A0A087Y164_POEFO Loading...

Abhydrolase domain containing 15

AlphaFold DB , UniProt , Accession A0A087Y164, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 547 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	53.5	Low	60	Low	211 Å²	211	118.8 Å²	118.8	100%	1.039	63%	0.629	S	S	*	*				0	-38.2	0	-108.8	-171.5	-78.4	0	0	111.8	V5	M1-V5 WeakPolarHBondContact O-CG2 3.36Å; M1-V5 PolarHBondContact O-N 3.35Å
2	E	53.3	Low	60.5	Low	180 Å²	180	118 Å²	118	84%	0.841	62%	0.624	S	S	*	*	H	α-helix	trans	-65.3	-37.5	-178.5	-66.9	-173.2	151.7	0	0	115.4	Y4 V5 L6	E2-Y4 PolarHBondContact O-N 3.47Å; E2-V5 PolarHBondContact O-N 3.45Å; E2-L6 PolarHBondContact O-N 3.03Å
3	S	56.1	Low	61.3	Low	84 Å²	84	115.2 Å²	115.2	59%	0.587	61%	0.609	S	S	*	*	H	α-helix	trans	-69.2	-35.7	179.5	79.7	0	0	0	0	113	V5 L6 D7	S3-V5 VanDerWaalsContact C-N 3.32Å; S3-V5 PolarHBondContact O-N 3.39Å; S3-L6 PolarHBondContact O-N 2.92Å; S3-D7 PolarHBondContact O-N 3.23Å
4	Y	58.2	Low	61.9	Low	179 Å²	179	112.9 Å²	112.9	70%	0.702	60%	0.604	S	S	*	*	H	α-helix	trans	-69.9	-31.5	-178.8	-140.7	-91.9	0	0	0	112.1	E2 C8	E2-Y4 PolarHBondContact O-N 3.47Å; Y4-C8 WeakPolarHBondContact O-CB 3.45Å; Y4-C8 PolarHBondContact O-N 2.8Å; Y4-C8 PolarHBondContact O-SG 2.93Å; Y4-C8 VanDerWaalsContact O-SG 3.33Å
5	V	63.9	Low	62.6	Low	87 Å²	87	111.1 Å²	111.1	53%	0.527	60%	0.603	S	S	.	*	H	α-helix	trans	-72.7	-37.5	174.9	176	0	0	0	0	110.5	M1 E2 S3 L9	M1-V5 WeakPolarHBondContact O-CG2 3.36Å; M1-V5 PolarHBondContact O-N 3.35Å; E2-V5 PolarHBondContact O-N 3.45Å; S3-V5 VanDerWaalsContact C-N 3.32Å; S3-V5 PolarHBondContact O-N 3.39Å; V5-L9 HydrophobicContact CG1-CD1 4.05Å; V5-L9 WeakPolarHBondContact O-CB 3.42Å; V5-L9 VanDerWaalsContact O-CG 3.28Å; V5-L9 WeakPolarHBondContact O-CG 3.25Å; V5-L9 PolarHBondContact O-N 3.38Å
6	L	61.3	Low	63.1	Low	106 Å²	106	107.6 Å²	107.6	56%	0.555	59%	0.589	S	S	*	*	H	α-helix	trans	-68	-41.9	177.6	-161	74.9	0	0	0	112.3	E2 S3 L9 L10	E2-L6 PolarHBondContact O-N 3.03Å; S3-L6 PolarHBondContact O-N 2.92Å; L6-L9 PolarHBondContact O-N 3.49Å; L6-L10 HydrophobicContact CG-CD1 4.47Å; L6-L10 WeakPolarHBondContact O-CG 3.42Å; L6-L10 PolarHBondContact O-N 3.41Å
7	D	63.2	Low	63.6	Low	94 Å²	94	107.5 Å²	107.5	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-66.4	-38.7	176.5	-70.3	-29.1	0	0	0	111.9	S3 L10 C11	S3-D7 PolarHBondContact O-N 3.23Å; D7-L10 PolarHBondContact O-N 3.48Å; D7-C11 WeakPolarHBondContact O-CB 3.35Å; D7-C11 PolarHBondContact O-N 3.13Å; D7-C11 PolarHBondContact O-SG 2.97Å
8	C	58.6	Low	64	Low	64 Å²	64	109.4 Å²	109.4	43%	0.432	59%	0.589	S	S	.	*	H	α-helix	trans	-65.5	-38.1	172.5	-77.4	0	0	0	0	112.6	Y4 C11 L12	Y4-C8 WeakPolarHBondContact O-CB 3.45Å; Y4-C8 PolarHBondContact O-N 2.8Å; Y4-C8 PolarHBondContact O-SG 2.93Å; Y4-C8 VanDerWaalsContact O-SG 3.33Å; C8-C11 PolarHBondContact O-N 3.4Å; C8-L12 WeakPolarHBondContact O-CG 3.46Å; C8-L12 PolarHBondContact O-N 3.35Å
9	L	59.9	Low	64.6	Low	103 Å²	103	110.7 Å²	110.7	54%	0.539	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-39	175.3	-77.6	165.7	0	0	0	112	V5 L6 L12 L13	V5-L9 HydrophobicContact CG1-CD1 4.05Å; V5-L9 WeakPolarHBondContact O-CB 3.42Å; V5-L9 VanDerWaalsContact O-CG 3.28Å; V5-L9 WeakPolarHBondContact O-CG 3.25Å; V5-L9 PolarHBondContact O-N 3.38Å; L6-L9 PolarHBondContact O-N 3.49Å; L9-L12 PolarHBondContact O-N 2.88Å; L9-L13 PolarHBondContact O-N 3.22Å
10	L	67.1	Low	65	Low	100 Å²	100	110.7 Å²	110.7	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-66.9	-36	174.9	-75.9	162.8	0	0	0	112.4	L6 D7 L12 L13	L6-L10 HydrophobicContact CG-CD1 4.47Å; L6-L10 WeakPolarHBondContact O-CG 3.42Å; L6-L10 PolarHBondContact O-N 3.41Å; D7-L10 PolarHBondContact O-N 3.48Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L13 HydrophobicContact CD2-CD1 4.04Å; L10-L13 VanDerWaalsContact O-CB 3.32Å; L10-L13 WeakPolarHBondContact O-CB 3.19Å; L10-L13 PolarHBondContact O-N 2.88Å
11	C	65.4	Low	65.2	Low	99 Å²	99	109.9 Å²	109.9	67%	0.669	58%	0.584	S	S	*	*	H	α-helix	trans	-70	-26.3	174.8	-79	0	0	0	0	113.9	D7 C8 P14	D7-C11 WeakPolarHBondContact O-CB 3.35Å; D7-C11 PolarHBondContact O-N 3.13Å; D7-C11 PolarHBondContact O-SG 2.97Å; C8-C11 PolarHBondContact O-N 3.4Å; C11-P14 WeakPolarHBondContact O-CD 3.36Å
12	L	66.1	Low	65.9	Low	109 Å²	109	102.2 Å²	102.2	57%	0.571	55%	0.55	S	S	*	*	H	α-helix	trans	-87.4	-14.5	177.6	-69.5	170.1	0	0	0	113.4	C8 L9 L10 C15 S16	C8-L12 WeakPolarHBondContact O-CG 3.46Å; C8-L12 PolarHBondContact O-N 3.35Å; L9-L12 PolarHBondContact O-N 2.88Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L12-C15 PolarHBondContact O-N 3.43Å; L12-S16 PolarHBondContact O-N 3.47Å; L12-S16 PolarHBondContact O-OG 2.89Å
13	L	71	Confident	66.6	Low	81 Å²	81	97.6 Å²	97.6	42%	0.424	53%	0.531	S	S	.	.	H	α-helix	trans	-57.3	-43.3	-179.1	-130.7	156.1	0	0	0	114.5	L9 L10 S16 L17	L9-L13 PolarHBondContact O-N 3.22Å; L10-L13 HydrophobicContact CD2-CD1 4.04Å; L10-L13 VanDerWaalsContact O-CB 3.32Å; L10-L13 WeakPolarHBondContact O-CB 3.19Å; L10-L13 PolarHBondContact O-N 2.88Å; L13-S16 WeakPolarHBondContact CA-OG 3.29Å; L13-S16 PolarHBondContact O-N 3.46Å; L13-S16 PolarHBondContact O-OG 2.97Å; L13-L17 HydrophobicContact CD2-CD1 3.6Å; L13-L17 HydrophobicContact CD2-CG 4.37Å; L13-L17 VanDerWaalsContact O-CB 3.32Å; L13-L17 WeakPolarHBondContact O-CB 3.35Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 PolarHBondContact O-N 2.88Å
14	P	69.9	Low	67	Low	84 Å²	84	94.2 Å²	94.2	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-68	-36.7	175.7	6.5	-2.8	0	0	0	112.6	C11 F18	C11-P14 WeakPolarHBondContact O-CD 3.36Å; P14-F18 WeakPolarHBondContact O-CB 3.35Å; P14-F18 PolarHBondContact O-N 2.9Å
15	C	71.2	Confident	67.3	Low	86 Å²	86	90.5 Å²	90.5	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-69.3	-38.8	177.4	-66.7	0	0	0	0	111.8	L12 F19	L12-C15 PolarHBondContact O-N 3.43Å; C15-F19 WeakPolarHBondContact O-CB 3.44Å; C15-F19 PolarHBondContact O-N 3.05Å
16	S	71.2	Confident	67.5	Low	55 Å²	55	96.7 Å²	96.7	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-71.3	-38.4	175.8	63.6	0	0	0	0	112.1	L12 L13 F19 L20	L12-S16 PolarHBondContact O-N 3.47Å; L12-S16 PolarHBondContact O-OG 2.89Å; L13-S16 WeakPolarHBondContact CA-OG 3.29Å; L13-S16 PolarHBondContact O-N 3.46Å; L13-S16 PolarHBondContact O-OG 2.97Å; S16-F19 PolarHBondContact O-N 3.3Å; S16-L20 WeakPolarHBondContact O-CB 3.45Å; S16-L20 VanDerWaalsContact O-CG 3.24Å; S16-L20 WeakPolarHBondContact O-CG 3.41Å; S16-L20 PolarHBondContact O-N 3.28Å
17	L	71.4	Confident	68.1	Low	106 Å²	106	100.3 Å²	100.3	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-60.1	-45.4	170.8	-91.1	155.8	0	0	0	112.1	L13 L20 L21	L13-L17 HydrophobicContact CD2-CD1 3.6Å; L13-L17 HydrophobicContact CD2-CG 4.37Å; L13-L17 VanDerWaalsContact O-CB 3.32Å; L13-L17 WeakPolarHBondContact O-CB 3.35Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 PolarHBondContact O-N 2.88Å; L17-L20 PolarHBondContact O-N 3.1Å; L17-L21 WeakPolarHBondContact O-CB 3.49Å; L17-L21 PolarHBondContact O-N 2.99Å
18	F	70.9	Confident	68.4	Low	141 Å²	141	100.9 Å²	100.9	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-65	-38.8	177.2	-174.9	-100	0	0	0	112.3	P14 L21 C22	P14-F18 WeakPolarHBondContact O-CB 3.35Å; P14-F18 PolarHBondContact O-N 2.9Å; F18-L21 PolarHBondContact O-N 2.93Å; F18-C22 WeakPolarHBondContact O-CB 3.44Å; F18-C22 PolarHBondContact O-N 3.3Å; F18-C22 PolarHBondContact O-SG 3.33Å
19	F	74.4	Confident	69.1	Low	134 Å²	134	99.6 Å²	99.6	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-66.8	-41.9	175.5	-175.3	-104.7	0	0	0	112.2	C15 S16 C22 L23	C15-F19 WeakPolarHBondContact O-CB 3.44Å; C15-F19 PolarHBondContact O-N 3.05Å; S16-F19 PolarHBondContact O-N 3.3Å; F19-C22 PolarHBondContact O-N 3.29Å; F19-L23 HydrophobicContact CD1-CD1 3.7Å; F19-L23 HydrophobicContact CD1-CG 4.5Å; F19-L23 HydrophobicContact CE1-CD1 3.35Å; F19-L23 HydrophobicContact CE1-CG 4.22Å; F19-L23 HydrophobicContact CZ-CD1 3.92Å; F19-L23 HydrophobicContact CZ-CG 4.4Å; F19-L23 WeakPolarHBondContact O-CG 3.34Å; F19-L23 PolarHBondContact O-N 3.36Å
20	L	73.1	Confident	69.8	Low	111 Å²	111	98.8 Å²	98.8	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-37.2	174.3	-71.5	171.2	0	0	0	112.1	S16 L17 L23 G24	S16-L20 WeakPolarHBondContact O-CB 3.45Å; S16-L20 VanDerWaalsContact O-CG 3.24Å; S16-L20 WeakPolarHBondContact O-CG 3.41Å; S16-L20 PolarHBondContact O-N 3.28Å; L17-L20 PolarHBondContact O-N 3.1Å; L20-L23 PolarHBondContact O-N 2.98Å; L20-G24 PolarHBondContact O-N 3.16Å
21	L	69.8	Low	69.7	Low	94 Å²	94	95.7 Å²	95.7	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-45.8	172.4	-168.1	92.2	0	0	0	111	L17 F18 L23 G24 L25	L17-L21 WeakPolarHBondContact O-CB 3.49Å; L17-L21 PolarHBondContact O-N 2.99Å; F18-L21 PolarHBondContact O-N 2.93Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.34Å; L21-G24 PolarHBondContact O-N 3Å; L21-L25 HydrophobicContact CD2-CD1 4.34Å; L21-L25 HydrophobicContact CG-CD1 4.32Å; L21-L25 WeakPolarHBondContact O-CG 3.28Å; L21-L25 PolarHBondContact O-N 2.89Å
22	C	67.1	Low	70	Confident	49 Å²	49	94.1 Å²	94.1	33%	0.331	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-37.2	176.1	-71.7	0	0	0	0	112.7	F18 F19 R26	F18-C22 WeakPolarHBondContact O-CB 3.44Å; F18-C22 PolarHBondContact O-N 3.3Å; F18-C22 PolarHBondContact O-SG 3.33Å; F19-C22 PolarHBondContact O-N 3.29Å; C22-R26 PolarHBondContact O-N 2.99Å
23	L	69.3	Low	70.6	Confident	84 Å²	84	98.6 Å²	98.6	44%	0.44	51%	0.505	S	S	.	.	H	α-helix	trans	-69.8	-39.8	174	-78.4	169.8	0	0	0	111.9	F19 L20 L21 R26 W27	F19-L23 HydrophobicContact CD1-CD1 3.7Å; F19-L23 HydrophobicContact CD1-CG 4.5Å; F19-L23 HydrophobicContact CE1-CD1 3.35Å; F19-L23 HydrophobicContact CE1-CG 4.22Å; F19-L23 HydrophobicContact CZ-CD1 3.92Å; F19-L23 HydrophobicContact CZ-CG 4.4Å; F19-L23 WeakPolarHBondContact O-CG 3.34Å; F19-L23 PolarHBondContact O-N 3.36Å; L20-L23 PolarHBondContact O-N 2.98Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.34Å; L23-R26 PolarHBondContact O-N 3.16Å; L23-W27 PolarHBondContact O-N 3.27Å
24	G	63.4	Low	70.7	Confident	12 Å²	12	97.7 Å²	97.7	12%	0.124	50%	0.503	C	S	.	.	H	α-helix	trans	-61.3	-45.3	173.7	0	0	0	0	0	112.1	L20 L21 R26 W27 F30	L20-G24 PolarHBondContact O-N 3.16Å; L21-G24 PolarHBondContact O-N 3Å; G24-R26 PolarHBondContact O-N 3.02Å; G24-R26 VanDerWaalsContact O-N 3.15Å; G24-W27 WeakPolarHBondContact O-CB 3.33Å; G24-W27 PolarHBondContact O-N 3.44Å; G24-F30 WeakPolarHBondContact O-CB 3.5Å; G24-F30 VanDerWaalsContact O-CD1 3.22Å; G24-F30 WeakPolarHBondContact O-CD1 3.48Å
25	L	64.6	Low	70.8	Confident	102 Å²	102	99.2 Å²	99.2	53%	0.534	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.2	177.7	-71.2	170.1	0	0	0	114.1	L21 C31	L21-L25 HydrophobicContact CD2-CD1 4.34Å; L21-L25 HydrophobicContact CG-CD1 4.32Å; L21-L25 WeakPolarHBondContact O-CG 3.28Å; L21-L25 PolarHBondContact O-N 2.89Å; L25-C31 VanDerWaalsContact C-SG 3.57Å; L25-C31 PolarHBondContact O-SG 2.97Å
26	R	68.3	Low	71.1	Confident	216 Å²	216	99.9 Å²	99.9	82%	0.815	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-10	171.3	-74.1	-177.4	175	-166.1	-0.8	113.3	C22 L23 G24 P28	C22-R26 PolarHBondContact O-N 2.99Å; L23-R26 PolarHBondContact O-N 3.16Å; G24-R26 PolarHBondContact O-N 3.02Å; G24-R26 VanDerWaalsContact O-N 3.15Å; R26-P28 WeakPolarHBondContact O-CD 3.22Å
27	W	74.5	Confident	71.3	Confident	183 Å²	183	99.8 Å²	99.8	69%	0.693	51%	0.51	S	S	*	.			trans	-93.6	113	179.3	-165.6	-23.2	0	0	0	109.7	L23 G24 G29 F30 C31	L23-W27 PolarHBondContact O-N 3.27Å; G24-W27 WeakPolarHBondContact O-CB 3.33Å; G24-W27 PolarHBondContact O-N 3.44Å; W27-G29 PolarHBondContact O-N 3.03Å; W27-G29 VanDerWaalsContact O-N 3.11Å; W27-F30 HydrophobicContact CB-CB 4.04Å; W27-F30 HydrophobicContact CG-CB 4.48Å; W27-F30 PolarHBondContact O-N 3.05Å; W27-C31 PolarHBondContact O-N 2.92Å
28	P	70.2	Confident	71.4	Confident	106 Å²	106	97.6 Å²	97.6	69%	0.688	51%	0.507	S	S	*	.	H	α-helix	trans	-54	-36	-178.9	-26.1	33.4	0	0	0	113.9	R26 S32	R26-P28 WeakPolarHBondContact O-CD 3.22Å; P28-S32 VanDerWaalsContact O-CB 3.26Å; P28-S32 WeakPolarHBondContact O-CB 3.39Å; P28-S32 PolarHBondContact O-N 3.01Å
29	G	72.5	Confident	71.6	Confident	36 Å²	36	92 Å²	92	37%	0.371	49%	0.49	S	S	.	.	H	α-helix	trans	-68.9	-36.6	176.7	0	0	0	0	0	114.3	W27 W33	W27-G29 PolarHBondContact O-N 3.03Å; W27-G29 VanDerWaalsContact O-N 3.11Å; G29-W33 WeakPolarHBondContact O-CB 3.41Å; G29-W33 PolarHBondContact O-N 3.47Å
30	F	73.4	Confident	71.8	Confident	87 Å²	87	88 Å²	88	38%	0.382	48%	0.481	S	S	.	.	H	α-helix	trans	-72.9	-42.1	174.6	-179.4	-95.2	0	0	0	110.9	G24 W27 S32 W33 V34	G24-F30 WeakPolarHBondContact O-CB 3.5Å; G24-F30 VanDerWaalsContact O-CD1 3.22Å; G24-F30 WeakPolarHBondContact O-CD1 3.48Å; W27-F30 HydrophobicContact CB-CB 4.04Å; W27-F30 HydrophobicContact CG-CB 4.48Å; W27-F30 PolarHBondContact O-N 3.05Å; F30-S32 VanDerWaalsContact C-N 3.33Å; F30-S32 PolarHBondContact O-N 3.29Å; F30-W33 PolarHBondContact O-N 3.39Å; F30-V34 HydrophobicContact CD1-CG2 3.9Å; F30-V34 HydrophobicContact CE1-CG2 3.57Å; F30-V34 HydrophobicContact CE2-CG2 4.32Å; F30-V34 HydrophobicContact CG-CG2 4.44Å; F30-V34 HydrophobicContact CZ-CG2 3.8Å; F30-V34 WeakPolarHBondContact O-CB 3.29Å; F30-V34 VanDerWaalsContact O-CG2 3.3Å; F30-V34 WeakPolarHBondContact O-CG2 3.49Å; F30-V34 PolarHBondContact O-N 2.95Å
31	C	66.7	Low	72	Confident	34 Å²	34	85.7 Å²	85.7	23%	0.23	48%	0.478	C	S	.	.	H	α-helix	trans	-60.2	-42.2	173	-66.8	0	0	0	0	112.1	L25 W27 V34 N35	L25-C31 VanDerWaalsContact C-SG 3.57Å; L25-C31 PolarHBondContact O-SG 2.97Å; W27-C31 PolarHBondContact O-N 2.92Å; C31-V34 PolarHBondContact O-N 3.1Å; C31-N35 WeakPolarHBondContact O-CB 3.21Å; C31-N35 PolarHBondContact O-N 3.19Å; C31-N35 PolarHBondContact O-ND2 3.06Å
32	S	70.6	Confident	72.5	Confident	67 Å²	67	82.8 Å²	82.8	47%	0.469	47%	0.471	S	S	.	.	H	α-helix	trans	-60.4	-46.8	173.6	-179.9	0	0	0	0	111.5	P28 F30 V34 N35 V36	P28-S32 VanDerWaalsContact O-CB 3.26Å; P28-S32 WeakPolarHBondContact O-CB 3.39Å; P28-S32 PolarHBondContact O-N 3.01Å; F30-S32 VanDerWaalsContact C-N 3.33Å; F30-S32 PolarHBondContact O-N 3.29Å; S32-V34 PolarHBondContact O-N 3.23Å; S32-N35 PolarHBondContact O-N 3.34Å; S32-V36 VanDerWaalsContact O-CG2 3.27Å; S32-V36 WeakPolarHBondContact O-CG2 3.12Å; S32-V36 PolarHBondContact O-N 3.14Å
33	W	78.1	Confident	73.2	Confident	203 Å²	203	84.1 Å²	84.1	77%	0.769	47%	0.47	S	S	*	.	H	α-helix	trans	-61	-43.1	175.1	-104	83.7	0	0	0	113.4	G29 F30 V36 A37	G29-W33 WeakPolarHBondContact O-CB 3.41Å; G29-W33 PolarHBondContact O-N 3.47Å; F30-W33 PolarHBondContact O-N 3.39Å; W33-V36 PolarHBondContact O-N 3.5Å; W33-A37 VanDerWaalsContact O-CB 3.28Å; W33-A37 WeakPolarHBondContact O-CB 3.31Å; W33-A37 PolarHBondContact O-N 3.3Å
34	V	73.7	Confident	73.8	Confident	62 Å²	62	87.8 Å²	87.8	38%	0.376	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-42.5	177	169.6	0	0	0	0	110.5	F30 C31 S32 A37 A38	F30-V34 HydrophobicContact CD1-CG2 3.9Å; F30-V34 HydrophobicContact CE1-CG2 3.57Å; F30-V34 HydrophobicContact CE2-CG2 4.32Å; F30-V34 HydrophobicContact CG-CG2 4.44Å; F30-V34 HydrophobicContact CZ-CG2 3.8Å; F30-V34 WeakPolarHBondContact O-CB 3.29Å; F30-V34 VanDerWaalsContact O-CG2 3.3Å; F30-V34 WeakPolarHBondContact O-CG2 3.49Å; F30-V34 PolarHBondContact O-N 2.95Å; C31-V34 PolarHBondContact O-N 3.1Å; S32-V34 PolarHBondContact O-N 3.23Å; V34-A37 PolarHBondContact O-N 2.83Å; V34-A38 WeakPolarHBondContact O-CB 3.44Å; V34-A38 PolarHBondContact O-N 3.16Å
35	N	71.5	Confident	74.8	Confident	115 Å²	115	92.6 Å²	92.6	62%	0.615	50%	0.504	S	S	*	.	H	α-helix	trans	-64.5	-42.1	176.6	-72.6	-15.8	0	0	0	111.8	C31 S32 G39	C31-N35 WeakPolarHBondContact O-CB 3.21Å; C31-N35 PolarHBondContact O-N 3.19Å; C31-N35 PolarHBondContact O-ND2 3.06Å; S32-N35 PolarHBondContact O-N 3.34Å; N35-G39 PolarHBondContact O-N 3.44Å
36	V	77.3	Confident	75.7	Confident	101 Å²	101	90.6 Å²	90.6	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-64.6	-44.2	175.6	171.5	0	0	0	0	111.1	S32 W33 G39 A40	S32-V36 VanDerWaalsContact O-CG2 3.27Å; S32-V36 WeakPolarHBondContact O-CG2 3.12Å; S32-V36 PolarHBondContact O-N 3.14Å; W33-V36 PolarHBondContact O-N 3.5Å; V36-G39 PolarHBondContact O-N 3.24Å; V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.1Å
37	A	76.2	Confident	76.4	Confident	53 Å²	53	81.9 Å²	81.9	44%	0.438	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-42.5	178.9	0	0	0	0	0	112.3	W33 V34 A40 A41	W33-A37 VanDerWaalsContact O-CB 3.28Å; W33-A37 WeakPolarHBondContact O-CB 3.31Å; W33-A37 PolarHBondContact O-N 3.3Å; V34-A37 PolarHBondContact O-N 2.83Å; A37-A40 PolarHBondContact O-N 3.07Å; A37-A41 WeakPolarHBondContact O-CB 3.26Å; A37-A41 PolarHBondContact O-N 3.33Å
38	A	73.9	Confident	76.6	Confident	59 Å²	59	76.4 Å²	76.4	49%	0.488	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-42.8	174.9	0	0	0	0	0	111.1	V34 A41 G42	V34-A38 WeakPolarHBondContact O-CB 3.44Å; V34-A38 PolarHBondContact O-N 3.16Å; A38-A41 PolarHBondContact O-N 2.97Å; A38-G42 PolarHBondContact O-N 3Å
39	G	75.8	Confident	77.2	Confident	25 Å²	25	73.6 Å²	73.6	26%	0.258	43%	0.428	S	S	.	.	H	α-helix	trans	-59.8	-50	172.7	0	0	0	0	0	111.8	N35 V36 A41 G42 W43	N35-G39 PolarHBondContact O-N 3.44Å; V36-G39 PolarHBondContact O-N 3.24Å; G39-A41 VanDerWaalsContact C-N 3.34Å; G39-A41 PolarHBondContact O-N 3.04Å; G39-G42 PolarHBondContact O-N 2.99Å; G39-W43 PolarHBondContact O-N 3.5Å
40	A	77.9	Confident	77.7	Confident	49 Å²	49	72 Å²	72	41%	0.405	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-38.9	178.2	0	0	0	0	0	113	V36 A37 K44	V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.1Å; A37-A40 PolarHBondContact O-N 3.07Å; A40-K44 WeakPolarHBondContact O-CG 3.4Å; A40-K44 PolarHBondContact O-N 3.43Å
41	A	77.1	Confident	78.1	Confident	62 Å²	62	73.1 Å²	73.1	51%	0.512	42%	0.421	S	S	.	.	H	α-helix	trans	-67.5	-42.9	174.4	0	0	0	0	0	111.8	A37 A38 G39 W43 K44 L45	A37-A41 WeakPolarHBondContact O-CB 3.26Å; A37-A41 PolarHBondContact O-N 3.33Å; A38-A41 PolarHBondContact O-N 2.97Å; G39-A41 VanDerWaalsContact C-N 3.34Å; G39-A41 PolarHBondContact O-N 3.04Å; A41-W43 VanDerWaalsContact C-N 3.32Å; A41-W43 PolarHBondContact O-N 3.49Å; A41-K44 PolarHBondContact O-N 3.24Å; A41-L45 WeakPolarHBondContact O-CB 3.41Å; A41-L45 PolarHBondContact O-N 2.87Å
42	G	80.3	Confident	78.7	Confident	34 Å²	34	77.8 Å²	77.8	35%	0.351	44%	0.442	S	S	.	.	H	α-helix	trans	-59.2	-41.4	173.6	0	0	0	0	0	112.3	A38 G39 L45 W46	A38-G42 PolarHBondContact O-N 3Å; G39-G42 PolarHBondContact O-N 2.99Å; G42-L45 WeakPolarHBondContact O-CB 2.97Å; G42-L45 PolarHBondContact O-N 3.43Å; G42-W46 PolarHBondContact O-N 3.17Å
43	W	81.3	Confident	79.1	Confident	77 Å²	77	77.8 Å²	77.8	29%	0.292	44%	0.436	S	S	.	.	H	α-helix	trans	-68.6	-41.4	176.9	-59.6	146	0	0	0	113.4	G39 A41 L45 W46 V47 P107 W108 L113	G39-W43 PolarHBondContact O-N 3.5Å; A41-W43 VanDerWaalsContact C-N 3.32Å; A41-W43 PolarHBondContact O-N 3.49Å; W43-L45 VanDerWaalsContact C-N 3.25Å; W43-L45 PolarHBondContact O-N 3.27Å; W43-W46 HydrophobicContact CE3-CB 4.42Å; W43-W46 PolarHBondContact O-N 3.27Å; W43-V47 WeakPolarHBondContact O-CG2 3.49Å; W43-V47 PolarHBondContact O-N 2.55Å; W43-P107 HydrophobicContact CD2-CB 4.23Å; W43-P107 HydrophobicContact CD2-CG 4.3Å; W43-P107 HydrophobicContact CZ2-CB 4.44Å; W43-P107 HydrophobicContact CZ2-CG 3.97Å; W43-W108 HydrophobicContact CH2-CE3 4.22Å; W43-W108 AromaticContact CH2-CH2 3.77Å; W43-W108 HydrophobicContact CH2-CH2 3.77Å; W43-W108 HydrophobicContact CH2-CZ2 4.17Å; W43-W108 AromaticContact CH2-CZ3 3.8Å; W43-W108 HydrophobicContact CH2-CZ3 3.8Å; W43-W108 AromaticContact CZ2-CH2 3.78Å; W43-W108 HydrophobicContact CZ2-CH2 3.78Å; W43-W108 AromaticContact CZ2-CZ2 3.71Å; W43-W108 HydrophobicContact CZ2-CZ2 3.71Å; W43-W108 HydrophobicContact CZ2-CZ3 4.19Å; W43-L113 HydrophobicContact CH2-CD2 4.22Å; W43-L113 HydrophobicContact CZ3-CD2 4.15Å
44	K	81.8	Confident	79.2	Confident	160 Å²	160	74.2 Å²	74.2	70%	0.696	43%	0.432	S	S	*	.	H	α-helix	trans	-59.9	-40.2	172	-74.5	-176.4	-178.9	-175	0	111.3	A40 A41 T48	A40-K44 WeakPolarHBondContact O-CG 3.4Å; A40-K44 PolarHBondContact O-N 3.43Å; A41-K44 PolarHBondContact O-N 3.24Å; K44-T48 VanDerWaalsContact O-CG2 3.31Å; K44-T48 WeakPolarHBondContact O-CG2 3.32Å; K44-T48 PolarHBondContact O-N 2.96Å; K44-T48 PolarHBondContact O-OG1 2.9Å; K44-T48 VanDerWaalsContact O-OG1 3.11Å
45	L	84.3	Confident	79.5	Confident	113 Å²	113	71.8 Å²	71.8	59%	0.592	42%	0.417	S	S	*	.	H	α-helix	trans	-66.2	-39.9	175.7	-176.3	66.7	0	0	0	112.4	A41 G42 W43 T48 T49	A41-L45 WeakPolarHBondContact O-CB 3.41Å; A41-L45 PolarHBondContact O-N 2.87Å; G42-L45 WeakPolarHBondContact O-CB 2.97Å; G42-L45 PolarHBondContact O-N 3.43Å; W43-L45 VanDerWaalsContact C-N 3.25Å; W43-L45 PolarHBondContact O-N 3.27Å; L45-T48 WeakPolarHBondContact CA-OG1 3.19Å; L45-T48 PolarHBondContact O-OG1 2.97Å; L45-T49 VanDerWaalsContact O-CB 3.3Å; L45-T49 WeakPolarHBondContact O-CB 3.25Å; L45-T49 PolarHBondContact O-N 3.22Å; L45-T49 PolarHBondContact O-OG1 2.94Å
46	W	84	Confident	79.7	Confident	60 Å²	60	70.1 Å²	70.1	23%	0.227	41%	0.413	C	S	.	.	H	α-helix	trans	-63.7	-47.6	176.5	-179.2	-111.4	0	0	0	111.7	G42 W43 T48 T49 C50 D110 H112 L113	G42-W46 PolarHBondContact O-N 3.17Å; W43-W46 HydrophobicContact CE3-CB 4.42Å; W43-W46 PolarHBondContact O-N 3.27Å; W46-T48 PolarHBondContact O-N 3.32Å; W46-T49 WeakPolarHBondContact O-CB 3.31Å; W46-T49 PolarHBondContact O-N 3.44Å; W46-C50 PolarHBondContact O-N 3.36Å; W46-C50 PolarHBondContact O-SG 3.33Å; W46-D110 PolarHBondContact NE1-OD1 3.36Å; W46-H112 HydrophobicContact CZ2-CB 3.87Å; W46-L113 HydrophobicContact CZ2-CB 4.17Å
47	V	82.9	Confident	79.2	Confident	34 Å²	34	66.7 Å²	66.7	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-46.4	177.4	168.8	0	0	0	0	110.9	W43 T49 C50 L51 L57 W106	W43-V47 WeakPolarHBondContact O-CG2 3.49Å; W43-V47 PolarHBondContact O-N 2.55Å; V47-T49 VanDerWaalsContact C-N 3.29Å; V47-T49 PolarHBondContact O-N 2.92Å; V47-C50 PolarHBondContact O-N 2.9Å; V47-L51 HydrophobicContact CG1-CD1 4.13Å; V47-L51 WeakPolarHBondContact O-CG 3.45Å; V47-L51 PolarHBondContact O-N 3.26Å; V47-L57 HydrophobicContact CB-CD1 4.42Å; V47-L57 HydrophobicContact CG1-CD1 3.85Å; V47-W106 HydrophobicContact CG2-CZ2 4.12Å
48	T	80.1	Confident	78.4	Confident	67 Å²	67	69.3 Å²	69.3	41%	0.411	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-37.6	176.4	54.5	0	0	0	0	111.8	K44 L45 W46 L51 I52	K44-T48 VanDerWaalsContact O-CG2 3.31Å; K44-T48 WeakPolarHBondContact O-CG2 3.32Å; K44-T48 PolarHBondContact O-N 2.96Å; K44-T48 PolarHBondContact O-OG1 2.9Å; K44-T48 VanDerWaalsContact O-OG1 3.11Å; L45-T48 WeakPolarHBondContact CA-OG1 3.19Å; L45-T48 PolarHBondContact O-OG1 2.97Å; W46-T48 PolarHBondContact O-N 3.32Å; T48-L51 PolarHBondContact O-N 3.06Å; T48-I52 WeakPolarHBondContact O-CB 3.23Å; T48-I52 WeakPolarHBondContact O-CD1 3.16Å; T48-I52 WeakPolarHBondContact O-CG1 3.44Å; T48-I52 PolarHBondContact O-N 3.39Å
49	T	82.1	Confident	77.1	Confident	48 Å²	48	72.6 Å²	72.6	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-44.7	175.5	-58.4	0	0	0	0	111.4	L45 W46 V47 L51 I52 L53	L45-T49 VanDerWaalsContact O-CB 3.3Å; L45-T49 WeakPolarHBondContact O-CB 3.25Å; L45-T49 PolarHBondContact O-N 3.22Å; L45-T49 PolarHBondContact O-OG1 2.94Å; W46-T49 WeakPolarHBondContact O-CB 3.31Å; W46-T49 PolarHBondContact O-N 3.44Å; V47-T49 VanDerWaalsContact C-N 3.29Å; V47-T49 PolarHBondContact O-N 2.92Å; T49-L51 VanDerWaalsContact C-N 3.35Å; T49-L51 PolarHBondContact O-N 3.38Å; T49-I52 PolarHBondContact O-N 3.46Å; T49-L53 HydrophobicContact CG2-CD1 3.63Å; T49-L53 HydrophobicContact CG2-CG 4.34Å; T49-L53 WeakPolarHBondContact O-CB 3.41Å; T49-L53 VanDerWaalsContact O-CG 3.24Å; T49-L53 WeakPolarHBondContact O-CG 3.41Å; T49-L53 PolarHBondContact O-N 3.12Å
50	C	82.5	Confident	75.3	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.007	43%	0.429	C	S	.	.	H	α-helix	trans	-61.4	-43	176.3	-68.3	0	0	0	0	111.7	W46 V47 I52 L53 D54 L55 L57	W46-C50 PolarHBondContact O-N 3.36Å; W46-C50 PolarHBondContact O-SG 3.33Å; V47-C50 PolarHBondContact O-N 2.9Å; C50-I52 PolarHBondContact O-N 3.27Å; C50-L53 CarbonylContact O-C 3.55Å; C50-L53 PolarHBondContact O-N 2.96Å; C50-D54 PolarHBondContact O-N 2.69Å; C50-D54 VanDerWaalsContact O-N 3.14Å; C50-L55 HydrophobicContact CB-CB 4.02Å; C50-L55 PolarHBondContact O-N 2.97Å; C50-L57 HydrophobicContact CB-CD1 3.95Å; C50-L57 HydrophobicContact CB-CD2 3.71Å; C50-L57 HydrophobicContact CB-CG 3.83Å
51	L	81	Confident	73.2	Confident	112 Å²	112	80.2 Å²	80.2	59%	0.586	45%	0.449	S	S	*	.	H	α-helix	trans	-63.4	-39.1	175.2	-69.3	171.4	0	0	0	112.6	V47 T48 T49 L53 D54 L57	V47-L51 HydrophobicContact CG1-CD1 4.13Å; V47-L51 WeakPolarHBondContact O-CG 3.45Å; V47-L51 PolarHBondContact O-N 3.26Å; T48-L51 PolarHBondContact O-N 3.06Å; T49-L51 VanDerWaalsContact C-N 3.35Å; T49-L51 PolarHBondContact O-N 3.38Å; L51-L53 VanDerWaalsContact C-N 3.29Å; L51-L53 PolarHBondContact O-N 3.41Å; L51-D54 PolarHBondContact O-N 3.36Å; L51-L57 HydrophobicContact CD2-CD1 4.27Å; L51-L57 HydrophobicContact CG-CD1 4.15Å
52	I	80.3	Confident	71.1	Confident	132 Å²	132	85.4 Å²	85.4	68%	0.677	46%	0.462	S	S	*	.	H	α-helix	trans	-66.9	-33.3	176.1	-71	163.4	0	0	0	111.4	T48 T49 C50 D54	T48-I52 WeakPolarHBondContact O-CB 3.23Å; T48-I52 WeakPolarHBondContact O-CD1 3.16Å; T48-I52 WeakPolarHBondContact O-CG1 3.44Å; T48-I52 PolarHBondContact O-N 3.39Å; T49-I52 PolarHBondContact O-N 3.46Å; C50-I52 PolarHBondContact O-N 3.27Å; I52-D54 VanDerWaalsContact C-N 3.34Å
53	L	80.1	Confident	68.9	Low	66 Å²	66	91.9 Å²	91.9	35%	0.346	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	8.1	-177.1	-64.1	174.1	0	0	0	113.4	T49 C50 L51 L55 L294	T49-L53 HydrophobicContact CG2-CD1 3.63Å; T49-L53 HydrophobicContact CG2-CG 4.34Å; T49-L53 WeakPolarHBondContact O-CB 3.41Å; T49-L53 VanDerWaalsContact O-CG 3.24Å; T49-L53 WeakPolarHBondContact O-CG 3.41Å; T49-L53 PolarHBondContact O-N 3.12Å; C50-L53 CarbonylContact O-C 3.55Å; C50-L53 PolarHBondContact O-N 2.96Å; L51-L53 VanDerWaalsContact C-N 3.29Å; L51-L53 PolarHBondContact O-N 3.41Å; L53-L55 HydrophobicContact CB-CD1 4.2Å; L53-L55 HydrophobicContact CB-CG 3.94Å; L53-L55 HydrophobicContact CD1-CD1 4.45Å; L53-L55 PolarHBondContact O-N 2.83Å; L53-L294 HydrophobicContact CB-CD2 4.5Å; L53-L294 HydrophobicContact CD1-CD2 3.89Å
54	D	79.4	Confident	66.6	Low	129 Å²	129	95.6 Å²	95.6	69%	0.69	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	37.7	-174.6	-65.9	-40.4	0	0	0	112.8	C50 L51 I52	C50-D54 PolarHBondContact O-N 2.69Å; C50-D54 VanDerWaalsContact O-N 3.14Å; L51-D54 PolarHBondContact O-N 3.36Å; I52-D54 VanDerWaalsContact C-N 3.34Å
55	L	80.2	Confident	63.9	Low	10 Å²	10	95.5 Å²	95.5	5%	0.052	51%	0.508	C	S	.	.			trans	-85.5	124	175.2	-66	-179.8	0	0	0	109.4	C50 L53 L57 P292 L294 Y295	C50-L55 HydrophobicContact CB-CB 4.02Å; C50-L55 PolarHBondContact O-N 2.97Å; L53-L55 HydrophobicContact CB-CD1 4.2Å; L53-L55 HydrophobicContact CB-CG 3.94Å; L53-L55 HydrophobicContact CD1-CD1 4.45Å; L53-L55 PolarHBondContact O-N 2.83Å; L55-L57 PolarHBondContact O-N 3.31Å; L55-P292 HydrophobicContact CD2-CB 3.74Å; L55-P292 HydrophobicContact CD2-CG 4.41Å; L55-L294 HydrophobicContact CD1-CD2 4.28Å; L55-L294 HydrophobicContact CD2-CB 4.44Å; L55-L294 HydrophobicContact CD2-CD2 4.45Å; L55-Y295 HydrophobicContact CD2-CD2 4.34Å; L55-Y295 HydrophobicContact CD2-CE2 3.92Å
56	P	76.3	Confident	61.4	Low	81 Å²	81	94.6 Å²	94.6	53%	0.526	51%	0.509	S	S	.	.			trans	-66.6	109.3	-178.6	26.1	-32.6	0	0	0	110.6	H112 P292	P56-H112 PolarHBondContact O-NE2 2.88Å; P56-P292 HydrophobicContact CG-CG 4.49Å
57	L	66.4	Low	58.8	Low	29 Å²	29	97.5 Å²	97.5	15%	0.152	54%	0.536	C	S	.	.			trans	-81.8	123.4	169.3	-67.5	167.3	0	0	0	108.3	V47 C50 L51 L55 H59 W106	V47-L57 HydrophobicContact CB-CD1 4.42Å; V47-L57 HydrophobicContact CG1-CD1 3.85Å; C50-L57 HydrophobicContact CB-CD1 3.95Å; C50-L57 HydrophobicContact CB-CD2 3.71Å; C50-L57 HydrophobicContact CB-CG 3.83Å; L51-L57 HydrophobicContact CD2-CD1 4.27Å; L51-L57 HydrophobicContact CG-CD1 4.15Å; L55-L57 PolarHBondContact O-N 3.31Å; L57-H59 PolarHBondContact O-N 2.93Å; L57-W106 HydrophobicContact CD2-CH2 4.07Å
58	L	58.5	Low	56.2	Low	108 Å²	108	104.1 Å²	104.1	57%	0.565	56%	0.564	S	S	*	*			trans	-69.2	84.7	166.7	-74.8	166	0	0	0	108.4	P111 D405	L58-P111 HydrophobicContact CD1-CG 4.37Å; L58-D405 HydrophobicContact CD1-CB 3.59Å
59	H	46.2	Very low	53.9	Low	128 Å²	128	107 Å²	107	59%	0.593	58%	0.582	S	S	*	*			trans	-73.1	131.4	159.6	-90.1	46.5	0	0	0	107.6	L57 D61	L57-H59 PolarHBondContact O-N 2.93Å; H59-D61 PolarHBondContact O-N 3.43Å
60	G	39.7	Very low	51.5	Low	81 Å²	81	110.7 Å²	110.7	84%	0.835	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	30.5	-173.8	0	0	0	0	0	116.8
61	D	32.1	Very low	49	Very low	152 Å²	152	115.3 Å²	115.3	81%	0.813	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	-3.1	-176.3	-74.9	-33.1	0	0	0	115.1	H59	H59-D61 PolarHBondContact O-N 3.43Å
62	E	33.3	Very low	46.5	Very low	171 Å²	171	114.2 Å²	114.2	80%	0.799	66%	0.658	S	S	*	*			trans	-119.4	81.2	165.2	-69.2	-143.4	154.2	0	0	111	L64	E62-L64 VanDerWaalsContact C-N 3.28Å; E62-L64 PolarHBondContact O-N 2.77Å
63	E	34.2	Very low	44.1	Very low	170 Å²	170	116.2 Å²	116.2	79%	0.794	66%	0.664	S	S	*	*			trans	-55.9	93.8	157.2	-94.1	-174.5	150	0	0	108.8	K65	E63-K65 VanDerWaalsContact C-N 3.26Å; E63-K65 PolarHBondContact O-N 3.28Å
64	L	34.1	Very low	42	Very low	156 Å²	156	119.7 Å²	119.7	82%	0.817	69%	0.688	S	S	*	*			trans	-68	92.6	162	-133.5	97.7	0	0	0	106.8	E62 P66	E62-L64 VanDerWaalsContact C-N 3.28Å; E62-L64 PolarHBondContact O-N 2.77Å; L64-P66 VanDerWaalsContact O-CD 3.26Å; L64-P66 WeakPolarHBondContact O-CD 3.46Å; L64-P66 VanDerWaalsContact O-N 3.1Å
65	K	25.2	Very low	40.5	Very low	158 Å²	158	116.6 Å²	116.6	69%	0.687	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-51.6	117.6	175.2	-84.5	-176.4	175.1	-176.9	0	109.5	E63	E63-K65 VanDerWaalsContact C-N 3.26Å; E63-K65 PolarHBondContact O-N 3.28Å
66	P	31	Very low	39.7	Very low	94 Å²	94	120.5 Å²	120.5	61%	0.61	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-64.7	158.8	168.6	26.6	-30.5	0	0	0	109.5	L64 E68	L64-P66 VanDerWaalsContact O-CD 3.26Å; L64-P66 WeakPolarHBondContact O-CD 3.46Å; L64-P66 VanDerWaalsContact O-N 3.1Å; P66-E68 PolarHBondContact O-N 2.83Å
67	P	29.6	Very low	39.5	Very low	121 Å²	121	117.3 Å²	117.3	79%	0.786	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-53.4	126.7	-179.8	21	-31.7	0	0	0	110.4	T69	P67-T69 PolarHBondContact O-N 3.45Å
68	E	28.6	Very low	40.5	Very low	173 Å²	173	116.5 Å²	116.5	81%	0.808	68%	0.676	S	S	*	*			trans	-58.3	98.9	-176.4	-66.7	-176.7	164.3	0	0	110.9	P66	P66-E68 PolarHBondContact O-N 2.83Å
69	T	31.3	Very low	42.1	Very low	128 Å²	128	115.8 Å²	115.8	79%	0.785	67%	0.666	S	S	*	*			trans	-94.4	121.7	153.2	46.8	0	0	0	0	108	P67 S71	P67-T69 PolarHBondContact O-N 3.45Å; T69-S71 PolarHBondContact O-N 3.13Å
70	S	30.9	Very low	44.4	Very low	124 Å²	124	111.6 Å²	111.6	87%	0.867	65%	0.648	S	S	*	*	S	Bend	trans	-57.4	89.4	-176.7	55.3	0	0	0	0	113.6
71	S	30.1	Very low	47	Very low	99 Å²	99	109.5 Å²	109.5	69%	0.692	62%	0.617	S	S	*	*			trans	-174.5	108.2	146.2	55.6	0	0	0	0	108.8	T69 Q73	T69-S71 PolarHBondContact O-N 3.13Å; S71-Q73 PolarHBondContact O-N 3.34Å
72	G	29.1	Very low	50	Low	89 Å²	89	103.5 Å²	103.5	92%	0.918	59%	0.587	S	S	*	*			trans	-69.3	85.8	179.6	0	0	0	0	0	113
73	Q	31.1	Very low	53	Low	173 Å²	173	98.9 Å²	98.9	81%	0.808	56%	0.564	S	S	*	*			trans	-135	103.7	160.3	-77.8	-175	-15.1	0	0	108.5	S71 S75	S71-Q73 PolarHBondContact O-N 3.34Å; Q73-S75 PolarHBondContact O-N 2.77Å
74	T	35.9	Very low	55.9	Low	139 Å²	139	96.5 Å²	96.5	85%	0.853	56%	0.564	S	S	*	*			trans	-70.5	81.9	163.7	40.7	0	0	0	0	107.9	D76	T74-D76 PolarHBondContact O-N 2.97Å
75	S	47.9	Very low	58.7	Low	65 Å²	65	89.4 Å²	89.4	46%	0.455	53%	0.527	S	S	.	.			trans	-76.4	109	172.4	155.8	0	0	0	0	108.2	Q73 G77	Q73-S75 PolarHBondContact O-N 2.77Å; S75-G77 PolarHBondContact O-N 3.3Å
76	D	61.6	Low	61.9	Low	91 Å²	91	83.5 Å²	83.5	49%	0.487	51%	0.507	S	S	.	.	S	Bend	trans	-68.3	20.8	177.1	-159	26	0	0	0	113.3	T74 R433	T74-D76 PolarHBondContact O-N 2.97Å; D76-R433 IonicContact OD1-CZ 3.31Å; D76-R433 IonicContact OD1-NH1 2.77Å; D76-R433 IonicContact OD1-NH2 3.21Å; D76-R433 PolarHBondContact OD1-NH2 3.39Å; D76-R433 VanDerWaalsContact OD1-NH2 3.15Å
77	G	73.1	Confident	64.8	Low	15 Å²	15	79 Å²	79	16%	0.155	48%	0.478	C	S	.	.	S	Bend	trans	-127.4	170.1	-176.2	0	0	0	0	0	112.9	S75 R79	S75-G77 PolarHBondContact O-N 3.3Å; G77-R79 PolarHBondContact O-N 3.17Å
78	P	86.5	Confident	67.8	Low	12 Å²	12	73.4 Å²	73.4	8%	0.078	44%	0.442	C	S	.	.			trans	-59.3	127.9	-176.7	24	-34	0	0	0	111.9	L98 A101 T431 W462	P78-L98 WeakPolarHBondContact CG-O 3.49Å; P78-A101 WeakPolarHBondContact CD-O 3.16Å; P78-A101 HydrophobicContact CG-CB 4.12Å; P78-T431 HydrophobicContact CB-CG2 3.87Å; P78-W462 HydrophobicContact CB-CH2 3.75Å; P78-W462 HydrophobicContact CB-CZ2 3.63Å; P78-W462 HydrophobicContact CG-CH2 4.35Å; P78-W462 HydrophobicContact CG-CZ2 3.72Å
79	R	92.1	Very high	70.9	Confident	93 Å²	93	71.8 Å²	71.8	35%	0.351	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	113.6	174.6	-64.5	-171	-66.4	-97.7	-3.6	109.6	G77 L430 D432	G77-R79 PolarHBondContact O-N 3.17Å; R79-L430 PolarHBondContact N-O 3.48Å; R79-L430 PolarHBondContact O-N 3.3Å; R79-D432 IonicContact CZ-OD1 3.47Å; R79-D432 VanDerWaalsContact CZ-OD1 3.31Å; R79-D432 IonicContact NH1-OD1 3.12Å; R79-D432 PolarHBondContact NH1-OD1 3.11Å; R79-D432 IonicContact NH1-OD2 3.65Å; R79-D432 PolarHBondContact NH1-OD2 2.9Å; R79-D432 IonicContact NH2-OD1 3.83Å; R79-D432 PolarHBondContact NH2-OD1 2.84Å
80	L	94.3	Very high	73.9	Confident	39 Å²	39	67.6 Å²	67.6	20%	0.204	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.6	175.2	-171.5	70.3	0	0	0	110.7	L92 L427 L428	L80-L92 HydrophobicContact CD2-CD1 4.47Å; L80-L92 HydrophobicContact CD2-CD2 3.62Å; L80-L92 HydrophobicContact CD2-CG 3.92Å; L80-L427 HydrophobicContact CD1-CB 4.3Å; L80-L427 HydrophobicContact CD1-CD2 4.46Å; L80-L428 CarbonylContact C-O 3.37Å; L80-L428 WeakPolarHBondContact CA-O 3.49Å
81	I	95.4	Very high	76.9	Confident	37 Å²	37	61.8 Å²	61.8	19%	0.19	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.7	174.9	-54.8	174.5	0	0	0	107.9	V417 F420 Q421 L428 L430	I81-V417 HydrophobicContact CG2-CG1 4.08Å; I81-F420 HydrophobicContact CG2-CB 4.21Å; I81-Q421 HydrophobicContact CG2-CG 4.01Å; I81-L428 HydrophobicContact CB-CB 4.24Å; I81-L428 HydrophobicContact CB-CD2 4.45Å; I81-L428 HydrophobicContact CD1-CD2 4.09Å; I81-L428 PolarHBondContact N-O 2.82Å; I81-L428 PolarHBondContact O-N 2.89Å; I81-L430 HydrophobicContact CD1-CD2 4.41Å
82	C	95.6	Very high	79.8	Confident	27 Å²	27	61 Å²	61	18%	0.182	35%	0.345	C	S	.	.			trans	-158	164.3	177.2	60.9	0	0	0	0	110.8	F420 L427	C82-F420 CarbonylContact C-O 3.21Å; C82-F420 WeakPolarHBondContact CA-O 3.37Å; C82-L427 HydrophobicContact CB-CB 4.26Å; C82-L427 HydrophobicContact CB-CD2 4.04Å; C82-L427 HydrophobicContact CB-CG 3.97Å
83	K	95.6	Very high	82.7	Confident	73 Å²	73	63.9 Å²	63.9	32%	0.317	34%	0.335	S	S	.	.			trans	-66.3	129.3	168.5	-179	166.6	-179.7	176	0	110.1	S85 F420 Q421 S422 P424	K83-S85 PolarHBondContact O-N 3.27Å; K83-F420 PolarHBondContact N-O 3.09Å; K83-Q421 VanDerWaalsContact CB-O 3.29Å; K83-Q421 WeakPolarHBondContact CB-O 3.38Å; K83-S422 WeakPolarHBondContact CD-O 3.27Å; K83-S422 PolarHBondContact NZ-O 3.14Å; K83-S422 VanDerWaalsContact NZ-O 3.1Å; K83-P424 HydrophobicContact CD-CB 4.32Å
84	P	94.2	Very high	85.5	Confident	121 Å²	121	60.1 Å²	60.1	79%	0.786	32%	0.318	S	S	*	.			trans	-55.5	113.8	171.1	-25.1	34.6	0	0	0	110.8
85	S	93.1	Very high	87.9	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.042	28%	0.277	C	S	.	.			trans	-145.9	167.5	-176.4	70	0	0	0	0	110.7	K83 L87 A88 R89	K83-S85 PolarHBondContact O-N 3.27Å; S85-L87 VanDerWaalsContact C-N 3.27Å; S85-L87 PolarHBondContact O-N 3.24Å; S85-A88 PolarHBondContact O-N 2.97Å; S85-A88 WeakPolarHBondContact OG-CB 3.39Å; S85-A88 PolarHBondContact OG-N 3.27Å; S85-R89 PolarHBondContact O-N 2.69Å
86	A	92.7	Very high	89.7	Confident	34 Å²	34	52.3 Å²	52.3	28%	0.281	28%	0.275	S	S	.	.	H	α-helix	trans	-59.4	-41.3	174.8	0	0	0	0	0	111.7	R89 Y90 F477	A86-R89 PolarHBondContact O-N 3.09Å; A86-Y90 WeakPolarHBondContact O-CB 3.49Å; A86-Y90 PolarHBondContact O-N 3.43Å; A86-F477 HydrophobicContact CB-CE2 4.45Å; A86-F477 HydrophobicContact CB-CZ 4.12Å
