A0A093H848_STRCA Loading...

Carbohydrate sulfotransferase

AlphaFold DB , UniProt , Accession A0A093H848, Species STRCA (Struthio camelus australis), Gene n/a, Length 419 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.8	Low	71.6	Confident	206 Å²	206	131.5 Å²	131.5	100%	1.015	66%	0.66	S	S	*	*				0	-7.7	0	-86.9	176.2	134	0	0	115.3
2	T	62.4	Low	73.2	Confident	116 Å²	116	127.5 Å²	127.5	71%	0.712	65%	0.647	S	S	*	*	H	α-helix	trans	-84.9	-35.5	-171.9	38.6	0	0	0	0	115.1	A4 R5 L6	T2-A4 PolarHBondContact O-N 2.91Å; T2-R5 PolarHBondContact O-N 3.15Å; T2-L6 PolarHBondContact O-N 2.64Å
3	K	62.9	Low	74.3	Confident	188 Å²	188	126.4 Å²	126.4	82%	0.817	64%	0.643	S	S	*	*	H	α-helix	trans	-65.5	-37.8	-178.7	-67.6	-174.5	178.3	-178.2	0	113.9	R5 L6 L7	K3-R5 VanDerWaalsContact C-N 3.35Å; K3-R5 PolarHBondContact O-N 3.07Å; K3-L6 PolarHBondContact O-N 3.01Å; K3-L7 PolarHBondContact O-N 3.22Å; K3-L7 VanDerWaalsContact O-N 3.12Å
4	A	66.4	Low	75.3	Confident	64 Å²	64	125.1 Å²	125.1	53%	0.529	64%	0.637	S	S	.	*	H	α-helix	trans	-68.8	-31.7	179.7	0	0	0	0	0	113	T2 R8	T2-A4 PolarHBondContact O-N 2.91Å; A4-R8 WeakPolarHBondContact O-CG 3.44Å; A4-R8 PolarHBondContact O-N 3.17Å
5	R	70.3	Confident	76.2	Confident	182 Å²	182	120.7 Å²	120.7	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-72.7	-38.1	175.4	-72.7	-175	177.7	-179.5	-0.4	111.7	T2 K3 R8 L9	T2-R5 PolarHBondContact O-N 3.15Å; K3-R5 VanDerWaalsContact C-N 3.35Å; K3-R5 PolarHBondContact O-N 3.07Å; R5-R8 PolarHBondContact O-N 3.25Å; R5-L9 PolarHBondContact O-N 3.25Å
6	L	72.3	Confident	77.1	Confident	123 Å²	123	118.7 Å²	118.7	64%	0.644	61%	0.611	S	S	*	*	H	α-helix	trans	-64.9	-40.2	176.7	-138.6	85.2	0	0	0	112.1	T2 K3 L9 S10	T2-L6 PolarHBondContact O-N 2.64Å; K3-L6 PolarHBondContact O-N 3.01Å; L6-L9 PolarHBondContact O-N 3.17Å; L6-S10 WeakPolarHBondContact O-CB 3.15Å; L6-S10 PolarHBondContact O-N 3.08Å; L6-S10 PolarHBondContact O-OG 3.49Å
7	L	75.5	Confident	77.9	Confident	125 Å²	125	119.2 Å²	119.2	65%	0.654	61%	0.608	S	S	*	*	H	α-helix	trans	-64.9	-42.9	176.8	-153.1	94.9	0	0	0	111.4	K3 S10 V11	K3-L7 PolarHBondContact O-N 3.22Å; K3-L7 VanDerWaalsContact O-N 3.12Å; L7-S10 PolarHBondContact O-N 3.31Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.14Å
8	R	75.8	Confident	78.5	Confident	194 Å²	194	118.4 Å²	118.4	73%	0.732	60%	0.603	S	S	*	*	H	α-helix	trans	-63.5	-43	176.7	-74.2	-178.2	-175.8	-165.8	1.4	112.4	A4 R5 S10 V11 V12	A4-R8 WeakPolarHBondContact O-CG 3.44Å; A4-R8 PolarHBondContact O-N 3.17Å; R5-R8 PolarHBondContact O-N 3.25Å; R8-S10 VanDerWaalsContact C-N 3.32Å; R8-S10 PolarHBondContact O-N 3.34Å; R8-V11 PolarHBondContact O-N 3.25Å; R8-V12 WeakPolarHBondContact O-CG2 3.5Å; R8-V12 PolarHBondContact O-N 3.41Å; R8-V12 VanDerWaalsContact O-N 3.1Å
9	L	81.1	Confident	79	Confident	109 Å²	109	117.4 Å²	117.4	57%	0.571	60%	0.598	S	S	*	*	H	α-helix	trans	-60.8	-41.5	174.7	-97.4	148.3	0	0	0	112.1	R5 L6 V12 L13	R5-L9 PolarHBondContact O-N 3.25Å; L6-L9 PolarHBondContact O-N 3.17Å; L9-V12 PolarHBondContact O-N 3.25Å; L9-L13 PolarHBondContact O-N 2.92Å
10	S	78	Confident	79	Confident	57 Å²	57	116.3 Å²	116.3	40%	0.399	59%	0.593	S	S	.	*	H	α-helix	trans	-65.5	-41.8	179.3	-55.6	0	0	0	0	112	L6 L7 R8 V12 L13 I14	L6-S10 WeakPolarHBondContact O-CB 3.15Å; L6-S10 PolarHBondContact O-N 3.08Å; L6-S10 PolarHBondContact O-OG 3.49Å; L7-S10 PolarHBondContact O-N 3.31Å; R8-S10 VanDerWaalsContact C-N 3.32Å; R8-S10 PolarHBondContact O-N 3.34Å; S10-V12 PolarHBondContact O-N 3.06Å; S10-L13 PolarHBondContact O-N 3.33Å; S10-I14 VanDerWaalsContact O-CG1 3.26Å; S10-I14 WeakPolarHBondContact O-CG1 3.31Å; S10-I14 PolarHBondContact O-N 3.15Å
11	V	87.6	Confident	78.9	Confident	83 Å²	83	114.8 Å²	114.8	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-39.4	176.8	172.5	0	0	0	0	111.6	L7 R8 S15	L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.14Å; R8-V11 PolarHBondContact O-N 3.25Å; V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.37Å; V11-S15 PolarHBondContact O-OG 2.94Å
12	V	90.3	Very high	79.9	Confident	83 Å²	83	109.5 Å²	109.5	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-65.6	-44.6	176.5	172.1	0	0	0	0	111	R8 L9 S10 S15 I16	R8-V12 WeakPolarHBondContact O-CG2 3.5Å; R8-V12 PolarHBondContact O-N 3.41Å; R8-V12 VanDerWaalsContact O-N 3.1Å; L9-V12 PolarHBondContact O-N 3.25Å; S10-V12 PolarHBondContact O-N 3.06Å; V12-S15 PolarHBondContact O-N 2.82Å; V12-I16 HydrophobicContact CG1-CD1 3.8Å; V12-I16 HydrophobicContact CG1-CG1 4.45Å; V12-I16 WeakPolarHBondContact O-CG1 3.22Å; V12-I16 PolarHBondContact O-N 2.71Å
13	L	87.3	Confident	80.3	Confident	113 Å²	113	108.5 Å²	108.5	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-61.8	-43.9	177.3	-86.9	155.2	0	0	0	112.4	L9 S10 S15 I16 F17	L9-L13 PolarHBondContact O-N 2.92Å; S10-L13 PolarHBondContact O-N 3.33Å; L13-S15 VanDerWaalsContact C-N 3.32Å; L13-S15 PolarHBondContact O-N 3.22Å; L13-I16 PolarHBondContact O-N 2.9Å; L13-F17 WeakPolarHBondContact O-CB 3.44Å; L13-F17 PolarHBondContact O-N 3.43Å
14	I	88.2	Confident	80.5	Confident	109 Å²	109	103.7 Å²	103.7	56%	0.559	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-40	176.2	-67.7	165.7	0	0	0	110.6	S10 F17 M18	S10-I14 VanDerWaalsContact O-CG1 3.26Å; S10-I14 WeakPolarHBondContact O-CG1 3.31Å; S10-I14 PolarHBondContact O-N 3.15Å; I14-F17 PolarHBondContact O-N 3.04Å; I14-M18 HydrophobicContact CG2-CG 4.39Å; I14-M18 WeakPolarHBondContact O-CB 3.39Å; I14-M18 VanDerWaalsContact O-CG 3.26Å; I14-M18 WeakPolarHBondContact O-CG 3.43Å; I14-M18 PolarHBondContact O-N 3.34Å
15	S	89.8	Confident	80.6	Confident	58 Å²	58	108.1 Å²	108.1	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-65.6	-43.9	178.6	-58.2	0	0	0	0	111.9	V11 V12 L13 F17 M18 I19	V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.37Å; V11-S15 PolarHBondContact O-OG 2.94Å; V12-S15 PolarHBondContact O-N 2.82Å; L13-S15 VanDerWaalsContact C-N 3.32Å; L13-S15 PolarHBondContact O-N 3.22Å; S15-F17 VanDerWaalsContact C-N 3.34Å; S15-F17 PolarHBondContact O-N 2.86Å; S15-M18 PolarHBondContact O-N 3.05Å; S15-I19 VanDerWaalsContact O-CG1 3.26Å; S15-I19 WeakPolarHBondContact O-CG1 3.48Å; S15-I19 PolarHBondContact O-N 3.43Å
16	I	89.8	Confident	79.6	Confident	89 Å²	89	107.3 Å²	107.3	46%	0.456	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-43	175.5	-68.6	168.5	0	0	0	110.4	V12 L13 M18 I19 L20	V12-I16 HydrophobicContact CG1-CD1 3.8Å; V12-I16 HydrophobicContact CG1-CG1 4.45Å; V12-I16 WeakPolarHBondContact O-CG1 3.22Å; V12-I16 PolarHBondContact O-N 2.71Å; L13-I16 PolarHBondContact O-N 2.9Å; I16-M18 PolarHBondContact O-N 3.47Å; I16-I19 PolarHBondContact O-N 3.18Å; I16-L20 HydrophobicContact CG2-CD1 4.06Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.16Å
17	F	90.6	Very high	78.4	Confident	127 Å²	127	108.1 Å²	108.1	56%	0.557	54%	0.543	S	S	*	.	H	α-helix	trans	-62.3	-42.6	177.2	-177.2	-103.2	0	0	0	112.3	L13 I14 S15 L20 L21	L13-F17 WeakPolarHBondContact O-CB 3.44Å; L13-F17 PolarHBondContact O-N 3.43Å; I14-F17 PolarHBondContact O-N 3.04Å; S15-F17 VanDerWaalsContact C-N 3.34Å; S15-F17 PolarHBondContact O-N 2.86Å; F17-L20 PolarHBondContact O-N 2.9Å; F17-L21 HydrophobicContact CD1-CD1 3.84Å; F17-L21 HydrophobicContact CD1-CG 4.47Å; F17-L21 HydrophobicContact CE1-CD1 3.38Å; F17-L21 HydrophobicContact CE1-CG 4.12Å; F17-L21 HydrophobicContact CZ-CD1 3.92Å; F17-L21 HydrophobicContact CZ-CG 4.27Å; F17-L21 PolarHBondContact O-N 3.22Å
18	M	89.7	Confident	77.1	Confident	106 Å²	106	107.5 Å²	107.5	52%	0.522	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-39.1	176.1	-70.4	-64	-111.9	0	0	112.2	I14 S15 I16 L21 I22	I14-M18 HydrophobicContact CG2-CG 4.39Å; I14-M18 WeakPolarHBondContact O-CB 3.39Å; I14-M18 VanDerWaalsContact O-CG 3.26Å; I14-M18 WeakPolarHBondContact O-CG 3.43Å; I14-M18 PolarHBondContact O-N 3.34Å; S15-M18 PolarHBondContact O-N 3.05Å; I16-M18 PolarHBondContact O-N 3.47Å; M18-L21 PolarHBondContact O-N 2.79Å; M18-L21 HydrophobicContact SD-CD1 4.2Å; M18-I22 VanDerWaalsContact O-CG1 3.24Å; M18-I22 WeakPolarHBondContact O-CG1 3.24Å; M18-I22 PolarHBondContact O-N 3.47Å
19	I	86.8	Confident	76	Confident	98 Å²	98	100.9 Å²	100.9	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-42.5	174.6	-69.3	165.7	0	0	0	110.6	S15 I16 L21 I22 I23	S15-I19 VanDerWaalsContact O-CG1 3.26Å; S15-I19 WeakPolarHBondContact O-CG1 3.48Å; S15-I19 PolarHBondContact O-N 3.43Å; I16-I19 PolarHBondContact O-N 3.18Å; I19-L21 PolarHBondContact O-N 3.05Å; I19-I22 PolarHBondContact O-N 3.22Å; I19-I23 HydrophobicContact CG2-CD1 3.77Å; I19-I23 HydrophobicContact CG2-CG1 4.39Å; I19-I23 VanDerWaalsContact O-CG1 3.28Å; I19-I23 WeakPolarHBondContact O-CG1 3.43Å; I19-I23 PolarHBondContact O-N 3.25Å
20	L	79.4	Confident	73.7	Confident	96 Å²	96	98.2 Å²	98.2	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-40	175.3	-73.5	169.4	0	0	0	111.9	I16 F17 I23 V24	I16-L20 HydrophobicContact CG2-CD1 4.06Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.16Å; F17-L20 PolarHBondContact O-N 2.9Å; L20-I23 PolarHBondContact O-N 3.47Å; L20-V24 WeakPolarHBondContact O-CB 3.03Å; L20-V24 VanDerWaalsContact O-CG2 3.28Å; L20-V24 WeakPolarHBondContact O-CG2 3.43Å; L20-V24 PolarHBondContact O-N 3.11Å
21	L	76.9	Confident	71.7	Confident	85 Å²	85	102 Å²	102	45%	0.445	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-40.1	173.5	-79.2	174.6	0	0	0	112.2	F17 M18 I19 V24 Y25	F17-L21 HydrophobicContact CD1-CD1 3.84Å; F17-L21 HydrophobicContact CD1-CG 4.47Å; F17-L21 HydrophobicContact CE1-CD1 3.38Å; F17-L21 HydrophobicContact CE1-CG 4.12Å; F17-L21 HydrophobicContact CZ-CD1 3.92Å; F17-L21 HydrophobicContact CZ-CG 4.27Å; F17-L21 PolarHBondContact O-N 3.22Å; M18-L21 PolarHBondContact O-N 2.79Å; M18-L21 HydrophobicContact SD-CD1 4.2Å; I19-L21 PolarHBondContact O-N 3.05Å; L21-V24 PolarHBondContact O-N 3.45Å; L21-Y25 WeakPolarHBondContact O-CB 3.5Å; L21-Y25 PolarHBondContact O-N 2.92Å
22	I	76.7	Confident	69.2	Low	95 Å²	95	100.9 Å²	100.9	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174.5	-69.3	165.5	0	0	0	109.7	M18 I19 Y25 W26	M18-I22 VanDerWaalsContact O-CG1 3.24Å; M18-I22 WeakPolarHBondContact O-CG1 3.24Å; M18-I22 PolarHBondContact O-N 3.47Å; I19-I22 PolarHBondContact O-N 3.22Å; I22-Y25 CarbonylContact O-C 3.6Å; I22-Y25 PolarHBondContact O-N 3.34Å; I22-W26 HydrophobicContact CG2-CG 4.5Å; I22-W26 VanDerWaalsContact O-CB 3.3Å; I22-W26 WeakPolarHBondContact O-CB 3.26Å; I22-W26 PolarHBondContact O-N 2.91Å
23	I	70.3	Confident	66.5	Low	95 Å²	95	105.8 Å²	105.8	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-63.4	-46.9	177.4	-67.8	165.8	0	0	0	110.5	I19 L20 Y25 W26 D27	I19-I23 HydrophobicContact CG2-CD1 3.77Å; I19-I23 HydrophobicContact CG2-CG1 4.39Å; I19-I23 VanDerWaalsContact O-CG1 3.28Å; I19-I23 WeakPolarHBondContact O-CG1 3.43Å; I19-I23 PolarHBondContact O-N 3.25Å; L20-I23 PolarHBondContact O-N 3.47Å; I23-Y25 VanDerWaalsContact C-N 3.28Å; I23-Y25 PolarHBondContact O-N 2.99Å; I23-W26 PolarHBondContact O-N 3.47Å; I23-W26 VanDerWaalsContact O-N 3.17Å; I23-D27 WeakPolarHBondContact O-CB 3.24Å; I23-D27 PolarHBondContact O-N 3.32Å
24	V	68.2	Low	63.9	Low	87 Å²	87	109.2 Å²	109.2	53%	0.527	57%	0.567	S	S	.	*	H	α-helix	trans	-62.5	-36	176.2	171.1	0	0	0	0	111.7	L20 L21 N28	L20-V24 WeakPolarHBondContact O-CB 3.03Å; L20-V24 VanDerWaalsContact O-CG2 3.28Å; L20-V24 WeakPolarHBondContact O-CG2 3.43Å; L20-V24 PolarHBondContact O-N 3.11Å; L21-V24 PolarHBondContact O-N 3.45Å; V24-N28 WeakPolarHBondContact O-CB 3.39Å; V24-N28 PolarHBondContact O-N 3.03Å; V24-N28 PolarHBondContact O-ND2 3.12Å
25	Y	68.9	Low	61.1	Low	156 Å²	156	113.6 Å²	113.6	61%	0.612	58%	0.579	S	S	*	*	H	α-helix	trans	-68	-42.7	174.3	-179.9	-95.7	0	0	0	111.5	L21 I22 I23 N28 V29	L21-Y25 WeakPolarHBondContact O-CB 3.5Å; L21-Y25 PolarHBondContact O-N 2.92Å; I22-Y25 CarbonylContact O-C 3.6Å; I22-Y25 PolarHBondContact O-N 3.34Å; I23-Y25 VanDerWaalsContact C-N 3.28Å; I23-Y25 PolarHBondContact O-N 2.99Å; Y25-N28 WeakPolarHBondContact O-CB 3.48Å; Y25-N28 PolarHBondContact O-N 3.34Å; Y25-V29 HydrophobicContact CD1-CG2 4.39Å; Y25-V29 HydrophobicContact CE1-CG2 4.16Å; Y25-V29 WeakPolarHBondContact O-CG2 3.44Å; Y25-V29 PolarHBondContact O-N 3.24Å
26	W	47.7	Very low	58.2	Low	165 Å²	165	117.5 Å²	117.5	63%	0.625	59%	0.594	S	S	*	*	H	α-helix	trans	-81.2	-30.4	-176.4	-83.6	82.5	0	0	0	114	I22 I23 N28 V29 G30	I22-W26 HydrophobicContact CG2-CG 4.5Å; I22-W26 VanDerWaalsContact O-CB 3.3Å; I22-W26 WeakPolarHBondContact O-CB 3.26Å; I22-W26 PolarHBondContact O-N 2.91Å; I23-W26 PolarHBondContact O-N 3.47Å; I23-W26 VanDerWaalsContact O-N 3.17Å; W26-N28 PolarHBondContact O-N 2.92Å; W26-V29 HydrophobicContact CE3-CG1 4.49Å; W26-V29 CarbonylContact O-C 3.6Å; W26-V29 WeakPolarHBondContact O-CA 3.14Å; W26-V29 PolarHBondContact O-N 2.98Å; W26-G30 PolarHBondContact O-N 3.37Å
27	D	48.8	Very low	55.4	Low	141 Å²	141	121.2 Å²	121.2	75%	0.754	61%	0.609	S	S	*	*	H	α-helix	trans	-65.3	-31.2	169.8	-156.5	43.5	0	0	0	110.1	I23 V29	I23-D27 WeakPolarHBondContact O-CB 3.24Å; I23-D27 PolarHBondContact O-N 3.32Å; D27-V29 VanDerWaalsContact C-N 3.28Å; D27-V29 PolarHBondContact O-N 3.14Å
28	N	48.2	Very low	52.5	Low	111 Å²	111	119.3 Å²	119.3	59%	0.594	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-6.8	166	-84.8	-58.6	0	0	0	114.6	V24 Y25 W26 R226	V24-N28 WeakPolarHBondContact O-CB 3.39Å; V24-N28 PolarHBondContact O-N 3.03Å; V24-N28 PolarHBondContact O-ND2 3.12Å; Y25-N28 WeakPolarHBondContact O-CB 3.48Å; Y25-N28 PolarHBondContact O-N 3.34Å; W26-N28 PolarHBondContact O-N 2.92Å; N28-R226 PolarHBondContact O-NH2 3.27Å
29	V	51	Low	49.5	Very low	56 Å²	56	119.5 Å²	119.5	34%	0.339	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116	0.1	-176.1	174.3	0	0	0	0	112.5	Y25 W26 D27 T31	Y25-V29 HydrophobicContact CD1-CG2 4.39Å; Y25-V29 HydrophobicContact CE1-CG2 4.16Å; Y25-V29 WeakPolarHBondContact O-CG2 3.44Å; Y25-V29 PolarHBondContact O-N 3.24Å; W26-V29 HydrophobicContact CE3-CG1 4.49Å; W26-V29 CarbonylContact O-C 3.6Å; W26-V29 WeakPolarHBondContact O-CA 3.14Å; W26-V29 PolarHBondContact O-N 2.98Å; D27-V29 VanDerWaalsContact C-N 3.28Å; D27-V29 PolarHBondContact O-N 3.14Å; V29-T31 PolarHBondContact O-N 2.93Å; V29-T31 VanDerWaalsContact O-N 3.09Å
30	G	33.3	Very low	46.7	Very low	52 Å²	52	124.3 Å²	124.3	54%	0.536	64%	0.637	S	S	.	*			trans	-58	109.2	-176.8	0	0	0	0	0	116.1	W26	W26-G30 PolarHBondContact O-N 3.37Å
31	T	36.1	Very low	44.2	Very low	137 Å²	137	124.6 Å²	124.6	84%	0.84	65%	0.647	S	S	*	*			trans	78.5	90.1	159.7	65.9	0	0	0	0	119.3	V29	V29-T31 PolarHBondContact O-N 2.93Å; V29-T31 VanDerWaalsContact O-N 3.09Å
32	A	34.9	Very low	41.9	Very low	60 Å²	60	131.5 Å²	131.5	50%	0.496	67%	0.668	S	S	.	*			trans	-151	116.7	143.5	0	0	0	0	0	109.6
33	H	34.5	Very low	39.6	Very low	186 Å²	186	133 Å²	133	86%	0.861	68%	0.683	S	S	*	*			trans	-58.2	133.9	169.4	-83.6	-91.9	0	0	0	110.3	Y35	H33-Y35 PolarHBondContact O-N 3.22Å
34	F	32.4	Very low	37.6	Very low	184 Å²	184	137.4 Å²	137.4	81%	0.807	70%	0.702	S	S	*	*			trans	-73.6	114.5	179	-69.2	-88.2	0	0	0	110.7
35	Y	29.7	Very low	35.6	Very low	202 Å²	202	138.9 Å²	138.9	79%	0.792	72%	0.716	S	S	*	*			trans	-124	99.4	151.8	-77.9	-80.8	0	0	0	107.7	H33 H37	H33-Y35 PolarHBondContact O-N 3.22Å; Y35-H37 PolarHBondContact O-N 3.43Å
36	L	29.5	Very low	34	Very low	139 Å²	139	137.6 Å²	137.6	73%	0.728	73%	0.727	S	S	*	*			trans	-87.1	98	168.7	-88.4	157.7	0	0	0	107.9
37	H	29.9	Very low	32.9	Very low	167 Å²	167	133.7 Å²	133.7	77%	0.773	74%	0.738	S	S	*	*			trans	-126	104.4	156	-74.4	-73.7	0	0	0	107.9	Y35	Y35-H37 PolarHBondContact O-N 3.43Å
38	T	30.2	Very low	31.8	Very low	87 Å²	87	131.5 Å²	131.5	53%	0.534	74%	0.739	S	S	.	*			trans	-108.7	101.6	164.5	49.6	0	0	0	0	107.6	F40	T38-F40 PolarHBondContact O-N 2.86Å
39	S	26.5	Very low	30.8	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	75%	0.752	S	S	*	*			trans	-78.7	109.8	162.9	-30.6	0	0	0	0	107	S41	S39-S41 PolarHBondContact O-N 3.12Å
40	F	28.4	Very low	29.9	Very low	198 Å²	198	137.5 Å²	137.5	87%	0.868	77%	0.774	S	S	*	*			trans	-76.6	105.7	167.8	-80.6	-86.1	0	0	0	108.5	T38 R42	T38-F40 PolarHBondContact O-N 2.86Å; F40-R42 PolarHBondContact O-N 3.22Å
41	S	27	Very low	29.4	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	78%	0.781	S	S	*	*			trans	-76.9	115.6	165.6	-57.8	0	0	0	0	108.9	S39	S39-S41 PolarHBondContact O-N 3.12Å
42	R	27.2	Very low	28.9	Very low	230 Å²	230	139.8 Å²	139.8	87%	0.868	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.4	145.7	173.9	-154.4	173.6	-167.6	176.5	3.2	109.6	F40	F40-R42 PolarHBondContact O-N 3.22Å
43	P	29.7	Very low	28.5	Very low	126 Å²	126	140.8 Å²	140.8	82%	0.818	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.9	135	175.1	-3.5	15.1	0	0	0	111
44	H	26.7	Very low	28.1	Very low	189 Å²	189	141.4 Å²	141.4	88%	0.875	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-88	128.2	169	-82.9	-60.2	0	0	0	111
45	S	26.1	Very low	27.7	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	80%	0.795	S	S	*	*			trans	-170	143.6	148.2	-81.9	0	0	0	0	107.3
46	P	36.5	Very low	27.6	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	80%	0.795	S	S	*	*				-148.4	164.9	55.9	37.7	-16.9	0	0	0	117.6
47	G	24.8	Very low	27.3	Very low	83 Å²	83	132.1 Å²	132.1	86%	0.856	80%	0.8	S	S	*	*			trans	-137.3	121.3	154.9	0	0	0	0	0	108.9
48	A	24.8	Very low	27.1	Very low	94 Å²	94	136 Å²	136	78%	0.777	81%	0.807	S	S	*	*			trans	-100.7	147.3	-169.7	0	0	0	0	0	112.8
49	I	27.1	Very low	26.9	Very low	170 Å²	170	141.3 Å²	141.3	87%	0.872	83%	0.827	S	S	*	*			trans	-155.4	164.2	140	-12.4	173.8	0	0	0	108.6
50	P	31.9	Very low	27	Very low	123 Å²	123	140.6 Å²	140.6	80%	0.799	83%	0.827	S	S	*	*				-122.7	163.2	-121.9	26.4	-2	0	0	0	116
51	G	23.9	Very low	27	Very low	66 Å²	66	139.5 Å²	139.5	68%	0.68	83%	0.83	S	S	*	*			trans	90.4	111.8	144.4	0	0	0	0	0	118
52	I	25.1	Very low	27.3	Very low	172 Å²	172	140.6 Å²	140.6	88%	0.882	83%	0.834	S	S	*	*				172.5	125.2	106.7	-82.9	159.5	0	0	0	110.3
53	A	25.7	Very low	27.8	Very low	81 Å²	81	136.1 Å²	136.1	67%	0.669	83%	0.827	S	S	*	*			trans	40.7	119.9	148.6	0	0	0	0	0	124
54	E	27.5	Very low	28.4	Very low	198 Å²	198	135 Å²	135	93%	0.925	82%	0.818	S	S	*	*				73.9	113	125.5	-66.2	-176.2	171.7	0	0	122.6
55	G	24.1	Very low	29	Very low	80 Å²	80	132.3 Å²	132.3	83%	0.825	81%	0.81	S	S	*	*				107.6	98.1	116.6	0	0	0	0	0	118.5
56	A	26.4	Very low	29.5	Very low	96 Å²	96	133.9 Å²	133.9	79%	0.793	80%	0.804	S	S	*	*			trans	178.3	122.8	134.7	0	0	0	0	0	111.7
57	D	23.6	Very low	29.5	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	80%	0.797	S	S	*	*			trans	-65.3	140.8	174.8	-76.2	-43.4	0	0	0	113.5
58	W	26.4	Very low	30.2	Very low	248 Å²	248	135.5 Å²	135.5	94%	0.939	78%	0.779	S	S	*	*			trans	-142.6	114.4	150.2	-75.2	101.2	0	0	0	109
59	E	25.7	Very low	30.8	Very low	200 Å²	200	134.2 Å²	134.2	94%	0.935	77%	0.768	S	S	*	*			trans	-62.8	132.4	176.7	-66.7	176.5	143.9	0	0	111.5
60	A	28.5	Very low	31.2	Very low	96 Å²	96	134 Å²	134	79%	0.793	76%	0.761	S	S	*	*			trans	-115.8	129.9	176.6	0	0	0	0	0	110.8
61	L	29.3	Very low	31.4	Very low	175 Å²	175	134.1 Å²	134.1	92%	0.916	75%	0.754	S	S	*	*			trans	-65.7	137.6	175.8	-77.6	116.7	0	0	0	112.4
62	P	33.3	Very low	32.1	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	76%	0.76	S	S	*	*			trans	-102.9	108.6	178.3	35.1	-24.8	0	0	0	111.6
63	D	36.7	Very low	32.4	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	75%	0.751	S	S	*	*			trans	-162.4	19.3	159	-153	13.3	0	0	0	115.6
64	V	42.6	Very low	32.6	Very low	103 Å²	103	135.6 Å²	135.6	62%	0.624	75%	0.752	S	S	*	*	S	Bend	trans	-108.7	-24.2	-178.3	-174.6	0	0	0	0	112.3	L68	V64-L68 HydrophobicContact CG1-CD1 4.43Å
65	D	39.5	Very low	32.7	Very low	133 Å²	133	131.7 Å²	131.7	71%	0.711	75%	0.746	S	S	*	*	H	α-helix	trans	-79.3	-24	-174.3	-69.4	-37	0	0	0	113.6	A69	D65-A69 PolarHBondContact O-N 2.96Å
66	E	36.1	Very low	32.7	Very low	149 Å²	149	136 Å²	136	70%	0.696	75%	0.749	S	S	*	*	H	α-helix	trans	-74	-30.2	178.5	-165.3	171.4	165	0	0	112.3
67	F	37	Very low	32.8	Very low	156 Å²	156	140.7 Å²	140.7	68%	0.684	75%	0.752	S	S	*	*	H	α-helix	trans	-75	-35.9	177.7	-173.3	-104.2	0	0	0	112.4	K70	F67-K70 PolarHBondContact O-N 3.46Å
68	L	38.6	Very low	32.8	Very low	92 Å²	92	141.5 Å²	141.5	48%	0.482	75%	0.751	S	S	.	*	H	α-helix	trans	-73.6	-31.8	-179.9	-70.8	171.5	0	0	0	112.7	V64 K70	V64-L68 HydrophobicContact CG1-CD1 4.43Å; L68-K70 VanDerWaalsContact C-N 3.28Å; L68-K70 PolarHBondContact O-N 3.46Å
69	A	38.1	Very low	32.7	Very low	66 Å²	66	136.9 Å²	136.9	55%	0.545	74%	0.744	S	S	.	*	H	α-helix	trans	-67.6	-28	175.8	0	0	0	0	0	113	D65	D65-A69 PolarHBondContact O-N 2.96Å
70	K	35.1	Very low	32.5	Very low	165 Å²	165	132.5 Å²	132.5	72%	0.717	74%	0.736	S	S	*	*	H	α-helix	trans	-81.9	-19.2	-176.5	-135.4	170.1	-172.8	168.9	0	114	F67 L68	F67-K70 PolarHBondContact O-N 3.46Å; L68-K70 VanDerWaalsContact C-N 3.28Å; L68-K70 PolarHBondContact O-N 3.46Å
71	L	35.9	Very low	32.2	Very low	127 Å²	127	133.9 Å²	133.9	67%	0.665	74%	0.74	S	S	*	*	H	α-helix	trans	-88	-21.1	179.3	-156.6	77	0	0	0	112.8
72	L	38.4	Very low	31.8	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	74%	0.737	S	S	*	*	S	Bend	trans	-92.4	-5.5	-172	-70.6	169.8	0	0	0	114.6
73	S	31.4	Very low	31.3	Very low	101 Å²	101	133.3 Å²	133.3	71%	0.706	74%	0.738	S	S	*	*	S	Bend	trans	-100.2	4.9	-175	55	0	0	0	0	115.1
74	S	30.9	Very low	30.7	Very low	97 Å²	97	136 Å²	136	68%	0.678	74%	0.744	S	S	*	*	S	Bend	trans	-123.5	51.4	-174.2	60.9	0	0	0	0	114.5
75	S	29.3	Very low	29.7	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	75%	0.752	S	S	*	*			trans	-160.9	83.3	157.4	-148.5	0	0	0	0	113
76	L	24.8	Very low	28.8	Very low	170 Å²	170	140.5 Å²	140.5	89%	0.89	76%	0.761	S	S	*	*			trans	-139.1	112.2	163.2	-81.9	171	0	0	0	108.4
77	K	26.7	Very low	28.1	Very low	196 Å²	196	140.7 Å²	140.7	85%	0.852	76%	0.762	S	S	*	*			trans	-171.9	108.6	145.3	-103.9	167.9	-172.3	-174.1	0	111.4
78	Q	24.5	Very low	27.4	Very low	171 Å²	171	141.3 Å²	141.3	80%	0.799	77%	0.767	S	S	*	*			trans	39.8	127.1	135.7	-74.6	-177.2	-24.4	0	0	121
79	N	24.1	Very low	26.9	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	78%	0.78	S	S	*	*				-176	150.7	89.6	-103.3	-21.9	0	0	0	114.2
80	S	22	Very low	26	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	79%	0.793	S	S	*	*			trans	-87.2	149.7	179.1	52	0	0	0	0	113.9
81	S	22.4	Very low	25.4	Very low	125 Å²	125	147 Å²	147	87%	0.874	80%	0.802	S	S	*	*			trans	-164.5	151.3	137.8	63.9	0	0	0	0	113.2
82	I	21.2	Very low	24.7	Very low	166 Å²	166	150.1 Å²	150.1	85%	0.851	81%	0.813	S	S	*	*			trans	-100.9	141.4	-172.9	-71.4	160.7	0	0	0	109.5
83	S	22.9	Very low	23.9	Very low	120 Å²	120	146.5 Å²	146.5	84%	0.839	81%	0.812	S	S	*	*			trans	-169.1	166.2	138.9	-148.7	0	0	0	0	113.9
84	K	23.4	Very low	23.4	Very low	194 Å²	194	147.8 Å²	147.8	84%	0.843	82%	0.821	S	S	*	*			trans	-94.3	158.6	-148	-72.5	164.5	168	173.6	0	117.4
85	K	20.8	Very low	23.1	Very low	182 Å²	182	148.1 Å²	148.1	79%	0.791	82%	0.823	S	S	*	*			trans	-15.3	150.2	155.2	-76.5	-178.2	168.3	-168.3	0	119.9
86	T	21.4	Very low	23	Very low	147 Å²	147	152 Å²	152	90%	0.902	83%	0.825	S	S	*	*				-160.7	147	126.8	-55.1	0	0	0	0	111
87	E	21.2	Very low	23.2	Very low	154 Å²	154	149.5 Å²	149.5	72%	0.72	82%	0.82	S	S	*	*			trans	-98.3	145.9	-171.7	-73.5	163.7	143.5	0	0	115.3
88	Q	21.5	Very low	23.1	Very low	168 Å²	168	144.6 Å²	144.6	79%	0.785	82%	0.815	S	S	*	*			trans	57.4	167.7	137.3	-73.7	-171.3	-2.8	0	0	122.3
89	P	28.1	Very low	23.1	Very low	117 Å²	117	141 Å²	141	76%	0.76	82%	0.815	S	S	*	*			cis	-139.3	-178.8	9.9	27.6	-1	0	0	0	119.2
90	L	20.2	Very low	23.2	Very low	154 Å²	154	139.8 Å²	139.8	81%	0.806	82%	0.818	S	S	*	*			trans	-46.4	160.1	174	-69.5	133.8	0	0	0	120.3
91	L	22.7	Very low	23.5	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	81%	0.81	S	S	*	*			trans	-152.2	131.1	145.8	-100.5	159.5	0	0	0	113.1
92	Q	21.2	Very low	23.7	Very low	192 Å²	192	141.8 Å²	141.8	90%	0.897	81%	0.81	S	S	*	*			trans	-63.9	166.5	165.7	-69.4	157.1	-34.7	0	0	110.8
93	G	20.7	Very low	24.2	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	79%	0.793	S	S	*	*			cis	155.6	144.2	8.4	0	0	0	0	0	106.7
94	S	21.7	Very low	24.4	Very low	128 Å²	128	140.2 Å²	140.2	90%	0.895	79%	0.786	S	S	*	*			trans	-166.6	154.6	163.1	-166.2	0	0	0	0	112.8
95	S	24.2	Very low	24.6	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	78%	0.78	S	S	*	*			trans	-122.3	134.5	-150.2	49.2	0	0	0	0	114.9
96	K	26.9	Very low	25.5	Very low	195 Å²	195	132.9 Å²	132.9	85%	0.848	77%	0.767	S	S	*	*			trans	50.7	158.2	143.6	-88.9	-174.7	-177.2	-176.8	0	120.8
97	P	29.6	Very low	26.2	Very low	119 Å²	119	137 Å²	137	77%	0.773	77%	0.766	S	S	*	*			cis	-133.4	142.4	43.3	30.8	-8.3	0	0	0	116.1
98	A	24.2	Very low	27.2	Very low	92 Å²	92	132.5 Å²	132.5	76%	0.76	76%	0.761	S	S	*	*				63.6	94.9	84.7	0	0	0	0	0	115.6
99	A	25.1	Very low	28.3	Very low	95 Å²	95	129.4 Å²	129.4	79%	0.785	74%	0.743	S	S	*	*			trans	-127.2	140.7	163.2	0	0	0	0	0	109.4
100	S	25.5	Very low	29.2	Very low	125 Å²	125	128.8 Å²	128.8	87%	0.874	73%	0.733	S	S	*	*			trans	-54.5	129.1	-160.5	52.3	0	0	0	0	117.1
101	N	27.7	Very low	30.7	Very low	112 Å²	112	125.3 Å²	125.3	60%	0.599	71%	0.709	S	S	*	*			trans	-84.3	121.1	176.1	-72.6	-18.8	0	0	0	112	E103	N101-E103 HydrophobicContact CB-CB 4.24Å; N101-E103 HydrophobicContact CB-CG 3.71Å; N101-E103 VanDerWaalsContact CG-OE1 3.3Å; N101-E103 PolarHBondContact ND2-OE1 3.16Å; N101-E103 PolarHBondContact ND2-OE2 3.31Å
102	L	28.4	Very low	31.9	Very low	164 Å²	164	121.2 Å²	121.2	86%	0.859	70%	0.695	S	S	*	*			trans	-100.1	81	143.4	-163.5	74.7	0	0	0	105.6	N375	L102-N375 PolarHBondContact O-ND2 2.69Å
103	E	30	Very low	33.4	Very low	106 Å²	106	116.9 Å²	116.9	50%	0.495	68%	0.681	S	S	.	*			trans	-86	108.5	178	-86.2	166.4	164.4	0	0	108.4	N101 N105	N101-E103 HydrophobicContact CB-CB 4.24Å; N101-E103 HydrophobicContact CB-CG 3.71Å; N101-E103 VanDerWaalsContact CG-OE1 3.3Å; N101-E103 PolarHBondContact ND2-OE1 3.16Å; N101-E103 PolarHBondContact ND2-OE2 3.31Å; E103-N105 PolarHBondContact O-N 3.21Å
104	E	28.2	Very low	35.1	Very low	148 Å²	148	123.1 Å²	123.1	69%	0.692	68%	0.682	S	S	*	*			trans	-80.4	93.8	158.3	-164.1	173.8	-166	0	0	106.6	V106	E104-V106 VanDerWaalsContact C-N 3.34Å; E104-V106 PolarHBondContact O-N 3.37Å
105	N	26.4	Very low	37.1	Very low	136 Å²	136	121.4 Å²	121.4	73%	0.727	66%	0.662	S	S	*	*			trans	-65.9	91.1	176	-81.7	-42.8	0	0	0	109.7	E103 R107	E103-N105 PolarHBondContact O-N 3.21Å; N105-R107 PolarHBondContact O-N 2.94Å; N105-R107 VanDerWaalsContact O-N 3.16Å
106	V	39.7	Very low	38.9	Very low	85 Å²	85	120 Å²	120	52%	0.515	66%	0.657	S	S	.	*			trans	-71.7	106.7	167.6	-178.1	0	0	0	0	107.5	E104 G108	E104-V106 VanDerWaalsContact C-N 3.34Å; E104-V106 PolarHBondContact O-N 3.37Å; V106-G108 PolarHBondContact O-N 3.43Å
107	R	37.1	Very low	40.7	Very low	234 Å²	234	120 Å²	120	88%	0.883	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-48.4	125.5	170	-97.6	-178.2	-176.9	-170	1.1	108.6	N105 Y109	N105-R107 PolarHBondContact O-N 2.94Å; N105-R107 VanDerWaalsContact O-N 3.16Å; R107-Y109 PolarHBondContact O-N 3.39Å
108	G	42.3	Very low	42.8	Very low	59 Å²	59	116.2 Å²	116.2	61%	0.608	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-53.4	127.5	168.4	0	0	0	0	0	109.2	V106 D110	V106-G108 PolarHBondContact O-N 3.43Å; G108-D110 PolarHBondContact O-N 3.26Å
109	Y	44.9	Very low	45.2	Very low	104 Å²	104	113.7 Å²	113.7	41%	0.408	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-55.1	134.3	176.1	-161.5	-90.7	0	0	0	109	R107 W111 D351 E352	R107-Y109 PolarHBondContact O-N 3.39Å; Y109-W111 PolarHBondContact O-N 2.79Å; Y109-W111 PolarHBondContact O-NE1 3.33Å; Y109-D351 HydrophobicContact CG-CB 4.42Å; Y109-E352 HydrophobicContact CE2-CG 4.25Å; Y109-E352 WeakPolarHBondContact CE2-OE1 3.43Å
110	D	47.5	Very low	47.7	Very low	103 Å²	103	113.7 Å²	113.7	55%	0.551	59%	0.594	S	S	*	*			trans	-78.9	103.2	175.2	-175.4	-0.2	0	0	0	108.9	G108 S112	G108-D110 PolarHBondContact O-N 3.26Å; D110-S112 PolarHBondContact O-N 3.3Å; D110-S112 VanDerWaalsContact O-N 3.17Å; D110-S112 WeakPolarHBondContact OD1-CB 3.36Å; D110-S112 PolarHBondContact OD1-N 3.48Å; D110-S112 PolarHBondContact OD1-OG 3Å; D110-S112 PolarHBondContact OD2-OG 3.29Å; D110-S112 VanDerWaalsContact OD2-OG 3.07Å
111	W	50.3	Low	50.7	Low	82 Å²	82	112.2 Å²	112.2	31%	0.311	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	1.1	-179.3	-55.6	84.3	0	0	0	113.5	Y109 D351 A354 A355 F369	Y109-W111 PolarHBondContact O-N 2.79Å; Y109-W111 PolarHBondContact O-NE1 3.33Å; W111-D351 WeakPolarHBondContact CH2-O 3.21Å; W111-D351 HydrophobicContact CZ2-CB 4.39Å; W111-A354 HydrophobicContact CH2-CB 4.2Å; W111-A355 HydrophobicContact CE3-CB 3.6Å; W111-A355 HydrophobicContact CH2-CB 4.03Å; W111-A355 HydrophobicContact CZ3-CB 3.14Å; W111-F369 HydrophobicContact CH2-CB 4.17Å
112	S	49.1	Very low	53.6	Low	86 Å²	86	108.3 Å²	108.3	60%	0.601	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-17.3	-171.2	71.1	0	0	0	0	114.9	D110	D110-S112 PolarHBondContact O-N 3.3Å; D110-S112 VanDerWaalsContact O-N 3.17Å; D110-S112 WeakPolarHBondContact OD1-CB 3.36Å; D110-S112 PolarHBondContact OD1-N 3.48Å; D110-S112 PolarHBondContact OD1-OG 3Å; D110-S112 PolarHBondContact OD2-OG 3.29Å; D110-S112 VanDerWaalsContact OD2-OG 3.07Å
113	T	51.6	Low	56.6	Low	101 Å²	101	105.1 Å²	105.1	62%	0.62	54%	0.535	S	S	*	.			trans	-99.2	106.3	-178.2	47.2	0	0	0	0	112.4	D115	T113-D115 PolarHBondContact O-N 3.43Å; T113-D115 VanDerWaalsContact O-N 3.15Å
114	R	57.4	Low	59.7	Low	207 Å²	207	106.7 Å²	106.7	78%	0.781	54%	0.54	S	S	*	.			trans	-72.2	95.3	167.1	-70.7	176.4	168.9	-170.7	-9.5	109.6
115	D	63.9	Low	62.9	Low	91 Å²	91	102.5 Å²	102.5	49%	0.487	52%	0.522	S	S	.	.			trans	-97.2	112.8	170.2	-171.8	-6.1	0	0	0	110.4	T113 R117 A118 S119	T113-D115 PolarHBondContact O-N 3.43Å; T113-D115 VanDerWaalsContact O-N 3.15Å; D115-R117 PolarHBondContact O-N 3.36Å; D115-R117 WeakPolarHBondContact OD1-CB 3.21Å; D115-R117 PolarHBondContact OD1-N 3.49Å; D115-A118 HydrophobicContact CB-CB 3.87Å; D115-A118 WeakPolarHBondContact O-CB 3.21Å; D115-A118 PolarHBondContact O-N 2.67Å; D115-S119 PolarHBondContact O-N 2.94Å; D115-S119 VanDerWaalsContact O-N 3.14Å
116	A	61.6	Low	66.3	Low	76 Å²	76	96.4 Å²	96.4	63%	0.628	49%	0.489	S	S	*	.	H	α-helix	trans	-62.7	-28.9	177.8	0	0	0	0	0	112.6	S119 L120	A116-S119 PolarHBondContact O-N 3.01Å; A116-L120 PolarHBondContact O-N 3.27Å
117	R	64	Low	69	Low	196 Å²	196	96 Å²	96	74%	0.74	49%	0.487	S	S	*	.	H	α-helix	trans	-70.1	-44.3	174.9	-69.3	-178.4	179.7	169.6	0.6	111	D115 S119 L120 D121	D115-R117 PolarHBondContact O-N 3.36Å; D115-R117 WeakPolarHBondContact OD1-CB 3.21Å; D115-R117 PolarHBondContact OD1-N 3.49Å; R117-S119 PolarHBondContact O-N 3.49Å; R117-L120 PolarHBondContact O-N 2.96Å; R117-D121 PolarHBondContact O-N 2.95Å; R117-D121 VanDerWaalsContact O-N 3.08Å
118	A	73.1	Confident	71.9	Confident	39 Å²	39	89 Å²	89	32%	0.322	46%	0.464	S	S	.	.	H	α-helix	trans	-57.9	-39	174.7	0	0	0	0	0	111.6	D115 D121 Q122	D115-A118 HydrophobicContact CB-CB 3.87Å; D115-A118 WeakPolarHBondContact O-CB 3.21Å; D115-A118 PolarHBondContact O-N 2.67Å; A118-D121 PolarHBondContact O-N 3.3Å; A118-Q122 VanDerWaalsContact O-CG 3.24Å; A118-Q122 WeakPolarHBondContact O-CG 3.46Å; A118-Q122 PolarHBondContact O-N 3.21Å
119	S	74.8	Confident	74.6	Confident	38 Å²	38	87.4 Å²	87.4	27%	0.266	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-45.4	175.6	-167.2	0	0	0	0	113.1	D115 A116 R117 D121 Q122 E123	D115-S119 PolarHBondContact O-N 2.94Å; D115-S119 VanDerWaalsContact O-N 3.14Å; A116-S119 PolarHBondContact O-N 3.01Å; R117-S119 PolarHBondContact O-N 3.49Å; S119-D121 VanDerWaalsContact C-N 3.33Å; S119-D121 PolarHBondContact O-N 3.11Å; S119-Q122 PolarHBondContact O-N 2.88Å; S119-E123 PolarHBondContact O-N 2.79Å
120	L	79.1	Confident	77.1	Confident	96 Å²	96	84 Å²	84	50%	0.503	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-36.4	179.4	-73.8	169.6	0	0	0	112.5	A116 R117 K124	A116-L120 PolarHBondContact O-N 3.27Å; R117-L120 PolarHBondContact O-N 2.96Å; L120-K124 WeakPolarHBondContact O-CG 3.39Å; L120-K124 PolarHBondContact O-N 3.27Å
121	D	87.1	Confident	79.5	Confident	93 Å²	93	84.9 Å²	84.9	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-71.3	-35.9	177.7	-68.7	-23.9	0	0	0	111.6	R117 A118 S119 K124 L125	R117-D121 PolarHBondContact O-N 2.95Å; R117-D121 VanDerWaalsContact O-N 3.08Å; A118-D121 PolarHBondContact O-N 3.3Å; S119-D121 VanDerWaalsContact C-N 3.33Å; S119-D121 PolarHBondContact O-N 3.11Å; D121-K124 PolarHBondContact O-N 3.38Å; D121-K124 IonicContact OD1-NZ 2.77Å; D121-L125 WeakPolarHBondContact O-CB 3.36Å; D121-L125 PolarHBondContact O-N 2.8Å
122	Q	89.4	Confident	81.8	Confident	31 Å²	31	82.1 Å²	82.1	15%	0.145	42%	0.415	C	S	.	.	H	α-helix	trans	-65.5	-41.1	173.3	-70.1	-61.2	-37.8	0	0	112.4	A118 S119 L125 Q126 H356	A118-Q122 VanDerWaalsContact O-CG 3.24Å; A118-Q122 WeakPolarHBondContact O-CG 3.46Å; A118-Q122 PolarHBondContact O-N 3.21Å; S119-Q122 PolarHBondContact O-N 2.88Å; Q122-L125 PolarHBondContact O-N 3.25Å; Q122-Q126 WeakPolarHBondContact O-CG 3.36Å; Q122-Q126 PolarHBondContact O-N 3.19Å; Q122-H356 HydrophobicContact CB-CB 4.25Å; Q122-H356 HydrophobicContact CG-CB 4.38Å
123	E	91.8	Very high	84.1	Confident	97 Å²	97	78.3 Å²	78.3	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-46.3	175.9	-75.6	175.5	-165.8	0	0	111.9	S119 L125 Q126 V127	S119-E123 PolarHBondContact O-N 2.79Å; E123-L125 VanDerWaalsContact C-N 3.32Å; E123-L125 PolarHBondContact O-N 3.01Å; E123-Q126 PolarHBondContact O-N 2.95Å; E123-V127 WeakPolarHBondContact O-CG2 3.4Å; E123-V127 PolarHBondContact O-N 3.25Å
124	K	94.6	Very high	86.3	Confident	138 Å²	138	79.7 Å²	79.7	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-60	-43.1	175.8	-71.6	172.2	-172.1	166.1	0	111.7	L120 D121 Q126 V127 E128	L120-K124 WeakPolarHBondContact O-CG 3.39Å; L120-K124 PolarHBondContact O-N 3.27Å; D121-K124 PolarHBondContact O-N 3.38Å; D121-K124 IonicContact OD1-NZ 2.77Å; K124-Q126 VanDerWaalsContact C-N 3.34Å; K124-Q126 PolarHBondContact O-N 2.91Å; K124-V127 PolarHBondContact O-N 3.01Å; K124-E128 PolarHBondContact O-N 3.01Å
125	L	95.4	Very high	88.2	Confident	61 Å²	61	75.1 Å²	75.1	32%	0.319	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-41.6	178.3	-178.2	61.5	0	0	0	111.7	D121 Q122 E123 E128 R129	D121-L125 WeakPolarHBondContact O-CB 3.36Å; D121-L125 PolarHBondContact O-N 2.8Å; Q122-L125 PolarHBondContact O-N 3.25Å; E123-L125 VanDerWaalsContact C-N 3.32Å; E123-L125 PolarHBondContact O-N 3.01Å; L125-E128 PolarHBondContact O-N 3.08Å; L125-R129 WeakPolarHBondContact O-CG 3.42Å; L125-R129 PolarHBondContact O-N 3.45Å