87	L	92.8	Very high	90.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-49.4	175.6	175.5	68.3	0	0	0	111.1	S85 R89 Y90 L91 P397 L427 F477 W541	S85-L87 VanDerWaalsContact C-N 3.27Å; S85-L87 PolarHBondContact O-N 3.24Å; L87-R89 VanDerWaalsContact C-N 3.3Å; L87-R89 PolarHBondContact O-N 3.37Å; L87-Y90 WeakPolarHBondContact O-CB 3.43Å; L87-Y90 PolarHBondContact O-N 2.81Å; L87-Y90 VanDerWaalsContact O-N 3.13Å; L87-L91 HydrophobicContact CD1-CD1 3.97Å; L87-L91 HydrophobicContact CD1-CG 4.01Å; L87-L91 HydrophobicContact CD2-CD1 4.32Å; L87-L91 HydrophobicContact CG-CD1 3.77Å; L87-L91 HydrophobicContact CG-CG 4.23Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 VanDerWaalsContact O-CG 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.22Å; L87-L91 PolarHBondContact O-N 3.22Å; L87-P397 HydrophobicContact CD2-CB 3.83Å; L87-P397 HydrophobicContact CD2-CG 3.66Å; L87-L427 HydrophobicContact CD2-CD1 4.48Å; L87-F477 HydrophobicContact CB-CD1 4.36Å; L87-F477 HydrophobicContact CB-CE1 3.95Å; L87-F477 HydrophobicContact CB-CZ 4.22Å; L87-F477 HydrophobicContact CD1-CB 4.26Å; L87-F477 HydrophobicContact CD1-CD1 3.54Å; L87-F477 HydrophobicContact CD1-CE1 4.01Å; L87-F477 HydrophobicContact CD1-CG 3.9Å; L87-W541 HydrophobicContact CB-CZ2 3.62Å; L87-W541 HydrophobicContact CD2-CH2 3.6Å; L87-W541 HydrophobicContact CD2-CZ2 3.45Å; L87-W541 VanDerWaalsContact CD2-CZ2 3.45Å; L87-W541 HydrophobicContact CG-CZ2 4.13Å
88	A	93	Very high	91.5	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.033	25%	0.25	C	S	.	.	H	α-helix	trans	-58.8	-42.2	-179.3	0	0	0	0	0	112	S85 L91 L92	S85-A88 PolarHBondContact O-N 2.97Å; S85-A88 WeakPolarHBondContact OG-CB 3.39Å; S85-A88 PolarHBondContact OG-N 3.27Å; A88-L91 PolarHBondContact O-N 2.66Å; A88-L92 WeakPolarHBondContact O-CG 3.29Å; A88-L92 PolarHBondContact O-N 3.43Å
89	R	93.6	Very high	91.2	Very high	138 Å²	138	50.4 Å²	50.4	52%	0.521	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-42.6	175.1	-76.1	-176.9	-88	106.2	-8.5	112.4	S85 A86 L87 L92 Q93	S85-R89 PolarHBondContact O-N 2.69Å; A86-R89 PolarHBondContact O-N 3.09Å; L87-R89 VanDerWaalsContact C-N 3.3Å; L87-R89 PolarHBondContact O-N 3.37Å; R89-L92 PolarHBondContact O-N 3.46Å; R89-Q93 VanDerWaalsContact O-CG 3.31Å; R89-Q93 WeakPolarHBondContact O-CG 3.32Å; R89-Q93 PolarHBondContact O-N 3.07Å
90	Y	93.5	Very high	90.2	Very high	41 Å²	41	54.1 Å²	54.1	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-45.2	176.7	-170.4	-90.7	0	0	0	111.3	A86 L87 L92 Q93 H94 V473 F477 E480	A86-Y90 WeakPolarHBondContact O-CB 3.49Å; A86-Y90 PolarHBondContact O-N 3.43Å; L87-Y90 WeakPolarHBondContact O-CB 3.43Å; L87-Y90 PolarHBondContact O-N 2.81Å; L87-Y90 VanDerWaalsContact O-N 3.13Å; Y90-L92 PolarHBondContact O-N 2.91Å; Y90-Q93 PolarHBondContact O-N 3.08Å; Y90-Q93 VanDerWaalsContact O-N 3.17Å; Y90-H94 AromaticContact CD1-CD2 3.8Å; Y90-H94 AromaticContact CD2-CD2 3.68Å; Y90-H94 AromaticContact CD2-NE2 3.92Å; Y90-H94 HydrophobicContact CE1-CB 4.47Å; Y90-H94 AromaticContact CE1-CD2 3.72Å; Y90-H94 AromaticContact CE2-CD2 3.62Å; Y90-H94 AromaticContact CE2-NE2 3.6Å; Y90-H94 AromaticContact CG-CD2 3.79Å; Y90-H94 AromaticContact CZ-CD2 3.65Å; Y90-H94 AromaticContact CZ-NE2 3.88Å; Y90-H94 WeakPolarHBondContact O-CB 3.36Å; Y90-H94 PolarHBondContact O-CD2 3.01Å; Y90-H94 VanDerWaalsContact O-CD2 3.24Å; Y90-H94 PolarHBondContact O-N 3.37Å; Y90-V473 HydrophobicContact CD1-CG1 3.66Å; Y90-V473 HydrophobicContact CE1-CG1 3.55Å; Y90-F477 HydrophobicContact CD1-CB 3.79Å; Y90-F477 AromaticContact CD1-CD2 3.9Å; Y90-F477 HydrophobicContact CD1-CD2 3.9Å; Y90-F477 HydrophobicContact CD1-CG 4.21Å; Y90-F477 AromaticContact CD2-CD2 3.85Å; Y90-F477 HydrophobicContact CD2-CD2 3.85Å; Y90-F477 HydrophobicContact CE1-CB 3.76Å; Y90-F477 HydrophobicContact CE1-CD2 4.37Å; Y90-F477 HydrophobicContact CE2-CD2 4.31Å; Y90-F477 HydrophobicContact CG-CB 4.38Å; Y90-F477 AromaticContact CG-CD2 3.6Å; Y90-F477 HydrophobicContact CG-CD2 3.6Å; Y90-F477 HydrophobicContact CG-CE2 4.35Å; Y90-F477 HydrophobicContact CG-CG 4.35Å; Y90-E480 PolarHBondContact OH-OE2 3.47Å
91	L	93.3	Very high	89.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-43.9	176.2	-69.6	170.6	0	0	0	112	L87 A88 Q93 H94 C95 L427 F470 V473 A474	L87-L91 HydrophobicContact CD1-CD1 3.97Å; L87-L91 HydrophobicContact CD1-CG 4.01Å; L87-L91 HydrophobicContact CD2-CD1 4.32Å; L87-L91 HydrophobicContact CG-CD1 3.77Å; L87-L91 HydrophobicContact CG-CG 4.23Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 VanDerWaalsContact O-CG 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.22Å; L87-L91 PolarHBondContact O-N 3.22Å; A88-L91 PolarHBondContact O-N 2.66Å; L91-Q93 PolarHBondContact O-N 3.09Å; L91-H94 PolarHBondContact O-N 2.96Å; L91-C95 WeakPolarHBondContact O-CA 3.29Å; L91-C95 WeakPolarHBondContact O-CB 3.47Å; L91-C95 PolarHBondContact O-N 3.19Å; L91-L427 HydrophobicContact CD1-CD1 4.27Å; L91-L427 HydrophobicContact CD1-CD2 3.52Å; L91-F470 HydrophobicContact CD1-CD2 4.02Å; L91-F470 HydrophobicContact CD1-CE2 3.73Å; L91-F470 HydrophobicContact CD2-CD2 3.8Å; L91-F470 HydrophobicContact CD2-CE2 4.16Å; L91-V473 HydrophobicContact CD2-CB 4.15Å; L91-V473 HydrophobicContact CD2-CG1 3.77Å; L91-A474 HydrophobicContact CD2-CB 4.44Å
92	L	90.6	Very high	88.9	Confident	82 Å²	82	54.1 Å²	54.1	43%	0.429	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-27.2	176.8	-75.7	169.5	0	0	0	113.5	L80 A88 R89 Y90 T99	L80-L92 HydrophobicContact CD2-CD1 4.47Å; L80-L92 HydrophobicContact CD2-CD2 3.62Å; L80-L92 HydrophobicContact CD2-CG 3.92Å; A88-L92 WeakPolarHBondContact O-CG 3.29Å; A88-L92 PolarHBondContact O-N 3.43Å; R89-L92 PolarHBondContact O-N 3.46Å; Y90-L92 PolarHBondContact O-N 2.91Å; L92-T99 HydrophobicContact CD2-CG2 3.69Å
93	Q	90.6	Very high	88.4	Confident	151 Å²	151	53.4 Å²	53.4	71%	0.706	28%	0.275	S	S	*	.	H	α-helix	trans	-83.3	-33.1	177.6	-71.9	173.9	-0.9	0	0	112.9	R89 Y90 L91	R89-Q93 VanDerWaalsContact O-CG 3.31Å; R89-Q93 WeakPolarHBondContact O-CG 3.32Å; R89-Q93 PolarHBondContact O-N 3.07Å; Y90-Q93 PolarHBondContact O-N 3.08Å; Y90-Q93 VanDerWaalsContact O-N 3.17Å; L91-Q93 PolarHBondContact O-N 3.09Å
94	H	89.7	Confident	87.8	Confident	94 Å²	94	50.1 Å²	50.1	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-111.1	-14.4	-169.8	-69.5	-73.5	0	0	0	114.8	Y90 L91 V473	Y90-H94 AromaticContact CD1-CD2 3.8Å; Y90-H94 AromaticContact CD2-CD2 3.68Å; Y90-H94 AromaticContact CD2-NE2 3.92Å; Y90-H94 HydrophobicContact CE1-CB 4.47Å; Y90-H94 AromaticContact CE1-CD2 3.72Å; Y90-H94 AromaticContact CE2-CD2 3.62Å; Y90-H94 AromaticContact CE2-NE2 3.6Å; Y90-H94 AromaticContact CG-CD2 3.79Å; Y90-H94 AromaticContact CZ-CD2 3.65Å; Y90-H94 AromaticContact CZ-NE2 3.88Å; Y90-H94 WeakPolarHBondContact O-CB 3.36Å; Y90-H94 PolarHBondContact O-CD2 3.01Å; Y90-H94 VanDerWaalsContact O-CD2 3.24Å; Y90-H94 PolarHBondContact O-N 3.37Å; L91-H94 PolarHBondContact O-N 2.96Å; H94-V473 HydrophobicContact CB-CG1 3.57Å; H94-V473 HydrophobicContact CB-CG2 4.16Å
95	C	87.6	Confident	87.3	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.			trans	-103.6	92.3	174.4	-61.9	0	0	0	0	110.3	L91 S97 L98 E469	L91-C95 WeakPolarHBondContact O-CA 3.29Å; L91-C95 WeakPolarHBondContact O-CB 3.47Å; L91-C95 PolarHBondContact O-N 3.19Å; C95-S97 VanDerWaalsContact C-N 3.28Å; C95-S97 PolarHBondContact O-N 3.5Å; C95-L98 HydrophobicContact CB-CB 4.21Å; C95-L98 HydrophobicContact CB-CD1 3.78Å; C95-L98 HydrophobicContact CB-CG 4.01Å; C95-L98 PolarHBondContact O-N 3.15Å; C95-E469 VanDerWaalsContact CA-CD 3.49Å; C95-E469 WeakPolarHBondContact CA-OE2 3.31Å; C95-E469 HydrophobicContact CB-CG 4.36Å
96	G	84.4	Confident	86.6	Confident	39 Å²	39	52.7 Å²	52.7	40%	0.402	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-65.3	-33.5	179.9	0	0	0	0	0	112.4	L98 T99 K100 E469	G96-L98 VanDerWaalsContact C-N 3.28Å; G96-L98 PolarHBondContact O-N 3.22Å; G96-T99 PolarHBondContact O-N 2.93Å; G96-T99 PolarHBondContact O-OG1 2.89Å; G96-T99 VanDerWaalsContact O-OG1 3.1Å; G96-K100 PolarHBondContact O-N 3.05Å; G96-K100 VanDerWaalsContact O-N 3.14Å; G96-E469 PolarHBondContact N-OE1 2.81Å; G96-E469 PolarHBondContact N-OE2 3.36Å
97	S	87.6	Confident	85.7	Confident	17 Å²	17	52.3 Å²	52.3	12%	0.119	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-70.1	-25.7	-176.1	78.8	0	0	0	0	112.9	C95 T99 W462 A466 E469	C95-S97 VanDerWaalsContact C-N 3.28Å; C95-S97 PolarHBondContact O-N 3.5Å; S97-T99 PolarHBondContact O-N 3.49Å; S97-W462 PolarHBondContact O-NE1 3.48Å; S97-A466 WeakPolarHBondContact OG-CA 3.14Å; S97-A466 WeakPolarHBondContact OG-CB 3.36Å; S97-E469 VanDerWaalsContact CB-OE2 3.27Å; S97-E469 WeakPolarHBondContact CB-OE2 3.45Å; S97-E469 PolarHBondContact N-OE2 2.89Å; S97-E469 PolarHBondContact OG-OE2 3.45Å
98	L	86.1	Confident	85.2	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-77.7	-9.5	178.8	-69.5	179.2	0	0	0	113.2	P78 C95 G96 L399 A429 W462 A466	P78-L98 WeakPolarHBondContact CG-O 3.49Å; C95-L98 HydrophobicContact CB-CB 4.21Å; C95-L98 HydrophobicContact CB-CD1 3.78Å; C95-L98 HydrophobicContact CB-CG 4.01Å; C95-L98 PolarHBondContact O-N 3.15Å; G96-L98 VanDerWaalsContact C-N 3.28Å; G96-L98 PolarHBondContact O-N 3.22Å; L98-L399 HydrophobicContact CD2-CD1 4.46Å; L98-L399 HydrophobicContact CD2-CD2 4.1Å; L98-A429 HydrophobicContact CD2-CB 4.28Å; L98-W462 HydrophobicContact CD2-CZ2 4.43Å; L98-A466 HydrophobicContact CD2-CB 3.97Å
99	T	79.1	Confident	84.7	Confident	59 Å²	59	60.1 Å²	60.1	36%	0.362	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-26.3	-175.7	55.3	0	0	0	0	113.9	L92 G96 S97	L92-T99 HydrophobicContact CD2-CG2 3.69Å; G96-T99 PolarHBondContact O-N 2.93Å; G96-T99 PolarHBondContact O-OG1 2.89Å; G96-T99 VanDerWaalsContact O-OG1 3.1Å; S97-T99 PolarHBondContact O-N 3.49Å
100	K	72.4	Confident	84.4	Confident	170 Å²	170	53.6 Å²	53.6	74%	0.739	26%	0.259	S	S	*	.	S	Bend	trans	-130.6	41	-168.7	-63.9	-179.6	-177.9	177.3	0	114.3	G96	G96-K100 PolarHBondContact O-N 3.05Å; G96-K100 VanDerWaalsContact O-N 3.14Å
101	A	78.3	Confident	84.2	Confident	8 Å²	8	52 Å²	52	7%	0.066	25%	0.253	C	S	.	.			trans	-96.8	133.1	177.5	0	0	0	0	0	112	P78 W462	P78-A101 WeakPolarHBondContact CD-O 3.16Å; P78-A101 HydrophobicContact CG-CB 4.12Å; A101-W462 HydrophobicContact CB-CD2 4.25Å; A101-W462 HydrophobicContact CB-CG 3.94Å
102	K	82.3	Confident	84.1	Confident	68 Å²	68	52 Å²	52	30%	0.296	25%	0.254	S	S	.	.			trans	-108.5	111.1	168.1	-164.8	-177.9	-178.3	-125.4	0	108.4	D105 D442	K102-D105 IonicContact NZ-OD2 2.66Å; K102-D105 PolarHBondContact NZ-OD2 3.24Å; K102-D442 HydrophobicContact CG-CB 4.48Å; K102-D442 IonicContact NZ-OD2 3.58Å; K102-D442 PolarHBondContact NZ-OD2 2.8Å; K102-D442 PolarHBondContact O-N 3.47Å
103	L	85.6	Confident	83.9	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.063	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-78	157.1	178.5	-63.4	-179.8	0	0	0	110.7	D105 T431 R433 A440 W462	L103-D105 PolarHBondContact O-N 3.4Å; L103-T431 HydrophobicContact CD1-CG2 3.8Å; L103-R433 HydrophobicContact CD1-CB 4.47Å; L103-R433 WeakPolarHBondContact CD1-O 3.36Å; L103-A440 WeakPolarHBondContact CA-O 3.28Å; L103-W462 HydrophobicContact CD2-CB 3.75Å; L103-W462 HydrophobicContact CD2-CD2 4.15Å; L103-W462 HydrophobicContact CD2-CE3 4.1Å; L103-W462 HydrophobicContact CD2-CG 4.01Å
104	A	83.6	Confident	83.8	Confident	4 Å²	4	43 Å²	43	3%	0.033	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-54.4	134.3	179.9	0	0	0	0	0	111.5	W108 G109 R433 A440	A104-W108 HydrophobicContact CB-CB 4.11Å; A104-G109 WeakPolarHBondContact O-CA 3.47Å; A104-R433 PolarHBondContact O-NE 2.74Å; A104-A440 HydrophobicContact CB-CB 4.06Å; A104-A440 PolarHBondContact N-O 3Å
105	D	83.8	Confident	83.8	Confident	56 Å²	56	38.6 Å²	38.6	30%	0.299	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-85.1	164.9	173.8	-68.8	-36.6	0	0	0	110.5	K102 L103 W108 G109 R433	K102-D105 IonicContact NZ-OD2 2.66Å; K102-D105 PolarHBondContact NZ-OD2 3.24Å; L103-D105 PolarHBondContact O-N 3.4Å; D105-W108 PolarHBondContact O-N 2.87Å; D105-W108 VanDerWaalsContact O-N 3.11Å; D105-G109 PolarHBondContact O-N 2.88Å; D105-R433 IonicContact OD1-CZ 3.28Å; D105-R433 IonicContact OD1-NE 3.38Å; D105-R433 IonicContact OD1-NH2 3Å; D105-R433 PolarHBondContact OD1-NH2 2.9Å
106	W	77.5	Confident	83.8	Confident	125 Å²	125	41.1 Å²	41.1	47%	0.473	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	134.2	174.4	-179	-93.9	0	0	0	110.9	V47 L57 D110	V47-W106 HydrophobicContact CG2-CZ2 4.12Å; L57-W106 HydrophobicContact CD2-CH2 4.07Å; W106-D110 HydrophobicContact CE3-CB 3.91Å; W106-D110 HydrophobicContact CH2-CB 4.08Å; W106-D110 HydrophobicContact CZ3-CB 3.38Å; W106-D110 VanDerWaalsContact CZ3-OD2 3.27Å; W106-D110 WeakPolarHBondContact CZ3-OD2 3.28Å
107	P	75.4	Confident	83.8	Confident	27 Å²	27	41.2 Å²	41.2	18%	0.175	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.9	-15.9	11.1	34.3	-35	0	0	0	115.8	W43 G109 D110	W43-P107 HydrophobicContact CD2-CB 4.23Å; W43-P107 HydrophobicContact CD2-CG 4.3Å; W43-P107 HydrophobicContact CZ2-CB 4.44Å; W43-P107 HydrophobicContact CZ2-CG 3.97Å; P107-G109 PolarHBondContact O-N 2.71Å; P107-D110 VanDerWaalsContact O-CB 3.31Å; P107-D110 WeakPolarHBondContact O-CB 3.33Å; P107-D110 PolarHBondContact O-N 3.28Å; P107-D110 VanDerWaalsContact O-N 3.11Å
108	W	80.9	Confident	83.7	Confident	165 Å²	165	40.5 Å²	40.5	63%	0.625	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.1	-177.7	-57.6	110.7	0	0	0	112.8	W43 A104 D105 D110 L113 Q114	W43-W108 HydrophobicContact CH2-CE3 4.22Å; W43-W108 AromaticContact CH2-CH2 3.77Å; W43-W108 HydrophobicContact CH2-CH2 3.77Å; W43-W108 HydrophobicContact CH2-CZ2 4.17Å; W43-W108 AromaticContact CH2-CZ3 3.8Å; W43-W108 HydrophobicContact CH2-CZ3 3.8Å; W43-W108 AromaticContact CZ2-CH2 3.78Å; W43-W108 HydrophobicContact CZ2-CH2 3.78Å; W43-W108 AromaticContact CZ2-CZ2 3.71Å; W43-W108 HydrophobicContact CZ2-CZ2 3.71Å; W43-W108 HydrophobicContact CZ2-CZ3 4.19Å; A104-W108 HydrophobicContact CB-CB 4.11Å; D105-W108 PolarHBondContact O-N 2.87Å; D105-W108 VanDerWaalsContact O-N 3.11Å; W108-D110 VanDerWaalsContact C-N 3.27Å; W108-D110 PolarHBondContact O-N 3.41Å; W108-L113 HydrophobicContact CE3-CD2 4.12Å; W108-Q114 WeakPolarHBondContact O-CG 3.44Å
109	G	82.7	Confident	83.5	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.031	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.5	170.4	0	0	0	0	0	115.5	A104 D105 P107 Q114	A104-G109 WeakPolarHBondContact O-CA 3.47Å; D105-G109 PolarHBondContact O-N 2.88Å; P107-G109 PolarHBondContact O-N 2.71Å; G109-Q114 VanDerWaalsContact C-NE2 3.3Å; G109-Q114 PolarHBondContact O-NE2 3.32Å
110	D	87.1	Confident	83.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.			trans	-57.9	126.1	179.4	176.7	-122.8	0	0	0	111.7	W46 W106 P107 W108 H112 L113 Q114	W46-D110 PolarHBondContact NE1-OD1 3.36Å; W106-D110 HydrophobicContact CE3-CB 3.91Å; W106-D110 HydrophobicContact CH2-CB 4.08Å; W106-D110 HydrophobicContact CZ3-CB 3.38Å; W106-D110 VanDerWaalsContact CZ3-OD2 3.27Å; W106-D110 WeakPolarHBondContact CZ3-OD2 3.28Å; P107-D110 VanDerWaalsContact O-CB 3.31Å; P107-D110 WeakPolarHBondContact O-CB 3.33Å; P107-D110 PolarHBondContact O-N 3.28Å; P107-D110 VanDerWaalsContact O-N 3.11Å; W108-D110 VanDerWaalsContact C-N 3.27Å; W108-D110 PolarHBondContact O-N 3.41Å; D110-H112 VanDerWaalsContact C-N 3.28Å; D110-H112 PolarHBondContact O-N 2.6Å; D110-H112 WeakPolarHBondContact OD1-CB 3.23Å; D110-H112 PolarHBondContact OD1-N 3.41Å; D110-L113 HydrophobicContact CB-CB 3.86Å; D110-L113 PolarHBondContact O-N 2.99Å; D110-L113 WeakPolarHBondContact OD1-CB 3.48Å; D110-L113 PolarHBondContact OD1-N 2.84Å; D110-Q114 WeakPolarHBondContact O-CB 3.36Å; D110-Q114 WeakPolarHBondContact O-CG 3.43Å; D110-Q114 PolarHBondContact O-N 2.84Å
111	P	89.8	Confident	83.2	Confident	7 Å²	7	38.9 Å²	38.9	5%	0.045	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-36.6	-177.5	20.3	-33	0	0	0	113	L58 T115 D405	L58-P111 HydrophobicContact CD1-CG 4.37Å; P111-T115 WeakPolarHBondContact O-CB 3.42Å; P111-T115 PolarHBondContact O-N 3.31Å; P111-T115 PolarHBondContact O-OG1 3.24Å; P111-D405 HydrophobicContact CB-CB 3.99Å; P111-D405 WeakPolarHBondContact CB-O 3.33Å; P111-D405 HydrophobicContact CG-CB 4.27Å
112	H	90.4	Very high	82.3	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-73.1	-44.4	-178.5	-65	-61.8	0	0	0	111.7	W46 P56 D110 T115 V116 Y295	W46-H112 HydrophobicContact CZ2-CB 3.87Å; P56-H112 PolarHBondContact O-NE2 2.88Å; D110-H112 VanDerWaalsContact C-N 3.28Å; D110-H112 PolarHBondContact O-N 2.6Å; D110-H112 WeakPolarHBondContact OD1-CB 3.23Å; D110-H112 PolarHBondContact OD1-N 3.41Å; H112-T115 PolarHBondContact O-N 2.62Å; H112-V116 WeakPolarHBondContact O-CB 3.45Å; H112-V116 VanDerWaalsContact O-CG2 3.32Å; H112-V116 WeakPolarHBondContact O-CG2 3.47Å; H112-V116 PolarHBondContact O-N 2.98Å; H112-Y295 AromaticContact CE1-CE2 3.69Å; H112-Y295 AromaticContact ND1-CE2 3.37Å; H112-Y295 WeakPolarHBondContact ND1-CE2 3.36Å; H112-Y295 AromaticContact ND1-CZ 3.58Å; H112-Y295 PolarHBondContact ND1-OH 2.96Å
113	L	87.3	Confident	81	Confident	37 Å²	37	43.9 Å²	43.9	19%	0.194	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-48.1	175.5	-175.5	64.4	0	0	0	110.9	W43 W46 W108 D110 T115 V116 S117	W43-L113 HydrophobicContact CH2-CD2 4.22Å; W43-L113 HydrophobicContact CZ3-CD2 4.15Å; W46-L113 HydrophobicContact CZ2-CB 4.17Å; W108-L113 HydrophobicContact CE3-CD2 4.12Å; D110-L113 HydrophobicContact CB-CB 3.86Å; D110-L113 PolarHBondContact O-N 2.99Å; D110-L113 WeakPolarHBondContact OD1-CB 3.48Å; D110-L113 PolarHBondContact OD1-N 2.84Å; L113-T115 PolarHBondContact O-N 3.02Å; L113-V116 PolarHBondContact O-N 3.44Å; L113-S117 VanDerWaalsContact O-CB 3.22Å; L113-S117 WeakPolarHBondContact O-CB 3.48Å; L113-S117 PolarHBondContact O-N 2.95Å; L113-S117 PolarHBondContact O-OG 3.27Å; L113-S117 VanDerWaalsContact O-OG 3.07Å
114	Q	88.4	Confident	79.3	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.028	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-41.6	176.9	-76.7	-166.5	77	0	0	112.5	W108 G109 D110 S117 S118 G434	W108-Q114 WeakPolarHBondContact O-CG 3.44Å; G109-Q114 VanDerWaalsContact C-NE2 3.3Å; G109-Q114 PolarHBondContact O-NE2 3.32Å; D110-Q114 WeakPolarHBondContact O-CB 3.36Å; D110-Q114 WeakPolarHBondContact O-CG 3.43Å; D110-Q114 PolarHBondContact O-N 2.84Å; Q114-S117 PolarHBondContact O-OG 3.45Å; Q114-S117 VanDerWaalsContact O-OG 3.11Å; Q114-S118 VanDerWaalsContact O-CB 3.26Å; Q114-S118 WeakPolarHBondContact O-CB 3.04Å; Q114-S118 PolarHBondContact O-N 2.83Å; Q114-S118 PolarHBondContact O-OG 3.19Å; Q114-G434 PolarHBondContact OE1-O 2.9Å
115	T	90.1	Very high	77.3	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-45.5	177.3	-61.6	0	0	0	0	111.6	P111 H112 L113 S118 Q119 Y295 P407 L408 H436	P111-T115 WeakPolarHBondContact O-CB 3.42Å; P111-T115 PolarHBondContact O-N 3.31Å; P111-T115 PolarHBondContact O-OG1 3.24Å; H112-T115 PolarHBondContact O-N 2.62Å; L113-T115 PolarHBondContact O-N 3.02Å; T115-S118 PolarHBondContact O-OG 3.18Å; T115-Q119 WeakPolarHBondContact O-CB 3.33Å; T115-Q119 WeakPolarHBondContact O-CG 3.32Å; T115-Q119 PolarHBondContact O-N 3.14Å; T115-Y295 HydrophobicContact CG2-CE1 4.28Å; T115-P407 HydrophobicContact CG2-CG 4.26Å; T115-P407 WeakPolarHBondContact OG1-CD 3.44Å; T115-P407 WeakPolarHBondContact OG1-CG 3.19Å; T115-L408 HydrophobicContact CG2-CD1 3.99Å; T115-L408 HydrophobicContact CG2-CG 4.29Å; T115-H436 HydrophobicContact CG2-CB 3.76Å; T115-H436 PolarHBondContact OG1-N 3.49Å
116	V	87.3	Confident	76	Confident	53 Å²	53	55.8 Å²	55.8	32%	0.321	30%	0.297	S	S	.	.	H	α-helix	trans	-70.4	-39.7	-179.3	173.7	0	0	0	0	110.7	H112 L113 Q119 V120	H112-V116 WeakPolarHBondContact O-CB 3.45Å; H112-V116 VanDerWaalsContact O-CG2 3.32Å; H112-V116 WeakPolarHBondContact O-CG2 3.47Å; H112-V116 PolarHBondContact O-N 2.98Å; L113-V116 PolarHBondContact O-N 3.44Å; V116-Q119 PolarHBondContact O-N 3.18Å; V116-V120 HydrophobicContact CG1-CB 4.45Å; V116-V120 HydrophobicContact CG1-CG2 4.44Å; V116-V120 WeakPolarHBondContact O-CB 3.44Å; V116-V120 PolarHBondContact O-N 2.9Å
117	S	83.9	Confident	75.6	Confident	41 Å²	41	52.5 Å²	52.5	29%	0.287	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-36.7	179.5	72.1	0	0	0	0	112.5	L113 Q114 Q119 C121	L113-S117 VanDerWaalsContact O-CB 3.22Å; L113-S117 WeakPolarHBondContact O-CB 3.48Å; L113-S117 PolarHBondContact O-N 2.95Å; L113-S117 PolarHBondContact O-OG 3.27Å; L113-S117 VanDerWaalsContact O-OG 3.07Å; Q114-S117 PolarHBondContact O-OG 3.45Å; Q114-S117 VanDerWaalsContact O-OG 3.11Å; S117-Q119 VanDerWaalsContact C-N 3.31Å; S117-Q119 PolarHBondContact O-N 2.98Å; S117-C121 PolarHBondContact O-N 3.32Å
118	S	84.7	Confident	75.7	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-34.3	176.6	77.1	0	0	0	0	112.3	Q114 T115 H188 H436 C437	Q114-S118 VanDerWaalsContact O-CB 3.26Å; Q114-S118 WeakPolarHBondContact O-CB 3.04Å; Q114-S118 PolarHBondContact O-N 2.83Å; Q114-S118 PolarHBondContact O-OG 3.19Å; T115-S118 PolarHBondContact O-OG 3.18Å; S118-H188 VanDerWaalsContact O-CB 3.31Å; S118-H188 WeakPolarHBondContact O-CB 3.31Å; S118-H188 PolarHBondContact O-N 3.24Å; S118-H188 VanDerWaalsContact O-N 3.07Å; S118-H436 PolarHBondContact OG-O 3.46Å; S118-C437 WeakPolarHBondContact CB-O 3.37Å
119	Q	82.9	Confident	76	Confident	19 Å²	19	50 Å²	50	9%	0.089	29%	0.286	C	S	.	.	H	α-helix	trans	-93.9	-34	-174.1	-63	-52.4	-49.8	0	0	114.6	T115 V116 S117 Q180 W182 P187	T115-Q119 WeakPolarHBondContact O-CB 3.33Å; T115-Q119 WeakPolarHBondContact O-CG 3.32Å; T115-Q119 PolarHBondContact O-N 3.14Å; V116-Q119 PolarHBondContact O-N 3.18Å; S117-Q119 VanDerWaalsContact C-N 3.31Å; S117-Q119 PolarHBondContact O-N 2.98Å; Q119-Q180 VanDerWaalsContact NE2-NE2 3.11Å; Q119-W182 HydrophobicContact CB-CZ3 4.06Å; Q119-W182 HydrophobicContact CG-CH2 4.44Å; Q119-W182 HydrophobicContact CG-CZ3 3.92Å; Q119-P187 WeakPolarHBondContact O-CD 3.49Å
120	V	78.4	Confident	76.4	Confident	107 Å²	107	52.3 Å²	52.3	65%	0.648	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	-38.6	-167.1	-172.9	0	0	0	0	112.9	V116 G122	V116-V120 HydrophobicContact CG1-CB 4.45Å; V116-V120 HydrophobicContact CG1-CG2 4.44Å; V116-V120 WeakPolarHBondContact O-CB 3.44Å; V116-V120 PolarHBondContact O-N 2.9Å; V120-G122 PolarHBondContact O-N 3.02Å
121	C	67.6	Low	76.7	Confident	72 Å²	72	56.3 Å²	56.3	49%	0.486	32%	0.32	S	S	.	.			trans	-88.3	89.6	-174.3	-59.2	0	0	0	0	110.8	S117 R191	S117-C121 PolarHBondContact O-N 3.32Å; C121-R191 PolarHBondContact O-NH2 3.38Å
122	G	59.3	Low	76.9	Confident	22 Å²	22	60.3 Å²	60.3	23%	0.227	34%	0.335	C	S	.	.			trans	-100.1	127.2	171.8	0	0	0	0	0	112.5	V120 H124	V120-G122 PolarHBondContact O-N 3.02Å; G122-H124 PolarHBondContact O-ND1 3.19Å
123	E	53.5	Low	77.1	Confident	158 Å²	158	62.7 Å²	62.7	74%	0.738	35%	0.346	S	S	*	.			trans	-69.5	130	164.5	-65	-166.1	149.9	0	0	109.3
124	H	51	Low	77.5	Confident	176 Å²	176	65.8 Å²	65.8	82%	0.815	36%	0.359	S	S	*	.			trans	-90.6	-2.7	-174.7	-76.4	62.6	0	0	0	113.1	G122	G122-H124 PolarHBondContact O-ND1 3.19Å
125	A	41.2	Very low	77.8	Confident	78 Å²	78	66.7 Å²	66.7	65%	0.645	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	127.1	175.9	0	0	0	0	0	109
126	D	57.1	Low	78.1	Confident	69 Å²	69	72.4 Å²	72.4	37%	0.369	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	31.3	174.5	-70.7	6.6	0	0	0	118.4	I128 W152 K156 Q194	D126-I128 PolarHBondContact O-N 3.29Å; D126-W152 HydrophobicContact CB-CZ2 4.35Å; D126-K156 IonicContact OD2-NZ 3.2Å; D126-K156 PolarHBondContact OD2-NZ 3.01Å; D126-Q194 PolarHBondContact O-NE2 2.83Å
127	S	67.7	Low	78.3	Confident	56 Å²	56	70.2 Å²	70.2	39%	0.392	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-61.3	133.8	172.4	62.5	0	0	0	0	112.9	Q129	S127-Q129 PolarHBondContact O-N 3.37Å
128	I	79.1	Confident	78.5	Confident	19 Å²	19	75.4 Å²	75.4	10%	0.097	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-59.6	132.9	172.4	-80.4	178	0	0	0	109.5	D126 F130 A148 S193 Q194 A197	D126-I128 PolarHBondContact O-N 3.29Å; I128-F130 HydrophobicContact CB-CE2 4.17Å; I128-F130 HydrophobicContact CB-CZ 4.34Å; I128-F130 HydrophobicContact CG2-CD1 4.46Å; I128-F130 HydrophobicContact CG2-CD2 4.2Å; I128-F130 HydrophobicContact CG2-CE1 4.11Å; I128-F130 HydrophobicContact CG2-CE2 3.82Å; I128-F130 HydrophobicContact CG2-CZ 3.78Å; I128-F130 WeakPolarHBondContact O-CD2 3.3Å; I128-A148 HydrophobicContact CG2-CB 3.75Å; I128-S193 WeakPolarHBondContact CD1-O 3.37Å; I128-Q194 VanDerWaalsContact CD1-CA 3.44Å; I128-Q194 HydrophobicContact CD1-CB 4.21Å; I128-Q194 HydrophobicContact CD1-CG 3.79Å; I128-Q194 HydrophobicContact CG1-CG 3.74Å; I128-A197 HydrophobicContact CD1-CB 3.66Å
129	Q	86.7	Confident	78.5	Confident	120 Å²	120	75.8 Å²	75.8	56%	0.561	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-80.8	127.3	171	-68	-174.6	-5.4	0	0	110.7	S127 N149	S127-Q129 PolarHBondContact O-N 3.37Å; Q129-N149 HydrophobicContact CB-CB 4.39Å; Q129-N149 WeakPolarHBondContact O-CB 3.5Å; Q129-N149 PolarHBondContact O-N 2.92Å
130	F	90.9	Very high	78.7	Confident	52 Å²	52	76.6 Å²	76.6	23%	0.228	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.9	174.6	-66.2	-85.8	0	0	0	111.3	I128 D146 W147 A148 V205	I128-F130 HydrophobicContact CB-CE2 4.17Å; I128-F130 HydrophobicContact CB-CZ 4.34Å; I128-F130 HydrophobicContact CG2-CD1 4.46Å; I128-F130 HydrophobicContact CG2-CD2 4.2Å; I128-F130 HydrophobicContact CG2-CE1 4.11Å; I128-F130 HydrophobicContact CG2-CE2 3.82Å; I128-F130 HydrophobicContact CG2-CZ 3.78Å; I128-F130 WeakPolarHBondContact O-CD2 3.3Å; F130-D146 HydrophobicContact CB-CB 3.95Å; F130-D146 HydrophobicContact CD1-CB 4.05Å; F130-D146 HydrophobicContact CG-CB 4.22Å; F130-W147 CarbonylContact C-O 3.56Å; F130-W147 WeakPolarHBondContact CA-O 3.24Å; F130-A148 HydrophobicContact CD1-CB 4.23Å; F130-A148 HydrophobicContact CE1-CB 3.96Å; F130-V205 HydrophobicContact CD1-CG2 4.36Å; F130-V205 HydrophobicContact CE1-CG2 3.74Å; F130-V205 HydrophobicContact CZ-CG2 4.2Å
131	T	93.3	Very high	79.2	Confident	84 Å²	84	71.5 Å²	71.5	52%	0.515	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.4	169	-56.7	0	0	0	0	108.7	W147	T131-W147 PolarHBondContact N-O 2.95Å; T131-W147 PolarHBondContact O-N 3.4Å
132	R	94.1	Very high	80.5	Confident	91 Å²	91	69 Å²	69	34%	0.343	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	136.1	-179.7	-179.9	158.7	-69.4	171.7	0.3	112.4	A144 L145 D146 A212	R132-A144 HydrophobicContact CG-CB 4.23Å; R132-L145 CarbonylContact C-O 3.54Å; R132-L145 WeakPolarHBondContact CA-O 3.3Å; R132-D146 WeakPolarHBondContact CA-OD1 3.26Å; R132-D146 WeakPolarHBondContact CB-OD1 3.42Å; R132-D146 VanDerWaalsContact CG-OD1 3.27Å; R132-D146 WeakPolarHBondContact CG-OD1 3.44Å; R132-D146 IonicContact CZ-OD1 2.8Å; R132-D146 IonicContact CZ-OD2 2.85Å; R132-D146 IonicContact NE-OD1 2.76Å; R132-D146 PolarHBondContact NE-OD1 3.46Å; R132-D146 IonicContact NE-OD2 3.97Å; R132-D146 PolarHBondContact NE-OD2 3.42Å; R132-D146 IonicContact NH2-OD1 3.72Å; R132-D146 IonicContact NH2-OD2 3.43Å; R132-D146 PolarHBondContact NH2-OD2 3.34Å; R132-A212 PolarHBondContact NH1-O 2.78Å; R132-A212 PolarHBondContact NH2-O 3.08Å
133	E	94.9	Very high	82.1	Confident	52 Å²	52	68 Å²	68	24%	0.243	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.6	169.9	-175.4	172.5	-156.4	0	0	109.5	A144 L145 W147 Y236 R240	E133-A144 CarbonylContact O-C 3.56Å; E133-A144 WeakPolarHBondContact O-CA 3.48Å; E133-L145 PolarHBondContact N-O 3.43Å; E133-L145 PolarHBondContact O-N 2.9Å; E133-W147 PolarHBondContact OE2-NE1 3.09Å; E133-Y236 VanDerWaalsContact CD-OH 3.25Å; E133-Y236 PolarHBondContact OE1-OH 3.02Å; E133-Y236 PolarHBondContact OE2-OH 3.46Å; E133-R240 IonicContact OE1-NH1 3.48Å; E133-R240 PolarHBondContact OE1-NH1 3.42Å; E133-R240 IonicContact OE2-NH1 2.6Å; E133-R240 PolarHBondContact OE2-NH1 3.28Å
134	H	95.8	Very high	84.1	Confident	101 Å²	101	60.4 Å²	60.4	47%	0.468	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.3	175.7	-71.5	-69	0	0	0	110.1	V142 V143	H134-V142 HydrophobicContact CB-CG1 3.91Å; H134-V143 WeakPolarHBondContact CA-O 3.26Å
135	L	95.3	Very high	86.3	Confident	26 Å²	26	52 Å²	52	14%	0.136	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.8	178.3	-170.8	63.7	0	0	0	109.4	M137 V143 L145 A233 Y236	L135-M137 HydrophobicContact CB-CE 3.86Å; L135-M137 HydrophobicContact CD2-CE 3.49Å; L135-M137 VanDerWaalsContact CD2-CE 3.49Å; L135-M137 HydrophobicContact CG-CE 3.33Å; L135-V143 HydrophobicContact CB-CG2 3.86Å; L135-V143 HydrophobicContact CD2-CG2 4.47Å; L135-V143 PolarHBondContact N-O 2.87Å; L135-V143 PolarHBondContact O-N 3.21Å; L135-V143 VanDerWaalsContact O-N 3.08Å; L135-L145 HydrophobicContact CD2-CD1 4.38Å; L135-A233 HydrophobicContact CD2-CB 4.44Å; L135-Y236 HydrophobicContact CD1-CD1 4.15Å; L135-Y236 HydrophobicContact CD1-CD2 3.82Å; L135-Y236 HydrophobicContact CD1-CE1 4.45Å; L135-Y236 HydrophobicContact CD1-CE2 4.19Å; L135-Y236 HydrophobicContact CD1-CG 3.82Å; L135-Y236 HydrophobicContact CD2-CD1 4.11Å; L135-Y236 HydrophobicContact CD2-CG 3.93Å
136	L	94.9	Very high	88.9	Confident	123 Å²	123	48.9 Å²	48.9	64%	0.644	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	121.5	174.6	-176.3	68.6	0	0	0	109.5	G141 V142	L136-G141 WeakPolarHBondContact CA-O 2.81Å; L136-V142 HydrophobicContact CD1-CG2 4.14Å
137	M	91.8	Very high	90.6	Very high	6 Å²	6	47 Å²	47	3%	0.03	24%	0.239	C	C	.	.			trans	-80.4	157.8	177.9	-57.8	-66.1	89.2	0	0	111.1	L135 D139 G140 G141 V143 D229 Q232	L135-M137 HydrophobicContact CB-CE 3.86Å; L135-M137 HydrophobicContact CD2-CE 3.49Å; L135-M137 VanDerWaalsContact CD2-CE 3.49Å; L135-M137 HydrophobicContact CG-CE 3.33Å; M137-D139 WeakPolarHBondContact CB-OD1 3.33Å; M137-D139 PolarHBondContact O-N 2.88Å; M137-G140 PolarHBondContact O-N 2.98Å; M137-G141 WeakPolarHBondContact CB-O 3.15Å; M137-G141 PolarHBondContact N-O 3.19Å; M137-V143 HydrophobicContact CE-CG2 3.55Å; M137-V143 HydrophobicContact CG-CG1 4.19Å; M137-V143 HydrophobicContact CG-CG2 4.48Å; M137-V143 HydrophobicContact SD-CG1 4.19Å; M137-V143 HydrophobicContact SD-CG2 3.91Å; M137-D229 HydrophobicContact SD-CB 4.2Å; M137-Q232 HydrophobicContact CE-CB 4.1Å; M137-Q232 HydrophobicContact SD-CB 3.89Å
138	K	88.4	Confident	91.8	Very high	151 Å²	151	45 Å²	45	66%	0.657	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	178.6	-74.9	170.3	-175.8	174.5	0	114.7	Q232 T361	K138-Q232 VanDerWaalsContact CG-OE1 3.3Å; K138-T361 PolarHBondContact O-OG1 2.83Å
139	D	84.5	Confident	92	Very high	9 Å²	9	46.4 Å²	46.4	5%	0.048	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.6	179.2	75.9	-32.8	0	0	0	113.4	M137 G141 R209 R220 A364	M137-D139 WeakPolarHBondContact CB-OD1 3.33Å; M137-D139 PolarHBondContact O-N 2.88Å; D139-G141 VanDerWaalsContact C-N 3.35Å; D139-G141 PolarHBondContact OD1-N 3.21Å; D139-R209 VanDerWaalsContact CG-NH1 3.34Å; D139-R209 IonicContact OD1-CZ 2.68Å; D139-R209 IonicContact OD1-NH1 3.59Å; D139-R209 PolarHBondContact OD1-NH1 3.34Å; D139-R209 IonicContact OD1-NH2 2.71Å; D139-R209 PolarHBondContact OD1-NH2 2.92Å; D139-R209 IonicContact OD2-CZ 2.71Å; D139-R209 VanDerWaalsContact OD2-CZ 3.31Å; D139-R209 IonicContact OD2-NH1 3.44Å; D139-R209 PolarHBondContact OD2-NH1 2.84Å; D139-R209 IonicContact OD2-NH2 3.09Å; D139-R209 PolarHBondContact OD2-NH2 3.18Å; D139-R220 WeakPolarHBondContact OD2-CD 3.15Å; D139-R220 IonicContact OD2-NE 2.62Å; D139-A364 HydrophobicContact CB-CB 3.29Å
140	G	87.4	Confident	90.9	Very high	36 Å²	36	46.2 Å²	46.2	37%	0.371	23%	0.228	S	C	.	.	S	Bend	trans	87.9	0.4	-174.7	0	0	0	0	0	114.3	M137 T217	M137-G140 PolarHBondContact O-N 2.98Å; G140-T217 PolarHBondContact O-OG1 3.16Å
141	G	89.9	Confident	89	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.254	C	S	.	.			trans	-64	155	172	0	0	0	0	0	114.1	L136 M137 D139 T217	L136-G141 WeakPolarHBondContact CA-O 2.81Å; M137-G141 WeakPolarHBondContact CB-O 3.15Å; M137-G141 PolarHBondContact N-O 3.19Å; D139-G141 VanDerWaalsContact C-N 3.35Å; D139-G141 PolarHBondContact OD1-N 3.21Å; G141-T217 WeakPolarHBondContact CA-OG1 3.42Å
142	V	93.1	Very high	86.8	Confident	20 Å²	20	54.3 Å²	54.3	12%	0.121	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.8	173.1	-179.3	0	0	0	0	110.4	H134 L136 S214 P215 T217	H134-V142 HydrophobicContact CB-CG1 3.91Å; L136-V142 HydrophobicContact CD1-CG2 4.14Å; V142-S214 PolarHBondContact O-OG 2.9Å; V142-P215 HydrophobicContact CB-CG 4.33Å; V142-P215 HydrophobicContact CG1-CG 4.24Å; V142-T217 HydrophobicContact CB-CG2 4.24Å; V142-T217 HydrophobicContact CG2-CG2 3.67Å; V142-T217 PolarHBondContact N-OG1 3.23Å
143	V	94.7	Very high	84.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	163.6	168	-58.6	0	0	0	0	109.3	H134 L135 M137 F206 H207 R209 D229	H134-V143 WeakPolarHBondContact CA-O 3.26Å; L135-V143 HydrophobicContact CB-CG2 3.86Å; L135-V143 HydrophobicContact CD2-CG2 4.47Å; L135-V143 PolarHBondContact N-O 2.87Å; L135-V143 PolarHBondContact O-N 3.21Å; L135-V143 VanDerWaalsContact O-N 3.08Å; M137-V143 HydrophobicContact CE-CG2 3.55Å; M137-V143 HydrophobicContact CG-CG1 4.19Å; M137-V143 HydrophobicContact CG-CG2 4.48Å; M137-V143 HydrophobicContact SD-CG1 4.19Å; M137-V143 HydrophobicContact SD-CG2 3.91Å; V143-F206 HydrophobicContact CB-CE2 4.07Å; V143-F206 HydrophobicContact CG1-CE2 4.3Å; V143-F206 HydrophobicContact CG1-CZ 4.48Å; V143-F206 HydrophobicContact CG2-CE2 4.02Å; V143-H207 WeakPolarHBondContact CB-O 3.42Å; V143-R209 HydrophobicContact CG1-CG 3.82Å; V143-D229 HydrophobicContact CG1-CB 4.09Å
144	A	95.2	Very high	82.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	142.8	178.2	0	0	0	0	0	111.2	R132 E133 H207	R132-A144 HydrophobicContact CG-CB 4.23Å; E133-A144 CarbonylContact O-C 3.56Å; E133-A144 WeakPolarHBondContact O-CA 3.48Å; A144-H207 HydrophobicContact CB-CB 4.18Å; A144-H207 PolarHBondContact N-O 2.96Å; A144-H207 PolarHBondContact O-N 3.1Å
145	L	96.1	Very high	79.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.7	173	-65.8	178.5	0	0	0	108.7	R132 E133 L135 W147 V204 V205 F206 A233 Y236 V237	R132-L145 CarbonylContact C-O 3.54Å; R132-L145 WeakPolarHBondContact CA-O 3.3Å; E133-L145 PolarHBondContact N-O 3.43Å; E133-L145 PolarHBondContact O-N 2.9Å; L135-L145 HydrophobicContact CD2-CD1 4.38Å; L145-W147 HydrophobicContact CD1-CZ2 4.31Å; L145-V204 HydrophobicContact CB-CG1 4.29Å; L145-V204 HydrophobicContact CD2-CG1 4.27Å; L145-V205 CarbonylContact C-O 3.49Å; L145-V205 WeakPolarHBondContact CA-O 3.43Å; L145-F206 HydrophobicContact CD2-CB 4.08Å; L145-F206 HydrophobicContact CD2-CD2 3.83Å; L145-F206 HydrophobicContact CD2-CG 4.46Å; L145-A233 HydrophobicContact CD2-CB 4.27Å; L145-Y236 HydrophobicContact CD1-CD1 3.56Å; L145-Y236 HydrophobicContact CD1-CE1 3.95Å; L145-V237 HydrophobicContact CD1-CG2 4.21Å
146	D	95.1	Very high	77.5	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.059	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.7	179.6	-80.1	7	0	0	0	109.3	F130 R132 V204 V205 H207	F130-D146 HydrophobicContact CB-CB 3.95Å; F130-D146 HydrophobicContact CD1-CB 4.05Å; F130-D146 HydrophobicContact CG-CB 4.22Å; R132-D146 WeakPolarHBondContact CA-OD1 3.26Å; R132-D146 WeakPolarHBondContact CB-OD1 3.42Å; R132-D146 VanDerWaalsContact CG-OD1 3.27Å; R132-D146 WeakPolarHBondContact CG-OD1 3.44Å; R132-D146 IonicContact CZ-OD1 2.8Å; R132-D146 IonicContact CZ-OD2 2.85Å; R132-D146 IonicContact NE-OD1 2.76Å; R132-D146 PolarHBondContact NE-OD1 3.46Å; R132-D146 IonicContact NE-OD2 3.97Å; R132-D146 PolarHBondContact NE-OD2 3.42Å; R132-D146 IonicContact NH2-OD1 3.72Å; R132-D146 IonicContact NH2-OD2 3.43Å; R132-D146 PolarHBondContact NH2-OD2 3.34Å; D146-V204 CarbonylContact O-C 3.5Å; D146-V204 WeakPolarHBondContact O-CA 3.27Å; D146-V205 HydrophobicContact CB-CB 4.16Å; D146-V205 PolarHBondContact N-O 2.85Å; D146-V205 PolarHBondContact O-N 3.23Å; D146-H207 IonicContact OD2-CD2 2.66Å; D146-H207 IonicContact OD2-NE2 3.89Å; D146-H207 PolarHBondContact OD2-NE2 2.99Å