126	Q	97.2	Very high	89.8	Confident	7 Å²	7	73.9 Å²	73.9	3%	0.033	36%	0.36	C	S	.	.	H	α-helix	trans	-67.5	-41	176.8	-71.7	-61	-37	0	0	112.2	Q122 E123 K124 E128 R129 Q130 F343 I344 D353	Q122-Q126 WeakPolarHBondContact O-CG 3.36Å; Q122-Q126 PolarHBondContact O-N 3.19Å; E123-Q126 PolarHBondContact O-N 2.95Å; K124-Q126 VanDerWaalsContact C-N 3.34Å; K124-Q126 PolarHBondContact O-N 2.91Å; Q126-E128 VanDerWaalsContact C-N 3.29Å; Q126-E128 PolarHBondContact O-N 3.23Å; Q126-R129 VanDerWaalsContact NE2-NH1 3.19Å; Q126-R129 PolarHBondContact O-N 3.44Å; Q126-Q130 WeakPolarHBondContact O-CB 3.27Å; Q126-Q130 VanDerWaalsContact O-CG 3.3Å; Q126-Q130 WeakPolarHBondContact O-CG 3.24Å; Q126-Q130 PolarHBondContact O-N 2.88Å; Q126-F343 VanDerWaalsContact CD-CE2 3.43Å; Q126-F343 HydrophobicContact CG-CD2 3.92Å; Q126-F343 HydrophobicContact CG-CE2 3.7Å; Q126-F343 HydrophobicContact CG-CZ 4.37Å; Q126-F343 VanDerWaalsContact NE2-CZ 3.32Å; Q126-I344 PolarHBondContact NE2-O 2.79Å; Q126-I344 PolarHBondContact OE1-O 3.02Å; Q126-D353 PolarHBondContact NE2-OD1 3.4Å
127	V	97	Very high	91.6	Very high	78 Å²	78	71.4 Å²	71.4	47%	0.473	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-43.9	173.7	169.2	0	0	0	0	110.9	E123 K124 Q130 R131	E123-V127 WeakPolarHBondContact O-CG2 3.4Å; E123-V127 PolarHBondContact O-N 3.25Å; K124-V127 PolarHBondContact O-N 3.01Å; V127-Q130 PolarHBondContact O-N 3.06Å; V127-R131 VanDerWaalsContact O-CB 3.29Å; V127-R131 WeakPolarHBondContact O-CB 3.38Å; V127-R131 PolarHBondContact O-N 3.47Å
128	E	97.9	Very high	93.1	Very high	87 Å²	87	66 Å²	66	41%	0.407	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-46.5	178.5	-173.9	62.1	-171.6	0	0	111.9	K124 L125 Q126 Q130 R131 T132	K124-E128 PolarHBondContact O-N 3.01Å; L125-E128 PolarHBondContact O-N 3.08Å; Q126-E128 VanDerWaalsContact C-N 3.29Å; Q126-E128 PolarHBondContact O-N 3.23Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; E128-Q130 PolarHBondContact O-N 2.95Å; E128-R131 WeakPolarHBondContact O-CB 3.33Å; E128-R131 PolarHBondContact O-N 3.17Å; E128-R131 VanDerWaalsContact O-N 3.16Å; E128-R131 IonicContact OE2-CZ 2.79Å; E128-R131 IonicContact OE2-NH1 3.32Å; E128-R131 PolarHBondContact OE2-NH1 3.07Å; E128-T132 PolarHBondContact O-N 3.06Å; E128-T132 PolarHBondContact O-OG1 3.11Å; E128-T132 VanDerWaalsContact O-OG1 3.07Å
129	R	98.2	Very high	94.2	Very high	24 Å²	24	67.2 Å²	67.2	9%	0.091	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-43.4	177.5	-70.9	173.4	-179.5	179.2	1.5	112.2	L125 Q126 L133 I344 T349 D353	L125-R129 WeakPolarHBondContact O-CG 3.42Å; L125-R129 PolarHBondContact O-N 3.45Å; Q126-R129 VanDerWaalsContact NE2-NH1 3.19Å; Q126-R129 PolarHBondContact O-N 3.44Å; R129-L133 PolarHBondContact O-N 3.13Å; R129-L133 VanDerWaalsContact O-N 3.17Å; R129-I344 HydrophobicContact CB-CB 4.21Å; R129-I344 HydrophobicContact CB-CD1 4.36Å; R129-I344 WeakPolarHBondContact CD-O 3.4Å; R129-I344 PolarHBondContact NH1-O 3.36Å; R129-T349 PolarHBondContact NH2-OG1 3.31Å; R129-D353 IonicContact CZ-OD1 2.69Å; R129-D353 IonicContact CZ-OD2 3.89Å; R129-D353 VanDerWaalsContact NH1-CG 3.26Å; R129-D353 IonicContact NH1-OD1 3.73Å; R129-D353 PolarHBondContact NH1-OD1 2.98Å; R129-D353 IonicContact NH1-OD2 3.39Å; R129-D353 PolarHBondContact NH1-OD2 3.27Å; R129-D353 IonicContact NH2-OD1 3.72Å; R129-D353 IonicContact NH2-OD2 3.29Å
130	Q	98.3	Very high	95	Very high	34 Å²	34	70 Å²	70	16%	0.159	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-40.9	176.6	-70	172.5	36.1	0	0	111.9	Q126 V127 E128 L133 R134 D342	Q126-Q130 WeakPolarHBondContact O-CB 3.27Å; Q126-Q130 VanDerWaalsContact O-CG 3.3Å; Q126-Q130 WeakPolarHBondContact O-CG 3.24Å; Q126-Q130 PolarHBondContact O-N 2.88Å; V127-Q130 PolarHBondContact O-N 3.06Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; E128-Q130 PolarHBondContact O-N 2.95Å; Q130-L133 PolarHBondContact O-N 3.08Å; Q130-R134 WeakPolarHBondContact O-CG 3.23Å; Q130-R134 PolarHBondContact O-N 3.42Å; Q130-D342 PolarHBondContact NE2-O 2.67Å
131	R	98	Very high	95.8	Very high	120 Å²	120	70.4 Å²	70.4	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-59.8	-53.2	176.2	178.7	-171.5	-64.7	155.1	-6.7	110.6	V127 E128 L133 R134 E135	V127-R131 VanDerWaalsContact O-CB 3.29Å; V127-R131 WeakPolarHBondContact O-CB 3.38Å; V127-R131 PolarHBondContact O-N 3.47Å; E128-R131 WeakPolarHBondContact O-CB 3.33Å; E128-R131 PolarHBondContact O-N 3.17Å; E128-R131 VanDerWaalsContact O-N 3.16Å; E128-R131 IonicContact OE2-CZ 2.79Å; E128-R131 IonicContact OE2-NH1 3.32Å; E128-R131 PolarHBondContact OE2-NH1 3.07Å; R131-L133 VanDerWaalsContact C-N 3.28Å; R131-L133 PolarHBondContact O-N 2.97Å; R131-R134 PolarHBondContact O-N 3.31Å; R131-R134 VanDerWaalsContact O-N 3.14Å; R131-E135 WeakPolarHBondContact CD-OE1 3.15Å; R131-E135 HydrophobicContact CG-CG 4.18Å; R131-E135 WeakPolarHBondContact CG-OE1 3.15Å; R131-E135 WeakPolarHBondContact O-CB 3.09Å; R131-E135 WeakPolarHBondContact O-CG 3.41Å; R131-E135 PolarHBondContact O-N 3.19Å
132	T	98.2	Very high	96.1	Very high	24 Å²	24	67.3 Å²	67.3	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-53.1	-47.6	178.3	-56.4	0	0	0	0	111.2	E128 R134 E135 F136	E128-T132 PolarHBondContact O-N 3.06Å; E128-T132 PolarHBondContact O-OG1 3.11Å; E128-T132 VanDerWaalsContact O-OG1 3.07Å; T132-R134 PolarHBondContact O-N 3.36Å; T132-E135 PolarHBondContact O-N 3.31Å; T132-F136 HydrophobicContact CG2-CD2 3.86Å; T132-F136 HydrophobicContact CG2-CE2 3.98Å; T132-F136 WeakPolarHBondContact O-CD2 3.42Å; T132-F136 PolarHBondContact O-N 3.37Å; T132-F136 VanDerWaalsContact O-N 3.1Å
133	L	98.3	Very high	96.4	Very high	7 Å²	7	71.2 Å²	71.2	4%	0.037	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-49.5	179.1	175.2	62.2	0	0	0	111.7	R129 Q130 R131 E135 F136 C137 P336 I344 L407	R129-L133 PolarHBondContact O-N 3.13Å; R129-L133 VanDerWaalsContact O-N 3.17Å; Q130-L133 PolarHBondContact O-N 3.08Å; R131-L133 VanDerWaalsContact C-N 3.28Å; R131-L133 PolarHBondContact O-N 2.97Å; L133-E135 PolarHBondContact O-N 2.8Å; L133-F136 PolarHBondContact O-N 3.18Å; L133-C137 WeakPolarHBondContact O-CB 3.34Å; L133-C137 PolarHBondContact O-N 3.49Å; L133-C137 PolarHBondContact O-SG 2.84Å; L133-P336 HydrophobicContact CD1-CB 3.76Å; L133-P336 HydrophobicContact CD1-CG 4.19Å; L133-P336 HydrophobicContact CD2-CB 3.94Å; L133-P336 HydrophobicContact CG-CB 4.44Å; L133-I344 HydrophobicContact CB-CD1 4.1Å; L133-I344 HydrophobicContact CD2-CD1 3.71Å; L133-L407 HydrophobicContact CD1-CB 3.85Å; L133-L407 HydrophobicContact CD1-CD2 3.82Å; L133-L407 HydrophobicContact CD1-CG 4.33Å
134	R	97.7	Very high	96.6	Very high	130 Å²	130	67.9 Å²	67.9	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-42.1	-179.5	-72.5	177.6	-172.7	161	10	112	Q130 R131 T132 C137 A138	Q130-R134 WeakPolarHBondContact O-CG 3.23Å; Q130-R134 PolarHBondContact O-N 3.42Å; R131-R134 PolarHBondContact O-N 3.31Å; R131-R134 VanDerWaalsContact O-N 3.14Å; T132-R134 PolarHBondContact O-N 3.36Å; R134-C137 PolarHBondContact O-N 3.09Å; R134-A138 WeakPolarHBondContact O-CB 3.39Å; R134-A138 PolarHBondContact O-N 3.28Å
135	E	97.6	Very high	96.5	Very high	110 Å²	110	64.7 Å²	64.7	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-47.7	178.4	-75.8	175.3	177.6	0	0	111.6	R131 T132 L133 A138 N139	R131-E135 WeakPolarHBondContact CD-OE1 3.15Å; R131-E135 HydrophobicContact CG-CG 4.18Å; R131-E135 WeakPolarHBondContact CG-OE1 3.15Å; R131-E135 WeakPolarHBondContact O-CB 3.09Å; R131-E135 WeakPolarHBondContact O-CG 3.41Å; R131-E135 PolarHBondContact O-N 3.19Å; T132-E135 PolarHBondContact O-N 3.31Å; L133-E135 PolarHBondContact O-N 2.8Å; E135-A138 PolarHBondContact O-N 3.5Å; E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 PolarHBondContact O-N 3.45Å
136	F	97.6	Very high	96.4	Very high	65 Å²	65	64.5 Å²	64.5	29%	0.285	35%	0.354	S	S	.	.	H	α-helix	trans	-74	-28.7	179.3	-79.2	-69.5	0	0	0	113.8	T132 L133 F142 V406 L407	T132-F136 HydrophobicContact CG2-CD2 3.86Å; T132-F136 HydrophobicContact CG2-CE2 3.98Å; T132-F136 WeakPolarHBondContact O-CD2 3.42Å; T132-F136 PolarHBondContact O-N 3.37Å; T132-F136 VanDerWaalsContact O-N 3.1Å; L133-F136 PolarHBondContact O-N 3.18Å; F136-F142 HydrophobicContact CB-CD1 4.28Å; F136-F142 HydrophobicContact CD1-CB 4.46Å; F136-F142 HydrophobicContact CD1-CD1 4.14Å; F136-F142 HydrophobicContact CD1-CG 4.27Å; F136-V406 HydrophobicContact CB-CG1 4.13Å; F136-V406 HydrophobicContact CD1-CG1 3.2Å; F136-V406 HydrophobicContact CD2-CG1 3.65Å; F136-V406 HydrophobicContact CE1-CG1 3.32Å; F136-V406 HydrophobicContact CE2-CG1 3.76Å; F136-V406 HydrophobicContact CG-CG1 3.38Å; F136-V406 HydrophobicContact CZ-CG1 3.6Å; F136-L407 HydrophobicContact CB-CD2 3.89Å
137	C	97.6	Very high	96.3	Very high	25 Å²	25	64.6 Å²	64.6	17%	0.169	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-37.3	168.7	-73.7	0	0	0	0	112	L133 R134 K147 C337	L133-C137 WeakPolarHBondContact O-CB 3.34Å; L133-C137 PolarHBondContact O-N 3.49Å; L133-C137 PolarHBondContact O-SG 2.84Å; R134-C137 PolarHBondContact O-N 3.09Å; C137-K147 WeakPolarHBondContact O-CE 3.46Å; C137-C337 VanDerWaalsContact CA-SG 3.51Å; C137-C337 HydrophobicContact CB-CB 3.72Å; C137-C337 WeakPolarHBondContact CB-SG 3.4Å; C137-C337 WeakPolarHBondContact SG-CA 3.5Å; C137-C337 WeakPolarHBondContact SG-CB 3.46Å; C137-C337 CovalentContact SG-SG 2.05Å; C137-C337 PolarHBondContact SG-SG 3.33Å
138	A	96.4	Very high	96.1	Very high	83 Å²	83	68 Å²	68	69%	0.686	37%	0.365	S	S	*	.	H	α-helix	trans	-79.4	-21	177.4	0	0	0	0	0	113.7	R134 E135 S140	R134-A138 WeakPolarHBondContact O-CB 3.39Å; R134-A138 PolarHBondContact O-N 3.28Å; E135-A138 PolarHBondContact O-N 3.5Å; A138-S140 PolarHBondContact O-N 3.41Å; A138-S140 VanDerWaalsContact O-N 3.13Å
139	N	96.1	Very high	96	Very high	64 Å²	64	66 Å²	66	34%	0.342	35%	0.354	S	S	.	.			trans	-70.4	106.3	-177.1	-177	-11.3	0	0	0	111.8	E135 S141 F142 K147	E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 PolarHBondContact O-N 3.45Å; N139-S141 VanDerWaalsContact C-N 3.26Å; N139-S141 PolarHBondContact O-N 3.41Å; N139-S141 WeakPolarHBondContact OD1-CB 3.33Å; N139-S141 PolarHBondContact OD1-N 3.39Å; N139-F142 HydrophobicContact CB-CB 4.24Å; N139-F142 PolarHBondContact O-N 2.91Å; N139-F142 PolarHBondContact OD1-N 3.49Å; N139-K147 PolarHBondContact O-NZ 2.79Å
140	S	92.2	Very high	95.9	Very high	95 Å²	95	67.6 Å²	67.6	66%	0.664	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.6	179.8	57.9	0	0	0	0	114.3	A138 F142	A138-S140 PolarHBondContact O-N 3.41Å; A138-S140 VanDerWaalsContact O-N 3.13Å; S140-F142 VanDerWaalsContact C-N 3.3Å
141	S	94.8	Very high	95.8	Very high	106 Å²	106	66.9 Å²	66.9	74%	0.741	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.4	178.1	-59	0	0	0	0	112.2	N139	N139-S141 VanDerWaalsContact C-N 3.26Å; N139-S141 PolarHBondContact O-N 3.41Å; N139-S141 WeakPolarHBondContact OD1-CB 3.33Å; N139-S141 PolarHBondContact OD1-N 3.39Å
142	F	94.8	Very high	95.7	Very high	27 Å²	27	64.6 Å²	64.6	12%	0.118	36%	0.362	C	S	.	.			trans	-89.8	108.5	175.5	-171.7	-121.8	0	0	0	109.9	F136 N139 S140 F144 K147 E402 A403 V406 L407	F136-F142 HydrophobicContact CB-CD1 4.28Å; F136-F142 HydrophobicContact CD1-CB 4.46Å; F136-F142 HydrophobicContact CD1-CD1 4.14Å; F136-F142 HydrophobicContact CD1-CG 4.27Å; N139-F142 HydrophobicContact CB-CB 4.24Å; N139-F142 PolarHBondContact O-N 2.91Å; N139-F142 PolarHBondContact OD1-N 3.49Å; S140-F142 VanDerWaalsContact C-N 3.3Å; F142-F144 AromaticContact CD1-CD1 3.86Å; F142-F144 HydrophobicContact CD1-CD1 3.86Å; F142-F144 AromaticContact CD1-CE1 3.93Å; F142-F144 HydrophobicContact CD1-CE1 3.93Å; F142-F144 AromaticContact CE1-CD1 3.56Å; F142-F144 HydrophobicContact CE1-CD1 3.56Å; F142-F144 AromaticContact CE1-CE1 3.74Å; F142-F144 HydrophobicContact CE1-CE1 3.74Å; F142-F144 HydrophobicContact CZ-CD1 4.22Å; F142-K147 VanDerWaalsContact O-CD 3.27Å; F142-K147 WeakPolarHBondContact O-CD 3.46Å; F142-K147 WeakPolarHBondContact O-CE 3.44Å; F142-K147 PolarHBondContact O-NZ 2.81Å; F142-E402 HydrophobicContact CE2-CG 4.21Å; F142-A403 HydrophobicContact CZ-CB 4.49Å; F142-V406 HydrophobicContact CD1-CG1 4.22Å; F142-V406 HydrophobicContact CE1-CB 4Å; F142-V406 HydrophobicContact CE1-CG1 3.71Å; F142-V406 HydrophobicContact CE2-CB 4.17Å; F142-V406 HydrophobicContact CE2-CG1 4.08Å; F142-V406 HydrophobicContact CE2-CG2 4.03Å; F142-V406 HydrophobicContact CZ-CB 3.56Å; F142-V406 HydrophobicContact CZ-CG1 3.64Å; F142-V406 HydrophobicContact CZ-CG2 3.87Å; F142-L407 HydrophobicContact CE1-CD2 4.49Å; F142-L407 HydrophobicContact CE1-CG 4.41Å
143	T	94.7	Very high	95.7	Very high	113 Å²	113	68.5 Å²	68.5	69%	0.693	38%	0.382	S	S	*	.			trans	-114.3	135.6	-176.9	59.8	0	0	0	0	110.9
144	F	95.4	Very high	95.6	Very high	28 Å²	28	68.2 Å²	68.2	12%	0.123	38%	0.38	C	S	.	.			trans	-151.4	160.7	170.8	60.1	-93.6	0	0	0	109.2	F142 T146 K147 Y331 A403 L407	F142-F144 AromaticContact CD1-CD1 3.86Å; F142-F144 HydrophobicContact CD1-CD1 3.86Å; F142-F144 AromaticContact CD1-CE1 3.93Å; F142-F144 HydrophobicContact CD1-CE1 3.93Å; F142-F144 AromaticContact CE1-CD1 3.56Å; F142-F144 HydrophobicContact CE1-CD1 3.56Å; F142-F144 AromaticContact CE1-CE1 3.74Å; F142-F144 HydrophobicContact CE1-CE1 3.74Å; F142-F144 HydrophobicContact CZ-CD1 4.22Å; F144-T146 PolarHBondContact O-N 2.79Å; F144-K147 HydrophobicContact CD1-CB 4.24Å; F144-K147 HydrophobicContact CD1-CD 4Å; F144-K147 HydrophobicContact CD1-CG 4.33Å; F144-K147 HydrophobicContact CD2-CB 3.99Å; F144-K147 HydrophobicContact CE1-CB 3.98Å; F144-K147 HydrophobicContact CE1-CD 3.61Å; F144-K147 HydrophobicContact CE1-CG 3.71Å; F144-K147 HydrophobicContact CE2-CB 3.7Å; F144-K147 HydrophobicContact CE2-CG 4.14Å; F144-K147 HydrophobicContact CG-CB 4.24Å; F144-K147 HydrophobicContact CZ-CB 3.7Å; F144-K147 HydrophobicContact CZ-CD 4.06Å; F144-K147 HydrophobicContact CZ-CG 3.6Å; F144-K147 WeakPolarHBondContact O-CB 3.35Å; F144-K147 PolarHBondContact O-N 2.96Å; F144-Y331 AromaticContact CD2-CD2 3.61Å; F144-Y331 HydrophobicContact CD2-CD2 3.61Å; F144-Y331 AromaticContact CD2-CE2 3.67Å; F144-Y331 HydrophobicContact CD2-CE2 3.67Å; F144-Y331 HydrophobicContact CD2-CG 4.13Å; F144-Y331 AromaticContact CE2-CD2 3.65Å; F144-Y331 HydrophobicContact CE2-CD2 3.65Å; F144-Y331 HydrophobicContact CE2-CE2 4.17Å; F144-Y331 HydrophobicContact CE2-CG 4.1Å; F144-A403 HydrophobicContact CB-CB 3.94Å; F144-A403 HydrophobicContact CD1-CB 4.05Å; F144-A403 HydrophobicContact CD2-CB 4.11Å; F144-A403 HydrophobicContact CG-CB 3.78Å; F144-L407 HydrophobicContact CE1-CD1 4.05Å; F144-L407 HydrophobicContact CE1-CD2 4.15Å; F144-L407 HydrophobicContact CE1-CG 4.41Å; F144-L407 HydrophobicContact CE2-CD1 4.33Å; F144-L407 HydrophobicContact CZ-CD1 3.74Å; F144-L407 HydrophobicContact CZ-CD2 4.29Å
145	P	94.1	Very high	95.5	Very high	70 Å²	70	64.1 Å²	64.1	46%	0.455	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	140.5	-177.3	-28.3	35	0	0	0	112.5	K147 Y331	P145-K147 PolarHBondContact O-N 2.79Å; P145-K147 VanDerWaalsContact O-N 3.09Å; P145-Y331 HydrophobicContact CB-CE2 4.47Å; P145-Y331 WeakPolarHBondContact CD-OH 3.29Å; P145-Y331 VanDerWaalsContact O-CE2 3.27Å; P145-Y331 WeakPolarHBondContact O-CE2 3.4Å
146	T	92.6	Very high	95.3	Very high	57 Å²	57	60.9 Å²	60.9	35%	0.35	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	10.8	175.1	70.5	0	0	0	0	116.5	F144 E148 R149 Q338	F144-T146 PolarHBondContact O-N 2.79Å; T146-E148 PolarHBondContact O-N 2.97Å; T146-R149 VanDerWaalsContact O-CG 3.31Å; T146-R149 WeakPolarHBondContact O-CG 3.32Å; T146-Q338 PolarHBondContact O-NE2 3.24Å; T146-Q338 VanDerWaalsContact O-NE2 3.1Å
147	K	95	Very high	95.1	Very high	10 Å²	10	64.9 Å²	64.9	4%	0.043	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-48.2	178.2	-177.7	-173.8	168.6	-135.5	0	112.8	C137 N139 F142 F144 P145 R149 Q338	C137-K147 WeakPolarHBondContact O-CE 3.46Å; N139-K147 PolarHBondContact O-NZ 2.79Å; F142-K147 VanDerWaalsContact O-CD 3.27Å; F142-K147 WeakPolarHBondContact O-CD 3.46Å; F142-K147 WeakPolarHBondContact O-CE 3.44Å; F142-K147 PolarHBondContact O-NZ 2.81Å; F144-K147 HydrophobicContact CD1-CB 4.24Å; F144-K147 HydrophobicContact CD1-CD 4Å; F144-K147 HydrophobicContact CD1-CG 4.33Å; F144-K147 HydrophobicContact CD2-CB 3.99Å; F144-K147 HydrophobicContact CE1-CB 3.98Å; F144-K147 HydrophobicContact CE1-CD 3.61Å; F144-K147 HydrophobicContact CE1-CG 3.71Å; F144-K147 HydrophobicContact CE2-CB 3.7Å; F144-K147 HydrophobicContact CE2-CG 4.14Å; F144-K147 HydrophobicContact CG-CB 4.24Å; F144-K147 HydrophobicContact CZ-CB 3.7Å; F144-K147 HydrophobicContact CZ-CD 4.06Å; F144-K147 HydrophobicContact CZ-CG 3.6Å; F144-K147 WeakPolarHBondContact O-CB 3.35Å; F144-K147 PolarHBondContact O-N 2.96Å; P145-K147 PolarHBondContact O-N 2.79Å; P145-K147 VanDerWaalsContact O-N 3.09Å; K147-R149 VanDerWaalsContact C-N 3.32Å; K147-R149 PolarHBondContact O-N 3.01Å; K147-Q338 PolarHBondContact O-NE2 3.32Å
148	E	93.3	Very high	95	Very high	150 Å²	150	64.9 Å²	64.9	70%	0.701	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	4.2	-171.2	-54.4	-59.7	148.8	0	0	114	T146	T146-E148 PolarHBondContact O-N 2.97Å
149	R	95.1	Very high	95	Very high	45 Å²	45	61 Å²	61	17%	0.17	34%	0.336	C	S	.	.			trans	-75.1	150.1	-179.1	78	-177.7	165.2	174.5	-3.1	111.6	T146 K147 D153 I154 E158 H335 Q338	T146-R149 VanDerWaalsContact O-CG 3.31Å; T146-R149 WeakPolarHBondContact O-CG 3.32Å; K147-R149 VanDerWaalsContact C-N 3.32Å; K147-R149 PolarHBondContact O-N 3.01Å; R149-D153 HydrophobicContact CB-CB 4.32Å; R149-I154 HydrophobicContact CG-CG1 4.42Å; R149-E158 IonicContact CZ-OE2 2.69Å; R149-E158 VanDerWaalsContact CZ-OE2 3.3Å; R149-E158 IonicContact NH1-OE2 3.94Å; R149-E158 PolarHBondContact NH1-OE2 3.48Å; R149-E158 IonicContact NH2-OE2 3.11Å; R149-E158 PolarHBondContact NH2-OE2 3.33Å; R149-H335 PolarHBondContact NH2-CE1 2.94Å; R149-H335 PolarHBondContact NH2-ND1 3.18Å; R149-Q338 HydrophobicContact CG-CG 4.25Å; R149-Q338 WeakPolarHBondContact O-CG 3.48Å; R149-Q338 PolarHBondContact O-NE2 3.02Å
150	S	96.3	Very high	95	Very high	57 Å²	57	59.9 Å²	59.9	40%	0.399	33%	0.33	S	S	.	.			trans	-74.3	157.8	169.3	175.5	0	0	0	0	111.1	D152 D153	S150-D152 PolarHBondContact O-N 2.86Å; S150-D152 PolarHBondContact OG-N 3.4Å; S150-D153 VanDerWaalsContact CB-OD2 3.31Å; S150-D153 WeakPolarHBondContact CB-OD2 3.3Å; S150-D153 PolarHBondContact N-OD2 2.93Å; S150-D153 VanDerWaalsContact N-OD2 3.1Å; S150-D153 PolarHBondContact O-N 2.62Å; S150-D153 VanDerWaalsContact O-N 3.09Å
151	F	97.1	Very high	95.3	Very high	18 Å²	18	56.2 Å²	56.2	8%	0.079	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-56.4	-32.7	169.4	-179	-97	0	0	0	112.4	D153 I154 L159 F221 R233 M236 K237 L240 Q338 I339	F151-D153 PolarHBondContact O-N 3.35Å; F151-I154 HydrophobicContact CD2-CD1 3.81Å; F151-I154 HydrophobicContact CE2-CD1 4.37Å; F151-I154 PolarHBondContact O-N 2.9Å; F151-L159 HydrophobicContact CE2-CD2 3.96Å; F151-L159 HydrophobicContact CZ-CD1 4.13Å; F151-L159 HydrophobicContact CZ-CD2 4.34Å; F151-F221 HydrophobicContact CZ-CD2 4.29Å; F151-F221 HydrophobicContact CZ-CE2 4.35Å; F151-R233 PolarHBondContact O-NH1 2.85Å; F151-M236 HydrophobicContact CE1-CB 3.96Å; F151-M236 HydrophobicContact CE1-SD 4.19Å; F151-M236 HydrophobicContact CZ-CB 4.07Å; F151-M236 HydrophobicContact CZ-SD 4.12Å; F151-K237 HydrophobicContact CD1-CG 4.24Å; F151-K237 HydrophobicContact CE1-CG 4.45Å; F151-L240 HydrophobicContact CD1-CD1 4.27Å; F151-L240 HydrophobicContact CD2-CD1 3.87Å; F151-L240 HydrophobicContact CE1-CD1 3.93Å; F151-L240 HydrophobicContact CE2-CD1 3.51Å; F151-L240 HydrophobicContact CG-CD1 4.25Å; F151-L240 HydrophobicContact CZ-CD1 3.55Å; F151-Q338 HydrophobicContact CB-CB 4.45Å; F151-I339 HydrophobicContact CD2-CG1 4.36Å; F151-I339 HydrophobicContact CE2-CD1 4.36Å; F151-I339 HydrophobicContact CE2-CG1 4.46Å
152	D	95.8	Very high	95.5	Very high	73 Å²	73	51.1 Å²	51.1	39%	0.39	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-66.7	-27.8	178.5	-69	-41.8	0	0	0	112.9	S150 I154 K237	S150-D152 PolarHBondContact O-N 2.86Å; S150-D152 PolarHBondContact OG-N 3.4Å; D152-I154 VanDerWaalsContact C-N 3.31Å; D152-K237 WeakPolarHBondContact OD1-CE 3.29Å; D152-K237 IonicContact OD1-NZ 2.79Å; D152-K237 PolarHBondContact OD1-NZ 3.5Å; D152-K237 WeakPolarHBondContact OD2-CE 3.37Å; D152-K237 IonicContact OD2-NZ 3.99Å; D152-K237 PolarHBondContact OD2-NZ 2.98Å
153	D	96.4	Very high	95.7	Very high	106 Å²	106	50 Å²	50	57%	0.567	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-82.8	-10.1	-178.6	-55.1	-40.3	0	0	0	112.5	R149 S150 F151 P155	R149-D153 HydrophobicContact CB-CB 4.32Å; S150-D153 VanDerWaalsContact CB-OD2 3.31Å; S150-D153 WeakPolarHBondContact CB-OD2 3.3Å; S150-D153 PolarHBondContact N-OD2 2.93Å; S150-D153 VanDerWaalsContact N-OD2 3.1Å; S150-D153 PolarHBondContact O-N 2.62Å; S150-D153 VanDerWaalsContact O-N 3.09Å; F151-D153 PolarHBondContact O-N 3.35Å; D153-P155 VanDerWaalsContact O-CD 3.28Å; D153-P155 WeakPolarHBondContact O-CD 3.2Å
154	I	96.9	Very high	95.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.231	C	C	.	.	S	Bend	trans	-73.2	119.1	178.3	-54	177.2	0	0	0	108.7	R149 F151 D152 E158 L159 R233 H335 Q338	R149-I154 HydrophobicContact CG-CG1 4.42Å; F151-I154 HydrophobicContact CD2-CD1 3.81Å; F151-I154 HydrophobicContact CE2-CD1 4.37Å; F151-I154 PolarHBondContact O-N 2.9Å; D152-I154 VanDerWaalsContact C-N 3.31Å; I154-E158 HydrophobicContact CG2-CB 3.81Å; I154-L159 HydrophobicContact CB-CD2 4.25Å; I154-L159 HydrophobicContact CD1-CD2 4.43Å; I154-L159 HydrophobicContact CG2-CD2 3.61Å; I154-L159 HydrophobicContact CG2-CG 4.04Å; I154-R233 VanDerWaalsContact O-CZ 3.25Å; I154-R233 PolarHBondContact O-NH1 3.43Å; I154-R233 PolarHBondContact O-NH2 3.1Å; I154-H335 HydrophobicContact CD1-CB 3.87Å; I154-Q338 HydrophobicContact CD1-CB 3.93Å; I154-Q338 HydrophobicContact CD1-CG 4.03Å
155	P	94.9	Very high	95.9	Very high	43 Å²	43	43.7 Å²	43.7	28%	0.279	23%	0.226	S	C	.	.			trans	-62.4	148.4	177.4	-22.6	34.5	0	0	0	112.7	D153 Y157 E158	D153-P155 VanDerWaalsContact O-CD 3.28Å; D153-P155 WeakPolarHBondContact O-CD 3.2Å; P155-Y157 HydrophobicContact CB-CD1 3.56Å; P155-Y157 HydrophobicContact CB-CE1 3.2Å; P155-Y157 HydrophobicContact CB-CG 4.37Å; P155-Y157 HydrophobicContact CG-CE1 3.82Å; P155-Y157 PolarHBondContact O-N 3.26Å; P155-Y157 VanDerWaalsContact O-N 3.16Å; P155-E158 HydrophobicContact CB-CG 4.47Å; P155-E158 HydrophobicContact CG-CG 4.48Å; P155-E158 PolarHBondContact O-N 3.21Å
156	N	94.3	Very high	96	Very high	43 Å²	43	43.4 Å²	43.4	23%	0.23	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-54.8	-38.6	-177.8	-73.1	-20.1	0	0	0	113.1	E158 L159 N222 R233	N156-E158 PolarHBondContact O-N 2.83Å; N156-L159 WeakPolarHBondContact O-CB 3.19Å; N156-L159 PolarHBondContact O-N 3.22Å; N156-N222 VanDerWaalsContact C-OD1 3.23Å; N156-N222 WeakPolarHBondContact O-CA 3.29Å; N156-N222 VanDerWaalsContact O-CB 3.3Å; N156-N222 WeakPolarHBondContact O-CB 3.35Å; N156-N222 PolarHBondContact O-OD1 3.23Å; N156-R233 PolarHBondContact OD1-NH2 3.48Å
157	Y	92.9	Very high	96.2	Very high	149 Å²	149	46.8 Å²	46.8	58%	0.584	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-64.1	-24.7	-179.5	68.3	-99	0	0	0	112.9	P155 L159 N222	P155-Y157 HydrophobicContact CB-CD1 3.56Å; P155-Y157 HydrophobicContact CB-CE1 3.2Å; P155-Y157 HydrophobicContact CB-CG 4.37Å; P155-Y157 HydrophobicContact CG-CE1 3.82Å; P155-Y157 PolarHBondContact O-N 3.26Å; P155-Y157 VanDerWaalsContact O-N 3.16Å; Y157-L159 VanDerWaalsContact C-N 3.28Å; Y157-N222 PolarHBondContact N-OD1 3.48Å
158	E	95.8	Very high	96.3	Very high	25 Å²	25	49.3 Å²	49.3	12%	0.117	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-80.3	-8.4	174.2	-59.2	-154.6	144.7	0	0	113.1	R149 I154 P155 N156 N160 R328 H335	R149-E158 IonicContact CZ-OE2 2.69Å; R149-E158 VanDerWaalsContact CZ-OE2 3.3Å; R149-E158 IonicContact NH1-OE2 3.94Å; R149-E158 PolarHBondContact NH1-OE2 3.48Å; R149-E158 IonicContact NH2-OE2 3.11Å; R149-E158 PolarHBondContact NH2-OE2 3.33Å; I154-E158 HydrophobicContact CG2-CB 3.81Å; P155-E158 HydrophobicContact CB-CG 4.47Å; P155-E158 HydrophobicContact CG-CG 4.48Å; P155-E158 PolarHBondContact O-N 3.21Å; N156-E158 PolarHBondContact O-N 2.83Å; E158-N160 VanDerWaalsContact C-N 3.34Å; E158-R328 IonicContact OE1-NH2 3.71Å; E158-R328 PolarHBondContact OE1-NH2 3.43Å; E158-H335 PolarHBondContact O-NE2 2.71Å; E158-H335 IonicContact OE2-CE1 3.55Å
159	L	97.1	Very high	96.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-95.2	13.7	177.3	-56.4	177.3	0	0	0	112.4	F151 I154 N156 Y157 H161 L162 F221 N222 M236	F151-L159 HydrophobicContact CE2-CD2 3.96Å; F151-L159 HydrophobicContact CZ-CD1 4.13Å; F151-L159 HydrophobicContact CZ-CD2 4.34Å; I154-L159 HydrophobicContact CB-CD2 4.25Å; I154-L159 HydrophobicContact CD1-CD2 4.43Å; I154-L159 HydrophobicContact CG2-CD2 3.61Å; I154-L159 HydrophobicContact CG2-CG 4.04Å; N156-L159 WeakPolarHBondContact O-CB 3.19Å; N156-L159 PolarHBondContact O-N 3.22Å; Y157-L159 VanDerWaalsContact C-N 3.28Å; L159-H161 PolarHBondContact O-N 2.92Å; L159-L162 HydrophobicContact CB-CD1 4.39Å; L159-L162 HydrophobicContact CD2-CD1 3.79Å; L159-L162 PolarHBondContact O-N 2.73Å; L159-F221 HydrophobicContact CB-CB 3.78Å; L159-F221 HydrophobicContact CD1-CB 4.34Å; L159-N222 PolarHBondContact O-N 2.93Å; L159-M236 HydrophobicContact CD1-CE 4.21Å; L159-M236 HydrophobicContact CD1-SD 3.86Å
160	N	96.1	Very high	96.7	Very high	42 Å²	42	40.7 Å²	40.7	23%	0.225	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.6	-179.3	-165.7	47.5	0	0	0	113.5	E158 Y174 T220 N222	E158-N160 VanDerWaalsContact C-N 3.34Å; N160-Y174 WeakPolarHBondContact O-CE1 3.42Å; N160-T220 WeakPolarHBondContact O-CG2 3.32Å; N160-T220 PolarHBondContact OD1-OG1 3.46Å; N160-N222 HydrophobicContact CB-CB 3.97Å
161	H	97.8	Very high	96.8	Very high	17 Å²	17	38 Å²	38	8%	0.079	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-13.1	179.2	-74.6	-97.9	0	0	0	113.8	L159 I163 Y172 C173 Y174 E325	L159-H161 PolarHBondContact O-N 2.92Å; H161-I163 PolarHBondContact O-N 3.43Å; H161-Y172 VanDerWaalsContact O-O 3.08Å; H161-C173 CarbonylContact O-C 3.39Å; H161-C173 VanDerWaalsContact O-CA 3.29Å; H161-C173 WeakPolarHBondContact O-CA 3.13Å; H161-Y174 VanDerWaalsContact CA-CE1 3.47Å; H161-Y174 HydrophobicContact CB-CD1 4.42Å; H161-Y174 HydrophobicContact CB-CE1 4.29Å; H161-Y174 AromaticContact CE1-CE2 3.41Å; H161-Y174 VanDerWaalsContact CE1-CE2 3.41Å; H161-Y174 WeakPolarHBondContact CE1-CE2 3.44Å; H161-Y174 AromaticContact CE1-CZ 3.68Å; H161-Y174 AromaticContact CG-CZ 3.98Å; H161-Y174 AromaticContact ND1-CD2 3.65Å; H161-Y174 AromaticContact ND1-CE2 3.31Å; H161-Y174 VanDerWaalsContact ND1-CE2 3.31Å; H161-Y174 WeakPolarHBondContact ND1-CE2 3.3Å; H161-Y174 AromaticContact ND1-CZ 3.5Å; H161-Y174 PolarHBondContact ND1-O 2.8Å; H161-Y174 WeakPolarHBondContact O-CD1 3.35Å; H161-Y174 PolarHBondContact O-N 2.84Å; H161-E325 IonicContact CE1-OE2 3.31Å; H161-E325 PolarHBondContact CE1-OE2 3.39Å; H161-E325 VanDerWaalsContact CE1-OE2 3.24Å; H161-E325 IonicContact NE2-OE2 2.92Å
162	L	98.6	Very high	96.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	92.6	-178.3	-63.5	166.3	0	0	0	109.9	L159 I171 C173 T220 F221 I339	L159-L162 HydrophobicContact CB-CD1 4.39Å; L159-L162 HydrophobicContact CD2-CD1 3.79Å; L159-L162 PolarHBondContact O-N 2.73Å; L162-I171 HydrophobicContact CB-CG2 4.21Å; L162-I171 HydrophobicContact CD2-CG2 3.88Å; L162-C173 HydrophobicContact CD2-CB 3.79Å; L162-T220 CarbonylContact O-C 3.54Å; L162-T220 WeakPolarHBondContact O-CA 3.5Å; L162-T220 WeakPolarHBondContact O-CB 3.47Å; L162-F221 HydrophobicContact CB-CB 4.23Å; L162-F221 HydrophobicContact CB-CD2 4.01Å; L162-F221 HydrophobicContact CB-CG 4.15Å; L162-F221 HydrophobicContact CD1-CB 4.49Å; L162-F221 HydrophobicContact CD1-CD2 3.49Å; L162-F221 VanDerWaalsContact CD1-CD2 3.49Å; L162-F221 HydrophobicContact CD1-CE2 4.09Å; L162-F221 HydrophobicContact CD1-CG 4.33Å; L162-F221 HydrophobicContact CG-CD2 4.38Å; L162-F221 PolarHBondContact O-N 3.05Å; L162-I339 HydrophobicContact CD1-CD1 3.65Å; L162-I339 HydrophobicContact CD2-CD1 3.88Å; L162-I339 HydrophobicContact CG-CD1 4.4Å
163	I	98.5	Very high	97	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	134.8	173.1	-62.3	169.2	0	0	0	108.6	H161 I171 Y172 Y174 K184 M187 H218 L219 T220	H161-I163 PolarHBondContact O-N 3.43Å; I163-I171 CarbonylContact O-C 3.54Å; I163-I171 VanDerWaalsContact O-CA 3.31Å; I163-I171 WeakPolarHBondContact O-CA 3.33Å; I163-Y172 HydrophobicContact CD1-CD1 4.11Å; I163-Y172 PolarHBondContact N-O 3.27Å; I163-Y172 PolarHBondContact O-N 3.17Å; I163-Y174 HydrophobicContact CD1-CD1 3.56Å; I163-Y174 HydrophobicContact CD1-CE1 4.16Å; I163-Y174 HydrophobicContact CD1-CG 4.37Å; I163-Y174 HydrophobicContact CG1-CD1 3.86Å; I163-Y174 HydrophobicContact CG1-CE1 4.25Å; I163-K184 HydrophobicContact CD1-CD 4.5Å; I163-K184 HydrophobicContact CD1-CG 3.9Å; I163-M187 HydrophobicContact CG2-CB 4.2Å; I163-M187 HydrophobicContact CG2-CE 4.01Å; I163-M187 HydrophobicContact CG2-CG 4.2Å; I163-H218 HydrophobicContact CD1-CB 4.1Å; I163-H218 HydrophobicContact CG1-CB 3.96Å; I163-H218 HydrophobicContact CG2-CB 4.05Å; I163-L219 CarbonylContact C-O 3.54Å; I163-L219 WeakPolarHBondContact CA-O 3.41Å; I163-T220 HydrophobicContact CG1-CG2 3.98Å
164	V	98.3	Very high	97.1	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.03	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.9	-175.7	-169.8	0	0	0	0	109.5	D166 L219 F221 F224 K239 Y243	V164-D166 WeakPolarHBondContact CG1-OD1 3.45Å; V164-L219 PolarHBondContact N-O 2.7Å; V164-F221 HydrophobicContact CG2-CD1 3.31Å; V164-F221 HydrophobicContact CG2-CE1 3.34Å; V164-F221 HydrophobicContact CG2-CG 4.32Å; V164-F221 HydrophobicContact CG2-CZ 4.36Å; V164-F224 HydrophobicContact CB-CE1 4.4Å; V164-F224 HydrophobicContact CB-CZ 4.47Å; V164-F224 HydrophobicContact CG1-CZ 4.27Å; V164-F224 HydrophobicContact CG2-CE1 3.97Å; V164-F224 HydrophobicContact CG2-CZ 4.12Å; V164-K239 HydrophobicContact CG1-CD 4.13Å; V164-Y243 HydrophobicContact CG1-CD2 4.13Å; V164-Y243 HydrophobicContact CG1-CE2 3.81Å
165	D	97.7	Very high	97.2	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.016	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	109.8	163.7	172.1	40.5	0	0	0	110	R167 H168 G169 I170 M187	D165-R167 VanDerWaalsContact C-N 3.29Å; D165-R167 PolarHBondContact O-N 3.14Å; D165-R167 WeakPolarHBondContact OD1-CB 3.34Å; D165-R167 PolarHBondContact OD1-N 2.67Å; D165-R167 VanDerWaalsContact OD1-N 3.11Å; D165-H168 WeakPolarHBondContact OD2-CB 3.27Å; D165-H168 IonicContact OD2-CE1 3.22Å; D165-H168 IonicContact OD2-CG 2.71Å; D165-H168 VanDerWaalsContact OD2-CG 3.29Å; D165-H168 PolarHBondContact OD2-N 2.96Å; D165-H168 IonicContact OD2-ND1 2.94Å; D165-H168 PolarHBondContact OD2-ND1 2.85Å; D165-G169 WeakPolarHBondContact O-CA 3.29Å; D165-G169 PolarHBondContact O-N 3.26Å; D165-G169 VanDerWaalsContact O-N 3.08Å; D165-I170 HydrophobicContact CB-CB 4.33Å; D165-I170 PolarHBondContact N-O 3.3Å; D165-I170 PolarHBondContact O-N 3.02Å; D165-M187 HydrophobicContact CB-CE 3.71Å
166	D	96.2	Very high	97.3	Very high	64 Å²	64	27.4 Å²	27.4	34%	0.342	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.9	-179.2	-75.5	-0.8	0	0	0	112.6	V164 K239 Y243	V164-D166 WeakPolarHBondContact CG1-OD1 3.45Å; D166-K239 IonicContact OD1-NZ 2.79Å; D166-K239 PolarHBondContact OD1-NZ 2.95Å; D166-K239 IonicContact OD2-NZ 3.68Å; D166-K239 PolarHBondContact OD2-NZ 3.32Å; D166-Y243 WeakPolarHBondContact CA-OH 3.29Å; D166-Y243 WeakPolarHBondContact OD1-CE2 3.45Å; D166-Y243 PolarHBondContact OD1-OH 3.02Å
167	R	95.9	Very high	97.4	Very high	127 Å²	127	27 Å²	27	48%	0.479	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-43.2	-175.9	-62.6	-176.4	78	-142.3	19.7	111.8	D165 L190 E192	D165-R167 VanDerWaalsContact C-N 3.29Å; D165-R167 PolarHBondContact O-N 3.14Å; D165-R167 WeakPolarHBondContact OD1-CB 3.34Å; D165-R167 PolarHBondContact OD1-N 2.67Å; D165-R167 VanDerWaalsContact OD1-N 3.11Å; R167-L190 PolarHBondContact NH1-O 2.86Å; R167-E192 IonicContact CZ-OE1 3.47Å; R167-E192 VanDerWaalsContact CZ-OE1 3.22Å; R167-E192 IonicContact CZ-OE2 3.93Å; R167-E192 IonicContact NH1-OE1 2.75Å; R167-E192 PolarHBondContact NH1-OE1 3.41Å; R167-E192 IonicContact NH1-OE2 3.22Å; R167-E192 IonicContact NH2-OE1 3.37Å; R167-E192 PolarHBondContact NH2-OE1 2.94Å; R167-E192 IonicContact NH2-OE2 3.48Å; R167-E192 PolarHBondContact NH2-OE2 2.81Å
168	H	97.3	Very high	97.5	Very high	64 Å²	64	19.9 Å²	19.9	30%	0.296	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-1.8	179.2	-54.2	85	0	0	0	112.6	D165 I170 L190	D165-H168 WeakPolarHBondContact OD2-CB 3.27Å; D165-H168 IonicContact OD2-CE1 3.22Å; D165-H168 IonicContact OD2-CG 2.71Å; D165-H168 VanDerWaalsContact OD2-CG 3.29Å; D165-H168 PolarHBondContact OD2-N 2.96Å; D165-H168 IonicContact OD2-ND1 2.94Å; D165-H168 PolarHBondContact OD2-ND1 2.85Å; H168-I170 HydrophobicContact CB-CD1 3.54Å; H168-I170 HydrophobicContact CB-CG1 3.89Å; H168-L190 PolarHBondContact CE1-O 2.77Å
169	G	98.1	Very high	97.3	Very high	13 Å²	13	19.7 Å²	19.7	13%	0.134	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	53.6	-179.1	0	0	0	0	0	111.7	D165 Y243 T244	D165-G169 WeakPolarHBondContact O-CA 3.29Å; D165-G169 PolarHBondContact O-N 3.26Å; D165-G169 VanDerWaalsContact O-N 3.08Å; G169-Y243 VanDerWaalsContact C-CB 3.48Å; G169-Y243 CarbonylContact O-C 3.34Å; G169-Y243 WeakPolarHBondContact O-CA 3.04Å; G169-Y243 WeakPolarHBondContact O-CB 3.31Å; G169-T244 PolarHBondContact O-N 3.09Å
170	I	98.6	Very high	97.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.9	-174.2	-62.3	171	0	0	0	110.3	D165 H168 M187 L190 T244 F246 L361	D165-I170 HydrophobicContact CB-CB 4.33Å; D165-I170 PolarHBondContact N-O 3.3Å; D165-I170 PolarHBondContact O-N 3.02Å; H168-I170 HydrophobicContact CB-CD1 3.54Å; H168-I170 HydrophobicContact CB-CG1 3.89Å; I170-M187 HydrophobicContact CB-CE 4.34Å; I170-M187 HydrophobicContact CG2-CE 3.85Å; I170-M187 HydrophobicContact CG2-SD 4.15Å; I170-L190 HydrophobicContact CD1-CD1 3.83Å; I170-T244 CarbonylContact C-O 3.55Å; I170-T244 WeakPolarHBondContact CA-O 2.71Å; I170-F246 HydrophobicContact CG2-CD1 3.99Å; I170-F246 HydrophobicContact CG2-CE1 3.54Å; I170-L361 HydrophobicContact CD1-CD1 3.82Å; I170-L361 HydrophobicContact CD1-CD2 3.92Å; I170-L361 HydrophobicContact CD1-CG 4.32Å; I170-L361 HydrophobicContact CG1-CD1 4.46Å; I170-L361 HydrophobicContact CG1-CD2 3.79Å