147	W	94.3	Very high	75.1	Confident	30 Å²	30	59 Å²	59	11%	0.114	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.7	-176.5	-60.5	88	0	0	0	110.7	F130 T131 E133 L145 N149 V204 Y236 V237 H241	F130-W147 CarbonylContact C-O 3.56Å; F130-W147 WeakPolarHBondContact CA-O 3.24Å; T131-W147 PolarHBondContact N-O 2.95Å; T131-W147 PolarHBondContact O-N 3.4Å; E133-W147 PolarHBondContact OE2-NE1 3.09Å; L145-W147 HydrophobicContact CD1-CZ2 4.31Å; W147-N149 PolarHBondContact O-N 3.13Å; W147-V204 HydrophobicContact CD2-CG1 4.08Å; W147-V204 HydrophobicContact CD2-CG2 4.07Å; W147-V204 HydrophobicContact CE3-CB 4.34Å; W147-V204 HydrophobicContact CE3-CG1 4.16Å; W147-V204 HydrophobicContact CE3-CG2 3.32Å; W147-V204 HydrophobicContact CH2-CG1 4.38Å; W147-V204 HydrophobicContact CH2-CG2 4.02Å; W147-V204 HydrophobicContact CZ2-CG1 4.34Å; W147-V204 HydrophobicContact CZ3-CB 4.45Å; W147-V204 HydrophobicContact CZ3-CG1 4.31Å; W147-V204 HydrophobicContact CZ3-CG2 3.29Å; W147-Y236 HydrophobicContact CZ2-CE1 4.16Å; W147-V237 HydrophobicContact CH2-CG1 4.35Å; W147-V237 HydrophobicContact CH2-CG2 4.03Å; W147-V237 HydrophobicContact CZ2-CG2 4.37Å; W147-H241 AromaticContact CH2-NE2 3.95Å; W147-H241 AromaticContact CZ3-CD2 3.87Å; W147-H241 AromaticContact CZ3-NE2 3.42Å; W147-H241 WeakPolarHBondContact CZ3-NE2 3.42Å
148	A	91.9	Very high	72.6	Confident	15 Å²	15	66.7 Å²	66.7	12%	0.124	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	130.6	175.7	0	0	0	0	0	111.2	I128 F130 R150 V203	I128-A148 HydrophobicContact CG2-CB 3.75Å; F130-A148 HydrophobicContact CD1-CB 4.23Å; F130-A148 HydrophobicContact CE1-CB 3.96Å; A148-R150 PolarHBondContact O-N 2.57Å; A148-V203 HydrophobicContact CB-CB 3.9Å; A148-V203 PolarHBondContact N-O 2.91Å
149	N	82.8	Confident	70.3	Confident	48 Å²	48	67.1 Å²	67.1	26%	0.257	31%	0.312	S	S	.	.			trans	-80.7	110.1	-176	-172.4	-1.3	0	0	0	112.3	Q129 W147 R151 W152	Q129-N149 HydrophobicContact CB-CB 4.39Å; Q129-N149 WeakPolarHBondContact O-CB 3.5Å; Q129-N149 PolarHBondContact O-N 2.92Å; W147-N149 PolarHBondContact O-N 3.13Å; N149-R151 PolarHBondContact O-N 3.23Å; N149-R151 VanDerWaalsContact O-N 3.16Å; N149-R151 WeakPolarHBondContact OD1-CB 3.28Å; N149-R151 PolarHBondContact OD1-N 3.47Å; N149-W152 PolarHBondContact O-N 2.89Å
150	R	63.9	Low	68.3	Low	115 Å²	115	69 Å²	69	43%	0.434	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.9	175.7	-75.6	-175.1	153.2	-142.5	-20.9	115.4	A148 W152 E153	A148-R150 PolarHBondContact O-N 2.57Å; R150-W152 PolarHBondContact O-N 3.37Å; R150-E153 WeakPolarHBondContact O-CB 3.3Å; R150-E153 PolarHBondContact O-N 2.99Å; R150-E153 VanDerWaalsContact O-N 3.08Å
151	R	52.4	Low	65.9	Low	207 Å²	207	71.5 Å²	71.5	78%	0.781	35%	0.351	S	S	*	.	H	α-helix	trans	-65.3	-22.2	-179.5	-72.2	-175.1	177.5	177.1	0.4	113.1	N149 E153	N149-R151 PolarHBondContact O-N 3.23Å; N149-R151 VanDerWaalsContact O-N 3.16Å; N149-R151 WeakPolarHBondContact OD1-CB 3.28Å; N149-R151 PolarHBondContact OD1-N 3.47Å; R151-E153 VanDerWaalsContact C-N 3.32Å
152	W	46.9	Very low	63.6	Low	100 Å²	100	76.4 Å²	76.4	38%	0.379	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-37.2	172.9	-176.6	-110.6	0	0	0	111.7	D126 N149 R150	D126-W152 HydrophobicContact CB-CZ2 4.35Å; N149-W152 PolarHBondContact O-N 2.89Å; R150-W152 PolarHBondContact O-N 3.37Å
153	E	48.7	Very low	61.1	Low	46 Å²	46	84.7 Å²	84.7	22%	0.215	42%	0.416	C	S	.	.	H	α-helix	trans	-72.2	-41	-174.8	-64	168.4	179.6	0	0	112.6	R150 R151 K155 K156 E157 A197	R150-E153 WeakPolarHBondContact O-CB 3.3Å; R150-E153 PolarHBondContact O-N 2.99Å; R150-E153 VanDerWaalsContact O-N 3.08Å; R151-E153 VanDerWaalsContact C-N 3.32Å; E153-K155 PolarHBondContact O-N 3.33Å; E153-K155 VanDerWaalsContact O-N 3.08Å; E153-K156 PolarHBondContact O-N 3.2Å; E153-E157 WeakPolarHBondContact O-CB 3.16Å; E153-E157 PolarHBondContact O-N 3.34Å; E153-A197 WeakPolarHBondContact OE1-CB 3.32Å
154	V	46.1	Very low	58.8	Low	85 Å²	85	86 Å²	86	52%	0.515	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-28.9	-178.3	-177.7	0	0	0	0	112.4
155	K	43.2	Very low	56.4	Low	162 Å²	162	91.4 Å²	91.4	70%	0.704	46%	0.455	S	S	*	.	H	α-helix	trans	-72.5	-33.3	176.9	-88.5	-173.9	172.8	-176.6	0	113.7	E153	E153-K155 PolarHBondContact O-N 3.33Å; E153-K155 VanDerWaalsContact O-N 3.08Å
156	K	45.7	Very low	53.9	Low	85 Å²	85	91.9 Å²	91.9	37%	0.37	46%	0.46	S	S	.	.	H	α-helix	trans	-89.8	-30.9	179	-113	178.3	171.4	175.3	0	111.5	D126 E153 Q158 Q159 S160 D456	D126-K156 IonicContact OD2-NZ 3.2Å; D126-K156 PolarHBondContact OD2-NZ 3.01Å; E153-K156 PolarHBondContact O-N 3.2Å; K156-Q158 VanDerWaalsContact C-N 3.29Å; K156-Q158 PolarHBondContact O-N 2.98Å; K156-Q159 WeakPolarHBondContact O-CB 3.27Å; K156-Q159 PolarHBondContact O-N 2.94Å; K156-S160 PolarHBondContact O-N 3.03Å; K156-D456 IonicContact NZ-OD2 2.73Å; K156-D456 PolarHBondContact NZ-OD2 3.36Å
157	E	45.4	Very low	51.4	Low	113 Å²	113	96.7 Å²	96.7	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-27.3	177.9	-136.6	176.1	-166.9	0	0	113.1	E153 Q159	E153-E157 WeakPolarHBondContact O-CB 3.16Å; E153-E157 PolarHBondContact O-N 3.34Å; E157-Q159 PolarHBondContact O-N 2.99Å
158	Q	39.3	Very low	49.2	Very low	167 Å²	167	100.4 Å²	100.4	78%	0.78	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-11.9	170.3	-82.2	-179.6	-27.8	0	0	113.9	K156	K156-Q158 VanDerWaalsContact C-N 3.29Å; K156-Q158 PolarHBondContact O-N 2.98Å
159	Q	40.1	Very low	47.2	Very low	161 Å²	161	101.7 Å²	101.7	75%	0.752	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-30.2	-177.5	-70.9	179.9	-26	0	0	113.6	K156 E157	K156-Q159 WeakPolarHBondContact O-CB 3.27Å; K156-Q159 PolarHBondContact O-N 2.94Å; E157-Q159 PolarHBondContact O-N 2.99Å
160	S	41.8	Very low	46.2	Very low	48 Å²	48	105.9 Å²	105.9	34%	0.336	55%	0.549	S	S	.	.			trans	-112.7	105.3	175.9	-173.9	0	0	0	0	109.4	K156 T162	K156-S160 PolarHBondContact O-N 3.03Å; S160-T162 PolarHBondContact O-N 3.34Å; S160-T162 PolarHBondContact OG-OG1 3.24Å; S160-T162 VanDerWaalsContact OG-OG1 3.1Å
161	G	36.8	Very low	46.9	Very low	88 Å²	88	102.4 Å²	102.4	91%	0.907	54%	0.541	S	S	*	.			trans	-66.2	26.3	-179	0	0	0	0	0	115.6
162	T	42.3	Very low	48.4	Very low	103 Å²	103	94.4 Å²	94.4	63%	0.632	52%	0.516	S	S	*	.			trans	-91.7	115.4	-177.1	-43	0	0	0	0	109	S160 A164	S160-T162 PolarHBondContact O-N 3.34Å; S160-T162 PolarHBondContact OG-OG1 3.24Å; S160-T162 VanDerWaalsContact OG-OG1 3.1Å; T162-A164 PolarHBondContact O-N 2.95Å
163	K	40.9	Very low	50.6	Low	194 Å²	194	90.5 Å²	90.5	84%	0.843	50%	0.504	S	S	*	.			trans	-58.3	109.5	175.3	-72.5	177.6	178.2	175.1	0	109.4	L165	K163-L165 PolarHBondContact O-N 3.42Å
164	A	45.4	Very low	52.8	Low	27 Å²	27	88.3 Å²	88.3	22%	0.223	49%	0.493	C	S	.	.			trans	-56.7	128.1	176.2	0	0	0	0	0	110.4	T162 G166 C167	T162-A164 PolarHBondContact O-N 2.95Å; A164-G166 PolarHBondContact O-N 3.32Å; A164-C167 PolarHBondContact O-SG 2.89Å
165	L	46.2	Very low	55.2	Low	114 Å²	114	84.3 Å²	84.3	60%	0.597	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	26.5	176.9	-81	106.6	0	0	0	113.2	K163 F168 R472	K163-L165 PolarHBondContact O-N 3.42Å; L165-F168 HydrophobicContact CB-CE2 4.39Å; L165-F168 HydrophobicContact CD2-CZ 4.42Å; L165-F168 WeakPolarHBondContact O-CD2 3.44Å; L165-F168 WeakPolarHBondContact O-CE2 3.29Å; L165-R472 PolarHBondContact O-NH2 2.83Å
166	G	42.4	Very low	57.9	Low	10 Å²	10	76.6 Å²	76.6	10%	0.103	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.9	174.9	0	0	0	0	0	114.4	A164 F168 Q199	A164-G166 PolarHBondContact O-N 3.32Å; G166-F168 PolarHBondContact O-N 2.82Å; G166-Q199 WeakPolarHBondContact CA-O 3.19Å; G166-Q199 PolarHBondContact N-O 3.37Å
167	C	42.9	Very low	60.3	Low	112 Å²	112	72.5 Å²	72.5	76%	0.757	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	26.1	-173.1	-63.4	0	0	0	0	114.9	A164 T169	A164-C167 PolarHBondContact O-SG 2.89Å; C167-T169 VanDerWaalsContact C-N 3.32Å; C167-T169 PolarHBondContact O-N 3.24Å
168	F	46.9	Very low	62.8	Low	109 Å²	109	67.1 Å²	67.1	48%	0.478	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.9	-173.5	-65.3	-64.5	0	0	0	114.5	L165 G166	L165-F168 HydrophobicContact CB-CE2 4.39Å; L165-F168 HydrophobicContact CD2-CZ 4.42Å; L165-F168 WeakPolarHBondContact O-CD2 3.44Å; L165-F168 WeakPolarHBondContact O-CE2 3.29Å; G166-F168 PolarHBondContact O-N 2.82Å
169	T	50.9	Low	65.4	Low	42 Å²	42	59.2 Å²	59.2	26%	0.258	36%	0.356	S	S	.	.	S	Bend	trans	-145.4	148.6	176.1	41.4	0	0	0	0	110.3	C167 T171 V245	C167-T169 VanDerWaalsContact C-N 3.32Å; C167-T169 PolarHBondContact O-N 3.24Å; T169-T171 WeakPolarHBondContact CB-O 3.33Å; T169-T171 PolarHBondContact O-N 3.28Å; T169-T171 PolarHBondContact OG1-O 3.06Å; T169-V245 HydrophobicContact CG2-CG2 4.36Å
170	S	61	Low	67.8	Low	135 Å²	135	51.8 Å²	51.8	94%	0.944	32%	0.321	S	S	*	.	S	Bend	trans	-57.7	-16.6	177	-171.3	0	0	0	0	113.2
171	T	79.5	Confident	69.6	Low	43 Å²	43	49.9 Å²	49.9	26%	0.264	31%	0.307	S	S	.	.	S	Bend	trans	-128.5	139.4	171.4	52.7	0	0	0	0	109.4	T169 S243	T169-T171 WeakPolarHBondContact CB-O 3.33Å; T169-T171 PolarHBondContact O-N 3.28Å; T169-T171 PolarHBondContact OG1-O 3.06Å; T171-S243 PolarHBondContact OG1-O 2.97Å
172	P	84.5	Confident	71.4	Confident	39 Å²	39	49.5 Å²	49.5	25%	0.253	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-60.6	139.3	-177.4	28.1	-38.2	0	0	0	112	S244	P172-S244 VanDerWaalsContact O-CB 3.23Å; P172-S244 WeakPolarHBondContact O-CB 3.48Å; P172-S244 PolarHBondContact O-OG 2.88Å
173	P	92	Very high	72.6	Confident	18 Å²	18	45.7 Å²	45.7	12%	0.117	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-65.2	142.7	173.8	27.9	-33.4	0	0	0	110.6	F201 S202 V245	P173-F201 HydrophobicContact CB-CD1 3.89Å; P173-F201 HydrophobicContact CB-CE1 3.97Å; P173-F201 HydrophobicContact CG-CD1 3.56Å; P173-F201 HydrophobicContact CG-CE1 3.71Å; P173-F201 HydrophobicContact CG-CG 4.21Å; P173-F201 HydrophobicContact CG-CZ 4.48Å; P173-F201 WeakPolarHBondContact O-CA 3.45Å; P173-S202 PolarHBondContact O-N 3.4Å; P173-V245 WeakPolarHBondContact CA-O 3.49Å; P173-V245 HydrophobicContact CB-CB 4.42Å
174	V	95.7	Very high	74.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.9	177	-179.1	0	0	0	0	108.8	S202 V204 V237 H241 V245 L246 V247	V174-S202 CarbonylContact C-O 3.54Å; V174-S202 WeakPolarHBondContact CA-O 3.27Å; V174-V204 HydrophobicContact CG1-CG2 3.87Å; V174-V237 HydrophobicContact CG1-CG1 3.67Å; V174-H241 HydrophobicContact CG2-CB 3.81Å; V174-V245 PolarHBondContact N-O 3.22Å; V174-L246 HydrophobicContact CB-CD1 3.61Å; V174-L246 HydrophobicContact CG1-CD1 3.52Å; V174-V247 WeakPolarHBondContact O-CG2 3.41Å; V174-V247 PolarHBondContact O-N 2.95Å
175	L	97.3	Very high	76.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	111.8	175.8	173.9	61.4	0	0	0	109.3	L177 A196 F201 S202 V203 V204 V247 V249 L468 L471	L175-L177 HydrophobicContact CD1-CD2 4.13Å; L175-L177 HydrophobicContact CD2-CD2 3.9Å; L175-L177 HydrophobicContact CD2-CG 4.45Å; L175-L177 HydrophobicContact CG-CD2 3.85Å; L175-L177 HydrophobicContact CG-CG 4.25Å; L175-A196 HydrophobicContact CD2-CB 3.4Å; L175-A196 VanDerWaalsContact CD2-CB 3.4Å; L175-F201 HydrophobicContact CB-CB 4.03Å; L175-F201 HydrophobicContact CB-CD1 3.97Å; L175-F201 HydrophobicContact CB-CG 4.28Å; L175-S202 PolarHBondContact N-O 2.96Å; L175-V203 HydrophobicContact CD2-CG2 4.41Å; L175-V204 PolarHBondContact O-N 3.46Å; L175-V247 HydrophobicContact CB-CG2 4.39Å; L175-V247 HydrophobicContact CD1-CG2 3.95Å; L175-V249 HydrophobicContact CD1-CB 4.26Å; L175-V249 HydrophobicContact CD1-CG2 3.62Å; L175-L468 HydrophobicContact CD2-CD2 3.97Å; L175-L471 HydrophobicContact CD1-CD1 4.01Å
176	L	98.1	Very high	78.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.6	174.1	-175.7	65.5	0	0	0	110.1	V204 F206 L230 V234 V247 A248 V249	L176-V204 CarbonylContact C-O 3.55Å; L176-V204 WeakPolarHBondContact CA-O 3.46Å; L176-V204 HydrophobicContact CD1-CB 4.27Å; L176-V204 HydrophobicContact CD1-CG1 4.31Å; L176-F206 HydrophobicContact CD1-CB 3.97Å; L176-L230 HydrophobicContact CD2-CD1 3.93Å; L176-V234 HydrophobicContact CD2-CG2 3.59Å; L176-V247 PolarHBondContact N-O 3.25Å; L176-A248 HydrophobicContact CB-CB 4.3Å; L176-A248 CarbonylContact O-C 3.58Å; L176-A248 WeakPolarHBondContact O-CA 3.46Å; L176-V249 PolarHBondContact O-N 3.34Å
177	L	97.6	Very high	80.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.3	176.9	-65.2	-175.3	0	0	0	110.5	L175 L189 L192 S193 V203 V204 V205 F206 V249	L175-L177 HydrophobicContact CD1-CD2 4.13Å; L175-L177 HydrophobicContact CD2-CD2 3.9Å; L175-L177 HydrophobicContact CD2-CG 4.45Å; L175-L177 HydrophobicContact CG-CD2 3.85Å; L175-L177 HydrophobicContact CG-CG 4.25Å; L177-L189 HydrophobicContact CB-CD1 4.1Å; L177-L189 HydrophobicContact CB-CD2 4.41Å; L177-L189 HydrophobicContact CB-CG 4.46Å; L177-L189 HydrophobicContact CD1-CD1 3.94Å; L177-L189 HydrophobicContact CD1-CG 4.03Å; L177-L189 HydrophobicContact CD2-CD1 4.29Å; L177-L189 HydrophobicContact CG-CD1 4.34Å; L177-L192 HydrophobicContact CD2-CD2 3.8Å; L177-L192 HydrophobicContact CD2-CG 4.38Å; L177-S193 WeakPolarHBondContact CD1-OG 3.42Å; L177-V203 HydrophobicContact CD1-CG1 3.47Å; L177-V203 VanDerWaalsContact CD1-CG1 3.47Å; L177-V203 HydrophobicContact CG-CG1 3.96Å; L177-V204 PolarHBondContact N-O 2.8Å; L177-V205 HydrophobicContact CB-CB 4.48Å; L177-V205 HydrophobicContact CB-CG1 4.47Å; L177-V205 HydrophobicContact CB-CG2 4.13Å; L177-V205 HydrophobicContact CD1-CG2 4.24Å; L177-V205 WeakPolarHBondContact O-CA 3.35Å; L177-F206 PolarHBondContact O-N 2.87Å; L177-V249 CarbonylContact C-O 3.59Å; L177-V249 VanDerWaalsContact CA-O 3.31Å; L177-V249 WeakPolarHBondContact CA-O 3.45Å; L177-V249 HydrophobicContact CD2-CB 3.8Å; L177-V249 HydrophobicContact CD2-CG1 4.49Å
178	V	96.4	Very high	83	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	104.2	175.9	-174.7	0	0	0	0	108.3	F206 L230 V249 S250 E251 G254 V257	V178-F206 HydrophobicContact CG1-CD1 4.47Å; V178-L230 HydrophobicContact CG2-CD1 4.27Å; V178-V249 PolarHBondContact N-O 3.17Å; V178-S250 CarbonylContact O-C 3.41Å; V178-S250 VanDerWaalsContact O-CA 3.28Å; V178-S250 WeakPolarHBondContact O-CA 3.34Å; V178-E251 PolarHBondContact O-N 2.97Å; V178-G254 WeakPolarHBondContact CG1-O 3.3Å; V178-V257 HydrophobicContact CG1-CG1 3.56Å
179	P	94.3	Very high	85.1	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.006	15%	0.145	C	C	.	.			trans	-72.5	171.6	-177.3	33.2	-34.6	0	0	0	111.4	L189 V205 F206 G254	P179-L189 HydrophobicContact CB-CD2 3.7Å; P179-V205 HydrophobicContact CG-CG1 4.2Å; P179-F206 WeakPolarHBondContact CD-O 3.39Å; P179-F206 WeakPolarHBondContact CG-O 3.3Å; P179-G254 WeakPolarHBondContact O-CA 3.49Å
180	Q	90.1	Very high	86.9	Confident	5 Å²	5	23.6 Å²	23.6	2%	0.023	15%	0.146	C	C	.	.			trans	-62.7	157.7	167.7	-61.4	-176.4	12.1	0	0	112.7	Q119 W182 G183 E251 H436	Q119-Q180 VanDerWaalsContact NE2-NE2 3.11Å; Q180-W182 PolarHBondContact O-N 3.2Å; Q180-G183 PolarHBondContact O-N 2.9Å; Q180-E251 HydrophobicContact CG-CB 4.32Å; Q180-E251 HydrophobicContact CG-CG 3.85Å; Q180-E251 VanDerWaalsContact CG-O 3.28Å; Q180-E251 WeakPolarHBondContact CG-O 3.16Å; Q180-H436 PolarHBondContact NE2-NE2 3.39Å
181	T	79.8	Confident	88.3	Confident	7 Å²	7	20 Å²	20	4%	0.043	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.4	-178.4	57.9	0	0	0	0	113.7	G183 E223 F224 S253 Q306	T181-G183 PolarHBondContact O-N 3.32Å; T181-E223 WeakPolarHBondContact CB-O 3.25Å; T181-E223 WeakPolarHBondContact CG2-O 3.42Å; T181-F224 HydrophobicContact CG2-CD1 4.21Å; T181-S253 WeakPolarHBondContact CG2-OG 3.3Å; T181-S253 PolarHBondContact N-OG 3.27Å; T181-S253 PolarHBondContact OG1-OG 3.36Å; T181-Q306 PolarHBondContact O-NE2 2.96Å
182	W	74.5	Confident	88.9	Confident	80 Å²	80	18 Å²	18	30%	0.303	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.2	167.7	-64.8	-2.9	0	0	0	112.3	Q119 Q180 V299 H302 Q306 L408	Q119-W182 HydrophobicContact CB-CZ3 4.06Å; Q119-W182 HydrophobicContact CG-CH2 4.44Å; Q119-W182 HydrophobicContact CG-CZ3 3.92Å; Q180-W182 PolarHBondContact O-N 3.2Å; W182-V299 HydrophobicContact CZ2-CG2 3.99Å; W182-H302 WeakPolarHBondContact CA-NE2 3.47Å; W182-H302 AromaticContact CD1-CD2 4Å; W182-H302 PolarHBondContact O-CE1 3.49Å; W182-H302 PolarHBondContact O-NE2 3.16Å; W182-H302 VanDerWaalsContact O-NE2 3.11Å; W182-Q306 PolarHBondContact O-NE2 2.86Å; W182-Q306 VanDerWaalsContact O-NE2 3.12Å; W182-L408 HydrophobicContact CH2-CD1 4.46Å
183	G	69.1	Low	89.3	Confident	23 Å²	23	16.1 Å²	16.1	24%	0.237	9%	0.088	C	C	.	.			trans	82	159.5	175.7	0	0	0	0	0	113.4	Q180 T181	Q180-G183 PolarHBondContact O-N 2.9Å; T181-G183 PolarHBondContact O-N 3.32Å
184	G	81.5	Confident	89.1	Confident	19 Å²	19	16.5 Å²	16.5	20%	0.196	9%	0.088	C	C	.	.	S	Bend	trans	78.7	-170.6	-172.8	0	0	0	0	0	112.4	H207	G184-H207 PolarHBondContact O-CE1 2.81Å
185	T	85.6	Confident	88.8	Confident	33 Å²	33	18.3 Å²	18.3	20%	0.202	10%	0.096	C	C	.	.			trans	-109.5	112.8	-179.9	-45.9	0	0	0	0	107.9	L189 Q190	T185-L189 HydrophobicContact CG2-CB 4.04Å; T185-L189 HydrophobicContact CG2-CD2 4.07Å; T185-L189 HydrophobicContact CG2-CG 4.26Å; T185-Q190 HydrophobicContact CG2-CG 3.51Å
186	T	88.8	Confident	88.5	Confident	15 Å²	15	18.3 Å²	18.3	9%	0.092	10%	0.096	C	C	.	.			trans	-67.8	158.7	177.2	63.1	0	0	0	0	110.6	H188 L189 Q190 E251	T186-H188 PolarHBondContact O-N 2.95Å; T186-L189 PolarHBondContact O-N 3.08Å; T186-L189 VanDerWaalsContact O-N 3.14Å; T186-L189 VanDerWaalsContact OG1-CB 3.29Å; T186-L189 WeakPolarHBondContact OG1-CB 3.35Å; T186-L189 PolarHBondContact OG1-N 3.15Å; T186-Q190 WeakPolarHBondContact O-CG 3.3Å; T186-Q190 PolarHBondContact O-N 3.06Å; T186-E251 WeakPolarHBondContact CG2-OE2 3.46Å; T186-E251 PolarHBondContact OG1-OE1 2.85Å; T186-E251 PolarHBondContact OG1-OE2 2.83Å
187	P	88.2	Confident	88.1	Confident	16 Å²	16	18.6 Å²	18.6	10%	0.104	10%	0.099	C	C	.	.	H	α-helix	trans	-53.3	-42.5	171.5	-27.1	36.1	0	0	0	112.8	Q119 L189 Q190 R191	Q119-P187 WeakPolarHBondContact O-CD 3.49Å; P187-L189 PolarHBondContact O-N 3.11Å; P187-Q190 PolarHBondContact O-N 2.99Å; P187-R191 WeakPolarHBondContact O-CG 3.4Å; P187-R191 PolarHBondContact O-N 3.16Å
188	H	90.8	Very high	87.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.4	-45.6	175.6	169.4	-94.3	0	0	0	112.5	S118 T186 Q190 R191 L192 E251 C437 H464	S118-H188 VanDerWaalsContact O-CB 3.31Å; S118-H188 WeakPolarHBondContact O-CB 3.31Å; S118-H188 PolarHBondContact O-N 3.24Å; S118-H188 VanDerWaalsContact O-N 3.07Å; T186-H188 PolarHBondContact O-N 2.95Å; H188-Q190 PolarHBondContact O-N 2.77Å; H188-R191 PolarHBondContact O-N 2.63Å; H188-L192 PolarHBondContact O-N 2.71Å; H188-E251 WeakPolarHBondContact CB-OE1 3.31Å; H188-E251 IonicContact CE1-OE1 2.76Å; H188-E251 IonicContact CG-OE1 3.62Å; H188-E251 IonicContact ND1-OE1 3.27Å; H188-E251 PolarHBondContact ND1-OE1 2.77Å; H188-C437 PolarHBondContact CD2-O 3Å; H188-C437 PolarHBondContact NE2-O 2.85Å; H188-H464 AromaticContact CD2-CE1 3.84Å; H188-H464 AromaticContact CD2-NE2 3.07Å; H188-H464 PolarHBondContact CD2-NE2 3.47Å; H188-H464 AromaticContact CE1-NE2 3.53Å; H188-H464 AromaticContact CG-NE2 3.78Å; H188-H464 AromaticContact NE2-CD2 3.54Å; H188-H464 AromaticContact NE2-NE2 2.88Å; H188-H464 PolarHBondContact NE2-NE2 3.19Å; H188-H464 PolarHBondContact O-CE1 2.88Å; H188-H464 VanDerWaalsContact O-CE1 3.23Å
189	L	90.7	Very high	87	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-32.3	177.8	-160.7	70.4	0	0	0	112.7	L177 P179 T185 T186 P187 L192 S193 V205 E251	L177-L189 HydrophobicContact CB-CD1 4.1Å; L177-L189 HydrophobicContact CB-CD2 4.41Å; L177-L189 HydrophobicContact CB-CG 4.46Å; L177-L189 HydrophobicContact CD1-CD1 3.94Å; L177-L189 HydrophobicContact CD1-CG 4.03Å; L177-L189 HydrophobicContact CD2-CD1 4.29Å; L177-L189 HydrophobicContact CG-CD1 4.34Å; P179-L189 HydrophobicContact CB-CD2 3.7Å; T185-L189 HydrophobicContact CG2-CB 4.04Å; T185-L189 HydrophobicContact CG2-CD2 4.07Å; T185-L189 HydrophobicContact CG2-CG 4.26Å; T186-L189 PolarHBondContact O-N 3.08Å; T186-L189 VanDerWaalsContact O-N 3.14Å; T186-L189 VanDerWaalsContact OG1-CB 3.29Å; T186-L189 WeakPolarHBondContact OG1-CB 3.35Å; T186-L189 PolarHBondContact OG1-N 3.15Å; P187-L189 PolarHBondContact O-N 3.11Å; L189-L192 HydrophobicContact CD1-CD2 4.31Å; L189-L192 PolarHBondContact O-N 2.68Å; L189-S193 WeakPolarHBondContact O-CB 3.4Å; L189-S193 PolarHBondContact O-N 3.49Å; L189-S193 PolarHBondContact O-OG 2.85Å; L189-V205 HydrophobicContact CD2-CG1 3.89Å; L189-E251 HydrophobicContact CD1-CB 4.28Å
190	Q	90.2	Very high	86.6	Confident	60 Å²	60	26.7 Å²	26.7	28%	0.28	14%	0.135	S	C	.	.	H	α-helix	trans	-63.5	-46.4	173.1	-72.2	179.7	-2.6	0	0	111.5	T185 T186 P187 H188 S193 Q194	T185-Q190 HydrophobicContact CG2-CG 3.51Å; T186-Q190 WeakPolarHBondContact O-CG 3.3Å; T186-Q190 PolarHBondContact O-N 3.06Å; P187-Q190 PolarHBondContact O-N 2.99Å; H188-Q190 PolarHBondContact O-N 2.77Å; Q190-S193 WeakPolarHBondContact O-CB 3.37Å; Q190-S193 PolarHBondContact O-N 3.16Å; Q190-Q194 WeakPolarHBondContact O-CG 3.43Å; Q190-Q194 PolarHBondContact O-N 3.28Å
191	R	89.6	Confident	86.6	Confident	59 Å²	59	26.8 Å²	26.8	22%	0.223	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175.4	-68.9	-172.6	-145.4	113.8	2.4	111.8	C121 P187 H188 S193 Q194 Q195	C121-R191 PolarHBondContact O-NH2 3.38Å; P187-R191 WeakPolarHBondContact O-CG 3.4Å; P187-R191 PolarHBondContact O-N 3.16Å; H188-R191 PolarHBondContact O-N 2.63Å; R191-S193 VanDerWaalsContact C-N 3.27Å; R191-S193 PolarHBondContact O-N 2.85Å; R191-Q194 WeakPolarHBondContact O-CB 3.41Å; R191-Q194 PolarHBondContact O-N 2.93Å; R191-Q194 VanDerWaalsContact O-N 3.14Å; R191-Q195 PolarHBondContact O-N 2.9Å
192	L	92.1	Very high	87.3	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-41.1	174.4	178.6	59.9	0	0	0	111.3	L177 H188 L189 Q195 A196 V249 I277 H464 L468	L177-L192 HydrophobicContact CD2-CD2 3.8Å; L177-L192 HydrophobicContact CD2-CG 4.38Å; H188-L192 PolarHBondContact O-N 2.71Å; L189-L192 HydrophobicContact CD1-CD2 4.31Å; L189-L192 PolarHBondContact O-N 2.68Å; L192-Q195 PolarHBondContact O-N 3.45Å; L192-A196 VanDerWaalsContact O-CB 3.22Å; L192-A196 WeakPolarHBondContact O-CB 3.39Å; L192-A196 PolarHBondContact O-N 3.32Å; L192-V249 HydrophobicContact CD2-CB 4.44Å; L192-V249 HydrophobicContact CD2-CG1 3.85Å; L192-I277 HydrophobicContact CD2-CD1 4.44Å; L192-H464 HydrophobicContact CD1-CB 3.8Å; L192-H464 PolarHBondContact N-CE1 2.88Å; L192-H464 VanDerWaalsContact N-CE1 3.35Å; L192-H464 PolarHBondContact N-ND1 3.05Å; L192-L468 HydrophobicContact CD1-CD1 4.13Å; L192-L468 HydrophobicContact CD1-CD2 4.38Å; L192-L468 HydrophobicContact CD1-CG 4.15Å
193	S	92.3	Very high	88.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-43.6	176.3	-58.1	0	0	0	0	111.3	I128 L177 L189 Q190 R191 A196 A197	I128-S193 WeakPolarHBondContact CD1-O 3.37Å; L177-S193 WeakPolarHBondContact CD1-OG 3.42Å; L189-S193 WeakPolarHBondContact O-CB 3.4Å; L189-S193 PolarHBondContact O-N 3.49Å; L189-S193 PolarHBondContact O-OG 2.85Å; Q190-S193 WeakPolarHBondContact O-CB 3.37Å; Q190-S193 PolarHBondContact O-N 3.16Å; R191-S193 VanDerWaalsContact C-N 3.27Å; R191-S193 PolarHBondContact O-N 2.85Å; S193-A196 PolarHBondContact O-N 2.91Å; S193-A197 WeakPolarHBondContact O-CB 3.26Å; S193-A197 PolarHBondContact O-N 2.71Å
194	Q	89.2	Confident	89.6	Confident	26 Å²	26	22.4 Å²	22.4	12%	0.121	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-47.2	176.4	-75.3	164.8	-17	0	0	111.8	D126 I128 Q190 R191 A197 R198	D126-Q194 PolarHBondContact O-NE2 2.83Å; I128-Q194 VanDerWaalsContact CD1-CA 3.44Å; I128-Q194 HydrophobicContact CD1-CB 4.21Å; I128-Q194 HydrophobicContact CD1-CG 3.79Å; I128-Q194 HydrophobicContact CG1-CG 3.74Å; Q190-Q194 WeakPolarHBondContact O-CG 3.43Å; Q190-Q194 PolarHBondContact O-N 3.28Å; R191-Q194 WeakPolarHBondContact O-CB 3.41Å; R191-Q194 PolarHBondContact O-N 2.93Å; R191-Q194 VanDerWaalsContact O-N 3.14Å; Q194-A197 WeakPolarHBondContact O-CB 3.22Å; Q194-A197 PolarHBondContact O-N 3.41Å; Q194-R198 VanDerWaalsContact O-CG 3.3Å; Q194-R198 WeakPolarHBondContact O-CG 3.42Å; Q194-R198 PolarHBondContact O-N 3.11Å
195	Q	89.3	Confident	90.3	Very high	38 Å²	38	21.5 Å²	21.5	18%	0.178	11%	0.105	C	C	.	.	H	α-helix	trans	-64.9	-43.2	178.7	-171.4	174	-36.3	0	0	111.6	R191 L192 R198 Q199 L468	R191-Q195 PolarHBondContact O-N 2.9Å; L192-Q195 PolarHBondContact O-N 3.45Å; Q195-R198 PolarHBondContact O-N 3.18Å; Q195-Q199 VanDerWaalsContact O-CB 3.27Å; Q195-Q199 WeakPolarHBondContact O-CB 3.19Å; Q195-Q199 VanDerWaalsContact O-CG 3.27Å; Q195-Q199 WeakPolarHBondContact O-CG 3.24Å; Q195-Q199 PolarHBondContact O-N 3.32Å; Q195-L468 HydrophobicContact CB-CD1 4.18Å; Q195-L468 HydrophobicContact CG-CD1 3.78Å
196	A	91	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.8	-41.9	177.3	0	0	0	0	0	112.5	L175 L192 S193 Q199 G200 F201 V203 L468	L175-A196 HydrophobicContact CD2-CB 3.4Å; L175-A196 VanDerWaalsContact CD2-CB 3.4Å; L192-A196 VanDerWaalsContact O-CB 3.22Å; L192-A196 WeakPolarHBondContact O-CB 3.39Å; L192-A196 PolarHBondContact O-N 3.32Å; S193-A196 PolarHBondContact O-N 2.91Å; A196-Q199 CarbonylContact O-C 3.57Å; A196-Q199 WeakPolarHBondContact O-CA 3.33Å; A196-Q199 WeakPolarHBondContact O-CB 3.39Å; A196-Q199 PolarHBondContact O-N 2.81Å; A196-Q199 VanDerWaalsContact O-N 3.11Å; A196-G200 PolarHBondContact O-N 2.78Å; A196-F201 HydrophobicContact CB-CB 4.17Å; A196-F201 HydrophobicContact CB-CD2 4.3Å; A196-F201 HydrophobicContact CB-CG 4.49Å; A196-F201 WeakPolarHBondContact O-CB 3.23Å; A196-F201 WeakPolarHBondContact O-CD2 3.31Å; A196-F201 PolarHBondContact O-N 3.05Å; A196-V203 HydrophobicContact CB-CG2 3.75Å; A196-L468 HydrophobicContact CB-CD1 4.2Å; A196-L468 HydrophobicContact CB-CD2 3.88Å
197	A	89	Confident	91	Very high	6 Å²	6	19.2 Å²	19.2	5%	0.05	9%	0.091	C	C	.	.	H	α-helix	trans	-57.3	-51.4	173.9	0	0	0	0	0	112	I128 E153 S193 Q194 Q199 G200	I128-A197 HydrophobicContact CD1-CB 3.66Å; E153-A197 WeakPolarHBondContact OE1-CB 3.32Å; S193-A197 WeakPolarHBondContact O-CB 3.26Å; S193-A197 PolarHBondContact O-N 2.71Å; Q194-A197 WeakPolarHBondContact O-CB 3.22Å; Q194-A197 PolarHBondContact O-N 3.41Å; A197-Q199 PolarHBondContact O-N 3.14Å; A197-Q199 VanDerWaalsContact O-N 3.15Å; A197-G200 WeakPolarHBondContact O-CA 3.22Å; A197-G200 PolarHBondContact O-N 2.92Å
198	R	85.8	Confident	91.1	Very high	119 Å²	119	19 Å²	19	45%	0.449	9%	0.088	S	C	.	.	H	α-helix	trans	-59.7	-27	174.7	-68.8	175.2	-170.6	171.3	7.5	112.8	Q194 Q195 G200 D458	Q194-R198 VanDerWaalsContact O-CG 3.3Å; Q194-R198 WeakPolarHBondContact O-CG 3.42Å; Q194-R198 PolarHBondContact O-N 3.11Å; Q195-R198 PolarHBondContact O-N 3.18Å; R198-G200 VanDerWaalsContact C-N 3.28Å; R198-D458 IonicContact CZ-OD2 2.72Å; R198-D458 IonicContact NH1-OD2 3.3Å; R198-D458 PolarHBondContact NH1-OD2 3.31Å; R198-D458 IonicContact NH2-OD2 3.15Å; R198-D458 PolarHBondContact NH2-OD2 3.39Å
199	Q	85.8	Confident	91.1	Very high	36 Å²	36	20.2 Å²	20.2	17%	0.168	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	3.8	175.4	-80.9	-167.5	31.6	0	0	114	G166 Q195 A196 A197 F201 R472	G166-Q199 WeakPolarHBondContact CA-O 3.19Å; G166-Q199 PolarHBondContact N-O 3.37Å; Q195-Q199 VanDerWaalsContact O-CB 3.27Å; Q195-Q199 WeakPolarHBondContact O-CB 3.19Å; Q195-Q199 VanDerWaalsContact O-CG 3.27Å; Q195-Q199 WeakPolarHBondContact O-CG 3.24Å; Q195-Q199 PolarHBondContact O-N 3.32Å; A196-Q199 CarbonylContact O-C 3.57Å; A196-Q199 WeakPolarHBondContact O-CA 3.33Å; A196-Q199 WeakPolarHBondContact O-CB 3.39Å; A196-Q199 PolarHBondContact O-N 2.81Å; A196-Q199 VanDerWaalsContact O-N 3.11Å; A197-Q199 PolarHBondContact O-N 3.14Å; A197-Q199 VanDerWaalsContact O-N 3.15Å; Q199-F201 HydrophobicContact CB-CD2 3.93Å; Q199-F201 HydrophobicContact CB-CE2 4.12Å; Q199-R472 VanDerWaalsContact CG-NH2 3.27Å; Q199-R472 PolarHBondContact O-NH2 2.84Å; Q199-R472 VanDerWaalsContact O-NH2 3.08Å; Q199-R472 VanDerWaalsContact OE1-NH2 3.1Å
200	G	85.9	Confident	91	Very high	16 Å²	16	20.7 Å²	20.7	17%	0.165	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	12.2	174.4	0	0	0	0	0	115.6	A196 A197 R198	A196-G200 PolarHBondContact O-N 2.78Å; A197-G200 WeakPolarHBondContact O-CA 3.22Å; A197-G200 PolarHBondContact O-N 2.92Å; R198-G200 VanDerWaalsContact C-N 3.28Å
201	F	90.6	Very high	90.9	Very high	8 Å²	8	18.4 Å²	18.4	4%	0.035	9%	0.089	C	C	.	.			trans	-75.4	140.9	173.6	-69.8	-92.2	0	0	0	111.2	P173 L175 A196 Q199 V203 V247 L468 R472	P173-F201 HydrophobicContact CB-CD1 3.89Å; P173-F201 HydrophobicContact CB-CE1 3.97Å; P173-F201 HydrophobicContact CG-CD1 3.56Å; P173-F201 HydrophobicContact CG-CE1 3.71Å; P173-F201 HydrophobicContact CG-CG 4.21Å; P173-F201 HydrophobicContact CG-CZ 4.48Å; P173-F201 WeakPolarHBondContact O-CA 3.45Å; L175-F201 HydrophobicContact CB-CB 4.03Å; L175-F201 HydrophobicContact CB-CD1 3.97Å; L175-F201 HydrophobicContact CB-CG 4.28Å; A196-F201 HydrophobicContact CB-CB 4.17Å; A196-F201 HydrophobicContact CB-CD2 4.3Å; A196-F201 HydrophobicContact CB-CG 4.49Å; A196-F201 WeakPolarHBondContact O-CB 3.23Å; A196-F201 WeakPolarHBondContact O-CD2 3.31Å; A196-F201 PolarHBondContact O-N 3.05Å; Q199-F201 HydrophobicContact CB-CD2 3.93Å; Q199-F201 HydrophobicContact CB-CE2 4.12Å; F201-V203 HydrophobicContact CB-CG2 4.36Å; F201-V203 PolarHBondContact O-N 3.49Å; F201-V247 HydrophobicContact CD1-CG2 4.42Å; F201-V247 HydrophobicContact CE1-CG2 4.08Å; F201-L468 HydrophobicContact CD2-CD2 4.38Å; F201-L468 HydrophobicContact CE2-CD2 4.11Å; F201-R472 HydrophobicContact CE2-CG 4.47Å; F201-R472 HydrophobicContact CZ-CG 3.95Å
202	S	92.9	Very high	90.6	Very high	16 Å²	16	17.1 Å²	17.1	11%	0.112	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	102.6	164.6	-173.7	0	0	0	0	108.7	P173 V174 L175	P173-S202 PolarHBondContact O-N 3.4Å; V174-S202 CarbonylContact C-O 3.54Å; V174-S202 WeakPolarHBondContact CA-O 3.27Å; L175-S202 PolarHBondContact N-O 2.96Å
203	V	95.3	Very high	90.2	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.012	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	134.2	-174.2	-174.9	0	0	0	0	111.6	A148 L175 L177 A196 F201	A148-V203 HydrophobicContact CB-CB 3.9Å; A148-V203 PolarHBondContact N-O 2.91Å; L175-V203 HydrophobicContact CD2-CG2 4.41Å; L177-V203 HydrophobicContact CD1-CG1 3.47Å; L177-V203 VanDerWaalsContact CD1-CG1 3.47Å; L177-V203 HydrophobicContact CG-CG1 3.96Å; A196-V203 HydrophobicContact CB-CG2 3.75Å; F201-V203 HydrophobicContact CB-CG2 4.36Å; F201-V203 PolarHBondContact O-N 3.49Å
204	V	96.2	Very high	89.9	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.7	176.4	-169.9	0	0	0	0	108.7	L145 D146 W147 V174 L175 L176 L177	L145-V204 HydrophobicContact CB-CG1 4.29Å; L145-V204 HydrophobicContact CD2-CG1 4.27Å; D146-V204 CarbonylContact O-C 3.5Å; D146-V204 WeakPolarHBondContact O-CA 3.27Å; W147-V204 HydrophobicContact CD2-CG1 4.08Å; W147-V204 HydrophobicContact CD2-CG2 4.07Å; W147-V204 HydrophobicContact CE3-CB 4.34Å; W147-V204 HydrophobicContact CE3-CG1 4.16Å; W147-V204 HydrophobicContact CE3-CG2 3.32Å; W147-V204 HydrophobicContact CH2-CG1 4.38Å; W147-V204 HydrophobicContact CH2-CG2 4.02Å; W147-V204 HydrophobicContact CZ2-CG1 4.34Å; W147-V204 HydrophobicContact CZ3-CB 4.45Å; W147-V204 HydrophobicContact CZ3-CG1 4.31Å; W147-V204 HydrophobicContact CZ3-CG2 3.29Å; V174-V204 HydrophobicContact CG1-CG2 3.87Å; L175-V204 PolarHBondContact O-N 3.46Å; L176-V204 CarbonylContact C-O 3.55Å; L176-V204 WeakPolarHBondContact CA-O 3.46Å; L176-V204 HydrophobicContact CD1-CB 4.27Å; L176-V204 HydrophobicContact CD1-CG1 4.31Å; L177-V204 PolarHBondContact N-O 2.8Å
205	V	96.3	Very high	89.8	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.8	175.6	-171.9	0	0	0	0	109.6	F130 L145 D146 L177 P179 L189	F130-V205 HydrophobicContact CD1-CG2 4.36Å; F130-V205 HydrophobicContact CE1-CG2 3.74Å; F130-V205 HydrophobicContact CZ-CG2 4.2Å; L145-V205 CarbonylContact C-O 3.49Å; L145-V205 WeakPolarHBondContact CA-O 3.43Å; D146-V205 HydrophobicContact CB-CB 4.16Å; D146-V205 PolarHBondContact N-O 2.85Å; D146-V205 PolarHBondContact O-N 3.23Å; L177-V205 HydrophobicContact CB-CB 4.48Å; L177-V205 HydrophobicContact CB-CG1 4.47Å; L177-V205 HydrophobicContact CB-CG2 4.13Å; L177-V205 HydrophobicContact CD1-CG2 4.24Å; L177-V205 WeakPolarHBondContact O-CA 3.35Å; P179-V205 HydrophobicContact CG-CG1 4.2Å; L189-V205 HydrophobicContact CD2-CG1 3.89Å
206	F	96.1	Very high	89.8	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	119.6	176.9	168.2	-101.8	0	0	0	111	V143 L145 L176 L177 V178 P179 H208 D229 L230 A233	V143-F206 HydrophobicContact CB-CE2 4.07Å; V143-F206 HydrophobicContact CG1-CE2 4.3Å; V143-F206 HydrophobicContact CG1-CZ 4.48Å; V143-F206 HydrophobicContact CG2-CE2 4.02Å; L145-F206 HydrophobicContact CD2-CB 4.08Å; L145-F206 HydrophobicContact CD2-CD2 3.83Å; L145-F206 HydrophobicContact CD2-CG 4.46Å; L176-F206 HydrophobicContact CD1-CB 3.97Å; L177-F206 PolarHBondContact O-N 2.87Å; V178-F206 HydrophobicContact CG1-CD1 4.47Å; P179-F206 WeakPolarHBondContact CD-O 3.39Å; P179-F206 WeakPolarHBondContact CG-O 3.3Å; F206-H208 AromaticContact CE1-CE1 3.86Å; F206-H208 AromaticContact CE1-ND1 3.68Å; F206-D229 HydrophobicContact CZ-CB 4Å; F206-L230 HydrophobicContact CD1-CD1 3.85Å; F206-L230 HydrophobicContact CE1-CB 4.24Å; F206-L230 HydrophobicContact CE1-CD1 4.03Å; F206-L230 HydrophobicContact CG-CD1 4.11Å; F206-L230 HydrophobicContact CZ-CB 4.31Å; F206-L230 HydrophobicContact CZ-CD1 4.45Å; F206-A233 HydrophobicContact CD2-CB 3.55Å; F206-A233 HydrophobicContact CE2-CB 3.59Å
207	H	94	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.1	177.1	-63.8	-65.2	0	0	0	111.7	V143 A144 D146 G184 A212	V143-H207 WeakPolarHBondContact CB-O 3.42Å; A144-H207 HydrophobicContact CB-CB 4.18Å; A144-H207 PolarHBondContact N-O 2.96Å; A144-H207 PolarHBondContact O-N 3.1Å; D146-H207 IonicContact OD2-CD2 2.66Å; D146-H207 IonicContact OD2-NE2 3.89Å; D146-H207 PolarHBondContact OD2-NE2 2.99Å; G184-H207 PolarHBondContact O-CE1 2.81Å; H207-A212 HydrophobicContact CB-CB 4.03Å
208	H	90.8	Very high	89.4	Confident	11 Å²	11	25.2 Å²	25.2	5%	0.051	16%	0.157	C	C	.	.			trans	-62.5	161.6	175.5	-57.9	-72.7	0	0	0	113	F206 G210 T211	F206-H208 AromaticContact CE1-CE1 3.86Å; F206-H208 AromaticContact CE1-ND1 3.68Å; H208-G210 PolarHBondContact O-N 3.34Å; H208-T211 HydrophobicContact CB-CG2 3.99Å; H208-T211 PolarHBondContact N-OG1 2.76Å; H208-T211 PolarHBondContact O-N 2.8Å; H208-T211 PolarHBondContact O-OG1 3.14Å
209	R	90.8	Very high	89.2	Confident	25 Å²	25	20.9 Å²	20.9	9%	0.094	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	136.7	173.6	-57.6	-179.5	-176.4	-135.3	-4.1	111.2	D139 V143 T211 L216 T218 D229	D139-R209 VanDerWaalsContact CG-NH1 3.34Å; D139-R209 IonicContact OD1-CZ 2.68Å; D139-R209 IonicContact OD1-NH1 3.59Å; D139-R209 PolarHBondContact OD1-NH1 3.34Å; D139-R209 IonicContact OD1-NH2 2.71Å; D139-R209 PolarHBondContact OD1-NH2 2.92Å; D139-R209 IonicContact OD2-CZ 2.71Å; D139-R209 VanDerWaalsContact OD2-CZ 3.31Å; D139-R209 IonicContact OD2-NH1 3.44Å; D139-R209 PolarHBondContact OD2-NH1 2.84Å; D139-R209 IonicContact OD2-NH2 3.09Å; D139-R209 PolarHBondContact OD2-NH2 3.18Å; V143-R209 HydrophobicContact CG1-CG 3.82Å; R209-T211 PolarHBondContact O-N 3.04Å; R209-T211 VanDerWaalsContact O-N 3.11Å; R209-L216 HydrophobicContact CB-CD1 3.93Å; R209-T218 PolarHBondContact NH1-OG1 2.89Å; R209-D229 WeakPolarHBondContact CD-OD2 3.22Å; R209-D229 WeakPolarHBondContact CG-OD2 3.46Å; R209-D229 IonicContact CZ-OD1 3.83Å; R209-D229 IonicContact CZ-OD2 3.62Å; R209-D229 IonicContact NE-OD1 3.06Å; R209-D229 PolarHBondContact NE-OD1 2.81Å; R209-D229 IonicContact NE-OD2 3.38Å; R209-D229 PolarHBondContact NE-OD2 2.89Å; R209-D229 IonicContact NH2-OD1 3.31Å; R209-D229 PolarHBondContact NH2-OD1 2.95Å; R209-D229 IonicContact NH2-OD2 2.85Å
210	G	87.5	Confident	88.9	Confident	12 Å²	12	20.4 Å²	20.4	12%	0.124	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	0.6	176.7	0	0	0	0	0	115.8	H208 S214 Y310	H208-G210 PolarHBondContact O-N 3.34Å; G210-S214 CarbonylContact C-O 3.54Å; G210-S214 WeakPolarHBondContact CA-O 3.18Å; G210-Y310 PolarHBondContact O-OH 2.93Å
211	T	87.7	Confident	88.6	Confident	12 Å²	12	21 Å²	21	7%	0.074	14%	0.142	C	C	.	.	S	Bend	trans	-103.8	163	179.7	72.4	0	0	0	0	112	H208 R209 G213 S214	H208-T211 HydrophobicContact CB-CG2 3.99Å; H208-T211 PolarHBondContact N-OG1 2.76Å; H208-T211 PolarHBondContact O-N 2.8Å; H208-T211 PolarHBondContact O-OG1 3.14Å; R209-T211 PolarHBondContact O-N 3.04Å; R209-T211 VanDerWaalsContact O-N 3.11Å; T211-G213 PolarHBondContact O-N 2.88Å; T211-S214 VanDerWaalsContact O-CB 3.27Å; T211-S214 WeakPolarHBondContact O-CB 3.36Å; T211-S214 PolarHBondContact O-N 2.87Å
212	A	84.8	Confident	88	Confident	32 Å²	32	22.5 Å²	22.5	26%	0.264	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	11.3	176.6	0	0	0	0	0	115.9	R132 H207	R132-A212 PolarHBondContact NH1-O 2.78Å; R132-A212 PolarHBondContact NH2-O 3.08Å; H207-A212 HydrophobicContact CB-CB 4.03Å
213	G	83.3	Confident	87.4	Confident	64 Å²	64	22 Å²	22	66%	0.66	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.8	2.4	-172.3	0	0	0	0	0	114.4	T211	T211-G213 PolarHBondContact O-N 2.88Å
214	S	86.4	Confident	87	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.007	15%	0.152	C	C	.	.			trans	-69.2	135.6	167.4	-168.3	0	0	0	0	110.4	V142 G210 T211	V142-S214 PolarHBondContact O-OG 2.9Å; G210-S214 CarbonylContact C-O 3.54Å; G210-S214 WeakPolarHBondContact CA-O 3.18Å; T211-S214 VanDerWaalsContact O-CB 3.27Å; T211-S214 WeakPolarHBondContact O-CB 3.36Å; T211-S214 PolarHBondContact O-N 2.87Å
215	P	87.3	Confident	86.4	Confident	62 Å²	62	23.6 Å²	23.6	40%	0.403	16%	0.162	S	C	.	.			trans	-68.8	145.1	177.5	28.7	-34.4	0	0	0	111.7	V142 T217	V142-P215 HydrophobicContact CB-CG 4.33Å; V142-P215 HydrophobicContact CG1-CG 4.24Å; P215-T217 HydrophobicContact CB-CG2 4.28Å; P215-T217 HydrophobicContact CG-CG2 4.27Å; P215-T217 PolarHBondContact O-N 3.04Å
216	L	88.4	Confident	86	Confident	25 Å²	25	24.2 Å²	24.2	13%	0.131	17%	0.165	C	C	.	.			trans	-89.5	93.2	168.5	-172.8	64.9	0	0	0	109.6	R209 T218 I221 Y310 L314	R209-L216 HydrophobicContact CB-CD1 3.93Å; L216-T218 VanDerWaalsContact CD1-O 3.32Å; L216-T218 WeakPolarHBondContact CD1-O 3.22Å; L216-T218 WeakPolarHBondContact CG-O 3.5Å; L216-I221 HydrophobicContact CD2-CD1 4.44Å; L216-I221 HydrophobicContact CD2-CG1 4.09Å; L216-Y310 HydrophobicContact CB-CD1 3.84Å; L216-Y310 HydrophobicContact CB-CD2 4.29Å; L216-Y310 HydrophobicContact CB-CE1 3.55Å; L216-Y310 HydrophobicContact CB-CE2 4.02Å; L216-Y310 HydrophobicContact CB-CG 4.2Å; L216-Y310 HydrophobicContact CD2-CD1 4.18Å; L216-Y310 HydrophobicContact CD2-CD2 3.76Å; L216-Y310 HydrophobicContact CD2-CE2 4.2Å; L216-Y310 HydrophobicContact CD2-CG 3.74Å; L216-L314 HydrophobicContact CD2-CD1 4.22Å; L216-L314 HydrophobicContact CD2-CD2 4.41Å
217	T	87.2	Confident	85.8	Confident	77 Å²	77	24.4 Å²	24.4	47%	0.472	17%	0.166	S	C	.	.			trans	-86.5	-15.1	-176.3	55.8	0	0	0	0	114.3	G140 G141 V142 P215	G140-T217 PolarHBondContact O-OG1 3.16Å; G141-T217 WeakPolarHBondContact CA-OG1 3.42Å; V142-T217 HydrophobicContact CB-CG2 4.24Å; V142-T217 HydrophobicContact CG2-CG2 3.67Å; V142-T217 PolarHBondContact N-OG1 3.23Å; P215-T217 HydrophobicContact CB-CG2 4.28Å; P215-T217 HydrophobicContact CG-CG2 4.27Å; P215-T217 PolarHBondContact O-N 3.04Å
218	T	84.9	Confident	85.6	Confident	12 Å²	12	25.2 Å²	25.2	7%	0.074	17%	0.173	C	C	.	.	S	Bend	trans	-127.7	152.8	179.6	58.1	0	0	0	0	109.5	R209 L216 R220	R209-T218 PolarHBondContact NH1-OG1 2.89Å; L216-T218 VanDerWaalsContact CD1-O 3.32Å; L216-T218 WeakPolarHBondContact CD1-O 3.22Å; L216-T218 WeakPolarHBondContact CG-O 3.5Å; T218-R220 PolarHBondContact O-N 3.08Å
219	A	81.2	Confident	85.8	Confident	28 Å²	28	24.9 Å²	24.9	23%	0.231	17%	0.172	C	C	.	.	S	Bend	trans	-74.6	27.2	175.5	0	0	0	0	0	114.6	L314 I317	A219-L314 HydrophobicContact CB-CD2 3.79Å; A219-I317 HydrophobicContact CB-CB 4.36Å; A219-I317 HydrophobicContact CB-CD1 3.3Å; A219-I317 HydrophobicContact CB-CG1 4.39Å; A219-I317 HydrophobicContact CB-CG2 4.03Å
220	R	79.9	Confident	86	Confident	26 Å²	26	23.7 Å²	23.7	10%	0.098	17%	0.167	C	C	.	.			trans	-92	107	175.8	-63.3	-171	65.4	62	3	109	D139 T218 D226 L360 L368	D139-R220 WeakPolarHBondContact OD2-CD 3.15Å; D139-R220 IonicContact OD2-NE 2.62Å; T218-R220 PolarHBondContact O-N 3.08Å; R220-D226 IonicContact CZ-OD2 2.75Å; R220-D226 IonicContact NE-OD2 2.85Å; R220-D226 PolarHBondContact NE-OD2 3.08Å; R220-D226 IonicContact NH2-OD2 3.93Å; R220-D226 PolarHBondContact NH2-OD2 3.06Å; R220-L360 HydrophobicContact CG-CD1 3.76Å; R220-L368 VanDerWaalsContact NH2-CD1 3.27Å
221	I	80	Confident	86.4	Confident	27 Å²	27	24.8 Å²	24.8	14%	0.138	17%	0.169	C	C	.	.			trans	-113.7	136.6	167.1	-58	164.1	0	0	0	106.2	L216 L307 L314 L318 F337	L216-I221 HydrophobicContact CD2-CD1 4.44Å; L216-I221 HydrophobicContact CD2-CG1 4.09Å; I221-L307 HydrophobicContact CD1-CD1 3.9Å; I221-L314 HydrophobicContact CD1-CD1 3.33Å; I221-L314 HydrophobicContact CD1-CD2 4.19Å; I221-L314 HydrophobicContact CD1-CG 4.39Å; I221-L314 HydrophobicContact CG1-CD1 4.42Å; I221-L318 HydrophobicContact CD1-CD1 4.14Å; I221-F337 HydrophobicContact CB-CZ 4.27Å; I221-F337 HydrophobicContact CG2-CZ 4.3Å; I221-F337 WeakPolarHBondContact O-CE1 3.38Å; I221-F337 WeakPolarHBondContact O-CZ 3.32Å
222	C	78.1	Confident	86.7	Confident	41 Å²	41	25.7 Å²	25.7	28%	0.277	17%	0.172	S	C	.	.			trans	-136.2	127.5	172.8	-61	0	0	0	0	106.3	F224 G225	C222-F224 VanDerWaalsContact C-N 3.31Å; C222-F224 PolarHBondContact O-N 3.32Å; C222-G225 WeakPolarHBondContact CB-O 3.42Å; C222-G225 PolarHBondContact O-N 3.28Å
223	E	79.5	Confident	87.3	Confident	6 Å²	6	24.1 Å²	24.1	3%	0.028	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-51.5	-176.8	175.3	68.4	176.8	0	0	110.7	T181 F287 R303 E333	T181-E223 WeakPolarHBondContact CB-O 3.25Å; T181-E223 WeakPolarHBondContact CG2-O 3.42Å; E223-F287 HydrophobicContact CB-CZ 4.27Å; E223-F287 HydrophobicContact CG-CE2 4.16Å; E223-F287 HydrophobicContact CG-CZ 3.72Å; E223-R303 WeakPolarHBondContact OE2-CD 3.38Å; E223-R303 IonicContact OE2-CZ 3.6Å; E223-R303 VanDerWaalsContact OE2-CZ 3.3Å; E223-R303 IonicContact OE2-NE 3.53Å; E223-R303 PolarHBondContact OE2-NE 2.91Å; E223-R303 IonicContact OE2-NH1 3.53Å; E223-R303 PolarHBondContact OE2-NH1 3.23Å; E223-E333 WeakPolarHBondContact CB-OE1 3.34Å
224	F	85.8	Confident	88	Confident	15 Å²	15	21.1 Å²	21.1	7%	0.066	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	11	-177.8	-67.4	-38.7	0	0	0	114.4	T181 C222 A256 V257 V280 W286 F287 W382	T181-F224 HydrophobicContact CG2-CD1 4.21Å; C222-F224 VanDerWaalsContact C-N 3.31Å; C222-F224 PolarHBondContact O-N 3.32Å; F224-A256 HydrophobicContact CB-CB 3.43Å; F224-A256 VanDerWaalsContact CB-CB 3.43Å; F224-A256 HydrophobicContact CD1-CB 4.1Å; F224-A256 HydrophobicContact CD2-CB 3.82Å; F224-A256 HydrophobicContact CG-CB 3.52Å; F224-V257 VanDerWaalsContact O-CB 3.29Å; F224-V257 WeakPolarHBondContact O-CB 3.28Å; F224-V257 PolarHBondContact O-N 2.88Å; F224-V280 HydrophobicContact CE1-CG1 4.42Å; F224-V280 HydrophobicContact CE1-CG2 4.45Å; F224-V280 HydrophobicContact CE2-CG1 4.06Å; F224-V280 HydrophobicContact CZ-CG1 3.85Å; F224-W286 HydrophobicContact CE1-CE3 4.4Å; F224-W286 HydrophobicContact CE1-CZ3 4.38Å; F224-W286 HydrophobicContact CZ-CD2 4.12Å; F224-W286 AromaticContact CZ-CE3 3.75Å; F224-W286 HydrophobicContact CZ-CE3 3.75Å; F224-W286 HydrophobicContact CZ-CZ3 4.09Å; F224-F287 AromaticContact CE2-CE2 3.98Å; F224-F287 HydrophobicContact CE2-CE2 3.98Å; F224-F287 HydrophobicContact CZ-CD2 4.5Å; F224-F287 AromaticContact CZ-CE2 3.91Å; F224-F287 HydrophobicContact CZ-CE2 3.91Å; F224-W382 AromaticContact CD2-CH2 3.82Å; F224-W382 HydrophobicContact CD2-CH2 3.82Å; F224-W382 HydrophobicContact CD2-CZ3 4.08Å; F224-W382 AromaticContact CE2-CH2 3.45Å; F224-W382 HydrophobicContact CE2-CH2 3.45Å; F224-W382 VanDerWaalsContact CE2-CH2 3.45Å; F224-W382 AromaticContact CE2-CZ3 3.93Å; F224-W382 HydrophobicContact CE2-CZ3 3.93Å
225	G	84	Confident	88.4	Confident	20 Å²	20	24.9 Å²	24.9	21%	0.206	15%	0.148	C	C	.	.			trans	84.2	173.5	-174.4	0	0	0	0	0	114.4	C222	C222-G225 WeakPolarHBondContact CB-O 3.42Å; C222-G225 PolarHBondContact O-N 3.28Å
226	D	88.6	Confident	88.9	Confident	12 Å²	12	24.6 Å²	24.6	6%	0.064	14%	0.139	C	C	.	.			trans	-112.6	124.6	-178.1	-172.4	-14.4	0	0	0	110	R220 A228 D229 L230 V257	R220-D226 IonicContact CZ-OD2 2.75Å; R220-D226 IonicContact NE-OD2 2.85Å; R220-D226 PolarHBondContact NE-OD2 3.08Å; R220-D226 IonicContact NH2-OD2 3.93Å; R220-D226 PolarHBondContact NH2-OD2 3.06Å; D226-A228 PolarHBondContact O-N 2.75Å; D226-A228 WeakPolarHBondContact OD1-CB 3.42Å; D226-A228 PolarHBondContact OD1-N 2.66Å; D226-D229 HydrophobicContact CB-CB 4.34Å; D226-D229 WeakPolarHBondContact O-CB 3.4Å; D226-D229 PolarHBondContact O-N 2.73Å; D226-D229 VanDerWaalsContact O-N 3.16Å; D226-L230 PolarHBondContact O-N 3.31Å; D226-V257 WeakPolarHBondContact O-CG2 3.5Å
227	S	92.1	Very high	89.3	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-28.1	179.1	52.8	0	0	0	0	112.4	D229 L230 E231 E264	S227-D229 VanDerWaalsContact C-N 3.31Å; S227-D229 PolarHBondContact O-N 3.2Å; S227-L230 PolarHBondContact O-N 2.87Å; S227-E231 WeakPolarHBondContact O-CB 3.39Å; S227-E231 PolarHBondContact O-N 2.84Å; S227-E264 WeakPolarHBondContact CB-OE2 3.26Å; S227-E264 PolarHBondContact OG-OE1 2.83Å; S227-E264 VanDerWaalsContact OG-OE1 3.05Å; S227-E264 PolarHBondContact OG-OE2 2.77Å
228	A	90.4	Very high	89.6	Confident	18 Å²	18	24.1 Å²	24.1	15%	0.149	13%	0.127	C	C	.	.	H	α-helix	trans	-69.8	-28.5	176.6	0	0	0	0	0	112.7	D226 Q232	D226-A228 PolarHBondContact O-N 2.75Å; D226-A228 WeakPolarHBondContact OD1-CB 3.42Å; D226-A228 PolarHBondContact OD1-N 2.66Å; A228-Q232 WeakPolarHBondContact O-CG 3.4Å; A228-Q232 PolarHBondContact O-N 3.24Å; A228-Q232 PolarHBondContact O-NE2 2.91Å
229	D	93.6	Very high	90.1	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-72.9	-46.2	172.7	-71.9	-16.1	0	0	0	110.7	M137 V143 F206 R209 D226 S227 E231 Q232 A233	M137-D229 HydrophobicContact SD-CB 4.2Å; V143-D229 HydrophobicContact CG1-CB 4.09Å; F206-D229 HydrophobicContact CZ-CB 4Å; R209-D229 WeakPolarHBondContact CD-OD2 3.22Å; R209-D229 WeakPolarHBondContact CG-OD2 3.46Å; R209-D229 IonicContact CZ-OD1 3.83Å; R209-D229 IonicContact CZ-OD2 3.62Å; R209-D229 IonicContact NE-OD1 3.06Å; R209-D229 PolarHBondContact NE-OD1 2.81Å; R209-D229 IonicContact NE-OD2 3.38Å; R209-D229 PolarHBondContact NE-OD2 2.89Å; R209-D229 IonicContact NH2-OD1 3.31Å; R209-D229 PolarHBondContact NH2-OD1 2.95Å; R209-D229 IonicContact NH2-OD2 2.85Å; D226-D229 HydrophobicContact CB-CB 4.34Å; D226-D229 WeakPolarHBondContact O-CB 3.4Å; D226-D229 PolarHBondContact O-N 2.73Å; D226-D229 VanDerWaalsContact O-N 3.16Å; S227-D229 VanDerWaalsContact C-N 3.31Å; S227-D229 PolarHBondContact O-N 3.2Å; D229-E231 VanDerWaalsContact C-N 3.29Å; D229-E231 PolarHBondContact O-N 2.77Å; D229-Q232 PolarHBondContact O-N 2.97Å; D229-A233 WeakPolarHBondContact O-CB 3.14Å; D229-A233 PolarHBondContact O-N 2.71Å
230	L	95.5	Very high	90.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-39.5	178.7	-177.9	58.5	0	0	0	111.1	L176 V178 F206 D226 S227 A233 V234 V257 L258 Y261	L176-L230 HydrophobicContact CD2-CD1 3.93Å; V178-L230 HydrophobicContact CG2-CD1 4.27Å; F206-L230 HydrophobicContact CD1-CD1 3.85Å; F206-L230 HydrophobicContact CE1-CB 4.24Å; F206-L230 HydrophobicContact CE1-CD1 4.03Å; F206-L230 HydrophobicContact CG-CD1 4.11Å; F206-L230 HydrophobicContact CZ-CB 4.31Å; F206-L230 HydrophobicContact CZ-CD1 4.45Å; D226-L230 PolarHBondContact O-N 3.31Å; S227-L230 PolarHBondContact O-N 2.87Å; L230-A233 PolarHBondContact O-N 2.98Å; L230-V234 HydrophobicContact CD1-CG2 4.18Å; L230-V234 HydrophobicContact CG-CG2 4.34Å; L230-V234 WeakPolarHBondContact O-CB 3.5Å; L230-V234 VanDerWaalsContact O-CG2 3.26Å; L230-V234 WeakPolarHBondContact O-CG2 3.45Å; L230-V234 PolarHBondContact O-N 3.4Å; L230-V257 HydrophobicContact CB-CG2 3.84Å; L230-V257 HydrophobicContact CD2-CG1 4.14Å; L230-V257 HydrophobicContact CD2-CG2 3.9Å; L230-L258 HydrophobicContact CD2-CB 4.43Å; L230-L258 HydrophobicContact CD2-CD1 4.16Å; L230-Y261 HydrophobicContact CD2-CD1 4.3Å; L230-Y261 HydrophobicContact CD2-CG 4.04Å; L230-Y261 HydrophobicContact CG-CD2 4.48Å; L230-Y261 HydrophobicContact CG-CG 4.21Å
231	E	95.3	Very high	91.2	Very high	34 Å²	34	33.7 Å²	33.7	16%	0.159	17%	0.171	C	C	.	.	H	α-helix	trans	-58.2	-50.1	173.9	-179.1	-157.5	-175.8	0	0	112.2	S227 D229 A233 V234 L235 Y261 R265	S227-E231 WeakPolarHBondContact O-CB 3.39Å; S227-E231 PolarHBondContact O-N 2.84Å; D229-E231 VanDerWaalsContact C-N 3.29Å; D229-E231 PolarHBondContact O-N 2.77Å; E231-A233 VanDerWaalsContact C-N 3.28Å; E231-A233 PolarHBondContact O-N 3.01Å; E231-V234 PolarHBondContact O-N 3.01Å; E231-L235 HydrophobicContact CG-CD1 4.08Å; E231-L235 HydrophobicContact CG-CG 4.48Å; E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 WeakPolarHBondContact O-CG 3.43Å; E231-L235 PolarHBondContact O-N 3.34Å; E231-Y261 HydrophobicContact CB-CD2 3.88Å; E231-Y261 HydrophobicContact CB-CE2 3.78Å; E231-Y261 HydrophobicContact CG-CE2 4.09Å; E231-R265 IonicContact OE1-CZ 2.74Å; E231-R265 IonicContact OE1-NE 3.43Å; E231-R265 PolarHBondContact OE1-NE 2.92Å; E231-R265 VanDerWaalsContact OE1-NE 3.15Å; E231-R265 IonicContact OE1-NH1 3.06Å; E231-R265 PolarHBondContact OE1-NH1 3.36Å; E231-R265 IonicContact OE1-NH2 3.19Å; E231-R265 PolarHBondContact OE1-NH2 3.39Å; E231-R265 IonicContact OE2-CZ 3.15Å; E231-R265 VanDerWaalsContact OE2-CZ 3.24Å; E231-R265 IonicContact OE2-NE 3.05Å; E231-R265 PolarHBondContact OE2-NE 2.89Å; E231-R265 IonicContact OE2-NH2 2.95Å; E231-R265 PolarHBondContact OE2-NH2 3.37Å
232	Q	95.3	Very high	91.7	Very high	31 Å²	31	36.1 Å²	36.1	15%	0.145	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-39.1	179.7	-74.3	173.5	86.8	0	0	111.4	M137 K138 A228 D229 Y236	M137-Q232 HydrophobicContact CE-CB 4.1Å; M137-Q232 HydrophobicContact SD-CB 3.89Å; K138-Q232 VanDerWaalsContact CG-OE1 3.3Å; A228-Q232 WeakPolarHBondContact O-CG 3.4Å; A228-Q232 PolarHBondContact O-N 3.24Å; A228-Q232 PolarHBondContact O-NE2 2.91Å; D229-Q232 PolarHBondContact O-N 2.97Å; Q232-Y236 WeakPolarHBondContact O-CB 3.46Å; Q232-Y236 PolarHBondContact O-N 2.84Å
233	A	96.8	Very high	92.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-45.9	173.9	0	0	0	0	0	112.3	L135 L145 F206 D229 L230 E231 L235 Y236 V237	L135-A233 HydrophobicContact CD2-CB 4.44Å; L145-A233 HydrophobicContact CD2-CB 4.27Å; F206-A233 HydrophobicContact CD2-CB 3.55Å; F206-A233 HydrophobicContact CE2-CB 3.59Å; D229-A233 WeakPolarHBondContact O-CB 3.14Å; D229-A233 PolarHBondContact O-N 2.71Å; L230-A233 PolarHBondContact O-N 2.98Å; E231-A233 VanDerWaalsContact C-N 3.28Å; E231-A233 PolarHBondContact O-N 3.01Å; A233-L235 PolarHBondContact O-N 3.43Å; A233-Y236 WeakPolarHBondContact O-CB 3.36Å; A233-Y236 PolarHBondContact O-N 2.75Å; A233-V237 VanDerWaalsContact O-CG2 3.31Å; A233-V237 WeakPolarHBondContact O-CG2 3.46Å; A233-V237 PolarHBondContact O-N 3.1Å
234	V	97.3	Very high	92.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-44.6	177.3	166.7	0	0	0	0	111.1	L176 L230 E231 Y236 V237 R238 L246 Y261 C270 L271	L176-V234 HydrophobicContact CD2-CG2 3.59Å; L230-V234 HydrophobicContact CD1-CG2 4.18Å; L230-V234 HydrophobicContact CG-CG2 4.34Å; L230-V234 WeakPolarHBondContact O-CB 3.5Å; L230-V234 VanDerWaalsContact O-CG2 3.26Å; L230-V234 WeakPolarHBondContact O-CG2 3.45Å; L230-V234 PolarHBondContact O-N 3.4Å; E231-V234 PolarHBondContact O-N 3.01Å; V234-Y236 VanDerWaalsContact C-N 3.34Å; V234-Y236 PolarHBondContact O-N 3.47Å; V234-V237 PolarHBondContact O-N 3.23Å; V234-R238 VanDerWaalsContact O-CB 3.28Å; V234-R238 WeakPolarHBondContact O-CB 2.97Å; V234-R238 PolarHBondContact O-N 3.44Å; V234-L246 HydrophobicContact CG1-CD2 3.82Å; V234-Y261 WeakPolarHBondContact CG1-OH 3.41Å; V234-Y261 HydrophobicContact CG2-CE1 4.41Å; V234-C270 HydrophobicContact CG1-CB 3.83Å; V234-L271 HydrophobicContact CG1-CD2 4.37Å; V234-L271 HydrophobicContact CG2-CD2 4.48Å
235	L	96.4	Very high	93	Very high	80 Å²	80	39.3 Å²	39.3	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-40.4	176.1	-70.5	174.9	0	0	0	111.7	E231 A233 R238 S239	E231-L235 HydrophobicContact CG-CD1 4.08Å; E231-L235 HydrophobicContact CG-CG 4.48Å; E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 WeakPolarHBondContact O-CG 3.43Å; E231-L235 PolarHBondContact O-N 3.34Å; A233-L235 PolarHBondContact O-N 3.43Å; L235-R238 PolarHBondContact O-N 2.66Å; L235-S239 WeakPolarHBondContact O-CB 3.18Å; L235-S239 PolarHBondContact O-N 3.28Å
236	Y	96.8	Very high	93.6	Very high	56 Å²	56	38.5 Å²	38.5	22%	0.22	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-50.8	175.3	178	-107.2	0	0	0	111.6	E133 L135 L145 W147 Q232 A233 V234 R238 S239 R240	E133-Y236 VanDerWaalsContact CD-OH 3.25Å; E133-Y236 PolarHBondContact OE1-OH 3.02Å; E133-Y236 PolarHBondContact OE2-OH 3.46Å; L135-Y236 HydrophobicContact CD1-CD1 4.15Å; L135-Y236 HydrophobicContact CD1-CD2 3.82Å; L135-Y236 HydrophobicContact CD1-CE1 4.45Å; L135-Y236 HydrophobicContact CD1-CE2 4.19Å; L135-Y236 HydrophobicContact CD1-CG 3.82Å; L135-Y236 HydrophobicContact CD2-CD1 4.11Å; L135-Y236 HydrophobicContact CD2-CG 3.93Å; L145-Y236 HydrophobicContact CD1-CD1 3.56Å; L145-Y236 HydrophobicContact CD1-CE1 3.95Å; W147-Y236 HydrophobicContact CZ2-CE1 4.16Å; Q232-Y236 WeakPolarHBondContact O-CB 3.46Å; Q232-Y236 PolarHBondContact O-N 2.84Å; A233-Y236 WeakPolarHBondContact O-CB 3.36Å; A233-Y236 PolarHBondContact O-N 2.75Å; V234-Y236 VanDerWaalsContact C-N 3.34Å; V234-Y236 PolarHBondContact O-N 3.47Å; Y236-R238 VanDerWaalsContact C-N 3.3Å; Y236-R238 PolarHBondContact O-N 2.88Å; Y236-S239 WeakPolarHBondContact O-CB 3.38Å; Y236-S239 PolarHBondContact O-N 2.88Å; Y236-S239 VanDerWaalsContact O-N 3.09Å; Y236-S239 PolarHBondContact O-OG 2.88Å; Y236-R240 PolarHBondContact O-N 2.89Å; Y236-R240 VanDerWaalsContact O-N 3.08Å; Y236-R240 PolarHBondContact OH-NH1 3.44Å
237	V	96.3	Very high	94	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-42.8	177.6	173.4	0	0	0	0	110.8	L145 W147 V174 A233 V234 S239 R240 H241 L246	L145-V237 HydrophobicContact CD1-CG2 4.21Å; W147-V237 HydrophobicContact CH2-CG1 4.35Å; W147-V237 HydrophobicContact CH2-CG2 4.03Å; W147-V237 HydrophobicContact CZ2-CG2 4.37Å; V174-V237 HydrophobicContact CG1-CG1 3.67Å; A233-V237 VanDerWaalsContact O-CG2 3.31Å; A233-V237 WeakPolarHBondContact O-CG2 3.46Å; A233-V237 PolarHBondContact O-N 3.1Å; V234-V237 PolarHBondContact O-N 3.23Å; V237-S239 VanDerWaalsContact C-N 3.32Å; V237-S239 PolarHBondContact O-N 3.43Å; V237-R240 PolarHBondContact O-N 2.97Å; V237-H241 PolarHBondContact O-N 2.84Å; V237-L246 HydrophobicContact CG1-CD1 3.7Å; V237-L246 HydrophobicContact CG1-CD2 4.46Å
238	R	95.1	Very high	94.3	Very high	93 Å²	93	37.8 Å²	37.8	35%	0.351	20%	0.199	S	C	.	.	H	α-helix	trans	-61	-39.8	175.3	179.3	60	178.9	167.5	7.1	112.3	V234 L235 Y236 R240 H241 P242 S244 C270	V234-R238 VanDerWaalsContact O-CB 3.28Å; V234-R238 WeakPolarHBondContact O-CB 2.97Å; V234-R238 PolarHBondContact O-N 3.44Å; L235-R238 PolarHBondContact O-N 2.66Å; Y236-R238 VanDerWaalsContact C-N 3.3Å; Y236-R238 PolarHBondContact O-N 2.88Å; R238-R240 VanDerWaalsContact C-N 3.31Å; R238-R240 PolarHBondContact O-N 3.26Å; R238-H241 CarbonylContact O-C 3.22Å; R238-H241 PolarHBondContact O-N 2.83Å; R238-P242 PolarHBondContact NH1-O 3.2Å; R238-P242 PolarHBondContact NH2-O 2.91Å; R238-P242 VanDerWaalsContact O-CA 3.29Å; R238-P242 WeakPolarHBondContact O-CA 3.49Å; R238-S244 PolarHBondContact NH1-O 3.05Å; R238-C270 HydrophobicContact CB-CB 4.34Å; R238-C270 HydrophobicContact CG-CB 4.22Å
239	S	95.1	Very high	94.7	Very high	82 Å²	82	37 Å²	37	57%	0.573	19%	0.192	S	C	*	.	H	α-helix	trans	-66.4	-33.5	177.6	78.3	0	0	0	0	112.8	L235 Y236 V237	L235-S239 WeakPolarHBondContact O-CB 3.18Å; L235-S239 PolarHBondContact O-N 3.28Å; Y236-S239 WeakPolarHBondContact O-CB 3.38Å; Y236-S239 PolarHBondContact O-N 2.88Å; Y236-S239 VanDerWaalsContact O-N 3.09Å; Y236-S239 PolarHBondContact O-OG 2.88Å; V237-S239 VanDerWaalsContact C-N 3.32Å; V237-S239 PolarHBondContact O-N 3.43Å
240	R	93.1	Very high	94.9	Very high	134 Å²	134	36.9 Å²	36.9	51%	0.506	19%	0.192	S	C	.	.	H	α-helix	trans	-77.9	-30.5	177.6	-165.4	166	-174.3	134.3	-6.1	112.8	E133 Y236 V237 R238 P242	E133-R240 IonicContact OE1-NH1 3.48Å; E133-R240 PolarHBondContact OE1-NH1 3.42Å; E133-R240 IonicContact OE2-NH1 2.6Å; E133-R240 PolarHBondContact OE2-NH1 3.28Å; Y236-R240 PolarHBondContact O-N 2.89Å; Y236-R240 VanDerWaalsContact O-N 3.08Å; Y236-R240 PolarHBondContact OH-NH1 3.44Å; V237-R240 PolarHBondContact O-N 2.97Å; R238-R240 VanDerWaalsContact C-N 3.31Å; R238-R240 PolarHBondContact O-N 3.26Å; R240-P242 VanDerWaalsContact C-CD 3.48Å; R240-P242 WeakPolarHBondContact O-CD 3.09Å
241	H	90.9	Very high	94.8	Very high	50 Å²	50	36.9 Å²	36.9	23%	0.231	19%	0.192	C	C	.	.	S	Bend	trans	-125.6	66.8	178.6	-61.1	-81.9	0	0	0	112	W147 V174 V237 R238 S243 S244	W147-H241 AromaticContact CH2-NE2 3.95Å; W147-H241 AromaticContact CZ3-CD2 3.87Å; W147-H241 AromaticContact CZ3-NE2 3.42Å; W147-H241 WeakPolarHBondContact CZ3-NE2 3.42Å; V174-H241 HydrophobicContact CG2-CB 3.81Å; V237-H241 PolarHBondContact O-N 2.84Å; R238-H241 CarbonylContact O-C 3.22Å; R238-H241 PolarHBondContact O-N 2.83Å; H241-S243 VanDerWaalsContact C-N 3.28Å; H241-S243 PolarHBondContact O-N 2.8Å; H241-S244 PolarHBondContact O-N 3.23Å
242	P	90.4	Very high	94.8	Very high	78 Å²	78	35.3 Å²	35.3	51%	0.506	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.8	-170.7	26.5	-35.6	0	0	0	114.2	R238 R240	R238-P242 PolarHBondContact NH1-O 3.2Å; R238-P242 PolarHBondContact NH2-O 2.91Å; R238-P242 VanDerWaalsContact O-CA 3.29Å; R238-P242 WeakPolarHBondContact O-CA 3.49Å; R240-P242 VanDerWaalsContact C-CD 3.48Å; R240-P242 WeakPolarHBondContact O-CD 3.09Å
243	S	87.6	Confident	94.7	Very high	93 Å²	93	34.2 Å²	34.2	65%	0.65	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-14.2	-179.7	-55.8	0	0	0	0	113.4	T171 H241	T171-S243 PolarHBondContact OG1-O 2.97Å; H241-S243 VanDerWaalsContact C-N 3.28Å; H241-S243 PolarHBondContact O-N 2.8Å
244	S	90	Very high	94.6	Very high	8 Å²	8	34.2 Å²	34.2	6%	0.056	18%	0.18	C	C	.	.	S	Bend	trans	-80.9	144	-178	-67.3	0	0	0	0	111.5	P172 R238 H241	P172-S244 VanDerWaalsContact O-CB 3.23Å; P172-S244 WeakPolarHBondContact O-CB 3.48Å; P172-S244 PolarHBondContact O-OG 2.88Å; R238-S244 PolarHBondContact NH1-O 3.05Å; H241-S244 PolarHBondContact O-N 3.23Å
245	V	92	Very high	94.5	Very high	28 Å²	28	34.2 Å²	34.2	17%	0.17	18%	0.18	C	C	.	.			trans	-65.7	136.4	163.7	173.4	0	0	0	0	108.1	T169 P173 V174 V247 T272	T169-V245 HydrophobicContact CG2-CG2 4.36Å; P173-V245 WeakPolarHBondContact CA-O 3.49Å; P173-V245 HydrophobicContact CB-CB 4.42Å; V174-V245 PolarHBondContact N-O 3.22Å; V245-V247 HydrophobicContact CG1-CG1 4.17Å; V245-T272 HydrophobicContact CG1-CG2 4.27Å
246	L	96.2	Very high	94.5	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.6	177.6	-172.4	64.6	0	0	0	109.1	V174 V234 V237 C270 L271 T272	V174-L246 HydrophobicContact CB-CD1 3.61Å; V174-L246 HydrophobicContact CG1-CD1 3.52Å; V234-L246 HydrophobicContact CG1-CD2 3.82Å; V237-L246 HydrophobicContact CG1-CD1 3.7Å; V237-L246 HydrophobicContact CG1-CD2 4.46Å; L246-C270 HydrophobicContact CD2-CB 4.48Å; L246-L271 HydrophobicContact CB-CD2 4.33Å; L246-L271 HydrophobicContact CD2-CD2 3.71Å; L246-L271 HydrophobicContact CG-CD2 3.57Å; L246-L271 CarbonylContact O-C 3.58Å; L246-L271 WeakPolarHBondContact O-CA 3.48Å; L246-T272 PolarHBondContact O-N 3.08Å
247	V	97.9	Very high	94.4	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156.4	176.7	-69.7	0	0	0	0	109.3	V174 L175 L176 F201 V245 A273 L471	V174-V247 WeakPolarHBondContact O-CG2 3.41Å; V174-V247 PolarHBondContact O-N 2.95Å; L175-V247 HydrophobicContact CB-CG2 4.39Å; L175-V247 HydrophobicContact CD1-CG2 3.95Å; L176-V247 PolarHBondContact N-O 3.25Å; F201-V247 HydrophobicContact CD1-CG2 4.42Å; F201-V247 HydrophobicContact CE1-CG2 4.08Å; V245-V247 HydrophobicContact CG1-CG1 4.17Å; V247-A273 WeakPolarHBondContact CA-O 3.3Å; V247-A273 HydrophobicContact CG1-CB 4.49Å; V247-L471 HydrophobicContact CB-CD1 4.07Å; V247-L471 HydrophobicContact CB-CD2 3.96Å; V247-L471 HydrophobicContact CB-CG 4.43Å; V247-L471 HydrophobicContact CG1-CB 4.47Å; V247-L471 HydrophobicContact CG1-CD2 4.13Å; V247-L471 HydrophobicContact CG2-CD1 3.97Å
248	A	98.4	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.7	-179.2	0	0	0	0	0	112.5	L176 L258 L271 A273 A274 A275	L176-A248 HydrophobicContact CB-CB 4.3Å; L176-A248 CarbonylContact O-C 3.58Å; L176-A248 WeakPolarHBondContact O-CA 3.46Å; A248-L258 HydrophobicContact CB-CD1 3.83Å; A248-L258 HydrophobicContact CB-CD2 4.2Å; A248-L271 HydrophobicContact CB-CD1 3.66Å; A248-L271 HydrophobicContact CB-CD2 4.16Å; A248-A273 PolarHBondContact N-O 2.8Å; A248-A274 HydrophobicContact CB-CB 4.5Å; A248-A274 CarbonylContact O-C 3.59Å; A248-A274 WeakPolarHBondContact O-CA 3.41Å; A248-A275 PolarHBondContact O-N 3.15Å
249	V	98.4	Very high	94.6	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.1	170.4	-179.4	0	0	0	0	109.1	L175 L176 L177 V178 L192 A275 I277 V467 L471	L175-V249 HydrophobicContact CD1-CB 4.26Å; L175-V249 HydrophobicContact CD1-CG2 3.62Å; L176-V249 PolarHBondContact O-N 3.34Å; L177-V249 CarbonylContact C-O 3.59Å; L177-V249 VanDerWaalsContact CA-O 3.31Å; L177-V249 WeakPolarHBondContact CA-O 3.45Å; L177-V249 HydrophobicContact CD2-CB 3.8Å; L177-V249 HydrophobicContact CD2-CG1 4.49Å; V178-V249 PolarHBondContact N-O 3.17Å; L192-V249 HydrophobicContact CD2-CB 4.44Å; L192-V249 HydrophobicContact CD2-CG1 3.85Å; V249-A275 CarbonylContact C-O 3.5Å; V249-A275 VanDerWaalsContact CA-O 3.24Å; V249-A275 WeakPolarHBondContact CA-O 3.46Å; V249-A275 HydrophobicContact CG2-CB 4.35Å; V249-I277 HydrophobicContact CG1-CD1 4.27Å; V249-V467 HydrophobicContact CB-CG1 4.22Å; V249-V467 HydrophobicContact CG1-CG1 3.86Å; V249-V467 HydrophobicContact CG2-CG1 3.25Å; V249-L471 HydrophobicContact CG2-CD1 3.53Å
250	S	97.3	Very high	94.7	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.007	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	148.8	173	61.3	0	0	0	0	112.5	V178 S255 A275 A276 I277	V178-S250 CarbonylContact O-C 3.41Å; V178-S250 VanDerWaalsContact O-CA 3.28Å; V178-S250 WeakPolarHBondContact O-CA 3.34Å; S250-S255 WeakPolarHBondContact OG-CA 3.29Å; S250-S255 VanDerWaalsContact OG-CB 3.3Å; S250-S255 WeakPolarHBondContact OG-CB 3.39Å; S250-A275 PolarHBondContact N-O 3.02Å; S250-A276 WeakPolarHBondContact O-CA 3.33Å; S250-A276 WeakPolarHBondContact OG-CA 3.46Å; S250-A276 WeakPolarHBondContact OG-CB 3.48Å; S250-I277 PolarHBondContact O-N 3.34Å
251	E	95.3	Very high	94.9	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.2	173.7	-177.6	-168.5	-146.1	0	0	110.3	V178 Q180 T186 H188 L189 S253 G254 C437	V178-E251 PolarHBondContact O-N 2.97Å; Q180-E251 HydrophobicContact CG-CB 4.32Å; Q180-E251 HydrophobicContact CG-CG 3.85Å; Q180-E251 VanDerWaalsContact CG-O 3.28Å; Q180-E251 WeakPolarHBondContact CG-O 3.16Å; T186-E251 WeakPolarHBondContact CG2-OE2 3.46Å; T186-E251 PolarHBondContact OG1-OE1 2.85Å; T186-E251 PolarHBondContact OG1-OE2 2.83Å; H188-E251 WeakPolarHBondContact CB-OE1 3.31Å; H188-E251 IonicContact CE1-OE1 2.76Å; H188-E251 IonicContact CG-OE1 3.62Å; H188-E251 IonicContact ND1-OE1 3.27Å; H188-E251 PolarHBondContact ND1-OE1 2.77Å; L189-E251 HydrophobicContact CD1-CB 4.28Å; E251-S253 PolarHBondContact O-N 3.39Å; E251-G254 PolarHBondContact O-N 2.83Å; E251-C437 HydrophobicContact CG-CB 4.49Å; E251-C437 VanDerWaalsContact CG-SG 3.6Å
252	G	93.9	Very high	95.2	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	53	-127.5	171.6	0	0	0	0	0	113	G254 S255 I277 S278	G252-G254 PolarHBondContact O-N 3.4Å; G252-G254 VanDerWaalsContact O-N 3.14Å; G252-S255 WeakPolarHBondContact O-CB 3.22Å; G252-S255 PolarHBondContact O-N 3.22Å; G252-S255 VanDerWaalsContact O-N 3.08Å; G252-S255 PolarHBondContact O-OG 3.1Å; G252-S255 VanDerWaalsContact O-OG 3.05Å; G252-I277 PolarHBondContact N-O 3.25Å; G252-S278 WeakPolarHBondContact CA-O 3.13Å
253	S	93.4	Very high	95.5	Very high	9 Å²	9	8.2 Å²	8.2	6%	0.063	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-62	-17.4	178.5	61.3	0	0	0	0	114.9	T181 E251 S255 A256	T181-S253 WeakPolarHBondContact CG2-OG 3.3Å; T181-S253 PolarHBondContact N-OG 3.27Å; T181-S253 PolarHBondContact OG1-OG 3.36Å; E251-S253 PolarHBondContact O-N 3.39Å; S253-S255 PolarHBondContact O-N 2.71Å; S253-A256 PolarHBondContact O-N 3.31Å
254	G	94.5	Very high	95.8	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	-63.4	-19.7	172.5	0	0	0	0	0	113.3	V178 P179 E251 G252 A256 V257	V178-G254 WeakPolarHBondContact CG1-O 3.3Å; P179-G254 WeakPolarHBondContact O-CA 3.49Å; E251-G254 PolarHBondContact O-N 2.83Å; G252-G254 PolarHBondContact O-N 3.4Å; G252-G254 VanDerWaalsContact O-N 3.14Å; G254-A256 PolarHBondContact O-N 3.08Å; G254-V257 VanDerWaalsContact O-CG1 3.22Å; G254-V257 WeakPolarHBondContact O-CG1 3.22Å
255	S	95.9	Very high	96	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-62.7	-28.7	176.3	71.2	0	0	0	0	112.7	S250 G252 S253 L258 L259 P279 V280	S250-S255 WeakPolarHBondContact OG-CA 3.29Å; S250-S255 VanDerWaalsContact OG-CB 3.3Å; S250-S255 WeakPolarHBondContact OG-CB 3.39Å; G252-S255 WeakPolarHBondContact O-CB 3.22Å; G252-S255 PolarHBondContact O-N 3.22Å; G252-S255 VanDerWaalsContact O-N 3.08Å; G252-S255 PolarHBondContact O-OG 3.1Å; G252-S255 VanDerWaalsContact O-OG 3.05Å; S253-S255 PolarHBondContact O-N 2.71Å; S255-L258 PolarHBondContact O-N 2.88Å; S255-L258 VanDerWaalsContact O-N 3.16Å; S255-L259 WeakPolarHBondContact O-CB 3.22Å; S255-L259 VanDerWaalsContact O-CG 3.22Å; S255-L259 WeakPolarHBondContact O-CG 3.31Å; S255-L259 PolarHBondContact O-N 2.97Å; S255-P279 WeakPolarHBondContact OG-CA 3.34Å; S255-P279 WeakPolarHBondContact OG-CB 3.21Å; S255-V280 PolarHBondContact OG-N 2.86Å
256	A	95.4	Very high	96.2	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.008	4%	0.041	C	C	.	.	H	α-helix	trans	-67.4	-40.1	-173.4	0	0	0	0	0	112.7	F224 S253 G254 S260 P387	F224-A256 HydrophobicContact CB-CB 3.43Å; F224-A256 VanDerWaalsContact CB-CB 3.43Å; F224-A256 HydrophobicContact CD1-CB 4.1Å; F224-A256 HydrophobicContact CD2-CB 3.82Å; F224-A256 HydrophobicContact CG-CB 3.52Å; S253-A256 PolarHBondContact O-N 3.31Å; G254-A256 PolarHBondContact O-N 3.08Å; A256-S260 VanDerWaalsContact O-CB 3.22Å; A256-S260 WeakPolarHBondContact O-CB 3.34Å; A256-S260 PolarHBondContact O-N 3.36Å; A256-S260 VanDerWaalsContact O-N 3.14Å; A256-S260 PolarHBondContact O-OG 2.68Å; A256-P387 HydrophobicContact CB-CB 4.07Å; A256-P387 HydrophobicContact CB-CG 3.42Å; A256-P387 VanDerWaalsContact CB-CG 3.42Å
257	V	95.7	Very high	96	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.012	6%	0.055	C	C	.	.	H	α-helix	trans	-67.9	-37.7	170.2	64.5	0	0	0	0	111.9	V178 F224 D226 L230 G254 S260 Y261	V178-V257 HydrophobicContact CG1-CG1 3.56Å; F224-V257 VanDerWaalsContact O-CB 3.29Å; F224-V257 WeakPolarHBondContact O-CB 3.28Å; F224-V257 PolarHBondContact O-N 2.88Å; D226-V257 WeakPolarHBondContact O-CG2 3.5Å; L230-V257 HydrophobicContact CB-CG2 3.84Å; L230-V257 HydrophobicContact CD2-CG1 4.14Å; L230-V257 HydrophobicContact CD2-CG2 3.9Å; G254-V257 VanDerWaalsContact O-CG1 3.22Å; G254-V257 WeakPolarHBondContact O-CG1 3.22Å; V257-S260 PolarHBondContact O-N 3.38Å; V257-Y261 VanDerWaalsContact O-CB 3.31Å; V257-Y261 WeakPolarHBondContact O-CB 3.2Å; V257-Y261 PolarHBondContact O-N 2.94Å
258	L	97.7	Very high	95.9	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-68.3	-47.4	-175.2	178.6	59.4	0	0	0	110.4	L230 A248 S255 Y261 L262 L271 A274	L230-L258 HydrophobicContact CD2-CB 4.43Å; L230-L258 HydrophobicContact CD2-CD1 4.16Å; A248-L258 HydrophobicContact CB-CD1 3.83Å; A248-L258 HydrophobicContact CB-CD2 4.2Å; S255-L258 PolarHBondContact O-N 2.88Å; S255-L258 VanDerWaalsContact O-N 3.16Å; L258-Y261 PolarHBondContact O-N 3.41Å; L258-L262 HydrophobicContact CD1-CD1 4.37Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.25Å; L258-L262 VanDerWaalsContact O-CG 3.26Å; L258-L262 WeakPolarHBondContact O-CG 3.3Å; L258-L262 PolarHBondContact O-N 3.14Å; L258-L271 HydrophobicContact CD1-CD1 4.07Å; L258-A274 HydrophobicContact CD2-CB 4.35Å
259	L	97.8	Very high	95.7	Very high	4 Å²	4	15 Å²	15	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-63.8	-43.2	176.7	-67	171.2	0	0	0	111.4	S255 Y261 L262 G263 L281 P387 L388 V398 F426	S255-L259 WeakPolarHBondContact O-CB 3.22Å; S255-L259 VanDerWaalsContact O-CG 3.22Å; S255-L259 WeakPolarHBondContact O-CG 3.31Å; S255-L259 PolarHBondContact O-N 2.97Å; L259-Y261 PolarHBondContact O-N 2.67Å; L259-L262 PolarHBondContact O-N 3.17Å; L259-G263 PolarHBondContact O-N 2.84Å; L259-L281 HydrophobicContact CD1-CD2 3.69Å; L259-P387 CarbonylContact C-O 3.54Å; L259-P387 HydrophobicContact CB-CB 4.29Å; L259-P387 WeakPolarHBondContact CB-O 3.41Å; L259-P387 HydrophobicContact CD1-CB 4.34Å; L259-L388 HydrophobicContact CB-CD2 4.46Å; L259-L388 HydrophobicContact CD1-CD2 4.05Å; L259-L388 HydrophobicContact CD2-CD2 4.36Å; L259-V398 HydrophobicContact CD2-CG1 4.06Å; L259-F426 HydrophobicContact CD2-CE1 3.83Å; L259-F426 HydrophobicContact CD2-CZ 4.2Å
260	S	95.9	Very high	95.5	Very high	10 Å²	10	16.5 Å²	16.5	7%	0.07	10%	0.096	C	C	.	.	H	α-helix	trans	-56.5	-48.4	173.1	-72.3	0	0	0	0	112.2	A256 V257 G263 E264 P387 R389	A256-S260 VanDerWaalsContact O-CB 3.22Å; A256-S260 WeakPolarHBondContact O-CB 3.34Å; A256-S260 PolarHBondContact O-N 3.36Å; A256-S260 VanDerWaalsContact O-N 3.14Å; A256-S260 PolarHBondContact O-OG 2.68Å; V257-S260 PolarHBondContact O-N 3.38Å; S260-G263 PolarHBondContact O-N 3.42Å; S260-E264 WeakPolarHBondContact O-CB 3.17Å; S260-E264 WeakPolarHBondContact O-CG 3.49Å; S260-E264 PolarHBondContact O-N 2.95Å; S260-P387 PolarHBondContact N-O 3.33Å; S260-R389 VanDerWaalsContact CB-NH2 3.32Å; S260-R389 PolarHBondContact OG-NH1 3.01Å; S260-R389 PolarHBondContact OG-NH2 3.2Å
261	Y	97.3	Very high	95.5	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-43.3	178.2	161.4	-94.4	0	0	0	112	L230 E231 V234 V257 L258 L259 R265 T269 L271	L230-Y261 HydrophobicContact CD2-CD1 4.3Å; L230-Y261 HydrophobicContact CD2-CG 4.04Å; L230-Y261 HydrophobicContact CG-CD2 4.48Å; L230-Y261 HydrophobicContact CG-CG 4.21Å; E231-Y261 HydrophobicContact CB-CD2 3.88Å; E231-Y261 HydrophobicContact CB-CE2 3.78Å; E231-Y261 HydrophobicContact CG-CE2 4.09Å; V234-Y261 WeakPolarHBondContact CG1-OH 3.41Å; V234-Y261 HydrophobicContact CG2-CE1 4.41Å; V257-Y261 VanDerWaalsContact O-CB 3.31Å; V257-Y261 WeakPolarHBondContact O-CB 3.2Å; V257-Y261 PolarHBondContact O-N 2.94Å; L258-Y261 PolarHBondContact O-N 3.41Å; L259-Y261 PolarHBondContact O-N 2.67Å; Y261-R265 HydrophobicContact CD2-CG 3.83Å; Y261-R265 HydrophobicContact CE2-CB 4.36Å; Y261-R265 HydrophobicContact CE2-CG 3.57Å; Y261-R265 VanDerWaalsContact O-CB 3.32Å; Y261-R265 WeakPolarHBondContact O-CB 3.1Å; Y261-R265 WeakPolarHBondContact O-CG 3.26Å; Y261-R265 PolarHBondContact O-N 3Å; Y261-T269 VanDerWaalsContact CE1-OG1 3.3Å; Y261-T269 WeakPolarHBondContact CE1-OG1 3.44Å; Y261-T269 PolarHBondContact OH-OG1 3.34Å; Y261-L271 HydrophobicContact CD1-CD1 4.28Å; Y261-L271 HydrophobicContact CE1-CD1 3.71Å; Y261-L271 HydrophobicContact CE1-CG 4.08Å
262	L	97.9	Very high	95.5	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-40.8	179.7	-73.1	173.8	0	0	0	112.1	L258 L259 G266 L271 A274 V394 V396 V398	L258-L262 HydrophobicContact CD1-CD1 4.37Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.25Å; L258-L262 VanDerWaalsContact O-CG 3.26Å; L258-L262 WeakPolarHBondContact O-CG 3.3Å; L258-L262 PolarHBondContact O-N 3.14Å; L259-L262 PolarHBondContact O-N 3.17Å; L262-G266 WeakPolarHBondContact O-CA 3.46Å; L262-G266 PolarHBondContact O-N 3.19Å; L262-L271 HydrophobicContact CD2-CD1 3.9Å; L262-A274 HydrophobicContact CD1-CB 3.7Å; L262-V394 HydrophobicContact CB-CG1 4.44Å; L262-V394 HydrophobicContact CB-CG2 4.04Å; L262-V396 HydrophobicContact CD2-CG2 3.63Å; L262-V398 HydrophobicContact CD1-CG2 3.75Å
263	G	96.3	Very high	95.7	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-67.1	-51.3	175.6	0	0	0	0	0	112.1	L259 S260 R265 G266 D390 E393	L259-G263 PolarHBondContact O-N 2.84Å; S260-G263 PolarHBondContact O-N 3.42Å; G263-R265 VanDerWaalsContact C-N 3.27Å; G263-R265 PolarHBondContact O-N 3.21Å; G263-G266 PolarHBondContact O-N 3.03Å; G263-D390 WeakPolarHBondContact CA-O 3.49Å; G263-E393 VanDerWaalsContact O-CB 3.25Å; G263-E393 WeakPolarHBondContact O-CB 3.33Å
264	E	94.3	Very high	96	Very high	50 Å²	50	17 Å²	17	23%	0.234	10%	0.099	C	C	.	.	H	α-helix	trans	-62.1	-32.8	-178.5	-74.9	179.7	-179	0	0	114.1	S227 S260 R371 R389	S227-E264 WeakPolarHBondContact CB-OE2 3.26Å; S227-E264 PolarHBondContact OG-OE1 2.83Å; S227-E264 VanDerWaalsContact OG-OE1 3.05Å; S227-E264 PolarHBondContact OG-OE2 2.77Å; S260-E264 WeakPolarHBondContact O-CB 3.17Å; S260-E264 WeakPolarHBondContact O-CG 3.49Å; S260-E264 PolarHBondContact O-N 2.95Å; E264-R371 IonicContact OE1-CZ 3.41Å; E264-R371 IonicContact OE1-NH1 3.23Å; E264-R371 PolarHBondContact OE1-NH1 3.33Å; E264-R371 IonicContact OE1-NH2 3.69Å; E264-R371 PolarHBondContact OE1-NH2 2.89Å; E264-R371 IonicContact OE2-NH2 2.92Å; E264-R389 IonicContact OE1-CZ 3.15Å; E264-R389 IonicContact OE1-NE 2.84Å; E264-R389 IonicContact OE1-NH2 3.24Å; E264-R389 PolarHBondContact OE1-NH2 3.4Å