171	I	98.8	Very high	97	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.6	166.4	-58.6	171.9	0	0	0	108.5	L162 I163 F221 K239 L240 Y243 T244 K245 F246	L162-I171 HydrophobicContact CB-CG2 4.21Å; L162-I171 HydrophobicContact CD2-CG2 3.88Å; I163-I171 CarbonylContact O-C 3.54Å; I163-I171 VanDerWaalsContact O-CA 3.31Å; I163-I171 WeakPolarHBondContact O-CA 3.33Å; I171-F221 HydrophobicContact CD1-CE1 4.37Å; I171-F221 HydrophobicContact CD1-CE2 4.32Å; I171-F221 HydrophobicContact CD1-CZ 3.63Å; I171-F221 HydrophobicContact CG1-CZ 4.46Å; I171-K239 HydrophobicContact CD1-CB 4.26Å; I171-L240 HydrophobicContact CD1-CD2 3.97Å; I171-L240 HydrophobicContact CD1-CG 4.41Å; I171-Y243 HydrophobicContact CD1-CD2 4.33Å; I171-Y243 HydrophobicContact CG1-CD2 3.94Å; I171-Y243 HydrophobicContact CG1-CG 4.43Å; I171-T244 PolarHBondContact N-O 3.15Å; I171-K245 HydrophobicContact CB-CB 4.48Å; I171-K245 HydrophobicContact CB-CG 4Å; I171-K245 HydrophobicContact CD1-CG 4.06Å; I171-K245 HydrophobicContact CG1-CG 4.46Å; I171-K245 CarbonylContact O-C 3.59Å; I171-K245 VanDerWaalsContact O-CA 3.29Å; I171-K245 WeakPolarHBondContact O-CA 3.35Å; I171-F246 PolarHBondContact O-N 3.27Å
172	Y	98.8	Very high	96.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.1	173.7	172.4	-139.3	0	0	0	109.8	H161 I163 Y174 C180 W183 K184 M187 F246	H161-Y172 VanDerWaalsContact O-O 3.08Å; I163-Y172 HydrophobicContact CD1-CD1 4.11Å; I163-Y172 PolarHBondContact N-O 3.27Å; I163-Y172 PolarHBondContact O-N 3.17Å; Y172-Y174 VanDerWaalsContact CZ-CA 3.45Å; Y172-Y174 VanDerWaalsContact CZ-CB 3.48Å; Y172-Y174 PolarHBondContact O-N 2.9Å; Y172-C180 WeakPolarHBondContact OH-CA 3.24Å; Y172-C180 WeakPolarHBondContact OH-CB 3.29Å; Y172-W183 HydrophobicContact CD1-CB 4.18Å; Y172-W183 HydrophobicContact CE1-CB 3.38Å; Y172-W183 HydrophobicContact CE1-CG 4.35Å; Y172-W183 HydrophobicContact CE2-CB 4.22Å; Y172-W183 HydrophobicContact CE2-CG 4.38Å; Y172-W183 VanDerWaalsContact CZ-CB 3.42Å; Y172-W183 AromaticContact CZ-CG 3.96Å; Y172-W183 WeakPolarHBondContact OH-CB 3.34Å; Y172-K184 HydrophobicContact CE1-CG 4.46Å; Y172-M187 HydrophobicContact CD1-CG 3.84Å; Y172-M187 HydrophobicContact CG-CG 4.39Å; Y172-F246 HydrophobicContact CD1-CZ 4.46Å; Y172-F246 AromaticContact CD2-CD2 3.68Å; Y172-F246 HydrophobicContact CD2-CD2 3.68Å; Y172-F246 HydrophobicContact CD2-CE1 4.21Å; Y172-F246 AromaticContact CD2-CE2 3.17Å; Y172-F246 HydrophobicContact CD2-CE2 3.17Å; Y172-F246 HydrophobicContact CD2-CG 4.38Å; Y172-F246 AromaticContact CD2-CZ 3.49Å; Y172-F246 HydrophobicContact CD2-CZ 3.49Å; Y172-F246 VanDerWaalsContact CD2-CZ 3.49Å; Y172-F246 HydrophobicContact CE2-CD2 4.19Å; Y172-F246 AromaticContact CE2-CE2 3.65Å; Y172-F246 HydrophobicContact CE2-CE2 3.65Å; Y172-F246 HydrophobicContact CE2-CZ 4.3Å; Y172-F246 HydrophobicContact CG-CE1 4.21Å; Y172-F246 AromaticContact CG-CE2 3.81Å; Y172-F246 HydrophobicContact CG-CE2 3.81Å; Y172-F246 AromaticContact CG-CZ 3.6Å; Y172-F246 HydrophobicContact CG-CZ 3.6Å
173	C	98.8	Very high	96.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	107.1	164.4	-167	0	0	0	0	110.6	H161 L162 F246 L247 C334 Y341	H161-C173 CarbonylContact O-C 3.39Å; H161-C173 VanDerWaalsContact O-CA 3.29Å; H161-C173 WeakPolarHBondContact O-CA 3.13Å; L162-C173 HydrophobicContact CD2-CB 3.79Å; C173-F246 PolarHBondContact N-O 3.32Å; C173-L247 HydrophobicContact CB-CB 4.07Å; C173-C334 HydrophobicContact CB-CB 3.87Å; C173-C334 WeakPolarHBondContact CB-SG 3.43Å; C173-C334 WeakPolarHBondContact SG-CA 3.48Å; C173-C334 WeakPolarHBondContact SG-CB 3.28Å; C173-C334 CovalentContact SG-SG 2.03Å; C173-C334 PolarHBondContact SG-SG 2.75Å; C173-Y341 HydrophobicContact CB-CE1 3.85Å; C173-Y341 WeakPolarHBondContact CB-OH 3.32Å
174	Y	98.3	Very high	96.7	Very high	17 Å²	17	20.3 Å²	20.3	7%	0.067	10%	0.102	C	C	.	.			trans	-82.2	129	179.9	77.1	-94.4	0	0	0	111.9	N160 H161 I163 Y172 E325	N160-Y174 WeakPolarHBondContact O-CE1 3.42Å; H161-Y174 VanDerWaalsContact CA-CE1 3.47Å; H161-Y174 HydrophobicContact CB-CD1 4.42Å; H161-Y174 HydrophobicContact CB-CE1 4.29Å; H161-Y174 AromaticContact CE1-CE2 3.41Å; H161-Y174 VanDerWaalsContact CE1-CE2 3.41Å; H161-Y174 WeakPolarHBondContact CE1-CE2 3.44Å; H161-Y174 AromaticContact CE1-CZ 3.68Å; H161-Y174 AromaticContact CG-CZ 3.98Å; H161-Y174 AromaticContact ND1-CD2 3.65Å; H161-Y174 AromaticContact ND1-CE2 3.31Å; H161-Y174 VanDerWaalsContact ND1-CE2 3.31Å; H161-Y174 WeakPolarHBondContact ND1-CE2 3.3Å; H161-Y174 AromaticContact ND1-CZ 3.5Å; H161-Y174 PolarHBondContact ND1-O 2.8Å; H161-Y174 WeakPolarHBondContact O-CD1 3.35Å; H161-Y174 PolarHBondContact O-N 2.84Å; I163-Y174 HydrophobicContact CD1-CD1 3.56Å; I163-Y174 HydrophobicContact CD1-CE1 4.16Å; I163-Y174 HydrophobicContact CD1-CG 4.37Å; I163-Y174 HydrophobicContact CG1-CD1 3.86Å; I163-Y174 HydrophobicContact CG1-CE1 4.25Å; Y172-Y174 VanDerWaalsContact CZ-CA 3.45Å; Y172-Y174 VanDerWaalsContact CZ-CB 3.48Å; Y172-Y174 PolarHBondContact O-N 2.9Å; Y174-E325 WeakPolarHBondContact CE2-OE2 3.31Å
175	V	98.4	Very high	96.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.			trans	-110.4	133.4	171.2	175.9	0	0	0	0	107.7	V178 C180 L247 V330 L333 C334	V175-V178 HydrophobicContact CB-CG2 3.64Å; V175-V178 HydrophobicContact CG1-CG1 4.2Å; V175-V178 HydrophobicContact CG1-CG2 4.08Å; V175-V178 WeakPolarHBondContact O-CG2 3.4Å; V175-C180 WeakPolarHBondContact O-CB 3.39Å; V175-C180 PolarHBondContact O-SG 2.84Å; V175-L247 HydrophobicContact CG2-CD1 4.49Å; V175-V330 HydrophobicContact CG1-CG2 3.76Å; V175-V330 HydrophobicContact CG2-CG1 3.8Å; V175-V330 HydrophobicContact CG2-CG2 4.33Å; V175-L333 HydrophobicContact CG1-CD1 4.46Å; V175-C334 VanDerWaalsContact CG2-SG 3.56Å
176	P	97.1	Very high	96.6	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.019	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	151.4	174.4	-24.6	35.9	0	0	0	113.7	V178 E325 H326	P176-V178 VanDerWaalsContact C-N 3.31Å; P176-V178 PolarHBondContact O-N 2.93Å; P176-E325 WeakPolarHBondContact CD-O 3.45Å; P176-E325 HydrophobicContact CG-CB 4.01Å; P176-E325 HydrophobicContact CG-CG 4.03Å; P176-E325 WeakPolarHBondContact CG-O 3.44Å; P176-H326 WeakPolarHBondContact CB-ND1 3.21Å
177	K	95.2	Very high	96.6	Very high	33 Å²	33	18.9 Å²	18.9	14%	0.143	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	19.9	177.2	-40.9	-58.4	164.5	-176	0	115.5	R250 R255 A259 S262	K177-R250 PolarHBondContact O-NH1 2.86Å; K177-R250 VanDerWaalsContact O-NH1 3.16Å; K177-R255 HydrophobicContact CB-CG 3.84Å; K177-R255 HydrophobicContact CG-CG 4.47Å; K177-A259 HydrophobicContact CG-CB 4.11Å; K177-S262 VanDerWaalsContact NZ-CB 3.26Å; K177-S262 PolarHBondContact NZ-OG 3.35Å
178	V	95.2	Very high	96.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-124.8	43.9	174.6	-57.3	0	0	0	0	111.8	V175 P176 C180 F248 R250	V175-V178 HydrophobicContact CB-CG2 3.64Å; V175-V178 HydrophobicContact CG1-CG1 4.2Å; V175-V178 HydrophobicContact CG1-CG2 4.08Å; V175-V178 WeakPolarHBondContact O-CG2 3.4Å; P176-V178 VanDerWaalsContact C-N 3.31Å; P176-V178 PolarHBondContact O-N 2.93Å; V178-C180 PolarHBondContact O-N 3.22Å; V178-F248 HydrophobicContact CB-CB 4.21Å; V178-F248 HydrophobicContact CG2-CB 4.03Å; V178-F248 WeakPolarHBondContact CG2-O 3.43Å; V178-R250 HydrophobicContact CG1-CB 3.59Å
179	A	92.3	Very high	96.7	Very high	22 Å²	22	10.5 Å²	10.5	18%	0.182	6%	0.059	C	C	.	.	S	Bend	trans	60.6	22.9	-173.6	0	0	0	0	0	115.5	T181 N182 W183 L347 L350 F369	A179-T181 PolarHBondContact O-N 2.62Å; A179-T181 VanDerWaalsContact O-N 3.14Å; A179-N182 PolarHBondContact O-N 3.25Å; A179-W183 PolarHBondContact O-N 2.94Å; A179-L347 HydrophobicContact CB-CD1 3.85Å; A179-L350 HydrophobicContact CB-CD1 3.92Å; A179-L350 HydrophobicContact CB-CD2 3.64Å; A179-L350 HydrophobicContact CB-CG 4.45Å; A179-F369 HydrophobicContact CB-CZ 4.19Å
180	C	94.1	Very high	96.6	Very high	10 Å²	10	10.1 Å²	10.1	7%	0.068	5%	0.053	C	C	.	.	H	α-helix	trans	-62.3	-24.1	-176.7	67.3	0	0	0	0	115.5	Y172 V175 V178 N182 K184	Y172-C180 WeakPolarHBondContact OH-CA 3.24Å; Y172-C180 WeakPolarHBondContact OH-CB 3.29Å; V175-C180 WeakPolarHBondContact O-CB 3.39Å; V175-C180 PolarHBondContact O-SG 2.84Å; V178-C180 PolarHBondContact O-N 3.22Å; C180-N182 VanDerWaalsContact C-N 3.33Å; C180-K184 VanDerWaalsContact O-CB 3.29Å; C180-K184 WeakPolarHBondContact O-CB 3.3Å; C180-K184 VanDerWaalsContact O-CG 3.24Å; C180-K184 WeakPolarHBondContact O-CG 3.45Å; C180-K184 PolarHBondContact O-N 2.96Å
181	T	93.3	Very high	96.4	Very high	32 Å²	32	11.6 Å²	11.6	20%	0.196	6%	0.064	C	C	.	.	H	α-helix	trans	-62.5	-42.8	172.8	-59.8	0	0	0	0	110.5	A179 K184 R185 V212 H213	A179-T181 PolarHBondContact O-N 2.62Å; A179-T181 VanDerWaalsContact O-N 3.14Å; T181-K184 PolarHBondContact O-N 3.41Å; T181-R185 WeakPolarHBondContact O-CG 3.35Å; T181-R185 PolarHBondContact O-N 3.37Å; T181-R185 VanDerWaalsContact O-N 3.08Å; T181-V212 HydrophobicContact CG2-CB 4.49Å; T181-V212 HydrophobicContact CG2-CG1 3.97Å; T181-V212 WeakPolarHBondContact O-CG1 3.35Å; T181-H213 PolarHBondContact OG1-CE1 3.43Å; T181-H213 VanDerWaalsContact OG1-CE1 3.27Å; T181-H213 PolarHBondContact OG1-NE2 2.79Å; T181-H213 VanDerWaalsContact OG1-NE2 3.17Å
182	N	94.8	Very high	96.2	Very high	19 Å²	19	15.4 Å²	15.4	10%	0.102	8%	0.082	C	C	.	.	H	α-helix	trans	-70.9	-42	178.1	-73.5	-4.1	0	0	0	111.2	A179 C180 K184 R185 V186 F369 P370	A179-N182 PolarHBondContact O-N 3.25Å; C180-N182 VanDerWaalsContact C-N 3.33Å; N182-K184 VanDerWaalsContact C-N 3.34Å; N182-K184 PolarHBondContact O-N 3.38Å; N182-R185 WeakPolarHBondContact O-CB 3.36Å; N182-R185 PolarHBondContact O-N 3.49Å; N182-R185 VanDerWaalsContact O-N 3.13Å; N182-V186 WeakPolarHBondContact O-CG2 3.36Å; N182-V186 PolarHBondContact O-N 2.86Å; N182-F369 HydrophobicContact CB-CE1 4.31Å; N182-F369 HydrophobicContact CB-CE2 3.86Å; N182-F369 HydrophobicContact CB-CZ 3.59Å; N182-P370 HydrophobicContact CB-CB 4.27Å; N182-P370 HydrophobicContact CB-CG 4.23Å; N182-P370 PolarHBondContact ND2-O 3.05Å; N182-P370 VanDerWaalsContact ND2-O 3.12Å
183	W	96.9	Very high	95.9	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-61.8	-39.2	173.4	-77.4	115.9	0	0	0	113.1	Y172 A179 R185 V186 M187 F246 F248 A354 L357 L358 F369	Y172-W183 HydrophobicContact CD1-CB 4.18Å; Y172-W183 HydrophobicContact CE1-CB 3.38Å; Y172-W183 HydrophobicContact CE1-CG 4.35Å; Y172-W183 HydrophobicContact CE2-CB 4.22Å; Y172-W183 HydrophobicContact CE2-CG 4.38Å; Y172-W183 VanDerWaalsContact CZ-CB 3.42Å; Y172-W183 AromaticContact CZ-CG 3.96Å; Y172-W183 WeakPolarHBondContact OH-CB 3.34Å; A179-W183 PolarHBondContact O-N 2.94Å; W183-R185 VanDerWaalsContact C-N 3.32Å; W183-R185 PolarHBondContact O-N 3.36Å; W183-V186 HydrophobicContact CE3-CB 4.24Å; W183-V186 HydrophobicContact CE3-CG1 4.22Å; W183-V186 HydrophobicContact CE3-CG2 4.46Å; W183-V186 HydrophobicContact CZ3-CG1 4.22Å; W183-V186 WeakPolarHBondContact O-CB 3.46Å; W183-V186 PolarHBondContact O-N 3.14Å; W183-M187 WeakPolarHBondContact O-CG 3.18Å; W183-M187 PolarHBondContact O-N 3.34Å; W183-F246 AromaticContact CD2-CE2 3.95Å; W183-F246 HydrophobicContact CD2-CE2 3.95Å; W183-F246 HydrophobicContact CD2-CZ 4.37Å; W183-F246 AromaticContact CE3-CE2 3.81Å; W183-F246 HydrophobicContact CE3-CE2 3.81Å; W183-F246 AromaticContact CE3-CZ 3.82Å; W183-F246 HydrophobicContact CE3-CZ 3.82Å; W183-F246 HydrophobicContact CG-CE2 4.49Å; W183-F246 HydrophobicContact CZ3-CE2 4.17Å; W183-F246 HydrophobicContact CZ3-CZ 4.15Å; W183-F248 AromaticContact CD1-CD2 3.95Å; W183-F248 HydrophobicContact CD2-CD2 4.44Å; W183-F248 HydrophobicContact CD2-CE2 4.23Å; W183-F248 AromaticContact CE2-CD2 3.69Å; W183-F248 AromaticContact CE2-CE2 3.3Å; W183-F248 AromaticContact CE2-CZ 3.61Å; W183-F248 HydrophobicContact CH2-CE2 4.09Å; W183-F248 HydrophobicContact CH2-CZ 4.18Å; W183-F248 HydrophobicContact CZ2-CD2 4.11Å; W183-F248 HydrophobicContact CZ2-CE1 4.03Å; W183-F248 AromaticContact CZ2-CE2 3.23Å; W183-F248 HydrophobicContact CZ2-CE2 3.23Å; W183-F248 AromaticContact CZ2-CZ 3.2Å; W183-F248 HydrophobicContact CZ2-CZ 3.2Å; W183-F248 AromaticContact NE1-CD1 3.8Å; W183-F248 AromaticContact NE1-CD2 3.29Å; W183-F248 VanDerWaalsContact NE1-CD2 3.29Å; W183-F248 AromaticContact NE1-CE1 3.85Å; W183-F248 AromaticContact NE1-CE2 3.37Å; W183-F248 AromaticContact NE1-CG 3.55Å; W183-F248 AromaticContact NE1-CZ 3.66Å; W183-A354 HydrophobicContact CH2-CB 3.93Å; W183-A354 HydrophobicContact CZ2-CB 3.62Å; W183-L357 HydrophobicContact CH2-CB 4.5Å; W183-L357 HydrophobicContact CH2-CD2 3.65Å; W183-L357 HydrophobicContact CH2-CG 4.38Å; W183-L357 HydrophobicContact CZ2-CD2 4.18Å; W183-L357 HydrophobicContact CZ3-CD2 3.99Å; W183-L358 HydrophobicContact CZ3-CD2 4.28Å; W183-F369 AromaticContact CD1-CE2 3.92Å; W183-F369 HydrophobicContact CD2-CD2 4.15Å; W183-F369 AromaticContact CD2-CE2 3.52Å; W183-F369 HydrophobicContact CD2-CE2 3.52Å; W183-F369 HydrophobicContact CD2-CZ 4.44Å; W183-F369 AromaticContact CE2-CD2 3.92Å; W183-F369 AromaticContact CE2-CE2 3.33Å; W183-F369 AromaticContact CE2-CZ 3.98Å; W183-F369 HydrophobicContact CE3-CD2 4.23Å; W183-F369 HydrophobicContact CE3-CE2 4.03Å; W183-F369 AromaticContact CG-CE2 3.86Å; W183-F369 HydrophobicContact CG-CE2 3.86Å; W183-F369 HydrophobicContact CG-CZ 4.49Å; W183-F369 AromaticContact CH2-CD2 3.85Å; W183-F369 HydrophobicContact CH2-CD2 3.85Å; W183-F369 HydrophobicContact CH2-CE2 4.13Å; W183-F369 AromaticContact CZ2-CD2 3.76Å; W183-F369 HydrophobicContact CZ2-CD2 3.76Å; W183-F369 AromaticContact CZ2-CE2 3.65Å; W183-F369 HydrophobicContact CZ2-CE2 3.65Å; W183-F369 HydrophobicContact CZ2-CZ 4.37Å; W183-F369 HydrophobicContact CZ3-CD2 4.11Å; W183-F369 HydrophobicContact CZ3-CE2 4.32Å; W183-F369 AromaticContact NE1-CE2 3.63Å; W183-F369 AromaticContact NE1-CZ 3.83Å
184	K	96.9	Very high	95.6	Very high	13 Å²	13	19.4 Å²	19.4	6%	0.057	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-39.1	173.1	-77.6	-179.2	-178.3	-169.7	0	111.7	I163 Y172 C180 T181 N182 M187 I188 V212 H218	I163-K184 HydrophobicContact CD1-CD 4.5Å; I163-K184 HydrophobicContact CD1-CG 3.9Å; Y172-K184 HydrophobicContact CE1-CG 4.46Å; C180-K184 VanDerWaalsContact O-CB 3.29Å; C180-K184 WeakPolarHBondContact O-CB 3.3Å; C180-K184 VanDerWaalsContact O-CG 3.24Å; C180-K184 WeakPolarHBondContact O-CG 3.45Å; C180-K184 PolarHBondContact O-N 2.96Å; T181-K184 PolarHBondContact O-N 3.41Å; N182-K184 VanDerWaalsContact C-N 3.34Å; N182-K184 PolarHBondContact O-N 3.38Å; K184-M187 PolarHBondContact O-N 3.43Å; K184-I188 WeakPolarHBondContact O-CG1 3.47Å; K184-I188 PolarHBondContact O-N 3.14Å; K184-V212 HydrophobicContact CB-CG1 3.43Å; K184-V212 VanDerWaalsContact CB-CG1 3.43Å; K184-V212 HydrophobicContact CD-CG1 4.2Å; K184-V212 HydrophobicContact CG-CG1 4.44Å; K184-H218 PolarHBondContact O-CE1 3.31Å
185	R	96.3	Very high	95.3	Very high	39 Å²	39	23.4 Å²	23.4	15%	0.147	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-43.6	173.6	-69.5	164.7	153.5	173	-8.6	111.8	T181 N182 W183 M187 I188 V189 P204 I207 V212	T181-R185 WeakPolarHBondContact O-CG 3.35Å; T181-R185 PolarHBondContact O-N 3.37Å; T181-R185 VanDerWaalsContact O-N 3.08Å; N182-R185 WeakPolarHBondContact O-CB 3.36Å; N182-R185 PolarHBondContact O-N 3.49Å; N182-R185 VanDerWaalsContact O-N 3.13Å; W183-R185 VanDerWaalsContact C-N 3.32Å; W183-R185 PolarHBondContact O-N 3.36Å; R185-M187 VanDerWaalsContact C-N 3.34Å; R185-M187 PolarHBondContact O-N 3.13Å; R185-I188 WeakPolarHBondContact O-CB 3.17Å; R185-I188 PolarHBondContact O-N 3.07Å; R185-V189 PolarHBondContact O-N 3.16Å; R185-P204 HydrophobicContact CB-CB 3.65Å; R185-P204 WeakPolarHBondContact CB-O 2.91Å; R185-P204 WeakPolarHBondContact CD-O 3.09Å; R185-P204 WeakPolarHBondContact CG-O 3.36Å; R185-P204 PolarHBondContact NE-O 3.45Å; R185-I207 HydrophobicContact CB-CD1 4.11Å; R185-I207 HydrophobicContact CG-CB 4.14Å; R185-I207 HydrophobicContact CG-CD1 4.41Å; R185-I207 HydrophobicContact CG-CG2 4.38Å; R185-I207 PolarHBondContact NE-O 3.37Å; R185-I207 PolarHBondContact NH2-O 2.88Å; R185-V212 HydrophobicContact CG-CG1 4.21Å; R185-V212 HydrophobicContact CG-CG2 3.42Å; R185-V212 VanDerWaalsContact CG-CG2 3.42Å
186	V	96.9	Very high	95	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-56.6	-48	172.3	169.6	0	0	0	0	110.8	N182 W183 I188 V189 L190 P204 L358 L367 F369	N182-V186 WeakPolarHBondContact O-CG2 3.36Å; N182-V186 PolarHBondContact O-N 2.86Å; W183-V186 HydrophobicContact CE3-CB 4.24Å; W183-V186 HydrophobicContact CE3-CG1 4.22Å; W183-V186 HydrophobicContact CE3-CG2 4.46Å; W183-V186 HydrophobicContact CZ3-CG1 4.22Å; W183-V186 WeakPolarHBondContact O-CB 3.46Å; W183-V186 PolarHBondContact O-N 3.14Å; V186-I188 VanDerWaalsContact C-N 3.29Å; V186-I188 PolarHBondContact O-N 3.3Å; V186-V189 PolarHBondContact O-N 3.29Å; V186-L190 HydrophobicContact CG1-CD1 3.9Å; V186-L190 HydrophobicContact CG1-CG 4.29Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.39Å; V186-P204 HydrophobicContact CG2-CB 4.48Å; V186-P204 HydrophobicContact CG2-CG 4.21Å; V186-L358 HydrophobicContact CG1-CD2 4.3Å; V186-L367 HydrophobicContact CG1-CD1 3.94Å; V186-L367 HydrophobicContact CG1-CD2 4.04Å; V186-L367 HydrophobicContact CG2-CD1 3.99Å; V186-F369 HydrophobicContact CG2-CD2 4.12Å
187	M	97.6	Very high	94.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-34.5	177.8	-65.2	-51.4	-67	0	0	113.1	I163 D165 I170 Y172 W183 K184 R185 S191 F246	I163-M187 HydrophobicContact CG2-CB 4.2Å; I163-M187 HydrophobicContact CG2-CE 4.01Å; I163-M187 HydrophobicContact CG2-CG 4.2Å; D165-M187 HydrophobicContact CB-CE 3.71Å; I170-M187 HydrophobicContact CB-CE 4.34Å; I170-M187 HydrophobicContact CG2-CE 3.85Å; I170-M187 HydrophobicContact CG2-SD 4.15Å; Y172-M187 HydrophobicContact CD1-CG 3.84Å; Y172-M187 HydrophobicContact CG-CG 4.39Å; W183-M187 WeakPolarHBondContact O-CG 3.18Å; W183-M187 PolarHBondContact O-N 3.34Å; K184-M187 PolarHBondContact O-N 3.43Å; R185-M187 VanDerWaalsContact C-N 3.34Å; R185-M187 PolarHBondContact O-N 3.13Å; M187-S191 VanDerWaalsContact O-CB 3.29Å; M187-S191 WeakPolarHBondContact O-CB 3.19Å; M187-S191 PolarHBondContact O-N 3.09Å; M187-S191 PolarHBondContact O-OG 3.09Å; M187-F246 HydrophobicContact SD-CE1 4.41Å; M187-F246 HydrophobicContact SD-CZ 4.36Å
188	I	96.6	Very high	94.5	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-46	175.3	-70.4	163.3	0	0	0	111	K184 R185 V186 S191 E192 S193 L194 I207 T217	K184-I188 WeakPolarHBondContact O-CG1 3.47Å; K184-I188 PolarHBondContact O-N 3.14Å; R185-I188 WeakPolarHBondContact O-CB 3.17Å; R185-I188 PolarHBondContact O-N 3.07Å; V186-I188 VanDerWaalsContact C-N 3.29Å; V186-I188 PolarHBondContact O-N 3.3Å; I188-S191 PolarHBondContact O-OG 3.2Å; I188-E192 WeakPolarHBondContact O-CA 3.45Å; I188-E192 PolarHBondContact O-N 2.83Å; I188-S193 PolarHBondContact O-N 3.26Å; I188-L194 HydrophobicContact CG2-CB 3.53Å; I188-L194 HydrophobicContact CG2-CD2 4.46Å; I188-I207 HydrophobicContact CB-CD1 3.73Å; I188-I207 HydrophobicContact CD1-CD1 4.36Å; I188-I207 HydrophobicContact CD1-CG2 4.04Å; I188-I207 HydrophobicContact CG2-CD1 3.54Å; I188-I207 HydrophobicContact CG2-CG1 4.43Å; I188-T217 HydrophobicContact CD1-CG2 3.5Å; I188-T217 VanDerWaalsContact CD1-CG2 3.5Å; I188-T217 HydrophobicContact CG1-CG2 3.56Å
189	V	96.6	Very high	94.4	Very high	15 Å²	15	41.4 Å²	41.4	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-46.5	177.5	173.8	0	0	0	0	110.6	R185 V186 E192 R202 P204 I207 L367	R185-V189 PolarHBondContact O-N 3.16Å; V186-V189 PolarHBondContact O-N 3.29Å; V189-E192 PolarHBondContact O-N 3.17Å; V189-R202 WeakPolarHBondContact CG1-O 3.35Å; V189-P204 HydrophobicContact CG2-CB 4.25Å; V189-P204 HydrophobicContact CG2-CG 3.97Å; V189-I207 HydrophobicContact CG2-CD1 3.87Å; V189-L367 HydrophobicContact CB-CD2 3.96Å; V189-L367 HydrophobicContact CG1-CB 4.47Å; V189-L367 HydrophobicContact CG1-CD2 3.66Å
190	L	96.4	Very high	94.5	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-64.8	-45.6	-179.2	-67	179.3	0	0	0	112.8	R167 H168 I170 V186 E192 V363 L367	R167-L190 PolarHBondContact NH1-O 2.86Å; H168-L190 PolarHBondContact CE1-O 2.77Å; I170-L190 HydrophobicContact CD1-CD1 3.83Å; V186-L190 HydrophobicContact CG1-CD1 3.9Å; V186-L190 HydrophobicContact CG1-CG 4.29Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.39Å; L190-E192 VanDerWaalsContact C-N 3.26Å; L190-E192 PolarHBondContact O-N 3.44Å; L190-V363 HydrophobicContact CD2-CB 3.92Å; L190-V363 HydrophobicContact CD2-CG1 3.83Å; L190-V363 HydrophobicContact CD2-CG2 4.23Å; L190-L367 HydrophobicContact CD2-CD2 3.64Å; L190-L367 HydrophobicContact CG-CD2 3.88Å
191	S	95.1	Very high	94.5	Very high	32 Å²	32	43.3 Å²	43.3	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-78.2	-11.7	-179	62.2	0	0	0	0	113.6	M187 I188 S193	M187-S191 VanDerWaalsContact O-CB 3.29Å; M187-S191 WeakPolarHBondContact O-CB 3.19Å; M187-S191 PolarHBondContact O-N 3.09Å; M187-S191 PolarHBondContact O-OG 3.09Å; I188-S191 PolarHBondContact O-OG 3.2Å; S191-S193 PolarHBondContact O-N 3.27Å; S191-S193 VanDerWaalsContact OG-CB 3.32Å; S191-S193 WeakPolarHBondContact OG-CB 3.35Å; S191-S193 PolarHBondContact OG-OG 3.44Å
192	E	94.8	Very high	94.5	Very high	80 Å²	80	51.6 Å²	51.6	37%	0.374	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	30.6	-171.4	-62.9	174.9	-163.4	0	0	112.1	R167 I188 V189 L190 L194 P200	R167-E192 IonicContact CZ-OE1 3.47Å; R167-E192 VanDerWaalsContact CZ-OE1 3.22Å; R167-E192 IonicContact CZ-OE2 3.93Å; R167-E192 IonicContact NH1-OE1 2.75Å; R167-E192 PolarHBondContact NH1-OE1 3.41Å; R167-E192 IonicContact NH1-OE2 3.22Å; R167-E192 IonicContact NH2-OE1 3.37Å; R167-E192 PolarHBondContact NH2-OE1 2.94Å; R167-E192 IonicContact NH2-OE2 3.48Å; R167-E192 PolarHBondContact NH2-OE2 2.81Å; I188-E192 WeakPolarHBondContact O-CA 3.45Å; I188-E192 PolarHBondContact O-N 2.83Å; V189-E192 PolarHBondContact O-N 3.17Å; L190-E192 VanDerWaalsContact C-N 3.26Å; L190-E192 PolarHBondContact O-N 3.44Å; E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.01Å; E192-P200 HydrophobicContact CB-CB 3.82Å; E192-P200 HydrophobicContact CB-CG 3.98Å; E192-P200 HydrophobicContact CG-CB 3.73Å; E192-P200 HydrophobicContact CG-CG 4.01Å
193	S	92.6	Very high	94.4	Very high	52 Å²	52	54 Å²	54	36%	0.364	29%	0.285	S	S	.	.			trans	-75.8	-14	-170.4	70.1	0	0	0	0	114.6	I188 S191 T217	I188-S193 PolarHBondContact O-N 3.26Å; S191-S193 PolarHBondContact O-N 3.27Å; S191-S193 VanDerWaalsContact OG-CB 3.32Å; S191-S193 WeakPolarHBondContact OG-CB 3.35Å; S191-S193 PolarHBondContact OG-OG 3.44Å; S193-T217 VanDerWaalsContact CB-O 3.3Å; S193-T217 WeakPolarHBondContact CB-O 3.26Å; S193-T217 PolarHBondContact OG-O 3.16Å
194	L	93	Very high	94.2	Very high	32 Å²	32	54.1 Å²	54.1	17%	0.168	29%	0.285	C	S	.	.	S	Bend	trans	-125.3	135.1	178.4	-167	69	0	0	0	109.3	I188 E192 Y201 I207 H211 T217	I188-L194 HydrophobicContact CG2-CB 3.53Å; I188-L194 HydrophobicContact CG2-CD2 4.46Å; E192-L194 VanDerWaalsContact C-N 3.27Å; E192-L194 PolarHBondContact O-N 3.01Å; L194-Y201 HydrophobicContact CB-CD2 4.14Å; L194-Y201 HydrophobicContact CB-CE2 4.32Å; L194-Y201 HydrophobicContact CD2-CD2 4.1Å; L194-Y201 HydrophobicContact CD2-CE2 3.65Å; L194-Y201 HydrophobicContact CG-CD2 4.1Å; L194-Y201 HydrophobicContact CG-CE2 3.75Å; L194-Y201 WeakPolarHBondContact O-CD2 3.36Å; L194-I207 HydrophobicContact CD2-CG2 4.14Å; L194-H211 HydrophobicContact CD2-CB 3.75Å; L194-T217 HydrophobicContact CB-CG2 4.44Å
195	L	92.1	Very high	94	Very high	100 Å²	100	56.8 Å²	56.8	52%	0.524	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.3	-179.6	-53.1	179.3	0	0	0	109.8	V199 P200	L195-V199 CarbonylContact C-O 3.55Å; L195-V199 WeakPolarHBondContact CA-O 3.08Å; L195-P200 HydrophobicContact CD2-CB 4.18Å; L195-P200 HydrophobicContact CD2-CG 3.74Å
196	D	90.3	Very high	93.8	Very high	85 Å²	85	60 Å²	60	46%	0.455	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.7	163.6	-175.5	29.6	0	0	0	108.7	G198 V199 Y201	D196-G198 PolarHBondContact O-N 2.97Å; D196-V199 PolarHBondContact N-O 3.31Å; D196-V199 PolarHBondContact O-N 3.07Å; D196-Y201 HydrophobicContact CB-CD2 4.47Å; D196-Y201 HydrophobicContact CB-CE1 4.17Å; D196-Y201 HydrophobicContact CB-CE2 3.83Å
197	Q	89.4	Confident	93.7	Very high	188 Å²	188	59.9 Å²	59.9	88%	0.879	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	34.1	-176.8	-56.3	-175.9	-13.7	0	0	114.3	V199	Q197-V199 VanDerWaalsContact C-N 3.35Å
198	G	92.3	Very high	93.3	Very high	60 Å²	60	61.7 Å²	61.7	62%	0.619	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	2.2	-178.9	0	0	0	0	0	115.1	D196	D196-G198 PolarHBondContact O-N 2.97Å
199	V	93.8	Very high	92.8	Very high	82 Å²	82	67 Å²	67	50%	0.497	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.2	179.2	-175.3	0	0	0	0	110	L195 D196 Q197	L195-V199 CarbonylContact C-O 3.55Å; L195-V199 WeakPolarHBondContact CA-O 3.08Å; D196-V199 PolarHBondContact N-O 3.31Å; D196-V199 PolarHBondContact O-N 3.07Å; Q197-V199 VanDerWaalsContact C-N 3.35Å
200	P	94.4	Very high	92.3	Very high	39 Å²	39	72.5 Å²	72.5	25%	0.253	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	144	174.9	-22.3	32.7	0	0	0	112.9	E192 L195	E192-P200 HydrophobicContact CB-CB 3.82Å; E192-P200 HydrophobicContact CB-CG 3.98Å; E192-P200 HydrophobicContact CG-CB 3.73Å; E192-P200 HydrophobicContact CG-CG 4.01Å; L195-P200 HydrophobicContact CD2-CB 4.18Å; L195-P200 HydrophobicContact CD2-CG 3.74Å
201	Y	94.3	Very high	91.9	Very high	33 Å²	33	75.8 Å²	75.8	13%	0.129	39%	0.391	C	S	.	.			trans	-60.7	138.1	171	-76.5	-91.4	0	0	0	111.1	L194 D196 D206 I207	L194-Y201 HydrophobicContact CB-CD2 4.14Å; L194-Y201 HydrophobicContact CB-CE2 4.32Å; L194-Y201 HydrophobicContact CD2-CD2 4.1Å; L194-Y201 HydrophobicContact CD2-CE2 3.65Å; L194-Y201 HydrophobicContact CG-CD2 4.1Å; L194-Y201 HydrophobicContact CG-CE2 3.75Å; L194-Y201 WeakPolarHBondContact O-CD2 3.36Å; D196-Y201 HydrophobicContact CB-CD2 4.47Å; D196-Y201 HydrophobicContact CB-CE1 4.17Å; D196-Y201 HydrophobicContact CB-CE2 3.83Å; Y201-D206 HydrophobicContact CD1-CB 3.93Å; Y201-D206 HydrophobicContact CE1-CB 4.17Å; Y201-I207 HydrophobicContact CD1-CG1 3.58Å; Y201-I207 HydrophobicContact CD2-CG1 4.17Å; Y201-I207 HydrophobicContact CE1-CG1 4.13Å; Y201-I207 HydrophobicContact CG-CD1 4.32Å; Y201-I207 HydrophobicContact CG-CG1 3.59Å
202	R	92.6	Very high	91.7	Very high	205 Å²	205	74.3 Å²	74.3	77%	0.774	38%	0.38	S	S	*	.			trans	-108.4	-39.3	178.8	-64.9	-173.3	177	-179.1	-0.6	113	V189	V189-R202 WeakPolarHBondContact CG1-O 3.35Å
203	D	92.8	Very high	91.4	Very high	71 Å²	71	74.3 Å²	74.3	38%	0.38	38%	0.38	S	S	.	.	S	Bend	trans	-96.9	125.4	174.3	-165.8	-35.9	0	0	0	109.6	L205 D206	D203-L205 PolarHBondContact O-N 3.39Å; D203-L205 WeakPolarHBondContact OD1-CB 3.23Å; D203-L205 PolarHBondContact OD1-N 3.19Å; D203-D206 HydrophobicContact CB-CB 4.44Å; D203-D206 WeakPolarHBondContact CB-OD2 3.3Å; D203-D206 PolarHBondContact O-N 3.49Å
204	P	93.9	Very high	91.2	Very high	2 Å²	2	75.2 Å²	75.2	1%	0.013	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.9	175.4	-18	27.5	0	0	0	113.8	R185 V186 V189 D206 I207 L367 P370	R185-P204 HydrophobicContact CB-CB 3.65Å; R185-P204 WeakPolarHBondContact CB-O 2.91Å; R185-P204 WeakPolarHBondContact CD-O 3.09Å; R185-P204 WeakPolarHBondContact CG-O 3.36Å; R185-P204 PolarHBondContact NE-O 3.45Å; V186-P204 HydrophobicContact CG2-CB 4.48Å; V186-P204 HydrophobicContact CG2-CG 4.21Å; V189-P204 HydrophobicContact CG2-CB 4.25Å; V189-P204 HydrophobicContact CG2-CG 3.97Å; P204-D206 VanDerWaalsContact C-N 3.34Å; P204-I207 PolarHBondContact O-N 3.4Å; P204-L367 HydrophobicContact CG-CB 4.42Å; P204-P370 HydrophobicContact CB-CG 3.6Å; P204-P370 HydrophobicContact CG-CG 4.14Å
205	L	91.9	Very high	90.5	Very high	70 Å²	70	78.3 Å²	78.3	37%	0.366	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-71.3	-26.4	178.5	-74.9	175.9	0	0	0	113.5	D203 I207 P370	D203-L205 PolarHBondContact O-N 3.39Å; D203-L205 WeakPolarHBondContact OD1-CB 3.23Å; D203-L205 PolarHBondContact OD1-N 3.19Å; L205-I207 PolarHBondContact O-N 3.16Å; L205-P370 HydrophobicContact CD2-CB 3.74Å; L205-P370 HydrophobicContact CG-CB 4.02Å; L205-P370 HydrophobicContact CG-CG 4.49Å
206	D	93.4	Very high	90.2	Very high	105 Å²	105	76.8 Å²	76.8	56%	0.561	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-69.6	-18.9	178.3	-68	-18.9	0	0	0	112.1	Y201 D203 P204 P208	Y201-D206 HydrophobicContact CD1-CB 3.93Å; Y201-D206 HydrophobicContact CE1-CB 4.17Å; D203-D206 HydrophobicContact CB-CB 4.44Å; D203-D206 WeakPolarHBondContact CB-OD2 3.3Å; D203-D206 PolarHBondContact O-N 3.49Å; P204-D206 VanDerWaalsContact C-N 3.34Å; D206-P208 WeakPolarHBondContact O-CD 3.4Å
207	I	93	Very high	90.2	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.382	C	S	.	.	S	Bend	trans	-76.4	116.8	-177.8	-58.6	166.5	0	0	0	110.4	R185 I188 V189 L194 Y201 P204 L205 V212	R185-I207 HydrophobicContact CB-CD1 4.11Å; R185-I207 HydrophobicContact CG-CB 4.14Å; R185-I207 HydrophobicContact CG-CD1 4.41Å; R185-I207 HydrophobicContact CG-CG2 4.38Å; R185-I207 PolarHBondContact NE-O 3.37Å; R185-I207 PolarHBondContact NH2-O 2.88Å; I188-I207 HydrophobicContact CB-CD1 3.73Å; I188-I207 HydrophobicContact CD1-CD1 4.36Å; I188-I207 HydrophobicContact CD1-CG2 4.04Å; I188-I207 HydrophobicContact CG2-CD1 3.54Å; I188-I207 HydrophobicContact CG2-CG1 4.43Å; V189-I207 HydrophobicContact CG2-CD1 3.87Å; L194-I207 HydrophobicContact CD2-CG2 4.14Å; Y201-I207 HydrophobicContact CD1-CG1 3.58Å; Y201-I207 HydrophobicContact CD2-CG1 4.17Å; Y201-I207 HydrophobicContact CE1-CG1 4.13Å; Y201-I207 HydrophobicContact CG-CD1 4.32Å; Y201-I207 HydrophobicContact CG-CG1 3.59Å; P204-I207 PolarHBondContact O-N 3.4Å; L205-I207 PolarHBondContact O-N 3.16Å; I207-V212 HydrophobicContact CG2-CG2 3.69Å
208	P	90.3	Very high	90.5	Very high	40 Å²	40	65 Å²	65	26%	0.26	34%	0.342	S	S	.	.			trans	-65.5	146	179.1	-19.8	32.7	0	0	0	112.8	D206 E210 H211 V212	D206-P208 WeakPolarHBondContact O-CD 3.4Å; P208-E210 VanDerWaalsContact C-N 3.29Å; P208-E210 HydrophobicContact CB-CG 4.13Å; P208-E210 WeakPolarHBondContact CB-OE1 3.18Å; P208-E210 VanDerWaalsContact CB-OE2 3.3Å; P208-E210 WeakPolarHBondContact CB-OE2 3.37Å; P208-E210 PolarHBondContact O-N 2.03Å; P208-H211 PolarHBondContact O-N 2.64Å; P208-H211 VanDerWaalsContact O-N 3.09Å; P208-V212 WeakPolarHBondContact O-CG2 3.21Å; P208-V212 PolarHBondContact O-N 3.34Å
209	R	86.1	Confident	90.6	Very high	112 Å²	112	64 Å²	64	42%	0.423	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-34.5	-169.6	-174.7	177.2	-179.1	-160.4	-1.9	112.9	H211 V212 H213	R209-H211 PolarHBondContact O-N 3.23Å; R209-V212 PolarHBondContact O-N 2.8Å; R209-H213 PolarHBondContact O-CD2 3.37Å
210	E	85.9	Confident	90.8	Very high	131 Å²	131	60.4 Å²	60.4	61%	0.612	30%	0.301	S	S	*	.	H	α-helix	trans	-57.4	-36.1	175.8	57.5	-88.4	-149.4	0	0	112.2	P208	P208-E210 VanDerWaalsContact C-N 3.29Å; P208-E210 HydrophobicContact CB-CG 4.13Å; P208-E210 WeakPolarHBondContact CB-OE1 3.18Å; P208-E210 VanDerWaalsContact CB-OE2 3.3Å; P208-E210 WeakPolarHBondContact CB-OE2 3.37Å; P208-E210 PolarHBondContact O-N 2.03Å
211	H	88.4	Confident	90.9	Very high	73 Å²	73	58.5 Å²	58.5	34%	0.338	29%	0.289	S	S	.	.	H	α-helix	trans	-82	-29.4	178.9	-62.7	-59.2	0	0	0	112.6	L194 P208 R209 H213 N214 T217	L194-H211 HydrophobicContact CD2-CB 3.75Å; P208-H211 PolarHBondContact O-N 2.64Å; P208-H211 VanDerWaalsContact O-N 3.09Å; R209-H211 PolarHBondContact O-N 3.23Å; H211-H213 VanDerWaalsContact C-N 3.3Å; H211-H213 PolarHBondContact O-N 3.09Å; H211-N214 PolarHBondContact O-N 3.46Å; H211-T217 PolarHBondContact O-OG1 3.19Å
212	V	90.9	Very high	91	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-38.4	-179.5	-179.8	0	0	0	0	112.2	T181 K184 R185 I207 P208 R209 H218	T181-V212 HydrophobicContact CG2-CB 4.49Å; T181-V212 HydrophobicContact CG2-CG1 3.97Å; T181-V212 WeakPolarHBondContact O-CG1 3.35Å; K184-V212 HydrophobicContact CB-CG1 3.43Å; K184-V212 VanDerWaalsContact CB-CG1 3.43Å; K184-V212 HydrophobicContact CD-CG1 4.2Å; K184-V212 HydrophobicContact CG-CG1 4.44Å; R185-V212 HydrophobicContact CG-CG1 4.21Å; R185-V212 HydrophobicContact CG-CG2 3.42Å; R185-V212 VanDerWaalsContact CG-CG2 3.42Å; I207-V212 HydrophobicContact CG2-CG2 3.69Å; P208-V212 WeakPolarHBondContact O-CG2 3.21Å; P208-V212 PolarHBondContact O-N 3.34Å; R209-V212 PolarHBondContact O-N 2.8Å; V212-H218 PolarHBondContact O-NE2 3.35Å
213	H	88	Confident	91.2	Very high	80 Å²	80	51.8 Å²	51.8	37%	0.37	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-2.5	-176.8	-64.8	-66.8	0	0	0	113.5	T181 R209 H211 T215	T181-H213 PolarHBondContact OG1-CE1 3.43Å; T181-H213 VanDerWaalsContact OG1-CE1 3.27Å; T181-H213 PolarHBondContact OG1-NE2 2.79Å; T181-H213 VanDerWaalsContact OG1-NE2 3.17Å; R209-H213 PolarHBondContact O-CD2 3.37Å; H211-H213 VanDerWaalsContact C-N 3.3Å; H211-H213 PolarHBondContact O-N 3.09Å; H213-T215 PolarHBondContact O-N 3.26Å
214	N	87.9	Confident	91.3	Very high	72 Å²	72	48.4 Å²	48.4	39%	0.385	25%	0.25	S	S	.	.			trans	-65.9	124.8	176.7	-175	-32.6	0	0	0	110	H211 S216 T217	H211-N214 PolarHBondContact O-N 3.46Å; N214-S216 PolarHBondContact O-N 2.94Å; N214-S216 VanDerWaalsContact O-N 3.13Å; N214-S216 WeakPolarHBondContact OD1-CB 3.47Å; N214-S216 PolarHBondContact OD1-N 2.84Å; N214-T217 WeakPolarHBondContact O-CB 3.3Å; N214-T217 PolarHBondContact O-N 3.42Å; N214-T217 VanDerWaalsContact O-N 3.14Å; N214-T217 PolarHBondContact O-OG1 3.47Å
215	T	80.1	Confident	91.3	Very high	96 Å²	96	55 Å²	55	59%	0.589	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-55.1	-33.5	-178.2	-54	0	0	0	0	111.8	H213 K223	H213-T215 PolarHBondContact O-N 3.26Å; T215-K223 VanDerWaalsContact O-CE 3.22Å; T215-K223 WeakPolarHBondContact O-CE 3.34Å; T215-K223 PolarHBondContact O-NZ 2.91Å
216	S	85.7	Confident	91.3	Very high	69 Å²	69	59.7 Å²	59.7	48%	0.483	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-72.6	-25.8	-177.1	-64.9	0	0	0	0	114.1	N214 H218 K223	N214-S216 PolarHBondContact O-N 2.94Å; N214-S216 VanDerWaalsContact O-N 3.13Å; N214-S216 WeakPolarHBondContact OD1-CB 3.47Å; N214-S216 PolarHBondContact OD1-N 2.84Å; S216-H218 VanDerWaalsContact C-N 3.33Å; S216-H218 PolarHBondContact O-N 3.03Å; S216-K223 PolarHBondContact O-NZ 2.81Å
217	T	90.1	Very high	91.2	Very high	14 Å²	14	61.5 Å²	61.5	9%	0.086	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-66.8	-30.1	-173	-53.8	0	0	0	0	113.9	I188 S193 L194 H211 N214	I188-T217 HydrophobicContact CD1-CG2 3.5Å; I188-T217 VanDerWaalsContact CD1-CG2 3.5Å; I188-T217 HydrophobicContact CG1-CG2 3.56Å; S193-T217 VanDerWaalsContact CB-O 3.3Å; S193-T217 WeakPolarHBondContact CB-O 3.26Å; S193-T217 PolarHBondContact OG-O 3.16Å; L194-T217 HydrophobicContact CB-CG2 4.44Å; H211-T217 PolarHBondContact O-OG1 3.19Å; N214-T217 WeakPolarHBondContact O-CB 3.3Å; N214-T217 PolarHBondContact O-N 3.42Å; N214-T217 VanDerWaalsContact O-N 3.14Å; N214-T217 PolarHBondContact O-OG1 3.47Å