265	R	95.1	Very high	96.1	Very high	84 Å²	84	17 Å²	17	32%	0.317	10%	0.099	S	C	.	.	H	α-helix	trans	-92.9	-26.1	-178.2	-63.9	-69.5	159.4	-151.5	-1.5	112.9	E231 Y261 G263 S267 S268	E231-R265 IonicContact OE1-CZ 2.74Å; E231-R265 IonicContact OE1-NE 3.43Å; E231-R265 PolarHBondContact OE1-NE 2.92Å; E231-R265 VanDerWaalsContact OE1-NE 3.15Å; E231-R265 IonicContact OE1-NH1 3.06Å; E231-R265 PolarHBondContact OE1-NH1 3.36Å; E231-R265 IonicContact OE1-NH2 3.19Å; E231-R265 PolarHBondContact OE1-NH2 3.39Å; E231-R265 IonicContact OE2-CZ 3.15Å; E231-R265 VanDerWaalsContact OE2-CZ 3.24Å; E231-R265 IonicContact OE2-NE 3.05Å; E231-R265 PolarHBondContact OE2-NE 2.89Å; E231-R265 IonicContact OE2-NH2 2.95Å; E231-R265 PolarHBondContact OE2-NH2 3.37Å; Y261-R265 HydrophobicContact CD2-CG 3.83Å; Y261-R265 HydrophobicContact CE2-CB 4.36Å; Y261-R265 HydrophobicContact CE2-CG 3.57Å; Y261-R265 VanDerWaalsContact O-CB 3.32Å; Y261-R265 WeakPolarHBondContact O-CB 3.1Å; Y261-R265 WeakPolarHBondContact O-CG 3.26Å; Y261-R265 PolarHBondContact O-N 3Å; G263-R265 VanDerWaalsContact C-N 3.27Å; G263-R265 PolarHBondContact O-N 3.21Å; R265-S267 PolarHBondContact O-N 2.84Å; R265-S268 WeakPolarHBondContact O-CA 3.38Å; R265-S268 VanDerWaalsContact O-CB 3.26Å; R265-S268 WeakPolarHBondContact O-CB 3.39Å; R265-S268 PolarHBondContact O-N 3.23Å
266	G	95	Very high	96.3	Very high	4 Å²	4	17.1 Å²	17.1	4%	0.041	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	43.8	-120.9	-178.2	0	0	0	0	0	112.6	L262 G263 S268 T269 E393	L262-G266 WeakPolarHBondContact O-CA 3.46Å; L262-G266 PolarHBondContact O-N 3.19Å; G263-G266 PolarHBondContact O-N 3.03Å; G266-S268 PolarHBondContact O-N 2.79Å; G266-T269 WeakPolarHBondContact O-CG2 3.26Å; G266-T269 PolarHBondContact O-N 2.79Å; G266-E393 WeakPolarHBondContact CA-O 3.24Å
267	S	93.4	Very high	96.4	Very high	44 Å²	44	17.1 Å²	17.1	31%	0.308	10%	0.099	S	C	.	.	G	3₁₀ helix	trans	-67.8	-14.7	179.9	63.9	0	0	0	0	115.3	R265 T269	R265-S267 PolarHBondContact O-N 2.84Å; S267-T269 VanDerWaalsContact C-N 3.3Å
268	S	94.4	Very high	96.4	Very high	86 Å²	86	17 Å²	17	60%	0.601	10%	0.099	S	C	*	.	G	3₁₀ helix	trans	-83.5	-4.5	178.7	-54.5	0	0	0	0	113.3	R265 G266	R265-S268 WeakPolarHBondContact O-CA 3.38Å; R265-S268 VanDerWaalsContact O-CB 3.26Å; R265-S268 WeakPolarHBondContact O-CB 3.39Å; R265-S268 PolarHBondContact O-N 3.23Å; G266-S268 PolarHBondContact O-N 2.79Å
269	T	95.3	Very high	96.4	Very high	8 Å²	8	17.1 Å²	17.1	5%	0.049	10%	0.099	C	C	.	.			trans	-63.3	140.3	177.7	-173.5	0	0	0	0	112	Y261 G266 S267 L271 V396	Y261-T269 VanDerWaalsContact CE1-OG1 3.3Å; Y261-T269 WeakPolarHBondContact CE1-OG1 3.44Å; Y261-T269 PolarHBondContact OH-OG1 3.34Å; G266-T269 WeakPolarHBondContact O-CG2 3.26Å; G266-T269 PolarHBondContact O-N 2.79Å; S267-T269 VanDerWaalsContact C-N 3.3Å; T269-L271 VanDerWaalsContact C-N 3.26Å; T269-L271 PolarHBondContact OG1-N 2.87Å; T269-V396 HydrophobicContact CG2-CG1 3.59Å; T269-V396 HydrophobicContact CG2-CG2 4.33Å
270	C	94.8	Very high	96.3	Very high	34 Å²	34	17 Å²	17	23%	0.23	10%	0.099	C	C	.	.	S	Bend	trans	-80.4	-7.4	171.5	-66.9	0	0	0	0	113.3	V234 R238 L246	V234-C270 HydrophobicContact CG1-CB 3.83Å; R238-C270 HydrophobicContact CB-CB 4.34Å; R238-C270 HydrophobicContact CG-CB 4.22Å; L246-C270 HydrophobicContact CD2-CB 4.48Å
271	L	96.6	Very high	96.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.			trans	-75.6	147.2	178	-58	-177.1	0	0	0	110.6	V234 L246 A248 L258 Y261 L262 T269 V396	V234-L271 HydrophobicContact CG1-CD2 4.37Å; V234-L271 HydrophobicContact CG2-CD2 4.48Å; L246-L271 HydrophobicContact CB-CD2 4.33Å; L246-L271 HydrophobicContact CD2-CD2 3.71Å; L246-L271 HydrophobicContact CG-CD2 3.57Å; L246-L271 CarbonylContact O-C 3.58Å; L246-L271 WeakPolarHBondContact O-CA 3.48Å; A248-L271 HydrophobicContact CB-CD1 3.66Å; A248-L271 HydrophobicContact CB-CD2 4.16Å; L258-L271 HydrophobicContact CD1-CD1 4.07Å; Y261-L271 HydrophobicContact CD1-CD1 4.28Å; Y261-L271 HydrophobicContact CE1-CD1 3.71Å; Y261-L271 HydrophobicContact CE1-CG 4.08Å; L262-L271 HydrophobicContact CD2-CD1 3.9Å; T269-L271 VanDerWaalsContact C-N 3.26Å; T269-L271 PolarHBondContact OG1-N 2.87Å; L271-V396 WeakPolarHBondContact O-CG1 3.21Å
272	T	95.9	Very high	96.1	Very high	22 Å²	22	18.5 Å²	18.5	14%	0.135	11%	0.106	C	C	.	.	S	Bend	trans	-94.1	-39.8	174.4	-64.3	0	0	0	0	111.8	V245 L246 P397 L478	V245-T272 HydrophobicContact CG1-CG2 4.27Å; L246-T272 PolarHBondContact O-N 3.08Å; T272-P397 WeakPolarHBondContact O-CD 3.39Å; T272-L478 HydrophobicContact CG2-CD1 3.8Å; T272-L478 WeakPolarHBondContact O-CD1 3.36Å
273	A	97.4	Very high	95.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.106	C	C	.	.			trans	-154.9	158.5	176.2	0	0	0	0	0	108.9	V247 A248 P397 F470 L471 A474	V247-A273 WeakPolarHBondContact CA-O 3.3Å; V247-A273 HydrophobicContact CG1-CB 4.49Å; A248-A273 PolarHBondContact N-O 2.8Å; A273-P397 WeakPolarHBondContact CA-O 3.21Å; A273-P397 HydrophobicContact CB-CB 4.37Å; A273-F470 HydrophobicContact CB-CE1 4.37Å; A273-L471 HydrophobicContact CB-CD2 3.79Å; A273-A474 HydrophobicContact CB-CB 4.19Å
274	A	98.5	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	155.5	178.1	0	0	0	0	0	111.7	A248 L258 L262 P397 V398 L399 F470	A248-A274 HydrophobicContact CB-CB 4.5Å; A248-A274 CarbonylContact O-C 3.59Å; A248-A274 WeakPolarHBondContact O-CA 3.41Å; L258-A274 HydrophobicContact CD2-CB 4.35Å; L262-A274 HydrophobicContact CD1-CB 3.7Å; A274-P397 PolarHBondContact N-O 3.33Å; A274-V398 HydrophobicContact CB-CG2 4.48Å; A274-V398 VanDerWaalsContact O-CA 3.26Å; A274-V398 WeakPolarHBondContact O-CA 3.41Å; A274-L399 PolarHBondContact O-N 3.44Å; A274-F470 VanDerWaalsContact O-CE1 3.3Å; A274-F470 WeakPolarHBondContact O-CE1 3.36Å
275	A	98.6	Very high	95.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.8	169.6	0	0	0	0	0	111.8	A248 V249 S250 L399 V467 F470	A248-A275 PolarHBondContact O-N 3.15Å; V249-A275 CarbonylContact C-O 3.5Å; V249-A275 VanDerWaalsContact CA-O 3.24Å; V249-A275 WeakPolarHBondContact CA-O 3.46Å; V249-A275 HydrophobicContact CG2-CB 4.35Å; S250-A275 PolarHBondContact N-O 3.02Å; A275-L399 CarbonylContact C-O 3.53Å; A275-L399 WeakPolarHBondContact CA-O 3.26Å; A275-L399 HydrophobicContact CB-CB 4.14Å; A275-V467 HydrophobicContact CB-CB 4.2Å; A275-V467 HydrophobicContact CB-CG1 3.5Å; A275-V467 VanDerWaalsContact CB-CG1 3.5Å; A275-V467 HydrophobicContact CB-CG2 3.79Å; A275-F470 HydrophobicContact CB-CD1 4.38Å
276	A	98.4	Very high	95.4	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.008	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	126.4	178.8	0	0	0	0	0	110.7	S250 P279 L399 C400 I401	S250-A276 WeakPolarHBondContact O-CA 3.33Å; S250-A276 WeakPolarHBondContact OG-CA 3.46Å; S250-A276 WeakPolarHBondContact OG-CB 3.48Å; A276-P279 HydrophobicContact CB-CB 3.77Å; A276-P279 HydrophobicContact CB-CG 4.19Å; A276-L399 PolarHBondContact N-O 2.87Å; A276-C400 WeakPolarHBondContact O-CA 3.38Å; A276-I401 PolarHBondContact O-N 2.96Å
277	I	97.7	Very high	95.2	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.2	179.2	-56.5	171.3	0	0	0	108.2	L192 V249 S250 G252 C437 F439 V467	L192-I277 HydrophobicContact CD2-CD1 4.44Å; V249-I277 HydrophobicContact CG1-CD1 4.27Å; S250-I277 PolarHBondContact O-N 3.34Å; G252-I277 PolarHBondContact N-O 3.25Å; I277-C437 HydrophobicContact CG2-CB 4.42Å; I277-F439 HydrophobicContact CG2-CD2 4.03Å; I277-F439 HydrophobicContact CG2-CE2 3.72Å; I277-V467 HydrophobicContact CD1-CG2 4.08Å; I277-V467 HydrophobicContact CG1-CG2 3.87Å
278	S	96.8	Very high	95	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	47.3	54.8	-171.3	-66.4	0	0	0	0	113.2	G252 I401 D406 H436 C437	G252-S278 WeakPolarHBondContact CA-O 3.13Å; S278-I401 PolarHBondContact N-O 3.43Å; S278-D406 WeakPolarHBondContact CB-OD2 3.42Å; S278-D406 PolarHBondContact OG-OD2 3.17Å; S278-D406 VanDerWaalsContact OG-OD2 3.06Å; S278-H436 VanDerWaalsContact CB-CE1 3.45Å; S278-H436 WeakPolarHBondContact CB-CE1 3.22Å; S278-H436 WeakPolarHBondContact CB-ND1 3.49Å; S278-C437 PolarHBondContact OG-N 2.7Å
279	P	97	Very high	94.5	Very high	4 Å²	4	21.4 Å²	21.4	3%	0.026	11%	0.105	C	C	.	.			trans	-68.7	140.2	-173.4	26.5	-33.2	0	0	0	113.9	S255 A276 L281 C400 I401	S255-P279 WeakPolarHBondContact OG-CA 3.34Å; S255-P279 WeakPolarHBondContact OG-CB 3.21Å; A276-P279 HydrophobicContact CB-CB 3.77Å; A276-P279 HydrophobicContact CB-CG 4.19Å; P279-L281 HydrophobicContact CB-CD2 3.82Å; P279-L281 HydrophobicContact CB-CG 4.18Å; P279-L281 HydrophobicContact CG-CD2 3.85Å; P279-L281 HydrophobicContact CG-CG 4.02Å; P279-L281 PolarHBondContact O-N 3.45Å; P279-L281 VanDerWaalsContact O-N 3.1Å; P279-C400 HydrophobicContact CG-CB 3.99Å; P279-I401 VanDerWaalsContact CD-O 3.26Å; P279-I401 WeakPolarHBondContact CD-O 3.26Å
280	V	95.4	Very high	93.4	Very high	3 Å²	3	26 Å²	26	2%	0.018	14%	0.144	C	C	.	.			trans	-75.7	94.5	159.4	-177.6	0	0	0	0	108.5	F224 S255 W286 L409	F224-V280 HydrophobicContact CE1-CG1 4.42Å; F224-V280 HydrophobicContact CE1-CG2 4.45Å; F224-V280 HydrophobicContact CE2-CG1 4.06Å; F224-V280 HydrophobicContact CZ-CG1 3.85Å; S255-V280 PolarHBondContact OG-N 2.86Å; V280-W286 HydrophobicContact CG1-CB 3.98Å; V280-W286 HydrophobicContact CG1-CG 4.15Å; V280-W286 HydrophobicContact CG2-CG 4.45Å; V280-L409 HydrophobicContact CG2-CD2 3.83Å
281	L	95.1	Very high	92.9	Very high	6 Å²	6	25.2 Å²	25.2	3%	0.031	14%	0.137	C	C	.	.			trans	-83.1	-36.2	177.8	-62.8	-178.8	0	0	0	112.7	L259 P279 L388 L415 P416 F420	L259-L281 HydrophobicContact CD1-CD2 3.69Å; P279-L281 HydrophobicContact CB-CD2 3.82Å; P279-L281 HydrophobicContact CB-CG 4.18Å; P279-L281 HydrophobicContact CG-CD2 3.85Å; P279-L281 HydrophobicContact CG-CG 4.02Å; P279-L281 PolarHBondContact O-N 3.45Å; P279-L281 VanDerWaalsContact O-N 3.1Å; L281-L388 HydrophobicContact CB-CD1 3.87Å; L281-L388 HydrophobicContact CD2-CD1 4.27Å; L281-L388 WeakPolarHBondContact O-CD1 3.15Å; L281-L388 WeakPolarHBondContact O-CG 3.26Å; L281-L415 HydrophobicContact CD1-CD2 3.83Å; L281-P416 HydrophobicContact CD1-CG 4.25Å; L281-F420 HydrophobicContact CD1-CE2 4.04Å; L281-F420 HydrophobicContact CD1-CZ 3.85Å
282	L	93.5	Very high	92.4	Very high	39 Å²	39	26.1 Å²	26.1	20%	0.204	14%	0.143	C	C	.	.			trans	-119.6	88.5	-178	-63.1	178.5	0	0	0	110.1	R285 W286 E386 T414	L282-R285 HydrophobicContact CB-CB 4.03Å; L282-R285 HydrophobicContact CB-CG 4.37Å; L282-R285 PolarHBondContact O-N 3.25Å; L282-W286 PolarHBondContact O-N 2.71Å; L282-E386 VanDerWaalsContact C-OE1 3.29Å; L282-E386 WeakPolarHBondContact CA-OE1 3.38Å; L282-T414 VanDerWaalsContact CD1-O 3.26Å; L282-T414 WeakPolarHBondContact CD1-O 3.27Å
283	G	92.3	Very high	91.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-46.8	-173.5	0	0	0	0	0	112.8	R285 W286 F287 E386	G283-R285 VanDerWaalsContact C-N 3.33Å; G283-R285 PolarHBondContact O-N 2.83Å; G283-W286 WeakPolarHBondContact O-CB 3.19Å; G283-W286 PolarHBondContact O-N 2.74Å; G283-W286 VanDerWaalsContact O-N 3.16Å; G283-F287 WeakPolarHBondContact O-CD2 3.32Å; G283-F287 PolarHBondContact O-N 2.71Å; G283-E386 PolarHBondContact N-OE1 3.32Å
284	Q	93.1	Very high	91.4	Very high	55 Å²	55	32 Å²	32	26%	0.257	18%	0.177	S	C	.	.	H	α-helix	trans	-57	-48.4	176.6	-175.1	174.3	-7.1	0	0	111.8	W286 F287 E288 W382 E386	Q284-W286 VanDerWaalsContact C-N 3.28Å; Q284-W286 PolarHBondContact O-N 3.43Å; Q284-F287 PolarHBondContact O-N 3.14Å; Q284-E288 VanDerWaalsContact CG-OE1 3.28Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.32Å; Q284-E288 PolarHBondContact NE2-OE1 2.88Å; Q284-E288 WeakPolarHBondContact O-CG 3.32Å; Q284-E288 PolarHBondContact O-N 3.19Å; Q284-W382 VanDerWaalsContact CA-CD2 3.5Å; Q284-W382 HydrophobicContact CB-CB 3.83Å; Q284-W382 HydrophobicContact CB-CD2 3.71Å; Q284-W382 HydrophobicContact CB-CE3 4.3Å; Q284-W382 HydrophobicContact CB-CG 3.43Å; Q284-W382 VanDerWaalsContact CB-CG 3.43Å; Q284-W382 HydrophobicContact CG-CB 4.17Å; Q284-W382 HydrophobicContact CG-CD2 4.41Å; Q284-W382 HydrophobicContact CG-CG 3.76Å; Q284-E386 PolarHBondContact N-OE2 3.16Å
285	R	92.1	Very high	91	Very high	118 Å²	118	33.3 Å²	33.3	45%	0.445	18%	0.182	S	C	.	.	H	α-helix	trans	-65	-33.4	-179.9	-73.3	-166.3	177.1	168.9	-5.2	112	L282 G283 F287 E288 S289 P410 T414	L282-R285 HydrophobicContact CB-CB 4.03Å; L282-R285 HydrophobicContact CB-CG 4.37Å; L282-R285 PolarHBondContact O-N 3.25Å; G283-R285 VanDerWaalsContact C-N 3.33Å; G283-R285 PolarHBondContact O-N 2.83Å; R285-F287 VanDerWaalsContact C-N 3.28Å; R285-F287 PolarHBondContact O-N 2.91Å; R285-E288 CarbonylContact O-C 3.57Å; R285-E288 PolarHBondContact O-N 3.4Å; R285-E288 VanDerWaalsContact O-N 3.14Å; R285-S289 VanDerWaalsContact O-CB 3.22Å; R285-S289 WeakPolarHBondContact O-CB 3.33Å; R285-S289 PolarHBondContact O-N 3.24Å; R285-S289 PolarHBondContact O-OG 2.92Å; R285-P410 HydrophobicContact CB-CG 4.28Å; R285-T414 PolarHBondContact NH1-O 3.36Å
286	W	92.9	Very high	90.5	Very high	19 Å²	19	39 Å²	39	7%	0.072	20%	0.204	C	C	.	.	H	α-helix	trans	-58.5	-41.3	176.5	-176.8	89	0	0	0	111.9	F224 V280 L282 G283 Q284 M291 V299 L329 L408 P410	F224-W286 HydrophobicContact CE1-CE3 4.4Å; F224-W286 HydrophobicContact CE1-CZ3 4.38Å; F224-W286 HydrophobicContact CZ-CD2 4.12Å; F224-W286 AromaticContact CZ-CE3 3.75Å; F224-W286 HydrophobicContact CZ-CE3 3.75Å; F224-W286 HydrophobicContact CZ-CZ3 4.09Å; V280-W286 HydrophobicContact CG1-CB 3.98Å; V280-W286 HydrophobicContact CG1-CG 4.15Å; V280-W286 HydrophobicContact CG2-CG 4.45Å; L282-W286 PolarHBondContact O-N 2.71Å; G283-W286 WeakPolarHBondContact O-CB 3.19Å; G283-W286 PolarHBondContact O-N 2.74Å; G283-W286 VanDerWaalsContact O-N 3.16Å; Q284-W286 VanDerWaalsContact C-N 3.28Å; Q284-W286 PolarHBondContact O-N 3.43Å; W286-M291 HydrophobicContact CZ2-CE 4.19Å; W286-M291 HydrophobicContact CZ2-SD 4.48Å; W286-V299 HydrophobicContact CH2-CG1 3.91Å; W286-V299 HydrophobicContact CZ2-CG1 4.46Å; W286-L329 HydrophobicContact CE3-CD2 4.23Å; W286-L329 HydrophobicContact CH2-CD2 3.46Å; W286-L329 VanDerWaalsContact CH2-CD2 3.46Å; W286-L329 HydrophobicContact CZ2-CD2 4.4Å; W286-L329 HydrophobicContact CZ3-CD2 3.34Å; W286-L329 HydrophobicContact CZ3-CG 4.31Å; W286-L408 PolarHBondContact NE1-O 3.42Å; W286-P410 HydrophobicContact CB-CG 4.36Å
287	F	90.8	Very high	90.1	Very high	14 Å²	14	46.6 Å²	46.6	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-73	-25.8	175.5	-83.6	-88.1	0	0	0	114.4	E223 F224 G283 Q284 R285 L329 E333 W378 W382	E223-F287 HydrophobicContact CB-CZ 4.27Å; E223-F287 HydrophobicContact CG-CE2 4.16Å; E223-F287 HydrophobicContact CG-CZ 3.72Å; F224-F287 AromaticContact CE2-CE2 3.98Å; F224-F287 HydrophobicContact CE2-CE2 3.98Å; F224-F287 HydrophobicContact CZ-CD2 4.5Å; F224-F287 AromaticContact CZ-CE2 3.91Å; F224-F287 HydrophobicContact CZ-CE2 3.91Å; G283-F287 WeakPolarHBondContact O-CD2 3.32Å; G283-F287 PolarHBondContact O-N 2.71Å; Q284-F287 PolarHBondContact O-N 3.14Å; R285-F287 VanDerWaalsContact C-N 3.28Å; R285-F287 PolarHBondContact O-N 2.91Å; F287-L329 HydrophobicContact CD1-CB 4.3Å; F287-L329 HydrophobicContact CD1-CD2 4.13Å; F287-L329 HydrophobicContact CD1-CG 3.69Å; F287-L329 HydrophobicContact CE1-CD1 4.21Å; F287-L329 HydrophobicContact CE1-CD2 4.15Å; F287-L329 HydrophobicContact CE1-CG 3.58Å; F287-E333 HydrophobicContact CD1-CB 4.15Å; F287-E333 HydrophobicContact CE1-CB 3.52Å; F287-E333 HydrophobicContact CE1-CG 3.78Å; F287-E333 HydrophobicContact CE2-CG 4.38Å; F287-E333 HydrophobicContact CZ-CB 3.96Å; F287-E333 HydrophobicContact CZ-CG 3.68Å; F287-W378 HydrophobicContact CB-CH2 3.88Å; F287-W378 HydrophobicContact CB-CZ2 3.61Å; F287-W378 HydrophobicContact CD1-CH2 4.07Å; F287-W378 HydrophobicContact CD2-CH2 4.33Å; F287-W378 AromaticContact CG-CH2 3.86Å; F287-W378 HydrophobicContact CG-CH2 3.86Å; F287-W378 HydrophobicContact CG-CZ2 4.09Å; F287-W382 AromaticContact CD2-CH2 3.77Å; F287-W382 HydrophobicContact CD2-CH2 3.77Å; F287-W382 AromaticContact CD2-CZ2 3.21Å; F287-W382 HydrophobicContact CD2-CZ2 3.21Å; F287-W382 AromaticContact CE2-CH2 3.61Å; F287-W382 HydrophobicContact CE2-CH2 3.61Å; F287-W382 AromaticContact CE2-CZ2 3.32Å; F287-W382 HydrophobicContact CE2-CZ2 3.32Å; F287-W382 HydrophobicContact CG-CZ2 4.2Å; F287-W382 HydrophobicContact CZ-CZ2 4.34Å
288	E	89.1	Confident	89.7	Confident	95 Å²	95	47.9 Å²	47.9	44%	0.444	25%	0.246	S	C	.	.	H	α-helix	trans	-92.1	-18.4	-178.9	-67.8	171.7	-176.7	0	0	113.1	Q284 R285 W378	Q284-E288 VanDerWaalsContact CG-OE1 3.28Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.32Å; Q284-E288 PolarHBondContact NE2-OE1 2.88Å; Q284-E288 WeakPolarHBondContact O-CG 3.32Å; Q284-E288 PolarHBondContact O-N 3.19Å; R285-E288 CarbonylContact O-C 3.57Å; R285-E288 PolarHBondContact O-N 3.4Å; R285-E288 VanDerWaalsContact O-N 3.14Å; E288-W378 PolarHBondContact OE1-NE1 2.95Å
289	S	83.8	Confident	89.4	Confident	30 Å²	30	48.1 Å²	48.1	21%	0.21	25%	0.248	C	C	.	.	S	Bend	trans	-73.5	146.1	-175.9	-67	0	0	0	0	112.1	R285 M291 P410	R285-S289 VanDerWaalsContact O-CB 3.22Å; R285-S289 WeakPolarHBondContact O-CB 3.33Å; R285-S289 PolarHBondContact O-N 3.24Å; R285-S289 PolarHBondContact O-OG 2.92Å; S289-M291 PolarHBondContact O-N 3.06Å; S289-M291 VanDerWaalsContact O-N 3.09Å; S289-P410 WeakPolarHBondContact OG-CB 3.5Å; S289-P410 WeakPolarHBondContact OG-CG 3.47Å
290	A	72.4	Confident	89.1	Confident	106 Å²	106	48.7 Å²	48.7	88%	0.876	25%	0.25	S	S	*	.			trans	-79.5	88.6	174.8	0	0	0	0	0	110.1
291	M	82.9	Confident	89	Confident	17 Å²	17	53.9 Å²	53.9	8%	0.084	27%	0.273	C	S	.	.			trans	-73.4	153.2	163.5	-71.7	-178.6	-79.3	0	0	110.6	W286 S289 R296 L329 L408	W286-M291 HydrophobicContact CZ2-CE 4.19Å; W286-M291 HydrophobicContact CZ2-SD 4.48Å; S289-M291 PolarHBondContact O-N 3.06Å; S289-M291 VanDerWaalsContact O-N 3.09Å; M291-R296 HydrophobicContact CB-CB 4.43Å; M291-L329 HydrophobicContact CE-CD2 4.15Å; M291-L408 HydrophobicContact SD-CD2 4.44Å
292	P	86.5	Confident	88.7	Confident	18 Å²	18	56.2 Å²	56.2	12%	0.117	28%	0.284	C	S	.	.			trans	-52.3	139.5	173	-24.7	32.7	0	0	0	111.6	L55 P56 L294 Y295 R296 P407	L55-P292 HydrophobicContact CD2-CB 3.74Å; L55-P292 HydrophobicContact CD2-CG 4.41Å; P56-P292 HydrophobicContact CG-CG 4.49Å; P292-L294 PolarHBondContact O-N 3.3Å; P292-L294 VanDerWaalsContact O-N 3.08Å; P292-Y295 HydrophobicContact CB-CD2 3.88Å; P292-Y295 HydrophobicContact CB-CE2 4.47Å; P292-Y295 HydrophobicContact CG-CD2 3.87Å; P292-Y295 HydrophobicContact CG-CE2 4.3Å; P292-Y295 PolarHBondContact O-N 2.85Å; P292-Y295 VanDerWaalsContact O-N 3.09Å; P292-R296 PolarHBondContact O-N 3.05Å; P292-P407 WeakPolarHBondContact CD-O 3.24Å
293	P	86.4	Confident	88.5	Confident	77 Å²	77	55 Å²	55	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-53.8	-36.4	-171.1	-28.9	35.1	0	0	0	114.3	R296 W297	P293-R296 PolarHBondContact O-N 3.18Å; P293-W297 VanDerWaalsContact O-CB 3.28Å; P293-W297 WeakPolarHBondContact O-CB 3.46Å; P293-W297 PolarHBondContact O-N 2.97Å
294	L	87.1	Confident	88.5	Confident	69 Å²	69	57.4 Å²	57.4	36%	0.361	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-50	178.6	-176.4	68.7	0	0	0	112.3	L53 L55 P292 W297 G298	L53-L294 HydrophobicContact CB-CD2 4.5Å; L53-L294 HydrophobicContact CD1-CD2 3.89Å; L55-L294 HydrophobicContact CD1-CD2 4.28Å; L55-L294 HydrophobicContact CD2-CB 4.44Å; L55-L294 HydrophobicContact CD2-CD2 4.45Å; P292-L294 PolarHBondContact O-N 3.3Å; P292-L294 VanDerWaalsContact O-N 3.08Å; L294-W297 PolarHBondContact O-N 3.03Å; L294-G298 PolarHBondContact O-N 3.14Å
295	Y	88.7	Confident	88.3	Confident	28 Å²	28	59.1 Å²	59.1	11%	0.11	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-43.5	178.3	-66.7	-60.7	0	0	0	111.4	L55 H112 T115 P292 W297 G298 V299 P407 L408	L55-Y295 HydrophobicContact CD2-CD2 4.34Å; L55-Y295 HydrophobicContact CD2-CE2 3.92Å; H112-Y295 AromaticContact CE1-CE2 3.69Å; H112-Y295 AromaticContact ND1-CE2 3.37Å; H112-Y295 WeakPolarHBondContact ND1-CE2 3.36Å; H112-Y295 AromaticContact ND1-CZ 3.58Å; H112-Y295 PolarHBondContact ND1-OH 2.96Å; T115-Y295 HydrophobicContact CG2-CE1 4.28Å; P292-Y295 HydrophobicContact CB-CD2 3.88Å; P292-Y295 HydrophobicContact CB-CE2 4.47Å; P292-Y295 HydrophobicContact CG-CD2 3.87Å; P292-Y295 HydrophobicContact CG-CE2 4.3Å; P292-Y295 PolarHBondContact O-N 2.85Å; P292-Y295 VanDerWaalsContact O-N 3.09Å; Y295-W297 VanDerWaalsContact C-N 3.28Å; Y295-W297 PolarHBondContact O-N 3.24Å; Y295-G298 PolarHBondContact O-N 3.39Å; Y295-G298 VanDerWaalsContact O-N 3.14Å; Y295-V299 WeakPolarHBondContact O-CG2 3.49Å; Y295-V299 PolarHBondContact O-N 3.48Å; Y295-P407 HydrophobicContact CD2-CB 4.3Å; Y295-P407 HydrophobicContact CE2-CB 3.81Å; Y295-P407 HydrophobicContact CE2-CG 4.04Å; Y295-L408 HydrophobicContact CD1-CD2 3.66Å; Y295-L408 HydrophobicContact CD2-CD2 4.01Å; Y295-L408 HydrophobicContact CE1-CD2 4.33Å; Y295-L408 HydrophobicContact CG-CD2 3.46Å; Y295-L408 VanDerWaalsContact CG-CD2 3.46Å
296	R	89	Confident	88.2	Confident	119 Å²	119	54.6 Å²	54.6	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-57.8	-43.6	176.9	-169.6	-179.9	75.6	167.9	0.9	111.5	M291 P292 P293 L300	M291-R296 HydrophobicContact CB-CB 4.43Å; P292-R296 PolarHBondContact O-N 3.05Å; P293-R296 PolarHBondContact O-N 3.18Å; R296-L300 WeakPolarHBondContact O-CB 3.37Å; R296-L300 PolarHBondContact O-N 3.34Å; R296-L300 VanDerWaalsContact O-N 3.08Å
297	W	89.8	Confident	88	Confident	160 Å²	160	53.8 Å²	53.8	61%	0.606	28%	0.277	S	S	*	.	H	α-helix	trans	-64.2	-46.1	175.3	176.3	87.2	0	0	0	111.6	P293 L294 Y295 L300 F301	P293-W297 VanDerWaalsContact O-CB 3.28Å; P293-W297 WeakPolarHBondContact O-CB 3.46Å; P293-W297 PolarHBondContact O-N 2.97Å; L294-W297 PolarHBondContact O-N 3.03Å; Y295-W297 VanDerWaalsContact C-N 3.28Å; Y295-W297 PolarHBondContact O-N 3.24Å; W297-L300 PolarHBondContact O-N 3.49Å; W297-F301 HydrophobicContact CH2-CG 4.4Å; W297-F301 HydrophobicContact CZ2-CB 4.45Å; W297-F301 HydrophobicContact CZ2-CD2 4.27Å; W297-F301 HydrophobicContact CZ2-CG 4.33Å; W297-F301 WeakPolarHBondContact O-CB 3.19Å; W297-F301 PolarHBondContact O-N 3Å
298	G	89.4	Confident	88	Confident	29 Å²	29	56 Å²	56	30%	0.299	29%	0.294	S	S	.	.	H	α-helix	trans	-59.6	-47.2	179.1	0	0	0	0	0	112.9	L294 Y295 F301 H302	L294-G298 PolarHBondContact O-N 3.14Å; Y295-G298 PolarHBondContact O-N 3.39Å; Y295-G298 VanDerWaalsContact O-N 3.14Å; G298-F301 PolarHBondContact O-N 3.35Å; G298-H302 WeakPolarHBondContact O-CB 3.07Å; G298-H302 PolarHBondContact O-N 3.46Å
299	V	89.7	Confident	88	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.03	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-49.5	176.4	174.4	0	0	0	0	110.7	W182 W286 Y295 F301 H302 R303 L329	W182-V299 HydrophobicContact CZ2-CG2 3.99Å; W286-V299 HydrophobicContact CH2-CG1 3.91Å; W286-V299 HydrophobicContact CZ2-CG1 4.46Å; Y295-V299 WeakPolarHBondContact O-CG2 3.49Å; Y295-V299 PolarHBondContact O-N 3.48Å; V299-F301 PolarHBondContact O-N 3.19Å; V299-H302 PolarHBondContact O-N 2.89Å; V299-R303 WeakPolarHBondContact O-CB 3.38Å; V299-R303 WeakPolarHBondContact O-CG 3.34Å; V299-R303 PolarHBondContact O-N 3Å; V299-L329 HydrophobicContact CG1-CD1 3.99Å; V299-L329 HydrophobicContact CG1-CD2 3.74Å
300	L	91.8	Very high	88.2	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.084	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-43	178.7	178.8	61.3	0	0	0	112.2	R296 W297 R303 K304 L329 F332	R296-L300 WeakPolarHBondContact O-CB 3.37Å; R296-L300 PolarHBondContact O-N 3.34Å; R296-L300 VanDerWaalsContact O-N 3.08Å; W297-L300 PolarHBondContact O-N 3.49Å; L300-R303 PolarHBondContact O-N 3.49Å; L300-K304 HydrophobicContact CD1-CD 4.5Å; L300-K304 HydrophobicContact CD1-CG 4.37Å; L300-K304 HydrophobicContact CG-CD 4.43Å; L300-K304 WeakPolarHBondContact O-CG 3.44Å; L300-K304 PolarHBondContact O-N 2.84Å; L300-L329 HydrophobicContact CD1-CD1 4.4Å; L300-F332 HydrophobicContact CD1-CB 3.88Å; L300-F332 HydrophobicContact CD1-CD2 4.12Å; L300-F332 HydrophobicContact CD1-CG 4.09Å
301	F	91.9	Very high	88.9	Confident	112 Å²	112	56.4 Å²	56.4	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-47.6	177.7	176.5	-99.4	0	0	0	110.8	W297 G298 V299 R303 K304 M305	W297-F301 HydrophobicContact CH2-CG 4.4Å; W297-F301 HydrophobicContact CZ2-CB 4.45Å; W297-F301 HydrophobicContact CZ2-CD2 4.27Å; W297-F301 HydrophobicContact CZ2-CG 4.33Å; W297-F301 WeakPolarHBondContact O-CB 3.19Å; W297-F301 PolarHBondContact O-N 3Å; G298-F301 PolarHBondContact O-N 3.35Å; V299-F301 PolarHBondContact O-N 3.19Å; F301-R303 VanDerWaalsContact C-N 3.33Å; F301-R303 PolarHBondContact O-N 3.28Å; F301-K304 PolarHBondContact O-N 2.62Å; F301-M305 WeakPolarHBondContact O-CB 3.34Å; F301-M305 PolarHBondContact O-N 2.75Å
302	H	89.2	Confident	89	Confident	55 Å²	55	60.9 Å²	60.9	26%	0.255	30%	0.301	S	S	.	.	H	α-helix	trans	-58.8	-45.5	176.2	-176.8	85.7	0	0	0	111.6	W182 G298 V299 K304 M305 Q306	W182-H302 WeakPolarHBondContact CA-NE2 3.47Å; W182-H302 AromaticContact CD1-CD2 4Å; W182-H302 PolarHBondContact O-CE1 3.49Å; W182-H302 PolarHBondContact O-NE2 3.16Å; W182-H302 VanDerWaalsContact O-NE2 3.11Å; G298-H302 WeakPolarHBondContact O-CB 3.07Å; G298-H302 PolarHBondContact O-N 3.46Å; V299-H302 PolarHBondContact O-N 2.89Å; H302-K304 PolarHBondContact O-N 3.22Å; H302-M305 WeakPolarHBondContact O-CB 2.87Å; H302-M305 PolarHBondContact O-N 3.39Å; H302-M305 VanDerWaalsContact O-N 3.15Å; H302-Q306 VanDerWaalsContact NE2-CD 3.34Å; H302-Q306 PolarHBondContact NE2-NE2 3.32Å; H302-Q306 PolarHBondContact O-N 2.8Å
303	R	89.3	Confident	89	Confident	14 Å²	14	63.8 Å²	63.8	5%	0.053	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-45.4	177.2	-78.8	-48.7	-35.7	179	27.2	113.2	E223 V299 L300 F301 M305 Q306 L307 L329 F332	E223-R303 WeakPolarHBondContact OE2-CD 3.38Å; E223-R303 IonicContact OE2-CZ 3.6Å; E223-R303 VanDerWaalsContact OE2-CZ 3.3Å; E223-R303 IonicContact OE2-NE 3.53Å; E223-R303 PolarHBondContact OE2-NE 2.91Å; E223-R303 IonicContact OE2-NH1 3.53Å; E223-R303 PolarHBondContact OE2-NH1 3.23Å; V299-R303 WeakPolarHBondContact O-CB 3.38Å; V299-R303 WeakPolarHBondContact O-CG 3.34Å; V299-R303 PolarHBondContact O-N 3Å; L300-R303 PolarHBondContact O-N 3.49Å; F301-R303 VanDerWaalsContact C-N 3.33Å; F301-R303 PolarHBondContact O-N 3.28Å; R303-M305 VanDerWaalsContact C-N 3.33Å; R303-Q306 VanDerWaalsContact NH1-OE1 3.16Å; R303-Q306 PolarHBondContact O-N 2.9Å; R303-L307 WeakPolarHBondContact O-CB 3.39Å; R303-L307 PolarHBondContact O-N 2.9Å; R303-L329 HydrophobicContact CG-CD1 4.12Å; R303-F332 HydrophobicContact CB-CD1 4.48Å; R303-F332 HydrophobicContact CB-CE1 3.96Å; R303-F332 HydrophobicContact CB-CZ 4.05Å
304	K	92.2	Very high	88.9	Confident	49 Å²	49	60.2 Å²	60.2	21%	0.213	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-39.9	175.2	-72.3	-177.7	177.8	-164.9	0	111.6	L300 F301 H302 L307 S308 L324 S326 F332	L300-K304 HydrophobicContact CD1-CD 4.5Å; L300-K304 HydrophobicContact CD1-CG 4.37Å; L300-K304 HydrophobicContact CG-CD 4.43Å; L300-K304 WeakPolarHBondContact O-CG 3.44Å; L300-K304 PolarHBondContact O-N 2.84Å; F301-K304 PolarHBondContact O-N 2.62Å; H302-K304 PolarHBondContact O-N 3.22Å; K304-L307 PolarHBondContact O-N 2.85Å; K304-S308 VanDerWaalsContact O-CB 3.27Å; K304-S308 WeakPolarHBondContact O-CB 3.49Å; K304-S308 PolarHBondContact O-N 2.88Å; K304-S308 PolarHBondContact O-OG 3.07Å; K304-L324 HydrophobicContact CB-CD2 3.94Å; K304-L324 WeakPolarHBondContact CE-O 3.43Å; K304-L324 HydrophobicContact CG-CD2 4.16Å; K304-L324 PolarHBondContact NZ-O 3.16Å; K304-S326 WeakPolarHBondContact CE-O 3.45Å; K304-S326 PolarHBondContact NZ-O 2.64Å; K304-F332 HydrophobicContact CG-CD2 4.03Å; K304-F332 HydrophobicContact CG-CE2 3.75Å
305	M	90.3	Very high	88.8	Confident	92 Å²	92	64.4 Å²	64.4	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-38.3	176.5	-169.6	-172.5	-174.7	0	0	112.2	F301 H302 R303 S308	F301-M305 WeakPolarHBondContact O-CB 3.34Å; F301-M305 PolarHBondContact O-N 2.75Å; H302-M305 WeakPolarHBondContact O-CB 2.87Å; H302-M305 PolarHBondContact O-N 3.39Å; H302-M305 VanDerWaalsContact O-N 3.15Å; R303-M305 VanDerWaalsContact C-N 3.33Å; M305-S308 PolarHBondContact O-OG 2.85Å
306	Q	88.2	Confident	88.2	Confident	22 Å²	22	66.3 Å²	66.3	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-66.3	-45.8	174	-73.3	-170.1	-11.2	0	0	111.4	T181 W182 H302 R303 S308 R309 Y310	T181-Q306 PolarHBondContact O-NE2 2.96Å; W182-Q306 PolarHBondContact O-NE2 2.86Å; W182-Q306 VanDerWaalsContact O-NE2 3.12Å; H302-Q306 VanDerWaalsContact NE2-CD 3.34Å; H302-Q306 PolarHBondContact NE2-NE2 3.32Å; H302-Q306 PolarHBondContact O-N 2.8Å; R303-Q306 VanDerWaalsContact NH1-OE1 3.16Å; R303-Q306 PolarHBondContact O-N 2.9Å; Q306-S308 VanDerWaalsContact C-N 3.33Å; Q306-S308 PolarHBondContact O-N 2.57Å; Q306-R309 PolarHBondContact O-N 3.14Å; Q306-Y310 WeakPolarHBondContact O-CD2 3.32Å
307	L	89.7	Confident	87.7	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-37.1	179.1	-177	63.6	0	0	0	111.8	I221 R303 K304 R309 Y310 V311 L314 V320 A323 L324 F332 L336	I221-L307 HydrophobicContact CD1-CD1 3.9Å; R303-L307 WeakPolarHBondContact O-CB 3.39Å; R303-L307 PolarHBondContact O-N 2.9Å; K304-L307 PolarHBondContact O-N 2.85Å; L307-R309 PolarHBondContact O-N 3.34Å; L307-Y310 PolarHBondContact O-N 3.3Å; L307-V311 PolarHBondContact O-N 3.38Å; L307-L314 HydrophobicContact CD1-CD1 3.71Å; L307-V320 HydrophobicContact CD1-CG1 4.31Å; L307-V320 HydrophobicContact CD1-CG2 4.43Å; L307-V320 HydrophobicContact CD2-CG1 3.93Å; L307-V320 HydrophobicContact CG-CG1 3.88Å; L307-A323 HydrophobicContact CD2-CB 3.94Å; L307-L324 HydrophobicContact CB-CD2 4.4Å; L307-L324 HydrophobicContact CD2-CD2 4.18Å; L307-L324 HydrophobicContact CD2-CG 4.35Å; L307-L324 HydrophobicContact CG-CD2 4.45Å; L307-F332 HydrophobicContact CB-CZ 4.13Å; L307-F332 HydrophobicContact CD2-CE2 3.78Å; L307-F332 HydrophobicContact CD2-CZ 3.63Å; L307-L336 HydrophobicContact CD2-CD1 4.29Å; L307-L336 HydrophobicContact CD2-CD2 4.08Å
308	S	90.5	Very high	87.4	Confident	59 Å²	59	57.3 Å²	57.3	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-29.8	-178.3	72.6	0	0	0	0	113	K304 M305 Q306 Y310 V311	K304-S308 VanDerWaalsContact O-CB 3.27Å; K304-S308 WeakPolarHBondContact O-CB 3.49Å; K304-S308 PolarHBondContact O-N 2.88Å; K304-S308 PolarHBondContact O-OG 3.07Å; M305-S308 PolarHBondContact O-OG 2.85Å; Q306-S308 VanDerWaalsContact C-N 3.33Å; Q306-S308 PolarHBondContact O-N 2.57Å; S308-Y310 PolarHBondContact O-N 2.92Å; S308-V311 VanDerWaalsContact O-CG2 3.29Å; S308-V311 WeakPolarHBondContact O-CG2 2.88Å
309	R	88.9	Confident	87.2	Confident	157 Å²	157	59.5 Å²	59.5	59%	0.592	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.7	175.7	-66.9	175.2	-179.2	179.1	0.5	113.5	Q306 L307	Q306-R309 PolarHBondContact O-N 3.14Å; L307-R309 PolarHBondContact O-N 3.34Å
310	Y	87.5	Confident	87.2	Confident	50 Å²	50	59.3 Å²	59.3	20%	0.196	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	16.3	-172.2	-57.1	-66.5	0	0	0	113.3	G210 L216 Q306 L307 S308 S312 S313 L314	G210-Y310 PolarHBondContact O-OH 2.93Å; L216-Y310 HydrophobicContact CB-CD1 3.84Å; L216-Y310 HydrophobicContact CB-CD2 4.29Å; L216-Y310 HydrophobicContact CB-CE1 3.55Å; L216-Y310 HydrophobicContact CB-CE2 4.02Å; L216-Y310 HydrophobicContact CB-CG 4.2Å; L216-Y310 HydrophobicContact CD2-CD1 4.18Å; L216-Y310 HydrophobicContact CD2-CD2 3.76Å; L216-Y310 HydrophobicContact CD2-CE2 4.2Å; L216-Y310 HydrophobicContact CD2-CG 3.74Å; Q306-Y310 WeakPolarHBondContact O-CD2 3.32Å; L307-Y310 PolarHBondContact O-N 3.3Å; S308-Y310 PolarHBondContact O-N 2.92Å; Y310-S312 VanDerWaalsContact C-N 3.34Å; Y310-S312 PolarHBondContact O-N 3.12Å; Y310-S313 PolarHBondContact O-N 2.82Å; Y310-S313 VanDerWaalsContact O-N 3.16Å; Y310-L314 WeakPolarHBondContact O-CB 3.22Å; Y310-L314 VanDerWaalsContact O-CG 3.3Å; Y310-L314 WeakPolarHBondContact O-CG 3.34Å; Y310-L314 PolarHBondContact O-N 3.24Å
311	V	87.7	Confident	87.1	Confident	34 Å²	34	61 Å²	61	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-54	-49.6	-177.8	173.4	0	0	0	0	111.5	L307 S308 S313 L314 R315 V320 L324	L307-V311 PolarHBondContact O-N 3.38Å; S308-V311 VanDerWaalsContact O-CG2 3.29Å; S308-V311 WeakPolarHBondContact O-CG2 2.88Å; V311-S313 VanDerWaalsContact C-N 3.29Å; V311-S313 PolarHBondContact O-N 3.36Å; V311-L314 PolarHBondContact O-N 3.39Å; V311-R315 WeakPolarHBondContact O-CB 3.5Å; V311-R315 PolarHBondContact O-N 3.16Å; V311-V320 HydrophobicContact CB-CG1 4.27Å; V311-V320 HydrophobicContact CG1-CG1 4.2Å; V311-V320 HydrophobicContact CG2-CG1 3.71Å; V311-L324 HydrophobicContact CG2-CD1 3.94Å
312	S	86.1	Confident	87	Confident	110 Å²	110	60.8 Å²	60.8	77%	0.769	32%	0.318	S	S	*	.	H	α-helix	trans	-58.9	-40.3	-178.4	50.1	0	0	0	0	112.6	Y310	Y310-S312 VanDerWaalsContact C-N 3.34Å; Y310-S312 PolarHBondContact O-N 3.12Å
313	S	85.3	Confident	87.1	Confident	80 Å²	80	58.2 Å²	58.2	56%	0.559	31%	0.306	S	S	*	.	H	α-helix	trans	-76	-29.9	-179.7	-55.2	0	0	0	0	113.2	Y310 V311	Y310-S313 PolarHBondContact O-N 2.82Å; Y310-S313 VanDerWaalsContact O-N 3.16Å; V311-S313 VanDerWaalsContact C-N 3.29Å; V311-S313 PolarHBondContact O-N 3.36Å
314	L	85	Confident	87.3	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-100.9	-20.9	-171.4	-64.9	170	0	0	0	114.2	L216 A219 I221 L307 Y310 V311 G316 I317 L318 V320	L216-L314 HydrophobicContact CD2-CD1 4.22Å; L216-L314 HydrophobicContact CD2-CD2 4.41Å; A219-L314 HydrophobicContact CB-CD2 3.79Å; I221-L314 HydrophobicContact CD1-CD1 3.33Å; I221-L314 HydrophobicContact CD1-CD2 4.19Å; I221-L314 HydrophobicContact CD1-CG 4.39Å; I221-L314 HydrophobicContact CG1-CD1 4.42Å; L307-L314 HydrophobicContact CD1-CD1 3.71Å; Y310-L314 WeakPolarHBondContact O-CB 3.22Å; Y310-L314 VanDerWaalsContact O-CG 3.3Å; Y310-L314 WeakPolarHBondContact O-CG 3.34Å; Y310-L314 PolarHBondContact O-N 3.24Å; V311-L314 PolarHBondContact O-N 3.39Å; L314-G316 PolarHBondContact O-N 3.12Å; L314-G316 VanDerWaalsContact O-N 3.08Å; L314-I317 PolarHBondContact O-N 2.8Å; L314-L318 HydrophobicContact CD2-CD1 4.31Å; L314-L318 PolarHBondContact O-N 3.37Å; L314-V320 HydrophobicContact CB-CG2 3.7Å
315	R	83.7	Confident	87.4	Confident	157 Å²	157	66 Å²	66	59%	0.592	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25	-176.1	-167.7	175.9	-162.3	-171.9	4.4	114.4	V311 I317 D321	V311-R315 WeakPolarHBondContact O-CB 3.5Å; V311-R315 PolarHBondContact O-N 3.16Å; R315-I317 VanDerWaalsContact C-N 3.31Å; R315-D321 IonicContact CZ-OD2 3.24Å; R315-D321 VanDerWaalsContact CZ-OD2 3.24Å; R315-D321 IonicContact NE-OD1 3.96Å; R315-D321 IonicContact NE-OD2 2.9Å; R315-D321 PolarHBondContact NE-OD2 3.45Å; R315-D321 IonicContact NH2-OD1 3.72Å; R315-D321 IonicContact NH2-OD2 2.77Å; R315-D321 PolarHBondContact NH2-OD2 3.22Å
316	G	77.1	Confident	87.6	Confident	68 Å²	68	61.8 Å²	61.8	70%	0.701	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.9	175.6	0	0	0	0	0	114.9	L314	L314-G316 PolarHBondContact O-N 3.12Å; L314-G316 VanDerWaalsContact O-N 3.08Å
317	I	79.3	Confident	87.6	Confident	56 Å²	56	65.5 Å²	65.5	29%	0.287	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-38.4	-171.3	-58	169.7	0	0	0	111.2	A219 L314 R315	A219-I317 HydrophobicContact CB-CB 4.36Å; A219-I317 HydrophobicContact CB-CD1 3.3Å; A219-I317 HydrophobicContact CB-CG1 4.39Å; A219-I317 HydrophobicContact CB-CG2 4.03Å; L314-I317 PolarHBondContact O-N 2.8Å; R315-I317 VanDerWaalsContact C-N 3.31Å
318	L	82.8	Confident	87.7	Confident	33 Å²	33	67 Å²	67	17%	0.173	36%	0.356	C	S	.	.	S	Bend	trans	-124.5	152.5	-177.6	-58.4	174.6	0	0	0	110.9	I221 L314 V320 L336	I221-L318 HydrophobicContact CD1-CD1 4.14Å; L314-L318 HydrophobicContact CD2-CD1 4.31Å; L314-L318 PolarHBondContact O-N 3.37Å; L318-V320 HydrophobicContact CB-CG2 4.14Å; L318-V320 PolarHBondContact O-N 3.33Å; L318-L336 HydrophobicContact CB-CD2 4.42Å; L318-L336 HydrophobicContact CD1-CD2 4.41Å
319	D	85.2	Confident	87.7	Confident	75 Å²	75	64.5 Å²	64.5	40%	0.401	34%	0.338	S	S	.	.			trans	-79.4	68.3	172.7	-168.6	-5.9	0	0	0	111.2	D321 R322 A323 T335	D319-D321 VanDerWaalsContact C-N 3.29Å; D319-D321 PolarHBondContact O-N 3.06Å; D319-R322 HydrophobicContact CB-CB 4.38Å; D319-R322 PolarHBondContact O-N 3.04Å; D319-R322 VanDerWaalsContact OD1-CB 3.27Å; D319-R322 WeakPolarHBondContact OD1-CB 3.29Å; D319-R322 PolarHBondContact OD1-N 3.18Å; D319-R322 VanDerWaalsContact OD1-N 3.11Å; D319-R322 VanDerWaalsContact OD2-CB 3.26Å; D319-R322 WeakPolarHBondContact OD2-CB 3.45Å; D319-A323 PolarHBondContact O-N 3.17Å; D319-A323 VanDerWaalsContact O-N 3.14Å; D319-T335 HydrophobicContact CB-CG2 4.45Å