218	H	94.2	Very high	91.3	Very high	10 Å²	10	64.6 Å²	64.6	5%	0.046	30%	0.299	C	S	.	.	S	Bend	trans	-109.5	130	-175.2	-59.8	-77.9	0	0	0	111.3	I163 K184 V212 S216 T220 K223	I163-H218 HydrophobicContact CD1-CB 4.1Å; I163-H218 HydrophobicContact CG1-CB 3.96Å; I163-H218 HydrophobicContact CG2-CB 4.05Å; K184-H218 PolarHBondContact O-CE1 3.31Å; V212-H218 PolarHBondContact O-NE2 3.35Å; S216-H218 VanDerWaalsContact C-N 3.33Å; S216-H218 PolarHBondContact O-N 3.03Å; H218-T220 HydrophobicContact CB-CG2 4.34Å; H218-T220 PolarHBondContact O-N 3.47Å; H218-K223 WeakPolarHBondContact O-CE 3.39Å; H218-K223 PolarHBondContact O-NZ 2.96Å
219	L	95.8	Very high	91.6	Very high	41 Å²	41	64 Å²	64	22%	0.215	30%	0.299	C	S	.	.			trans	-73.1	118.6	166.4	179.1	62.5	0	0	0	108.5	I163 V164 K223 F224	I163-L219 CarbonylContact C-O 3.54Å; I163-L219 WeakPolarHBondContact CA-O 3.41Å; V164-L219 PolarHBondContact N-O 2.7Å; L219-K223 HydrophobicContact CD1-CB 4.34Å; L219-F224 HydrophobicContact CD1-CD1 4.27Å; L219-F224 HydrophobicContact CD1-CE1 4.1Å; L219-F224 HydrophobicContact CD2-CE1 4Å; L219-F224 HydrophobicContact CG-CE1 3.91Å
220	T	97.1	Very high	92	Very high	5 Å²	5	66.8 Å²	66.8	3%	0.031	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-117	157.4	176.9	65	0	0	0	0	111.2	N160 L162 I163 H218 N222 K223 F224	N160-T220 WeakPolarHBondContact O-CG2 3.32Å; N160-T220 PolarHBondContact OD1-OG1 3.46Å; L162-T220 CarbonylContact O-C 3.54Å; L162-T220 WeakPolarHBondContact O-CA 3.5Å; L162-T220 WeakPolarHBondContact O-CB 3.47Å; I163-T220 HydrophobicContact CG1-CG2 3.98Å; H218-T220 HydrophobicContact CB-CG2 4.34Å; H218-T220 PolarHBondContact O-N 3.47Å; T220-N222 PolarHBondContact O-N 3.03Å; T220-K223 WeakPolarHBondContact O-CB 3.13Å; T220-K223 PolarHBondContact O-N 3.36Å; T220-F224 WeakPolarHBondContact O-CD1 3.18Å
221	F	97.4	Very high	92.4	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.6	-34.5	174.3	-83.4	-2.2	0	0	0	112.9	F151 L159 L162 V164 I171 K223 F224 M236 K239 L240	F151-F221 HydrophobicContact CZ-CD2 4.29Å; F151-F221 HydrophobicContact CZ-CE2 4.35Å; L159-F221 HydrophobicContact CB-CB 3.78Å; L159-F221 HydrophobicContact CD1-CB 4.34Å; L162-F221 HydrophobicContact CB-CB 4.23Å; L162-F221 HydrophobicContact CB-CD2 4.01Å; L162-F221 HydrophobicContact CB-CG 4.15Å; L162-F221 HydrophobicContact CD1-CB 4.49Å; L162-F221 HydrophobicContact CD1-CD2 3.49Å; L162-F221 VanDerWaalsContact CD1-CD2 3.49Å; L162-F221 HydrophobicContact CD1-CE2 4.09Å; L162-F221 HydrophobicContact CD1-CG 4.33Å; L162-F221 HydrophobicContact CG-CD2 4.38Å; L162-F221 PolarHBondContact O-N 3.05Å; V164-F221 HydrophobicContact CG2-CD1 3.31Å; V164-F221 HydrophobicContact CG2-CE1 3.34Å; V164-F221 HydrophobicContact CG2-CG 4.32Å; V164-F221 HydrophobicContact CG2-CZ 4.36Å; I171-F221 HydrophobicContact CD1-CE1 4.37Å; I171-F221 HydrophobicContact CD1-CE2 4.32Å; I171-F221 HydrophobicContact CD1-CZ 3.63Å; I171-F221 HydrophobicContact CG1-CZ 4.46Å; F221-K223 PolarHBondContact O-N 3.31Å; F221-K223 VanDerWaalsContact O-N 3.08Å; F221-F224 HydrophobicContact CD1-CD1 4.12Å; F221-F224 HydrophobicContact CD1-CD2 4.32Å; F221-F224 AromaticContact CD1-CE1 3.84Å; F221-F224 HydrophobicContact CD1-CE1 3.84Å; F221-F224 HydrophobicContact CD1-CE2 4.07Å; F221-F224 HydrophobicContact CD1-CG 4.36Å; F221-F224 AromaticContact CD1-CZ 3.83Å; F221-F224 HydrophobicContact CD1-CZ 3.83Å; F221-F224 HydrophobicContact CE1-CE1 4.34Å; F221-F224 HydrophobicContact CE1-CE2 4.03Å; F221-F224 AromaticContact CE1-CZ 3.87Å; F221-F224 HydrophobicContact CE1-CZ 3.87Å; F221-F224 WeakPolarHBondContact O-CB 3.29Å; F221-F224 PolarHBondContact O-N 3.32Å; F221-M236 HydrophobicContact CB-CE 4.02Å; F221-M236 HydrophobicContact CB-CG 4.38Å; F221-M236 HydrophobicContact CB-SD 4.36Å; F221-M236 HydrophobicContact CD1-CG 3.9Å; F221-M236 HydrophobicContact CD2-CB 4.26Å; F221-M236 HydrophobicContact CD2-CG 3.95Å; F221-M236 HydrophobicContact CD2-SD 4.37Å; F221-M236 HydrophobicContact CE1-CB 4.37Å; F221-M236 HydrophobicContact CE1-CG 4.1Å; F221-M236 HydrophobicContact CE2-CB 4.01Å; F221-M236 HydrophobicContact CE2-CG 4.16Å; F221-M236 HydrophobicContact CG-CE 4.46Å; F221-M236 HydrophobicContact CG-CG 3.83Å; F221-M236 HydrophobicContact CG-SD 4.34Å; F221-M236 HydrophobicContact CZ-CB 4.08Å; F221-M236 HydrophobicContact CZ-CG 4.23Å; F221-M236 WeakPolarHBondContact O-CE 3.42Å; F221-K239 HydrophobicContact CE1-CB 4.43Å; F221-K239 HydrophobicContact CE1-CD 4.31Å; F221-K239 HydrophobicContact CZ-CB 4.26Å; F221-L240 HydrophobicContact CE2-CD1 4.13Å; F221-L240 HydrophobicContact CE2-CD2 3.91Å; F221-L240 HydrophobicContact CE2-CG 3.81Å; F221-L240 HydrophobicContact CZ-CD2 4.37Å; F221-L240 HydrophobicContact CZ-CG 4.11Å
222	N	96.2	Very high	92.8	Very high	53 Å²	53	63 Å²	63	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-53.1	-33.1	172.2	-178.7	40.7	0	0	0	113.1	N156 Y157 L159 N160 T220	N156-N222 VanDerWaalsContact C-OD1 3.23Å; N156-N222 WeakPolarHBondContact O-CA 3.29Å; N156-N222 VanDerWaalsContact O-CB 3.3Å; N156-N222 WeakPolarHBondContact O-CB 3.35Å; N156-N222 PolarHBondContact O-OD1 3.23Å; Y157-N222 PolarHBondContact N-OD1 3.48Å; L159-N222 PolarHBondContact O-N 2.93Å; N160-N222 HydrophobicContact CB-CB 3.97Å; T220-N222 PolarHBondContact O-N 3.03Å
223	K	95.4	Very high	93.1	Very high	44 Å²	44	65.3 Å²	65.3	19%	0.191	31%	0.305	C	S	.	.	H	α-helix	trans	-82	-12.8	179.8	-61.8	178.2	178.4	-177	0	114.3	T215 S216 H218 L219 T220 F221 W225 R226 R227	T215-K223 VanDerWaalsContact O-CE 3.22Å; T215-K223 WeakPolarHBondContact O-CE 3.34Å; T215-K223 PolarHBondContact O-NZ 2.91Å; S216-K223 PolarHBondContact O-NZ 2.81Å; H218-K223 WeakPolarHBondContact O-CE 3.39Å; H218-K223 PolarHBondContact O-NZ 2.96Å; L219-K223 HydrophobicContact CD1-CB 4.34Å; T220-K223 WeakPolarHBondContact O-CB 3.13Å; T220-K223 PolarHBondContact O-N 3.36Å; F221-K223 PolarHBondContact O-N 3.31Å; F221-K223 VanDerWaalsContact O-N 3.08Å; K223-W225 VanDerWaalsContact C-N 3.28Å; K223-W225 PolarHBondContact O-N 3.01Å; K223-R226 PolarHBondContact O-N 3.04Å; K223-R226 VanDerWaalsContact O-N 3.15Å; K223-R227 PolarHBondContact O-N 3.34Å
224	F	96.1	Very high	93.5	Very high	0 Å²	0	67 Å²	67	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-35.1	-176.9	-88.2	41.6	0	0	0	112.2	V164 L219 T220 F221 R226 R227 Y228 L235 M236 K239	V164-F224 HydrophobicContact CB-CE1 4.4Å; V164-F224 HydrophobicContact CB-CZ 4.47Å; V164-F224 HydrophobicContact CG1-CZ 4.27Å; V164-F224 HydrophobicContact CG2-CE1 3.97Å; V164-F224 HydrophobicContact CG2-CZ 4.12Å; L219-F224 HydrophobicContact CD1-CD1 4.27Å; L219-F224 HydrophobicContact CD1-CE1 4.1Å; L219-F224 HydrophobicContact CD2-CE1 4Å; L219-F224 HydrophobicContact CG-CE1 3.91Å; T220-F224 WeakPolarHBondContact O-CD1 3.18Å; F221-F224 HydrophobicContact CD1-CD1 4.12Å; F221-F224 HydrophobicContact CD1-CD2 4.32Å; F221-F224 AromaticContact CD1-CE1 3.84Å; F221-F224 HydrophobicContact CD1-CE1 3.84Å; F221-F224 HydrophobicContact CD1-CE2 4.07Å; F221-F224 HydrophobicContact CD1-CG 4.36Å; F221-F224 AromaticContact CD1-CZ 3.83Å; F221-F224 HydrophobicContact CD1-CZ 3.83Å; F221-F224 HydrophobicContact CE1-CE1 4.34Å; F221-F224 HydrophobicContact CE1-CE2 4.03Å; F221-F224 AromaticContact CE1-CZ 3.87Å; F221-F224 HydrophobicContact CE1-CZ 3.87Å; F221-F224 WeakPolarHBondContact O-CB 3.29Å; F221-F224 PolarHBondContact O-N 3.32Å; F224-R226 VanDerWaalsContact C-N 3.27Å; F224-R226 PolarHBondContact O-N 3.3Å; F224-R227 PolarHBondContact O-N 2.7Å; F224-R227 VanDerWaalsContact O-N 3.11Å; F224-Y228 HydrophobicContact CB-CD2 3.9Å; F224-Y228 HydrophobicContact CB-CE2 4.36Å; F224-Y228 HydrophobicContact CD1-CE2 4.14Å; F224-Y228 AromaticContact CD2-CD2 3.69Å; F224-Y228 HydrophobicContact CD2-CD2 3.69Å; F224-Y228 AromaticContact CD2-CE2 3.69Å; F224-Y228 HydrophobicContact CD2-CE2 3.69Å; F224-Y228 HydrophobicContact CE1-CE2 4.33Å; F224-Y228 HydrophobicContact CE2-CD2 4.31Å; F224-Y228 AromaticContact CE2-CE2 3.88Å; F224-Y228 HydrophobicContact CE2-CE2 3.88Å; F224-Y228 AromaticContact CG-CD2 3.8Å; F224-Y228 HydrophobicContact CG-CD2 3.8Å; F224-Y228 AromaticContact CG-CE2 3.81Å; F224-Y228 HydrophobicContact CG-CE2 3.81Å; F224-Y228 HydrophobicContact CZ-CE2 4.2Å; F224-Y228 WeakPolarHBondContact O-CD2 3.36Å; F224-Y228 PolarHBondContact O-N 2.91Å; F224-L235 HydrophobicContact CD2-CB 4.42Å; F224-L235 HydrophobicContact CE2-CB 4.39Å; F224-M236 HydrophobicContact CB-CE 3.53Å; F224-M236 HydrophobicContact CD2-CE 4.45Å; F224-M236 HydrophobicContact CD2-CG 3.89Å; F224-M236 HydrophobicContact CE2-CG 4.43Å; F224-M236 HydrophobicContact CG-CE 4.17Å; F224-M236 HydrophobicContact CG-CG 4.43Å; F224-K239 HydrophobicContact CE2-CD 3.63Å; F224-K239 HydrophobicContact CZ-CD 3.65Å
225	W	93	Very high	94	Very high	140 Å²	140	65.9 Å²	65.9	53%	0.53	31%	0.306	S	S	.	.	H	α-helix	trans	-55.4	-45	175.3	169.6	-102.9	0	0	0	111.6	K223 R227 G229	K223-W225 VanDerWaalsContact C-N 3.28Å; K223-W225 PolarHBondContact O-N 3.01Å; W225-R227 VanDerWaalsContact C-N 3.28Å; W225-R227 PolarHBondContact O-N 3.35Å; W225-G229 VanDerWaalsContact O-CA 3.27Å; W225-G229 WeakPolarHBondContact O-CA 3.48Å; W225-G229 PolarHBondContact O-N 3.31Å
226	R	91.7	Very high	94.9	Very high	168 Å²	168	61.3 Å²	61.3	63%	0.634	28%	0.278	S	S	*	.	H	α-helix	trans	-65	-31.8	178.8	-63	-174.3	-179.3	177.4	3.6	112.6	N28 K223 F224	N28-R226 PolarHBondContact O-NH2 3.27Å; K223-R226 PolarHBondContact O-N 3.04Å; K223-R226 VanDerWaalsContact O-N 3.15Å; F224-R226 VanDerWaalsContact C-N 3.27Å; F224-R226 PolarHBondContact O-N 3.3Å
227	R	92.9	Very high	95.5	Very high	143 Å²	143	62.4 Å²	62.4	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-89.6	-35.4	-175.6	-167.9	168.1	-163.7	153.5	7.1	114.1	K223 F224 W225	K223-R227 PolarHBondContact O-N 3.34Å; F224-R227 PolarHBondContact O-N 2.7Å; F224-R227 VanDerWaalsContact O-N 3.11Å; W225-R227 VanDerWaalsContact C-N 3.28Å; W225-R227 PolarHBondContact O-N 3.35Å
228	Y	95	Very high	95.9	Very high	66 Å²	66	64.6 Å²	64.6	26%	0.259	28%	0.284	S	S	.	.	H	α-helix	trans	-123.3	-2.8	-168.6	-52.4	-67.6	0	0	0	113.7	F224 K230 F231 L235	F224-Y228 HydrophobicContact CB-CD2 3.9Å; F224-Y228 HydrophobicContact CB-CE2 4.36Å; F224-Y228 HydrophobicContact CD1-CE2 4.14Å; F224-Y228 AromaticContact CD2-CD2 3.69Å; F224-Y228 HydrophobicContact CD2-CD2 3.69Å; F224-Y228 AromaticContact CD2-CE2 3.69Å; F224-Y228 HydrophobicContact CD2-CE2 3.69Å; F224-Y228 HydrophobicContact CE1-CE2 4.33Å; F224-Y228 HydrophobicContact CE2-CD2 4.31Å; F224-Y228 AromaticContact CE2-CE2 3.88Å; F224-Y228 HydrophobicContact CE2-CE2 3.88Å; F224-Y228 AromaticContact CG-CD2 3.8Å; F224-Y228 HydrophobicContact CG-CD2 3.8Å; F224-Y228 AromaticContact CG-CE2 3.81Å; F224-Y228 HydrophobicContact CG-CE2 3.81Å; F224-Y228 HydrophobicContact CZ-CE2 4.2Å; F224-Y228 WeakPolarHBondContact O-CD2 3.36Å; F224-Y228 PolarHBondContact O-N 2.91Å; Y228-K230 PolarHBondContact O-N 3.25Å; Y228-F231 PolarHBondContact O-N 2.9Å; Y228-F231 VanDerWaalsContact O-N 3.12Å; Y228-L235 HydrophobicContact CD1-CD1 3.56Å; Y228-L235 HydrophobicContact CD2-CD1 3.86Å; Y228-L235 HydrophobicContact CE1-CD1 4.04Å; Y228-L235 HydrophobicContact CE2-CD1 4.32Å; Y228-L235 HydrophobicContact CG-CD1 3.45Å; Y228-L235 VanDerWaalsContact CG-CD1 3.45Å
229	G	95.1	Very high	96.1	Very high	26 Å²	26	65 Å²	65	27%	0.268	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	53.6	-128.9	179	0	0	0	0	0	112.6	W225 F231 S232	W225-G229 VanDerWaalsContact O-CA 3.27Å; W225-G229 WeakPolarHBondContact O-CA 3.48Å; W225-G229 PolarHBondContact O-N 3.31Å; G229-F231 PolarHBondContact O-N 3.13Å; G229-F231 VanDerWaalsContact O-N 3.13Å; G229-S232 WeakPolarHBondContact O-CB 3.41Å; G229-S232 PolarHBondContact O-N 2.62Å; G229-S232 PolarHBondContact O-OG 2.76Å
230	K	94.3	Very high	96.2	Very high	171 Å²	171	64.2 Å²	64.2	74%	0.743	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58.8	-23.4	-179.6	69.1	179.3	-177.5	179.2	0	114.5	Y228 S232	Y228-K230 PolarHBondContact O-N 3.25Å; K230-S232 VanDerWaalsContact C-N 3.33Å
231	F	96	Very high	96.3	Very high	123 Å²	123	73 Å²	73	54%	0.539	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-84.3	-7.2	179.6	-61.8	-71.6	0	0	0	113.5	Y228 G229 R233 H234 L235	Y228-F231 PolarHBondContact O-N 2.9Å; Y228-F231 VanDerWaalsContact O-N 3.12Å; G229-F231 PolarHBondContact O-N 3.13Å; G229-F231 VanDerWaalsContact O-N 3.13Å; F231-R233 PolarHBondContact O-N 2.8Å; F231-H234 PolarHBondContact O-N 3.42Å; F231-L235 WeakPolarHBondContact O-CG 3.19Å; F231-L235 PolarHBondContact O-N 3.37Å
232	S	96.3	Very high	96.3	Very high	3 Å²	3	80.7 Å²	80.7	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-51.9	-50.6	-176.6	54.4	0	0	0	0	113.5	G229 K230 H234 L235 M236	G229-S232 WeakPolarHBondContact O-CB 3.41Å; G229-S232 PolarHBondContact O-N 2.62Å; G229-S232 PolarHBondContact O-OG 2.76Å; K230-S232 VanDerWaalsContact C-N 3.33Å; S232-H234 PolarHBondContact O-N 3.3Å; S232-L235 PolarHBondContact O-N 2.85Å; S232-M236 VanDerWaalsContact O-CG 3.26Å; S232-M236 WeakPolarHBondContact O-CG 3.13Å; S232-M236 PolarHBondContact O-N 3.48Å
233	R	96.5	Very high	96.4	Very high	48 Å²	48	80 Å²	80	18%	0.181	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-41.9	-179.8	-73.8	-73.3	165.2	161.9	2.5	113.4	F151 I154 N156 F231 L235 M236 K237	F151-R233 PolarHBondContact O-NH1 2.85Å; I154-R233 VanDerWaalsContact O-CZ 3.25Å; I154-R233 PolarHBondContact O-NH1 3.43Å; I154-R233 PolarHBondContact O-NH2 3.1Å; N156-R233 PolarHBondContact OD1-NH2 3.48Å; F231-R233 PolarHBondContact O-N 2.8Å; R233-L235 VanDerWaalsContact C-N 3.35Å; R233-M236 PolarHBondContact O-N 3.39Å; R233-K237 WeakPolarHBondContact O-CG 3.45Å; R233-K237 PolarHBondContact O-N 3.33Å
234	H	97.3	Very high	96.6	Very high	115 Å²	115	79.9 Å²	79.9	53%	0.532	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.7	-179.8	71.9	0	0	0	111.1	F231 S232 K237 I238	F231-H234 PolarHBondContact O-N 3.42Å; S232-H234 PolarHBondContact O-N 3.3Å; H234-K237 PolarHBondContact O-N 3.09Å; H234-I238 VanDerWaalsContact NE2-CD1 3.29Å; H234-I238 WeakPolarHBondContact NE2-CD1 3.39Å; H234-I238 WeakPolarHBondContact O-CG1 3.34Å; H234-I238 PolarHBondContact O-N 3.24Å
235	L	97.9	Very high	96.7	Very high	49 Å²	49	80.5 Å²	80.5	26%	0.257	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-40	176.4	-68.8	173.2	0	0	0	112.7	F224 Y228 F231 S232 R233 K237 I238 K239	F224-L235 HydrophobicContact CD2-CB 4.42Å; F224-L235 HydrophobicContact CE2-CB 4.39Å; Y228-L235 HydrophobicContact CD1-CD1 3.56Å; Y228-L235 HydrophobicContact CD2-CD1 3.86Å; Y228-L235 HydrophobicContact CE1-CD1 4.04Å; Y228-L235 HydrophobicContact CE2-CD1 4.32Å; Y228-L235 HydrophobicContact CG-CD1 3.45Å; Y228-L235 VanDerWaalsContact CG-CD1 3.45Å; F231-L235 WeakPolarHBondContact O-CG 3.19Å; F231-L235 PolarHBondContact O-N 3.37Å; S232-L235 PolarHBondContact O-N 2.85Å; R233-L235 VanDerWaalsContact C-N 3.35Å; L235-K237 VanDerWaalsContact C-N 3.35Å; L235-K237 PolarHBondContact O-N 2.84Å; L235-I238 PolarHBondContact O-N 3.21Å; L235-K239 WeakPolarHBondContact O-CG 3.4Å; L235-K239 PolarHBondContact O-N 2.91Å
236	M	98.4	Very high	97	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57	-48.2	173.6	-70	168.4	-172.1	0	0	111.1	F151 L159 F221 F224 S232 R233 I238 K239 L240	F151-M236 HydrophobicContact CE1-CB 3.96Å; F151-M236 HydrophobicContact CE1-SD 4.19Å; F151-M236 HydrophobicContact CZ-CB 4.07Å; F151-M236 HydrophobicContact CZ-SD 4.12Å; L159-M236 HydrophobicContact CD1-CE 4.21Å; L159-M236 HydrophobicContact CD1-SD 3.86Å; F221-M236 HydrophobicContact CB-CE 4.02Å; F221-M236 HydrophobicContact CB-CG 4.38Å; F221-M236 HydrophobicContact CB-SD 4.36Å; F221-M236 HydrophobicContact CD1-CG 3.9Å; F221-M236 HydrophobicContact CD2-CB 4.26Å; F221-M236 HydrophobicContact CD2-CG 3.95Å; F221-M236 HydrophobicContact CD2-SD 4.37Å; F221-M236 HydrophobicContact CE1-CB 4.37Å; F221-M236 HydrophobicContact CE1-CG 4.1Å; F221-M236 HydrophobicContact CE2-CB 4.01Å; F221-M236 HydrophobicContact CE2-CG 4.16Å; F221-M236 HydrophobicContact CG-CE 4.46Å; F221-M236 HydrophobicContact CG-CG 3.83Å; F221-M236 HydrophobicContact CG-SD 4.34Å; F221-M236 HydrophobicContact CZ-CB 4.08Å; F221-M236 HydrophobicContact CZ-CG 4.23Å; F221-M236 WeakPolarHBondContact O-CE 3.42Å; F224-M236 HydrophobicContact CB-CE 3.53Å; F224-M236 HydrophobicContact CD2-CE 4.45Å; F224-M236 HydrophobicContact CD2-CG 3.89Å; F224-M236 HydrophobicContact CE2-CG 4.43Å; F224-M236 HydrophobicContact CG-CE 4.17Å; F224-M236 HydrophobicContact CG-CG 4.43Å; S232-M236 VanDerWaalsContact O-CG 3.26Å; S232-M236 WeakPolarHBondContact O-CG 3.13Å; S232-M236 PolarHBondContact O-N 3.48Å; R233-M236 PolarHBondContact O-N 3.39Å; M236-I238 PolarHBondContact O-N 3.03Å; M236-K239 PolarHBondContact O-N 2.9Å; M236-L240 WeakPolarHBondContact O-CB 3.41Å; M236-L240 WeakPolarHBondContact O-CG 3.46Å; M236-L240 PolarHBondContact O-N 3.27Å
237	K	98.2	Very high	97.3	Very high	91 Å²	91	65.9 Å²	65.9	40%	0.396	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-42.4	178.6	-73.8	177.8	172.2	178.3	0	112.6	F151 D152 R233 H234 L235 K239 L240 K241	F151-K237 HydrophobicContact CD1-CG 4.24Å; F151-K237 HydrophobicContact CE1-CG 4.45Å; D152-K237 WeakPolarHBondContact OD1-CE 3.29Å; D152-K237 IonicContact OD1-NZ 2.79Å; D152-K237 PolarHBondContact OD1-NZ 3.5Å; D152-K237 WeakPolarHBondContact OD2-CE 3.37Å; D152-K237 IonicContact OD2-NZ 3.99Å; D152-K237 PolarHBondContact OD2-NZ 2.98Å; R233-K237 WeakPolarHBondContact O-CG 3.45Å; R233-K237 PolarHBondContact O-N 3.33Å; H234-K237 PolarHBondContact O-N 3.09Å; L235-K237 VanDerWaalsContact C-N 3.35Å; L235-K237 PolarHBondContact O-N 2.84Å; K237-K239 VanDerWaalsContact C-N 3.32Å; K237-K239 PolarHBondContact O-N 3.39Å; K237-L240 PolarHBondContact O-N 3.48Å; K237-K241 PolarHBondContact O-N 2.87Å
238	I	98.4	Very high	97.6	Very high	60 Å²	60	59.1 Å²	59.1	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-58.9	-46.8	174.4	-70.8	167.8	0	0	0	110.4	H234 L235 M236 K241 K242	H234-I238 VanDerWaalsContact NE2-CD1 3.29Å; H234-I238 WeakPolarHBondContact NE2-CD1 3.39Å; H234-I238 WeakPolarHBondContact O-CG1 3.34Å; H234-I238 PolarHBondContact O-N 3.24Å; L235-I238 PolarHBondContact O-N 3.21Å; M236-I238 PolarHBondContact O-N 3.03Å; I238-K241 PolarHBondContact O-N 3.19Å; I238-K242 HydrophobicContact CG2-CD 3.91Å; I238-K242 HydrophobicContact CG2-CG 4.47Å; I238-K242 WeakPolarHBondContact O-CB 3.44Å; I238-K242 WeakPolarHBondContact O-CG 3.22Å; I238-K242 PolarHBondContact O-N 3.41Å
239	K	98.6	Very high	97.8	Very high	20 Å²	20	56 Å²	56	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-42.6	-179.8	-69.2	176.8	-173.6	-75.1	0	111.7	V164 D166 I171 F221 F224 L235 M236 K237 K241 K242 Y243	V164-K239 HydrophobicContact CG1-CD 4.13Å; D166-K239 IonicContact OD1-NZ 2.79Å; D166-K239 PolarHBondContact OD1-NZ 2.95Å; D166-K239 IonicContact OD2-NZ 3.68Å; D166-K239 PolarHBondContact OD2-NZ 3.32Å; I171-K239 HydrophobicContact CD1-CB 4.26Å; F221-K239 HydrophobicContact CE1-CB 4.43Å; F221-K239 HydrophobicContact CE1-CD 4.31Å; F221-K239 HydrophobicContact CZ-CB 4.26Å; F224-K239 HydrophobicContact CE2-CD 3.63Å; F224-K239 HydrophobicContact CZ-CD 3.65Å; L235-K239 WeakPolarHBondContact O-CG 3.4Å; L235-K239 PolarHBondContact O-N 2.91Å; M236-K239 PolarHBondContact O-N 2.9Å; K237-K239 VanDerWaalsContact C-N 3.32Å; K237-K239 PolarHBondContact O-N 3.39Å; K239-K241 PolarHBondContact O-N 2.91Å; K239-K242 PolarHBondContact O-N 3.49Å; K239-K242 VanDerWaalsContact O-N 3.09Å; K239-Y243 HydrophobicContact CB-CD2 4.02Å; K239-Y243 HydrophobicContact CB-CE2 4.14Å; K239-Y243 HydrophobicContact CB-CG 4.22Å; K239-Y243 HydrophobicContact CD-CE2 3.9Å; K239-Y243 HydrophobicContact CG-CD2 4.23Å; K239-Y243 HydrophobicContact CG-CE1 4.3Å; K239-Y243 HydrophobicContact CG-CE2 3.83Å; K239-Y243 PolarHBondContact NZ-OH 3.3Å; K239-Y243 WeakPolarHBondContact O-CB 3.36Å; K239-Y243 PolarHBondContact O-N 3.05Å
240	L	98.5	Very high	97.8	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.126	25%	0.25	C	C	.	.	H	α-helix	trans	-56.6	-37.8	173.7	-74.6	170	0	0	0	112.3	F151 I171 F221 M236 K237 K245 I339	F151-L240 HydrophobicContact CD1-CD1 4.27Å; F151-L240 HydrophobicContact CD2-CD1 3.87Å; F151-L240 HydrophobicContact CE1-CD1 3.93Å; F151-L240 HydrophobicContact CE2-CD1 3.51Å; F151-L240 HydrophobicContact CG-CD1 4.25Å; F151-L240 HydrophobicContact CZ-CD1 3.55Å; I171-L240 HydrophobicContact CD1-CD2 3.97Å; I171-L240 HydrophobicContact CD1-CG 4.41Å; F221-L240 HydrophobicContact CE2-CD1 4.13Å; F221-L240 HydrophobicContact CE2-CD2 3.91Å; F221-L240 HydrophobicContact CE2-CG 3.81Å; F221-L240 HydrophobicContact CZ-CD2 4.37Å; F221-L240 HydrophobicContact CZ-CG 4.11Å; M236-L240 WeakPolarHBondContact O-CB 3.41Å; M236-L240 WeakPolarHBondContact O-CG 3.46Å; M236-L240 PolarHBondContact O-N 3.27Å; K237-L240 PolarHBondContact O-N 3.48Å; L240-K245 HydrophobicContact CD2-CD 4.05Å; L240-K245 HydrophobicContact CD2-CG 4.48Å; L240-K245 VanDerWaalsContact O-CD 3.3Å; L240-K245 WeakPolarHBondContact O-CD 3.43Å; L240-K245 WeakPolarHBondContact O-CE 3.29Å; L240-K245 PolarHBondContact O-NZ 2.05Å; L240-I339 HydrophobicContact CD2-CD1 4.24Å; L240-I339 HydrophobicContact CD2-CG1 4.11Å; L240-I339 HydrophobicContact CD2-CG2 3.87Å
241	K	98.3	Very high	98	Very high	188 Å²	188	47.9 Å²	47.9	82%	0.817	22%	0.218	S	C	*	.	H	α-helix	trans	-72.8	-33.9	176.2	-173	173.6	-179.6	177.1	0	113.5	K237 I238 K239	K237-K241 PolarHBondContact O-N 2.87Å; I238-K241 PolarHBondContact O-N 3.19Å; K239-K241 PolarHBondContact O-N 2.91Å
242	K	98.4	Very high	98.1	Very high	163 Å²	163	42.1 Å²	42.1	71%	0.709	19%	0.192	S	C	*	.	H	α-helix	trans	-101.9	-27.7	-169.6	-69.5	-173.1	177.3	-173.5	0	115.1	I238 K239	I238-K242 HydrophobicContact CG2-CD 3.91Å; I238-K242 HydrophobicContact CG2-CG 4.47Å; I238-K242 WeakPolarHBondContact O-CB 3.44Å; I238-K242 WeakPolarHBondContact O-CG 3.22Å; I238-K242 PolarHBondContact O-N 3.41Å; K239-K242 PolarHBondContact O-N 3.49Å; K239-K242 VanDerWaalsContact O-N 3.09Å
243	Y	98.6	Very high	98.1	Very high	38 Å²	38	42 Å²	42	15%	0.149	19%	0.191	C	C	.	.	S	Bend	trans	-94.5	150.4	-170.8	-72.4	10.6	0	0	0	110.7	V164 D166 G169 I171 K239 K245	V164-Y243 HydrophobicContact CG1-CD2 4.13Å; V164-Y243 HydrophobicContact CG1-CE2 3.81Å; D166-Y243 WeakPolarHBondContact CA-OH 3.29Å; D166-Y243 WeakPolarHBondContact OD1-CE2 3.45Å; D166-Y243 PolarHBondContact OD1-OH 3.02Å; G169-Y243 VanDerWaalsContact C-CB 3.48Å; G169-Y243 CarbonylContact O-C 3.34Å; G169-Y243 WeakPolarHBondContact O-CA 3.04Å; G169-Y243 WeakPolarHBondContact O-CB 3.31Å; I171-Y243 HydrophobicContact CD1-CD2 4.33Å; I171-Y243 HydrophobicContact CG1-CD2 3.94Å; I171-Y243 HydrophobicContact CG1-CG 4.43Å; K239-Y243 HydrophobicContact CB-CD2 4.02Å; K239-Y243 HydrophobicContact CB-CE2 4.14Å; K239-Y243 HydrophobicContact CB-CG 4.22Å; K239-Y243 HydrophobicContact CD-CE2 3.9Å; K239-Y243 HydrophobicContact CG-CD2 4.23Å; K239-Y243 HydrophobicContact CG-CE1 4.3Å; K239-Y243 HydrophobicContact CG-CE2 3.83Å; K239-Y243 PolarHBondContact NZ-OH 3.3Å; K239-Y243 WeakPolarHBondContact O-CB 3.36Å; K239-Y243 PolarHBondContact O-N 3.05Å; Y243-K245 PolarHBondContact O-N 2.76Å; Y243-K245 PolarHBondContact O-NZ 2.95Å
244	T	98.7	Very high	98.1	Very high	42 Å²	42	39.7 Å²	39.7	26%	0.258	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.1	171.6	-55.4	0	0	0	0	109.3	G169 I170 I171 D342 L361	G169-T244 PolarHBondContact O-N 3.09Å; I170-T244 CarbonylContact C-O 3.55Å; I170-T244 WeakPolarHBondContact CA-O 2.71Å; I171-T244 PolarHBondContact N-O 3.15Å; T244-D342 VanDerWaalsContact CA-OD2 3.31Å; T244-D342 WeakPolarHBondContact CA-OD2 3.35Å; T244-D342 HydrophobicContact CG2-CB 4.1Å; T244-L361 HydrophobicContact CG2-CD2 3.69Å
245	K	98.8	Very high	98.1	Very high	13 Å²	13	34.3 Å²	34.3	6%	0.057	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.4	-176.2	-58.9	147.3	-63.9	-72.1	0	109.1	I171 L240 Y243 I339 D340 Y341 D342 F343	I171-K245 HydrophobicContact CB-CB 4.48Å; I171-K245 HydrophobicContact CB-CG 4Å; I171-K245 HydrophobicContact CD1-CG 4.06Å; I171-K245 HydrophobicContact CG1-CG 4.46Å; I171-K245 CarbonylContact O-C 3.59Å; I171-K245 VanDerWaalsContact O-CA 3.29Å; I171-K245 WeakPolarHBondContact O-CA 3.35Å; L240-K245 HydrophobicContact CD2-CD 4.05Å; L240-K245 HydrophobicContact CD2-CG 4.48Å; L240-K245 VanDerWaalsContact O-CD 3.3Å; L240-K245 WeakPolarHBondContact O-CD 3.43Å; L240-K245 WeakPolarHBondContact O-CE 3.29Å; L240-K245 PolarHBondContact O-NZ 2.05Å; Y243-K245 PolarHBondContact O-N 2.76Å; Y243-K245 PolarHBondContact O-NZ 2.95Å; K245-I339 HydrophobicContact CD-CG2 4.06Å; K245-D340 WeakPolarHBondContact CD-O 3.29Å; K245-D340 WeakPolarHBondContact CE-O 3.29Å; K245-Y341 HydrophobicContact CB-CD1 3.96Å; K245-Y341 HydrophobicContact CB-CE1 4.42Å; K245-D342 WeakPolarHBondContact CE-OD2 3.09Å; K245-D342 PolarHBondContact N-OD2 3.1Å; K245-D342 IonicContact NZ-OD1 3.24Å; K245-D342 PolarHBondContact NZ-OD1 3.19Å; K245-D342 IonicContact NZ-OD2 2.65Å; K245-D342 PolarHBondContact NZ-OD2 3.41Å; K245-D342 PolarHBondContact O-N 2.93Å; K245-F343 PolarHBondContact O-N 2.91Å
246	F	98.9	Very high	98.1	Very high	1 Å²	1	32 Å²	32	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	155.3	176.4	77	-87.5	0	0	0	112.7	I170 I171 Y172 C173 W183 M187 F248 F343 L357	I170-F246 HydrophobicContact CG2-CD1 3.99Å; I170-F246 HydrophobicContact CG2-CE1 3.54Å; I171-F246 PolarHBondContact O-N 3.27Å; Y172-F246 HydrophobicContact CD1-CZ 4.46Å; Y172-F246 AromaticContact CD2-CD2 3.68Å; Y172-F246 HydrophobicContact CD2-CD2 3.68Å; Y172-F246 HydrophobicContact CD2-CE1 4.21Å; Y172-F246 AromaticContact CD2-CE2 3.17Å; Y172-F246 HydrophobicContact CD2-CE2 3.17Å; Y172-F246 HydrophobicContact CD2-CG 4.38Å; Y172-F246 AromaticContact CD2-CZ 3.49Å; Y172-F246 HydrophobicContact CD2-CZ 3.49Å; Y172-F246 VanDerWaalsContact CD2-CZ 3.49Å; Y172-F246 HydrophobicContact CE2-CD2 4.19Å; Y172-F246 AromaticContact CE2-CE2 3.65Å; Y172-F246 HydrophobicContact CE2-CE2 3.65Å; Y172-F246 HydrophobicContact CE2-CZ 4.3Å; Y172-F246 HydrophobicContact CG-CE1 4.21Å; Y172-F246 AromaticContact CG-CE2 3.81Å; Y172-F246 HydrophobicContact CG-CE2 3.81Å; Y172-F246 AromaticContact CG-CZ 3.6Å; Y172-F246 HydrophobicContact CG-CZ 3.6Å; C173-F246 PolarHBondContact N-O 3.32Å; W183-F246 AromaticContact CD2-CE2 3.95Å; W183-F246 HydrophobicContact CD2-CE2 3.95Å; W183-F246 HydrophobicContact CD2-CZ 4.37Å; W183-F246 AromaticContact CE3-CE2 3.81Å; W183-F246 HydrophobicContact CE3-CE2 3.81Å; W183-F246 AromaticContact CE3-CZ 3.82Å; W183-F246 HydrophobicContact CE3-CZ 3.82Å; W183-F246 HydrophobicContact CG-CE2 4.49Å; W183-F246 HydrophobicContact CZ3-CE2 4.17Å; W183-F246 HydrophobicContact CZ3-CZ 4.15Å; M187-F246 HydrophobicContact SD-CE1 4.41Å; M187-F246 HydrophobicContact SD-CZ 4.36Å; F246-F248 AromaticContact CD2-CD2 3.94Å; F246-F248 HydrophobicContact CD2-CD2 3.94Å; F246-F248 AromaticContact CD2-CE2 3.82Å; F246-F248 HydrophobicContact CD2-CE2 3.82Å; F246-F248 HydrophobicContact CE2-CD2 4.11Å; F246-F248 AromaticContact CE2-CE2 4Å; F246-F248 HydrophobicContact CE2-CE2 4Å; F246-F343 VanDerWaalsContact CA-O 3.27Å; F246-F343 WeakPolarHBondContact CA-O 3.24Å; F246-F343 HydrophobicContact CB-CB 3.79Å; F246-F343 HydrophobicContact CB-CD1 4.29Å; F246-F343 HydrophobicContact CB-CG 4.47Å; F246-L357 HydrophobicContact CB-CD1 4.3Å; F246-L357 HydrophobicContact CB-CD2 4.14Å; F246-L357 HydrophobicContact CD1-CD1 4.46Å; F246-L357 HydrophobicContact CD1-CD2 4.01Å; F246-L357 HydrophobicContact CD2-CD2 3.37Å; F246-L357 HydrophobicContact CE1-CD2 4.2Å; F246-L357 HydrophobicContact CE2-CD2 3.6Å; F246-L357 HydrophobicContact CG-CD1 4.33Å; F246-L357 HydrophobicContact CG-CD2 3.59Å; F246-L357 HydrophobicContact CZ-CD2 4.02Å
247	L	98.8	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	163.1	165.5	75.1	145.9	0	0	0	110.4	C173 V175 V249 V330 C334 Y341 F343 I344 G345 F408	C173-L247 HydrophobicContact CB-CB 4.07Å; V175-L247 HydrophobicContact CG2-CD1 4.49Å; L247-V249 HydrophobicContact CD1-CG1 3.43Å; L247-V249 VanDerWaalsContact CD1-CG1 3.43Å; L247-V249 HydrophobicContact CG-CG1 4.29Å; L247-V330 HydrophobicContact CD1-CG1 3.89Å; L247-C334 HydrophobicContact CD1-CB 4.33Å; L247-Y341 HydrophobicContact CB-CD1 4.39Å; L247-Y341 HydrophobicContact CB-CE1 4.13Å; L247-Y341 HydrophobicContact CD2-CD1 3.32Å; L247-Y341 HydrophobicContact CD2-CD2 3.59Å; L247-Y341 HydrophobicContact CD2-CE1 3.61Å; L247-Y341 HydrophobicContact CD2-CE2 3.87Å; L247-Y341 HydrophobicContact CD2-CG 3.31Å; L247-Y341 HydrophobicContact CG-CD1 4.45Å; L247-Y341 HydrophobicContact CG-CE1 4.47Å; L247-F343 PolarHBondContact N-O 3.23Å; L247-I344 HydrophobicContact CD2-CG1 4.27Å; L247-G345 PolarHBondContact O-N 3.06Å; L247-F408 HydrophobicContact CD1-CE1 3.86Å; L247-F408 HydrophobicContact CD1-CZ 3.9Å; L247-F408 HydrophobicContact CD2-CE1 4.5Å
248	F	98.6	Very high	97.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.2	166.8	-81.6	-107.8	0	0	0	109	V178 W183 F246 F343 G345 L350 D353 L357	V178-F248 HydrophobicContact CB-CB 4.21Å; V178-F248 HydrophobicContact CG2-CB 4.03Å; V178-F248 WeakPolarHBondContact CG2-O 3.43Å; W183-F248 AromaticContact CD1-CD2 3.95Å; W183-F248 HydrophobicContact CD2-CD2 4.44Å; W183-F248 HydrophobicContact CD2-CE2 4.23Å; W183-F248 AromaticContact CE2-CD2 3.69Å; W183-F248 AromaticContact CE2-CE2 3.3Å; W183-F248 AromaticContact CE2-CZ 3.61Å; W183-F248 HydrophobicContact CH2-CE2 4.09Å; W183-F248 HydrophobicContact CH2-CZ 4.18Å; W183-F248 HydrophobicContact CZ2-CD2 4.11Å; W183-F248 HydrophobicContact CZ2-CE1 4.03Å; W183-F248 AromaticContact CZ2-CE2 3.23Å; W183-F248 HydrophobicContact CZ2-CE2 3.23Å; W183-F248 AromaticContact CZ2-CZ 3.2Å; W183-F248 HydrophobicContact CZ2-CZ 3.2Å; W183-F248 AromaticContact NE1-CD1 3.8Å; W183-F248 AromaticContact NE1-CD2 3.29Å; W183-F248 VanDerWaalsContact NE1-CD2 3.29Å; W183-F248 AromaticContact NE1-CE1 3.85Å; W183-F248 AromaticContact NE1-CE2 3.37Å; W183-F248 AromaticContact NE1-CG 3.55Å; W183-F248 AromaticContact NE1-CZ 3.66Å; F246-F248 AromaticContact CD2-CD2 3.94Å; F246-F248 HydrophobicContact CD2-CD2 3.94Å; F246-F248 AromaticContact CD2-CE2 3.82Å; F246-F248 HydrophobicContact CD2-CE2 3.82Å; F246-F248 HydrophobicContact CE2-CD2 4.11Å; F246-F248 AromaticContact CE2-CE2 4Å; F246-F248 HydrophobicContact CE2-CE2 4Å; F248-F343 HydrophobicContact CE2-CE1 4.19Å; F248-F343 AromaticContact CZ-CE1 3.91Å; F248-F343 HydrophobicContact CZ-CE1 3.91Å; F248-G345 CarbonylContact C-O 3.41Å; F248-G345 VanDerWaalsContact CA-O 3.29Å; F248-G345 WeakPolarHBondContact CA-O 3.46Å; F248-L350 HydrophobicContact CD1-CD1 3.86Å; F248-L350 HydrophobicContact CE1-CD1 3.78Å; F248-D353 HydrophobicContact CE1-CB 3.74Å; F248-D353 HydrophobicContact CZ-CB 4.01Å; F248-L357 HydrophobicContact CE2-CD2 3.79Å; F248-L357 HydrophobicContact CZ-CD2 4.32Å
249	V	98.4	Very high	97.9	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	173.2	177.5	-65.5	0	0	0	0	110.1	L247 V330 I344 G345 K346 L347 F408 Y410	L247-V249 HydrophobicContact CD1-CG1 3.43Å; L247-V249 VanDerWaalsContact CD1-CG1 3.43Å; L247-V249 HydrophobicContact CG-CG1 4.29Å; V249-V330 HydrophobicContact CG1-CG1 3.92Å; V249-I344 HydrophobicContact CG2-CG2 4.19Å; V249-G345 WeakPolarHBondContact CG2-O 3.44Å; V249-G345 PolarHBondContact N-O 3.36Å; V249-K346 HydrophobicContact CG2-CG 4.03Å; V249-K346 CarbonylContact O-C 3.56Å; V249-K346 WeakPolarHBondContact O-CA 3.3Å; V249-L347 PolarHBondContact O-N 3.5Å; V249-F408 HydrophobicContact CB-CD1 4.49Å; V249-F408 HydrophobicContact CB-CG 4.28Å; V249-F408 HydrophobicContact CG1-CD1 3.8Å; V249-F408 HydrophobicContact CG1-CD2 3.97Å; V249-F408 HydrophobicContact CG1-CE1 3.82Å; V249-F408 HydrophobicContact CG1-CE2 4.02Å; V249-F408 HydrophobicContact CG1-CG 3.88Å; V249-F408 HydrophobicContact CG1-CZ 3.93Å; V249-F408 HydrophobicContact CG2-CB 4.08Å; V249-F408 HydrophobicContact CG2-CD1 4.15Å; V249-F408 HydrophobicContact CG2-CG 4.09Å; V249-Y410 HydrophobicContact CB-CE2 4.39Å; V249-Y410 HydrophobicContact CG2-CE2 4.04Å; V249-Y410 WeakPolarHBondContact CG2-OH 3.29Å
250	R	96.4	Very high	97.8	Very high	14 Å²	14	25.2 Å²	25.2	5%	0.053	12%	0.117	C	C	.	.			trans	-149.9	158.5	173.9	177.6	-172.7	-160.9	154.4	9.2	107.4	K177 V178 V254 S258 L347 E348 T377 Y410	K177-R250 PolarHBondContact O-NH1 2.86Å; K177-R250 VanDerWaalsContact O-NH1 3.16Å; V178-R250 HydrophobicContact CG1-CB 3.59Å; R250-V254 HydrophobicContact CG-CB 4.47Å; R250-V254 VanDerWaalsContact NE-CG1 3.25Å; R250-S258 PolarHBondContact NH1-OG 2.91Å; R250-L347 HydrophobicContact CB-CB 3.97Å; R250-L347 HydrophobicContact CB-CD2 4.41Å; R250-L347 HydrophobicContact CG-CB 4.17Å; R250-L347 HydrophobicContact CG-CD2 4.08Å; R250-E348 WeakPolarHBondContact CG-OE1 3.37Å; R250-T377 VanDerWaalsContact NH2-CB 3.34Å; R250-T377 PolarHBondContact NH2-O 3.33Å; R250-Y410 WeakPolarHBondContact CA-OH 3.4Å; R250-Y410 PolarHBondContact N-OH 3.41Å; R250-Y410 VanDerWaalsContact N-OH 3.16Å
251	D	97.4	Very high	97.7	Very high	13 Å²	13	26.6 Å²	26.6	7%	0.07	12%	0.12	C	C	.	.			trans	-42.2	125.4	167.7	-177.8	-78.3	0	0	0	110.8	F253 V254 R255 E348 F405 Y410	D251-F253 VanDerWaalsContact C-N 3.32Å; D251-F253 PolarHBondContact O-N 3.44Å; D251-F253 PolarHBondContact OD1-N 3.14Å; D251-V254 HydrophobicContact CB-CB 4.05Å; D251-V254 HydrophobicContact CB-CG2 3.74Å; D251-V254 PolarHBondContact O-N 3.06Å; D251-V254 PolarHBondContact OD1-N 2.87Å; D251-V254 VanDerWaalsContact OD1-N 3.09Å; D251-R255 VanDerWaalsContact O-CB 3.3Å; D251-R255 WeakPolarHBondContact O-CB 3.31Å; D251-R255 PolarHBondContact O-N 2.96Å; D251-E348 PolarHBondContact N-OE1 2.81Å; D251-F405 WeakPolarHBondContact OD2-CE1 3.45Å; D251-Y410 HydrophobicContact CB-CD1 4.01Å; D251-Y410 HydrophobicContact CB-CE1 4.06Å; D251-Y410 PolarHBondContact N-OH 2.8Å
252	P	98.1	Very high	97.4	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.013	10%	0.095	C	C	.	.	H	α-helix	trans	-58	-38	-174	-27.8	35.9	0	0	0	114.4	R255 L256 Y401 D404 F405	P252-R255 WeakPolarHBondContact O-CB 3.11Å; P252-R255 PolarHBondContact O-N 2.9Å; P252-L256 WeakPolarHBondContact O-CG 3.46Å; P252-L256 PolarHBondContact O-N 2.69Å; P252-L256 VanDerWaalsContact O-N 3.15Å; P252-Y401 HydrophobicContact CB-CD1 4.39Å; P252-Y401 HydrophobicContact CB-CG 4.46Å; P252-D404 HydrophobicContact CB-CB 4.36Å; P252-D404 HydrophobicContact CG-CB 3.72Å; P252-F405 HydrophobicContact CB-CD2 3.99Å; P252-F405 HydrophobicContact CB-CE2 3.56Å; P252-F405 HydrophobicContact CB-CZ 3.89Å; P252-F405 HydrophobicContact CG-CD1 4.12Å; P252-F405 HydrophobicContact CG-CD2 3.63Å; P252-F405 HydrophobicContact CG-CE1 4.13Å; P252-F405 HydrophobicContact CG-CE2 3.65Å; P252-F405 HydrophobicContact CG-CG 3.86Å; P252-F405 HydrophobicContact CG-CZ 3.9Å
253	F	97.8	Very high	97.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-77.7	-42.4	-178.3	-83.7	13.9	0	0	0	111.4	D251 R255 L256 I257 E382 F386 L397 F405 P413 L416	D251-F253 VanDerWaalsContact C-N 3.32Å; D251-F253 PolarHBondContact O-N 3.44Å; D251-F253 PolarHBondContact OD1-N 3.14Å; F253-R255 PolarHBondContact O-N 3.02Å; F253-L256 HydrophobicContact CD1-CD1 4.38Å; F253-L256 WeakPolarHBondContact O-CB 3.43Å; F253-L256 PolarHBondContact O-N 3.27Å; F253-I257 PolarHBondContact O-N 3.37Å; F253-E382 WeakPolarHBondContact CB-OE1 3.43Å; F253-F386 HydrophobicContact CB-CE2 3.92Å; F253-F386 HydrophobicContact CB-CZ 4.14Å; F253-F386 HydrophobicContact CD1-CZ 4.41Å; F253-F386 HydrophobicContact CD2-CD2 4.41Å; F253-F386 HydrophobicContact CD2-CE1 4.31Å; F253-F386 AromaticContact CD2-CE2 3.77Å; F253-F386 HydrophobicContact CD2-CE2 3.77Å; F253-F386 AromaticContact CD2-CZ 3.7Å; F253-F386 HydrophobicContact CD2-CZ 3.7Å; F253-F386 HydrophobicContact CE2-CE1 4.36Å; F253-F386 HydrophobicContact CE2-CZ 4.18Å; F253-F386 AromaticContact CG-CE2 4Å; F253-F386 HydrophobicContact CG-CE2 4Å; F253-F386 AromaticContact CG-CZ 3.82Å; F253-F386 HydrophobicContact CG-CZ 3.82Å; F253-L397 HydrophobicContact CD1-CD2 4.23Å; F253-L397 HydrophobicContact CE1-CB 4.32Å; F253-L397 HydrophobicContact CE1-CD2 3.72Å; F253-L397 HydrophobicContact CE1-CG 3.73Å; F253-L397 HydrophobicContact CZ-CB 4.23Å; F253-L397 HydrophobicContact CZ-CD2 3.93Å; F253-L397 HydrophobicContact CZ-CG 4.08Å; F253-F405 HydrophobicContact CB-CZ 4.4Å; F253-F405 AromaticContact CD1-CE2 3.89Å; F253-F405 HydrophobicContact CD1-CE2 3.89Å; F253-F405 AromaticContact CD1-CZ 3.88Å; F253-F405 HydrophobicContact CD1-CZ 3.88Å; F253-F405 HydrophobicContact CD2-CZ 4.45Å; F253-F405 AromaticContact CE1-CE2 3.93Å; F253-F405 HydrophobicContact CE1-CE2 3.93Å; F253-F405 HydrophobicContact CE1-CZ 4.24Å; F253-F405 HydrophobicContact CG-CE2 4.47Å; F253-F405 HydrophobicContact CG-CZ 4.01Å; F253-P413 HydrophobicContact CD2-CG 4.22Å; F253-P413 HydrophobicContact CE2-CG 3.97Å; F253-L416 HydrophobicContact CD2-CD1 3.78Å; F253-L416 HydrophobicContact CE2-CD1 4.15Å
254	V	96.5	Very high	97.2	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-59.9	-35.4	171.3	-169.4	0	0	0	0	111.1	R250 D251 I257 S258 T377 E382	R250-V254 HydrophobicContact CG-CB 4.47Å; R250-V254 VanDerWaalsContact NE-CG1 3.25Å; D251-V254 HydrophobicContact CB-CB 4.05Å; D251-V254 HydrophobicContact CB-CG2 3.74Å; D251-V254 PolarHBondContact O-N 3.06Å; D251-V254 PolarHBondContact OD1-N 2.87Å; D251-V254 VanDerWaalsContact OD1-N 3.09Å; V254-I257 PolarHBondContact O-N 2.9Å; V254-S258 WeakPolarHBondContact O-CB 3.3Å; V254-S258 PolarHBondContact O-N 3.15Å; V254-T377 HydrophobicContact CG1-CG2 3.9Å; V254-T377 WeakPolarHBondContact CG1-O 3.17Å; V254-E382 VanDerWaalsContact CG2-CD 3.46Å; V254-E382 HydrophobicContact CG2-CG 3.67Å; V254-E382 WeakPolarHBondContact CG2-OE1 3.45Å
255	R	97.3	Very high	96.9	Very high	1 Å²	1	13.8 Å²	13.8	0%	0.004	7%	0.068	C	C	.	.	H	α-helix	trans	-63.4	-39.9	174.5	-161.1	-177.3	69.2	100.5	-1.3	112	K177 D251 P252 F253 S258 A259 H326 R328	K177-R255 HydrophobicContact CB-CG 3.84Å; K177-R255 HydrophobicContact CG-CG 4.47Å; D251-R255 VanDerWaalsContact O-CB 3.3Å; D251-R255 WeakPolarHBondContact O-CB 3.31Å; D251-R255 PolarHBondContact O-N 2.96Å; P252-R255 WeakPolarHBondContact O-CB 3.11Å; P252-R255 PolarHBondContact O-N 2.9Å; F253-R255 PolarHBondContact O-N 3.02Å; R255-S258 PolarHBondContact O-N 3.2Å; R255-A259 WeakPolarHBondContact O-CB 3.12Å; R255-A259 PolarHBondContact O-N 3.24Å; R255-H326 PolarHBondContact NH1-O 3Å; R255-R328 PolarHBondContact NH1-O 3.13Å; R255-R328 PolarHBondContact NH2-O 2.84Å
256	L	98.1	Very high	96.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.3	-44.1	174.9	-70.1	178.7	0	0	0	112.4	P252 F253 S258 A259 F260 F308 L312 W327 L397 Y401	P252-L256 WeakPolarHBondContact O-CG 3.46Å; P252-L256 PolarHBondContact O-N 2.69Å; P252-L256 VanDerWaalsContact O-N 3.15Å; F253-L256 HydrophobicContact CD1-CD1 4.38Å; F253-L256 WeakPolarHBondContact O-CB 3.43Å; F253-L256 PolarHBondContact O-N 3.27Å; L256-S258 VanDerWaalsContact C-N 3.32Å; L256-S258 PolarHBondContact O-N 2.97Å; L256-A259 WeakPolarHBondContact O-CB 3.17Å; L256-A259 PolarHBondContact O-N 2.94Å; L256-A259 VanDerWaalsContact O-N 3.14Å; L256-F260 PolarHBondContact O-N 2.99Å; L256-F308 HydrophobicContact CB-CE1 4.48Å; L256-F308 HydrophobicContact CD2-CE1 4.37Å; L256-F308 HydrophobicContact CD2-CZ 4.45Å; L256-L312 HydrophobicContact CD1-CD1 4.11Å; L256-L312 HydrophobicContact CD2-CD1 3.99Å; L256-W327 HydrophobicContact CD2-CB 3.64Å; L256-L397 HydrophobicContact CD1-CD1 4.1Å; L256-L397 HydrophobicContact CD1-CD2 4.03Å; L256-L397 HydrophobicContact CD1-CG 4.3Å; L256-Y401 HydrophobicContact CD1-CD2 4.19Å; L256-Y401 HydrophobicContact CD1-CE2 3.74Å; L256-Y401 HydrophobicContact CD2-CE1 4.3Å; L256-Y401 HydrophobicContact CD2-CE2 4.38Å
257	I	97.1	Very high	96.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.7	-48.3	174.6	-62.8	166.2	0	0	0	109.4	F253 V254 A259 F260 R261 F305 T377 E382 W385 F386	F253-I257 PolarHBondContact O-N 3.37Å; V254-I257 PolarHBondContact O-N 2.9Å; I257-A259 VanDerWaalsContact C-N 3.28Å; I257-A259 PolarHBondContact O-N 3.38Å; I257-F260 PolarHBondContact O-N 3.04Å; I257-R261 HydrophobicContact CG2-CG 4.21Å; I257-R261 WeakPolarHBondContact O-CB 3.4Å; I257-R261 VanDerWaalsContact O-CG 3.23Å; I257-R261 WeakPolarHBondContact O-CG 3.44Å; I257-R261 PolarHBondContact O-N 3.4Å; I257-F305 HydrophobicContact CG1-CE2 4.3Å; I257-F305 HydrophobicContact CG1-CZ 3.98Å; I257-T377 HydrophobicContact CB-CG2 4.05Å; I257-T377 HydrophobicContact CG2-CG2 3.55Å; I257-E382 HydrophobicContact CD1-CG 4.16Å; I257-W385 HydrophobicContact CD1-CB 3.71Å; I257-W385 HydrophobicContact CD1-CG 3.83Å; I257-W385 HydrophobicContact CG1-CB 4.04Å; I257-W385 HydrophobicContact CG1-CD2 4.24Å; I257-W385 HydrophobicContact CG1-CG 4Å; I257-W385 HydrophobicContact CG2-CD2 3.65Å; I257-W385 HydrophobicContact CG2-CE3 4.2Å; I257-W385 HydrophobicContact CG2-CG 3.92Å; I257-W385 HydrophobicContact CG2-CZ2 4.1Å; I257-F386 HydrophobicContact CD1-CE2 4.13Å; I257-F386 HydrophobicContact CG1-CE2 4.39Å
258	S	95.4	Very high	96.1	Very high	20 Å²	20	26.8 Å²	26.8	14%	0.14	13%	0.133	C	C	.	.	H	α-helix	trans	-60	-37	176.6	-170.9	0	0	0	0	112.9	R250 V254 R255 L256 S262	R250-S258 PolarHBondContact NH1-OG 2.91Å; V254-S258 WeakPolarHBondContact O-CB 3.3Å; V254-S258 PolarHBondContact O-N 3.15Å; R255-S258 PolarHBondContact O-N 3.2Å; L256-S258 VanDerWaalsContact C-N 3.32Å; L256-S258 PolarHBondContact O-N 2.97Å; S258-S262 WeakPolarHBondContact O-CB 3.46Å; S258-S262 PolarHBondContact O-N 3.23Å; S258-S262 VanDerWaalsContact O-N 3.09Å
259	A	96.9	Very high	96	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.9	-48.9	175.9	0	0	0	0	0	111.9	K177 R255 L256 I257 S262 K263 H326	K177-A259 HydrophobicContact CG-CB 4.11Å; R255-A259 WeakPolarHBondContact O-CB 3.12Å; R255-A259 PolarHBondContact O-N 3.24Å; L256-A259 WeakPolarHBondContact O-CB 3.17Å; L256-A259 PolarHBondContact O-N 2.94Å; L256-A259 VanDerWaalsContact O-N 3.14Å; I257-A259 VanDerWaalsContact C-N 3.28Å; I257-A259 PolarHBondContact O-N 3.38Å; A259-S262 PolarHBondContact O-N 2.88Å; A259-K263 WeakPolarHBondContact O-CB 3.34Å; A259-K263 WeakPolarHBondContact O-CG 3.41Å; A259-K263 PolarHBondContact O-N 3.47Å; A259-K263 VanDerWaalsContact O-N 3.13Å; A259-H326 HydrophobicContact CB-CB 4.24Å; A259-H326 WeakPolarHBondContact CB-O 3.05Å
260	F	97.6	Very high	95.9	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.044	17%	0.174	C	C	.	.	H	α-helix	trans	-58.1	-55.2	178.5	176.9	-93.6	0	0	0	111.2	L256 I257 S262 K263 F264 E265 V303 S304 F305 F308 W385	L256-F260 PolarHBondContact O-N 2.99Å; I257-F260 PolarHBondContact O-N 3.04Å; F260-S262 VanDerWaalsContact C-N 3.28Å; F260-S262 PolarHBondContact O-N 3.33Å; F260-K263 PolarHBondContact O-N 3.25Å; F260-F264 HydrophobicContact CD2-CB 4.26Å; F260-F264 AromaticContact CD2-CD2 3.57Å; F260-F264 HydrophobicContact CD2-CD2 3.57Å; F260-F264 HydrophobicContact CD2-CE2 4.37Å; F260-F264 HydrophobicContact CD2-CG 4.31Å; F260-F264 HydrophobicContact CE2-CB 4.01Å; F260-F264 AromaticContact CE2-CD2 3.97Å; F260-F264 HydrophobicContact CE2-CD2 3.97Å; F260-F264 HydrophobicContact CE2-CG 4.31Å; F260-F264 HydrophobicContact CG-CD2 4.26Å; F260-F264 HydrophobicContact CZ-CB 4.26Å; F260-F264 PolarHBondContact O-N 3.33Å; F260-E265 HydrophobicContact CE1-CG 4.4Å; F260-V303 HydrophobicContact CE2-CG1 4.06Å; F260-V303 WeakPolarHBondContact CZ-O 3.45Å; F260-S304 WeakPolarHBondContact CE2-O 3.27Å; F260-F305 HydrophobicContact CB-CD2 4.04Å; F260-F305 HydrophobicContact CB-CE2 4.2Å; F260-F305 HydrophobicContact CD1-CD2 4.06Å; F260-F305 HydrophobicContact CD2-CD2 4.06Å; F260-F305 HydrophobicContact CE1-CB 4.4Å; F260-F305 AromaticContact CG-CD2 3.77Å; F260-F305 HydrophobicContact CG-CD2 3.77Å; F260-F305 HydrophobicContact CG-CE2 4.42Å; F260-F305 HydrophobicContact CZ-CB 4.35Å; F260-F308 HydrophobicContact CB-CD1 4.05Å; F260-F308 HydrophobicContact CB-CE1 4.17Å; F260-F308 HydrophobicContact CD2-CB 3.62Å; F260-F308 AromaticContact CD2-CD1 3.85Å; F260-F308 HydrophobicContact CD2-CD1 3.85Å; F260-F308 HydrophobicContact CD2-CD2 4.48Å; F260-F308 AromaticContact CD2-CG 3.73Å; F260-F308 HydrophobicContact CD2-CG 3.73Å; F260-F308 HydrophobicContact CE2-CB 3.87Å; F260-F308 HydrophobicContact CE2-CG 4.46Å; F260-F308 HydrophobicContact CG-CD1 4.35Å; F260-W385 AromaticContact CD1-CH2 3.7Å; F260-W385 HydrophobicContact CD1-CH2 3.7Å; F260-W385 AromaticContact CD1-CZ3 3.42Å; F260-W385 HydrophobicContact CD1-CZ3 3.42Å; F260-W385 VanDerWaalsContact CD1-CZ3 3.42Å; F260-W385 AromaticContact CE1-CH2 3.86Å; F260-W385 HydrophobicContact CE1-CH2 3.86Å; F260-W385 AromaticContact CE1-CZ3 3.61Å; F260-W385 HydrophobicContact CE1-CZ3 3.61Å; F260-W385 HydrophobicContact CG-CZ3 4.41Å
261	R	94.9	Very high	95.9	Very high	53 Å²	53	35.1 Å²	35.1	20%	0.2	17%	0.173	C	C	.	.	I	π-helix	trans	-53.2	-47.6	178.2	-67.7	-177.4	62	-150.2	2.7	112	I257 K263 E265 T377 W385	I257-R261 HydrophobicContact CG2-CG 4.21Å; I257-R261 WeakPolarHBondContact O-CB 3.4Å; I257-R261 VanDerWaalsContact O-CG 3.23Å; I257-R261 WeakPolarHBondContact O-CG 3.44Å; I257-R261 PolarHBondContact O-N 3.4Å; R261-K263 PolarHBondContact O-N 3.31Å; R261-E265 HydrophobicContact CB-CG 4.43Å; R261-E265 VanDerWaalsContact CB-OE2 3.26Å; R261-E265 WeakPolarHBondContact CB-OE2 3.23Å; R261-E265 HydrophobicContact CG-CG 4.5Å; R261-E265 VanDerWaalsContact CG-OE2 3.3Å; R261-E265 WeakPolarHBondContact CG-OE2 3.3Å; R261-E265 IonicContact NE-OE2 3.64Å; R261-E265 PolarHBondContact NE-OE2 3.5Å; R261-E265 WeakPolarHBondContact O-CB 3.43Å; R261-E265 PolarHBondContact O-N 2.95Å; R261-T377 PolarHBondContact NH1-OG1 3.43Å; R261-W385 HydrophobicContact CG-CH2 3.73Å; R261-W385 HydrophobicContact CG-CZ2 3.69Å
262	S	92.5	Very high	95.9	Very high	40 Å²	40	34.7 Å²	34.7	28%	0.28	17%	0.17	S	C	.	.	I	π-helix	trans	-67.1	-20.8	-178.7	175.5	0	0	0	0	114.5	K177 S258 A259 F260	K177-S262 VanDerWaalsContact NZ-CB 3.26Å; K177-S262 PolarHBondContact NZ-OG 3.35Å; S258-S262 WeakPolarHBondContact O-CB 3.46Å; S258-S262 PolarHBondContact O-N 3.23Å; S258-S262 VanDerWaalsContact O-N 3.09Å; A259-S262 PolarHBondContact O-N 2.88Å; F260-S262 VanDerWaalsContact C-N 3.28Å; F260-S262 PolarHBondContact O-N 3.33Å
263	K	95.8	Very high	95.8	Very high	29 Å²	29	41.1 Å²	41.1	13%	0.126	19%	0.194	C	C	.	.	I	π-helix	trans	-115.5	-22.5	-171.1	-66.2	-53.5	-170.1	164.5	0	114.8	A259 F260 R261 F271 H326	A259-K263 WeakPolarHBondContact O-CB 3.34Å; A259-K263 WeakPolarHBondContact O-CG 3.41Å; A259-K263 PolarHBondContact O-N 3.47Å; A259-K263 VanDerWaalsContact O-N 3.13Å; F260-K263 PolarHBondContact O-N 3.25Å; R261-K263 PolarHBondContact O-N 3.31Å; K263-F271 HydrophobicContact CB-CD1 3.74Å; K263-F271 HydrophobicContact CB-CE1 4.25Å; K263-F271 HydrophobicContact CB-CG 4.21Å; K263-F271 HydrophobicContact CD-CD1 3.7Å; K263-F271 HydrophobicContact CD-CD2 3.93Å; K263-F271 HydrophobicContact CD-CE1 3.66Å; K263-F271 HydrophobicContact CD-CE2 3.91Å; K263-F271 HydrophobicContact CD-CG 3.84Å; K263-F271 HydrophobicContact CD-CZ 3.78Å; K263-F271 VanDerWaalsContact CE-CZ 3.41Å; K263-F271 HydrophobicContact CG-CD1 3.72Å; K263-F271 HydrophobicContact CG-CE1 3.72Å; K263-F271 HydrophobicContact CG-CG 4.3Å; K263-F271 HydrophobicContact CG-CZ 4.32Å; K263-F271 VanDerWaalsContact NZ-CZ 3.29Å; K263-H326 WeakPolarHBondContact CE-CD2 3.27Å; K263-H326 WeakPolarHBondContact CE-NE2 3.33Å; K263-H326 PolarHBondContact NZ-NE2 3.5Å
264	F	96.6	Very high	95.7	Very high	10 Å²	10	48.6 Å²	48.6	4%	0.044	22%	0.223	C	C	.	.	I	π-helix	trans	-128.2	-13.4	-172.8	-56.2	-65.6	0	0	0	114.3	F260 F271 F275 A276 M279 F297 F308 W327	F260-F264 HydrophobicContact CD2-CB 4.26Å; F260-F264 AromaticContact CD2-CD2 3.57Å; F260-F264 HydrophobicContact CD2-CD2 3.57Å; F260-F264 HydrophobicContact CD2-CE2 4.37Å; F260-F264 HydrophobicContact CD2-CG 4.31Å; F260-F264 HydrophobicContact CE2-CB 4.01Å; F260-F264 AromaticContact CE2-CD2 3.97Å; F260-F264 HydrophobicContact CE2-CD2 3.97Å; F260-F264 HydrophobicContact CE2-CG 4.31Å; F260-F264 HydrophobicContact CG-CD2 4.26Å; F260-F264 HydrophobicContact CZ-CB 4.26Å; F260-F264 PolarHBondContact O-N 3.33Å; F264-F271 HydrophobicContact CE1-CB 4.43Å; F264-F275 HydrophobicContact CE1-CB 4Å; F264-F275 HydrophobicContact CZ-CB 3.9Å; F264-A276 HydrophobicContact CD1-CB 4.25Å; F264-A276 HydrophobicContact CE1-CB 4.21Å; F264-M279 HydrophobicContact CE1-SD 4.39Å; F264-M279 HydrophobicContact CZ-CE 4.04Å; F264-M279 HydrophobicContact CZ-SD 4.09Å; F264-F297 WeakPolarHBondContact O-CZ 3.43Å; F264-F308 AromaticContact CE2-CD2 3.94Å; F264-F308 HydrophobicContact CE2-CD2 3.94Å; F264-F308 HydrophobicContact CE2-CE2 4.12Å; F264-W327 HydrophobicContact CE2-CZ3 4.42Å; F264-W327 HydrophobicContact CZ-CH2 4.43Å; F264-W327 HydrophobicContact CZ-CZ3 4.44Å
265	E	93.6	Very high	95.8	Very high	82 Å²	82	49.3 Å²	49.3	38%	0.383	23%	0.226	S	C	.	.	I	π-helix	trans	-84.1	-28.4	174	-70.7	-178.1	158.5	0	0	113.2	F260 R261 W385	F260-E265 HydrophobicContact CE1-CG 4.4Å; R261-E265 HydrophobicContact CB-CG 4.43Å; R261-E265 VanDerWaalsContact CB-OE2 3.26Å; R261-E265 WeakPolarHBondContact CB-OE2 3.23Å; R261-E265 HydrophobicContact CG-CG 4.5Å; R261-E265 VanDerWaalsContact CG-OE2 3.3Å; R261-E265 WeakPolarHBondContact CG-OE2 3.3Å; R261-E265 IonicContact NE-OE2 3.64Å; R261-E265 PolarHBondContact NE-OE2 3.5Å; R261-E265 WeakPolarHBondContact O-CB 3.43Å; R261-E265 PolarHBondContact O-N 2.95Å; E265-W385 VanDerWaalsContact OE1-CH2 3.32Å; E265-W385 WeakPolarHBondContact OE1-CH2 3.15Å
266	L	91.9	Very high	95.7	Very high	127 Å²	127	49.4 Å²	49.4	67%	0.665	23%	0.227	S	C	*	.	S	Bend	trans	-107.4	152.6	177.6	-59.2	178.5	0	0	0	110.3	N268	L266-N268 PolarHBondContact O-N 2.82Å
267	E	93.5	Very high	95.7	Very high	117 Å²	117	50.9 Å²	50.9	55%	0.547	23%	0.234	S	C	.	.			trans	-56.8	121.8	177.5	-68	-171.3	174.1	0	0	111.1	V293 S294 F297	E267-V293 HydrophobicContact CB-CG1 3.72Å; E267-V293 HydrophobicContact CG-CG1 4.03Å; E267-S294 WeakPolarHBondContact OE1-CA 3.05Å; E267-S294 VanDerWaalsContact OE1-CB 3.31Å; E267-S294 WeakPolarHBondContact OE1-CB 3.29Å; E267-S294 PolarHBondContact OE1-OG 3.32Å; E267-F297 HydrophobicContact CG-CD2 3.97Å; E267-F297 HydrophobicContact CG-CE2 4.22Å
268	N	94.8	Very high	95.6	Very high	43 Å²	43	53.1 Å²	53.1	23%	0.23	25%	0.249	C	C	.	.			trans	-148.9	96.2	177.4	-171.6	-42.9	0	0	0	109.6	L266 E270 F271 Y272	L266-N268 PolarHBondContact O-N 2.82Å; N268-E270 VanDerWaalsContact C-N 3.32Å; N268-E270 PolarHBondContact O-N 3.36Å; N268-E270 PolarHBondContact OD1-N 2.98Å; N268-F271 HydrophobicContact CB-CB 4.23Å; N268-F271 PolarHBondContact O-N 3.33Å; N268-F271 PolarHBondContact OD1-N 2.84Å; N268-Y272 WeakPolarHBondContact O-CB 3.08Å; N268-Y272 PolarHBondContact O-N 3Å
269	E	96	Very high	95.6	Very high	64 Å²	64	52.2 Å²	52.2	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-56.6	-42.3	-176.8	-75.9	-70.2	164.2	0	0	113.2	Y272 R273 S292 V293	E269-Y272 PolarHBondContact O-N 3.34Å; E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 VanDerWaalsContact O-CG 3.32Å; E269-R273 WeakPolarHBondContact O-CG 3.44Å; E269-R273 PolarHBondContact O-N 3.13Å; E269-R273 IonicContact OE2-CZ 2.96Å; E269-R273 IonicContact OE2-NE 2.7Å; E269-R273 PolarHBondContact OE2-NE 3.12Å; E269-R273 IonicContact OE2-NH2 3.48Å; E269-R273 PolarHBondContact OE2-NH2 2.74Å; E269-S292 VanDerWaalsContact OE1-CA 3.27Å; E269-S292 WeakPolarHBondContact OE1-CA 3.46Å; E269-S292 WeakPolarHBondContact OE1-CB 3.42Å; E269-S292 PolarHBondContact OE1-OG 3.13Å; E269-V293 HydrophobicContact CG-CG1 4.03Å; E269-V293 WeakPolarHBondContact OE1-CG1 3.49Å; E269-V293 PolarHBondContact OE1-N 3.15Å
270	E	95.3	Very high	95.7	Very high	119 Å²	119	52.2 Å²	52.2	56%	0.556	24%	0.243	S	C	*	.	H	α-helix	trans	-64.1	-50.6	-179.2	-171.1	-161.8	159.2	0	0	111.3	N268 Y272 R274	N268-E270 VanDerWaalsContact C-N 3.32Å; N268-E270 PolarHBondContact O-N 3.36Å; N268-E270 PolarHBondContact OD1-N 2.98Å; E270-Y272 VanDerWaalsContact C-N 3.34Å; E270-R274 VanDerWaalsContact O-CB 3.23Å; E270-R274 WeakPolarHBondContact O-CB 3.46Å; E270-R274 PolarHBondContact O-N 3.08Å
271	F	97	Very high	95.6	Very high	7 Å²	7	56.9 Å²	56.9	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-70.5	-33.7	-179.3	-85.5	-104	0	0	0	111.9	K263 F264 N268 F275 A276 H326 W327	K263-F271 HydrophobicContact CB-CD1 3.74Å; K263-F271 HydrophobicContact CB-CE1 4.25Å; K263-F271 HydrophobicContact CB-CG 4.21Å; K263-F271 HydrophobicContact CD-CD1 3.7Å; K263-F271 HydrophobicContact CD-CD2 3.93Å; K263-F271 HydrophobicContact CD-CE1 3.66Å; K263-F271 HydrophobicContact CD-CE2 3.91Å; K263-F271 HydrophobicContact CD-CG 3.84Å; K263-F271 HydrophobicContact CD-CZ 3.78Å; K263-F271 VanDerWaalsContact CE-CZ 3.41Å; K263-F271 HydrophobicContact CG-CD1 3.72Å; K263-F271 HydrophobicContact CG-CE1 3.72Å; K263-F271 HydrophobicContact CG-CG 4.3Å; K263-F271 HydrophobicContact CG-CZ 4.32Å; K263-F271 VanDerWaalsContact NZ-CZ 3.29Å; F264-F271 HydrophobicContact CE1-CB 4.43Å; N268-F271 HydrophobicContact CB-CB 4.23Å; N268-F271 PolarHBondContact O-N 3.33Å; N268-F271 PolarHBondContact OD1-N 2.84Å; F271-F275 HydrophobicContact CB-CD2 4.39Å; F271-F275 AromaticContact CD1-CD2 3.56Å; F271-F275 HydrophobicContact CD1-CD2 3.56Å; F271-F275 AromaticContact CD1-CE2 3.85Å; F271-F275 HydrophobicContact CD1-CE2 3.85Å; F271-F275 AromaticContact CE1-CD2 3.97Å; F271-F275 HydrophobicContact CE1-CD2 3.97Å; F271-F275 AromaticContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CG-CD2 4.12Å; F271-F275 HydrophobicContact CG-CE2 4.44Å; F271-F275 HydrophobicContact CZ-CE2 4.31Å; F271-F275 WeakPolarHBondContact O-CA 2.99Å; F271-F275 WeakPolarHBondContact O-CB 3.42Å; F271-F275 PolarHBondContact O-N 2.74Å; F271-A276 PolarHBondContact O-N 3.33Å; F271-A276 VanDerWaalsContact O-N 3.11Å; F271-H326 AromaticContact CE1-CD2 3.83Å; F271-H326 AromaticContact CZ-CD2 3.49Å; F271-H326 VanDerWaalsContact CZ-CD2 3.49Å; F271-H326 WeakPolarHBondContact CZ-CD2 3.2Å; F271-H326 AromaticContact CZ-NE2 3.78Å; F271-W327 HydrophobicContact CD1-CH2 4.24Å; F271-W327 HydrophobicContact CD1-CZ3 4.22Å; F271-W327 AromaticContact CE1-CH2 3.91Å; F271-W327 HydrophobicContact CE1-CH2 3.91Å; F271-W327 AromaticContact CE1-CZ3 3.78Å; F271-W327 HydrophobicContact CE1-CZ3 3.78Å
272	Y	97.4	Very high	95.6	Very high	5 Å²	5	58.8 Å²	58.8	2%	0.02	28%	0.276	C	S	.	.	I	π-helix	trans	-60.2	-54.5	174.7	174.5	-107.5	0	0	0	110.7	N268 E269 E270 R274 A276 I277 L280 P290 V293 A296	N268-Y272 WeakPolarHBondContact O-CB 3.08Å; N268-Y272 PolarHBondContact O-N 3Å; E269-Y272 PolarHBondContact O-N 3.34Å; E270-Y272 VanDerWaalsContact C-N 3.34Å; Y272-R274 PolarHBondContact O-N 2.64Å; Y272-A276 HydrophobicContact CD2-CB 3.57Å; Y272-A276 HydrophobicContact CE2-CB 4.22Å; Y272-A276 HydrophobicContact CG-CB 4.3Å; Y272-A276 WeakPolarHBondContact O-CA 3.4Å; Y272-A276 VanDerWaalsContact O-CB 3.28Å; Y272-A276 WeakPolarHBondContact O-CB 3.39Å; Y272-A276 PolarHBondContact O-N 3.35Å; Y272-I277 HydrophobicContact CD1-CD1 4.28Å; Y272-I277 HydrophobicContact CD1-CG1 4.33Å; Y272-I277 HydrophobicContact CE1-CD1 3.75Å; Y272-I277 HydrophobicContact CE1-CG1 3.83Å; Y272-I277 HydrophobicContact CE2-CG1 4.15Å; Y272-I277 PolarHBondContact O-N 2.81Å; Y272-L280 HydrophobicContact CE2-CD1 4.34Å; Y272-P290 VanDerWaalsContact CE1-O 3.28Å; Y272-P290 WeakPolarHBondContact CE1-O 3.28Å; Y272-P290 PolarHBondContact OH-O 3.05Å; Y272-V293 HydrophobicContact CD1-CB 3.96Å; Y272-V293 HydrophobicContact CD1-CG2 4.48Å; Y272-V293 HydrophobicContact CD2-CB 4.33Å; Y272-V293 HydrophobicContact CD2-CG2 3.97Å; Y272-V293 HydrophobicContact CG-CB 3.76Å; Y272-V293 HydrophobicContact CG-CG2 3.81Å; Y272-A296 HydrophobicContact CE1-CB 4.36Å; Y272-A296 HydrophobicContact CE2-CB 3.66Å; Y272-A296 VanDerWaalsContact OH-CB 3.29Å; Y272-A296 WeakPolarHBondContact OH-CB 3.4Å
273	R	96.4	Very high	95.7	Very high	137 Å²	137	58.5 Å²	58.5	52%	0.517	27%	0.269	S	S	.	.	I	π-helix	trans	-64.1	-43.8	-179	-68.5	177.5	-170.9	-165.3	3	112.7	E269 T291	E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 VanDerWaalsContact O-CG 3.32Å; E269-R273 WeakPolarHBondContact O-CG 3.44Å; E269-R273 PolarHBondContact O-N 3.13Å; E269-R273 IonicContact OE2-CZ 2.96Å; E269-R273 IonicContact OE2-NE 2.7Å; E269-R273 PolarHBondContact OE2-NE 3.12Å; E269-R273 IonicContact OE2-NH2 3.48Å; E269-R273 PolarHBondContact OE2-NH2 2.74Å; R273-T291 PolarHBondContact NE-O 3.26Å
274	R	95.9	Very high	95.6	Very high	157 Å²	157	58.8 Å²	58.8	59%	0.592	28%	0.275	S	S	*	.	I	π-helix	trans	-79.5	-32.4	-172.1	-170.5	172	-178.9	172.8	3.4	113.8	E270 Y272	E270-R274 VanDerWaalsContact O-CB 3.23Å; E270-R274 WeakPolarHBondContact O-CB 3.46Å; E270-R274 PolarHBondContact O-N 3.08Å; Y272-R274 PolarHBondContact O-N 2.64Å
275	F	96.8	Very high	95.4	Very high	14 Å²	14	64.7 Å²	64.7	6%	0.061	31%	0.307	C	S	.	.	I	π-helix	trans	-126	-46.5	-172.1	-57.1	-73.4	0	0	0	112.8	F264 F271 P278 M279 N324 W327	F264-F275 HydrophobicContact CE1-CB 4Å; F264-F275 HydrophobicContact CZ-CB 3.9Å; F271-F275 HydrophobicContact CB-CD2 4.39Å; F271-F275 AromaticContact CD1-CD2 3.56Å; F271-F275 HydrophobicContact CD1-CD2 3.56Å; F271-F275 AromaticContact CD1-CE2 3.85Å; F271-F275 HydrophobicContact CD1-CE2 3.85Å; F271-F275 AromaticContact CE1-CD2 3.97Å; F271-F275 HydrophobicContact CE1-CD2 3.97Å; F271-F275 AromaticContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CG-CD2 4.12Å; F271-F275 HydrophobicContact CG-CE2 4.44Å; F271-F275 HydrophobicContact CZ-CE2 4.31Å; F271-F275 WeakPolarHBondContact O-CA 2.99Å; F271-F275 WeakPolarHBondContact O-CB 3.42Å; F271-F275 PolarHBondContact O-N 2.74Å; F275-P278 WeakPolarHBondContact O-CD 3.34Å; F275-M279 HydrophobicContact CB-CE 3.99Å; F275-M279 HydrophobicContact CB-SD 4.46Å; F275-M279 WeakPolarHBondContact O-CB 3.49Å; F275-M279 WeakPolarHBondContact O-CG 3.31Å; F275-M279 PolarHBondContact O-N 3.36Å; F275-N324 HydrophobicContact CE1-CB 4.4Å; F275-N324 HydrophobicContact CZ-CB 3.95Å; F275-W327 AromaticContact CD1-CH2 3.87Å; F275-W327 HydrophobicContact CD1-CH2 3.87Å; F275-W327 AromaticContact CD1-CZ2 3.72Å; F275-W327 HydrophobicContact CD1-CZ2 3.72Å; F275-W327 AromaticContact CD2-CH2 3.86Å; F275-W327 HydrophobicContact CD2-CH2 3.86Å; F275-W327 AromaticContact CE1-CH2 3.95Å; F275-W327 HydrophobicContact CE1-CH2 3.95Å; F275-W327 AromaticContact CE1-CZ2 3.64Å; F275-W327 HydrophobicContact CE1-CZ2 3.64Å; F275-W327 AromaticContact CE2-CH2 3.94Å; F275-W327 HydrophobicContact CE2-CH2 3.94Å; F275-W327 HydrophobicContact CE2-CZ2 4.44Å; F275-W327 AromaticContact CG-CH2 3.83Å; F275-W327 HydrophobicContact CG-CH2 3.83Å; F275-W327 HydrophobicContact CG-CZ2 4.17Å; F275-W327 AromaticContact CZ-CH2 3.98Å; F275-W327 HydrophobicContact CZ-CH2 3.98Å; F275-W327 HydrophobicContact CZ-CZ2 4.03Å
276	A	97.1	Very high	95.3	Very high	3 Å²	3	64 Å²	64	3%	0.025	30%	0.304	C	S	.	.	I	π-helix	trans	-66.1	-44.3	-175.6	0	0	0	0	0	113	F264 F271 Y272 M279 L280 V303	F264-A276 HydrophobicContact CD1-CB 4.25Å; F264-A276 HydrophobicContact CE1-CB 4.21Å; F271-A276 PolarHBondContact O-N 3.33Å; F271-A276 VanDerWaalsContact O-N 3.11Å; Y272-A276 HydrophobicContact CD2-CB 3.57Å; Y272-A276 HydrophobicContact CE2-CB 4.22Å; Y272-A276 HydrophobicContact CG-CB 4.3Å; Y272-A276 WeakPolarHBondContact O-CA 3.4Å; Y272-A276 VanDerWaalsContact O-CB 3.28Å; Y272-A276 WeakPolarHBondContact O-CB 3.39Å; Y272-A276 PolarHBondContact O-N 3.35Å; A276-M279 PolarHBondContact O-N 3.15Å; A276-L280 WeakPolarHBondContact O-CB 3.5Å; A276-L280 VanDerWaalsContact O-CG 3.31Å; A276-L280 WeakPolarHBondContact O-CG 2.96Å; A276-L280 PolarHBondContact O-N 3.34Å; A276-V303 VanDerWaalsContact CA-CG2 3.5Å; A276-V303 HydrophobicContact CB-CG2 3.36Å
277	I	96.4	Very high	95.1	Very high	31 Å²	31	63.3 Å²	63.3	16%	0.159	31%	0.305	C	S	.	.	H	α-helix	trans	-58.2	-51.4	178.2	-71.8	179.5	0	0	0	111.4	Y272 M279 L280 K281 L289	Y272-I277 HydrophobicContact CD1-CD1 4.28Å; Y272-I277 HydrophobicContact CD1-CG1 4.33Å; Y272-I277 HydrophobicContact CE1-CD1 3.75Å; Y272-I277 HydrophobicContact CE1-CG1 3.83Å; Y272-I277 HydrophobicContact CE2-CG1 4.15Å; Y272-I277 PolarHBondContact O-N 2.81Å; I277-M279 VanDerWaalsContact C-N 3.34Å; I277-M279 PolarHBondContact O-N 3.11Å; I277-L280 PolarHBondContact O-N 3.09Å; I277-K281 HydrophobicContact CG2-CD 4.08Å; I277-K281 WeakPolarHBondContact O-CB 3.48Å; I277-K281 WeakPolarHBondContact O-CG 3.33Å; I277-K281 PolarHBondContact O-N 3.27Å; I277-L289 HydrophobicContact CB-CD1 4.27Å; I277-L289 HydrophobicContact CG1-CD1 4.31Å; I277-L289 HydrophobicContact CG2-CD1 4.01Å
278	P	95.1	Very high	94.9	Very high	48 Å²	48	64.9 Å²	64.9	31%	0.312	32%	0.317	S	S	.	.	H	α-helix	trans	-56	-43.7	172.7	-28.3	34.4	0	0	0	113.9	F275 K281 L282	F275-P278 WeakPolarHBondContact O-CD 3.34Å; P278-K281 PolarHBondContact O-N 2.7Å; P278-L282 WeakPolarHBondContact O-CB 3.29Å; P278-L282 VanDerWaalsContact O-CG 3.29Å; P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.24Å
279	M	97.1	Very high	94.8	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-50	179.4	-71.3	163.8	-177.5	0	0	111.9	F264 F275 A276 I277 K281 L282 Y283 V303 F308 Y311	F264-M279 HydrophobicContact CE1-SD 4.39Å; F264-M279 HydrophobicContact CZ-CE 4.04Å; F264-M279 HydrophobicContact CZ-SD 4.09Å; F275-M279 HydrophobicContact CB-CE 3.99Å; F275-M279 HydrophobicContact CB-SD 4.46Å; F275-M279 WeakPolarHBondContact O-CB 3.49Å; F275-M279 WeakPolarHBondContact O-CG 3.31Å; F275-M279 PolarHBondContact O-N 3.36Å; A276-M279 PolarHBondContact O-N 3.15Å; I277-M279 VanDerWaalsContact C-N 3.34Å; I277-M279 PolarHBondContact O-N 3.11Å; M279-K281 VanDerWaalsContact C-N 3.3Å; M279-K281 PolarHBondContact O-N 3.36Å; M279-L282 PolarHBondContact O-N 2.91Å; M279-Y283 HydrophobicContact CB-CD2 4.15Å; M279-Y283 HydrophobicContact CG-CD2 4.38Å; M279-Y283 HydrophobicContact CG-CE2 4.37Å; M279-Y283 WeakPolarHBondContact O-CB 3.35Å; M279-Y283 WeakPolarHBondContact O-CD2 3.45Å; M279-Y283 PolarHBondContact O-N 3.15Å; M279-V303 HydrophobicContact CB-CG1 4.28Å; M279-V303 HydrophobicContact CB-CG2 4.26Å; M279-V303 HydrophobicContact SD-CG1 3.8Å; M279-V303 HydrophobicContact SD-CG2 4.38Å; M279-F308 HydrophobicContact CE-CD2 3.79Å; M279-F308 HydrophobicContact CE-CE2 4.37Å; M279-F308 HydrophobicContact SD-CD2 4.49Å; M279-Y311 HydrophobicContact CE-CD1 3.32Å; M279-Y311 HydrophobicContact CE-CD2 3.77Å; M279-Y311 HydrophobicContact CE-CE1 3.7Å; M279-Y311 HydrophobicContact CE-CE2 4.12Å; M279-Y311 HydrophobicContact CE-CG 3.34Å; M279-Y311 HydrophobicContact CG-CD2 4.07Å; M279-Y311 HydrophobicContact CG-CG 4.11Å
280	L	97.2	Very high	94.8	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-35.6	-179.6	-71.2	169.9	0	0	0	112.3	Y272 A276 I277 S284 N285 H286 L289 V303	Y272-L280 HydrophobicContact CE2-CD1 4.34Å; A276-L280 WeakPolarHBondContact O-CB 3.5Å; A276-L280 VanDerWaalsContact O-CG 3.31Å; A276-L280 WeakPolarHBondContact O-CG 2.96Å; A276-L280 PolarHBondContact O-N 3.34Å; I277-L280 PolarHBondContact O-N 3.09Å; L280-S284 CarbonylContact O-C 3.36Å; L280-S284 WeakPolarHBondContact O-CB 3.3Å; L280-S284 PolarHBondContact O-N 2.74Å; L280-N285 PolarHBondContact O-N 2.98Å; L280-N285 VanDerWaalsContact O-N 3.16Å; L280-H286 HydrophobicContact CB-CB 4.36Å; L280-H286 PolarHBondContact O-N 3.39Å; L280-L289 HydrophobicContact CB-CD1 3.7Å; L280-L289 HydrophobicContact CB-CD2 4.13Å; L280-L289 HydrophobicContact CD1-CD1 4.27Å; L280-L289 HydrophobicContact CD1-CD2 3.85Å; L280-V303 HydrophobicContact CD1-CG2 4.24Å; L280-V303 HydrophobicContact CD2-CG2 4.18Å; L280-V303 HydrophobicContact CG-CG2 3.86Å
281	K	95.7	Very high	94.5	Very high	108 Å²	108	61.4 Å²	61.4	47%	0.47	31%	0.309	S	S	.	.	H	α-helix	trans	-68.3	-45.8	175.1	-77.3	177.7	175.5	-175.4	0	112.3	I277 P278 M279 H286 L289	I277-K281 HydrophobicContact CG2-CD 4.08Å; I277-K281 WeakPolarHBondContact O-CB 3.48Å; I277-K281 WeakPolarHBondContact O-CG 3.33Å; I277-K281 PolarHBondContact O-N 3.27Å; P278-K281 PolarHBondContact O-N 2.7Å; M279-K281 VanDerWaalsContact C-N 3.3Å; M279-K281 PolarHBondContact O-N 3.36Å; K281-H286 VanDerWaalsContact CG-O 3.31Å; K281-H286 WeakPolarHBondContact CG-O 3.01Å; K281-L289 HydrophobicContact CD-CD1 4.49Å; K281-L289 HydrophobicContact CG-CD1 3.83Å
282	L	94.9	Very high	94.5	Very high	92 Å²	92	62.5 Å²	62.5	48%	0.482	32%	0.318	S	S	.	.	H	α-helix	trans	-84.2	-35.9	-170.3	-70.3	171.9	0	0	0	113.7	P278 M279	P278-L282 WeakPolarHBondContact O-CB 3.29Å; P278-L282 VanDerWaalsContact O-CG 3.29Å; P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.24Å; M279-L282 PolarHBondContact O-N 2.91Å
283	Y	95.8	Very high	94.4	Very high	34 Å²	34	62.4 Å²	62.4	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-113.3	-15.3	-168.4	-50.1	-55.8	0	0	0	113.1	M279 Q310 Y311 D314	M279-Y283 HydrophobicContact CB-CD2 4.15Å; M279-Y283 HydrophobicContact CG-CD2 4.38Å; M279-Y283 HydrophobicContact CG-CE2 4.37Å; M279-Y283 WeakPolarHBondContact O-CB 3.35Å; M279-Y283 WeakPolarHBondContact O-CD2 3.45Å; M279-Y283 PolarHBondContact O-N 3.15Å; Y283-Q310 HydrophobicContact CD1-CB 3.74Å; Y283-Q310 HydrophobicContact CD2-CB 4.26Å; Y283-Q310 HydrophobicContact CE1-CB 4.1Å; Y283-Q310 HydrophobicContact CG-CB 3.85Å; Y283-Y311 HydrophobicContact CE2-CD2 4.32Å; Y283-D314 VanDerWaalsContact OH-CB 3.32Å; Y283-D314 WeakPolarHBondContact OH-CB 3.36Å; Y283-D314 PolarHBondContact OH-OD2 3.33Å
284	S	93.1	Very high	94.4	Very high	35 Å²	35	58.6 Å²	58.6	25%	0.245	31%	0.313	C	S	.	.	S	Bend	trans	-124.1	3.5	179.2	-23.9	0	0	0	0	113.8	L280 H286 D307	L280-S284 CarbonylContact O-C 3.36Å; L280-S284 WeakPolarHBondContact O-CB 3.3Å; L280-S284 PolarHBondContact O-N 2.74Å; S284-H286 PolarHBondContact O-N 3.29Å; S284-D307 PolarHBondContact OG-OD1 2.86Å; S284-D307 PolarHBondContact OG-OD2 3.41Å
285	N	91.5	Very high	94.5	Very high	134 Å²	134	57 Å²	57	72%	0.717	31%	0.312	S	S	*	.			trans	55.7	27.8	177.4	-62.5	-38	0	0	0	115.6	L280	L280-N285 PolarHBondContact O-N 2.98Å; L280-N285 VanDerWaalsContact O-N 3.16Å
286	H	92.5	Very high	94.4	Very high	68 Å²	68	56.4 Å²	56.4	32%	0.315	31%	0.309	S	S	.	.			trans	-79.1	126.4	173.8	-67.5	-62.7	0	0	0	111.2	L280 K281 S284 L289 L301	L280-H286 HydrophobicContact CB-CB 4.36Å; L280-H286 PolarHBondContact O-N 3.39Å; K281-H286 VanDerWaalsContact CG-O 3.31Å; K281-H286 WeakPolarHBondContact CG-O 3.01Å; S284-H286 PolarHBondContact O-N 3.29Å; H286-L289 HydrophobicContact CB-CD1 4.43Å; H286-L289 HydrophobicContact CB-CD2 3.61Å; H286-L289 HydrophobicContact CB-CG 4.06Å; H286-L301 VanDerWaalsContact CE1-CD2 3.44Å; H286-L301 WeakPolarHBondContact CE1-CD2 3.22Å; H286-L301 WeakPolarHBondContact ND1-CD2 3.35Å
287	T	87.7	Confident	94.4	Very high	113 Å²	113	57.7 Å²	57.7	69%	0.693	31%	0.314	S	S	*	.			trans	-100.9	-43	-177.4	49.9	0	0	0	0	113.2	L289	T287-L289 PolarHBondContact O-N 2.89Å
288	N	88.9	Confident	94.4	Very high	149 Å²	149	59.8 Å²	59.8	80%	0.797	34%	0.344	S	S	*	.	S	Bend	trans	-100.6	76.5	-176.9	-65.1	-26.6	0	0	0	110.9
289	L	94.1	Very high	94.3	Very high	27 Å²	27	60.7 Å²	60.7	14%	0.141	36%	0.355	C	S	.	.			trans	-90.8	130.6	179.9	-67.7	173.5	0	0	0	111.1	I277 L280 K281 H286 T287 L301	I277-L289 HydrophobicContact CB-CD1 4.27Å; I277-L289 HydrophobicContact CG1-CD1 4.31Å; I277-L289 HydrophobicContact CG2-CD1 4.01Å; L280-L289 HydrophobicContact CB-CD1 3.7Å; L280-L289 HydrophobicContact CB-CD2 4.13Å; L280-L289 HydrophobicContact CD1-CD1 4.27Å; L280-L289 HydrophobicContact CD1-CD2 3.85Å; K281-L289 HydrophobicContact CD-CD1 4.49Å; K281-L289 HydrophobicContact CG-CD1 3.83Å; H286-L289 HydrophobicContact CB-CD1 4.43Å; H286-L289 HydrophobicContact CB-CD2 3.61Å; H286-L289 HydrophobicContact CB-CG 4.06Å; T287-L289 PolarHBondContact O-N 2.89Å; L289-L301 HydrophobicContact CD2-CB 4.36Å; L289-L301 HydrophobicContact CD2-CD1 4.07Å; L289-L301 HydrophobicContact CD2-CD2 4.43Å
290	P	94.3	Very high	94.2	Very high	30 Å²	30	63.4 Å²	63.4	20%	0.195	38%	0.383	C	S	.	.			trans	-58.7	155.4	172.7	-25.1	35.6	0	0	0	112.5	Y272 E295 A296 L301	Y272-P290 VanDerWaalsContact CE1-O 3.28Å; Y272-P290 WeakPolarHBondContact CE1-O 3.28Å; Y272-P290 PolarHBondContact OH-O 3.05Å; P290-E295 HydrophobicContact CB-CB 3.7Å; P290-E295 HydrophobicContact CG-CB 4.19Å; P290-A296 HydrophobicContact CB-CB 4.36Å; P290-A296 HydrophobicContact CG-CB 4.25Å; P290-L301 HydrophobicContact CG-CD1 4.26Å
291	T	90.6	Very high	94.1	Very high	96 Å²	96	64.7 Å²	64.7	59%	0.589	39%	0.389	S	S	*	.	S	Bend	trans	-80.1	-30	178	-55.2	0	0	0	0	111.8	R273	R273-T291 PolarHBondContact NE-O 3.26Å
292	S	95.6	Very high	94.1	Very high	30 Å²	30	64.5 Å²	64.5	21%	0.21	39%	0.389	C	S	.	.	S	Bend	trans	-91.7	140.8	175.5	178.1	0	0	0	0	111.7	E269 S294 A296	E269-S292 VanDerWaalsContact OE1-CA 3.27Å; E269-S292 WeakPolarHBondContact OE1-CA 3.46Å; E269-S292 WeakPolarHBondContact OE1-CB 3.42Å; E269-S292 PolarHBondContact OE1-OG 3.13Å; S292-S294 VanDerWaalsContact C-N 3.28Å; S292-S294 PolarHBondContact O-N 2.94Å; S292-S294 PolarHBondContact OG-N 3.18Å; S292-A296 PolarHBondContact O-N 2.95Å; S292-A296 VanDerWaalsContact O-N 3.14Å
293	V	96.3	Very high	94.2	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-65.2	-33.7	174.3	71.6	0	0	0	0	111.8	E267 E269 Y272 A296 F297	E267-V293 HydrophobicContact CB-CG1 3.72Å; E267-V293 HydrophobicContact CG-CG1 4.03Å; E269-V293 HydrophobicContact CG-CG1 4.03Å; E269-V293 WeakPolarHBondContact OE1-CG1 3.49Å; E269-V293 PolarHBondContact OE1-N 3.15Å; Y272-V293 HydrophobicContact CD1-CB 3.96Å; Y272-V293 HydrophobicContact CD1-CG2 4.48Å; Y272-V293 HydrophobicContact CD2-CB 4.33Å; Y272-V293 HydrophobicContact CD2-CG2 3.97Å; Y272-V293 HydrophobicContact CG-CB 3.76Å; Y272-V293 HydrophobicContact CG-CG2 3.81Å; V293-A296 PolarHBondContact O-N 3.07Å; V293-F297 HydrophobicContact CG2-CD1 3.77Å; V293-F297 HydrophobicContact CG2-CE1 3.48Å; V293-F297 VanDerWaalsContact CG2-CE1 3.48Å; V293-F297 HydrophobicContact CG2-CE2 4.34Å; V293-F297 HydrophobicContact CG2-CG 4.32Å; V293-F297 HydrophobicContact CG2-CZ 3.8Å; V293-F297 VanDerWaalsContact O-CB 3.3Å; V293-F297 WeakPolarHBondContact O-CB 3.26Å; V293-F297 VanDerWaalsContact O-CD1 3.29Å; V293-F297 WeakPolarHBondContact O-CD1 3.31Å; V293-F297 WeakPolarHBondContact O-CG 3.45Å; V293-F297 PolarHBondContact O-N 2.87Å