320	V	89.1	Confident	87.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-36.9	-177.6	-179.7	0	0	0	0	111.7	L307 V311 L314 L318 R322 A323 L324	L307-V320 HydrophobicContact CD1-CG1 4.31Å; L307-V320 HydrophobicContact CD1-CG2 4.43Å; L307-V320 HydrophobicContact CD2-CG1 3.93Å; L307-V320 HydrophobicContact CG-CG1 3.88Å; V311-V320 HydrophobicContact CB-CG1 4.27Å; V311-V320 HydrophobicContact CG1-CG1 4.2Å; V311-V320 HydrophobicContact CG2-CG1 3.71Å; L314-V320 HydrophobicContact CB-CG2 3.7Å; L318-V320 HydrophobicContact CB-CG2 4.14Å; L318-V320 PolarHBondContact O-N 3.33Å; V320-R322 VanDerWaalsContact C-N 3.35Å; V320-R322 PolarHBondContact O-N 3.38Å; V320-A323 PolarHBondContact O-N 2.62Å; V320-L324 HydrophobicContact CG1-CD1 3.91Å; V320-L324 HydrophobicContact CG1-CG 4.16Å; V320-L324 WeakPolarHBondContact O-CB 3.22Å; V320-L324 VanDerWaalsContact O-CG 3.3Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.78Å
321	D	90.3	Very high	88	Confident	51 Å²	51	62 Å²	62	27%	0.273	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-39.9	-177.9	-71.1	-45.3	0	0	0	111.3	R315 D319 R325	R315-D321 IonicContact CZ-OD2 3.24Å; R315-D321 VanDerWaalsContact CZ-OD2 3.24Å; R315-D321 IonicContact NE-OD1 3.96Å; R315-D321 IonicContact NE-OD2 2.9Å; R315-D321 PolarHBondContact NE-OD2 3.45Å; R315-D321 IonicContact NH2-OD1 3.72Å; R315-D321 IonicContact NH2-OD2 2.77Å; R315-D321 PolarHBondContact NH2-OD2 3.22Å; D319-D321 VanDerWaalsContact C-N 3.29Å; D319-D321 PolarHBondContact O-N 3.06Å; D321-R325 WeakPolarHBondContact O-CG 3.45Å; D321-R325 PolarHBondContact O-N 2.89Å; D321-R325 PolarHBondContact O-NE 3.11Å
322	R	90.8	Very high	88.3	Confident	109 Å²	109	60.4 Å²	60.4	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-69.5	-44.7	174.3	-174.9	-179.2	168.7	177.6	-1.6	111.5	D319 V320 L324 R325 S326 T335	D319-R322 HydrophobicContact CB-CB 4.38Å; D319-R322 PolarHBondContact O-N 3.04Å; D319-R322 VanDerWaalsContact OD1-CB 3.27Å; D319-R322 WeakPolarHBondContact OD1-CB 3.29Å; D319-R322 PolarHBondContact OD1-N 3.18Å; D319-R322 VanDerWaalsContact OD1-N 3.11Å; D319-R322 VanDerWaalsContact OD2-CB 3.26Å; D319-R322 WeakPolarHBondContact OD2-CB 3.45Å; V320-R322 VanDerWaalsContact C-N 3.35Å; V320-R322 PolarHBondContact O-N 3.38Å; R322-L324 VanDerWaalsContact C-N 3.32Å; R322-L324 PolarHBondContact O-N 3.14Å; R322-R325 WeakPolarHBondContact O-CB 3.36Å; R322-R325 PolarHBondContact O-N 3.28Å; R322-S326 PolarHBondContact O-N 3.03Å; R322-S326 PolarHBondContact O-OG 3.32Å; R322-T335 HydrophobicContact CB-CG2 3.7Å; R322-T335 HydrophobicContact CG-CG2 3.63Å
323	A	91.1	Very high	88.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-43.2	178.9	0	0	0	0	0	111.7	L307 D319 V320 R325 S326 F332 T335 L336	L307-A323 HydrophobicContact CD2-CB 3.94Å; D319-A323 PolarHBondContact O-N 3.17Å; D319-A323 VanDerWaalsContact O-N 3.14Å; V320-A323 PolarHBondContact O-N 2.62Å; A323-R325 PolarHBondContact O-N 3Å; A323-S326 WeakPolarHBondContact O-CB 3.28Å; A323-S326 PolarHBondContact O-N 3.34Å; A323-S326 VanDerWaalsContact O-N 3.13Å; A323-S326 PolarHBondContact O-OG 2.87Å; A323-F332 HydrophobicContact CB-CD2 4.14Å; A323-F332 HydrophobicContact CB-CE2 4.12Å; A323-F332 WeakPolarHBondContact O-CD2 3.42Å; A323-T335 HydrophobicContact CB-CG2 4.02Å; A323-L336 HydrophobicContact CB-CD2 3.63Å; A323-L336 HydrophobicContact CB-CG 3.87Å
324	L	93.4	Very high	88.8	Confident	48 Å²	48	54.3 Å²	54.3	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-23.1	177	-69.2	176.5	0	0	0	113.5	K304 L307 V311 V320 R322	K304-L324 HydrophobicContact CB-CD2 3.94Å; K304-L324 WeakPolarHBondContact CE-O 3.43Å; K304-L324 HydrophobicContact CG-CD2 4.16Å; K304-L324 PolarHBondContact NZ-O 3.16Å; L307-L324 HydrophobicContact CB-CD2 4.4Å; L307-L324 HydrophobicContact CD2-CD2 4.18Å; L307-L324 HydrophobicContact CD2-CG 4.35Å; L307-L324 HydrophobicContact CG-CD2 4.45Å; V311-L324 HydrophobicContact CG2-CD1 3.94Å; V320-L324 HydrophobicContact CG1-CD1 3.91Å; V320-L324 HydrophobicContact CG1-CG 4.16Å; V320-L324 WeakPolarHBondContact O-CB 3.22Å; V320-L324 VanDerWaalsContact O-CG 3.3Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.78Å; R322-L324 VanDerWaalsContact C-N 3.32Å; R322-L324 PolarHBondContact O-N 3.14Å
325	R	94	Very high	89.1	Confident	180 Å²	180	55 Å²	55	68%	0.679	28%	0.277	S	S	*	.	H	α-helix	trans	-85.8	-15.3	175.3	-71.6	-173.2	-64.9	-102.5	-1.4	114.1	D321 R322 A323	D321-R325 WeakPolarHBondContact O-CG 3.45Å; D321-R325 PolarHBondContact O-N 2.89Å; D321-R325 PolarHBondContact O-NE 3.11Å; R322-R325 WeakPolarHBondContact O-CB 3.36Å; R322-R325 PolarHBondContact O-N 3.28Å; A323-R325 PolarHBondContact O-N 3Å
326	S	93.1	Very high	89.3	Confident	3 Å²	3	48 Å²	48	2%	0.021	25%	0.252	C	S	.	.			trans	-58	140.3	-178	-66.1	0	0	0	0	113.1	K304 R322 A323 D331	K304-S326 WeakPolarHBondContact CE-O 3.45Å; K304-S326 PolarHBondContact NZ-O 2.64Å; R322-S326 PolarHBondContact O-N 3.03Å; R322-S326 PolarHBondContact O-OG 3.32Å; A323-S326 WeakPolarHBondContact O-CB 3.28Å; A323-S326 PolarHBondContact O-N 3.34Å; A323-S326 VanDerWaalsContact O-N 3.13Å; A323-S326 PolarHBondContact O-OG 2.87Å; S326-D331 WeakPolarHBondContact CA-OD2 3.32Å; S326-D331 WeakPolarHBondContact CB-OD2 3.45Å; S326-D331 PolarHBondContact OG-OD2 3.24Å
327	S	89.1	Confident	89.8	Confident	99 Å²	99	46.3 Å²	46.3	69%	0.692	23%	0.225	S	C	*	.	S	Bend	trans	-99	-6.8	-178.4	58.3	0	0	0	0	113.8
328	S	91.4	Very high	90.2	Very high	35 Å²	35	44.1 Å²	44.1	25%	0.245	22%	0.215	C	C	.	.	S	Bend	trans	-130.9	154.7	177.8	76.2	0	0	0	0	111	R330 D331 F332	S328-R330 VanDerWaalsContact C-N 3.33Å; S328-D331 PolarHBondContact O-N 3.15Å; S328-D331 WeakPolarHBondContact OG-CB 3.47Å; S328-D331 PolarHBondContact OG-N 3.08Å; S328-D331 VanDerWaalsContact OG-N 3.09Å; S328-F332 WeakPolarHBondContact O-CB 3.38Å; S328-F332 PolarHBondContact O-N 3.41Å
329	L	90.8	Very high	90	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-38.8	178.7	-169.6	60.8	0	0	0	111.8	W286 F287 M291 V299 L300 R303 F332 E333	W286-L329 HydrophobicContact CE3-CD2 4.23Å; W286-L329 HydrophobicContact CH2-CD2 3.46Å; W286-L329 VanDerWaalsContact CH2-CD2 3.46Å; W286-L329 HydrophobicContact CZ2-CD2 4.4Å; W286-L329 HydrophobicContact CZ3-CD2 3.34Å; W286-L329 HydrophobicContact CZ3-CG 4.31Å; F287-L329 HydrophobicContact CD1-CB 4.3Å; F287-L329 HydrophobicContact CD1-CD2 4.13Å; F287-L329 HydrophobicContact CD1-CG 3.69Å; F287-L329 HydrophobicContact CE1-CD1 4.21Å; F287-L329 HydrophobicContact CE1-CD2 4.15Å; F287-L329 HydrophobicContact CE1-CG 3.58Å; M291-L329 HydrophobicContact CE-CD2 4.15Å; V299-L329 HydrophobicContact CG1-CD1 3.99Å; V299-L329 HydrophobicContact CG1-CD2 3.74Å; L300-L329 HydrophobicContact CD1-CD1 4.4Å; R303-L329 HydrophobicContact CG-CD1 4.12Å; L329-F332 WeakPolarHBondContact O-CB 3.45Å; L329-F332 PolarHBondContact O-N 3.41Å; L329-E333 PolarHBondContact O-N 3.02Å; L329-E333 VanDerWaalsContact O-N 3.08Å
330	R	92	Very high	89	Confident	103 Å²	103	46.1 Å²	46.1	39%	0.389	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-50	173.3	178.1	175.7	175.9	-138.6	-8.6	112.4	S328 F332 E333 E334 W378	S328-R330 VanDerWaalsContact C-N 3.33Å; R330-F332 VanDerWaalsContact C-N 3.27Å; R330-F332 PolarHBondContact O-N 3.38Å; R330-E333 PolarHBondContact O-N 3.34Å; R330-E334 VanDerWaalsContact O-CB 3.27Å; R330-E334 WeakPolarHBondContact O-CB 3.16Å; R330-E334 PolarHBondContact O-N 3.4Å; R330-W378 HydrophobicContact CG-CD2 4.45Å; R330-W378 HydrophobicContact CG-CH2 3.96Å; R330-W378 HydrophobicContact CG-CZ2 3.78Å; R330-W378 HydrophobicContact CG-CZ3 4.35Å
331	D	91.7	Very high	87.1	Confident	51 Å²	51	52.2 Å²	52.2	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-34.5	-179.4	-179.6	53.5	0	0	0	111.9	S326 S328 T335	S326-D331 WeakPolarHBondContact CA-OD2 3.32Å; S326-D331 WeakPolarHBondContact CB-OD2 3.45Å; S326-D331 PolarHBondContact OG-OD2 3.24Å; S328-D331 PolarHBondContact O-N 3.15Å; S328-D331 WeakPolarHBondContact OG-CB 3.47Å; S328-D331 PolarHBondContact OG-N 3.08Å; S328-D331 VanDerWaalsContact OG-N 3.09Å; D331-T335 VanDerWaalsContact O-CB 3.24Å; D331-T335 WeakPolarHBondContact O-CB 3.32Å; D331-T335 PolarHBondContact O-N 2.76Å; D331-T335 PolarHBondContact O-OG1 2.72Å
332	F	92.5	Very high	84.9	Confident	1 Å²	1	57.4 Å²	57.4	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-51	172.4	179	-86.3	0	0	0	111.3	L300 R303 K304 L307 A323 S328 L329 R330 L336	L300-F332 HydrophobicContact CD1-CB 3.88Å; L300-F332 HydrophobicContact CD1-CD2 4.12Å; L300-F332 HydrophobicContact CD1-CG 4.09Å; R303-F332 HydrophobicContact CB-CD1 4.48Å; R303-F332 HydrophobicContact CB-CE1 3.96Å; R303-F332 HydrophobicContact CB-CZ 4.05Å; K304-F332 HydrophobicContact CG-CD2 4.03Å; K304-F332 HydrophobicContact CG-CE2 3.75Å; L307-F332 HydrophobicContact CB-CZ 4.13Å; L307-F332 HydrophobicContact CD2-CE2 3.78Å; L307-F332 HydrophobicContact CD2-CZ 3.63Å; A323-F332 HydrophobicContact CB-CD2 4.14Å; A323-F332 HydrophobicContact CB-CE2 4.12Å; A323-F332 WeakPolarHBondContact O-CD2 3.42Å; S328-F332 WeakPolarHBondContact O-CB 3.38Å; S328-F332 PolarHBondContact O-N 3.41Å; L329-F332 WeakPolarHBondContact O-CB 3.45Å; L329-F332 PolarHBondContact O-N 3.41Å; R330-F332 VanDerWaalsContact C-N 3.27Å; R330-F332 PolarHBondContact O-N 3.38Å; F332-L336 HydrophobicContact CD1-CD1 4.03Å; F332-L336 HydrophobicContact CE1-CD1 3.48Å; F332-L336 VanDerWaalsContact CE1-CD1 3.48Å; F332-L336 HydrophobicContact CZ-CD1 3.86Å; F332-L336 WeakPolarHBondContact O-CG 3.31Å; F332-L336 PolarHBondContact O-N 3.15Å
333	E	91.6	Very high	82.2	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-45.4	-178.9	-171.1	71.9	177.8	0	0	112.2	E223 F287 L329 R330 T335 L336 F337 W378 Y381	E223-E333 WeakPolarHBondContact CB-OE1 3.34Å; F287-E333 HydrophobicContact CD1-CB 4.15Å; F287-E333 HydrophobicContact CE1-CB 3.52Å; F287-E333 HydrophobicContact CE1-CG 3.78Å; F287-E333 HydrophobicContact CE2-CG 4.38Å; F287-E333 HydrophobicContact CZ-CB 3.96Å; F287-E333 HydrophobicContact CZ-CG 3.68Å; L329-E333 PolarHBondContact O-N 3.02Å; L329-E333 VanDerWaalsContact O-N 3.08Å; R330-E333 PolarHBondContact O-N 3.34Å; E333-T335 VanDerWaalsContact C-N 3.28Å; E333-T335 PolarHBondContact O-N 2.85Å; E333-L336 PolarHBondContact O-N 2.91Å; E333-L336 VanDerWaalsContact O-N 3.11Å; E333-F337 VanDerWaalsContact CD-CD2 3.45Å; E333-F337 VanDerWaalsContact CD-CE2 3.46Å; E333-F337 HydrophobicContact CG-CD2 4.02Å; E333-F337 HydrophobicContact CG-CE2 4.48Å; E333-F337 WeakPolarHBondContact O-CD2 3.4Å; E333-F337 PolarHBondContact O-N 3.42Å; E333-F337 VanDerWaalsContact OE1-CD2 3.32Å; E333-F337 WeakPolarHBondContact OE1-CD2 3.28Å; E333-F337 VanDerWaalsContact OE1-CE2 3.28Å; E333-F337 WeakPolarHBondContact OE1-CE2 3.49Å; E333-F337 WeakPolarHBondContact OE2-CE2 3.49Å; E333-W378 HydrophobicContact CB-CH2 4.08Å; E333-W378 HydrophobicContact CB-CZ3 3.92Å; E333-W378 HydrophobicContact CG-CH2 4.02Å; E333-W378 HydrophobicContact CG-CZ3 3.82Å; E333-Y381 HydrophobicContact CG-CE1 3.87Å; E333-Y381 PolarHBondContact OE1-OH 3.4Å
334	E	91.6	Very high	79.6	Confident	61 Å²	61	67.3 Å²	67.3	29%	0.285	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-40.5	178.5	-174	168	-153.8	0	0	111	R330 L336 C338 W378	R330-E334 VanDerWaalsContact O-CB 3.27Å; R330-E334 WeakPolarHBondContact O-CB 3.16Å; R330-E334 PolarHBondContact O-N 3.4Å; E334-L336 VanDerWaalsContact C-N 3.3Å; E334-L336 PolarHBondContact O-N 2.87Å; E334-C338 HydrophobicContact CG-CB 3.9Å; E334-C338 WeakPolarHBondContact O-CA 3.32Å; E334-C338 WeakPolarHBondContact O-CB 3.22Å; E334-C338 PolarHBondContact O-N 2.89Å; E334-W378 HydrophobicContact CB-CE3 3.94Å; E334-W378 HydrophobicContact CB-CZ3 4.13Å; E334-W378 HydrophobicContact CG-CE3 4.33Å
335	T	90.4	Very high	76.5	Confident	16 Å²	16	69.3 Å²	69.3	10%	0.098	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-34.2	176.6	-64.9	0	0	0	0	113	D319 R322 A323 D331 E333	D319-T335 HydrophobicContact CB-CG2 4.45Å; R322-T335 HydrophobicContact CB-CG2 3.7Å; R322-T335 HydrophobicContact CG-CG2 3.63Å; A323-T335 HydrophobicContact CB-CG2 4.02Å; D331-T335 VanDerWaalsContact O-CB 3.24Å; D331-T335 WeakPolarHBondContact O-CB 3.32Å; D331-T335 PolarHBondContact O-N 2.76Å; D331-T335 PolarHBondContact O-OG1 2.72Å; E333-T335 VanDerWaalsContact C-N 3.28Å; E333-T335 PolarHBondContact O-N 2.85Å
336	L	88.1	Confident	73.7	Confident	10 Å²	10	67.1 Å²	67.1	5%	0.052	38%	0.377	C	S	.	.	H	α-helix	trans	-79.4	-37.8	-178.2	-69.9	177.1	0	0	0	112.7	L307 L318 A323 F332 E333 E334	L307-L336 HydrophobicContact CD2-CD1 4.29Å; L307-L336 HydrophobicContact CD2-CD2 4.08Å; L318-L336 HydrophobicContact CB-CD2 4.42Å; L318-L336 HydrophobicContact CD1-CD2 4.41Å; A323-L336 HydrophobicContact CB-CD2 3.63Å; A323-L336 HydrophobicContact CB-CG 3.87Å; F332-L336 HydrophobicContact CD1-CD1 4.03Å; F332-L336 HydrophobicContact CE1-CD1 3.48Å; F332-L336 VanDerWaalsContact CE1-CD1 3.48Å; F332-L336 HydrophobicContact CZ-CD1 3.86Å; F332-L336 WeakPolarHBondContact O-CG 3.31Å; F332-L336 PolarHBondContact O-N 3.15Å; E333-L336 PolarHBondContact O-N 2.91Å; E333-L336 VanDerWaalsContact O-N 3.11Å; E334-L336 VanDerWaalsContact C-N 3.3Å; E334-L336 PolarHBondContact O-N 2.87Å
337	F	87.9	Confident	70.9	Confident	32 Å²	32	71.6 Å²	71.6	14%	0.14	41%	0.408	C	S	.	.	H	α-helix	trans	-117.5	-13.9	-166.3	-60.2	-66.3	0	0	0	115.2	I221 E333 P374 A375 Y381	I221-F337 HydrophobicContact CB-CZ 4.27Å; I221-F337 HydrophobicContact CG2-CZ 4.3Å; I221-F337 WeakPolarHBondContact O-CE1 3.38Å; I221-F337 WeakPolarHBondContact O-CZ 3.32Å; E333-F337 VanDerWaalsContact CD-CD2 3.45Å; E333-F337 VanDerWaalsContact CD-CE2 3.46Å; E333-F337 HydrophobicContact CG-CD2 4.02Å; E333-F337 HydrophobicContact CG-CE2 4.48Å; E333-F337 WeakPolarHBondContact O-CD2 3.4Å; E333-F337 PolarHBondContact O-N 3.42Å; E333-F337 VanDerWaalsContact OE1-CD2 3.32Å; E333-F337 WeakPolarHBondContact OE1-CD2 3.28Å; E333-F337 VanDerWaalsContact OE1-CE2 3.28Å; E333-F337 WeakPolarHBondContact OE1-CE2 3.49Å; E333-F337 WeakPolarHBondContact OE2-CE2 3.49Å; F337-P374 CarbonylContact O-C 3.47Å; F337-P374 WeakPolarHBondContact O-CA 3.44Å; F337-A375 PolarHBondContact O-N 3.32Å; F337-Y381 HydrophobicContact CB-CD2 3.71Å; F337-Y381 HydrophobicContact CB-CE2 3.42Å; F337-Y381 VanDerWaalsContact CB-CE2 3.42Å; F337-Y381 HydrophobicContact CB-CG 4.45Å; F337-Y381 HydrophobicContact CD1-CE2 4.37Å; F337-Y381 HydrophobicContact CD2-CE2 4.14Å; F337-Y381 AromaticContact CD2-CZ 3.87Å; F337-Y381 WeakPolarHBondContact CD2-OH 3.43Å; F337-Y381 HydrophobicContact CG-CD2 4.49Å; F337-Y381 AromaticContact CG-CE2 3.73Å; F337-Y381 HydrophobicContact CG-CE2 3.73Å; F337-Y381 AromaticContact CG-CZ 3.97Å
338	C	88.1	Confident	68.2	Low	11 Å²	11	73.2 Å²	73.2	7%	0.074	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-102.7	140.6	175.4	-59.3	0	0	0	0	110.7	E334 A375 N377	E334-C338 HydrophobicContact CG-CB 3.9Å; E334-C338 WeakPolarHBondContact O-CA 3.32Å; E334-C338 WeakPolarHBondContact O-CB 3.22Å; E334-C338 PolarHBondContact O-N 2.89Å; C338-A375 CarbonylContact C-O 3.6Å; C338-A375 WeakPolarHBondContact CA-O 3.19Å; C338-N377 VanDerWaalsContact SG-C 3.6Å
339	S	78	Confident	65.5	Low	55 Å²	55	80.5 Å²	80.5	39%	0.385	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-66.7	139.1	172	-58.6	0	0	0	0	109	T341 A375	S339-T341 PolarHBondContact O-N 2.91Å; S339-T341 VanDerWaalsContact O-N 3.14Å; S339-A375 PolarHBondContact N-O 3.36Å; S339-A375 PolarHBondContact OG-O 2.83Å
340	P	65.1	Low	63	Low	94 Å²	94	91.4 Å²	91.4	61%	0.61	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-54.3	126.1	165.6	-17.7	28.7	0	0	0	107.6	E342	P340-E342 PolarHBondContact O-N 3.11Å
341	T	48.9	Very low	60.3	Low	129 Å²	129	93.1 Å²	93.1	79%	0.791	50%	0.502	S	S	*	.			trans	-61.4	83.1	167.5	25.7	0	0	0	0	108.5	S339 K343	S339-T341 PolarHBondContact O-N 2.91Å; S339-T341 VanDerWaalsContact O-N 3.14Å; T341-K343 PolarHBondContact O-N 3.34Å
342	E	42.6	Very low	57.9	Low	160 Å²	160	96.2 Å²	96.2	75%	0.748	53%	0.525	S	S	*	.			trans	-60.9	125.6	153.4	-80.3	-170	159.5	0	0	106.1	P340 V344	P340-E342 PolarHBondContact O-N 3.11Å; E342-V344 HydrophobicContact CB-CG2 3.84Å; E342-V344 PolarHBondContact O-N 2.65Å
343	K	35.3	Very low	55.3	Low	209 Å²	209	99.9 Å²	99.9	91%	0.909	56%	0.555	S	S	*	*			trans	-61.5	81.4	161.9	-70.7	176.7	177.6	176.9	0	107.1	T341 S345	T341-K343 PolarHBondContact O-N 3.34Å; K343-S345 PolarHBondContact O-N 2.8Å
344	V	36.5	Very low	53.1	Low	109 Å²	109	105 Å²	105	66%	0.661	59%	0.592	S	S	*	*			trans	-76.7	108.8	179	176.8	0	0	0	0	107.8	E342	E342-V344 HydrophobicContact CB-CG2 3.84Å; E342-V344 PolarHBondContact O-N 2.65Å
345	S	27.4	Very low	51.1	Low	90 Å²	90	106.6 Å²	106.6	63%	0.629	61%	0.607	S	S	*	*			trans	-51.3	143.1	163.7	-58.9	0	0	0	0	110.4	K343 S347	K343-S345 PolarHBondContact O-N 2.8Å; S345-S347 PolarHBondContact O-N 3.44Å
346	P	35	Very low	49.2	Very low	133 Å²	133	108 Å²	108	86%	0.864	62%	0.617	S	S	*	*	S	Bend	trans	-79.9	79.6	-172.5	32.9	-33.4	0	0	0	110.3
347	S	35.3	Very low	47.6	Very low	98 Å²	98	110.7 Å²	110.7	69%	0.685	63%	0.631	S	S	*	*			trans	-172.6	65	165.7	44.5	0	0	0	0	112.9	S345	S345-S347 PolarHBondContact O-N 3.44Å
348	T	31.6	Very low	46	Very low	133 Å²	133	118.4 Å²	118.4	82%	0.816	66%	0.659	S	S	*	*			trans	-154	120.6	147.5	-39.8	0	0	0	0	108.7	R350	T348-R350 PolarHBondContact O-N 3.06Å; T348-R350 VanDerWaalsContact O-N 3.16Å
349	E	35.1	Very low	44.6	Very low	188 Å²	188	120.4 Å²	120.4	88%	0.879	68%	0.682	S	S	*	*			trans	-50.7	121.5	168.5	-71.7	179	148.9	0	0	109	N351	E349-N351 PolarHBondContact O-N 3.35Å
350	R	37.4	Very low	44.1	Very low	235 Å²	235	119.3 Å²	119.3	89%	0.887	67%	0.672	S	S	*	*			trans	-70.6	93.4	-175.9	-156.6	-177.8	-70.7	-161.2	-1.4	107.6	T348 P352	T348-R350 PolarHBondContact O-N 3.06Å; T348-R350 VanDerWaalsContact O-N 3.16Å; R350-P352 VanDerWaalsContact O-CD 3.3Å; R350-P352 WeakPolarHBondContact O-CD 3.29Å
351	N	35.3	Very low	44.4	Very low	139 Å²	139	117.7 Å²	117.7	74%	0.743	66%	0.66	S	S	*	*			trans	-58.7	118.6	166.9	-102.2	-27.9	0	0	0	107.7	E349 A353	E349-N351 PolarHBondContact O-N 3.35Å; N351-A353 PolarHBondContact O-N 3.11Å
352	P	41.7	Very low	45.3	Very low	116 Å²	116	116.7 Å²	116.7	75%	0.753	66%	0.659	S	S	*	*	S	Bend	trans	-73	10.5	-178.5	29.2	-33.7	0	0	0	113.5	R350	R350-P352 VanDerWaalsContact O-CD 3.3Å; R350-P352 WeakPolarHBondContact O-CD 3.29Å
353	A	38.2	Very low	46.3	Very low	78 Å²	78	112.3 Å²	112.3	65%	0.645	65%	0.65	S	S	*	*			trans	-102.2	99.5	-179.6	0	0	0	0	0	110.7	N351	N351-A353 PolarHBondContact O-N 3.11Å
354	S	46.2	Very low	47.9	Very low	110 Å²	110	102.9 Å²	102.9	77%	0.769	61%	0.611	S	S	*	*			trans	87.2	119.4	176	87.3	0	0	0	0	115
355	P	49	Very low	49.4	Very low	94 Å²	94	98.4 Å²	98.4	61%	0.61	59%	0.585	S	S	*	*	S	Bend		-120.8	163.4	53.8	24.7	-5.2	0	0	0	115.7
356	S	51.5	Low	51.1	Low	44 Å²	44	104.6 Å²	104.6	31%	0.308	60%	0.595	S	S	.	*			trans	66.7	20.8	157.8	78.1	0	0	0	0	124	R358	S356-R358 PolarHBondContact O-N 3.38Å
357	L	53.9	Low	52.6	Low	67 Å²	67	101.2 Å²	101.2	35%	0.351	58%	0.578	S	S	.	*			trans	-69.7	8.8	163	-90.7	167.2	0	0	0	114.8	G359 L360 A365 A372 Y373	L357-G359 PolarHBondContact O-N 2.76Å; L357-L360 HydrophobicContact CD2-CB 3.96Å; L357-L360 PolarHBondContact O-N 3.27Å; L357-A365 HydrophobicContact CD1-CB 4.47Å; L357-A365 HydrophobicContact CD2-CB 3.39Å; L357-A372 HydrophobicContact CD2-CB 4.5Å; L357-Y373 HydrophobicContact CD1-CE1 4.12Å; L357-Y373 WeakPolarHBondContact CD1-OH 3.08Å; L357-Y373 HydrophobicContact CG-CE1 4.16Å
358	R	54.9	Low	54.2	Low	194 Å²	194	97.1 Å²	97.1	73%	0.732	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	111.4	-176.5	-77.8	-172	-173.5	-174	3.4	110.1	S356	S356-R358 PolarHBondContact O-N 3.38Å
359	G	58.6	Low	56.4	Low	53 Å²	53	92.5 Å²	92.5	55%	0.546	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-1.9	176.9	0	0	0	0	0	115.1	L357	L357-G359 PolarHBondContact O-N 2.76Å
360	L	66.1	Low	58.2	Low	33 Å²	33	89.4 Å²	89.4	17%	0.173	51%	0.513	C	S	.	.			trans	-97.9	139.4	168	-96.1	87.1	0	0	0	111.5	R220 L357 A364 L368	R220-L360 HydrophobicContact CG-CD1 3.76Å; L357-L360 HydrophobicContact CD2-CB 3.96Å; L357-L360 PolarHBondContact O-N 3.27Å; L360-A364 HydrophobicContact CD2-CB 3.95Å; L360-A364 HydrophobicContact CG-CB 4.28Å; L360-L368 HydrophobicContact CD2-CD1 3.36Å
361	T	71.3	Confident	60	Low	59 Å²	59	81.4 Å²	81.4	36%	0.362	48%	0.483	S	S	.	.			trans	-70.8	153.1	167.4	66	0	0	0	0	110.4	K138 A363 A364 A365	K138-T361 PolarHBondContact O-OG1 2.83Å; T361-A363 PolarHBondContact O-N 3.11Å; T361-A364 WeakPolarHBondContact O-CB 3.44Å; T361-A364 PolarHBondContact O-N 3.12Å; T361-A364 WeakPolarHBondContact OG1-CB 2.98Å; T361-A364 PolarHBondContact OG1-N 3.21Å; T361-A365 PolarHBondContact O-N 3.21Å
362	S	67.6	Low	61.6	Low	109 Å²	109	75.3 Å²	75.3	76%	0.762	45%	0.452	S	S	*	.	H	α-helix	trans	-57.7	-33.7	178	-53.5	0	0	0	0	112.8	W366	S362-W366 WeakPolarHBondContact O-CB 3.27Å; S362-W366 PolarHBondContact O-N 3.14Å
363	A	64.5	Low	63.2	Low	68 Å²	68	74.3 Å²	74.3	56%	0.562	43%	0.434	S	S	*	.	H	α-helix	trans	-66.6	-40.1	175.6	0	0	0	0	0	112.3	T361 W366 A367	T361-A363 PolarHBondContact O-N 3.11Å; A363-W366 PolarHBondContact O-N 3.42Å; A363-A367 WeakPolarHBondContact O-CB 3.37Å; A363-A367 PolarHBondContact O-N 3.23Å
364	A	68.1	Low	65.3	Low	11 Å²	11	73 Å²	73	9%	0.091	42%	0.418	C	S	.	.	H	α-helix	trans	-68.9	-44.4	176.8	0	0	0	0	0	111.8	D139 L360 T361 W366 A367 L368	D139-A364 HydrophobicContact CB-CB 3.29Å; L360-A364 HydrophobicContact CD2-CB 3.95Å; L360-A364 HydrophobicContact CG-CB 4.28Å; T361-A364 WeakPolarHBondContact O-CB 3.44Å; T361-A364 PolarHBondContact O-N 3.12Å; T361-A364 WeakPolarHBondContact OG1-CB 2.98Å; T361-A364 PolarHBondContact OG1-N 3.21Å; A364-W366 VanDerWaalsContact C-N 3.27Å; A364-W366 PolarHBondContact O-N 3.02Å; A364-A367 PolarHBondContact O-N 3.08Å; A364-L368 WeakPolarHBondContact O-CB 3.48Å; A364-L368 WeakPolarHBondContact O-CD1 3.21Å; A364-L368 VanDerWaalsContact O-CG 3.3Å; A364-L368 WeakPolarHBondContact O-CG 3.27Å; A364-L368 PolarHBondContact O-N 2.69Å
365	A	69	Low	67.2	Low	15 Å²	15	67.9 Å²	67.9	12%	0.124	38%	0.383	C	S	.	.	H	α-helix	trans	-56.4	-43.6	174.6	0	0	0	0	0	111.8	L357 T361 L368 G369	L357-A365 HydrophobicContact CD1-CB 4.47Å; L357-A365 HydrophobicContact CD2-CB 3.39Å; T361-A365 PolarHBondContact O-N 3.21Å; A365-L368 PolarHBondContact O-N 3.33Å; A365-G369 PolarHBondContact O-N 2.71Å
366	W	62.5	Low	69.1	Low	219 Å²	219	66.1 Å²	66.1	83%	0.83	38%	0.376	S	S	*	.	H	α-helix	trans	-64.3	-45.1	176.5	-175.1	85.7	0	0	0	112.3	S362 A363 A364 L368 G369	S362-W366 WeakPolarHBondContact O-CB 3.27Å; S362-W366 PolarHBondContact O-N 3.14Å; A363-W366 PolarHBondContact O-N 3.42Å; A364-W366 VanDerWaalsContact C-N 3.27Å; A364-W366 PolarHBondContact O-N 3.02Å; W366-L368 VanDerWaalsContact C-N 3.27Å; W366-L368 PolarHBondContact O-N 3.36Å; W366-G369 PolarHBondContact O-N 2.83Å
367	A	67.5	Low	70.9	Confident	63 Å²	63	67.5 Å²	67.5	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-34.6	179	0	0	0	0	0	112.8	A363 A364	A363-A367 WeakPolarHBondContact O-CB 3.37Å; A363-A367 PolarHBondContact O-N 3.23Å; A364-A367 PolarHBondContact O-N 3.08Å
368	L	68.8	Low	72.7	Confident	11 Å²	11	64.8 Å²	64.8	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-83.7	-20.1	-179.3	-69	161.8	0	0	0	113.4	R220 L360 A364 A365 W366 E370 R371 A372	R220-L368 VanDerWaalsContact NH2-CD1 3.27Å; L360-L368 HydrophobicContact CD2-CD1 3.36Å; A364-L368 WeakPolarHBondContact O-CB 3.48Å; A364-L368 WeakPolarHBondContact O-CD1 3.21Å; A364-L368 VanDerWaalsContact O-CG 3.3Å; A364-L368 WeakPolarHBondContact O-CG 3.27Å; A364-L368 PolarHBondContact O-N 2.69Å; A365-L368 PolarHBondContact O-N 3.33Å; W366-L368 VanDerWaalsContact C-N 3.27Å; W366-L368 PolarHBondContact O-N 3.36Å; L368-E370 PolarHBondContact O-N 3.3Å; L368-R371 HydrophobicContact CB-CB 4.48Å; L368-R371 WeakPolarHBondContact O-CB 3.42Å; L368-R371 PolarHBondContact O-N 3.07Å; L368-A372 HydrophobicContact CB-CB 4.04Å
369	G	77.4	Confident	74.4	Confident	36 Å²	36	62.4 Å²	62.4	37%	0.371	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	52.6	-122.5	-179.7	0	0	0	0	0	111.5	A365 W366 R371 A372	A365-G369 PolarHBondContact O-N 2.71Å; W366-G369 PolarHBondContact O-N 2.83Å; G369-R371 PolarHBondContact O-N 2.98Å; G369-A372 WeakPolarHBondContact O-CB 3.28Å; G369-A372 PolarHBondContact O-N 3Å
370	E	71.9	Confident	75.9	Confident	124 Å²	124	61.4 Å²	61.4	58%	0.579	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67.8	-19.2	-179.1	-56.2	-167.3	159	0	0	114.2	L368 A372 Y373 R384	L368-E370 PolarHBondContact O-N 3.3Å; E370-A372 PolarHBondContact O-N 2.85Å; E370-Y373 PolarHBondContact O-N 3.32Å; E370-R384 VanDerWaalsContact CB-CZ 3.45Å; E370-R384 PolarHBondContact O-NH1 2.71Å; E370-R384 IonicContact OE2-CZ 3.47Å; E370-R384 IonicContact OE2-NE 3.09Å; E370-R384 PolarHBondContact OE2-NE 3.33Å; E370-R384 IonicContact OE2-NH2 2.63Å; E370-R384 PolarHBondContact OE2-NH2 3.11Å
371	R	75.7	Confident	77.1	Confident	66 Å²	66	60.7 Å²	60.7	25%	0.249	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-76.1	-11	176.6	-66.6	-177.9	-73	-174.1	-7.9	113.4	E264 L368 G369 Y373 R384 R389	E264-R371 IonicContact OE1-CZ 3.41Å; E264-R371 IonicContact OE1-NH1 3.23Å; E264-R371 PolarHBondContact OE1-NH1 3.33Å; E264-R371 IonicContact OE1-NH2 3.69Å; E264-R371 PolarHBondContact OE1-NH2 2.89Å; E264-R371 IonicContact OE2-NH2 2.92Å; L368-R371 HydrophobicContact CB-CB 4.48Å; L368-R371 WeakPolarHBondContact O-CB 3.42Å; L368-R371 PolarHBondContact O-N 3.07Å; G369-R371 PolarHBondContact O-N 2.98Å; R371-Y373 PolarHBondContact O-N 3.04Å; R371-R384 HydrophobicContact CG-CB 3.96Å; R371-R389 VanDerWaalsContact NH1-NH2 3.14Å
372	A	70.2	Confident	78.1	Confident	12 Å²	12	58 Å²	58	10%	0.099	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-69.4	-14.9	172.8	0	0	0	0	0	112.5	L357 L368 G369 E370	L357-A372 HydrophobicContact CD2-CB 4.5Å; L368-A372 HydrophobicContact CB-CB 4.04Å; G369-A372 WeakPolarHBondContact O-CB 3.28Å; G369-A372 PolarHBondContact O-N 3Å; E370-A372 PolarHBondContact O-N 2.85Å
373	Y	74.6	Confident	79.2	Confident	95 Å²	95	55.5 Å²	55.5	37%	0.373	32%	0.318	S	S	.	.	S	Bend	trans	-120	152.1	-174.6	-55.6	-83.1	0	0	0	111.5	L357 E370 R371	L357-Y373 HydrophobicContact CD1-CE1 4.12Å; L357-Y373 WeakPolarHBondContact CD1-OH 3.08Å; L357-Y373 HydrophobicContact CG-CE1 4.16Å; E370-Y373 PolarHBondContact O-N 3.32Å; R371-Y373 PolarHBondContact O-N 3.04Å
374	P	82.6	Confident	80.3	Confident	49 Å²	49	55.3 Å²	55.3	32%	0.318	30%	0.302	S	S	.	.			trans	-54.2	140.6	170.3	-24.9	34.7	0	0	0	111.8	F337	F337-P374 CarbonylContact O-C 3.47Å; F337-P374 WeakPolarHBondContact O-CA 3.44Å
375	A	86.6	Confident	81.3	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-70.5	156.4	175.8	0	0	0	0	0	111	F337 C338 S339 N377 Y381	F337-A375 PolarHBondContact O-N 3.32Å; C338-A375 CarbonylContact C-O 3.6Å; C338-A375 WeakPolarHBondContact CA-O 3.19Å; S339-A375 PolarHBondContact N-O 3.36Å; S339-A375 PolarHBondContact OG-O 2.83Å; A375-N377 VanDerWaalsContact C-N 3.34Å; A375-Y381 HydrophobicContact CB-CD2 4.36Å; A375-Y381 HydrophobicContact CB-CG 4.49Å
376	A	87.4	Confident	82.5	Confident	57 Å²	57	57.6 Å²	57.6	47%	0.471	31%	0.31	S	S	.	.	S	Bend	trans	-72	-32	177.1	0	0	0	0	0	112.4
377	N	90.3	Very high	84.1	Confident	73 Å²	73	47.2 Å²	47.2	39%	0.39	27%	0.271	S	S	.	.	S	Bend	trans	-160.4	173.1	-179	58.6	33.7	0	0	0	110	C338 A375 E379 S380 Y381	C338-N377 VanDerWaalsContact SG-C 3.6Å; A375-N377 VanDerWaalsContact C-N 3.34Å; N377-E379 VanDerWaalsContact C-N 3.34Å; N377-E379 PolarHBondContact O-N 3.49Å; N377-E379 PolarHBondContact OD1-N 3.11Å; N377-S380 PolarHBondContact O-N 2.98Å; N377-S380 VanDerWaalsContact OD1-CB 3.26Å; N377-S380 WeakPolarHBondContact OD1-CB 3.4Å; N377-S380 PolarHBondContact OD1-N 3.09Å; N377-Y381 PolarHBondContact O-N 3.34Å
378	W	90.8	Very high	85.4	Confident	11 Å²	11	45.3 Å²	45.3	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-42.5	-179.6	-172.9	-113.1	0	0	0	114.2	F287 E288 R330 E333 E334 Y381 W382	F287-W378 HydrophobicContact CB-CH2 3.88Å; F287-W378 HydrophobicContact CB-CZ2 3.61Å; F287-W378 HydrophobicContact CD1-CH2 4.07Å; F287-W378 HydrophobicContact CD2-CH2 4.33Å; F287-W378 AromaticContact CG-CH2 3.86Å; F287-W378 HydrophobicContact CG-CH2 3.86Å; F287-W378 HydrophobicContact CG-CZ2 4.09Å; E288-W378 PolarHBondContact OE1-NE1 2.95Å; R330-W378 HydrophobicContact CG-CD2 4.45Å; R330-W378 HydrophobicContact CG-CH2 3.96Å; R330-W378 HydrophobicContact CG-CZ2 3.78Å; R330-W378 HydrophobicContact CG-CZ3 4.35Å; E333-W378 HydrophobicContact CB-CH2 4.08Å; E333-W378 HydrophobicContact CB-CZ3 3.92Å; E333-W378 HydrophobicContact CG-CH2 4.02Å; E333-W378 HydrophobicContact CG-CZ3 3.82Å; E334-W378 HydrophobicContact CB-CE3 3.94Å; E334-W378 HydrophobicContact CB-CZ3 4.13Å; E334-W378 HydrophobicContact CG-CE3 4.33Å; W378-Y381 HydrophobicContact CE3-CD1 4.3Å; W378-Y381 HydrophobicContact CZ3-CD1 4.17Å; W378-Y381 HydrophobicContact CZ3-CE1 4.46Å; W378-Y381 WeakPolarHBondContact O-CB 3.19Å; W378-Y381 PolarHBondContact O-N 2.89Å; W378-W382 AromaticContact CD2-CD1 3.73Å; W378-W382 AromaticContact CD2-NE1 3.69Å; W378-W382 AromaticContact CE2-CD1 3.44Å; W378-W382 VanDerWaalsContact CE2-CD1 3.44Å; W378-W382 AromaticContact CE2-NE1 3.2Å; W378-W382 AromaticContact CE3-NE1 3.87Å; W378-W382 AromaticContact CH2-CE2 3.99Å; W378-W382 HydrophobicContact CH2-CZ2 4.21Å; W378-W382 AromaticContact CH2-NE1 3.14Å; W378-W382 AromaticContact CZ2-CD1 3.69Å; W378-W382 AromaticContact CZ2-CE2 3.96Å; W378-W382 HydrophobicContact CZ2-CZ2 4.48Å; W378-W382 AromaticContact CZ2-NE1 2.93Å; W378-W382 AromaticContact CZ3-NE1 3.61Å; W378-W382 AromaticContact NE1-CD1 3.71Å; W378-W382 AromaticContact NE1-NE1 3.88Å; W378-W382 PolarHBondContact O-N 2.93Å; W378-W382 VanDerWaalsContact O-N 3.08Å
379	E	91.1	Very high	86.6	Confident	143 Å²	143	47.6 Å²	47.6	67%	0.668	26%	0.26	S	S	*	.	H	α-helix	trans	-66.9	-43.2	179.7	-174.3	177.9	-167.4	0	0	111.6	N377 Y381 W382 G383	N377-E379 VanDerWaalsContact C-N 3.34Å; N377-E379 PolarHBondContact O-N 3.49Å; N377-E379 PolarHBondContact OD1-N 3.11Å; E379-Y381 VanDerWaalsContact C-N 3.28Å; E379-Y381 PolarHBondContact O-N 3.34Å; E379-W382 PolarHBondContact O-N 2.64Å; E379-G383 PolarHBondContact O-N 3.06Å
380	S	90.6	Very high	87.5	Confident	33 Å²	33	48.7 Å²	48.7	23%	0.231	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-30.5	175	177	0	0	0	0	112.4	N377	N377-S380 PolarHBondContact O-N 2.98Å; N377-S380 VanDerWaalsContact OD1-CB 3.26Å; N377-S380 WeakPolarHBondContact OD1-CB 3.4Å; N377-S380 PolarHBondContact OD1-N 3.09Å
381	Y	90.9	Very high	88.6	Confident	17 Å²	17	43.2 Å²	43.2	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-52.2	174.7	175.2	-113.9	0	0	0	110.4	E333 F337 A375 N377 W378 E379 R384 N385	E333-Y381 HydrophobicContact CG-CE1 3.87Å; E333-Y381 PolarHBondContact OE1-OH 3.4Å; F337-Y381 HydrophobicContact CB-CD2 3.71Å; F337-Y381 HydrophobicContact CB-CE2 3.42Å; F337-Y381 VanDerWaalsContact CB-CE2 3.42Å; F337-Y381 HydrophobicContact CB-CG 4.45Å; F337-Y381 HydrophobicContact CD1-CE2 4.37Å; F337-Y381 HydrophobicContact CD2-CE2 4.14Å; F337-Y381 AromaticContact CD2-CZ 3.87Å; F337-Y381 WeakPolarHBondContact CD2-OH 3.43Å; F337-Y381 HydrophobicContact CG-CD2 4.49Å; F337-Y381 AromaticContact CG-CE2 3.73Å; F337-Y381 HydrophobicContact CG-CE2 3.73Å; F337-Y381 AromaticContact CG-CZ 3.97Å; A375-Y381 HydrophobicContact CB-CD2 4.36Å; A375-Y381 HydrophobicContact CB-CG 4.49Å; N377-Y381 PolarHBondContact O-N 3.34Å; W378-Y381 HydrophobicContact CE3-CD1 4.3Å; W378-Y381 HydrophobicContact CZ3-CD1 4.17Å; W378-Y381 HydrophobicContact CZ3-CE1 4.46Å; W378-Y381 WeakPolarHBondContact O-CB 3.19Å; W378-Y381 PolarHBondContact O-N 2.89Å; E379-Y381 VanDerWaalsContact C-N 3.28Å; E379-Y381 PolarHBondContact O-N 3.34Å; Y381-R384 PolarHBondContact O-N 3.45Å; Y381-N385 VanDerWaalsContact CD2-ND2 3.31Å; Y381-N385 WeakPolarHBondContact CD2-ND2 3.49Å; Y381-N385 WeakPolarHBondContact CE2-ND2 3.22Å; Y381-N385 PolarHBondContact O-N 2.91Å; Y381-N385 PolarHBondContact O-ND2 2.89Å
382	W	91.7	Very high	89.5	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-70.4	-35.1	179.9	-77	107	0	0	0	113.2	F224 Q284 F287 W378 E379 R384 N385 E386	F224-W382 AromaticContact CD2-CH2 3.82Å; F224-W382 HydrophobicContact CD2-CH2 3.82Å; F224-W382 HydrophobicContact CD2-CZ3 4.08Å; F224-W382 AromaticContact CE2-CH2 3.45Å; F224-W382 HydrophobicContact CE2-CH2 3.45Å; F224-W382 VanDerWaalsContact CE2-CH2 3.45Å; F224-W382 AromaticContact CE2-CZ3 3.93Å; F224-W382 HydrophobicContact CE2-CZ3 3.93Å; Q284-W382 VanDerWaalsContact CA-CD2 3.5Å; Q284-W382 HydrophobicContact CB-CB 3.83Å; Q284-W382 HydrophobicContact CB-CD2 3.71Å; Q284-W382 HydrophobicContact CB-CE3 4.3Å; Q284-W382 HydrophobicContact CB-CG 3.43Å; Q284-W382 VanDerWaalsContact CB-CG 3.43Å; Q284-W382 HydrophobicContact CG-CB 4.17Å; Q284-W382 HydrophobicContact CG-CD2 4.41Å; Q284-W382 HydrophobicContact CG-CG 3.76Å; F287-W382 AromaticContact CD2-CH2 3.77Å; F287-W382 HydrophobicContact CD2-CH2 3.77Å; F287-W382 AromaticContact CD2-CZ2 3.21Å; F287-W382 HydrophobicContact CD2-CZ2 3.21Å; F287-W382 AromaticContact CE2-CH2 3.61Å; F287-W382 HydrophobicContact CE2-CH2 3.61Å; F287-W382 AromaticContact CE2-CZ2 3.32Å; F287-W382 HydrophobicContact CE2-CZ2 3.32Å; F287-W382 HydrophobicContact CG-CZ2 4.2Å; F287-W382 HydrophobicContact CZ-CZ2 4.34Å; W378-W382 AromaticContact CD2-CD1 3.73Å; W378-W382 AromaticContact CD2-NE1 3.69Å; W378-W382 AromaticContact CE2-CD1 3.44Å; W378-W382 VanDerWaalsContact CE2-CD1 3.44Å; W378-W382 AromaticContact CE2-NE1 3.2Å; W378-W382 AromaticContact CE3-NE1 3.87Å; W378-W382 AromaticContact CH2-CE2 3.99Å; W378-W382 HydrophobicContact CH2-CZ2 4.21Å; W378-W382 AromaticContact CH2-NE1 3.14Å; W378-W382 AromaticContact CZ2-CD1 3.69Å; W378-W382 AromaticContact CZ2-CE2 3.96Å; W378-W382 HydrophobicContact CZ2-CZ2 4.48Å; W378-W382 AromaticContact CZ2-NE1 2.93Å; W378-W382 AromaticContact CZ3-NE1 3.61Å; W378-W382 AromaticContact NE1-CD1 3.71Å; W378-W382 AromaticContact NE1-NE1 3.88Å; W378-W382 PolarHBondContact O-N 2.93Å; W378-W382 VanDerWaalsContact O-N 3.08Å; E379-W382 PolarHBondContact O-N 2.64Å; W382-R384 PolarHBondContact O-N 2.84Å; W382-N385 HydrophobicContact CE3-CB 4.49Å; W382-N385 PolarHBondContact O-N 3.08Å; W382-E386 VanDerWaalsContact O-CB 3.25Å; W382-E386 WeakPolarHBondContact O-CB 3.31Å; W382-E386 PolarHBondContact O-N 2.86Å
383	G	90.3	Very high	90.8	Very high	58 Å²	58	52 Å²	52	60%	0.598	28%	0.279	S	S	*	.	H	α-helix	trans	-53.8	-24.1	173.6	0	0	0	0	0	114	E379	E379-G383 PolarHBondContact O-N 3.06Å
384	R	88.3	Confident	91.8	Very high	63 Å²	63	47.6 Å²	47.6	24%	0.238	26%	0.262	C	S	.	.	H	α-helix	trans	-102.4	-18.1	176.4	-59.8	174.6	-175.4	154.2	5	114.5	E370 R371 Y381 W382 R389	E370-R384 VanDerWaalsContact CB-CZ 3.45Å; E370-R384 PolarHBondContact O-NH1 2.71Å; E370-R384 IonicContact OE2-CZ 3.47Å; E370-R384 IonicContact OE2-NE 3.09Å; E370-R384 PolarHBondContact OE2-NE 3.33Å; E370-R384 IonicContact OE2-NH2 2.63Å; E370-R384 PolarHBondContact OE2-NH2 3.11Å; R371-R384 HydrophobicContact CG-CB 3.96Å; Y381-R384 PolarHBondContact O-N 3.45Å; W382-R384 PolarHBondContact O-N 2.84Å; R384-R389 WeakPolarHBondContact O-CD 3.28Å; R384-R389 PolarHBondContact O-NE 3.25Å
385	N	90.3	Very high	92.4	Very high	44 Å²	44	46.3 Å²	46.3	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-119.5	-0.2	-171.7	-65.3	-66.9	0	0	0	113.9	Y381 W382	Y381-N385 VanDerWaalsContact CD2-ND2 3.31Å; Y381-N385 WeakPolarHBondContact CD2-ND2 3.49Å; Y381-N385 WeakPolarHBondContact CE2-ND2 3.22Å; Y381-N385 PolarHBondContact O-N 2.91Å; Y381-N385 PolarHBondContact O-ND2 2.89Å; W382-N385 HydrophobicContact CE3-CB 4.49Å; W382-N385 PolarHBondContact O-N 3.08Å
386	E	93.7	Very high	92.9	Very high	30 Å²	30	46.4 Å²	46.4	14%	0.14	26%	0.256	C	S	.	.			trans	-59.4	126.6	176.8	-168.9	58.3	-126.1	0	0	110.1	L282 G283 Q284 W382 L388 R389	L282-E386 VanDerWaalsContact C-OE1 3.29Å; L282-E386 WeakPolarHBondContact CA-OE1 3.38Å; G283-E386 PolarHBondContact N-OE1 3.32Å; Q284-E386 PolarHBondContact N-OE2 3.16Å; W382-E386 VanDerWaalsContact O-CB 3.25Å; W382-E386 WeakPolarHBondContact O-CB 3.31Å; W382-E386 PolarHBondContact O-N 2.86Å; E386-L388 PolarHBondContact O-N 3.23Å; E386-R389 HydrophobicContact CB-CB 4.2Å; E386-R389 WeakPolarHBondContact O-CB 3.27Å; E386-R389 VanDerWaalsContact O-CG 3.3Å; E386-R389 WeakPolarHBondContact O-CG 3.34Å; E386-R389 PolarHBondContact O-N 2.98Å; E386-R389 VanDerWaalsContact O-N 3.11Å; E386-R389 PolarHBondContact O-NH1 2.92Å
387	P	95.3	Very high	93.4	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.013	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.7	-176.8	-34.8	42	0	0	0	115	A256 L259 S260	A256-P387 HydrophobicContact CB-CB 4.07Å; A256-P387 HydrophobicContact CB-CG 3.42Å; A256-P387 VanDerWaalsContact CB-CG 3.42Å; L259-P387 CarbonylContact C-O 3.54Å; L259-P387 HydrophobicContact CB-CB 4.29Å; L259-P387 WeakPolarHBondContact CB-O 3.41Å; L259-P387 HydrophobicContact CD1-CB 4.34Å; S260-P387 PolarHBondContact N-O 3.33Å
388	L	95.7	Very high	93.8	Very high	23 Å²	23	40.3 Å²	40.3	12%	0.12	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	12.7	-177.6	-66.9	178.7	0	0	0	113.7	L259 L281 E386 D390 A391 P416 L419 F426	L259-L388 HydrophobicContact CB-CD2 4.46Å; L259-L388 HydrophobicContact CD1-CD2 4.05Å; L259-L388 HydrophobicContact CD2-CD2 4.36Å; L281-L388 HydrophobicContact CB-CD1 3.87Å; L281-L388 HydrophobicContact CD2-CD1 4.27Å; L281-L388 WeakPolarHBondContact O-CD1 3.15Å; L281-L388 WeakPolarHBondContact O-CG 3.26Å; E386-L388 PolarHBondContact O-N 3.23Å; L388-D390 PolarHBondContact O-N 2.98Å; L388-D390 VanDerWaalsContact O-N 3.14Å; L388-A391 HydrophobicContact CB-CB 4.15Å; L388-A391 HydrophobicContact CD2-CB 4.08Å; L388-A391 VanDerWaalsContact O-CB 3.28Å; L388-A391 WeakPolarHBondContact O-CB 3.43Å; L388-A391 PolarHBondContact O-N 3.48Å; L388-A391 VanDerWaalsContact O-N 3.09Å; L388-P416 HydrophobicContact CD1-CG 3.82Å; L388-L419 HydrophobicContact CD1-CD2 3.88Å; L388-L419 HydrophobicContact CD2-CD2 4.08Å; L388-F426 HydrophobicContact CD2-CE1 4.2Å; L388-F426 HydrophobicContact CD2-CZ 4.13Å
389	R	94.3	Very high	94.2	Very high	59 Å²	59	39.8 Å²	39.8	22%	0.223	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-34.9	-176.5	67.6	-176.9	170.9	-84.9	1.7	114.2	S260 E264 R371 R384 E386	S260-R389 VanDerWaalsContact CB-NH2 3.32Å; S260-R389 PolarHBondContact OG-NH1 3.01Å; S260-R389 PolarHBondContact OG-NH2 3.2Å; E264-R389 IonicContact OE1-CZ 3.15Å; E264-R389 IonicContact OE1-NE 2.84Å; E264-R389 IonicContact OE1-NH2 3.24Å; E264-R389 PolarHBondContact OE1-NH2 3.4Å; R371-R389 VanDerWaalsContact NH1-NH2 3.14Å; R384-R389 WeakPolarHBondContact O-CD 3.28Å; R384-R389 PolarHBondContact O-NE 3.25Å; E386-R389 HydrophobicContact CB-CB 4.2Å; E386-R389 WeakPolarHBondContact O-CB 3.27Å; E386-R389 VanDerWaalsContact O-CG 3.3Å; E386-R389 WeakPolarHBondContact O-CG 3.34Å; E386-R389 PolarHBondContact O-N 2.98Å; E386-R389 VanDerWaalsContact O-N 3.11Å; E386-R389 PolarHBondContact O-NH1 2.92Å
390	D	95.3	Very high	94.5	Very high	58 Å²	58	33 Å²	33	31%	0.31	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	27.5	-177.8	-60.1	-49.8	0	0	0	110.8	G263 L388 D392 E393	G263-D390 WeakPolarHBondContact CA-O 3.49Å; L388-D390 PolarHBondContact O-N 2.98Å; L388-D390 VanDerWaalsContact O-N 3.14Å; D390-D392 PolarHBondContact O-N 3.44Å; D390-E393 PolarHBondContact O-N 2.86Å
391	A	95.4	Very high	94.9	Very high	9 Å²	9	31.4 Å²	31.4	7%	0.074	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.3	-174	0	0	0	0	0	113.8	L388 E393 V394 L419 N423 F426	L388-A391 HydrophobicContact CB-CB 4.15Å; L388-A391 HydrophobicContact CD2-CB 4.08Å; L388-A391 VanDerWaalsContact O-CB 3.28Å; L388-A391 WeakPolarHBondContact O-CB 3.43Å; L388-A391 PolarHBondContact O-N 3.48Å; L388-A391 VanDerWaalsContact O-N 3.09Å; A391-E393 PolarHBondContact O-N 3.11Å; A391-V394 WeakPolarHBondContact O-CB 3.4Å; A391-V394 WeakPolarHBondContact O-CG2 3.2Å; A391-V394 PolarHBondContact O-N 3.4Å; A391-L419 HydrophobicContact CB-CD1 4.04Å; A391-L419 HydrophobicContact CB-CD2 4.03Å; A391-N423 PolarHBondContact O-ND2 3.35Å; A391-F426 HydrophobicContact CB-CE2 4.11Å; A391-F426 HydrophobicContact CB-CZ 4.32Å
392	D	94.8	Very high	95.1	Very high	133 Å²	133	30.7 Å²	30.7	71%	0.711	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-68.5	-22.7	177.7	-68.9	-29.7	0	0	0	113.1	D390	D390-D392 PolarHBondContact O-N 3.44Å
393	E	96.2	Very high	95.2	Very high	129 Å²	129	31 Å²	31	60%	0.603	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-85	-12.1	179.5	-62.8	-60.9	148.7	0	0	112.6	G263 G266 D390 A391 A395	G263-E393 VanDerWaalsContact O-CB 3.25Å; G263-E393 WeakPolarHBondContact O-CB 3.33Å; G266-E393 WeakPolarHBondContact CA-O 3.24Å; D390-E393 PolarHBondContact O-N 2.86Å; A391-E393 PolarHBondContact O-N 3.11Å; E393-A395 PolarHBondContact O-N 3.4Å
394	V	96.6	Very high	95.4	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	16%	0.158	C	C	.	.			trans	-59.3	125.8	179.5	175.6	0	0	0	0	110.4	L262 A391 V398 Y425 F426	L262-V394 HydrophobicContact CB-CG1 4.44Å; L262-V394 HydrophobicContact CB-CG2 4.04Å; A391-V394 WeakPolarHBondContact O-CB 3.4Å; A391-V394 WeakPolarHBondContact O-CG2 3.2Å; A391-V394 PolarHBondContact O-N 3.4Å; V394-V398 HydrophobicContact CG1-CG2 3.81Å; V394-Y425 VanDerWaalsContact O-CD2 3.31Å; V394-Y425 WeakPolarHBondContact O-CD2 3.39Å; V394-F426 HydrophobicContact CB-CE2 3.76Å; V394-F426 HydrophobicContact CB-CZ 4.35Å; V394-F426 HydrophobicContact CG1-CE2 3.98Å; V394-F426 HydrophobicContact CG1-CZ 4.37Å; V394-F426 HydrophobicContact CG2-CE2 3.72Å; V394-F426 HydrophobicContact CG2-CZ 3.89Å
395	A	95.6	Very high	95.6	Very high	23 Å²	23	28.3 Å²	28.3	19%	0.19	15%	0.151	C	C	.	.			trans	-120	16.9	-172.8	0	0	0	0	0	114.1	E393 Y425	E393-A395 PolarHBondContact O-N 3.4Å; A395-Y425 WeakPolarHBondContact O-CE1 3.45Å
396	V	96.6	Very high	95.7	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.024	14%	0.144	C	C	.	.	S	Bend	trans	-134.8	150.8	177.7	-63	0	0	0	0	110.6	L262 T269 L271 V398	L262-V396 HydrophobicContact CD2-CG2 3.63Å; T269-V396 HydrophobicContact CG2-CG1 3.59Å; T269-V396 HydrophobicContact CG2-CG2 4.33Å; L271-V396 WeakPolarHBondContact O-CG1 3.21Å; V396-V398 WeakPolarHBondContact O-CG2 3.21Å; V396-V398 PolarHBondContact O-N 3.14Å
397	P	98	Very high	95.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.			trans	-57	131.3	176.1	-25	34.9	0	0	0	112.3	L87 T272 A273 A274 Y425 F470 A474 L478 W541	L87-P397 HydrophobicContact CD2-CB 3.83Å; L87-P397 HydrophobicContact CD2-CG 3.66Å; T272-P397 WeakPolarHBondContact O-CD 3.39Å; A273-P397 WeakPolarHBondContact CA-O 3.21Å; A273-P397 HydrophobicContact CB-CB 4.37Å; A274-P397 PolarHBondContact N-O 3.33Å; P397-Y425 CarbonylContact C-O 3.58Å; P397-Y425 WeakPolarHBondContact CA-O 3.3Å; P397-F470 HydrophobicContact CB-CE2 4.43Å; P397-F470 HydrophobicContact CB-CZ 3.79Å; P397-A474 HydrophobicContact CB-CB 4.37Å; P397-A474 HydrophobicContact CG-CB 4.45Å; P397-L478 HydrophobicContact CG-CD1 4.15Å; P397-W541 HydrophobicContact CG-CH2 3.89Å; P397-W541 HydrophobicContact CG-CZ3 4.22Å
398	V	98.5	Very high	95.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	117.4	176.9	-172.4	0	0	0	0	109.8	L259 L262 A274 V394 V396 Y425 F426 L427	L259-V398 HydrophobicContact CD2-CG1 4.06Å; L262-V398 HydrophobicContact CD1-CG2 3.75Å; A274-V398 HydrophobicContact CB-CG2 4.48Å; A274-V398 VanDerWaalsContact O-CA 3.26Å; A274-V398 WeakPolarHBondContact O-CA 3.41Å; V394-V398 HydrophobicContact CG1-CG2 3.81Å; V396-V398 WeakPolarHBondContact O-CG2 3.21Å; V396-V398 PolarHBondContact O-N 3.14Å; V398-Y425 PolarHBondContact N-O 3.09Å; V398-F426 HydrophobicContact CB-CD1 3.99Å; V398-F426 HydrophobicContact CB-CE1 3.98Å; V398-F426 HydrophobicContact CG1-CD1 4.19Å; V398-F426 HydrophobicContact CG1-CE1 3.92Å; V398-F426 HydrophobicContact CG2-CE1 4.35Å; V398-F426 HydrophobicContact CG2-CZ 4.47Å; V398-L427 PolarHBondContact O-N 3.44Å
399	L	98.6	Very high	95.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.1	171.7	176.3	65.9	0	0	0	110.6	L98 A274 A275 A276 I401 L427 A429 F470	L98-L399 HydrophobicContact CD2-CD1 4.46Å; L98-L399 HydrophobicContact CD2-CD2 4.1Å; A274-L399 PolarHBondContact O-N 3.44Å; A275-L399 CarbonylContact C-O 3.53Å; A275-L399 WeakPolarHBondContact CA-O 3.26Å; A275-L399 HydrophobicContact CB-CB 4.14Å; A276-L399 PolarHBondContact N-O 2.87Å; L399-I401 HydrophobicContact CD2-CD1 4.24Å; L399-I401 HydrophobicContact CD2-CG1 4.18Å; L399-I401 HydrophobicContact CG-CG1 4.13Å; L399-L427 HydrophobicContact CD1-CB 4.12Å; L399-A429 HydrophobicContact CD1-CB 4.19Å; L399-F470 HydrophobicContact CB-CD1 3.65Å; L399-F470 HydrophobicContact CB-CD2 3.99Å; L399-F470 HydrophobicContact CB-CE1 3.58Å; L399-F470 HydrophobicContact CB-CE2 3.91Å; L399-F470 HydrophobicContact CB-CG 3.86Å; L399-F470 HydrophobicContact CB-CZ 3.7Å; L399-F470 HydrophobicContact CD2-CB 3.68Å; L399-F470 HydrophobicContact CD2-CD1 4.04Å; L399-F470 HydrophobicContact CD2-CD2 4.1Å; L399-F470 HydrophobicContact CD2-CG 3.66Å; L399-F470 HydrophobicContact CG-CG 4.36Å
400	C	98.4	Very high	95	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.9	170.5	-66.2	0	0	0	0	109.3	A276 P279 F420 L427 L428 A429	A276-C400 WeakPolarHBondContact O-CA 3.38Å; P279-C400 HydrophobicContact CG-CB 3.99Å; C400-F420 HydrophobicContact CB-CE1 4.04Å; C400-F420 HydrophobicContact CB-CZ 4.18Å; C400-L427 PolarHBondContact N-O 3.3Å; C400-L428 HydrophobicContact CB-CD1 4.17Å; C400-L428 CarbonylContact O-C 3.54Å; C400-L428 WeakPolarHBondContact O-CA 3.3Å; C400-A429 PolarHBondContact O-N 3.39Å
401	I	97.6	Very high	94.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118	173.2	-56.3	-171.9	0	0	0	108.5	A276 S278 P279 L399 A429 F439 W462 A466 V467	A276-I401 PolarHBondContact O-N 2.96Å; S278-I401 PolarHBondContact N-O 3.43Å; P279-I401 VanDerWaalsContact CD-O 3.26Å; P279-I401 WeakPolarHBondContact CD-O 3.26Å; L399-I401 HydrophobicContact CD2-CD1 4.24Å; L399-I401 HydrophobicContact CD2-CG1 4.18Å; L399-I401 HydrophobicContact CG-CG1 4.13Å; I401-A429 WeakPolarHBondContact CA-O 3.49Å; I401-A429 HydrophobicContact CG1-CB 4.34Å; I401-F439 HydrophobicContact CG2-CD1 4.16Å; I401-F439 HydrophobicContact CG2-CE1 3.58Å; I401-F439 HydrophobicContact CG2-CE2 4.19Å; I401-F439 HydrophobicContact CG2-CZ 3.61Å; I401-W462 HydrophobicContact CD1-CH2 4.47Å; I401-W462 HydrophobicContact CD1-CZ3 4.44Å; I401-W462 HydrophobicContact CG2-CE3 4.38Å; I401-W462 HydrophobicContact CG2-CH2 3.96Å; I401-W462 HydrophobicContact CG2-CZ3 3.44Å; I401-W462 VanDerWaalsContact CG2-CZ3 3.44Å; I401-A466 HydrophobicContact CD1-CB 4.02Å; I401-V467 HydrophobicContact CD1-CG2 3.62Å; I401-V467 HydrophobicContact CG1-CG2 4.4Å
402	C	96.5	Very high	94.5	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.02	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.4	178.7	-61.1	0	0	0	0	110.3	L428 A429 L430 T431	C402-L428 HydrophobicContact CB-CD1 4.04Å; C402-A429 PolarHBondContact N-O 3.43Å; C402-L430 HydrophobicContact CB-CD1 4.06Å; C402-L430 WeakPolarHBondContact O-CA 3.27Å; C402-T431 PolarHBondContact O-N 3.31Å; C402-T431 PolarHBondContact O-OG1 3Å
403	S	94.4	Very high	94.1	Very high	8 Å²	8	25.7 Å²	25.7	6%	0.056	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.5	165.9	78	0	0	0	0	110.5	D405 D406 T431 G435	S403-D405 VanDerWaalsContact C-N 3.29Å; S403-D405 WeakPolarHBondContact CB-OD1 3.46Å; S403-D405 PolarHBondContact OG-OD1 2.92Å; S403-D406 PolarHBondContact OG-N 3.15Å; S403-T431 CarbonylContact C-O 3.42Å; S403-T431 WeakPolarHBondContact CA-O 3.48Å; S403-T431 WeakPolarHBondContact CB-OG1 3.17Å; S403-G435 PolarHBondContact OG-N 3.18Å; S403-G435 PolarHBondContact OG-O 3.47Å
404	S	93.1	Very high	93.9	Very high	48 Å²	48	21.1 Å²	21.1	34%	0.336	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.8	-179.8	-55.3	0	0	0	0	112.8	T431	S404-T431 PolarHBondContact N-O 2.89Å; S404-T431 PolarHBondContact OG-O 2.75Å
405	D	92	Very high	93.8	Very high	17 Å²	17	22.5 Å²	22.5	9%	0.091	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	7.9	179.8	69	-17.9	0	0	0	113.9	L58 P111 S403 P407 R433 G434 G435	L58-D405 HydrophobicContact CD1-CB 3.59Å; P111-D405 HydrophobicContact CB-CB 3.99Å; P111-D405 WeakPolarHBondContact CB-O 3.33Å; P111-D405 HydrophobicContact CG-CB 4.27Å; S403-D405 VanDerWaalsContact C-N 3.29Å; S403-D405 WeakPolarHBondContact CB-OD1 3.46Å; S403-D405 PolarHBondContact OG-OD1 2.92Å; D405-P407 VanDerWaalsContact O-CD 3.28Å; D405-P407 WeakPolarHBondContact O-CD 3.47Å; D405-R433 VanDerWaalsContact OD2-CA 3.27Å; D405-R433 WeakPolarHBondContact OD2-CA 3.34Å; D405-G434 PolarHBondContact OD1-N 2.77Å; D405-G434 PolarHBondContact OD2-N 3.45Å; D405-G435 PolarHBondContact OD1-N 2.83Å; D405-G435 PolarHBondContact OD2-N 2.96Å
406	D	93.3	Very high	93.7	Very high	14 Å²	14	22.6 Å²	22.6	8%	0.075	15%	0.147	C	C	.	.			trans	-62.5	114.9	-178.5	-169	-39.2	0	0	0	111.1	S278 S403 L408 L409 H436	S278-D406 WeakPolarHBondContact CB-OD2 3.42Å; S278-D406 PolarHBondContact OG-OD2 3.17Å; S278-D406 VanDerWaalsContact OG-OD2 3.06Å; S403-D406 PolarHBondContact OG-N 3.15Å; D406-L408 VanDerWaalsContact C-N 3.27Å; D406-L408 PolarHBondContact O-N 3.39Å; D406-L408 PolarHBondContact OD1-N 3.03Å; D406-L409 HydrophobicContact CB-CB 4.32Å; D406-L409 HydrophobicContact CB-CD1 4.42Å; D406-L409 HydrophobicContact CB-CG 4.46Å; D406-L409 PolarHBondContact OD1-N 3.46Å; D406-L409 VanDerWaalsContact OD2-CD1 3.29Å; D406-L409 WeakPolarHBondContact OD2-CD1 3.39Å; D406-H436 WeakPolarHBondContact OD1-CB 3.39Å; D406-H436 IonicContact OD1-CG 2.71Å; D406-H436 IonicContact OD1-ND1 3.31Å; D406-H436 PolarHBondContact OD1-ND1 2.94Å; D406-H436 VanDerWaalsContact OD1-ND1 3.12Å; D406-H436 WeakPolarHBondContact OD2-CA 3.09Å; D406-H436 IonicContact OD2-CE1 2.71Å; D406-H436 IonicContact OD2-CG 3.47Å; D406-H436 IonicContact OD2-ND1 3.89Å; D406-H436 PolarHBondContact OD2-ND1 3.36Å
407	P	91.4	Very high	93.7	Very high	15 Å²	15	24.8 Å²	24.8	10%	0.097	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-6.6	-174.9	32.9	-35.3	0	0	0	113.7	T115 P292 Y295 D405	T115-P407 HydrophobicContact CG2-CG 4.26Å; T115-P407 WeakPolarHBondContact OG1-CD 3.44Å; T115-P407 WeakPolarHBondContact OG1-CG 3.19Å; P292-P407 WeakPolarHBondContact CD-O 3.24Å; Y295-P407 HydrophobicContact CD2-CB 4.3Å; Y295-P407 HydrophobicContact CE2-CB 3.81Å; Y295-P407 HydrophobicContact CE2-CG 4.04Å; D405-P407 VanDerWaalsContact O-CD 3.28Å; D405-P407 WeakPolarHBondContact O-CD 3.47Å
408	L	91.1	Very high	93.5	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.047	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-10.3	-176.5	-62.9	-172.9	0	0	0	113.6	T115 W182 W286 M291 Y295 D406 H436	T115-L408 HydrophobicContact CG2-CD1 3.99Å; T115-L408 HydrophobicContact CG2-CG 4.29Å; W182-L408 HydrophobicContact CH2-CD1 4.46Å; W286-L408 PolarHBondContact NE1-O 3.42Å; M291-L408 HydrophobicContact SD-CD2 4.44Å; Y295-L408 HydrophobicContact CD1-CD2 3.66Å; Y295-L408 HydrophobicContact CD2-CD2 4.01Å; Y295-L408 HydrophobicContact CE1-CD2 4.33Å; Y295-L408 HydrophobicContact CG-CD2 3.46Å; Y295-L408 VanDerWaalsContact CG-CD2 3.46Å; D406-L408 VanDerWaalsContact C-N 3.27Å; D406-L408 PolarHBondContact O-N 3.39Å; D406-L408 PolarHBondContact OD1-N 3.03Å; L408-H436 HydrophobicContact CB-CB 4.29Å; L408-H436 HydrophobicContact CD1-CB 3.89Å; L408-H436 HydrophobicContact CG-CB 4.13Å
409	L	91.8	Very high	93.4	Very high	25 Å²	25	29.8 Å²	29.8	13%	0.131	19%	0.193	C	C	.	.	S	Bend	trans	-107.5	158.3	178.9	-63.9	-178.5	0	0	0	111.5	V280 D406	V280-L409 HydrophobicContact CG2-CD2 3.83Å; D406-L409 HydrophobicContact CB-CB 4.32Å; D406-L409 HydrophobicContact CB-CD1 4.42Å; D406-L409 HydrophobicContact CB-CG 4.46Å; D406-L409 PolarHBondContact OD1-N 3.46Å; D406-L409 VanDerWaalsContact OD2-CD1 3.29Å; D406-L409 WeakPolarHBondContact OD2-CD1 3.39Å
410	P	90.6	Very high	93.3	Very high	19 Å²	19	29.8 Å²	29.8	12%	0.123	19%	0.193	C	C	.	.			trans	-54.6	151.6	167.6	-25.9	35.8	0	0	0	111.5	R285 W286 S289 T414	R285-P410 HydrophobicContact CB-CG 4.28Å; W286-P410 HydrophobicContact CB-CG 4.36Å; S289-P410 WeakPolarHBondContact OG-CB 3.5Å; S289-P410 WeakPolarHBondContact OG-CG 3.47Å; P410-T414 VanDerWaalsContact CB-OG1 3.32Å; P410-T414 WeakPolarHBondContact CB-OG1 3.4Å
411	P	89.4	Confident	93.2	Very high	78 Å²	78	35.2 Å²	35.2	51%	0.506	22%	0.219	S	C	.	.			trans	-52.4	146	-178.9	-26.7	33.9	0	0	0	112.7	S413 T414	P411-S413 PolarHBondContact O-N 3.44Å; P411-T414 WeakPolarHBondContact O-CB 3.34Å; P411-T414 PolarHBondContact O-N 3.41Å; P411-T414 PolarHBondContact O-OG1 3.08Å
412	A	89.1	Confident	93	Very high	28 Å²	28	38.5 Å²	38.5	23%	0.231	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-56.6	-25.6	-178.5	0	0	0	0	0	114	T414 L415 L430	A412-T414 PolarHBondContact O-N 2.77Å; A412-T414 VanDerWaalsContact O-N 3.17Å; A412-L415 HydrophobicContact CB-CD1 4.04Å; A412-L415 VanDerWaalsContact O-CB 3.3Å; A412-L415 WeakPolarHBondContact O-CB 3.32Å; A412-L415 WeakPolarHBondContact O-CD1 3.19Å; A412-L415 WeakPolarHBondContact O-CG 3.47Å; A412-L415 PolarHBondContact O-N 3.35Å; A412-L415 VanDerWaalsContact O-N 3.14Å; A412-L430 HydrophobicContact CB-CD1 4.5Å
413	S	88.3	Confident	92.9	Very high	114 Å²	114	38.9 Å²	38.9	80%	0.797	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-61.9	-18.8	173.1	59.6	0	0	0	0	114	P411	P411-S413 PolarHBondContact O-N 3.44Å
414	T	90.6	Very high	92.9	Very high	34 Å²	34	39.1 Å²	39.1	21%	0.209	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-90.1	-6.2	179.1	70.5	0	0	0	0	113.4	L282 R285 P410 P411 A412	L282-T414 VanDerWaalsContact CD1-O 3.26Å; L282-T414 WeakPolarHBondContact CD1-O 3.27Å; R285-T414 PolarHBondContact NH1-O 3.36Å; P410-T414 VanDerWaalsContact CB-OG1 3.32Å; P410-T414 WeakPolarHBondContact CB-OG1 3.4Å; P411-T414 WeakPolarHBondContact O-CB 3.34Å; P411-T414 PolarHBondContact O-N 3.41Å; P411-T414 PolarHBondContact O-OG1 3.08Å; A412-T414 PolarHBondContact O-N 2.77Å; A412-T414 VanDerWaalsContact O-N 3.17Å
415	L	94.2	Very high	93	Very high	32 Å²	32	38.1 Å²	38.1	17%	0.168	23%	0.234	C	C	.	.	S	Bend	trans	-60.6	139.9	-179.1	-68.7	170.3	0	0	0	110.9	L281 A412 V417 L428 L430	L281-L415 HydrophobicContact CD1-CD2 3.83Å; A412-L415 HydrophobicContact CB-CD1 4.04Å; A412-L415 VanDerWaalsContact O-CB 3.3Å; A412-L415 WeakPolarHBondContact O-CB 3.32Å; A412-L415 WeakPolarHBondContact O-CD1 3.19Å; A412-L415 WeakPolarHBondContact O-CG 3.47Å; A412-L415 PolarHBondContact O-N 3.35Å; A412-L415 VanDerWaalsContact O-N 3.14Å; L415-V417 HydrophobicContact CB-CG2 4.34Å; L415-V417 PolarHBondContact O-N 3.46Å; L415-L428 HydrophobicContact CD1-CD2 4.29Å; L415-L430 HydrophobicContact CD1-CD1 3.99Å
416	P	95	Very high	93.3	Very high	25 Å²	25	37.3 Å²	37.3	16%	0.162	23%	0.23	C	C	.	.			trans	-77.4	64.4	179.2	32.7	-35.1	0	0	0	111.3	L281 L388 S418 L419 F420	L281-P416 HydrophobicContact CD1-CG 4.25Å; L388-P416 HydrophobicContact CD1-CG 3.82Å; P416-S418 PolarHBondContact O-N 2.88Å; P416-S418 VanDerWaalsContact O-N 3.13Å; P416-L419 HydrophobicContact CB-CB 4.38Å; P416-L419 WeakPolarHBondContact O-CB 3.22Å; P416-L419 PolarHBondContact O-N 2.85Å; P416-F420 HydrophobicContact CG-CE2 4.12Å; P416-F420 VanDerWaalsContact O-CD2 3.29Å; P416-F420 WeakPolarHBondContact O-CD2 3.48Å
417	V	94.9	Very high	93.5	Very high	50 Å²	50	36.8 Å²	36.8	30%	0.303	23%	0.227	S	C	.	.	H	α-helix	trans	-54	-35.2	-176.4	173.7	0	0	0	0	112.4	I81 L415 L419 F420 Q421	I81-V417 HydrophobicContact CG2-CG1 4.08Å; L415-V417 HydrophobicContact CB-CG2 4.34Å; L415-V417 PolarHBondContact O-N 3.46Å; V417-L419 VanDerWaalsContact C-N 3.29Å; V417-L419 PolarHBondContact O-N 3.38Å; V417-F420 PolarHBondContact O-N 3.39Å; V417-Q421 HydrophobicContact CG1-CG 4.22Å; V417-Q421 WeakPolarHBondContact O-CG 3.21Å; V417-Q421 PolarHBondContact O-N 3.42Å; V417-Q421 VanDerWaalsContact O-N 3.07Å
418	S	95.2	Very high	93.8	Very high	85 Å²	85	36 Å²	36	59%	0.594	22%	0.222	S	C	*	.	H	α-helix	trans	-60.5	-34.1	177.5	54	0	0	0	0	113.4	P416 Q421 S422	P416-S418 PolarHBondContact O-N 2.88Å; P416-S418 VanDerWaalsContact O-N 3.13Å; S418-Q421 PolarHBondContact O-N 3.07Å; S418-S422 VanDerWaalsContact O-CB 3.29Å; S418-S422 WeakPolarHBondContact O-CB 3.36Å; S418-S422 PolarHBondContact O-N 3.5Å; S418-S422 VanDerWaalsContact O-N 3.09Å; S418-S422 PolarHBondContact O-OG 3.35Å
419	L	95.7	Very high	94.1	Very high	21 Å²	21	35.7 Å²	35.7	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-49.8	174.9	173.9	64.5	0	0	0	110.1	L388 A391 P416 V417 Q421 S422 N423 F426	L388-L419 HydrophobicContact CD1-CD2 3.88Å; L388-L419 HydrophobicContact CD2-CD2 4.08Å; A391-L419 HydrophobicContact CB-CD1 4.04Å; A391-L419 HydrophobicContact CB-CD2 4.03Å; P416-L419 HydrophobicContact CB-CB 4.38Å; P416-L419 WeakPolarHBondContact O-CB 3.22Å; P416-L419 PolarHBondContact O-N 2.85Å; V417-L419 VanDerWaalsContact C-N 3.29Å; V417-L419 PolarHBondContact O-N 3.38Å; L419-Q421 VanDerWaalsContact C-N 3.3Å; L419-Q421 PolarHBondContact O-N 3.29Å; L419-S422 PolarHBondContact O-N 3.48Å; L419-S422 PolarHBondContact O-OG 2.85Å; L419-N423 HydrophobicContact CD1-CB 4.06Å; L419-N423 VanDerWaalsContact O-CB 3.32Å; L419-N423 WeakPolarHBondContact O-CB 3.31Å; L419-N423 PolarHBondContact O-N 2.87Å; L419-F426 HydrophobicContact CD1-CD2 4.44Å; L419-F426 HydrophobicContact CD2-CD2 4.49Å; L419-F426 HydrophobicContact CD2-CG 4.46Å; L419-F426 HydrophobicContact CG-CD2 4.47Å; L419-F426 HydrophobicContact CG-CG 4.49Å
420	F	96.3	Very high	94.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-32.5	-178.3	-61.6	-79.7	0	0	0	112.5	I81 C82 K83 L281 C400 P416 V417 F426 L428	I81-F420 HydrophobicContact CG2-CB 4.21Å; C82-F420 CarbonylContact C-O 3.21Å; C82-F420 WeakPolarHBondContact CA-O 3.37Å; K83-F420 PolarHBondContact N-O 3.09Å; L281-F420 HydrophobicContact CD1-CE2 4.04Å; L281-F420 HydrophobicContact CD1-CZ 3.85Å; C400-F420 HydrophobicContact CB-CE1 4.04Å; C400-F420 HydrophobicContact CB-CZ 4.18Å; P416-F420 HydrophobicContact CG-CE2 4.12Å; P416-F420 VanDerWaalsContact O-CD2 3.29Å; P416-F420 WeakPolarHBondContact O-CD2 3.48Å; V417-F420 PolarHBondContact O-N 3.39Å; F420-F426 HydrophobicContact CD1-CB 3.74Å; F420-F426 HydrophobicContact CD1-CD1 4.49Å; F420-F426 HydrophobicContact CE1-CB 4.06Å; F420-F426 AromaticContact CE1-CD1 3.95Å; F420-F426 HydrophobicContact CE1-CD1 3.95Å; F420-F426 HydrophobicContact CE1-CG 4.45Å; F420-L428 HydrophobicContact CB-CB 4.29Å; F420-L428 HydrophobicContact CD1-CB 3.5Å; F420-L428 VanDerWaalsContact CD1-CB 3.5Å; F420-L428 HydrophobicContact CD2-CB 3.99Å; F420-L428 HydrophobicContact CD2-CD2 3.93Å; F420-L428 HydrophobicContact CE1-CB 3.71Å; F420-L428 HydrophobicContact CE2-CB 4.17Å; F420-L428 HydrophobicContact CE2-CD2 4Å; F420-L428 HydrophobicContact CG-CB 3.65Å; F420-L428 HydrophobicContact CG-CD2 4.39Å; F420-L428 HydrophobicContact CZ-CB 4.04Å; F420-L428 HydrophobicContact CZ-CD1 4.44Å
421	Q	95.8	Very high	94.4	Very high	114 Å²	114	34.6 Å²	34.6	53%	0.533	21%	0.213	S	C	.	.	H	α-helix	trans	-78.2	-23.6	177.9	-70	175.7	-28.1	0	0	113.6	I81 K83 V417 S418 L419	I81-Q421 HydrophobicContact CG2-CG 4.01Å; K83-Q421 VanDerWaalsContact CB-O 3.29Å; K83-Q421 WeakPolarHBondContact CB-O 3.38Å; V417-Q421 HydrophobicContact CG1-CG 4.22Å; V417-Q421 WeakPolarHBondContact O-CG 3.21Å; V417-Q421 PolarHBondContact O-N 3.42Å; V417-Q421 VanDerWaalsContact O-N 3.07Å; S418-Q421 PolarHBondContact O-N 3.07Å; L419-Q421 VanDerWaalsContact C-N 3.3Å; L419-Q421 PolarHBondContact O-N 3.29Å
422	S	94.5	Very high	94.4	Very high	69 Å²	69	34 Å²	34	48%	0.483	21%	0.206	S	C	.	.	H	α-helix	trans	-103.2	-29.5	-174.6	60.5	0	0	0	0	114.1	K83 S418 L419	K83-S422 WeakPolarHBondContact CD-O 3.27Å; K83-S422 PolarHBondContact NZ-O 3.14Å; K83-S422 VanDerWaalsContact NZ-O 3.1Å; S418-S422 VanDerWaalsContact O-CB 3.29Å; S418-S422 WeakPolarHBondContact O-CB 3.36Å; S418-S422 PolarHBondContact O-N 3.5Å; S418-S422 VanDerWaalsContact O-N 3.09Å; S418-S422 PolarHBondContact O-OG 3.35Å; L419-S422 PolarHBondContact O-N 3.48Å; L419-S422 PolarHBondContact O-OG 2.85Å
423	N	94.3	Very high	94.5	Very high	11 Å²	11	35.8 Å²	35.8	6%	0.059	21%	0.207	C	C	.	.			trans	-99.8	120.4	-178	-170.4	-31.8	0	0	0	111.1	A391 L419 Y425 F426	A391-N423 PolarHBondContact O-ND2 3.35Å; L419-N423 HydrophobicContact CD1-CB 4.06Å; L419-N423 VanDerWaalsContact O-CB 3.32Å; L419-N423 WeakPolarHBondContact O-CB 3.31Å; L419-N423 PolarHBondContact O-N 2.87Å; N423-Y425 PolarHBondContact O-N 3.07Å; N423-Y425 WeakPolarHBondContact OD1-CB 3.29Å; N423-Y425 WeakPolarHBondContact OD1-CD2 3.27Å; N423-Y425 PolarHBondContact OD1-N 3.4Å; N423-F426 HydrophobicContact CB-CD2 4.37Å; N423-F426 PolarHBondContact O-N 3.08Å
424	P	94.5	Very high	94.5	Very high	13 Å²	13	30.4 Å²	30.4	8%	0.084	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.4	-178.1	31.2	-36.1	0	0	0	114.5	K83 F539	K83-P424 HydrophobicContact CD-CB 4.32Å; P424-F539 HydrophobicContact CB-CD1 4.26Å; P424-F539 HydrophobicContact CB-CE1 4.21Å; P424-F539 HydrophobicContact CG-CD1 4.19Å; P424-F539 HydrophobicContact CG-CD2 4.37Å; P424-F539 HydrophobicContact CG-CE1 3.8Å; P424-F539 HydrophobicContact CG-CE2 4Å; P424-F539 HydrophobicContact CG-CG 4.46Å; P424-F539 HydrophobicContact CG-CZ 3.7Å
425	Y	95.8	Very high	94.6	Very high	27 Å²	27	28.8 Å²	28.8	11%	0.106	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-22.4	178.9	-67.6	-79.9	0	0	0	112.9	V394 A395 P397 V398 N423 F539 W541	V394-Y425 VanDerWaalsContact O-CD2 3.31Å; V394-Y425 WeakPolarHBondContact O-CD2 3.39Å; A395-Y425 WeakPolarHBondContact O-CE1 3.45Å; P397-Y425 CarbonylContact C-O 3.58Å; P397-Y425 WeakPolarHBondContact CA-O 3.3Å; V398-Y425 PolarHBondContact N-O 3.09Å; N423-Y425 PolarHBondContact O-N 3.07Å; N423-Y425 WeakPolarHBondContact OD1-CB 3.29Å; N423-Y425 WeakPolarHBondContact OD1-CD2 3.27Å; N423-Y425 PolarHBondContact OD1-N 3.4Å; Y425-F539 HydrophobicContact CE2-CZ 4.18Å; Y425-W541 AromaticContact CD1-CH2 3.38Å; Y425-W541 HydrophobicContact CD1-CH2 3.38Å; Y425-W541 HydrophobicContact CD1-CZ2 4.39Å; Y425-W541 AromaticContact CD1-CZ3 3.6Å; Y425-W541 HydrophobicContact CD1-CZ3 3.6Å; Y425-W541 AromaticContact CE1-CE3 3.81Å; Y425-W541 HydrophobicContact CE1-CE3 3.81Å; Y425-W541 AromaticContact CE1-CH2 3.34Å; Y425-W541 HydrophobicContact CE1-CH2 3.34Å; Y425-W541 HydrophobicContact CE1-CZ2 4.33Å; Y425-W541 AromaticContact CE1-CZ3 3.07Å; Y425-W541 HydrophobicContact CE1-CZ3 3.07Å; Y425-W541 HydrophobicContact CG-CH2 4.36Å; Y425-W541 AromaticContact CZ-CZ3 3.93Å
426	F	97.7	Very high	94.6	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.6	-178.4	-85.7	-84.9	0	0	0	111.7	L259 L388 A391 V394 V398 L419 F420 N423	L259-F426 HydrophobicContact CD2-CE1 3.83Å; L259-F426 HydrophobicContact CD2-CZ 4.2Å; L388-F426 HydrophobicContact CD2-CE1 4.2Å; L388-F426 HydrophobicContact CD2-CZ 4.13Å; A391-F426 HydrophobicContact CB-CE2 4.11Å; A391-F426 HydrophobicContact CB-CZ 4.32Å; V394-F426 HydrophobicContact CB-CE2 3.76Å; V394-F426 HydrophobicContact CB-CZ 4.35Å; V394-F426 HydrophobicContact CG1-CE2 3.98Å; V394-F426 HydrophobicContact CG1-CZ 4.37Å; V394-F426 HydrophobicContact CG2-CE2 3.72Å; V394-F426 HydrophobicContact CG2-CZ 3.89Å; V398-F426 HydrophobicContact CB-CD1 3.99Å; V398-F426 HydrophobicContact CB-CE1 3.98Å; V398-F426 HydrophobicContact CG1-CD1 4.19Å; V398-F426 HydrophobicContact CG1-CE1 3.92Å; V398-F426 HydrophobicContact CG2-CE1 4.35Å; V398-F426 HydrophobicContact CG2-CZ 4.47Å; L419-F426 HydrophobicContact CD1-CD2 4.44Å; L419-F426 HydrophobicContact CD2-CD2 4.49Å; L419-F426 HydrophobicContact CD2-CG 4.46Å; L419-F426 HydrophobicContact CG-CD2 4.47Å; L419-F426 HydrophobicContact CG-CG 4.49Å; F420-F426 HydrophobicContact CD1-CB 3.74Å; F420-F426 HydrophobicContact CD1-CD1 4.49Å; F420-F426 HydrophobicContact CE1-CB 4.06Å; F420-F426 AromaticContact CE1-CD1 3.95Å; F420-F426 HydrophobicContact CE1-CD1 3.95Å; F420-F426 HydrophobicContact CE1-CG 4.45Å; N423-F426 HydrophobicContact CB-CD2 4.37Å; N423-F426 PolarHBondContact O-N 3.08Å
427	L	97.6	Very high	94.5	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.2	174.6	-58	98.9	0	0	0	109.4	L80 C82 L87 L91 V398 L399 C400 F470	L80-L427 HydrophobicContact CD1-CB 4.3Å; L80-L427 HydrophobicContact CD1-CD2 4.46Å; C82-L427 HydrophobicContact CB-CB 4.26Å; C82-L427 HydrophobicContact CB-CD2 4.04Å; C82-L427 HydrophobicContact CB-CG 3.97Å; L87-L427 HydrophobicContact CD2-CD1 4.48Å; L91-L427 HydrophobicContact CD1-CD1 4.27Å; L91-L427 HydrophobicContact CD1-CD2 3.52Å; V398-L427 PolarHBondContact O-N 3.44Å; L399-L427 HydrophobicContact CD1-CB 4.12Å; C400-L427 PolarHBondContact N-O 3.3Å; L427-F470 HydrophobicContact CD1-CE2 4.18Å
428	L	97.5	Very high	94.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.7	176.1	172.2	63.6	0	0	0	109.6	L80 I81 C400 C402 L415 F420 L430	L80-L428 CarbonylContact C-O 3.37Å; L80-L428 WeakPolarHBondContact CA-O 3.49Å; I81-L428 HydrophobicContact CB-CB 4.24Å; I81-L428 HydrophobicContact CB-CD2 4.45Å; I81-L428 HydrophobicContact CD1-CD2 4.09Å; I81-L428 PolarHBondContact N-O 2.82Å; I81-L428 PolarHBondContact O-N 2.89Å; C400-L428 HydrophobicContact CB-CD1 4.17Å; C400-L428 CarbonylContact O-C 3.54Å; C400-L428 WeakPolarHBondContact O-CA 3.3Å; C402-L428 HydrophobicContact CB-CD1 4.04Å; L415-L428 HydrophobicContact CD1-CD2 4.29Å; F420-L428 HydrophobicContact CB-CB 4.29Å; F420-L428 HydrophobicContact CD1-CB 3.5Å; F420-L428 VanDerWaalsContact CD1-CB 3.5Å; F420-L428 HydrophobicContact CD2-CB 3.99Å; F420-L428 HydrophobicContact CD2-CD2 3.93Å; F420-L428 HydrophobicContact CE1-CB 3.71Å; F420-L428 HydrophobicContact CE2-CB 4.17Å; F420-L428 HydrophobicContact CE2-CD2 4Å; F420-L428 HydrophobicContact CG-CB 3.65Å; F420-L428 HydrophobicContact CG-CD2 4.39Å; F420-L428 HydrophobicContact CZ-CB 4.04Å; F420-L428 HydrophobicContact CZ-CD1 4.44Å; L428-L430 HydrophobicContact CG-CB 4.41Å
429	A	96.6	Very high	94.1	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	107.4	165.4	0	0	0	0	0	108.4	L98 L399 C400 I401 C402 W462	L98-A429 HydrophobicContact CD2-CB 4.28Å; L399-A429 HydrophobicContact CD1-CB 4.19Å; C400-A429 PolarHBondContact O-N 3.39Å; I401-A429 WeakPolarHBondContact CA-O 3.49Å; I401-A429 HydrophobicContact CG1-CB 4.34Å; C402-A429 PolarHBondContact N-O 3.43Å; A429-W462 HydrophobicContact CB-CH2 4.18Å
430	L	95.6	Very high	93.8	Very high	18 Å²	18	20.6 Å²	20.6	9%	0.094	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.2	-179.9	-178.2	64.1	0	0	0	110.2	R79 I81 C402 A412 L415 L428	R79-L430 PolarHBondContact N-O 3.48Å; R79-L430 PolarHBondContact O-N 3.3Å; I81-L430 HydrophobicContact CD1-CD2 4.41Å; C402-L430 HydrophobicContact CB-CD1 4.06Å; C402-L430 WeakPolarHBondContact O-CA 3.27Å; A412-L430 HydrophobicContact CB-CD1 4.5Å; L415-L430 HydrophobicContact CD1-CD1 3.99Å; L428-L430 HydrophobicContact CG-CB 4.41Å
431	T	93.6	Very high	93.4	Very high	3 Å²	3	22 Å²	22	2%	0.018	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	157.9	174.1	61.2	0	0	0	0	110.6	P78 L103 C402 S403 S404 R433 F439 W462	P78-T431 HydrophobicContact CB-CG2 3.87Å; L103-T431 HydrophobicContact CD1-CG2 3.8Å; C402-T431 PolarHBondContact O-N 3.31Å; C402-T431 PolarHBondContact O-OG1 3Å; S403-T431 CarbonylContact C-O 3.42Å; S403-T431 WeakPolarHBondContact CA-O 3.48Å; S403-T431 WeakPolarHBondContact CB-OG1 3.17Å; S404-T431 PolarHBondContact N-O 2.89Å; S404-T431 PolarHBondContact OG-O 2.75Å; T431-R433 WeakPolarHBondContact CB-O 3.43Å; T431-R433 PolarHBondContact OG1-O 3.2Å; T431-F439 WeakPolarHBondContact OG1-CE1 3.35Å; T431-W462 HydrophobicContact CG2-CE3 4.35Å; T431-W462 HydrophobicContact CG2-CH2 3.73Å; T431-W462 HydrophobicContact CG2-CZ3 3.56Å
432	D	90.7	Very high	92.6	Very high	67 Å²	67	18.5 Å²	18.5	36%	0.358	10%	0.104	S	C	.	.	S	Bend	trans	-81	-31.9	175.4	-63.1	-33	0	0	0	111.2	R79	R79-D432 IonicContact CZ-OD1 3.47Å; R79-D432 VanDerWaalsContact CZ-OD1 3.31Å; R79-D432 IonicContact NH1-OD1 3.12Å; R79-D432 PolarHBondContact NH1-OD1 3.11Å; R79-D432 IonicContact NH1-OD2 3.65Å; R79-D432 PolarHBondContact NH1-OD2 2.9Å; R79-D432 IonicContact NH2-OD1 3.83Å; R79-D432 PolarHBondContact NH2-OD1 2.84Å
433	R	89.7	Confident	91.1	Very high	65 Å²	65	18.5 Å²	18.5	25%	0.245	11%	0.108	C	C	.	.	S	Bend	trans	-118.1	159.5	177.7	-64	-171.2	-75.8	-74.8	0.9	112.3	D76 L103 A104 D105 D405 T431	D76-R433 IonicContact OD1-CZ 3.31Å; D76-R433 IonicContact OD1-NH1 2.77Å; D76-R433 IonicContact OD1-NH2 3.21Å; D76-R433 PolarHBondContact OD1-NH2 3.39Å; D76-R433 VanDerWaalsContact OD1-NH2 3.15Å; L103-R433 HydrophobicContact CD1-CB 4.47Å; L103-R433 WeakPolarHBondContact CD1-O 3.36Å; A104-R433 PolarHBondContact O-NE 2.74Å; D105-R433 IonicContact OD1-CZ 3.28Å; D105-R433 IonicContact OD1-NE 3.38Å; D105-R433 IonicContact OD1-NH2 3Å; D105-R433 PolarHBondContact OD1-NH2 2.9Å; D405-R433 VanDerWaalsContact OD2-CA 3.27Å; D405-R433 WeakPolarHBondContact OD2-CA 3.34Å; T431-R433 WeakPolarHBondContact CB-O 3.43Å; T431-R433 PolarHBondContact OG1-O 3.2Å
434	G	89.7	Confident	89.1	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.131	C	C	.	.			trans	149.8	-16.4	169.8	0	0	0	0	0	115.3	Q114 D405 G438 F439	Q114-G434 PolarHBondContact OE1-O 2.9Å; D405-G434 PolarHBondContact OD1-N 2.77Å; D405-G434 PolarHBondContact OD2-N 3.45Å; G434-G438 CarbonylContact O-C 3.53Å; G434-G438 WeakPolarHBondContact O-CA 3.21Å; G434-G438 PolarHBondContact O-N 2.68Å; G434-F439 PolarHBondContact O-N 3.21Å
435	G	91.6	Very high	87	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	-164.7	-173.5	0	0	0	0	0	113.4	S403 D405 C437	S403-G435 PolarHBondContact OG-N 3.18Å; S403-G435 PolarHBondContact OG-O 3.47Å; D405-G435 PolarHBondContact OD1-N 2.83Å; D405-G435 PolarHBondContact OD2-N 2.96Å; G435-C437 PolarHBondContact O-N 2.89Å
436	H	93.5	Very high	84.7	Confident	6 Å²	6	26.7 Å²	26.7	3%	0.028	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	110.5	177	-161.7	75.3	0	0	0	111.3	T115 S118 Q180 S278 D406 L408 G438	T115-H436 HydrophobicContact CG2-CB 3.76Å; T115-H436 PolarHBondContact OG1-N 3.49Å; S118-H436 PolarHBondContact OG-O 3.46Å; Q180-H436 PolarHBondContact NE2-NE2 3.39Å; S278-H436 VanDerWaalsContact CB-CE1 3.45Å; S278-H436 WeakPolarHBondContact CB-CE1 3.22Å; S278-H436 WeakPolarHBondContact CB-ND1 3.49Å; D406-H436 WeakPolarHBondContact OD1-CB 3.39Å; D406-H436 IonicContact OD1-CG 2.71Å; D406-H436 IonicContact OD1-ND1 3.31Å; D406-H436 PolarHBondContact OD1-ND1 2.94Å; D406-H436 VanDerWaalsContact OD1-ND1 3.12Å; D406-H436 WeakPolarHBondContact OD2-CA 3.09Å; D406-H436 IonicContact OD2-CE1 2.71Å; D406-H436 IonicContact OD2-CG 3.47Å; D406-H436 IonicContact OD2-ND1 3.89Å; D406-H436 PolarHBondContact OD2-ND1 3.36Å; L408-H436 HydrophobicContact CB-CB 4.29Å; L408-H436 HydrophobicContact CD1-CB 3.89Å; L408-H436 HydrophobicContact CG-CB 4.13Å; H436-G438 PolarHBondContact O-N 3.13Å; H436-G438 VanDerWaalsContact O-N 3.17Å
437	C	92.9	Very high	81.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	26.3	-178.8	-57.3	0	0	0	0	114.2	S118 H188 E251 I277 S278 G435	S118-C437 WeakPolarHBondContact CB-O 3.37Å; H188-C437 PolarHBondContact CD2-O 3Å; H188-C437 PolarHBondContact NE2-O 2.85Å; E251-C437 HydrophobicContact CG-CB 4.49Å; E251-C437 VanDerWaalsContact CG-SG 3.6Å; I277-C437 HydrophobicContact CG2-CB 4.42Å; S278-C437 PolarHBondContact OG-N 2.7Å; G435-C437 PolarHBondContact O-N 2.89Å
438	G	90.3	Very high	79.1	Confident	7 Å²	7	39.6 Å²	39.6	7%	0.072	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-70.2	-179.7	0	0	0	0	0	112.6	G434 H436 A440 I461	G434-G438 CarbonylContact O-C 3.53Å; G434-G438 WeakPolarHBondContact O-CA 3.21Å; G434-G438 PolarHBondContact O-N 2.68Å; H436-G438 PolarHBondContact O-N 3.13Å; H436-G438 VanDerWaalsContact O-N 3.17Å; G438-A440 PolarHBondContact O-N 3.23Å; G438-A440 VanDerWaalsContact O-N 3.11Å; G438-I461 WeakPolarHBondContact O-CG2 3.24Å
439	F	92.3	Very high	76.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.271	C	S	.	.			trans	44.8	42.3	175.5	-59.3	-81.7	0	0	0	114.4	I277 I401 T431 G434 I461 W462	I277-F439 HydrophobicContact CG2-CD2 4.03Å; I277-F439 HydrophobicContact CG2-CE2 3.72Å; I401-F439 HydrophobicContact CG2-CD1 4.16Å; I401-F439 HydrophobicContact CG2-CE1 3.58Å; I401-F439 HydrophobicContact CG2-CE2 4.19Å; I401-F439 HydrophobicContact CG2-CZ 3.61Å; T431-F439 WeakPolarHBondContact OG1-CE1 3.35Å; G434-F439 PolarHBondContact O-N 3.21Å; F439-I461 HydrophobicContact CB-CG2 4.35Å; F439-W462 HydrophobicContact CB-CB 4.44Å; F439-W462 HydrophobicContact CB-CE3 4.08Å; F439-W462 AromaticContact CD1-CE3 3.65Å; F439-W462 HydrophobicContact CD1-CE3 3.65Å; F439-W462 AromaticContact CD1-CZ3 3.72Å; F439-W462 HydrophobicContact CD1-CZ3 3.72Å; F439-W462 HydrophobicContact CE1-CE3 4.46Å; F439-W462 HydrophobicContact CE1-CZ3 4.08Å; F439-W462 HydrophobicContact CG-CE3 4.12Å; F439-W462 WeakPolarHBondContact O-CB 3.39Å; F439-W462 PolarHBondContact O-N 3.27Å