294	S	96.9	Very high	94.2	Very high	58 Å²	58	61.3 Å²	61.3	41%	0.406	38%	0.379	S	S	.	.	H	α-helix	trans	-68.1	-43.7	-178.4	-162.9	0	0	0	0	111.1	E267 S292 F297 G298	E267-S294 WeakPolarHBondContact OE1-CA 3.05Å; E267-S294 VanDerWaalsContact OE1-CB 3.31Å; E267-S294 WeakPolarHBondContact OE1-CB 3.29Å; E267-S294 PolarHBondContact OE1-OG 3.32Å; S292-S294 VanDerWaalsContact C-N 3.28Å; S292-S294 PolarHBondContact O-N 2.94Å; S292-S294 PolarHBondContact OG-N 3.18Å; S294-F297 PolarHBondContact O-N 3.4Å; S294-G298 PolarHBondContact O-N 3.24Å
295	E	96.6	Very high	94.5	Very high	124 Å²	124	60.5 Å²	60.5	58%	0.579	37%	0.371	S	S	*	.	H	α-helix	trans	-61.9	-45.2	173	-68	177	171.7	0	0	111.8	P290 F297 G298 A299	P290-E295 HydrophobicContact CB-CB 3.7Å; P290-E295 HydrophobicContact CG-CB 4.19Å; E295-F297 VanDerWaalsContact C-N 3.34Å; E295-F297 PolarHBondContact O-N 2.76Å; E295-G298 PolarHBondContact O-N 3.2Å; E295-A299 WeakPolarHBondContact O-CB 3.17Å; E295-A299 PolarHBondContact O-N 3.27Å
296	A	96.2	Very high	94.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-44.4	177.2	0	0	0	0	0	111.6	Y272 P290 S292 V293 A299 G300 L301	Y272-A296 HydrophobicContact CE1-CB 4.36Å; Y272-A296 HydrophobicContact CE2-CB 3.66Å; Y272-A296 VanDerWaalsContact OH-CB 3.29Å; Y272-A296 WeakPolarHBondContact OH-CB 3.4Å; P290-A296 HydrophobicContact CB-CB 4.36Å; P290-A296 HydrophobicContact CG-CB 4.25Å; S292-A296 PolarHBondContact O-N 2.95Å; S292-A296 VanDerWaalsContact O-N 3.14Å; V293-A296 PolarHBondContact O-N 3.07Å; A296-A299 CarbonylContact O-C 3.38Å; A296-A299 PolarHBondContact O-N 2.91Å; A296-G300 PolarHBondContact O-N 3.15Å; A296-L301 HydrophobicContact CB-CB 4.23Å; A296-L301 WeakPolarHBondContact O-CA 3.38Å; A296-L301 WeakPolarHBondContact O-CB 3.03Å; A296-L301 PolarHBondContact O-N 3.27Å
297	F	95.9	Very high	95	Very high	31 Å²	31	53.1 Å²	53.1	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-66	-40.6	178.5	-81.5	23.7	0	0	0	111.8	F264 E267 V293 S294 E295 A299 G300 K302	F264-F297 WeakPolarHBondContact O-CZ 3.43Å; E267-F297 HydrophobicContact CG-CD2 3.97Å; E267-F297 HydrophobicContact CG-CE2 4.22Å; V293-F297 HydrophobicContact CG2-CD1 3.77Å; V293-F297 HydrophobicContact CG2-CE1 3.48Å; V293-F297 VanDerWaalsContact CG2-CE1 3.48Å; V293-F297 HydrophobicContact CG2-CE2 4.34Å; V293-F297 HydrophobicContact CG2-CG 4.32Å; V293-F297 HydrophobicContact CG2-CZ 3.8Å; V293-F297 VanDerWaalsContact O-CB 3.3Å; V293-F297 WeakPolarHBondContact O-CB 3.26Å; V293-F297 VanDerWaalsContact O-CD1 3.29Å; V293-F297 WeakPolarHBondContact O-CD1 3.31Å; V293-F297 WeakPolarHBondContact O-CG 3.45Å; V293-F297 PolarHBondContact O-N 2.87Å; S294-F297 PolarHBondContact O-N 3.4Å; E295-F297 VanDerWaalsContact C-N 3.34Å; E295-F297 PolarHBondContact O-N 2.76Å; F297-A299 PolarHBondContact O-N 3.39Å; F297-G300 PolarHBondContact O-N 2.9Å; F297-K302 HydrophobicContact CD1-CD 4.24Å; F297-K302 HydrophobicContact CD1-CG 3.71Å; F297-K302 HydrophobicContact CD2-CD 4.43Å; F297-K302 HydrophobicContact CE1-CD 4.37Å; F297-K302 HydrophobicContact CE1-CG 3.9Å; F297-K302 HydrophobicContact CG-CD 4.27Å; F297-K302 VanDerWaalsContact CG-CE 3.46Å; F297-K302 HydrophobicContact CG-CG 4.17Å
298	G	95.7	Very high	95.5	Very high	75 Å²	75	47.7 Å²	47.7	77%	0.773	30%	0.303	S	S	*	.	H	α-helix	trans	-61.9	-31.6	174	0	0	0	0	0	113.1	S294 E295 G300	S294-G298 PolarHBondContact O-N 3.24Å; E295-G298 PolarHBondContact O-N 3.2Å; G298-G300 VanDerWaalsContact C-N 3.32Å
299	A	94.9	Very high	96	Very high	66 Å²	66	40.6 Å²	40.6	55%	0.545	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.4	173.8	0	0	0	0	0	114.2	E295 A296 F297 L301	E295-A299 WeakPolarHBondContact O-CB 3.17Å; E295-A299 PolarHBondContact O-N 3.27Å; A296-A299 CarbonylContact O-C 3.38Å; A296-A299 PolarHBondContact O-N 2.91Å; F297-A299 PolarHBondContact O-N 3.39Å; A299-L301 HydrophobicContact CB-CD1 4.02Å; A299-L301 HydrophobicContact CB-CG 4.13Å; A299-L301 PolarHBondContact O-N 3.09Å
300	G	93.9	Very high	96.2	Very high	57 Å²	57	41.7 Å²	41.7	59%	0.588	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	10.3	-176.8	0	0	0	0	0	114.8	A296 F297 G298 K302	A296-G300 PolarHBondContact O-N 3.15Å; F297-G300 PolarHBondContact O-N 2.9Å; G298-G300 VanDerWaalsContact C-N 3.32Å; G300-K302 VanDerWaalsContact C-N 3.32Å; G300-K302 PolarHBondContact O-N 2.56Å
301	L	95.4	Very high	96.4	Very high	28 Å²	28	41.6 Å²	41.6	15%	0.147	27%	0.265	C	S	.	.			trans	-82.8	76.3	179.4	-61.3	169.2	0	0	0	110	H286 L289 P290 A296 A299	H286-L301 VanDerWaalsContact CE1-CD2 3.44Å; H286-L301 WeakPolarHBondContact CE1-CD2 3.22Å; H286-L301 WeakPolarHBondContact ND1-CD2 3.35Å; L289-L301 HydrophobicContact CD2-CB 4.36Å; L289-L301 HydrophobicContact CD2-CD1 4.07Å; L289-L301 HydrophobicContact CD2-CD2 4.43Å; P290-L301 HydrophobicContact CG-CD1 4.26Å; A296-L301 HydrophobicContact CB-CB 4.23Å; A296-L301 WeakPolarHBondContact O-CA 3.38Å; A296-L301 WeakPolarHBondContact O-CB 3.03Å; A296-L301 PolarHBondContact O-N 3.27Å; A299-L301 HydrophobicContact CB-CD1 4.02Å; A299-L301 HydrophobicContact CB-CG 4.13Å; A299-L301 PolarHBondContact O-N 3.09Å
302	K	95.4	Very high	96.7	Very high	105 Å²	105	37.2 Å²	37.2	46%	0.457	24%	0.239	S	C	.	.			trans	-114.9	137.7	179.5	-61	-170.9	-179.6	-173.1	0	110.5	F297 G300 S304	F297-K302 HydrophobicContact CD1-CD 4.24Å; F297-K302 HydrophobicContact CD1-CG 3.71Å; F297-K302 HydrophobicContact CD2-CD 4.43Å; F297-K302 HydrophobicContact CE1-CD 4.37Å; F297-K302 HydrophobicContact CE1-CG 3.9Å; F297-K302 HydrophobicContact CG-CD 4.27Å; F297-K302 VanDerWaalsContact CG-CE 3.46Å; F297-K302 HydrophobicContact CG-CG 4.17Å; G300-K302 VanDerWaalsContact C-N 3.32Å; G300-K302 PolarHBondContact O-N 2.56Å; K302-S304 PolarHBondContact O-N 3.1Å
303	V	96.8	Very high	96.8	Very high	10 Å²	10	37.4 Å²	37.4	6%	0.061	24%	0.237	C	C	.	.			trans	-61.7	129.9	172.4	178.4	0	0	0	0	108.2	F260 A276 M279 L280 D307	F260-V303 HydrophobicContact CE2-CG1 4.06Å; F260-V303 WeakPolarHBondContact CZ-O 3.45Å; A276-V303 VanDerWaalsContact CA-CG2 3.5Å; A276-V303 HydrophobicContact CB-CG2 3.36Å; M279-V303 HydrophobicContact CB-CG1 4.28Å; M279-V303 HydrophobicContact CB-CG2 4.26Å; M279-V303 HydrophobicContact SD-CG1 3.8Å; M279-V303 HydrophobicContact SD-CG2 4.38Å; L280-V303 HydrophobicContact CD1-CG2 4.24Å; L280-V303 HydrophobicContact CD2-CG2 4.18Å; L280-V303 HydrophobicContact CG-CG2 3.86Å; V303-D307 HydrophobicContact CG1-CB 3.9Å
304	S	96.9	Very high	96.9	Very high	49 Å²	49	38.1 Å²	38.1	34%	0.343	24%	0.241	S	C	.	.			trans	-85.5	161.9	171.6	75.3	0	0	0	0	111.2	F260 K302 S306 D307 F308	F260-S304 WeakPolarHBondContact CE2-O 3.27Å; K302-S304 PolarHBondContact O-N 3.1Å; S304-S306 PolarHBondContact O-N 3.28Å; S304-S306 PolarHBondContact OG-N 3.13Å; S304-D307 VanDerWaalsContact CB-OD2 3.28Å; S304-D307 WeakPolarHBondContact CB-OD2 3.27Å; S304-D307 PolarHBondContact N-OD2 2.96Å; S304-D307 PolarHBondContact O-N 3.38Å; S304-D307 PolarHBondContact OG-N 2.76Å; S304-D307 VanDerWaalsContact OG-N 3.15Å; S304-D307 PolarHBondContact OG-OD2 2.82Å; S304-F308 PolarHBondContact O-N 2.85Å; S304-F308 VanDerWaalsContact O-N 3.15Å
305	F	97.8	Very high	96.7	Very high	17 Å²	17	39.8 Å²	39.8	8%	0.075	25%	0.25	C	C	.	.	H	α-helix	trans	-59.7	-33.4	172.8	-169.2	-120.9	0	0	0	112	I257 F260 F308 I309 W385 F386 I389	I257-F305 HydrophobicContact CG1-CE2 4.3Å; I257-F305 HydrophobicContact CG1-CZ 3.98Å; F260-F305 HydrophobicContact CB-CD2 4.04Å; F260-F305 HydrophobicContact CB-CE2 4.2Å; F260-F305 HydrophobicContact CD1-CD2 4.06Å; F260-F305 HydrophobicContact CD2-CD2 4.06Å; F260-F305 HydrophobicContact CE1-CB 4.4Å; F260-F305 AromaticContact CG-CD2 3.77Å; F260-F305 HydrophobicContact CG-CD2 3.77Å; F260-F305 HydrophobicContact CG-CE2 4.42Å; F260-F305 HydrophobicContact CZ-CB 4.35Å; F305-F308 HydrophobicContact CD2-CD1 4.11Å; F305-F308 AromaticContact CE2-CD1 3.99Å; F305-F308 HydrophobicContact CE2-CD1 3.99Å; F305-F308 HydrophobicContact CE2-CE1 4.5Å; F305-F308 WeakPolarHBondContact O-CB 3.03Å; F305-F308 PolarHBondContact O-N 3.04Å; F305-I309 HydrophobicContact CD1-CG1 4.19Å; F305-I309 HydrophobicContact CE1-CD1 4.06Å; F305-I309 HydrophobicContact CE1-CG1 3.95Å; F305-I309 HydrophobicContact CE2-CD1 4.15Å; F305-I309 HydrophobicContact CZ-CD1 3.77Å; F305-I309 HydrophobicContact CZ-CG1 4.16Å; F305-I309 WeakPolarHBondContact O-CG1 3.28Å; F305-I309 PolarHBondContact O-N 2.96Å; F305-W385 HydrophobicContact CB-CE3 3.84Å; F305-W385 HydrophobicContact CB-CZ3 3.81Å; F305-W385 HydrophobicContact CD1-CB 4.49Å; F305-W385 AromaticContact CD1-CE3 3.87Å; F305-W385 HydrophobicContact CD1-CE3 3.87Å; F305-W385 WeakPolarHBondContact CD1-O 3.17Å; F305-W385 AromaticContact CD2-CE3 3.67Å; F305-W385 HydrophobicContact CD2-CE3 3.67Å; F305-W385 AromaticContact CD2-CZ3 3.82Å; F305-W385 HydrophobicContact CD2-CZ3 3.82Å; F305-W385 HydrophobicContact CE1-CB 4.26Å; F305-W385 HydrophobicContact CE1-CE3 4.31Å; F305-W385 HydrophobicContact CE2-CE3 4.15Å; F305-W385 AromaticContact CG-CE3 3.52Å; F305-W385 HydrophobicContact CG-CE3 3.52Å; F305-W385 AromaticContact CG-CZ3 3.86Å; F305-W385 HydrophobicContact CG-CZ3 3.86Å; F305-W385 HydrophobicContact CZ-CE3 4.44Å; F305-F386 HydrophobicContact CE1-CD1 4.19Å; F305-F386 HydrophobicContact CE1-CD2 4.48Å; F305-F386 AromaticContact CE1-CE1 3.91Å; F305-F386 HydrophobicContact CE1-CE1 3.91Å; F305-F386 HydrophobicContact CE1-CE2 4.21Å; F305-F386 HydrophobicContact CE1-CG 4.48Å; F305-F386 AromaticContact CE1-CZ 3.93Å; F305-F386 HydrophobicContact CE1-CZ 3.93Å; F305-F386 HydrophobicContact CZ-CE1 4.23Å; F305-F386 HydrophobicContact CZ-CE2 4.22Å; F305-F386 AromaticContact CZ-CZ 3.87Å; F305-F386 HydrophobicContact CZ-CZ 3.87Å; F305-I389 HydrophobicContact CD1-CD1 4.13Å; F305-I389 HydrophobicContact CD1-CG1 4.22Å; F305-I389 HydrophobicContact CE1-CG1 4.4Å
306	S	97.9	Very high	96.6	Very high	35 Å²	35	40.4 Å²	40.4	25%	0.245	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-43.3	176.1	-170.6	0	0	0	0	112.2	S304 F308 I309 Q310	S304-S306 PolarHBondContact O-N 3.28Å; S304-S306 PolarHBondContact OG-N 3.13Å; S306-F308 VanDerWaalsContact C-N 3.27Å; S306-F308 PolarHBondContact O-N 2.94Å; S306-I309 PolarHBondContact O-N 2.77Å; S306-Q310 WeakPolarHBondContact O-CG 3.31Å; S306-Q310 PolarHBondContact O-N 2.85Å
307	D	97.9	Very high	96.5	Very high	12 Å²	12	41 Å²	41	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-39.1	174.8	-56.2	-53	0	0	0	111.1	S284 V303 S304 Q310 Y311	S284-D307 PolarHBondContact OG-OD1 2.86Å; S284-D307 PolarHBondContact OG-OD2 3.41Å; V303-D307 HydrophobicContact CG1-CB 3.9Å; S304-D307 VanDerWaalsContact CB-OD2 3.28Å; S304-D307 WeakPolarHBondContact CB-OD2 3.27Å; S304-D307 PolarHBondContact N-OD2 2.96Å; S304-D307 PolarHBondContact O-N 3.38Å; S304-D307 PolarHBondContact OG-N 2.76Å; S304-D307 VanDerWaalsContact OG-N 3.15Å; S304-D307 PolarHBondContact OG-OD2 2.82Å; D307-Q310 PolarHBondContact O-N 2.9Å; D307-Y311 WeakPolarHBondContact O-CB 3.19Å; D307-Y311 PolarHBondContact O-N 2.84Å
308	F	98.4	Very high	96.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-42.3	176.1	178.8	-117.2	0	0	0	112.4	L256 F260 F264 M279 S304 F305 S306 Y311 L312 W327	L256-F308 HydrophobicContact CB-CE1 4.48Å; L256-F308 HydrophobicContact CD2-CE1 4.37Å; L256-F308 HydrophobicContact CD2-CZ 4.45Å; F260-F308 HydrophobicContact CB-CD1 4.05Å; F260-F308 HydrophobicContact CB-CE1 4.17Å; F260-F308 HydrophobicContact CD2-CB 3.62Å; F260-F308 AromaticContact CD2-CD1 3.85Å; F260-F308 HydrophobicContact CD2-CD1 3.85Å; F260-F308 HydrophobicContact CD2-CD2 4.48Å; F260-F308 AromaticContact CD2-CG 3.73Å; F260-F308 HydrophobicContact CD2-CG 3.73Å; F260-F308 HydrophobicContact CE2-CB 3.87Å; F260-F308 HydrophobicContact CE2-CG 4.46Å; F260-F308 HydrophobicContact CG-CD1 4.35Å; F264-F308 AromaticContact CE2-CD2 3.94Å; F264-F308 HydrophobicContact CE2-CD2 3.94Å; F264-F308 HydrophobicContact CE2-CE2 4.12Å; M279-F308 HydrophobicContact CE-CD2 3.79Å; M279-F308 HydrophobicContact CE-CE2 4.37Å; M279-F308 HydrophobicContact SD-CD2 4.49Å; S304-F308 PolarHBondContact O-N 2.85Å; S304-F308 VanDerWaalsContact O-N 3.15Å; F305-F308 HydrophobicContact CD2-CD1 4.11Å; F305-F308 AromaticContact CE2-CD1 3.99Å; F305-F308 HydrophobicContact CE2-CD1 3.99Å; F305-F308 HydrophobicContact CE2-CE1 4.5Å; F305-F308 WeakPolarHBondContact O-CB 3.03Å; F305-F308 PolarHBondContact O-N 3.04Å; S306-F308 VanDerWaalsContact C-N 3.27Å; S306-F308 PolarHBondContact O-N 2.94Å; F308-Y311 WeakPolarHBondContact O-CB 3.47Å; F308-Y311 PolarHBondContact O-N 3.36Å; F308-L312 HydrophobicContact CD1-CD1 4.34Å; F308-L312 HydrophobicContact CE1-CD1 3.83Å; F308-L312 HydrophobicContact CE2-CD1 4.39Å; F308-L312 HydrophobicContact CE2-CD2 4.33Å; F308-L312 HydrophobicContact CE2-CG 4.34Å; F308-L312 HydrophobicContact CZ-CD1 3.86Å; F308-L312 HydrophobicContact CZ-CD2 4.35Å; F308-L312 HydrophobicContact CZ-CG 4.29Å; F308-L312 WeakPolarHBondContact O-CG 3.47Å; F308-L312 PolarHBondContact O-N 3.32Å; F308-L312 VanDerWaalsContact O-N 3.15Å; F308-W327 AromaticContact CE2-CD2 3.97Å; F308-W327 HydrophobicContact CE2-CD2 3.97Å; F308-W327 AromaticContact CE2-CE3 3.97Å; F308-W327 HydrophobicContact CE2-CE3 3.97Å; F308-W327 HydrophobicContact CE2-CG 4.29Å; F308-W327 HydrophobicContact CE2-CZ3 4.41Å; F308-W327 HydrophobicContact CZ-CB 3.96Å; F308-W327 HydrophobicContact CZ-CD2 4.11Å; F308-W327 HydrophobicContact CZ-CE3 4.1Å; F308-W327 HydrophobicContact CZ-CG 4.09Å
309	I	98.4	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-44.1	174.4	-65	-45.5	0	0	0	111	F305 S306 Y311 L312 L313 F386 I389 W393 L397	F305-I309 HydrophobicContact CD1-CG1 4.19Å; F305-I309 HydrophobicContact CE1-CD1 4.06Å; F305-I309 HydrophobicContact CE1-CG1 3.95Å; F305-I309 HydrophobicContact CE2-CD1 4.15Å; F305-I309 HydrophobicContact CZ-CD1 3.77Å; F305-I309 HydrophobicContact CZ-CG1 4.16Å; F305-I309 WeakPolarHBondContact O-CG1 3.28Å; F305-I309 PolarHBondContact O-N 2.96Å; S306-I309 PolarHBondContact O-N 2.77Å; I309-Y311 VanDerWaalsContact C-N 3.3Å; I309-Y311 PolarHBondContact O-N 2.83Å; I309-L312 HydrophobicContact CD1-CD1 4.35Å; I309-L312 PolarHBondContact O-N 3.25Å; I309-L312 VanDerWaalsContact O-N 3.12Å; I309-L313 HydrophobicContact CG2-CD1 3.8Å; I309-L313 HydrophobicContact CG2-CG 4.19Å; I309-L313 WeakPolarHBondContact O-CG 3.46Å; I309-L313 PolarHBondContact O-N 3.39Å; I309-F386 HydrophobicContact CD1-CE1 4.42Å; I309-I389 HydrophobicContact CG1-CD1 4.19Å; I309-I389 HydrophobicContact CG2-CG2 4.2Å; I309-W393 HydrophobicContact CG2-CB 4.42Å; I309-W393 HydrophobicContact CG2-CE3 4.31Å; I309-L397 HydrophobicContact CD1-CD1 4.36Å; I309-L397 HydrophobicContact CD1-CD2 3.68Å
310	Q	97.9	Very high	96	Very high	49 Å²	49	52 Å²	52	23%	0.229	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-43.4	175.4	-73.8	-177.5	83.6	0	0	112.1	Y283 S306 D307 L312 L313 D314 W393	Y283-Q310 HydrophobicContact CD1-CB 3.74Å; Y283-Q310 HydrophobicContact CD2-CB 4.26Å; Y283-Q310 HydrophobicContact CE1-CB 4.1Å; Y283-Q310 HydrophobicContact CG-CB 3.85Å; S306-Q310 WeakPolarHBondContact O-CG 3.31Å; S306-Q310 PolarHBondContact O-N 2.85Å; D307-Q310 PolarHBondContact O-N 2.9Å; Q310-L312 VanDerWaalsContact C-N 3.3Å; Q310-L312 PolarHBondContact O-N 3.02Å; Q310-L313 CarbonylContact O-C 3.56Å; Q310-L313 PolarHBondContact O-N 3.09Å; Q310-D314 WeakPolarHBondContact O-CB 3.26Å; Q310-D314 PolarHBondContact O-N 2.65Å; Q310-W393 HydrophobicContact CG-CE3 3.99Å; Q310-W393 HydrophobicContact CG-CH2 3.19Å; Q310-W393 HydrophobicContact CG-CZ2 3.92Å; Q310-W393 HydrophobicContact CG-CZ3 3.22Å
311	Y	98	Very high	95.8	Very high	28 Å²	28	51.8 Å²	51.8	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-56.9	-41.3	175	170	-97	0	0	0	113.3	M279 Y283 D307 F308 I309 T317 W327	M279-Y311 HydrophobicContact CE-CD1 3.32Å; M279-Y311 HydrophobicContact CE-CD2 3.77Å; M279-Y311 HydrophobicContact CE-CE1 3.7Å; M279-Y311 HydrophobicContact CE-CE2 4.12Å; M279-Y311 HydrophobicContact CE-CG 3.34Å; M279-Y311 HydrophobicContact CG-CD2 4.07Å; M279-Y311 HydrophobicContact CG-CG 4.11Å; Y283-Y311 HydrophobicContact CE2-CD2 4.32Å; D307-Y311 WeakPolarHBondContact O-CB 3.19Å; D307-Y311 PolarHBondContact O-N 2.84Å; F308-Y311 WeakPolarHBondContact O-CB 3.47Å; F308-Y311 PolarHBondContact O-N 3.36Å; I309-Y311 VanDerWaalsContact C-N 3.3Å; I309-Y311 PolarHBondContact O-N 2.83Å; Y311-T317 HydrophobicContact CD1-CG2 4.36Å; Y311-T317 HydrophobicContact CD2-CG2 4Å; Y311-T317 HydrophobicContact CE1-CG2 3.8Å; Y311-T317 HydrophobicContact CE2-CG2 3.37Å; Y311-T317 HydrophobicContact CG-CG2 4.46Å; Y311-T317 WeakPolarHBondContact O-CB 3.4Å; Y311-T317 PolarHBondContact O-OG1 3.02Å; Y311-T317 WeakPolarHBondContact OH-CG2 3.41Å; Y311-W327 AromaticContact CE1-CZ2 3.97Å; Y311-W327 HydrophobicContact CE1-CZ2 3.97Å; Y311-W327 AromaticContact CE1-NE1 3.74Å
312	L	98.2	Very high	95.7	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-71	-34	177.6	-65	177.2	0	0	0	112.5	L256 F308 I309 Q310 F323 W327 L397 L400	L256-L312 HydrophobicContact CD1-CD1 4.11Å; L256-L312 HydrophobicContact CD2-CD1 3.99Å; F308-L312 HydrophobicContact CD1-CD1 4.34Å; F308-L312 HydrophobicContact CE1-CD1 3.83Å; F308-L312 HydrophobicContact CE2-CD1 4.39Å; F308-L312 HydrophobicContact CE2-CD2 4.33Å; F308-L312 HydrophobicContact CE2-CG 4.34Å; F308-L312 HydrophobicContact CZ-CD1 3.86Å; F308-L312 HydrophobicContact CZ-CD2 4.35Å; F308-L312 HydrophobicContact CZ-CG 4.29Å; F308-L312 WeakPolarHBondContact O-CG 3.47Å; F308-L312 PolarHBondContact O-N 3.32Å; F308-L312 VanDerWaalsContact O-N 3.15Å; I309-L312 HydrophobicContact CD1-CD1 4.35Å; I309-L312 PolarHBondContact O-N 3.25Å; I309-L312 VanDerWaalsContact O-N 3.12Å; Q310-L312 VanDerWaalsContact C-N 3.3Å; Q310-L312 PolarHBondContact O-N 3.02Å; L312-F323 HydrophobicContact CD2-CD1 4.34Å; L312-F323 HydrophobicContact CD2-CE1 4Å; L312-F323 HydrophobicContact CD2-CE2 4.39Å; L312-F323 HydrophobicContact CD2-CZ 4.04Å; L312-F323 WeakPolarHBondContact O-CZ 3.32Å; L312-W327 HydrophobicContact CD2-CB 4.28Å; L312-W327 HydrophobicContact CD2-CG 3.92Å; L312-L397 HydrophobicContact CB-CD1 4.29Å; L312-L397 HydrophobicContact CD1-CD1 4.07Å; L312-L400 HydrophobicContact CB-CD2 4.25Å; L312-L400 WeakPolarHBondContact O-CD2 3.34Å
313	L	98.1	Very high	95.8	Very high	34 Å²	34	49.5 Å²	49.5	18%	0.178	26%	0.26	C	S	.	.	H	α-helix	trans	-84.5	-14.2	-179.6	-62.5	-176.8	0	0	0	113.3	I309 Q310 P315 W393 Q396 L397	I309-L313 HydrophobicContact CG2-CD1 3.8Å; I309-L313 HydrophobicContact CG2-CG 4.19Å; I309-L313 WeakPolarHBondContact O-CG 3.46Å; I309-L313 PolarHBondContact O-N 3.39Å; Q310-L313 CarbonylContact O-C 3.56Å; Q310-L313 PolarHBondContact O-N 3.09Å; L313-P315 VanDerWaalsContact O-CD 3.31Å; L313-P315 WeakPolarHBondContact O-CD 3.47Å; L313-W393 HydrophobicContact CD1-CB 3.58Å; L313-W393 HydrophobicContact CD1-CD2 4.46Å; L313-W393 HydrophobicContact CD1-CG 3.86Å; L313-Q396 HydrophobicContact CD1-CB 4.2Å; L313-Q396 HydrophobicContact CD2-CB 3.81Å; L313-L397 HydrophobicContact CD2-CB 4.09Å; L313-L397 HydrophobicContact CD2-CD1 4.16Å
314	D	97.5	Very high	95.8	Very high	18 Å²	18	50.3 Å²	50.3	10%	0.096	26%	0.264	C	S	.	.			trans	-71.2	114.3	176.8	-170.5	-24.8	0	0	0	110.6	Y283 Q310 R316 T317	Y283-D314 VanDerWaalsContact OH-CB 3.32Å; Y283-D314 WeakPolarHBondContact OH-CB 3.36Å; Y283-D314 PolarHBondContact OH-OD2 3.33Å; Q310-D314 WeakPolarHBondContact O-CB 3.26Å; Q310-D314 PolarHBondContact O-N 2.65Å; D314-R316 PolarHBondContact O-N 3.21Å; D314-R316 VanDerWaalsContact O-N 3.07Å; D314-R316 WeakPolarHBondContact OD1-CB 3.02Å; D314-R316 VanDerWaalsContact OD1-CG 3.31Å; D314-R316 WeakPolarHBondContact OD1-CG 3.38Å; D314-R316 IonicContact OD1-CZ 2.77Å; D314-R316 PolarHBondContact OD1-N 2.93Å; D314-R316 IonicContact OD1-NE 3.84Å; D314-R316 PolarHBondContact OD1-NE 2.98Å; D314-R316 IonicContact OD1-NH2 2.65Å; D314-R316 IonicContact OD2-CZ 3.3Å; D314-R316 VanDerWaalsContact OD2-CZ 3.31Å; D314-R316 IonicContact OD2-NE 2.84Å; D314-R316 PolarHBondContact OD2-NE 3.02Å; D314-R316 VanDerWaalsContact OD2-NE 3.11Å; D314-R316 IonicContact OD2-NH2 2.85Å; D314-R316 PolarHBondContact OD2-NH2 3.16Å; D314-T317 WeakPolarHBondContact O-CB 3.34Å; D314-T317 PolarHBondContact O-N 3.22Å; D314-T317 PolarHBondContact O-OG1 3.11Å
315	P	93.8	Very high	95.8	Very high	92 Å²	92	50.7 Å²	50.7	60%	0.597	26%	0.26	S	S	*	.	H	α-helix	trans	-65.9	-15.2	-177.7	28.5	-36.3	0	0	0	113	L313 T317 K319	L313-P315 VanDerWaalsContact O-CD 3.31Å; L313-P315 WeakPolarHBondContact O-CD 3.47Å; P315-T317 VanDerWaalsContact C-N 3.3Å; P315-K319 VanDerWaalsContact O-CG 3.29Å; P315-K319 WeakPolarHBondContact O-CG 3.28Å
316	R	94.4	Very high	95.8	Very high	137 Å²	137	50.8 Å²	50.8	52%	0.517	26%	0.261	S	S	.	.	H	α-helix	trans	-70.5	-29.9	174.9	-60.7	175.4	-67.8	-179.3	0.9	111.4	D314 K319 M320	D314-R316 PolarHBondContact O-N 3.21Å; D314-R316 VanDerWaalsContact O-N 3.07Å; D314-R316 WeakPolarHBondContact OD1-CB 3.02Å; D314-R316 VanDerWaalsContact OD1-CG 3.31Å; D314-R316 WeakPolarHBondContact OD1-CG 3.38Å; D314-R316 IonicContact OD1-CZ 2.77Å; D314-R316 PolarHBondContact OD1-N 2.93Å; D314-R316 IonicContact OD1-NE 3.84Å; D314-R316 PolarHBondContact OD1-NE 2.98Å; D314-R316 IonicContact OD1-NH2 2.65Å; D314-R316 IonicContact OD2-CZ 3.3Å; D314-R316 VanDerWaalsContact OD2-CZ 3.31Å; D314-R316 IonicContact OD2-NE 2.84Å; D314-R316 PolarHBondContact OD2-NE 3.02Å; D314-R316 VanDerWaalsContact OD2-NE 3.11Å; D314-R316 IonicContact OD2-NH2 2.85Å; D314-R316 PolarHBondContact OD2-NH2 3.16Å; R316-K319 PolarHBondContact O-N 3Å; R316-M320 WeakPolarHBondContact O-CG 3.36Å; R316-M320 PolarHBondContact O-N 3.24Å
317	T	94	Very high	95.8	Very high	14 Å²	14	49.1 Å²	49.1	9%	0.086	25%	0.25	C	C	.	.	H	α-helix	trans	-60.2	-56.2	-175.9	-58.4	0	0	0	0	111.3	Y311 D314 P315 K319 M320 A321 F323	Y311-T317 HydrophobicContact CD1-CG2 4.36Å; Y311-T317 HydrophobicContact CD2-CG2 4Å; Y311-T317 HydrophobicContact CE1-CG2 3.8Å; Y311-T317 HydrophobicContact CE2-CG2 3.37Å; Y311-T317 HydrophobicContact CG-CG2 4.46Å; Y311-T317 WeakPolarHBondContact O-CB 3.4Å; Y311-T317 PolarHBondContact O-OG1 3.02Å; Y311-T317 WeakPolarHBondContact OH-CG2 3.41Å; D314-T317 WeakPolarHBondContact O-CB 3.34Å; D314-T317 PolarHBondContact O-N 3.22Å; D314-T317 PolarHBondContact O-OG1 3.11Å; P315-T317 VanDerWaalsContact C-N 3.3Å; T317-K319 VanDerWaalsContact C-N 3.28Å; T317-K319 PolarHBondContact O-N 3.46Å; T317-M320 PolarHBondContact O-N 2.65Å; T317-A321 PolarHBondContact O-N 2.74Å; T317-F323 HydrophobicContact CG2-CD1 3.93Å; T317-F323 HydrophobicContact CG2-CE1 3.52Å
318	E	91.7	Very high	95.8	Very high	55 Å²	55	50 Å²	50	26%	0.257	25%	0.252	S	S	.	.	H	α-helix	trans	-70.1	-23.6	179.5	-70.5	-135.9	90.8	0	0	113.3	A321 F323 R332	E318-A321 WeakPolarHBondContact CA-O 3.47Å; E318-F323 VanDerWaalsContact CD-CE2 3.47Å; E318-F323 HydrophobicContact CG-CD1 3.96Å; E318-F323 HydrophobicContact CG-CD2 3.95Å; E318-F323 HydrophobicContact CG-CE1 3.57Å; E318-F323 HydrophobicContact CG-CE2 3.55Å; E318-F323 HydrophobicContact CG-CG 4.13Å; E318-F323 HydrophobicContact CG-CZ 3.34Å; E318-R332 VanDerWaalsContact CD-NH1 3.34Å; E318-R332 IonicContact OE1-CZ 3.31Å; E318-R332 IonicContact OE1-NH1 2.74Å; E318-R332 PolarHBondContact OE1-NH1 3.35Å; E318-R332 IonicContact OE1-NH2 3.24Å; E318-R332 IonicContact OE2-CZ 2.62Å; E318-R332 IonicContact OE2-NH1 2.7Å; E318-R332 PolarHBondContact OE2-NH1 3.43Å; E318-R332 IonicContact OE2-NH2 3.82Å; E318-R332 PolarHBondContact OE2-NH2 2.94Å
319	K	91.9	Very high	95.8	Very high	179 Å²	179	50 Å²	50	78%	0.778	25%	0.252	S	S	*	.	H	α-helix	trans	-68.5	-34.8	173.4	-75.8	177.7	-177.7	-176.9	0	112.3	P315 R316 T317	P315-K319 VanDerWaalsContact O-CG 3.29Å; P315-K319 WeakPolarHBondContact O-CG 3.28Å; R316-K319 PolarHBondContact O-N 3Å; T317-K319 VanDerWaalsContact C-N 3.28Å; T317-K319 PolarHBondContact O-N 3.46Å
320	M	90.8	Very high	95.8	Very high	168 Å²	168	50.1 Å²	50.1	83%	0.828	25%	0.252	S	S	*	.	H	α-helix	trans	-79	-45.5	-179.4	-72.5	-179.3	66.5	0	0	112.2	R316 T317	R316-M320 WeakPolarHBondContact O-CG 3.36Å; R316-M320 PolarHBondContact O-N 3.24Å; T317-M320 PolarHBondContact O-N 2.65Å
321	A	91.6	Very high	95.8	Very high	52 Å²	52	48.1 Å²	48.1	43%	0.43	24%	0.243	S	C	.	.	S	Bend	trans	-156.7	151.1	178	0	0	0	0	0	110.6	T317 E318	T317-A321 PolarHBondContact O-N 2.74Å; E318-A321 WeakPolarHBondContact CA-O 3.47Å
322	P	93.1	Very high	95.8	Very high	79 Å²	79	48.9 Å²	48.9	51%	0.513	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-55.6	144.7	170.7	-23	33.1	0	0	0	111.3
323	F	96.6	Very high	95.8	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.026	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-52.3	145.6	173.2	-74.3	-32.8	0	0	0	112.5	L312 T317 E318 W327 R328 L400	L312-F323 HydrophobicContact CD2-CD1 4.34Å; L312-F323 HydrophobicContact CD2-CE1 4Å; L312-F323 HydrophobicContact CD2-CE2 4.39Å; L312-F323 HydrophobicContact CD2-CZ 4.04Å; L312-F323 WeakPolarHBondContact O-CZ 3.32Å; T317-F323 HydrophobicContact CG2-CD1 3.93Å; T317-F323 HydrophobicContact CG2-CE1 3.52Å; E318-F323 VanDerWaalsContact CD-CE2 3.47Å; E318-F323 HydrophobicContact CG-CD1 3.96Å; E318-F323 HydrophobicContact CG-CD2 3.95Å; E318-F323 HydrophobicContact CG-CE1 3.57Å; E318-F323 HydrophobicContact CG-CE2 3.55Å; E318-F323 HydrophobicContact CG-CG 4.13Å; E318-F323 HydrophobicContact CG-CZ 3.34Å; F323-W327 AromaticContact CD1-CD1 3.91Å; F323-W327 AromaticContact CD1-NE1 3.7Å; F323-W327 AromaticContact CG-CD1 3.71Å; F323-W327 AromaticContact CG-NE1 3.87Å; F323-R328 HydrophobicContact CB-CB 3.94Å; F323-R328 HydrophobicContact CB-CG 4.36Å; F323-L400 HydrophobicContact CE2-CD1 4.32Å; F323-L400 HydrophobicContact CE2-CD2 4.02Å; F323-L400 HydrophobicContact CZ-CD2 4.28Å
324	N	97.5	Very high	95.8	Very high	28 Å²	28	47.2 Å²	47.2	15%	0.15	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-58.6	142.6	171.1	-177	-85.4	0	0	0	109.9	F275 H326 W327 R328	F275-N324 HydrophobicContact CE1-CB 4.4Å; F275-N324 HydrophobicContact CZ-CB 3.95Å; N324-H326 PolarHBondContact O-N 3.14Å; N324-H326 WeakPolarHBondContact OD1-CB 3.27Å; N324-H326 PolarHBondContact OD1-CD2 3Å; N324-H326 VanDerWaalsContact OD1-CG 3.31Å; N324-H326 PolarHBondContact OD1-N 2.87Å; N324-W327 HydrophobicContact CB-CD2 3.95Å; N324-W327 VanDerWaalsContact CB-CE2 3.45Å; N324-W327 HydrophobicContact CB-CE3 4.19Å; N324-W327 HydrophobicContact CB-CH2 3.54Å; N324-W327 HydrophobicContact CB-CZ2 3.25Å; N324-W327 HydrophobicContact CB-CZ3 4.01Å; N324-W327 PolarHBondContact O-N 3.01Å; N324-R328 WeakPolarHBondContact O-CB 3.38Å; N324-R328 PolarHBondContact O-N 3.48Å
325	E	97.2	Very high	95.9	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-28.8	-178.9	55	162.6	-171.9	0	0	114.6	H161 Y174 P176 W327 L333	H161-E325 IonicContact CE1-OE2 3.31Å; H161-E325 PolarHBondContact CE1-OE2 3.39Å; H161-E325 VanDerWaalsContact CE1-OE2 3.24Å; H161-E325 IonicContact NE2-OE2 2.92Å; Y174-E325 WeakPolarHBondContact CE2-OE2 3.31Å; P176-E325 WeakPolarHBondContact CD-O 3.45Å; P176-E325 HydrophobicContact CG-CB 4.01Å; P176-E325 HydrophobicContact CG-CG 4.03Å; P176-E325 WeakPolarHBondContact CG-O 3.44Å; E325-W327 VanDerWaalsContact C-N 3.29Å; E325-W327 PolarHBondContact O-N 2.85Å; E325-L333 HydrophobicContact CB-CD2 4.48Å
326	H	97.5	Very high	96.1	Very high	20 Å²	20	42.3 Å²	42.3	9%	0.093	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.5	-177.7	-62	-46.6	0	0	0	114.2	P176 R255 A259 K263 F271 N324	P176-H326 WeakPolarHBondContact CB-ND1 3.21Å; R255-H326 PolarHBondContact NH1-O 3Å; A259-H326 HydrophobicContact CB-CB 4.24Å; A259-H326 WeakPolarHBondContact CB-O 3.05Å; K263-H326 WeakPolarHBondContact CE-CD2 3.27Å; K263-H326 WeakPolarHBondContact CE-NE2 3.33Å; K263-H326 PolarHBondContact NZ-NE2 3.5Å; F271-H326 AromaticContact CE1-CD2 3.83Å; F271-H326 AromaticContact CZ-CD2 3.49Å; F271-H326 VanDerWaalsContact CZ-CD2 3.49Å; F271-H326 WeakPolarHBondContact CZ-CD2 3.2Å; F271-H326 AromaticContact CZ-NE2 3.78Å; N324-H326 PolarHBondContact O-N 3.14Å; N324-H326 WeakPolarHBondContact OD1-CB 3.27Å; N324-H326 PolarHBondContact OD1-CD2 3Å; N324-H326 VanDerWaalsContact OD1-CG 3.31Å; N324-H326 PolarHBondContact OD1-N 2.87Å
327	W	98.1	Very high	96.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-3.8	175.9	53.8	85.4	0	0	0	113	L256 F264 F271 F275 F308 Y311 L312 F323 N324 E325 Y401	L256-W327 HydrophobicContact CD2-CB 3.64Å; F264-W327 HydrophobicContact CE2-CZ3 4.42Å; F264-W327 HydrophobicContact CZ-CH2 4.43Å; F264-W327 HydrophobicContact CZ-CZ3 4.44Å; F271-W327 HydrophobicContact CD1-CH2 4.24Å; F271-W327 HydrophobicContact CD1-CZ3 4.22Å; F271-W327 AromaticContact CE1-CH2 3.91Å; F271-W327 HydrophobicContact CE1-CH2 3.91Å; F271-W327 AromaticContact CE1-CZ3 3.78Å; F271-W327 HydrophobicContact CE1-CZ3 3.78Å; F275-W327 AromaticContact CD1-CH2 3.87Å; F275-W327 HydrophobicContact CD1-CH2 3.87Å; F275-W327 AromaticContact CD1-CZ2 3.72Å; F275-W327 HydrophobicContact CD1-CZ2 3.72Å; F275-W327 AromaticContact CD2-CH2 3.86Å; F275-W327 HydrophobicContact CD2-CH2 3.86Å; F275-W327 AromaticContact CE1-CH2 3.95Å; F275-W327 HydrophobicContact CE1-CH2 3.95Å; F275-W327 AromaticContact CE1-CZ2 3.64Å; F275-W327 HydrophobicContact CE1-CZ2 3.64Å; F275-W327 AromaticContact CE2-CH2 3.94Å; F275-W327 HydrophobicContact CE2-CH2 3.94Å; F275-W327 HydrophobicContact CE2-CZ2 4.44Å; F275-W327 AromaticContact CG-CH2 3.83Å; F275-W327 HydrophobicContact CG-CH2 3.83Å; F275-W327 HydrophobicContact CG-CZ2 4.17Å; F275-W327 AromaticContact CZ-CH2 3.98Å; F275-W327 HydrophobicContact CZ-CH2 3.98Å; F275-W327 HydrophobicContact CZ-CZ2 4.03Å; F308-W327 AromaticContact CE2-CD2 3.97Å; F308-W327 HydrophobicContact CE2-CD2 3.97Å; F308-W327 AromaticContact CE2-CE3 3.97Å; F308-W327 HydrophobicContact CE2-CE3 3.97Å; F308-W327 HydrophobicContact CE2-CG 4.29Å; F308-W327 HydrophobicContact CE2-CZ3 4.41Å; F308-W327 HydrophobicContact CZ-CB 3.96Å; F308-W327 HydrophobicContact CZ-CD2 4.11Å; F308-W327 HydrophobicContact CZ-CE3 4.1Å; F308-W327 HydrophobicContact CZ-CG 4.09Å; Y311-W327 AromaticContact CE1-CZ2 3.97Å; Y311-W327 HydrophobicContact CE1-CZ2 3.97Å; Y311-W327 AromaticContact CE1-NE1 3.74Å; L312-W327 HydrophobicContact CD2-CB 4.28Å; L312-W327 HydrophobicContact CD2-CG 3.92Å; F323-W327 AromaticContact CD1-CD1 3.91Å; F323-W327 AromaticContact CD1-NE1 3.7Å; F323-W327 AromaticContact CG-CD1 3.71Å; F323-W327 AromaticContact CG-NE1 3.87Å; N324-W327 HydrophobicContact CB-CD2 3.95Å; N324-W327 VanDerWaalsContact CB-CE2 3.45Å; N324-W327 HydrophobicContact CB-CE3 4.19Å; N324-W327 HydrophobicContact CB-CH2 3.54Å; N324-W327 HydrophobicContact CB-CZ2 3.25Å; N324-W327 HydrophobicContact CB-CZ3 4.01Å; N324-W327 PolarHBondContact O-N 3.01Å; E325-W327 VanDerWaalsContact C-N 3.29Å; E325-W327 PolarHBondContact O-N 2.85Å; W327-Y401 VanDerWaalsContact O-CE1 3.27Å; W327-Y401 WeakPolarHBondContact O-CE1 3.38Å; W327-Y401 VanDerWaalsContact O-CZ 3.31Å; W327-Y401 PolarHBondContact O-OH 3.34Å
328	R	97.9	Very high	96.5	Very high	30 Å²	30	38.3 Å²	38.3	11%	0.113	20%	0.195	C	C	.	.	S	Bend	trans	-63	139.8	170.9	-172.6	166.9	-178.4	176.9	0	110.9	E158 R255 F323 N324 R332 L333	E158-R328 IonicContact OE1-NH2 3.71Å; E158-R328 PolarHBondContact OE1-NH2 3.43Å; R255-R328 PolarHBondContact NH1-O 3.13Å; R255-R328 PolarHBondContact NH2-O 2.84Å; F323-R328 HydrophobicContact CB-CB 3.94Å; F323-R328 HydrophobicContact CB-CG 4.36Å; N324-R328 WeakPolarHBondContact O-CB 3.38Å; N324-R328 PolarHBondContact O-N 3.48Å; R328-R332 HydrophobicContact CG-CB 4.15Å; R328-L333 HydrophobicContact CB-CD2 4.07Å; R328-L333 HydrophobicContact CB-CG 4.46Å; R328-L333 HydrophobicContact CG-CD2 3.96Å; R328-L333 HydrophobicContact CG-CG 4.38Å
329	Q	98.4	Very high	96.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.			trans	-59	141.2	-177.8	-56.7	84.9	-11.9	0	0	111.5	Y331 R332 L333 L400 Y401 D404	Q329-Y331 VanDerWaalsContact C-N 3.3Å; Q329-Y331 HydrophobicContact CB-CD1 3.51Å; Q329-Y331 HydrophobicContact CB-CE1 3.4Å; Q329-Y331 HydrophobicContact CG-CD1 4.26Å; Q329-Y331 HydrophobicContact CG-CE1 3.7Å; Q329-Y331 PolarHBondContact O-N 2.84Å; Q329-R332 HydrophobicContact CB-CG 4.37Å; Q329-R332 PolarHBondContact O-N 3.47Å; Q329-R332 VanDerWaalsContact O-N 3.09Å; Q329-L333 PolarHBondContact O-N 3.37Å; Q329-L400 VanDerWaalsContact NE2-CD1 3.33Å; Q329-L400 PolarHBondContact NE2-O 3.01Å; Q329-L400 VanDerWaalsContact NE2-O 3.14Å; Q329-Y401 HydrophobicContact CB-CD1 4.45Å; Q329-Y401 HydrophobicContact CG-CD1 3.7Å; Q329-Y401 HydrophobicContact CG-CE1 3.75Å; Q329-Y401 HydrophobicContact CG-CG 4.43Å; Q329-D404 VanDerWaalsContact CA-OD2 3.23Å; Q329-D404 WeakPolarHBondContact CA-OD2 3.29Å; Q329-D404 WeakPolarHBondContact CB-OD2 3.28Å
330	V	98.6	Very high	97.1	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-42.5	-178.7	178.4	0	0	0	0	111	V175 L247 V249 R332 L333 C334 D404 F408	V175-V330 HydrophobicContact CG1-CG2 3.76Å; V175-V330 HydrophobicContact CG2-CG1 3.8Å; V175-V330 HydrophobicContact CG2-CG2 4.33Å; L247-V330 HydrophobicContact CD1-CG1 3.89Å; V249-V330 HydrophobicContact CG1-CG1 3.92Å; V330-R332 PolarHBondContact O-N 3.04Å; V330-R332 VanDerWaalsContact O-N 3.15Å; V330-L333 PolarHBondContact O-N 3.42Å; V330-C334 HydrophobicContact CG1-CB 4.47Å; V330-C334 PolarHBondContact O-N 2.97Å; V330-D404 WeakPolarHBondContact CB-OD1 3.37Å; V330-D404 VanDerWaalsContact N-CG 3.28Å; V330-D404 PolarHBondContact N-OD1 3.49Å; V330-D404 PolarHBondContact N-OD2 2.92Å; V330-F408 HydrophobicContact CB-CE2 3.78Å; V330-F408 HydrophobicContact CB-CZ 4.39Å; V330-F408 HydrophobicContact CG1-CD2 4.47Å; V330-F408 HydrophobicContact CG1-CE2 3.46Å; V330-F408 VanDerWaalsContact CG1-CE2 3.46Å; V330-F408 HydrophobicContact CG1-CZ 3.58Å
331	Y	98.1	Very high	97.4	Very high	8 Å²	8	24.8 Å²	24.8	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-29.8	179.7	80.9	-95.2	0	0	0	112.7	F144 P145 Q329 H335 P336 A403 D404	F144-Y331 AromaticContact CD2-CD2 3.61Å; F144-Y331 HydrophobicContact CD2-CD2 3.61Å; F144-Y331 AromaticContact CD2-CE2 3.67Å; F144-Y331 HydrophobicContact CD2-CE2 3.67Å; F144-Y331 HydrophobicContact CD2-CG 4.13Å; F144-Y331 AromaticContact CE2-CD2 3.65Å; F144-Y331 HydrophobicContact CE2-CD2 3.65Å; F144-Y331 HydrophobicContact CE2-CE2 4.17Å; F144-Y331 HydrophobicContact CE2-CG 4.1Å; P145-Y331 HydrophobicContact CB-CE2 4.47Å; P145-Y331 WeakPolarHBondContact CD-OH 3.29Å; P145-Y331 VanDerWaalsContact O-CE2 3.27Å; P145-Y331 WeakPolarHBondContact O-CE2 3.4Å; Q329-Y331 VanDerWaalsContact C-N 3.3Å; Q329-Y331 HydrophobicContact CB-CD1 3.51Å; Q329-Y331 HydrophobicContact CB-CE1 3.4Å; Q329-Y331 HydrophobicContact CG-CD1 4.26Å; Q329-Y331 HydrophobicContact CG-CE1 3.7Å; Q329-Y331 PolarHBondContact O-N 2.84Å; Y331-H335 WeakPolarHBondContact O-CA 3.5Å; Y331-H335 PolarHBondContact O-N 2.77Å; Y331-P336 WeakPolarHBondContact O-CD 3.3Å; Y331-A403 HydrophobicContact CD1-CB 3.51Å; Y331-A403 HydrophobicContact CE1-CB 3.76Å; Y331-A403 HydrophobicContact CG-CB 4.13Å; Y331-D404 WeakPolarHBondContact CD1-OD1 3.47Å; Y331-D404 PolarHBondContact N-OD1 3.36Å
332	R	97.4	Very high	97.8	Very high	44 Å²	44	25 Å²	25	17%	0.166	13%	0.13	C	C	.	.	H	α-helix	trans	-81.4	-22.5	176.2	-62.1	-169.1	-178.4	-174.8	11.9	113.6	E318 R328 Q329 V330 H335	E318-R332 VanDerWaalsContact CD-NH1 3.34Å; E318-R332 IonicContact OE1-CZ 3.31Å; E318-R332 IonicContact OE1-NH1 2.74Å; E318-R332 PolarHBondContact OE1-NH1 3.35Å; E318-R332 IonicContact OE1-NH2 3.24Å; E318-R332 IonicContact OE2-CZ 2.62Å; E318-R332 IonicContact OE2-NH1 2.7Å; E318-R332 PolarHBondContact OE2-NH1 3.43Å; E318-R332 IonicContact OE2-NH2 3.82Å; E318-R332 PolarHBondContact OE2-NH2 2.94Å; R328-R332 HydrophobicContact CG-CB 4.15Å; Q329-R332 HydrophobicContact CB-CG 4.37Å; Q329-R332 PolarHBondContact O-N 3.47Å; Q329-R332 VanDerWaalsContact O-N 3.09Å; V330-R332 PolarHBondContact O-N 3.04Å; V330-R332 VanDerWaalsContact O-N 3.15Å; R332-H335 PolarHBondContact O-CE1 3.3Å
333	L	98.3	Very high	98	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-83.9	-40.1	177.1	-62	-178.7	0	0	0	111.3	V175 E325 R328 Q329 V330	V175-L333 HydrophobicContact CG1-CD1 4.46Å; E325-L333 HydrophobicContact CB-CD2 4.48Å; R328-L333 HydrophobicContact CB-CD2 4.07Å; R328-L333 HydrophobicContact CB-CG 4.46Å; R328-L333 HydrophobicContact CG-CD2 3.96Å; R328-L333 HydrophobicContact CG-CG 4.38Å; Q329-L333 PolarHBondContact O-N 3.37Å; V330-L333 PolarHBondContact O-N 3.42Å
334	C	98.6	Very high	98.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-116.6	-5.6	-165.7	-69.1	0	0	0	0	115.2	C173 V175 L247 V330 Y341	C173-C334 HydrophobicContact CB-CB 3.87Å; C173-C334 WeakPolarHBondContact CB-SG 3.43Å; C173-C334 WeakPolarHBondContact SG-CA 3.48Å; C173-C334 WeakPolarHBondContact SG-CB 3.28Å; C173-C334 CovalentContact SG-SG 2.03Å; C173-C334 PolarHBondContact SG-SG 2.75Å; V175-C334 VanDerWaalsContact CG2-SG 3.56Å; L247-C334 HydrophobicContact CD1-CB 4.33Å; V330-C334 HydrophobicContact CG1-CB 4.47Å; V330-C334 PolarHBondContact O-N 2.97Å; C334-Y341 HydrophobicContact CB-CE2 4.48Å; C334-Y341 WeakPolarHBondContact CB-OH 3.48Å; C334-Y341 WeakPolarHBondContact O-CE2 3.23Å; C334-Y341 PolarHBondContact O-OH 2.97Å
335	H	98.4	Very high	98.2	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.098	C	C	.	.			trans	50.6	50.6	172.4	-45.3	-60	0	0	0	113.9	R149 I154 E158 Y331 R332 C337 Q338 I339	R149-H335 PolarHBondContact NH2-CE1 2.94Å; R149-H335 PolarHBondContact NH2-ND1 3.18Å; I154-H335 HydrophobicContact CD1-CB 3.87Å; E158-H335 PolarHBondContact O-NE2 2.71Å; E158-H335 IonicContact OE2-CE1 3.55Å; Y331-H335 WeakPolarHBondContact O-CA 3.5Å; Y331-H335 PolarHBondContact O-N 2.77Å; R332-H335 PolarHBondContact O-CE1 3.3Å; H335-C337 PolarHBondContact O-N 2.98Å; H335-C337 VanDerWaalsContact O-N 3.1Å; H335-Q338 HydrophobicContact CB-CB 4.22Å; H335-Q338 PolarHBondContact O-N 3.47Å; H335-I339 HydrophobicContact CB-CD1 4.3Å; H335-I339 PolarHBondContact O-N 3.48Å
336	P	98.1	Very high	98.1	Very high	6 Å²	6	18.5 Å²	18.5	4%	0.039	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-8.4	-166.7	35.1	-40.9	0	0	0	114.4	L133 Y331 Y341 L407 F408	L133-P336 HydrophobicContact CD1-CB 3.76Å; L133-P336 HydrophobicContact CD1-CG 4.19Å; L133-P336 HydrophobicContact CD2-CB 3.94Å; L133-P336 HydrophobicContact CG-CB 4.44Å; Y331-P336 WeakPolarHBondContact O-CD 3.3Å; P336-Y341 HydrophobicContact CB-CD2 4.25Å; P336-Y341 HydrophobicContact CB-CE2 4.13Å; P336-L407 HydrophobicContact CG-CD1 4.11Å; P336-F408 HydrophobicContact CB-CZ 4.26Å; P336-F408 HydrophobicContact CG-CZ 4.12Å
337	C	98.2	Very high	97.9	Very high	34 Å²	34	18.1 Å²	18.1	23%	0.23	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-10.4	168.8	-58.7	0	0	0	0	113.7	C137 H335	C137-C337 VanDerWaalsContact CA-SG 3.51Å; C137-C337 HydrophobicContact CB-CB 3.72Å; C137-C337 WeakPolarHBondContact CB-SG 3.4Å; C137-C337 WeakPolarHBondContact SG-CA 3.5Å; C137-C337 WeakPolarHBondContact SG-CB 3.46Å; C137-C337 CovalentContact SG-SG 2.05Å; C137-C337 PolarHBondContact SG-SG 3.33Å; H335-C337 PolarHBondContact O-N 2.98Å; H335-C337 VanDerWaalsContact O-N 3.1Å
338	Q	98.1	Very high	97.7	Very high	32 Å²	32	21.7 Å²	21.7	15%	0.15	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-11.4	172.9	-67.8	78	29.2	0	0	112.6	T146 K147 R149 F151 I154 H335	T146-Q338 PolarHBondContact O-NE2 3.24Å; T146-Q338 VanDerWaalsContact O-NE2 3.1Å; K147-Q338 PolarHBondContact O-NE2 3.32Å; R149-Q338 HydrophobicContact CG-CG 4.25Å; R149-Q338 WeakPolarHBondContact O-CG 3.48Å; R149-Q338 PolarHBondContact O-NE2 3.02Å; F151-Q338 HydrophobicContact CB-CB 4.45Å; I154-Q338 HydrophobicContact CD1-CB 3.93Å; I154-Q338 HydrophobicContact CD1-CG 4.03Å; H335-Q338 HydrophobicContact CB-CB 4.22Å; H335-Q338 PolarHBondContact O-N 3.47Å
339	I	98.3	Very high	97.4	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.015	11%	0.113	C	C	.	.	S	Bend	trans	-129.7	116	-176.5	-62.1	177.4	0	0	0	108.4	F151 L162 L240 K245 H335 Y341	F151-I339 HydrophobicContact CD2-CG1 4.36Å; F151-I339 HydrophobicContact CE2-CD1 4.36Å; F151-I339 HydrophobicContact CE2-CG1 4.46Å; L162-I339 HydrophobicContact CD1-CD1 3.65Å; L162-I339 HydrophobicContact CD2-CD1 3.88Å; L162-I339 HydrophobicContact CG-CD1 4.4Å; L240-I339 HydrophobicContact CD2-CD1 4.24Å; L240-I339 HydrophobicContact CD2-CG1 4.11Å; L240-I339 HydrophobicContact CD2-CG2 3.87Å; K245-I339 HydrophobicContact CD-CG2 4.06Å; H335-I339 HydrophobicContact CB-CD1 4.3Å; H335-I339 PolarHBondContact O-N 3.48Å; I339-Y341 HydrophobicContact CB-CD2 4.29Å; I339-Y341 HydrophobicContact CB-CE2 3.77Å; I339-Y341 HydrophobicContact CG2-CD1 4.46Å; I339-Y341 HydrophobicContact CG2-CD2 3.98Å; I339-Y341 HydrophobicContact CG2-CE1 4.18Å; I339-Y341 HydrophobicContact CG2-CE2 3.63Å; I339-Y341 HydrophobicContact CG2-CG 4.38Å; I339-Y341 WeakPolarHBondContact O-CD2 3.28Å; I339-Y341 PolarHBondContact O-N 3.34Å
340	D	97.6	Very high	97.1	Very high	112 Å²	112	22.1 Å²	22.1	60%	0.599	11%	0.113	S	C	*	.			trans	-74.8	92.7	175.9	-64.2	-48.3	0	0	0	110.3	K245	K245-D340 WeakPolarHBondContact CD-O 3.29Å; K245-D340 WeakPolarHBondContact CE-O 3.29Å
341	Y	98.7	Very high	96.6	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.016	12%	0.117	C	C	.	.			trans	-70.3	134.9	179	-73.7	-86.1	0	0	0	112.2	C173 K245 L247 C334 P336 I339	C173-Y341 HydrophobicContact CB-CE1 3.85Å; C173-Y341 WeakPolarHBondContact CB-OH 3.32Å; K245-Y341 HydrophobicContact CB-CD1 3.96Å; K245-Y341 HydrophobicContact CB-CE1 4.42Å; L247-Y341 HydrophobicContact CB-CD1 4.39Å; L247-Y341 HydrophobicContact CB-CE1 4.13Å; L247-Y341 HydrophobicContact CD2-CD1 3.32Å; L247-Y341 HydrophobicContact CD2-CD2 3.59Å; L247-Y341 HydrophobicContact CD2-CE1 3.61Å; L247-Y341 HydrophobicContact CD2-CE2 3.87Å; L247-Y341 HydrophobicContact CD2-CG 3.31Å; L247-Y341 HydrophobicContact CG-CD1 4.45Å; L247-Y341 HydrophobicContact CG-CE1 4.47Å; C334-Y341 HydrophobicContact CB-CE2 4.48Å; C334-Y341 WeakPolarHBondContact CB-OH 3.48Å; C334-Y341 WeakPolarHBondContact O-CE2 3.23Å; C334-Y341 PolarHBondContact O-OH 2.97Å; P336-Y341 HydrophobicContact CB-CD2 4.25Å; P336-Y341 HydrophobicContact CB-CE2 4.13Å; I339-Y341 HydrophobicContact CB-CD2 4.29Å; I339-Y341 HydrophobicContact CB-CE2 3.77Å; I339-Y341 HydrophobicContact CG2-CD1 4.46Å; I339-Y341 HydrophobicContact CG2-CD2 3.98Å; I339-Y341 HydrophobicContact CG2-CE1 4.18Å; I339-Y341 HydrophobicContact CG2-CE2 3.63Å; I339-Y341 HydrophobicContact CG2-CG 4.38Å; I339-Y341 WeakPolarHBondContact O-CD2 3.28Å; I339-Y341 PolarHBondContact O-N 3.34Å
342	D	98.5	Very high	96.2	Very high	55 Å²	55	25.5 Å²	25.5	29%	0.294	13%	0.13	S	C	.	.	S	Bend	trans	-88.2	-16.5	178.6	-52	-64.9	0	0	0	112.3	Q130 T244 K245	Q130-D342 PolarHBondContact NE2-O 2.67Å; T244-D342 VanDerWaalsContact CA-OD2 3.31Å; T244-D342 WeakPolarHBondContact CA-OD2 3.35Å; T244-D342 HydrophobicContact CG2-CB 4.1Å; K245-D342 WeakPolarHBondContact CE-OD2 3.09Å; K245-D342 PolarHBondContact N-OD2 3.1Å; K245-D342 IonicContact NZ-OD1 3.24Å; K245-D342 PolarHBondContact NZ-OD1 3.19Å; K245-D342 IonicContact NZ-OD2 2.65Å; K245-D342 PolarHBondContact NZ-OD2 3.41Å; K245-D342 PolarHBondContact O-N 2.93Å
343	F	98.7	Very high	96.1	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	133.3	177.8	-171.6	-81.7	0	0	0	111.3	Q126 K245 F246 L247 F248 D353 H356 L357 L360	Q126-F343 VanDerWaalsContact CD-CE2 3.43Å; Q126-F343 HydrophobicContact CG-CD2 3.92Å; Q126-F343 HydrophobicContact CG-CE2 3.7Å; Q126-F343 HydrophobicContact CG-CZ 4.37Å; Q126-F343 VanDerWaalsContact NE2-CZ 3.32Å; K245-F343 PolarHBondContact O-N 2.91Å; F246-F343 VanDerWaalsContact CA-O 3.27Å; F246-F343 WeakPolarHBondContact CA-O 3.24Å; F246-F343 HydrophobicContact CB-CB 3.79Å; F246-F343 HydrophobicContact CB-CD1 4.29Å; F246-F343 HydrophobicContact CB-CG 4.47Å; L247-F343 PolarHBondContact N-O 3.23Å; F248-F343 HydrophobicContact CE2-CE1 4.19Å; F248-F343 AromaticContact CZ-CE1 3.91Å; F248-F343 HydrophobicContact CZ-CE1 3.91Å; F343-D353 HydrophobicContact CE1-CB 4.14Å; F343-D353 HydrophobicContact CZ-CB 3.93Å; F343-D353 VanDerWaalsContact CZ-O 3.23Å; F343-D353 WeakPolarHBondContact CZ-O 3.27Å; F343-H356 AromaticContact CE2-CD2 3.74Å; F343-L357 HydrophobicContact CB-CD1 4.01Å; F343-L357 HydrophobicContact CD1-CB 4.29Å; F343-L357 HydrophobicContact CD1-CD1 4.11Å; F343-L357 HydrophobicContact CD1-CD2 4.07Å; F343-L357 HydrophobicContact CD1-CG 4.39Å; F343-L357 HydrophobicContact CD2-CB 4.32Å; F343-L357 HydrophobicContact CD2-CD1 4.04Å; F343-L357 HydrophobicContact CE1-CB 3.98Å; F343-L357 HydrophobicContact CE1-CD2 4.26Å; F343-L357 HydrophobicContact CE2-CB 3.98Å; F343-L357 HydrophobicContact CG-CB 4.47Å; F343-L357 HydrophobicContact CG-CD1 3.8Å; F343-L357 HydrophobicContact CZ-CB 3.83Å; F343-L360 HydrophobicContact CD2-CD2 4.29Å
344	I	98.8	Very high	96	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	102.5	178.3	-55.2	172.6	0	0	0	107.5	Q126 R129 L133 L247 V249 F408	Q126-I344 PolarHBondContact NE2-O 2.79Å; Q126-I344 PolarHBondContact OE1-O 3.02Å; R129-I344 HydrophobicContact CB-CB 4.21Å; R129-I344 HydrophobicContact CB-CD1 4.36Å; R129-I344 WeakPolarHBondContact CD-O 3.4Å; R129-I344 PolarHBondContact NH1-O 3.36Å; L133-I344 HydrophobicContact CB-CD1 4.1Å; L133-I344 HydrophobicContact CD2-CD1 3.71Å; L247-I344 HydrophobicContact CD2-CG1 4.27Å; V249-I344 HydrophobicContact CG2-CG2 4.19Å; I344-F408 HydrophobicContact CG2-CD1 4.03Å; I344-F408 HydrophobicContact CG2-CE1 4.45Å
345	G	97.9	Very high	95.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	152	174.6	0	0	0	0	0	112.2	L247 F248 V249 D353	L247-G345 PolarHBondContact O-N 3.06Å; F248-G345 CarbonylContact C-O 3.41Å; F248-G345 VanDerWaalsContact CA-O 3.29Å; F248-G345 WeakPolarHBondContact CA-O 3.46Å; V249-G345 WeakPolarHBondContact CG2-O 3.44Å; V249-G345 PolarHBondContact N-O 3.36Å; G345-D353 WeakPolarHBondContact CA-OD2 3.38Å
346	K	97.1	Very high	95.5	Very high	30 Å²	30	24.8 Å²	24.8	13%	0.13	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.5	172	-71.3	-163	176.3	-166.7	0	109.5	V249 E348 T349 L350 D353 F408 G409 Y410	V249-K346 HydrophobicContact CG2-CG 4.03Å; V249-K346 CarbonylContact O-C 3.56Å; V249-K346 WeakPolarHBondContact O-CA 3.3Å; K346-E348 WeakPolarHBondContact CB-OE2 3.49Å; K346-E348 PolarHBondContact O-N 3.43Å; K346-T349 CarbonylContact O-C 3.54Å; K346-T349 PolarHBondContact O-N 3.21Å; K346-L350 WeakPolarHBondContact O-CA 3.41Å; K346-L350 PolarHBondContact O-N 3.4Å; K346-L350 VanDerWaalsContact O-N 3.11Å; K346-D353 PolarHBondContact N-OD2 3.4Å; K346-F408 WeakPolarHBondContact CE-O 3.21Å; K346-F408 PolarHBondContact NZ-O 3.38Å; K346-G409 PolarHBondContact NZ-O 3.49Å; K346-G409 VanDerWaalsContact NZ-O 3.13Å; K346-Y410 HydrophobicContact CD-CE1 4.13Å
347	L	93.3	Very high	95.4	Very high	12 Å²	12	24.5 Å²	24.5	6%	0.063	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-65.9	-29.5	177.9	-173.8	69.4	0	0	0	111.5	A179 V249 R250 T349 L350	A179-L347 HydrophobicContact CB-CD1 3.85Å; V249-L347 PolarHBondContact O-N 3.5Å; R250-L347 HydrophobicContact CB-CB 3.97Å; R250-L347 HydrophobicContact CB-CD2 4.41Å; R250-L347 HydrophobicContact CG-CB 4.17Å; R250-L347 HydrophobicContact CG-CD2 4.08Å; L347-T349 PolarHBondContact O-N 3.07Å; L347-L350 HydrophobicContact CD1-CB 4.26Å; L347-L350 HydrophobicContact CD1-CD1 4.31Å; L347-L350 HydrophobicContact CD1-CD2 3.83Å; L347-L350 HydrophobicContact CD1-CG 4.36Å; L347-L350 WeakPolarHBondContact O-CB 3.48Å; L347-L350 PolarHBondContact O-N 3.18Å
348	E	91.9	Very high	95.3	Very high	75 Å²	75	23.1 Å²	23.1	35%	0.35	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-62.2	-30.1	177	-61.9	76.6	-170.2	0	0	111.7	R250 D251 K346 Y410	R250-E348 WeakPolarHBondContact CG-OE1 3.37Å; D251-E348 PolarHBondContact N-OE1 2.81Å; K346-E348 WeakPolarHBondContact CB-OE2 3.49Å; K346-E348 PolarHBondContact O-N 3.43Å; E348-Y410 PolarHBondContact OE2-OH 3.39Å
349	T	92.2	Very high	95.1	Very high	40 Å²	40	25.9 Å²	25.9	25%	0.245	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-119.2	32.9	176.9	52.8	0	0	0	0	111.5	R129 K346 L347 D351 E352 D353	R129-T349 PolarHBondContact NH2-OG1 3.31Å; K346-T349 CarbonylContact O-C 3.54Å; K346-T349 PolarHBondContact O-N 3.21Å; L347-T349 PolarHBondContact O-N 3.07Å; T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 3.14Å; T349-E352 PolarHBondContact O-N 3.49Å; T349-D353 VanDerWaalsContact O-CB 3.24Å; T349-D353 WeakPolarHBondContact O-CB 3.42Å; T349-D353 PolarHBondContact O-N 3.26Å; T349-D353 PolarHBondContact OG1-OD2 2.95Å
350	L	91.6	Very high	94.9	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-55.8	-43.7	-168.7	176.5	66.3	0	0	0	112.9	A179 F248 K346 L347 A354 F369	A179-L350 HydrophobicContact CB-CD1 3.92Å; A179-L350 HydrophobicContact CB-CD2 3.64Å; A179-L350 HydrophobicContact CB-CG 4.45Å; F248-L350 HydrophobicContact CD1-CD1 3.86Å; F248-L350 HydrophobicContact CE1-CD1 3.78Å; K346-L350 WeakPolarHBondContact O-CA 3.41Å; K346-L350 PolarHBondContact O-N 3.4Å; K346-L350 VanDerWaalsContact O-N 3.11Å; L347-L350 HydrophobicContact CD1-CB 4.26Å; L347-L350 HydrophobicContact CD1-CD1 4.31Å; L347-L350 HydrophobicContact CD1-CD2 3.83Å; L347-L350 HydrophobicContact CD1-CG 4.36Å; L347-L350 WeakPolarHBondContact O-CB 3.48Å; L347-L350 PolarHBondContact O-N 3.18Å; L350-A354 WeakPolarHBondContact O-CB 3.28Å; L350-A354 PolarHBondContact O-N 2.61Å; L350-F369 HydrophobicContact CD1-CE1 3.95Å; L350-F369 HydrophobicContact CD1-CZ 3.97Å; L350-F369 HydrophobicContact CD2-CE1 3.8Å; L350-F369 HydrophobicContact CD2-CZ 4.34Å; L350-F369 HydrophobicContact CG-CE1 3.88Å; L350-F369 HydrophobicContact CG-CZ 4.39Å
351	D	89	Confident	94.9	Very high	17 Å²	17	25.8 Å²	25.8	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-71.7	-45.8	-170.6	-59.8	-61.5	0	0	0	109.8	Y109 W111 T349 A355 R376	Y109-D351 HydrophobicContact CG-CB 4.42Å; W111-D351 WeakPolarHBondContact CH2-O 3.21Å; W111-D351 HydrophobicContact CZ2-CB 4.39Å; T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 3.14Å; D351-A355 PolarHBondContact O-N 3.11Å; D351-A355 VanDerWaalsContact O-N 3.11Å; D351-R376 IonicContact OD1-NH2 3.77Å; D351-R376 PolarHBondContact OD1-NH2 2.96Å; D351-R376 IonicContact OD2-CZ 3.47Å; D351-R376 IonicContact OD2-NH1 3.56Å; D351-R376 PolarHBondContact OD2-NH1 3.44Å; D351-R376 IonicContact OD2-NH2 2.9Å; D351-R376 PolarHBondContact OD2-NH2 3.33Å
352	E	90.8	Very high	94.7	Very high	64 Å²	64	34 Å²	34	30%	0.299	17%	0.167	S	C	.	.	H	α-helix	trans	-65.6	-45.6	174.9	-59.4	79	-174	0	0	112.1	Y109 T349 A354 A355 H356	Y109-E352 HydrophobicContact CE2-CG 4.25Å; Y109-E352 WeakPolarHBondContact CE2-OE1 3.43Å; T349-E352 PolarHBondContact O-N 3.49Å; E352-A354 PolarHBondContact O-N 3.09Å; E352-A355 WeakPolarHBondContact O-CB 3.41Å; E352-A355 PolarHBondContact O-N 3.15Å; E352-H356 PolarHBondContact O-N 2.93Å
353	D	94.9	Very high	94.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-40.9	179.5	-80.4	-34.7	0	0	0	111.4	Q126 R129 F248 F343 G345 K346 T349 A355 H356 L357	Q126-D353 PolarHBondContact NE2-OD1 3.4Å; R129-D353 IonicContact CZ-OD1 2.69Å; R129-D353 IonicContact CZ-OD2 3.89Å; R129-D353 VanDerWaalsContact NH1-CG 3.26Å; R129-D353 IonicContact NH1-OD1 3.73Å; R129-D353 PolarHBondContact NH1-OD1 2.98Å; R129-D353 IonicContact NH1-OD2 3.39Å; R129-D353 PolarHBondContact NH1-OD2 3.27Å; R129-D353 IonicContact NH2-OD1 3.72Å; R129-D353 IonicContact NH2-OD2 3.29Å; F248-D353 HydrophobicContact CE1-CB 3.74Å; F248-D353 HydrophobicContact CZ-CB 4.01Å; F343-D353 HydrophobicContact CE1-CB 4.14Å; F343-D353 HydrophobicContact CZ-CB 3.93Å; F343-D353 VanDerWaalsContact CZ-O 3.23Å; F343-D353 WeakPolarHBondContact CZ-O 3.27Å; G345-D353 WeakPolarHBondContact CA-OD2 3.38Å; K346-D353 PolarHBondContact N-OD2 3.4Å; T349-D353 VanDerWaalsContact O-CB 3.24Å; T349-D353 WeakPolarHBondContact O-CB 3.42Å; T349-D353 PolarHBondContact O-N 3.26Å; T349-D353 PolarHBondContact OG1-OD2 2.95Å; D353-A355 VanDerWaalsContact C-N 3.34Å; D353-H356 PolarHBondContact O-N 3.36Å; D353-L357 VanDerWaalsContact O-CB 3.27Å; D353-L357 WeakPolarHBondContact O-CB 3.41Å; D353-L357 PolarHBondContact O-N 2.98Å
354	A	95.1	Very high	94.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.7	-38.1	177.3	0	0	0	0	0	111.6	W111 W183 L350 E352 L358 F369	W111-A354 HydrophobicContact CH2-CB 4.2Å; W183-A354 HydrophobicContact CH2-CB 3.93Å; W183-A354 HydrophobicContact CZ2-CB 3.62Å; L350-A354 WeakPolarHBondContact O-CB 3.28Å; L350-A354 PolarHBondContact O-N 2.61Å; E352-A354 PolarHBondContact O-N 3.09Å; A354-L358 VanDerWaalsContact O-CG 3.26Å; A354-L358 WeakPolarHBondContact O-CG 3.49Å; A354-L358 PolarHBondContact O-N 3.37Å; A354-F369 HydrophobicContact CB-CB 3.76Å; A354-F369 HydrophobicContact CB-CD1 3.81Å; A354-F369 HydrophobicContact CB-CD2 4Å; A354-F369 HydrophobicContact CB-CE1 4.43Å; A354-F369 HydrophobicContact CB-CG 3.56Å
355	A	92.3	Very high	93.9	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-52.4	174.4	0	0	0	0	0	112.1	W111 D351 E352 D353 L357 L358 Q359	W111-A355 HydrophobicContact CE3-CB 3.6Å; W111-A355 HydrophobicContact CH2-CB 4.03Å; W111-A355 HydrophobicContact CZ3-CB 3.14Å; D351-A355 PolarHBondContact O-N 3.11Å; D351-A355 VanDerWaalsContact O-N 3.11Å; E352-A355 WeakPolarHBondContact O-CB 3.41Å; E352-A355 PolarHBondContact O-N 3.15Å; D353-A355 VanDerWaalsContact C-N 3.34Å; A355-L357 VanDerWaalsContact C-N 3.32Å; A355-L357 PolarHBondContact O-N 3.12Å; A355-L358 PolarHBondContact O-N 2.9Å; A355-Q359 VanDerWaalsContact O-CG 3.31Å; A355-Q359 WeakPolarHBondContact O-CG 3.44Å; A355-Q359 PolarHBondContact O-N 3.23Å; A355-Q359 VanDerWaalsContact O-N 3.12Å
356	H	94.4	Very high	93.5	Very high	17 Å²	17	49.5 Å²	49.5	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-42.3	-177.1	-173	48.6	0	0	0	111	Q122 F343 E352 D353 Q359 L360	Q122-H356 HydrophobicContact CB-CB 4.25Å; Q122-H356 HydrophobicContact CG-CB 4.38Å; F343-H356 AromaticContact CE2-CD2 3.74Å; E352-H356 PolarHBondContact O-N 2.93Å; D353-H356 PolarHBondContact O-N 3.36Å; H356-Q359 PolarHBondContact O-N 2.96Å; H356-L360 WeakPolarHBondContact O-CB 3.42Å; H356-L360 PolarHBondContact O-N 3.44Å
357	L	96.7	Very high	93.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-46.3	177.2	179.1	59.3	0	0	0	112.6	W183 F246 F248 F343 D353 A355 Q359 L360 L361	W183-L357 HydrophobicContact CH2-CB 4.5Å; W183-L357 HydrophobicContact CH2-CD2 3.65Å; W183-L357 HydrophobicContact CH2-CG 4.38Å; W183-L357 HydrophobicContact CZ2-CD2 4.18Å; W183-L357 HydrophobicContact CZ3-CD2 3.99Å; F246-L357 HydrophobicContact CB-CD1 4.3Å; F246-L357 HydrophobicContact CB-CD2 4.14Å; F246-L357 HydrophobicContact CD1-CD1 4.46Å; F246-L357 HydrophobicContact CD1-CD2 4.01Å; F246-L357 HydrophobicContact CD2-CD2 3.37Å; F246-L357 HydrophobicContact CE1-CD2 4.2Å; F246-L357 HydrophobicContact CE2-CD2 3.6Å; F246-L357 HydrophobicContact CG-CD1 4.33Å; F246-L357 HydrophobicContact CG-CD2 3.59Å; F246-L357 HydrophobicContact CZ-CD2 4.02Å; F248-L357 HydrophobicContact CE2-CD2 3.79Å; F248-L357 HydrophobicContact CZ-CD2 4.32Å; F343-L357 HydrophobicContact CB-CD1 4.01Å; F343-L357 HydrophobicContact CD1-CB 4.29Å; F343-L357 HydrophobicContact CD1-CD1 4.11Å; F343-L357 HydrophobicContact CD1-CD2 4.07Å; F343-L357 HydrophobicContact CD1-CG 4.39Å; F343-L357 HydrophobicContact CD2-CB 4.32Å; F343-L357 HydrophobicContact CD2-CD1 4.04Å; F343-L357 HydrophobicContact CE1-CB 3.98Å; F343-L357 HydrophobicContact CE1-CD2 4.26Å; F343-L357 HydrophobicContact CE2-CB 3.98Å; F343-L357 HydrophobicContact CG-CB 4.47Å; F343-L357 HydrophobicContact CG-CD1 3.8Å; F343-L357 HydrophobicContact CZ-CB 3.83Å; D353-L357 VanDerWaalsContact O-CB 3.27Å; D353-L357 WeakPolarHBondContact O-CB 3.41Å; D353-L357 PolarHBondContact O-N 2.98Å; A355-L357 VanDerWaalsContact C-N 3.32Å; A355-L357 PolarHBondContact O-N 3.12Å; L357-Q359 VanDerWaalsContact C-N 3.25Å; L357-Q359 PolarHBondContact O-N 2.76Å; L357-L360 WeakPolarHBondContact O-CB 3.42Å; L357-L360 PolarHBondContact O-N 3.15Å; L357-L361 HydrophobicContact CD1-CD1 3.8Å; L357-L361 HydrophobicContact CD1-CG 3.9Å; L357-L361 HydrophobicContact CG-CD1 3.83Å; L357-L361 HydrophobicContact CG-CG 4.34Å; L357-L361 WeakPolarHBondContact O-CB 3.42Å; L357-L361 VanDerWaalsContact O-CG 3.24Å; L357-L361 WeakPolarHBondContact O-CG 3.41Å; L357-L361 PolarHBondContact O-N 3.36Å
358	L	96.1	Very high	93.1	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-33.4	179.8	-68.1	176.3	0	0	0	112.1	W183 V186 A354 A355 K362 V363 D364 L367 F369	W183-L358 HydrophobicContact CZ3-CD2 4.28Å; V186-L358 HydrophobicContact CG1-CD2 4.3Å; A354-L358 VanDerWaalsContact O-CG 3.26Å; A354-L358 WeakPolarHBondContact O-CG 3.49Å; A354-L358 PolarHBondContact O-N 3.37Å; A355-L358 PolarHBondContact O-N 2.9Å; L358-K362 PolarHBondContact O-N 3.24Å; L358-K362 VanDerWaalsContact O-N 3.14Å; L358-V363 HydrophobicContact CB-CG2 4.32Å; L358-V363 HydrophobicContact CD2-CG2 3.65Å; L358-V363 PolarHBondContact O-N 2.65Å; L358-D364 HydrophobicContact CB-CB 4.27Å; L358-D364 PolarHBondContact O-N 3.1Å; L358-L367 HydrophobicContact CD1-CD1 3.93Å; L358-L367 HydrophobicContact CD2-CD1 3.78Å; L358-F369 HydrophobicContact CD1-CB 4Å
359	Q	94	Very high	93.1	Very high	90 Å²	90	53.1 Å²	53.1	42%	0.421	24%	0.243	S	C	.	.	H	α-helix	trans	-69.1	-45.4	173	-69.8	171.4	14.2	0	0	111.9	A355 H356 L357 L361 K362 D364	A355-Q359 VanDerWaalsContact O-CG 3.31Å; A355-Q359 WeakPolarHBondContact O-CG 3.44Å; A355-Q359 PolarHBondContact O-N 3.23Å; A355-Q359 VanDerWaalsContact O-N 3.12Å; H356-Q359 PolarHBondContact O-N 2.96Å; L357-Q359 VanDerWaalsContact C-N 3.25Å; L357-Q359 PolarHBondContact O-N 2.76Å; Q359-L361 PolarHBondContact O-N 2.92Å; Q359-K362 WeakPolarHBondContact O-CA 3.44Å; Q359-K362 PolarHBondContact O-N 2.86Å; Q359-D364 HydrophobicContact CG-CB 4Å
360	L	94.1	Very high	93	Very high	90 Å²	90	51.3 Å²	51.3	47%	0.471	23%	0.232	S	C	.	.	H	α-helix	trans	-57.5	-40.8	176.3	-178	68.7	0	0	0	111.4	F343 H356 L357 K362	F343-L360 HydrophobicContact CD2-CD2 4.29Å; H356-L360 WeakPolarHBondContact O-CB 3.42Å; H356-L360 PolarHBondContact O-N 3.44Å; L357-L360 WeakPolarHBondContact O-CB 3.42Å; L357-L360 PolarHBondContact O-N 3.15Å; L360-K362 VanDerWaalsContact C-N 3.25Å; L360-K362 PolarHBondContact O-N 3.47Å
361	L	96	Very high	92.4	Very high	23 Å²	23	53.1 Å²	53.1	12%	0.12	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.1	176.3	-66.9	175.3	0	0	0	113.6	I170 T244 L357 Q359 V363	I170-L361 HydrophobicContact CD1-CD1 3.82Å; I170-L361 HydrophobicContact CD1-CD2 3.92Å; I170-L361 HydrophobicContact CD1-CG 4.32Å; I170-L361 HydrophobicContact CG1-CD1 4.46Å; I170-L361 HydrophobicContact CG1-CD2 3.79Å; T244-L361 HydrophobicContact CG2-CD2 3.69Å; L357-L361 HydrophobicContact CD1-CD1 3.8Å; L357-L361 HydrophobicContact CD1-CG 3.9Å; L357-L361 HydrophobicContact CG-CD1 3.83Å; L357-L361 HydrophobicContact CG-CG 4.34Å; L357-L361 WeakPolarHBondContact O-CB 3.42Å; L357-L361 VanDerWaalsContact O-CG 3.24Å; L357-L361 WeakPolarHBondContact O-CG 3.41Å; L357-L361 PolarHBondContact O-N 3.36Å; Q359-L361 PolarHBondContact O-N 2.92Å; L361-V363 VanDerWaalsContact C-N 3.25Å; L361-V363 HydrophobicContact CB-CG1 4.45Å; L361-V363 HydrophobicContact CB-CG2 3.85Å; L361-V363 PolarHBondContact O-N 2.91Å
362	K	95.8	Very high	91.4	Very high	177 Å²	177	54 Å²	54	77%	0.77	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	33.2	-177.1	-52.1	179.3	-177.5	177.8	0	113.7	L358 Q359 L360	L358-K362 PolarHBondContact O-N 3.24Å; L358-K362 VanDerWaalsContact O-N 3.14Å; Q359-K362 WeakPolarHBondContact O-CA 3.44Å; Q359-K362 PolarHBondContact O-N 2.86Å; L360-K362 VanDerWaalsContact C-N 3.25Å; L360-K362 PolarHBondContact O-N 3.47Å
363	V	95.3	Very high	89.7	Confident	2 Å²	2	60 Å²	60	1%	0.012	27%	0.273	C	S	.	.			trans	-115.2	4.8	179	-59.8	0	0	0	0	112.6	L190 L358 L361 R365 L366 L367	L190-V363 HydrophobicContact CD2-CB 3.92Å; L190-V363 HydrophobicContact CD2-CG1 3.83Å; L190-V363 HydrophobicContact CD2-CG2 4.23Å; L358-V363 HydrophobicContact CB-CG2 4.32Å; L358-V363 HydrophobicContact CD2-CG2 3.65Å; L358-V363 PolarHBondContact O-N 2.65Å; L361-V363 VanDerWaalsContact C-N 3.25Å; L361-V363 HydrophobicContact CB-CG1 4.45Å; L361-V363 HydrophobicContact CB-CG2 3.85Å; L361-V363 PolarHBondContact O-N 2.91Å; V363-R365 PolarHBondContact O-N 3.18Å; V363-R365 VanDerWaalsContact O-N 3.15Å; V363-L366 HydrophobicContact CB-CD1 4.17Å; V363-L366 HydrophobicContact CG1-CD1 4.06Å; V363-L366 WeakPolarHBondContact O-CB 3.31Å; V363-L366 PolarHBondContact O-N 3.06Å; V363-L367 PolarHBondContact O-N 3.43Å
364	D	91.8	Very high	87.8	Confident	58 Å²	58	68 Å²	68	31%	0.31	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.3	177.6	64.5	-54.6	0	0	0	113.7	L358 Q359	L358-D364 HydrophobicContact CB-CB 4.27Å; L358-D364 PolarHBondContact O-N 3.1Å; Q359-D364 HydrophobicContact CG-CB 4Å
365	R	90.9	Very high	86	Confident	212 Å²	212	71.5 Å²	71.5	80%	0.8	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-20.1	171.9	-65.8	-177.3	174.7	174.8	-3	114.1	V363	V363-R365 PolarHBondContact O-N 3.18Å; V363-R365 VanDerWaalsContact O-N 3.15Å
366	L	90.5	Very high	84.9	Confident	110 Å²	110	73.9 Å²	73.9	58%	0.576	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-39.5	-177.6	-61.1	179.5	0	0	0	111.4	V363	V363-L366 HydrophobicContact CB-CD1 4.17Å; V363-L366 HydrophobicContact CG1-CD1 4.06Å; V363-L366 WeakPolarHBondContact O-CB 3.31Å; V363-L366 PolarHBondContact O-N 3.06Å
367	L	92.2	Very high	83.8	Confident	10 Å²	10	73.4 Å²	73.4	5%	0.052	33%	0.325	C	S	.	.			trans	-152.1	164.7	-177.5	64	84.8	0	0	0	111.2	V186 V189 L190 P204 L358 V363	V186-L367 HydrophobicContact CG1-CD1 3.94Å; V186-L367 HydrophobicContact CG1-CD2 4.04Å; V186-L367 HydrophobicContact CG2-CD1 3.99Å; V189-L367 HydrophobicContact CB-CD2 3.96Å; V189-L367 HydrophobicContact CG1-CB 4.47Å; V189-L367 HydrophobicContact CG1-CD2 3.66Å; L190-L367 HydrophobicContact CD2-CD2 3.64Å; L190-L367 HydrophobicContact CG-CD2 3.88Å; P204-L367 HydrophobicContact CG-CB 4.42Å; L358-L367 HydrophobicContact CD1-CD1 3.93Å; L358-L367 HydrophobicContact CD2-CD1 3.78Å; V363-L367 PolarHBondContact O-N 3.43Å
368	R	89.8	Confident	82.7	Confident	180 Å²	180	74.5 Å²	74.5	68%	0.679	33%	0.334	S	S	*	.			trans	-113.6	152.7	168.7	-67.3	-177.1	-178.9	153.9	-0.9	110.2
369	F	92.5	Very high	81.6	Confident	3 Å²	3	77 Å²	77	1%	0.013	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-68.1	130.7	173.5	-171.2	-103.3	0	0	0	109.8	W111 A179 N182 W183 V186 L350 A354 L358	W111-F369 HydrophobicContact CH2-CB 4.17Å; A179-F369 HydrophobicContact CB-CZ 4.19Å; N182-F369 HydrophobicContact CB-CE1 4.31Å; N182-F369 HydrophobicContact CB-CE2 3.86Å; N182-F369 HydrophobicContact CB-CZ 3.59Å; W183-F369 AromaticContact CD1-CE2 3.92Å; W183-F369 HydrophobicContact CD2-CD2 4.15Å; W183-F369 AromaticContact CD2-CE2 3.52Å; W183-F369 HydrophobicContact CD2-CE2 3.52Å; W183-F369 HydrophobicContact CD2-CZ 4.44Å; W183-F369 AromaticContact CE2-CD2 3.92Å; W183-F369 AromaticContact CE2-CE2 3.33Å; W183-F369 AromaticContact CE2-CZ 3.98Å; W183-F369 HydrophobicContact CE3-CD2 4.23Å; W183-F369 HydrophobicContact CE3-CE2 4.03Å; W183-F369 AromaticContact CG-CE2 3.86Å; W183-F369 HydrophobicContact CG-CE2 3.86Å; W183-F369 HydrophobicContact CG-CZ 4.49Å; W183-F369 AromaticContact CH2-CD2 3.85Å; W183-F369 HydrophobicContact CH2-CD2 3.85Å; W183-F369 HydrophobicContact CH2-CE2 4.13Å; W183-F369 AromaticContact CZ2-CD2 3.76Å; W183-F369 HydrophobicContact CZ2-CD2 3.76Å; W183-F369 AromaticContact CZ2-CE2 3.65Å; W183-F369 HydrophobicContact CZ2-CE2 3.65Å; W183-F369 HydrophobicContact CZ2-CZ 4.37Å; W183-F369 HydrophobicContact CZ3-CD2 4.11Å; W183-F369 HydrophobicContact CZ3-CE2 4.32Å; W183-F369 AromaticContact NE1-CE2 3.63Å; W183-F369 AromaticContact NE1-CZ 3.83Å; V186-F369 HydrophobicContact CG2-CD2 4.12Å; L350-F369 HydrophobicContact CD1-CE1 3.95Å; L350-F369 HydrophobicContact CD1-CZ 3.97Å; L350-F369 HydrophobicContact CD2-CE1 3.8Å; L350-F369 HydrophobicContact CD2-CZ 4.34Å; L350-F369 HydrophobicContact CG-CE1 3.88Å; L350-F369 HydrophobicContact CG-CZ 4.39Å; A354-F369 HydrophobicContact CB-CB 3.76Å; A354-F369 HydrophobicContact CB-CD1 3.81Å; A354-F369 HydrophobicContact CB-CD2 4Å; A354-F369 HydrophobicContact CB-CE1 4.43Å; A354-F369 HydrophobicContact CB-CG 3.56Å; L358-F369 HydrophobicContact CD1-CB 4Å
370	P	88.9	Confident	80.8	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.019	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-65.9	133.1	-178.4	-25.6	36.3	0	0	0	112.2	N182 P204 L205	N182-P370 HydrophobicContact CB-CB 4.27Å; N182-P370 HydrophobicContact CB-CG 4.23Å; N182-P370 PolarHBondContact ND2-O 3.05Å; N182-P370 VanDerWaalsContact ND2-O 3.12Å; P204-P370 HydrophobicContact CB-CG 3.6Å; P204-P370 HydrophobicContact CG-CG 4.14Å; L205-P370 HydrophobicContact CD2-CB 3.74Å; L205-P370 HydrophobicContact CG-CB 4.02Å; L205-P370 HydrophobicContact CG-CG 4.49Å
371	P	79.9	Confident	80.4	Confident	38 Å²	38	76.5 Å²	76.5	25%	0.247	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-59.9	146.2	174.2	24.8	-33.5	0	0	0	111	Y373	P371-Y373 HydrophobicContact CB-CE1 4.22Å; P371-Y373 HydrophobicContact CB-CE2 4.24Å; P371-Y373 HydrophobicContact CG-CD2 4.46Å; P371-Y373 HydrophobicContact CG-CE1 4.14Å; P371-Y373 HydrophobicContact CG-CE2 3.58Å; P371-Y373 WeakPolarHBondContact CG-OH 3.31Å
372	S	67.1	Low	80	Confident	34 Å²	34	76.4 Å²	76.4	24%	0.238	35%	0.352	C	S	.	.			trans	-96.2	92.4	175.6	173.7	0	0	0	0	110.4	R374	S372-R374 PolarHBondContact O-N 2.74Å
373	Y	55.7	Low	79.6	Confident	192 Å²	192	72 Å²	72	75%	0.753	34%	0.337	S	S	*	.			trans	-74.7	2	175.8	-55.9	-69.8	0	0	0	115	P371	P371-Y373 HydrophobicContact CB-CE1 4.22Å; P371-Y373 HydrophobicContact CB-CE2 4.24Å; P371-Y373 HydrophobicContact CG-CD2 4.46Å; P371-Y373 HydrophobicContact CG-CE1 4.14Å; P371-Y373 HydrophobicContact CG-CE2 3.58Å; P371-Y373 WeakPolarHBondContact CG-OH 3.31Å
374	R	54.9	Low	79.4	Confident	168 Å²	168	77.9 Å²	77.9	63%	0.634	37%	0.368	S	S	*	.	S	Bend	trans	-91.1	137.7	179.8	-68.3	-173.1	177.2	-159.4	-3.4	110.4	S372 R376	S372-R374 PolarHBondContact O-N 2.74Å; R374-R376 PolarHBondContact O-N 3.46Å
375	N	58.2	Low	79.6	Confident	73 Å²	73	77.6 Å²	77.6	39%	0.39	36%	0.363	S	S	.	.			trans	-45.7	97.8	167.7	-70.9	-1.5	0	0	0	109.8	L102 T377	L102-N375 PolarHBondContact O-ND2 2.69Å; N375-T377 PolarHBondContact O-N 2.87Å
376	R	68.1	Low	79.8	Confident	66 Å²	66	67.5 Å²	67.5	25%	0.249	33%	0.325	C	S	.	.			trans	-63.5	128.1	177.1	-63.7	-175.4	-174.6	174.8	7.6	105.6	D351 R374 A378	D351-R376 IonicContact OD1-NH2 3.77Å; D351-R376 PolarHBondContact OD1-NH2 2.96Å; D351-R376 IonicContact OD2-CZ 3.47Å; D351-R376 IonicContact OD2-NH1 3.56Å; D351-R376 PolarHBondContact OD2-NH1 3.44Å; D351-R376 IonicContact OD2-NH2 2.9Å; D351-R376 PolarHBondContact OD2-NH2 3.33Å; R374-R376 PolarHBondContact O-N 3.46Å; R376-A378 PolarHBondContact O-N 2.74Å
377	T	71.1	Confident	80	Confident	8 Å²	8	65.9 Å²	65.9	5%	0.049	33%	0.328	C	S	.	.			trans	-54	113.4	170.4	-52.3	0	0	0	0	107.6	R250 V254 I257 R261 N375 W381	R250-T377 VanDerWaalsContact NH2-CB 3.34Å; R250-T377 PolarHBondContact NH2-O 3.33Å; V254-T377 HydrophobicContact CG1-CG2 3.9Å; V254-T377 WeakPolarHBondContact CG1-O 3.17Å; I257-T377 HydrophobicContact CB-CG2 4.05Å; I257-T377 HydrophobicContact CG2-CG2 3.55Å; R261-T377 PolarHBondContact NH1-OG1 3.43Å; N375-T377 PolarHBondContact O-N 2.87Å; T377-W381 HydrophobicContact CG2-CD2 4.37Å; T377-W381 HydrophobicContact CG2-CE3 3.85Å
378	A	73.4	Confident	80	Confident	23 Å²	23	74.8 Å²	74.8	19%	0.19	37%	0.366	C	S	.	.			trans	-74.1	146.7	-177.4	0	0	0	0	0	109.4	R376 S380 W381	R376-A378 PolarHBondContact O-N 2.74Å; A378-S380 WeakPolarHBondContact CB-OG 3.28Å; A378-S380 PolarHBondContact O-N 3.17Å; A378-W381 HydrophobicContact CB-CG 4.31Å; A378-W381 WeakPolarHBondContact O-CB 3.44Å; A378-W381 PolarHBondContact O-N 2.76Å; A378-W381 VanDerWaalsContact O-N 3.09Å
379	S	74	Confident	80.3	Confident	58 Å²	58	66.5 Å²	66.5	41%	0.406	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-62.6	-25	174.3	-49.2	0	0	0	0	111.7	W381 E382	S379-W381 PolarHBondContact O-N 3.35Å; S379-W381 VanDerWaalsContact O-N 3.09Å; S379-E382 WeakPolarHBondContact O-CG 3.49Å; S379-E382 PolarHBondContact O-N 3.27Å
380	S	77.4	Confident	80.6	Confident	86 Å²	86	69.1 Å²	69.1	60%	0.601	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-62.3	-14.2	173.6	54.4	0	0	0	0	114.3	A378 E382	A378-S380 WeakPolarHBondContact CB-OG 3.28Å; A378-S380 PolarHBondContact O-N 3.17Å; S380-E382 VanDerWaalsContact C-N 3.31Å
381	W	84.3	Confident	81	Confident	82 Å²	82	70.1 Å²	70.1	31%	0.311	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-82.7	-10.8	-177.9	-65	10.4	0	0	0	112.7	T377 A378 S379 D383 D384 W385	T377-W381 HydrophobicContact CG2-CD2 4.37Å; T377-W381 HydrophobicContact CG2-CE3 3.85Å; A378-W381 HydrophobicContact CB-CG 4.31Å; A378-W381 WeakPolarHBondContact O-CB 3.44Å; A378-W381 PolarHBondContact O-N 2.76Å; A378-W381 VanDerWaalsContact O-N 3.09Å; S379-W381 PolarHBondContact O-N 3.35Å; S379-W381 VanDerWaalsContact O-N 3.09Å; W381-D383 VanDerWaalsContact C-N 3.33Å; W381-D383 PolarHBondContact O-N 3.07Å; W381-D384 PolarHBondContact O-N 3.16Å; W381-W385 AromaticContact CE3-NE1 3.76Å; W381-W385 PolarHBondContact O-N 2.84Å
382	E	87.6	Confident	81.8	Confident	22 Å²	22	70.9 Å²	70.9	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-43.9	-175.7	-65.1	-176.4	111.4	0	0	112.3	F253 V254 I257 S379 S380 D384 W385 F386 L416	F253-E382 WeakPolarHBondContact CB-OE1 3.43Å; V254-E382 VanDerWaalsContact CG2-CD 3.46Å; V254-E382 HydrophobicContact CG2-CG 3.67Å; V254-E382 WeakPolarHBondContact CG2-OE1 3.45Å; I257-E382 HydrophobicContact CD1-CG 4.16Å; S379-E382 WeakPolarHBondContact O-CG 3.49Å; S379-E382 PolarHBondContact O-N 3.27Å; S380-E382 VanDerWaalsContact C-N 3.31Å; E382-D384 VanDerWaalsContact C-N 3.33Å; E382-D384 PolarHBondContact O-N 3.19Å; E382-W385 PolarHBondContact O-N 2.87Å; E382-F386 HydrophobicContact CB-CD2 4.42Å; E382-F386 VanDerWaalsContact O-CB 3.31Å; E382-F386 WeakPolarHBondContact O-CB 3.47Å; E382-F386 VanDerWaalsContact O-CD2 3.29Å; E382-F386 WeakPolarHBondContact O-CD2 3.31Å; E382-F386 PolarHBondContact O-N 3.17Å; E382-L416 HydrophobicContact CB-CD1 4.02Å
383	D	88.1	Confident	83.3	Confident	84 Å²	84	72.5 Å²	72.5	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-57.4	-46.9	178.7	-68.8	-36.7	0	0	0	111.3	W381 F386 A387 N415 L416	W381-D383 VanDerWaalsContact C-N 3.33Å; W381-D383 PolarHBondContact O-N 3.07Å; D383-F386 PolarHBondContact O-N 3.35Å; D383-A387 WeakPolarHBondContact O-CA 3.35Å; D383-A387 VanDerWaalsContact O-CB 3.29Å; D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 3.02Å; D383-N415 PolarHBondContact OD1-ND2 3.45Å; D383-L416 WeakPolarHBondContact OD1-CD2 3.4Å
384	D	91.7	Very high	85.3	Confident	125 Å²	125	65 Å²	65	67%	0.668	34%	0.339	S	S	*	.	H	α-helix	trans	-65.5	-44.6	-179.6	-68	-27	0	0	0	112.6	W381 E382 F386	W381-D384 PolarHBondContact O-N 3.16Å; E382-D384 VanDerWaalsContact C-N 3.33Å; E382-D384 PolarHBondContact O-N 3.19Å; D384-F386 VanDerWaalsContact C-N 3.35Å
385	W	95.1	Very high	87.4	Confident	53 Å²	53	62.7 Å²	62.7	20%	0.201	33%	0.33	C	S	.	.	H	α-helix	trans	-70	-33.9	-178.4	-82.4	78.4	0	0	0	112.2	I257 F260 R261 E265 F305 W381 E382	I257-W385 HydrophobicContact CD1-CB 3.71Å; I257-W385 HydrophobicContact CD1-CG 3.83Å; I257-W385 HydrophobicContact CG1-CB 4.04Å; I257-W385 HydrophobicContact CG1-CD2 4.24Å; I257-W385 HydrophobicContact CG1-CG 4Å; I257-W385 HydrophobicContact CG2-CD2 3.65Å; I257-W385 HydrophobicContact CG2-CE3 4.2Å; I257-W385 HydrophobicContact CG2-CG 3.92Å; I257-W385 HydrophobicContact CG2-CZ2 4.1Å; F260-W385 AromaticContact CD1-CH2 3.7Å; F260-W385 HydrophobicContact CD1-CH2 3.7Å; F260-W385 AromaticContact CD1-CZ3 3.42Å; F260-W385 HydrophobicContact CD1-CZ3 3.42Å; F260-W385 VanDerWaalsContact CD1-CZ3 3.42Å; F260-W385 AromaticContact CE1-CH2 3.86Å; F260-W385 HydrophobicContact CE1-CH2 3.86Å; F260-W385 AromaticContact CE1-CZ3 3.61Å; F260-W385 HydrophobicContact CE1-CZ3 3.61Å; F260-W385 HydrophobicContact CG-CZ3 4.41Å; R261-W385 HydrophobicContact CG-CH2 3.73Å; R261-W385 HydrophobicContact CG-CZ2 3.69Å; E265-W385 VanDerWaalsContact OE1-CH2 3.32Å; E265-W385 WeakPolarHBondContact OE1-CH2 3.15Å; F305-W385 HydrophobicContact CB-CE3 3.84Å; F305-W385 HydrophobicContact CB-CZ3 3.81Å; F305-W385 HydrophobicContact CD1-CB 4.49Å; F305-W385 AromaticContact CD1-CE3 3.87Å; F305-W385 HydrophobicContact CD1-CE3 3.87Å; F305-W385 WeakPolarHBondContact CD1-O 3.17Å; F305-W385 AromaticContact CD2-CE3 3.67Å; F305-W385 HydrophobicContact CD2-CE3 3.67Å; F305-W385 AromaticContact CD2-CZ3 3.82Å; F305-W385 HydrophobicContact CD2-CZ3 3.82Å; F305-W385 HydrophobicContact CE1-CB 4.26Å; F305-W385 HydrophobicContact CE1-CE3 4.31Å; F305-W385 HydrophobicContact CE2-CE3 4.15Å; F305-W385 AromaticContact CG-CE3 3.52Å; F305-W385 HydrophobicContact CG-CE3 3.52Å; F305-W385 AromaticContact CG-CZ3 3.86Å; F305-W385 HydrophobicContact CG-CZ3 3.86Å; F305-W385 HydrophobicContact CZ-CE3 4.44Å; W381-W385 AromaticContact CE3-NE1 3.76Å; W381-W385 PolarHBondContact O-N 2.84Å; E382-W385 PolarHBondContact O-N 2.87Å
386	F	96.1	Very high	89.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-93.6	-6.9	-179.7	-75.5	-80.5	0	0	0	113.9	F253 I257 F305 I309 E382 D383 D384 K388 I389 R394 L397 L416	F253-F386 HydrophobicContact CB-CE2 3.92Å; F253-F386 HydrophobicContact CB-CZ 4.14Å; F253-F386 HydrophobicContact CD1-CZ 4.41Å; F253-F386 HydrophobicContact CD2-CD2 4.41Å; F253-F386 HydrophobicContact CD2-CE1 4.31Å; F253-F386 AromaticContact CD2-CE2 3.77Å; F253-F386 HydrophobicContact CD2-CE2 3.77Å; F253-F386 AromaticContact CD2-CZ 3.7Å; F253-F386 HydrophobicContact CD2-CZ 3.7Å; F253-F386 HydrophobicContact CE2-CE1 4.36Å; F253-F386 HydrophobicContact CE2-CZ 4.18Å; F253-F386 AromaticContact CG-CE2 4Å; F253-F386 HydrophobicContact CG-CE2 4Å; F253-F386 AromaticContact CG-CZ 3.82Å; F253-F386 HydrophobicContact CG-CZ 3.82Å; I257-F386 HydrophobicContact CD1-CE2 4.13Å; I257-F386 HydrophobicContact CG1-CE2 4.39Å; F305-F386 HydrophobicContact CE1-CD1 4.19Å; F305-F386 HydrophobicContact CE1-CD2 4.48Å; F305-F386 AromaticContact CE1-CE1 3.91Å; F305-F386 HydrophobicContact CE1-CE1 3.91Å; F305-F386 HydrophobicContact CE1-CE2 4.21Å; F305-F386 HydrophobicContact CE1-CG 4.48Å; F305-F386 AromaticContact CE1-CZ 3.93Å; F305-F386 HydrophobicContact CE1-CZ 3.93Å; F305-F386 HydrophobicContact CZ-CE1 4.23Å; F305-F386 HydrophobicContact CZ-CE2 4.22Å; F305-F386 AromaticContact CZ-CZ 3.87Å; F305-F386 HydrophobicContact CZ-CZ 3.87Å; I309-F386 HydrophobicContact CD1-CE1 4.42Å; E382-F386 HydrophobicContact CB-CD2 4.42Å; E382-F386 VanDerWaalsContact O-CB 3.31Å; E382-F386 WeakPolarHBondContact O-CB 3.47Å; E382-F386 VanDerWaalsContact O-CD2 3.29Å; E382-F386 WeakPolarHBondContact O-CD2 3.31Å; E382-F386 PolarHBondContact O-N 3.17Å; D383-F386 PolarHBondContact O-N 3.35Å; D384-F386 VanDerWaalsContact C-N 3.35Å; F386-K388 PolarHBondContact O-N 2.87Å; F386-K388 VanDerWaalsContact O-N 3.15Å; F386-I389 HydrophobicContact CD1-CB 4.15Å; F386-I389 HydrophobicContact CD1-CG1 4Å; F386-I389 HydrophobicContact CD1-CG2 4.4Å; F386-I389 WeakPolarHBondContact O-CB 3.3Å; F386-I389 PolarHBondContact O-N 3.36Å; F386-R394 HydrophobicContact CD1-CG 4.04Å; F386-L397 HydrophobicContact CE1-CD2 3.59Å; F386-L397 HydrophobicContact CZ-CD2 3.89Å; F386-L416 HydrophobicContact CB-CD1 4.44Å; F386-L416 HydrophobicContact CB-CD2 4.04Å; F386-L416 HydrophobicContact CD2-CD1 4Å; F386-L416 HydrophobicContact CG-CD1 4.28Å
387	A	93.3	Very high	90.8	Very high	76 Å²	76	61 Å²	61	63%	0.628	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-37.5	-179	0	0	0	0	0	113.6	D383	D383-A387 WeakPolarHBondContact O-CA 3.35Å; D383-A387 VanDerWaalsContact O-CB 3.29Å; D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 3.02Å
388	K	92.4	Very high	92.1	Very high	196 Å²	196	61.4 Å²	61.4	85%	0.852	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	1.5	-179.7	-62.2	-176.1	-177.7	177.9	0	113.7	F386	F386-K388 PolarHBondContact O-N 2.87Å; F386-K388 VanDerWaalsContact O-N 3.15Å
389	I	97.5	Very high	93.2	Very high	6 Å²	6	66.3 Å²	66.3	3%	0.031	34%	0.34	C	S	.	.	S	Bend	trans	-92.3	124.1	-178.2	-54.9	-59.1	0	0	0	109.3	F305 I309 F386 L391 W393 R394	F305-I389 HydrophobicContact CD1-CD1 4.13Å; F305-I389 HydrophobicContact CD1-CG1 4.22Å; F305-I389 HydrophobicContact CE1-CG1 4.4Å; I309-I389 HydrophobicContact CG1-CD1 4.19Å; I309-I389 HydrophobicContact CG2-CG2 4.2Å; F386-I389 HydrophobicContact CD1-CB 4.15Å; F386-I389 HydrophobicContact CD1-CG1 4Å; F386-I389 HydrophobicContact CD1-CG2 4.4Å; F386-I389 WeakPolarHBondContact O-CB 3.3Å; F386-I389 PolarHBondContact O-N 3.36Å; I389-L391 PolarHBondContact O-N 3.27Å; I389-W393 HydrophobicContact CG2-CB 3.93Å; I389-W393 HydrophobicContact CG2-CE3 4.35Å; I389-R394 HydrophobicContact CB-CG 4.04Å; I389-R394 HydrophobicContact CG2-CG 3.76Å; I389-R394 PolarHBondContact O-NE 3.37Å
390	P	97.3	Very high	94.4	Very high	59 Å²	59	65.4 Å²	65.4	38%	0.383	33%	0.331	S	S	.	.			trans	-53.3	140.3	179.4	-27.4	34.7	0	0	0	112.7	A392 W393 R394	P390-A392 PolarHBondContact O-N 2.82Å; P390-W393 HydrophobicContact CB-CB 4.47Å; P390-W393 HydrophobicContact CB-CD2 4.34Å; P390-W393 HydrophobicContact CB-CG 4.18Å; P390-W393 HydrophobicContact CG-CD2 3.99Å; P390-W393 HydrophobicContact CG-CE3 4.12Å; P390-W393 HydrophobicContact CG-CG 4.34Å; P390-W393 HydrophobicContact CG-CZ3 4.44Å; P390-W393 WeakPolarHBondContact O-CA 3.3Å; P390-W393 WeakPolarHBondContact O-CB 3.31Å; P390-W393 PolarHBondContact O-N 2.83Å; P390-R394 PolarHBondContact O-N 3.25Å
391	L	97.3	Very high	95.4	Very high	23 Å²	23	61.3 Å²	61.3	12%	0.12	30%	0.302	C	S	.	.	H	α-helix	trans	-52.3	-42.4	-179.8	-178.1	71.1	0	0	0	112.7	I389 W393 R394 R395 D419	I389-L391 PolarHBondContact O-N 3.27Å; L391-W393 VanDerWaalsContact C-N 3.26Å; L391-W393 PolarHBondContact O-N 3.38Å; L391-R394 PolarHBondContact O-N 3.04Å; L391-R395 VanDerWaalsContact CD2-CZ 3.4Å; L391-R395 WeakPolarHBondContact O-CG 3.36Å; L391-R395 PolarHBondContact O-N 3.29Å; L391-D419 VanDerWaalsContact CD2-CG 3.5Å; L391-D419 VanDerWaalsContact CD2-OD1 3.24Å; L391-D419 WeakPolarHBondContact CD2-OD1 3.49Å; L391-D419 VanDerWaalsContact CD2-OD2 3.3Å; L391-D419 WeakPolarHBondContact CD2-OD2 3.39Å
392	A	97.9	Very high	96.1	Very high	55 Å²	55	59.7 Å²	59.7	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-58.3	-40	177.7	0	0	0	0	0	112	P390 R395 Q396	P390-A392 PolarHBondContact O-N 2.82Å; A392-R395 PolarHBondContact O-N 3.06Å; A392-Q396 VanDerWaalsContact O-CG 3.31Å; A392-Q396 WeakPolarHBondContact O-CG 3.32Å; A392-Q396 PolarHBondContact O-N 3.5Å
393	W	98.3	Very high	96.6	Very high	68 Å²	68	59 Å²	59	26%	0.258	30%	0.295	S	S	.	.	H	α-helix	trans	-71.7	-41.5	178.1	-66.1	5.5	0	0	0	111.4	I309 Q310 L313 I389 P390 L391 R395 Q396 L397	I309-W393 HydrophobicContact CG2-CB 4.42Å; I309-W393 HydrophobicContact CG2-CE3 4.31Å; Q310-W393 HydrophobicContact CG-CE3 3.99Å; Q310-W393 HydrophobicContact CG-CH2 3.19Å; Q310-W393 HydrophobicContact CG-CZ2 3.92Å; Q310-W393 HydrophobicContact CG-CZ3 3.22Å; L313-W393 HydrophobicContact CD1-CB 3.58Å; L313-W393 HydrophobicContact CD1-CD2 4.46Å; L313-W393 HydrophobicContact CD1-CG 3.86Å; I389-W393 HydrophobicContact CG2-CB 3.93Å; I389-W393 HydrophobicContact CG2-CE3 4.35Å; P390-W393 HydrophobicContact CB-CB 4.47Å; P390-W393 HydrophobicContact CB-CD2 4.34Å; P390-W393 HydrophobicContact CB-CG 4.18Å; P390-W393 HydrophobicContact CG-CD2 3.99Å; P390-W393 HydrophobicContact CG-CE3 4.12Å; P390-W393 HydrophobicContact CG-CG 4.34Å; P390-W393 HydrophobicContact CG-CZ3 4.44Å; P390-W393 WeakPolarHBondContact O-CA 3.3Å; P390-W393 WeakPolarHBondContact O-CB 3.31Å; P390-W393 PolarHBondContact O-N 2.83Å; L391-W393 VanDerWaalsContact C-N 3.26Å; L391-W393 PolarHBondContact O-N 3.38Å; W393-R395 VanDerWaalsContact C-N 3.28Å; W393-R395 PolarHBondContact O-N 3.43Å; W393-Q396 PolarHBondContact O-N 3.31Å; W393-L397 VanDerWaalsContact O-CB 3.28Å; W393-L397 WeakPolarHBondContact O-CB 3.35Å; W393-L397 PolarHBondContact O-N 3.21Å
394	R	98.3	Very high	97.1	Very high	35 Å²	35	55 Å²	55	13%	0.132	27%	0.274	C	S	.	.	H	α-helix	trans	-56.5	-43.5	174	-64.9	-176	-80.4	151.7	0.8	111.4	F386 I389 P390 L391 L397 Y398 L416 L417	F386-R394 HydrophobicContact CD1-CG 4.04Å; I389-R394 HydrophobicContact CB-CG 4.04Å; I389-R394 HydrophobicContact CG2-CG 3.76Å; I389-R394 PolarHBondContact O-NE 3.37Å; P390-R394 PolarHBondContact O-N 3.25Å; L391-R394 PolarHBondContact O-N 3.04Å; R394-L397 PolarHBondContact O-N 3Å; R394-Y398 PolarHBondContact O-N 2.82Å; R394-L416 WeakPolarHBondContact CB-O 3.37Å; R394-L416 VanDerWaalsContact CD-O 3.28Å; R394-L416 WeakPolarHBondContact CD-O 3.26Å; R394-L416 VanDerWaalsContact CZ-O 3.25Å; R394-L416 PolarHBondContact NE-O 3.28Å; R394-L416 PolarHBondContact NH1-O 3.37Å; R394-L417 HydrophobicContact CB-CD2 4.13Å; R394-L417 WeakPolarHBondContact O-CD2 3.32Å
395	R	98.3	Very high	97.4	Very high	119 Å²	119	49.1 Å²	49.1	45%	0.449	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-44.6	175.7	-71.3	175.8	176.4	163.9	3.2	113.2	L391 A392 W393 L397 Y398 K399 L417	L391-R395 VanDerWaalsContact CD2-CZ 3.4Å; L391-R395 WeakPolarHBondContact O-CG 3.36Å; L391-R395 PolarHBondContact O-N 3.29Å; A392-R395 PolarHBondContact O-N 3.06Å; W393-R395 VanDerWaalsContact C-N 3.28Å; W393-R395 PolarHBondContact O-N 3.43Å; R395-L397 VanDerWaalsContact C-N 3.33Å; R395-Y398 PolarHBondContact O-N 3.24Å; R395-K399 WeakPolarHBondContact O-CG 3.43Å; R395-K399 PolarHBondContact O-N 3.44Å; R395-L417 HydrophobicContact CG-CD2 4.03Å; R395-L417 PolarHBondContact NE-O 3.47Å; R395-L417 PolarHBondContact NH2-O 2.83Å
396	Q	98.3	Very high	97.5	Very high	104 Å²	104	47.9 Å²	47.9	49%	0.486	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-40.1	175.9	-71.3	174.2	22.1	0	0	111.7	L313 A392 W393 K399 L400	L313-Q396 HydrophobicContact CD1-CB 4.2Å; L313-Q396 HydrophobicContact CD2-CB 3.81Å; A392-Q396 VanDerWaalsContact O-CG 3.31Å; A392-Q396 WeakPolarHBondContact O-CG 3.32Å; A392-Q396 PolarHBondContact O-N 3.5Å; W393-Q396 PolarHBondContact O-N 3.31Å; Q396-K399 PolarHBondContact O-N 2.93Å; Q396-L400 PolarHBondContact O-N 2.69Å
397	L	98.6	Very high	97.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-43.2	177.3	-171.1	71.2	0	0	0	111	F253 L256 I309 L312 L313 F386 W393 R394 R395 K399 L400 Y401	F253-L397 HydrophobicContact CD1-CD2 4.23Å; F253-L397 HydrophobicContact CE1-CB 4.32Å; F253-L397 HydrophobicContact CE1-CD2 3.72Å; F253-L397 HydrophobicContact CE1-CG 3.73Å; F253-L397 HydrophobicContact CZ-CB 4.23Å; F253-L397 HydrophobicContact CZ-CD2 3.93Å; F253-L397 HydrophobicContact CZ-CG 4.08Å; L256-L397 HydrophobicContact CD1-CD1 4.1Å; L256-L397 HydrophobicContact CD1-CD2 4.03Å; L256-L397 HydrophobicContact CD1-CG 4.3Å; I309-L397 HydrophobicContact CD1-CD1 4.36Å; I309-L397 HydrophobicContact CD1-CD2 3.68Å; L312-L397 HydrophobicContact CB-CD1 4.29Å; L312-L397 HydrophobicContact CD1-CD1 4.07Å; L313-L397 HydrophobicContact CD2-CB 4.09Å; L313-L397 HydrophobicContact CD2-CD1 4.16Å; F386-L397 HydrophobicContact CE1-CD2 3.59Å; F386-L397 HydrophobicContact CZ-CD2 3.89Å; W393-L397 VanDerWaalsContact O-CB 3.28Å; W393-L397 WeakPolarHBondContact O-CB 3.35Å; W393-L397 PolarHBondContact O-N 3.21Å; R394-L397 PolarHBondContact O-N 3Å; R395-L397 VanDerWaalsContact C-N 3.33Å; L397-K399 VanDerWaalsContact C-N 3.3Å; L397-K399 PolarHBondContact O-N 3.31Å; L397-L400 HydrophobicContact CD1-CD2 4.38Å; L397-L400 WeakPolarHBondContact O-CB 3.37Å; L397-L400 PolarHBondContact O-N 3.11Å; L397-L400 VanDerWaalsContact O-N 3.11Å; L397-Y401 HydrophobicContact CD1-CD2 4.09Å; L397-Y401 HydrophobicContact CD1-CE2 3.79Å; L397-Y401 HydrophobicContact CG-CD2 4.31Å; L397-Y401 HydrophobicContact CG-CE2 4.47Å; L397-Y401 WeakPolarHBondContact O-CD2 3.35Å; L397-Y401 PolarHBondContact O-N 2.91Å
398	Y	98.4	Very high	97.9	Very high	15 Å²	15	44.7 Å²	44.7	6%	0.059	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-46.2	172.5	170.7	-97.6	0	0	0	110.8	R394 R395 L400 Y401 E402 F405 K412 P413 L417	R394-Y398 PolarHBondContact O-N 2.82Å; R395-Y398 PolarHBondContact O-N 3.24Å; Y398-L400 VanDerWaalsContact C-N 3.27Å; Y398-L400 PolarHBondContact O-N 3.49Å; Y398-Y401 CarbonylContact O-C 3.57Å; Y398-Y401 PolarHBondContact O-N 2.89Å; Y398-E402 HydrophobicContact CE1-CB 4.21Å; Y398-E402 HydrophobicContact CE1-CG 4.01Å; Y398-E402 VanDerWaalsContact CE1-OE1 3.3Å; Y398-E402 WeakPolarHBondContact CE1-OE1 3.49Å; Y398-E402 WeakPolarHBondContact O-CA 3.44Å; Y398-E402 WeakPolarHBondContact O-CB 3.31Å; Y398-E402 PolarHBondContact O-N 2.91Å; Y398-E402 PolarHBondContact OH-OE1 3.31Å; Y398-F405 AromaticContact CD2-CD2 3.86Å; Y398-F405 HydrophobicContact CD2-CD2 3.86Å; Y398-F405 AromaticContact CD2-CE2 3.96Å; Y398-F405 HydrophobicContact CD2-CE2 3.96Å; Y398-F405 HydrophobicContact CD2-CG 4.39Å; Y398-F405 HydrophobicContact CE2-CB 4.22Å; Y398-F405 AromaticContact CE2-CD2 3.83Å; Y398-F405 HydrophobicContact CE2-CD2 3.83Å; Y398-F405 HydrophobicContact CE2-CE2 4.36Å; Y398-F405 AromaticContact CE2-CG 3.96Å; Y398-F405 HydrophobicContact CE2-CG 3.96Å; Y398-K412 HydrophobicContact CD2-CG 4.39Å; Y398-K412 HydrophobicContact CE1-CD 4.06Å; Y398-K412 HydrophobicContact CE1-CG 4.42Å; Y398-K412 HydrophobicContact CE2-CB 4.27Å; Y398-K412 HydrophobicContact CE2-CD 4.18Å; Y398-K412 HydrophobicContact CE2-CG 3.71Å; Y398-P413 HydrophobicContact CD2-CG 4.31Å; Y398-L417 HydrophobicContact CD1-CD1 4.12Å; Y398-L417 HydrophobicContact CD2-CD1 3.96Å; Y398-L417 HydrophobicContact CG-CD1 3.72Å
399	K	98	Very high	98.2	Very high	126 Å²	126	37.3 Å²	37.3	55%	0.548	19%	0.192	S	C	.	.	H	α-helix	trans	-60.2	-35.4	176.2	-70	-52.5	-168.3	177.8	0	113.5	R395 Q396 L397 Y401 E402	R395-K399 WeakPolarHBondContact O-CG 3.43Å; R395-K399 PolarHBondContact O-N 3.44Å; Q396-K399 PolarHBondContact O-N 2.93Å; L397-K399 VanDerWaalsContact C-N 3.3Å; L397-K399 PolarHBondContact O-N 3.31Å; K399-Y401 VanDerWaalsContact C-N 3.28Å; K399-Y401 PolarHBondContact O-N 3.06Å; K399-E402 WeakPolarHBondContact CD-OE2 3.45Å; K399-E402 IonicContact NZ-OE1 3.01Å; K399-E402 PolarHBondContact NZ-OE1 3.34Å; K399-E402 IonicContact NZ-OE2 2.84Å; K399-E402 PolarHBondContact NZ-OE2 2.94Å
400	L	98.1	Very high	98.2	Very high	40 Å²	40	38 Å²	38	21%	0.209	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-27.7	175.5	-176.6	60.7	0	0	0	113.6	L312 F323 Q329 Q396 L397 Y398	L312-L400 HydrophobicContact CB-CD2 4.25Å; L312-L400 WeakPolarHBondContact O-CD2 3.34Å; F323-L400 HydrophobicContact CE2-CD1 4.32Å; F323-L400 HydrophobicContact CE2-CD2 4.02Å; F323-L400 HydrophobicContact CZ-CD2 4.28Å; Q329-L400 VanDerWaalsContact NE2-CD1 3.33Å; Q329-L400 PolarHBondContact NE2-O 3.01Å; Q329-L400 VanDerWaalsContact NE2-O 3.14Å; Q396-L400 PolarHBondContact O-N 2.69Å; L397-L400 HydrophobicContact CD1-CD2 4.38Å; L397-L400 WeakPolarHBondContact O-CB 3.37Å; L397-L400 PolarHBondContact O-N 3.11Å; L397-L400 VanDerWaalsContact O-N 3.11Å; Y398-L400 VanDerWaalsContact C-N 3.27Å; Y398-L400 PolarHBondContact O-N 3.49Å
401	Y	98.5	Very high	98.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-115.2	8.3	-178.9	-69.4	-88.3	0	0	0	113.8	P252 L256 W327 Q329 L397 Y398 K399 A403 D404 F405	P252-Y401 HydrophobicContact CB-CD1 4.39Å; P252-Y401 HydrophobicContact CB-CG 4.46Å; L256-Y401 HydrophobicContact CD1-CD2 4.19Å; L256-Y401 HydrophobicContact CD1-CE2 3.74Å; L256-Y401 HydrophobicContact CD2-CE1 4.3Å; L256-Y401 HydrophobicContact CD2-CE2 4.38Å; W327-Y401 VanDerWaalsContact O-CE1 3.27Å; W327-Y401 WeakPolarHBondContact O-CE1 3.38Å; W327-Y401 VanDerWaalsContact O-CZ 3.31Å; W327-Y401 PolarHBondContact O-OH 3.34Å; Q329-Y401 HydrophobicContact CB-CD1 4.45Å; Q329-Y401 HydrophobicContact CG-CD1 3.7Å; Q329-Y401 HydrophobicContact CG-CE1 3.75Å; Q329-Y401 HydrophobicContact CG-CG 4.43Å; L397-Y401 HydrophobicContact CD1-CD2 4.09Å; L397-Y401 HydrophobicContact CD1-CE2 3.79Å; L397-Y401 HydrophobicContact CG-CD2 4.31Å; L397-Y401 HydrophobicContact CG-CE2 4.47Å; L397-Y401 WeakPolarHBondContact O-CD2 3.35Å; L397-Y401 PolarHBondContact O-N 2.91Å; Y398-Y401 CarbonylContact O-C 3.57Å; Y398-Y401 PolarHBondContact O-N 2.89Å; K399-Y401 VanDerWaalsContact C-N 3.28Å; K399-Y401 PolarHBondContact O-N 3.06Å; Y401-A403 PolarHBondContact O-N 2.9Å; Y401-D404 PolarHBondContact O-N 2.95Å; Y401-F405 PolarHBondContact O-N 2.74Å
402	E	98.5	Very high	98.1	Very high	48 Å²	48	43.5 Å²	43.5	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-56.8	-38.9	-172.4	176.1	164.8	-127.9	0	0	112	F142 Y398 K399 D404 F405 V406	F142-E402 HydrophobicContact CE2-CG 4.21Å; Y398-E402 HydrophobicContact CE1-CB 4.21Å; Y398-E402 HydrophobicContact CE1-CG 4.01Å; Y398-E402 VanDerWaalsContact CE1-OE1 3.3Å; Y398-E402 WeakPolarHBondContact CE1-OE1 3.49Å; Y398-E402 WeakPolarHBondContact O-CA 3.44Å; Y398-E402 WeakPolarHBondContact O-CB 3.31Å; Y398-E402 PolarHBondContact O-N 2.91Å; Y398-E402 PolarHBondContact OH-OE1 3.31Å; K399-E402 WeakPolarHBondContact CD-OE2 3.45Å; K399-E402 IonicContact NZ-OE1 3.01Å; K399-E402 PolarHBondContact NZ-OE1 3.34Å; K399-E402 IonicContact NZ-OE2 2.84Å; K399-E402 PolarHBondContact NZ-OE2 2.94Å; E402-D404 VanDerWaalsContact C-N 3.34Å; E402-D404 PolarHBondContact O-N 3.49Å; E402-F405 PolarHBondContact O-N 3.25Å; E402-V406 HydrophobicContact CG-CG2 4.24Å; E402-V406 WeakPolarHBondContact O-CB 3.28Å; E402-V406 VanDerWaalsContact O-CG2 3.32Å; E402-V406 WeakPolarHBondContact O-CG2 3.24Å; E402-V406 PolarHBondContact O-N 2.96Å
403	A	98.4	Very high	97.9	Very high	6 Å²	6	41.3 Å²	41.3	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-42.9	173.6	0	0	0	0	0	113	F142 F144 Y331 Y401 V406 L407	F142-A403 HydrophobicContact CZ-CB 4.49Å; F144-A403 HydrophobicContact CB-CB 3.94Å; F144-A403 HydrophobicContact CD1-CB 4.05Å; F144-A403 HydrophobicContact CD2-CB 4.11Å; F144-A403 HydrophobicContact CG-CB 3.78Å; Y331-A403 HydrophobicContact CD1-CB 3.51Å; Y331-A403 HydrophobicContact CE1-CB 3.76Å; Y331-A403 HydrophobicContact CG-CB 4.13Å; Y401-A403 PolarHBondContact O-N 2.9Å; A403-V406 PolarHBondContact O-N 3.43Å; A403-L407 HydrophobicContact CB-CD1 4.26Å; A403-L407 WeakPolarHBondContact O-CB 3.26Å; A403-L407 WeakPolarHBondContact O-CD1 3.48Å; A403-L407 WeakPolarHBondContact O-CG 3.31Å; A403-L407 PolarHBondContact O-N 3.48Å
404	D	98.6	Very high	97.7	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.011	21%	0.206	C	C	.	.	H	α-helix	trans	-70.4	-35.9	179.2	-70.1	-10.1	0	0	0	111.6	P252 Q329 V330 Y331 Y401 E402 F408	P252-D404 HydrophobicContact CB-CB 4.36Å; P252-D404 HydrophobicContact CG-CB 3.72Å; Q329-D404 VanDerWaalsContact CA-OD2 3.23Å; Q329-D404 WeakPolarHBondContact CA-OD2 3.29Å; Q329-D404 WeakPolarHBondContact CB-OD2 3.28Å; V330-D404 WeakPolarHBondContact CB-OD1 3.37Å; V330-D404 VanDerWaalsContact N-CG 3.28Å; V330-D404 PolarHBondContact N-OD1 3.49Å; V330-D404 PolarHBondContact N-OD2 2.92Å; Y331-D404 WeakPolarHBondContact CD1-OD1 3.47Å; Y331-D404 PolarHBondContact N-OD1 3.36Å; Y401-D404 PolarHBondContact O-N 2.95Å; E402-D404 VanDerWaalsContact C-N 3.34Å; E402-D404 PolarHBondContact O-N 3.49Å; D404-F408 VanDerWaalsContact O-CD2 3.3Å; D404-F408 WeakPolarHBondContact O-CD2 3.31Å
405	F	98.6	Very high	97.4	Very high	1 Å²	1	43.8 Å²	43.8	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-51.5	174.4	-83.1	-82.7	0	0	0	110.9	D251 P252 F253 Y398 Y401 E402 G409 Y410 P411 P413	D251-F405 WeakPolarHBondContact OD2-CE1 3.45Å; P252-F405 HydrophobicContact CB-CD2 3.99Å; P252-F405 HydrophobicContact CB-CE2 3.56Å; P252-F405 HydrophobicContact CB-CZ 3.89Å; P252-F405 HydrophobicContact CG-CD1 4.12Å; P252-F405 HydrophobicContact CG-CD2 3.63Å; P252-F405 HydrophobicContact CG-CE1 4.13Å; P252-F405 HydrophobicContact CG-CE2 3.65Å; P252-F405 HydrophobicContact CG-CG 3.86Å; P252-F405 HydrophobicContact CG-CZ 3.9Å; F253-F405 HydrophobicContact CB-CZ 4.4Å; F253-F405 AromaticContact CD1-CE2 3.89Å; F253-F405 HydrophobicContact CD1-CE2 3.89Å; F253-F405 AromaticContact CD1-CZ 3.88Å; F253-F405 HydrophobicContact CD1-CZ 3.88Å; F253-F405 HydrophobicContact CD2-CZ 4.45Å; F253-F405 AromaticContact CE1-CE2 3.93Å; F253-F405 HydrophobicContact CE1-CE2 3.93Å; F253-F405 HydrophobicContact CE1-CZ 4.24Å; F253-F405 HydrophobicContact CG-CE2 4.47Å; F253-F405 HydrophobicContact CG-CZ 4.01Å; Y398-F405 AromaticContact CD2-CD2 3.86Å; Y398-F405 HydrophobicContact CD2-CD2 3.86Å; Y398-F405 AromaticContact CD2-CE2 3.96Å; Y398-F405 HydrophobicContact CD2-CE2 3.96Å; Y398-F405 HydrophobicContact CD2-CG 4.39Å; Y398-F405 HydrophobicContact CE2-CB 4.22Å; Y398-F405 AromaticContact CE2-CD2 3.83Å; Y398-F405 HydrophobicContact CE2-CD2 3.83Å; Y398-F405 HydrophobicContact CE2-CE2 4.36Å; Y398-F405 AromaticContact CE2-CG 3.96Å; Y398-F405 HydrophobicContact CE2-CG 3.96Å; Y401-F405 PolarHBondContact O-N 2.74Å; E402-F405 PolarHBondContact O-N 3.25Å; F405-G409 PolarHBondContact O-N 3.36Å; F405-Y410 PolarHBondContact O-N 2.98Å; F405-P411 WeakPolarHBondContact CD1-O 3.37Å; F405-P413 HydrophobicContact CE1-CG 4.21Å; F405-P413 HydrophobicContact CZ-CG 4.08Å
406	V	98.2	Very high	97.2	Very high	26 Å²	26	38.3 Å²	38.3	16%	0.158	20%	0.202	C	C	.	.	H	α-helix	trans	-72	-50	-172	172.5	0	0	0	0	112	F136 F142 E402 A403 F408 G409	F136-V406 HydrophobicContact CB-CG1 4.13Å; F136-V406 HydrophobicContact CD1-CG1 3.2Å; F136-V406 HydrophobicContact CD2-CG1 3.65Å; F136-V406 HydrophobicContact CE1-CG1 3.32Å; F136-V406 HydrophobicContact CE2-CG1 3.76Å; F136-V406 HydrophobicContact CG-CG1 3.38Å; F136-V406 HydrophobicContact CZ-CG1 3.6Å; F142-V406 HydrophobicContact CD1-CG1 4.22Å; F142-V406 HydrophobicContact CE1-CB 4Å; F142-V406 HydrophobicContact CE1-CG1 3.71Å; F142-V406 HydrophobicContact CE2-CB 4.17Å; F142-V406 HydrophobicContact CE2-CG1 4.08Å; F142-V406 HydrophobicContact CE2-CG2 4.03Å; F142-V406 HydrophobicContact CZ-CB 3.56Å; F142-V406 HydrophobicContact CZ-CG1 3.64Å; F142-V406 HydrophobicContact CZ-CG2 3.87Å; E402-V406 HydrophobicContact CG-CG2 4.24Å; E402-V406 WeakPolarHBondContact O-CB 3.28Å; E402-V406 VanDerWaalsContact O-CG2 3.32Å; E402-V406 WeakPolarHBondContact O-CG2 3.24Å; E402-V406 PolarHBondContact O-N 2.96Å; A403-V406 PolarHBondContact O-N 3.43Å; V406-F408 PolarHBondContact O-N 2.99Å; V406-G409 PolarHBondContact O-N 3.1Å
407	L	98.4	Very high	97	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-28.8	-175.4	-69.8	168.6	0	0	0	113	L133 F136 F142 F144 P336 A403	L133-L407 HydrophobicContact CD1-CB 3.85Å; L133-L407 HydrophobicContact CD1-CD2 3.82Å; L133-L407 HydrophobicContact CD1-CG 4.33Å; F136-L407 HydrophobicContact CB-CD2 3.89Å; F142-L407 HydrophobicContact CE1-CD2 4.49Å; F142-L407 HydrophobicContact CE1-CG 4.41Å; F144-L407 HydrophobicContact CE1-CD1 4.05Å; F144-L407 HydrophobicContact CE1-CD2 4.15Å; F144-L407 HydrophobicContact CE1-CG 4.41Å; F144-L407 HydrophobicContact CE2-CD1 4.33Å; F144-L407 HydrophobicContact CZ-CD1 3.74Å; F144-L407 HydrophobicContact CZ-CD2 4.29Å; P336-L407 HydrophobicContact CG-CD1 4.11Å; A403-L407 HydrophobicContact CB-CD1 4.26Å; A403-L407 WeakPolarHBondContact O-CB 3.26Å; A403-L407 WeakPolarHBondContact O-CD1 3.48Å; A403-L407 WeakPolarHBondContact O-CG 3.31Å; A403-L407 PolarHBondContact O-N 3.48Å
408	F	98.4	Very high	96.6	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.044	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	12.9	-177.2	-59.6	-64.2	0	0	0	113.4	L247 V249 V330 P336 I344 K346 D404 V406 Y410	L247-F408 HydrophobicContact CD1-CE1 3.86Å; L247-F408 HydrophobicContact CD1-CZ 3.9Å; L247-F408 HydrophobicContact CD2-CE1 4.5Å; V249-F408 HydrophobicContact CB-CD1 4.49Å; V249-F408 HydrophobicContact CB-CG 4.28Å; V249-F408 HydrophobicContact CG1-CD1 3.8Å; V249-F408 HydrophobicContact CG1-CD2 3.97Å; V249-F408 HydrophobicContact CG1-CE1 3.82Å; V249-F408 HydrophobicContact CG1-CE2 4.02Å; V249-F408 HydrophobicContact CG1-CG 3.88Å; V249-F408 HydrophobicContact CG1-CZ 3.93Å; V249-F408 HydrophobicContact CG2-CB 4.08Å; V249-F408 HydrophobicContact CG2-CD1 4.15Å; V249-F408 HydrophobicContact CG2-CG 4.09Å; V330-F408 HydrophobicContact CB-CE2 3.78Å; V330-F408 HydrophobicContact CB-CZ 4.39Å; V330-F408 HydrophobicContact CG1-CD2 4.47Å; V330-F408 HydrophobicContact CG1-CE2 3.46Å; V330-F408 VanDerWaalsContact CG1-CE2 3.46Å; V330-F408 HydrophobicContact CG1-CZ 3.58Å; P336-F408 HydrophobicContact CB-CZ 4.26Å; P336-F408 HydrophobicContact CG-CZ 4.12Å; I344-F408 HydrophobicContact CG2-CD1 4.03Å; I344-F408 HydrophobicContact CG2-CE1 4.45Å; K346-F408 WeakPolarHBondContact CE-O 3.21Å; K346-F408 PolarHBondContact NZ-O 3.38Å; D404-F408 VanDerWaalsContact O-CD2 3.3Å; D404-F408 WeakPolarHBondContact O-CD2 3.31Å; V406-F408 PolarHBondContact O-N 2.99Å; F408-Y410 HydrophobicContact CB-CD2 3.82Å; F408-Y410 HydrophobicContact CB-CE2 3.63Å; F408-Y410 PolarHBondContact O-N 3.04Å
409	G	97.6	Very high	95.1	Very high	40 Å²	40	48.2 Å²	48.2	41%	0.412	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	43.9	174.7	0	0	0	0	0	112.9	K346 F405 V406	K346-G409 PolarHBondContact NZ-O 3.49Å; K346-G409 VanDerWaalsContact NZ-O 3.13Å; F405-G409 PolarHBondContact O-N 3.36Å; V406-G409 PolarHBondContact O-N 3.1Å
410	Y	97.7	Very high	95	Very high	22 Å²	22	44.3 Å²	44.3	9%	0.086	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-87.9	140.3	166.9	-70.6	-78.2	0	0	0	109.7	V249 R250 D251 K346 E348 F405 F408	V249-Y410 HydrophobicContact CB-CE2 4.39Å; V249-Y410 HydrophobicContact CG2-CE2 4.04Å; V249-Y410 WeakPolarHBondContact CG2-OH 3.29Å; R250-Y410 WeakPolarHBondContact CA-OH 3.4Å; R250-Y410 PolarHBondContact N-OH 3.41Å; R250-Y410 VanDerWaalsContact N-OH 3.16Å; D251-Y410 HydrophobicContact CB-CD1 4.01Å; D251-Y410 HydrophobicContact CB-CE1 4.06Å; D251-Y410 PolarHBondContact N-OH 2.8Å; K346-Y410 HydrophobicContact CD-CE1 4.13Å; E348-Y410 PolarHBondContact OE2-OH 3.39Å; F405-Y410 PolarHBondContact O-N 2.98Å; F408-Y410 HydrophobicContact CB-CD2 3.82Å; F408-Y410 HydrophobicContact CB-CE2 3.63Å; F408-Y410 PolarHBondContact O-N 3.04Å
411	P	95.9	Very high	94.8	Very high	104 Å²	104	44.5 Å²	44.5	68%	0.675	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-62.9	142.8	174.1	28.9	-33.9	0	0	0	109.5	F405	F405-P411 WeakPolarHBondContact CD1-O 3.37Å
412	K	96.4	Very high	94.6	Very high	92 Å²	92	47 Å²	47	40%	0.4	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-63.5	131.5	169	179	168.5	171.1	-125.4	0	108.6	Y398 E414 L417	Y398-K412 HydrophobicContact CD2-CG 4.39Å; Y398-K412 HydrophobicContact CE1-CD 4.06Å; Y398-K412 HydrophobicContact CE1-CG 4.42Å; Y398-K412 HydrophobicContact CE2-CB 4.27Å; Y398-K412 HydrophobicContact CE2-CD 4.18Å; Y398-K412 HydrophobicContact CE2-CG 3.71Å; K412-E414 WeakPolarHBondContact CD-OE1 3.26Å; K412-E414 VanDerWaalsContact CE-OE1 3.31Å; K412-E414 WeakPolarHBondContact CE-OE1 3.48Å; K412-E414 WeakPolarHBondContact CG-OE1 3.36Å; K412-E414 IonicContact NZ-OE1 3.92Å; K412-E414 PolarHBondContact NZ-OE1 3.39Å; K412-E414 PolarHBondContact O-N 3.01Å; K412-L417 HydrophobicContact CD-CD1 4.4Å; K412-L417 HydrophobicContact CG-CD1 3.86Å
413	P	94.7	Very high	94.4	Very high	9 Å²	9	46.9 Å²	46.9	6%	0.058	26%	0.255	C	S	.	.			trans	-77.5	72.2	-174.6	30.7	-35.4	0	0	0	110.9	F253 Y398 F405 N415 L416 L417	F253-P413 HydrophobicContact CD2-CG 4.22Å; F253-P413 HydrophobicContact CE2-CG 3.97Å; Y398-P413 HydrophobicContact CD2-CG 4.31Å; F405-P413 HydrophobicContact CE1-CG 4.21Å; F405-P413 HydrophobicContact CZ-CG 4.08Å; P413-N415 VanDerWaalsContact C-N 3.27Å; P413-N415 PolarHBondContact O-N 3.24Å; P413-L416 HydrophobicContact CB-CB 4.27Å; P413-L416 HydrophobicContact CB-CD1 4Å; P413-L416 HydrophobicContact CB-CG 4.23Å; P413-L416 PolarHBondContact O-N 3.12Å; P413-L417 HydrophobicContact CG-CD1 4.05Å; P413-L417 HydrophobicContact CG-CG 4.31Å; P413-L417 VanDerWaalsContact O-CG 3.26Å; P413-L417 WeakPolarHBondContact O-CG 3.33Å; P413-L417 PolarHBondContact O-N 3.39Å
414	E	94	Very high	94.1	Very high	67 Å²	67	49.5 Å²	49.5	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-35.5	-172.6	-71.4	-66.9	150.1	0	0	113.1	K412 L416 L417 K418	K412-E414 WeakPolarHBondContact CD-OE1 3.26Å; K412-E414 VanDerWaalsContact CE-OE1 3.31Å; K412-E414 WeakPolarHBondContact CE-OE1 3.48Å; K412-E414 WeakPolarHBondContact CG-OE1 3.36Å; K412-E414 IonicContact NZ-OE1 3.92Å; K412-E414 PolarHBondContact NZ-OE1 3.39Å; K412-E414 PolarHBondContact O-N 3.01Å; E414-L416 PolarHBondContact O-N 3.29Å; E414-L417 PolarHBondContact O-N 3.47Å; E414-L417 VanDerWaalsContact O-N 3.15Å; E414-K418 PolarHBondContact O-N 3.03Å; E414-K418 WeakPolarHBondContact OE2-CE 3.36Å; E414-K418 IonicContact OE2-NZ 3.84Å; E414-K418 PolarHBondContact OE2-NZ 3.46Å
415	N	91.6	Very high	93.8	Very high	89 Å²	89	52.7 Å²	52.7	48%	0.476	29%	0.285	S	S	.	.	H	α-helix	trans	-57.4	-34	172.7	57.4	-42.1	0	0	0	112.9	D383 P413	D383-N415 PolarHBondContact OD1-ND2 3.45Å; P413-N415 VanDerWaalsContact C-N 3.27Å; P413-N415 PolarHBondContact O-N 3.24Å
416	L	93.5	Very high	93.5	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-89.6	-10.2	-179.9	-56	-179.3	0	0	0	113.2	F253 E382 D383 F386 R394 P413 E414	F253-L416 HydrophobicContact CD2-CD1 3.78Å; F253-L416 HydrophobicContact CE2-CD1 4.15Å; E382-L416 HydrophobicContact CB-CD1 4.02Å; D383-L416 WeakPolarHBondContact OD1-CD2 3.4Å; F386-L416 HydrophobicContact CB-CD1 4.44Å; F386-L416 HydrophobicContact CB-CD2 4.04Å; F386-L416 HydrophobicContact CD2-CD1 4Å; F386-L416 HydrophobicContact CG-CD1 4.28Å; R394-L416 WeakPolarHBondContact CB-O 3.37Å; R394-L416 VanDerWaalsContact CD-O 3.28Å; R394-L416 WeakPolarHBondContact CD-O 3.26Å; R394-L416 VanDerWaalsContact CZ-O 3.25Å; R394-L416 PolarHBondContact NE-O 3.28Å; R394-L416 PolarHBondContact NH1-O 3.37Å; P413-L416 HydrophobicContact CB-CB 4.27Å; P413-L416 HydrophobicContact CB-CD1 4Å; P413-L416 HydrophobicContact CB-CG 4.23Å; P413-L416 PolarHBondContact O-N 3.12Å; E414-L416 PolarHBondContact O-N 3.29Å
417	L	94.4	Very high	93.1	Very high	9 Å²	9	58.7 Å²	58.7	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-113.6	1.5	-170.9	-61	179.7	0	0	0	113.5	R394 R395 Y398 K412 P413 E414	R394-L417 HydrophobicContact CB-CD2 4.13Å; R394-L417 WeakPolarHBondContact O-CD2 3.32Å; R395-L417 HydrophobicContact CG-CD2 4.03Å; R395-L417 PolarHBondContact NE-O 3.47Å; R395-L417 PolarHBondContact NH2-O 2.83Å; Y398-L417 HydrophobicContact CD1-CD1 4.12Å; Y398-L417 HydrophobicContact CD2-CD1 3.96Å; Y398-L417 HydrophobicContact CG-CD1 3.72Å; K412-L417 HydrophobicContact CD-CD1 4.4Å; K412-L417 HydrophobicContact CG-CD1 3.86Å; P413-L417 HydrophobicContact CG-CD1 4.05Å; P413-L417 HydrophobicContact CG-CG 4.31Å; P413-L417 VanDerWaalsContact O-CG 3.26Å; P413-L417 WeakPolarHBondContact O-CG 3.33Å; P413-L417 PolarHBondContact O-N 3.39Å; E414-L417 PolarHBondContact O-N 3.47Å; E414-L417 VanDerWaalsContact O-N 3.15Å
418	K	89.6	Confident	92.7	Very high	120 Å²	120	63.6 Å²	63.6	52%	0.522	34%	0.342	S	S	.	.			trans	-122.6	158.7	174.3	-69.6	169.9	170.7	155.5	0	109.9	E414	E414-K418 PolarHBondContact O-N 3.03Å; E414-K418 WeakPolarHBondContact OE2-CE 3.36Å; E414-K418 IonicContact OE2-NZ 3.84Å; E414-K418 PolarHBondContact OE2-NZ 3.46Å
419	D	67.9	Low	92.1	Very high	197 Å²	197	68.5 Å²	68.5	100%	1.053	37%	0.37	S	S	*	.			trans	-82.5	0	174.1	-72	-46.6	0	0	0	111.3	L391	L391-D419 VanDerWaalsContact CD2-CG 3.5Å; L391-D419 VanDerWaalsContact CD2-OD1 3.24Å; L391-D419 WeakPolarHBondContact CD2-OD1 3.49Å; L391-D419 VanDerWaalsContact CD2-OD2 3.3Å; L391-D419 WeakPolarHBondContact CD2-OD2 3.39Å

Retrieved 419 of 419 residues in 957.6 ms (Link to these results)

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