440	A	89.8	Confident	73.4	Confident	28 Å²	28	51.3 Å²	51.3	23%	0.231	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-65.3	141.2	179.5	0	0	0	0	0	111.2	L103 A104 G438	L103-A440 WeakPolarHBondContact CA-O 3.28Å; A104-A440 HydrophobicContact CB-CB 4.06Å; A104-A440 PolarHBondContact N-O 3Å; G438-A440 PolarHBondContact O-N 3.23Å; G438-A440 VanDerWaalsContact O-N 3.11Å
441	L	87.3	Confident	70.6	Confident	31 Å²	31	59.3 Å²	59.3	16%	0.162	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-81.2	152.6	172.9	-74.3	173.5	0	0	0	111.4	G460 W462 I465	L441-G460 WeakPolarHBondContact CB-O 3.36Å; L441-G460 WeakPolarHBondContact CD1-O 3.26Å; L441-G460 VanDerWaalsContact CG-O 3.31Å; L441-G460 WeakPolarHBondContact CG-O 3.39Å; L441-G460 PolarHBondContact N-O 2.82Å; L441-W462 HydrophobicContact CD2-CB 3.73Å; L441-W462 HydrophobicContact CD2-CG 4.33Å; L441-W462 HydrophobicContact CG-CB 3.99Å; L441-I465 HydrophobicContact CD1-CD1 3.82Å
442	D	80.2	Confident	67.6	Low	40 Å²	40	64.9 Å²	64.9	21%	0.214	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-66.8	137.3	171.3	-169.1	4.6	0	0	0	110.8	K102 G444 Q445	K102-D442 HydrophobicContact CG-CB 4.48Å; K102-D442 IonicContact NZ-OD2 3.58Å; K102-D442 PolarHBondContact NZ-OD2 2.8Å; K102-D442 PolarHBondContact O-N 3.47Å; D442-G444 PolarHBondContact O-N 2.77Å; D442-G444 VanDerWaalsContact O-N 3.08Å; D442-Q445 PolarHBondContact O-N 2.91Å; D442-Q445 VanDerWaalsContact O-N 3.15Å
443	A	62.4	Low	64.9	Low	68 Å²	68	67.8 Å²	67.8	56%	0.562	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-59.3	-25.1	-176.3	0	0	0	0	0	112.8	Q445 Q446	A443-Q445 VanDerWaalsContact C-N 3.34Å; A443-Q445 PolarHBondContact O-N 2.89Å; A443-Q446 PolarHBondContact O-N 2.93Å
444	G	52.1	Low	62.1	Low	53 Å²	53	68.4 Å²	68.4	55%	0.546	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-70.9	-16.3	178.8	0	0	0	0	0	116	D442 T447	D442-G444 PolarHBondContact O-N 2.77Å; D442-G444 VanDerWaalsContact O-N 3.08Å; G444-T447 PolarHBondContact O-OG1 3.41Å
445	Q	49.7	Very low	59.4	Low	87 Å²	87	74.7 Å²	74.7	41%	0.407	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-85.5	-11.6	175.5	-82.2	-166.3	-19.4	0	0	113.5	D442 A443 T447	D442-Q445 PolarHBondContact O-N 2.91Å; D442-Q445 VanDerWaalsContact O-N 3.15Å; A443-Q445 VanDerWaalsContact C-N 3.34Å; A443-Q445 PolarHBondContact O-N 2.89Å; Q445-T447 VanDerWaalsContact C-N 3.3Å; Q445-T447 PolarHBondContact O-N 3.41Å
446	Q	47.7	Very low	56.8	Low	83 Å²	83	79.3 Å²	79.3	39%	0.388	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.2	-176.4	-65.5	-180	15.7	0	0	113.5	A443	A443-Q446 PolarHBondContact O-N 2.93Å
447	T	39.1	Very low	54.3	Low	117 Å²	117	88 Å²	88	72%	0.718	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-15.2	-171.1	43.1	0	0	0	0	115.7	G444 Q445	G444-T447 PolarHBondContact O-OG1 3.41Å; Q445-T447 VanDerWaalsContact C-N 3.3Å; Q445-T447 PolarHBondContact O-N 3.41Å
448	D	38	Very low	52	Low	157 Å²	157	90.9 Å²	90.9	84%	0.84	53%	0.534	S	S	*	.	S	Bend	trans	-92.4	-13.9	-174.7	-113.8	-6.9	0	0	0	114.1	G450	D448-G450 PolarHBondContact O-N 3.22Å
449	E	39.5	Very low	50.4	Low	170 Å²	170	97.2 Å²	97.2	79%	0.794	56%	0.561	S	S	*	*	S	Bend	trans	-96.6	61.4	172.9	-69.2	-163.3	166	0	0	112	R451	E449-R451 VanDerWaalsContact C-N 3.26Å; E449-R451 PolarHBondContact O-N 3.06Å
450	G	35.1	Very low	49.4	Very low	78 Å²	78	98.2 Å²	98.2	80%	0.804	57%	0.572	S	S	*	*			trans	44.8	31.7	151	0	0	0	0	0	119.4	D448	D448-G450 PolarHBondContact O-N 3.22Å
451	R	38.4	Very low	49.4	Very low	186 Å²	186	97.5 Å²	97.5	70%	0.702	56%	0.564	S	S	*	*			trans	-95.3	113	177.9	-104.6	172.3	162.9	169	-10.3	110.4	E449 S453	E449-R451 VanDerWaalsContact C-N 3.26Å; E449-R451 PolarHBondContact O-N 3.06Å; R451-S453 PolarHBondContact O-N 2.88Å
452	T	29.7	Very low	49.6	Very low	120 Å²	120	96.2 Å²	96.2	74%	0.736	56%	0.557	S	S	*	*			trans	-57.7	127.1	170.5	42.7	0	0	0	0	110.3	G454	T452-G454 PolarHBondContact O-N 3.14Å; T452-G454 VanDerWaalsContact O-N 3.12Å
453	S	34	Very low	50.3	Low	127 Å²	127	94.3 Å²	94.3	89%	0.888	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.1	111.6	170.9	52.5	0	0	0	0	111.7	R451	R451-S453 PolarHBondContact O-N 2.88Å
454	G	31.4	Very low	51.8	Low	78 Å²	78	91.1 Å²	91.1	80%	0.804	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.1	-7.9	170.2	0	0	0	0	0	118	T452	T452-G454 PolarHBondContact O-N 3.14Å; T452-G454 VanDerWaalsContact O-N 3.12Å
455	E	33.4	Very low	53.8	Low	133 Å²	133	91.3 Å²	91.3	62%	0.621	51%	0.508	S	S	*	.	S	Bend	trans	-117.9	116.1	178.8	-65.1	-177.2	170	0	0	110.1
456	D	37.1	Very low	55.9	Low	96 Å²	96	87.2 Å²	87.2	51%	0.513	49%	0.489	S	S	.	.			trans	23.2	108.8	166.8	-54.7	-24.5	0	0	0	116.1	K156 D458	K156-D456 IonicContact NZ-OD2 2.73Å; K156-D456 PolarHBondContact NZ-OD2 3.36Å; D456-D458 PolarHBondContact O-N 3.22Å
457	E	39.1	Very low	58.2	Low	188 Å²	188	83.2 Å²	83.2	88%	0.879	47%	0.471	S	S	*	.			trans	-59.8	67.6	170.3	-66.2	177.3	165.1	0	0	111.6	E459	E457-E459 VanDerWaalsContact C-N 3.28Å; E457-E459 PolarHBondContact O-N 3.14Å
458	D	46	Very low	60.9	Low	62 Å²	62	77.7 Å²	77.7	33%	0.332	44%	0.436	S	S	.	.			trans	-77.8	85.7	170	-120.5	-32.5	0	0	0	107.3	R198 D456 G460	R198-D458 IonicContact CZ-OD2 2.72Å; R198-D458 IonicContact NH1-OD2 3.3Å; R198-D458 PolarHBondContact NH1-OD2 3.31Å; R198-D458 IonicContact NH2-OD2 3.15Å; R198-D458 PolarHBondContact NH2-OD2 3.39Å; D456-D458 PolarHBondContact O-N 3.22Å; D458-G460 PolarHBondContact O-N 3.49Å
459	E	56.5	Low	63.6	Low	139 Å²	139	72.7 Å²	72.7	65%	0.65	41%	0.408	S	S	*	.			trans	-52.9	104.7	168.1	-70.4	-173.6	160.2	0	0	108.5	E457 I461	E457-E459 VanDerWaalsContact C-N 3.28Å; E457-E459 PolarHBondContact O-N 3.14Å; E459-I461 PolarHBondContact O-N 2.68Å
460	G	70.7	Confident	66.3	Low	21 Å²	21	64.6 Å²	64.6	22%	0.216	37%	0.37	C	S	.	.			trans	-63.8	125.9	-172.1	0	0	0	0	0	112.1	L441 D458	L441-G460 WeakPolarHBondContact CB-O 3.36Å; L441-G460 WeakPolarHBondContact CD1-O 3.26Å; L441-G460 VanDerWaalsContact CG-O 3.31Å; L441-G460 WeakPolarHBondContact CG-O 3.39Å; L441-G460 PolarHBondContact N-O 2.82Å; D458-G460 PolarHBondContact O-N 3.49Å
461	I	89.2	Confident	69.2	Low	13 Å²	13	61 Å²	61	7%	0.067	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-84.1	119.8	170.1	-65.7	167.2	0	0	0	108.5	G438 F439 E459 S463 H464 I465	G438-I461 WeakPolarHBondContact O-CG2 3.24Å; F439-I461 HydrophobicContact CB-CG2 4.35Å; E459-I461 PolarHBondContact O-N 2.68Å; I461-S463 VanDerWaalsContact C-N 3.31Å; I461-S463 VanDerWaalsContact CG2-OG 3.24Å; I461-S463 WeakPolarHBondContact CG2-OG 3.44Å; I461-S463 PolarHBondContact O-N 3.19Å; I461-H464 HydrophobicContact CB-CB 4.43Å; I461-H464 VanDerWaalsContact CD1-CE1 3.45Å; I461-H464 WeakPolarHBondContact CD1-CE1 3.44Å; I461-H464 WeakPolarHBondContact O-CB 3.3Å; I461-H464 PolarHBondContact O-N 2.84Å; I461-H464 VanDerWaalsContact O-N 3.15Å; I461-I465 PolarHBondContact O-N 3.42Å
462	W	92.9	Very high	71.8	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-42.8	-175.4	170.1	68.8	0	0	0	112.5	P78 S97 L98 A101 L103 I401 A429 T431 F439 L441 H464 I465 A466	P78-W462 HydrophobicContact CB-CH2 3.75Å; P78-W462 HydrophobicContact CB-CZ2 3.63Å; P78-W462 HydrophobicContact CG-CH2 4.35Å; P78-W462 HydrophobicContact CG-CZ2 3.72Å; S97-W462 PolarHBondContact O-NE1 3.48Å; L98-W462 HydrophobicContact CD2-CZ2 4.43Å; A101-W462 HydrophobicContact CB-CD2 4.25Å; A101-W462 HydrophobicContact CB-CG 3.94Å; L103-W462 HydrophobicContact CD2-CB 3.75Å; L103-W462 HydrophobicContact CD2-CD2 4.15Å; L103-W462 HydrophobicContact CD2-CE3 4.1Å; L103-W462 HydrophobicContact CD2-CG 4.01Å; I401-W462 HydrophobicContact CD1-CH2 4.47Å; I401-W462 HydrophobicContact CD1-CZ3 4.44Å; I401-W462 HydrophobicContact CG2-CE3 4.38Å; I401-W462 HydrophobicContact CG2-CH2 3.96Å; I401-W462 HydrophobicContact CG2-CZ3 3.44Å; I401-W462 VanDerWaalsContact CG2-CZ3 3.44Å; A429-W462 HydrophobicContact CB-CH2 4.18Å; T431-W462 HydrophobicContact CG2-CE3 4.35Å; T431-W462 HydrophobicContact CG2-CH2 3.73Å; T431-W462 HydrophobicContact CG2-CZ3 3.56Å; F439-W462 HydrophobicContact CB-CB 4.44Å; F439-W462 HydrophobicContact CB-CE3 4.08Å; F439-W462 AromaticContact CD1-CE3 3.65Å; F439-W462 HydrophobicContact CD1-CE3 3.65Å; F439-W462 AromaticContact CD1-CZ3 3.72Å; F439-W462 HydrophobicContact CD1-CZ3 3.72Å; F439-W462 HydrophobicContact CE1-CE3 4.46Å; F439-W462 HydrophobicContact CE1-CZ3 4.08Å; F439-W462 HydrophobicContact CG-CE3 4.12Å; F439-W462 WeakPolarHBondContact O-CB 3.39Å; F439-W462 PolarHBondContact O-N 3.27Å; L441-W462 HydrophobicContact CD2-CB 3.73Å; L441-W462 HydrophobicContact CD2-CG 4.33Å; L441-W462 HydrophobicContact CG-CB 3.99Å; W462-H464 PolarHBondContact O-N 2.84Å; W462-I465 PolarHBondContact O-N 2.79Å; W462-A466 HydrophobicContact CZ2-CB 4.12Å; W462-A466 WeakPolarHBondContact O-CB 3.27Å; W462-A466 PolarHBondContact O-N 2.9Å
463	S	94.3	Very high	74.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-34	-178.3	64.3	0	0	0	0	111.9	I461 V467	I461-S463 VanDerWaalsContact C-N 3.31Å; I461-S463 VanDerWaalsContact CG2-OG 3.24Å; I461-S463 WeakPolarHBondContact CG2-OG 3.44Å; I461-S463 PolarHBondContact O-N 3.19Å; S463-V467 VanDerWaalsContact O-CB 3.32Å; S463-V467 WeakPolarHBondContact O-CB 3.41Å; S463-V467 VanDerWaalsContact O-CG2 3.22Å; S463-V467 WeakPolarHBondContact O-CG2 3.18Å; S463-V467 PolarHBondContact O-N 3.39Å
464	H	94.6	Very high	77.6	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-46.1	177.7	-63.1	-175.7	0	0	0	110.8	H188 L192 I461 W462 L468	H188-H464 AromaticContact CD2-CE1 3.84Å; H188-H464 AromaticContact CD2-NE2 3.07Å; H188-H464 PolarHBondContact CD2-NE2 3.47Å; H188-H464 AromaticContact CE1-NE2 3.53Å; H188-H464 AromaticContact CG-NE2 3.78Å; H188-H464 AromaticContact NE2-CD2 3.54Å; H188-H464 AromaticContact NE2-NE2 2.88Å; H188-H464 PolarHBondContact NE2-NE2 3.19Å; H188-H464 PolarHBondContact O-CE1 2.88Å; H188-H464 VanDerWaalsContact O-CE1 3.23Å; L192-H464 HydrophobicContact CD1-CB 3.8Å; L192-H464 PolarHBondContact N-CE1 2.88Å; L192-H464 VanDerWaalsContact N-CE1 3.35Å; L192-H464 PolarHBondContact N-ND1 3.05Å; I461-H464 HydrophobicContact CB-CB 4.43Å; I461-H464 VanDerWaalsContact CD1-CE1 3.45Å; I461-H464 WeakPolarHBondContact CD1-CE1 3.44Å; I461-H464 WeakPolarHBondContact O-CB 3.3Å; I461-H464 PolarHBondContact O-N 2.84Å; I461-H464 VanDerWaalsContact O-N 3.15Å; W462-H464 PolarHBondContact O-N 2.84Å; H464-L468 WeakPolarHBondContact O-CB 3.47Å; H464-L468 VanDerWaalsContact O-CG 3.23Å; H464-L468 WeakPolarHBondContact O-CG 3.33Å; H464-L468 PolarHBondContact O-N 2.87Å
465	I	92.7	Very high	80.5	Confident	58 Å²	58	40.1 Å²	40.1	30%	0.297	20%	0.2	S	C	.	.	H	α-helix	trans	-59.5	-50.5	177	-60.7	167.2	0	0	0	109.5	L441 I461 W462 V467 L468 E469	L441-I465 HydrophobicContact CD1-CD1 3.82Å; I461-I465 PolarHBondContact O-N 3.42Å; W462-I465 PolarHBondContact O-N 2.79Å; I465-V467 PolarHBondContact O-N 3.29Å; I465-L468 PolarHBondContact O-N 3.38Å; I465-E469 VanDerWaalsContact O-CB 3.3Å; I465-E469 WeakPolarHBondContact O-CB 3.4Å; I465-E469 PolarHBondContact O-N 3.46Å
466	A	94.4	Very high	83.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-43.2	-176.9	0	0	0	0	0	113.7	S97 L98 I401 W462 F470	S97-A466 WeakPolarHBondContact OG-CA 3.14Å; S97-A466 WeakPolarHBondContact OG-CB 3.36Å; L98-A466 HydrophobicContact CD2-CB 3.97Å; I401-A466 HydrophobicContact CD1-CB 4.02Å; W462-A466 HydrophobicContact CZ2-CB 4.12Å; W462-A466 WeakPolarHBondContact O-CB 3.27Å; W462-A466 PolarHBondContact O-N 2.9Å; A466-F470 WeakPolarHBondContact O-CB 3.33Å; A466-F470 PolarHBondContact O-N 3Å
467	V	96.6	Very high	85.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.6	-45.3	178	167.5	0	0	0	0	111.4	V249 A275 I277 I401 S463 I465 F470 L471	V249-V467 HydrophobicContact CB-CG1 4.22Å; V249-V467 HydrophobicContact CG1-CG1 3.86Å; V249-V467 HydrophobicContact CG2-CG1 3.25Å; A275-V467 HydrophobicContact CB-CB 4.2Å; A275-V467 HydrophobicContact CB-CG1 3.5Å; A275-V467 VanDerWaalsContact CB-CG1 3.5Å; A275-V467 HydrophobicContact CB-CG2 3.79Å; I277-V467 HydrophobicContact CD1-CG2 4.08Å; I277-V467 HydrophobicContact CG1-CG2 3.87Å; I401-V467 HydrophobicContact CD1-CG2 3.62Å; I401-V467 HydrophobicContact CG1-CG2 4.4Å; S463-V467 VanDerWaalsContact O-CB 3.32Å; S463-V467 WeakPolarHBondContact O-CB 3.41Å; S463-V467 VanDerWaalsContact O-CG2 3.22Å; S463-V467 WeakPolarHBondContact O-CG2 3.18Å; S463-V467 PolarHBondContact O-N 3.39Å; I465-V467 PolarHBondContact O-N 3.29Å; V467-F470 PolarHBondContact O-N 3Å; V467-L471 HydrophobicContact CG1-CD1 4.02Å; V467-L471 HydrophobicContact CG1-CG 4.37Å; V467-L471 WeakPolarHBondContact O-CB 3.36Å; V467-L471 VanDerWaalsContact O-CG 3.24Å; V467-L471 WeakPolarHBondContact O-CG 3.28Å; V467-L471 PolarHBondContact O-N 3.11Å
468	L	95.2	Very high	88.2	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.6	-37.9	-178.8	-65.7	174.1	0	0	0	112.1	L175 L192 Q195 A196 F201 H464 I465 R472	L175-L468 HydrophobicContact CD2-CD2 3.97Å; L192-L468 HydrophobicContact CD1-CD1 4.13Å; L192-L468 HydrophobicContact CD1-CD2 4.38Å; L192-L468 HydrophobicContact CD1-CG 4.15Å; Q195-L468 HydrophobicContact CB-CD1 4.18Å; Q195-L468 HydrophobicContact CG-CD1 3.78Å; A196-L468 HydrophobicContact CB-CD1 4.2Å; A196-L468 HydrophobicContact CB-CD2 3.88Å; F201-L468 HydrophobicContact CD2-CD2 4.38Å; F201-L468 HydrophobicContact CE2-CD2 4.11Å; H464-L468 WeakPolarHBondContact O-CB 3.47Å; H464-L468 VanDerWaalsContact O-CG 3.23Å; H464-L468 WeakPolarHBondContact O-CG 3.33Å; H464-L468 PolarHBondContact O-N 2.87Å; I465-L468 PolarHBondContact O-N 3.38Å; L468-R472 WeakPolarHBondContact O-CD 3.34Å; L468-R472 WeakPolarHBondContact O-CG 3.46Å; L468-R472 PolarHBondContact O-N 2.96Å
469	E	94.4	Very high	90.2	Very high	53 Å²	53	24.2 Å²	24.2	25%	0.248	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-49.8	172.2	-170.6	-179.7	-142.8	0	0	110.9	C95 G96 S97 I465 L471 R472 V473	C95-E469 VanDerWaalsContact CA-CD 3.49Å; C95-E469 WeakPolarHBondContact CA-OE2 3.31Å; C95-E469 HydrophobicContact CB-CG 4.36Å; G96-E469 PolarHBondContact N-OE1 2.81Å; G96-E469 PolarHBondContact N-OE2 3.36Å; S97-E469 VanDerWaalsContact CB-OE2 3.27Å; S97-E469 WeakPolarHBondContact CB-OE2 3.45Å; S97-E469 PolarHBondContact N-OE2 2.89Å; S97-E469 PolarHBondContact OG-OE2 3.45Å; I465-E469 VanDerWaalsContact O-CB 3.3Å; I465-E469 WeakPolarHBondContact O-CB 3.4Å; I465-E469 PolarHBondContact O-N 3.46Å; E469-L471 PolarHBondContact O-N 3.47Å; E469-R472 PolarHBondContact O-N 3.24Å; E469-V473 HydrophobicContact CG-CG2 4.28Å; E469-V473 WeakPolarHBondContact O-CG2 3.47Å; E469-V473 PolarHBondContact O-N 3.46Å
470	F	96.5	Very high	91.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-54.4	-48.8	177.1	165.1	-98	0	0	0	112.3	L91 A273 A274 A275 P397 L399 L427 A466 V467 R472 V473 A474	L91-F470 HydrophobicContact CD1-CD2 4.02Å; L91-F470 HydrophobicContact CD1-CE2 3.73Å; L91-F470 HydrophobicContact CD2-CD2 3.8Å; L91-F470 HydrophobicContact CD2-CE2 4.16Å; A273-F470 HydrophobicContact CB-CE1 4.37Å; A274-F470 VanDerWaalsContact O-CE1 3.3Å; A274-F470 WeakPolarHBondContact O-CE1 3.36Å; A275-F470 HydrophobicContact CB-CD1 4.38Å; P397-F470 HydrophobicContact CB-CE2 4.43Å; P397-F470 HydrophobicContact CB-CZ 3.79Å; L399-F470 HydrophobicContact CB-CD1 3.65Å; L399-F470 HydrophobicContact CB-CD2 3.99Å; L399-F470 HydrophobicContact CB-CE1 3.58Å; L399-F470 HydrophobicContact CB-CE2 3.91Å; L399-F470 HydrophobicContact CB-CG 3.86Å; L399-F470 HydrophobicContact CB-CZ 3.7Å; L399-F470 HydrophobicContact CD2-CB 3.68Å; L399-F470 HydrophobicContact CD2-CD1 4.04Å; L399-F470 HydrophobicContact CD2-CD2 4.1Å; L399-F470 HydrophobicContact CD2-CG 3.66Å; L399-F470 HydrophobicContact CG-CG 4.36Å; L427-F470 HydrophobicContact CD1-CE2 4.18Å; A466-F470 WeakPolarHBondContact O-CB 3.33Å; A466-F470 PolarHBondContact O-N 3Å; V467-F470 PolarHBondContact O-N 3Å; F470-R472 VanDerWaalsContact C-N 3.27Å; F470-R472 PolarHBondContact O-N 2.92Å; F470-V473 PolarHBondContact O-N 3.39Å; F470-A474 HydrophobicContact CE2-CB 4.2Å; F470-A474 HydrophobicContact CZ-CB 4.23Å; F470-A474 WeakPolarHBondContact O-CB 3.3Å; F470-A474 PolarHBondContact O-N 2.98Å
471	L	96	Very high	92.1	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-35.5	-177.7	-71.9	176.6	0	0	0	112.5	L175 V247 V249 A273 V467 E469 S475	L175-L471 HydrophobicContact CD1-CD1 4.01Å; V247-L471 HydrophobicContact CB-CD1 4.07Å; V247-L471 HydrophobicContact CB-CD2 3.96Å; V247-L471 HydrophobicContact CB-CG 4.43Å; V247-L471 HydrophobicContact CG1-CB 4.47Å; V247-L471 HydrophobicContact CG1-CD2 4.13Å; V247-L471 HydrophobicContact CG2-CD1 3.97Å; V249-L471 HydrophobicContact CG2-CD1 3.53Å; A273-L471 HydrophobicContact CB-CD2 3.79Å; V467-L471 HydrophobicContact CG1-CD1 4.02Å; V467-L471 HydrophobicContact CG1-CG 4.37Å; V467-L471 WeakPolarHBondContact O-CB 3.36Å; V467-L471 VanDerWaalsContact O-CG 3.24Å; V467-L471 WeakPolarHBondContact O-CG 3.28Å; V467-L471 PolarHBondContact O-N 3.11Å; E469-L471 PolarHBondContact O-N 3.47Å; L471-S475 VanDerWaalsContact O-CB 3.23Å; L471-S475 WeakPolarHBondContact O-CB 3.47Å; L471-S475 PolarHBondContact O-N 3.49Å; L471-S475 PolarHBondContact O-OG 2.92Å
472	R	92.2	Very high	91.8	Very high	47 Å²	47	25 Å²	25	18%	0.177	13%	0.125	C	C	.	.	H	α-helix	trans	-67.9	-56.1	175	-71.5	167.2	168.9	179.8	-11.7	110.9	L165 Q199 F201 L468 E469 F470 A474 S475 D476	L165-R472 PolarHBondContact O-NH2 2.83Å; Q199-R472 VanDerWaalsContact CG-NH2 3.27Å; Q199-R472 PolarHBondContact O-NH2 2.84Å; Q199-R472 VanDerWaalsContact O-NH2 3.08Å; Q199-R472 VanDerWaalsContact OE1-NH2 3.1Å; F201-R472 HydrophobicContact CE2-CG 4.47Å; F201-R472 HydrophobicContact CZ-CG 3.95Å; L468-R472 WeakPolarHBondContact O-CD 3.34Å; L468-R472 WeakPolarHBondContact O-CG 3.46Å; L468-R472 PolarHBondContact O-N 2.96Å; E469-R472 PolarHBondContact O-N 3.24Å; F470-R472 VanDerWaalsContact C-N 3.27Å; F470-R472 PolarHBondContact O-N 2.92Å; R472-A474 PolarHBondContact O-N 3.28Å; R472-S475 WeakPolarHBondContact O-CB 3.22Å; R472-S475 PolarHBondContact O-N 2.85Å; R472-S475 VanDerWaalsContact O-N 3.12Å; R472-D476 PolarHBondContact O-N 3.49Å
473	V	93.6	Very high	91.2	Very high	18 Å²	18	33.2 Å²	33.2	11%	0.109	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-43.4	-175.9	176.7	0	0	0	0	111.3	Y90 L91 H94 E469 F470 S475 D476 F477	Y90-V473 HydrophobicContact CD1-CG1 3.66Å; Y90-V473 HydrophobicContact CE1-CG1 3.55Å; L91-V473 HydrophobicContact CD2-CB 4.15Å; L91-V473 HydrophobicContact CD2-CG1 3.77Å; H94-V473 HydrophobicContact CB-CG1 3.57Å; H94-V473 HydrophobicContact CB-CG2 4.16Å; E469-V473 HydrophobicContact CG-CG2 4.28Å; E469-V473 WeakPolarHBondContact O-CG2 3.47Å; E469-V473 PolarHBondContact O-N 3.46Å; F470-V473 PolarHBondContact O-N 3.39Å; V473-S475 VanDerWaalsContact C-N 3.34Å; V473-S475 PolarHBondContact O-N 3.41Å; V473-D476 PolarHBondContact O-N 3.01Å; V473-F477 PolarHBondContact O-N 2.92Å
474	A	93.8	Very high	90.5	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-39.7	176	0	0	0	0	0	112.1	L91 A273 P397 F470 R472 D476 L478	L91-A474 HydrophobicContact CD2-CB 4.44Å; A273-A474 HydrophobicContact CB-CB 4.19Å; P397-A474 HydrophobicContact CB-CB 4.37Å; P397-A474 HydrophobicContact CG-CB 4.45Å; F470-A474 HydrophobicContact CE2-CB 4.2Å; F470-A474 HydrophobicContact CZ-CB 4.23Å; F470-A474 WeakPolarHBondContact O-CB 3.3Å; F470-A474 PolarHBondContact O-N 2.98Å; R472-A474 PolarHBondContact O-N 3.28Å; A474-D476 VanDerWaalsContact C-N 3.33Å; A474-L478 WeakPolarHBondContact O-CG 3.42Å; A474-L478 PolarHBondContact O-N 3.22Å; A474-L478 VanDerWaalsContact O-N 3.16Å
475	S	91.8	Very high	89.5	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.063	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-38	176.2	-65.3	0	0	0	0	112	L471 R472 V473 L478 K479	L471-S475 VanDerWaalsContact O-CB 3.23Å; L471-S475 WeakPolarHBondContact O-CB 3.47Å; L471-S475 PolarHBondContact O-N 3.49Å; L471-S475 PolarHBondContact O-OG 2.92Å; R472-S475 WeakPolarHBondContact O-CB 3.22Å; R472-S475 PolarHBondContact O-N 2.85Å; R472-S475 VanDerWaalsContact O-N 3.12Å; V473-S475 VanDerWaalsContact C-N 3.34Å; V473-S475 PolarHBondContact O-N 3.41Å; S475-L478 PolarHBondContact O-N 3.18Å; S475-K479 VanDerWaalsContact O-CG 3.28Å; S475-K479 WeakPolarHBondContact O-CG 3.44Å; S475-K479 PolarHBondContact O-N 3.39Å
476	D	89.8	Confident	88.7	Confident	44 Å²	44	49.6 Å²	49.6	24%	0.235	23%	0.226	C	C	.	.	H	α-helix	trans	-72.2	-42.3	180	-69.2	-21	0	0	0	111.9	R472 V473 A474 L478 K479 E480	R472-D476 PolarHBondContact O-N 3.49Å; V473-D476 PolarHBondContact O-N 3.01Å; A474-D476 VanDerWaalsContact C-N 3.33Å; D476-L478 VanDerWaalsContact C-N 3.29Å; D476-L478 PolarHBondContact O-N 2.92Å; D476-K479 PolarHBondContact O-N 2.98Å; D476-K479 VanDerWaalsContact O-N 3.14Å; D476-K479 IonicContact OD1-NZ 2.9Å; D476-K479 PolarHBondContact OD1-NZ 3.11Å; D476-E480 WeakPolarHBondContact O-CG 3.44Å; D476-E480 PolarHBondContact O-N 3.37Å
477	F	92	Very high	87.8	Confident	26 Å²	26	53.1 Å²	53.1	11%	0.114	25%	0.25	C	S	.	.	H	α-helix	trans	-52.8	-46.5	170.7	176.5	-97.7	0	0	0	112.2	A86 L87 Y90 V473 E480 A481 W541	A86-F477 HydrophobicContact CB-CE2 4.45Å; A86-F477 HydrophobicContact CB-CZ 4.12Å; L87-F477 HydrophobicContact CB-CD1 4.36Å; L87-F477 HydrophobicContact CB-CE1 3.95Å; L87-F477 HydrophobicContact CB-CZ 4.22Å; L87-F477 HydrophobicContact CD1-CB 4.26Å; L87-F477 HydrophobicContact CD1-CD1 3.54Å; L87-F477 HydrophobicContact CD1-CE1 4.01Å; L87-F477 HydrophobicContact CD1-CG 3.9Å; Y90-F477 HydrophobicContact CD1-CB 3.79Å; Y90-F477 AromaticContact CD1-CD2 3.9Å; Y90-F477 HydrophobicContact CD1-CD2 3.9Å; Y90-F477 HydrophobicContact CD1-CG 4.21Å; Y90-F477 AromaticContact CD2-CD2 3.85Å; Y90-F477 HydrophobicContact CD2-CD2 3.85Å; Y90-F477 HydrophobicContact CE1-CB 3.76Å; Y90-F477 HydrophobicContact CE1-CD2 4.37Å; Y90-F477 HydrophobicContact CE2-CD2 4.31Å; Y90-F477 HydrophobicContact CG-CB 4.38Å; Y90-F477 AromaticContact CG-CD2 3.6Å; Y90-F477 HydrophobicContact CG-CD2 3.6Å; Y90-F477 HydrophobicContact CG-CE2 4.35Å; Y90-F477 HydrophobicContact CG-CG 4.35Å; V473-F477 PolarHBondContact O-N 2.92Å; F477-E480 PolarHBondContact O-N 3.05Å; F477-A481 WeakPolarHBondContact O-CB 3.36Å; F477-A481 PolarHBondContact O-N 2.84Å; F477-W541 HydrophobicContact CE1-CD2 4.26Å; F477-W541 HydrophobicContact CE1-CG 4.39Å; F477-W541 AromaticContact CE1-NE1 3.94Å
478	L	90	Very high	86.7	Confident	20 Å²	20	62 Å²	62	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-68.5	-36.9	180	-69.4	174.6	0	0	0	112.5	T272 P397 A474 S475 D476 E482 W541	T272-L478 HydrophobicContact CG2-CD1 3.8Å; T272-L478 WeakPolarHBondContact O-CD1 3.36Å; P397-L478 HydrophobicContact CG-CD1 4.15Å; A474-L478 WeakPolarHBondContact O-CG 3.42Å; A474-L478 PolarHBondContact O-N 3.22Å; A474-L478 VanDerWaalsContact O-N 3.16Å; S475-L478 PolarHBondContact O-N 3.18Å; D476-L478 VanDerWaalsContact C-N 3.29Å; D476-L478 PolarHBondContact O-N 2.92Å; L478-E482 WeakPolarHBondContact O-CG 3.44Å; L478-E482 PolarHBondContact O-N 3.38Å; L478-W541 HydrophobicContact CD2-CE3 3.74Å; L478-W541 HydrophobicContact CD2-CZ3 3.8Å
479	K	86.5	Confident	85.4	Confident	54 Å²	54	68.5 Å²	68.5	24%	0.235	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-40.4	174.6	-72.8	170.5	-163.3	158	0	111.8	S475 D476 E482 R483	S475-K479 VanDerWaalsContact O-CG 3.28Å; S475-K479 WeakPolarHBondContact O-CG 3.44Å; S475-K479 PolarHBondContact O-N 3.39Å; D476-K479 PolarHBondContact O-N 2.98Å; D476-K479 VanDerWaalsContact O-N 3.14Å; D476-K479 IonicContact OD1-NZ 2.9Å; D476-K479 PolarHBondContact OD1-NZ 3.11Å; K479-E482 PolarHBondContact O-N 2.9Å; K479-R483 WeakPolarHBondContact O-CG 3.36Å; K479-R483 PolarHBondContact O-N 2.86Å
480	E	85.3	Confident	84	Confident	90 Å²	90	67.5 Å²	67.5	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-49.3	176.4	-73.7	177.2	177	0	0	110.6	Y90 D476 F477 E482 R483 D484	Y90-E480 PolarHBondContact OH-OE2 3.47Å; D476-E480 WeakPolarHBondContact O-CG 3.44Å; D476-E480 PolarHBondContact O-N 3.37Å; F477-E480 PolarHBondContact O-N 3.05Å; E480-E482 VanDerWaalsContact C-N 3.29Å; E480-E482 PolarHBondContact O-N 3.4Å; E480-R483 WeakPolarHBondContact O-CB 3.38Å; E480-R483 PolarHBondContact O-N 2.86Å; E480-D484 PolarHBondContact O-N 2.99Å
481	A	82.3	Confident	82.1	Confident	38 Å²	38	72.9 Å²	72.9	31%	0.314	34%	0.337	S	S	.	.	H	α-helix	trans	-57.9	-39.1	176.1	0	0	0	0	0	112.9	F477 W485	F477-A481 WeakPolarHBondContact O-CB 3.36Å; F477-A481 PolarHBondContact O-N 2.84Å; A481-W485 WeakPolarHBondContact O-CB 3.24Å; A481-W485 PolarHBondContact O-N 3.48Å
482	E	82.4	Confident	80.2	Confident	62 Å²	62	80 Å²	80	29%	0.29	37%	0.371	S	S	.	.	H	α-helix	trans	-66.7	-37.2	174.8	-79.8	-174.5	-160.3	0	0	113.2	L478 K479 E480 K486 R543 Y545	L478-E482 WeakPolarHBondContact O-CG 3.44Å; L478-E482 PolarHBondContact O-N 3.38Å; K479-E482 PolarHBondContact O-N 2.9Å; E480-E482 VanDerWaalsContact C-N 3.29Å; E480-E482 PolarHBondContact O-N 3.4Å; E482-K486 WeakPolarHBondContact O-CB 3.39Å; E482-K486 VanDerWaalsContact O-CG 3.29Å; E482-K486 WeakPolarHBondContact O-CG 3.32Å; E482-K486 PolarHBondContact O-N 3.26Å; E482-K486 IonicContact OE2-NZ 3.89Å; E482-R543 IonicContact OE1-NH1 3.34Å; E482-R543 PolarHBondContact OE1-NH1 3.26Å; E482-Y545 PolarHBondContact OE1-OH 3.48Å
483	R	81.8	Confident	78.4	Confident	176 Å²	176	83.8 Å²	83.8	66%	0.664	39%	0.39	S	S	*	.	H	α-helix	trans	-67.5	-45.3	177.1	-75.8	172.3	176.7	-178.9	0.4	110.9	K479 E480 K486 S487	K479-R483 WeakPolarHBondContact O-CG 3.36Å; K479-R483 PolarHBondContact O-N 2.86Å; E480-R483 WeakPolarHBondContact O-CB 3.38Å; E480-R483 PolarHBondContact O-N 2.86Å; R483-K486 PolarHBondContact O-N 3.42Å; R483-S487 WeakPolarHBondContact O-CB 3.48Å; R483-S487 PolarHBondContact O-N 3.22Å
484	D	79.3	Confident	76.6	Confident	100 Å²	100	87.9 Å²	87.9	54%	0.535	42%	0.415	S	S	.	.	H	α-helix	trans	-59.8	-49.5	176.2	-72.6	-9.6	0	0	0	110	E480 K486 S487 W488	E480-D484 PolarHBondContact O-N 2.99Å; D484-K486 VanDerWaalsContact C-N 3.33Å; D484-K486 PolarHBondContact O-N 3.15Å; D484-S487 WeakPolarHBondContact O-CB 3.45Å; D484-S487 PolarHBondContact O-N 3.18Å; D484-S487 VanDerWaalsContact O-N 3.1Å; D484-W488 PolarHBondContact O-N 3.24Å
485	W	73.2	Confident	74.4	Confident	167 Å²	167	92.9 Å²	92.9	63%	0.633	44%	0.442	S	S	*	.	H	α-helix	trans	-56.9	-42.7	176.9	179.2	-105.8	0	0	0	113.5	A481 W488 R489	A481-W485 WeakPolarHBondContact O-CB 3.24Å; A481-W485 PolarHBondContact O-N 3.48Å; W485-W488 PolarHBondContact O-N 2.93Å; W485-R489 PolarHBondContact O-N 3.43Å
486	K	75.8	Confident	72.1	Confident	137 Å²	137	94.7 Å²	94.7	60%	0.596	46%	0.462	S	S	*	.	H	α-helix	trans	-65.6	-40.2	176.2	-75.4	169.2	-176.1	162.2	0	111.9	E482 R483 D484 R489 G490	E482-K486 WeakPolarHBondContact O-CB 3.39Å; E482-K486 VanDerWaalsContact O-CG 3.29Å; E482-K486 WeakPolarHBondContact O-CG 3.32Å; E482-K486 PolarHBondContact O-N 3.26Å; E482-K486 IonicContact OE2-NZ 3.89Å; R483-K486 PolarHBondContact O-N 3.42Å; D484-K486 VanDerWaalsContact C-N 3.33Å; D484-K486 PolarHBondContact O-N 3.15Å; K486-R489 PolarHBondContact O-N 2.87Å; K486-G490 PolarHBondContact O-N 3.39Å
487	S	74.9	Confident	70	Confident	74 Å²	74	98.9 Å²	98.9	52%	0.517	49%	0.489	S	S	.	.	H	α-helix	trans	-60.1	-50.1	174.7	-174.5	0	0	0	0	111	R483 D484 R489 G490 Q491	R483-S487 WeakPolarHBondContact O-CB 3.48Å; R483-S487 PolarHBondContact O-N 3.22Å; D484-S487 WeakPolarHBondContact O-CB 3.45Å; D484-S487 PolarHBondContact O-N 3.18Å; D484-S487 VanDerWaalsContact O-N 3.1Å; S487-R489 PolarHBondContact O-N 2.86Å; S487-G490 PolarHBondContact O-N 3.34Å; S487-Q491 WeakPolarHBondContact O-CB 3.32Å; S487-Q491 PolarHBondContact O-N 2.93Å
488	W	74	Confident	67.5	Low	187 Å²	187	109 Å²	109	71%	0.708	53%	0.526	S	S	*	.	H	α-helix	trans	-58.3	-46.1	176.8	-85.3	85.2	0	0	0	112.6	D484 W485 Q491 Q492	D484-W488 PolarHBondContact O-N 3.24Å; W485-W488 PolarHBondContact O-N 2.93Å; W488-Q491 PolarHBondContact O-N 3.44Å; W488-Q492 PolarHBondContact O-N 2.96Å
489	R	67.4	Low	65.2	Low	136 Å²	136	110 Å²	110	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-44.1	176	-174.8	-171.6	-76.4	-133.7	-0.3	111.8	W485 K486 S487 Q491 Q492 E493	W485-R489 PolarHBondContact O-N 3.43Å; K486-R489 PolarHBondContact O-N 2.87Å; S487-R489 PolarHBondContact O-N 2.86Å; R489-Q491 VanDerWaalsContact C-N 3.27Å; R489-Q491 PolarHBondContact O-N 2.85Å; R489-Q492 PolarHBondContact O-N 2.92Å; R489-Q492 VanDerWaalsContact O-N 3.13Å; R489-E493 PolarHBondContact O-N 3.38Å
490	G	65.1	Low	62.8	Low	31 Å²	31	116.3 Å²	116.3	32%	0.32	57%	0.572	S	S	.	*	H	α-helix	trans	-60.1	-39.4	177	0	0	0	0	0	111.9	K486 S487 E493 V494	K486-G490 PolarHBondContact O-N 3.39Å; S487-G490 PolarHBondContact O-N 3.34Å; G490-E493 PolarHBondContact O-N 2.88Å; G490-V494 WeakPolarHBondContact O-CB 3.35Å; G490-V494 WeakPolarHBondContact O-CG2 3.4Å; G490-V494 PolarHBondContact O-N 2.94Å
491	Q	57.4	Low	60.2	Low	113 Å²	113	122.9 Å²	122.9	53%	0.528	60%	0.599	S	S	.	*	H	α-helix	trans	-69	-33.5	175.9	-153.3	169.8	-0.3	0	0	112.2	S487 W488 R489 N495	S487-Q491 WeakPolarHBondContact O-CB 3.32Å; S487-Q491 PolarHBondContact O-N 2.93Å; W488-Q491 PolarHBondContact O-N 3.44Å; R489-Q491 VanDerWaalsContact C-N 3.27Å; R489-Q491 PolarHBondContact O-N 2.85Å; Q491-N495 VanDerWaalsContact O-CB 3.25Å; Q491-N495 WeakPolarHBondContact O-CB 3.5Å; Q491-N495 VanDerWaalsContact O-CG 3.28Å; Q491-N495 PolarHBondContact O-N 3.23Å; Q491-N495 PolarHBondContact O-ND2 2.97Å
492	Q	55.7	Low	57.8	Low	152 Å²	152	125.4 Å²	125.4	71%	0.71	62%	0.615	S	S	*	*	H	α-helix	trans	-72.7	-35.2	174.4	-161.4	171.4	16.4	0	0	112.8	W488 R489 G496	W488-Q492 PolarHBondContact O-N 2.96Å; R489-Q492 PolarHBondContact O-N 2.92Å; R489-Q492 VanDerWaalsContact O-N 3.13Å; Q492-G496 WeakPolarHBondContact O-CA 3.42Å; Q492-G496 PolarHBondContact O-N 3.5Å
493	E	55.2	Low	55.6	Low	126 Å²	126	131.9 Å²	131.9	59%	0.589	64%	0.642	S	S	*	*	H	α-helix	trans	-70	-41.8	171.8	-77.2	179.6	-179.7	0	0	111.5	R489 G490 N495 G496 V497	R489-E493 PolarHBondContact O-N 3.38Å; G490-E493 PolarHBondContact O-N 2.88Å; E493-N495 PolarHBondContact O-N 3.35Å; E493-G496 PolarHBondContact O-N 2.99Å; E493-V497 WeakPolarHBondContact O-CG2 3.41Å; E493-V497 PolarHBondContact O-N 2.89Å
494	V	54.3	Low	53.1	Low	103 Å²	103	131.8 Å²	131.8	62%	0.624	65%	0.651	S	S	*	*	H	α-helix	trans	-64.6	-39.3	175.5	172.3	0	0	0	0	111.6	G490	G490-V494 WeakPolarHBondContact O-CB 3.35Å; G490-V494 WeakPolarHBondContact O-CG2 3.4Å; G490-V494 PolarHBondContact O-N 2.94Å
495	N	49.1	Very low	50.7	Low	106 Å²	106	134.4 Å²	134.4	57%	0.567	67%	0.665	S	S	*	*	H	α-helix	trans	-76.7	-26.1	174.6	-73.4	-20.5	0	0	0	112.9	Q491 E493 R498	Q491-N495 VanDerWaalsContact O-CB 3.25Å; Q491-N495 WeakPolarHBondContact O-CB 3.5Å; Q491-N495 VanDerWaalsContact O-CG 3.28Å; Q491-N495 PolarHBondContact O-N 3.23Å; Q491-N495 PolarHBondContact O-ND2 2.97Å; E493-N495 PolarHBondContact O-N 3.35Å; N495-R498 PolarHBondContact O-N 3.45Å
496	G	43.1	Very low	48.7	Very low	47 Å²	47	131.6 Å²	131.6	49%	0.485	68%	0.678	S	S	.	*	H	α-helix	trans	-72.8	-25.3	173.8	0	0	0	0	0	113.9	Q492 E493 R498	Q492-G496 WeakPolarHBondContact O-CA 3.42Å; Q492-G496 PolarHBondContact O-N 3.5Å; E493-G496 PolarHBondContact O-N 2.99Å; G496-R498 VanDerWaalsContact C-N 3.31Å
497	V	44.9	Very low	46.4	Very low	131 Å²	131	129.9 Å²	129.9	79%	0.794	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-14.1	173.8	175.5	0	0	0	0	112.5	E493	E493-V497 WeakPolarHBondContact O-CG2 3.41Å; E493-V497 PolarHBondContact O-N 2.89Å
498	R	39.3	Very low	44.1	Very low	238 Å²	238	131 Å²	131	90%	0.898	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-0.9	173	-88.4	-174.9	177.5	-161.3	0.2	114.8	N495 G496	N495-R498 PolarHBondContact O-N 3.45Å; G496-R498 VanDerWaalsContact C-N 3.31Å
499	G	41.5	Very low	41.8	Very low	43 Å²	43	131 Å²	131	44%	0.443	71%	0.712	S	S	.	*	S	Bend	trans	-121.2	119.2	178.4	0	0	0	0	0	112.6
500	Q	36.6	Very low	39.8	Very low	186 Å²	186	129.3 Å²	129.3	87%	0.869	72%	0.722	S	S	*	*			trans	81.8	73.9	166.9	-60.4	179.7	-41.4	0	0	118.1	S502	Q500-S502 PolarHBondContact O-N 3.23Å
501	K	32	Very low	38.3	Very low	227 Å²	227	139.5 Å²	139.5	99%	0.987	75%	0.751	S	S	*	*				-76.6	83.2	126.7	-82.1	-176	178.8	175.9	0	108.2
502	S	32	Very low	36.8	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	77%	0.766	S	S	*	*			trans	-123.5	116.5	160.4	-175.1	0	0	0	0	108.2	Q500 M504	Q500-S502 PolarHBondContact O-N 3.23Å; S502-M504 PolarHBondContact O-N 3.23Å
503	K	34.7	Very low	35.7	Very low	198 Å²	198	149.4 Å²	149.4	86%	0.861	78%	0.777	S	S	*	*			trans	-55.3	129.8	171.6	-74.7	170.2	170.8	174.2	0	109.1
504	M	29.5	Very low	34.4	Very low	174 Å²	174	154.4 Å²	154.4	86%	0.857	79%	0.79	S	S	*	*			trans	-165.9	110.7	139.2	-105.1	161.3	82.5	0	0	111.9	S502	S502-M504 PolarHBondContact O-N 3.23Å
505	N	28.5	Very low	33.1	Very low	155 Å²	155	152.8 Å²	152.8	83%	0.829	79%	0.794	S	S	*	*			trans	42.5	112.7	144.9	-63.3	-11.5	0	0	0	120.7	A507	N505-A507 PolarHBondContact O-N 3.18Å
506	A	30.9	Very low	32	Very low	108 Å²	108	153 Å²	153	89%	0.893	81%	0.811	S	S	*	*			trans	-58	123.6	152.8	0	0	0	0	0	111.2
507	A	27.5	Very low	31.2	Very low	100 Å²	100	157.1 Å²	157.1	83%	0.826	83%	0.826	S	S	*	*			trans	-139.8	104.7	150.6	0	0	0	0	0	107.3	N505	N505-A507 PolarHBondContact O-N 3.18Å
508	A	28.3	Very low	30.3	Very low	97 Å²	97	159.9 Å²	159.9	80%	0.802	83%	0.833	S	S	*	*			trans	-65.4	137.7	167.2	0	0	0	0	0	109.3
509	M	25.6	Very low	29.8	Very low	187 Å²	187	158.5 Å²	158.5	92%	0.921	83%	0.833	S	S	*	*			trans	-167.6	125.3	137.6	-106.7	-163.9	174.9	0	0	114.1
510	S	25.8	Very low	29	Very low	102 Å²	102	168 Å²	168	71%	0.713	86%	0.856	S	S	*	*			trans	70.3	104.7	130	-172.1	0	0	0	0	120.9	R512	S510-R512 PolarHBondContact O-N 3.35Å
511	R	32.3	Very low	28.4	Very low	245 Å²	245	164.8 Å²	164.8	93%	0.925	85%	0.854	S	S	*	*			trans	-34.4	130.1	146	-81.8	174.5	167.2	168.7	-4.1	112.6
512	R	26.5	Very low	28.1	Very low	223 Å²	223	165 Å²	165	84%	0.842	85%	0.849	S	S	*	*			trans	-149.5	118.7	147.2	-141.2	172.9	-175.7	-177.7	0.8	112.6	S510	S510-R512 PolarHBondContact O-N 3.35Å
513	R	31.4	Very low	28.1	Very low	250 Å²	250	165.5 Å²	165.5	94%	0.943	85%	0.85	S	S	*	*			trans	-59.9	128.5	171.1	-152.7	178.8	-169.1	-172.2	2.7	110
514	R	29.5	Very low	27.7	Very low	231 Å²	231	164.7 Å²	164.7	87%	0.872	85%	0.849	S	S	*	*			trans	-141.1	123.5	159.4	-70	-175.2	-175	176.2	1.9	104.9
515	G	26.1	Very low	27.6	Very low	68 Å²	68	162 Å²	162	70%	0.701	85%	0.845	S	S	*	*			cis	106.8	69.4	42.2	0	0	0	0	0	106.9	T517	G515-T517 PolarHBondContact O-N 3.45Å
516	A	25.3	Very low	27.4	Very low	112 Å²	112	159.6 Å²	159.6	93%	0.926	85%	0.847	S	S	*	*			trans	-66.9	119.8	-179.2	0	0	0	0	0	109.6
517	T	27	Very low	27	Very low	132 Å²	132	157.9 Å²	157.9	81%	0.81	84%	0.839	S	S	*	*			trans	-122.4	112.7	169.7	-42.7	0	0	0	0	107.5	G515	G515-T517 PolarHBondContact O-N 3.45Å
518	M	27.1	Very low	26.8	Very low	190 Å²	190	162 Å²	162	94%	0.936	84%	0.841	S	S	*	*			trans	-56.5	135.6	168.9	-80.1	177.8	164.1	0	0	110.2
519	K	27.1	Very low	26.6	Very low	208 Å²	208	163 Å²	163	90%	0.904	84%	0.843	S	S	*	*			trans	-126	116.9	156.3	-110.2	-176.5	178.5	-177.8	0	109.8
520	R	25.5	Very low	26.5	Very low	242 Å²	242	157.4 Å²	157.4	91%	0.913	83%	0.833	S	S	*	*			trans	-76.9	139.2	173.5	-167.6	-179.7	-171.8	176.7	3.3	108.8
521	S	24.9	Very low	26.9	Very low	119 Å²	119	159 Å²	159	83%	0.832	84%	0.838	S	S	*	*			trans	-129.8	136.7	165.8	47.8	0	0	0	0	110.8
522	R	24.3	Very low	26.7	Very low	232 Å²	232	154.3 Å²	154.3	88%	0.875	83%	0.831	S	S	*	*			trans	-129.3	171	175.7	-140.1	-158.6	167.5	161.3	-3.4	106.8
523	P	33.4	Very low	26.8	Very low	103 Å²	103	151.2 Å²	151.2	67%	0.669	83%	0.831	S	S	*	*				-122.5	-178.5	-99.9	38.8	-21.9	0	0	0	114.8
524	Q	24.6	Very low	26.9	Very low	180 Å²	180	146 Å²	146	84%	0.841	83%	0.827	S	S	*	*			trans	104.7	158.7	158.1	-68.3	-158.5	-11	0	0	118.6
525	P	29	Very low	27	Very low	118 Å²	118	142.4 Å²	142.4	77%	0.766	83%	0.825	S	S	*	*			cis	-130.1	-177.4	-18.1	24.2	-0.1	0	0	0	114.4
526	A	23.6	Very low	27.3	Very low	105 Å²	105	142.7 Å²	142.7	87%	0.868	83%	0.828	S	S	*	*			trans	-68.4	151.3	-175.3	0	0	0	0	0	116.5
527	G	23.1	Very low	27.5	Very low	72 Å²	72	144.8 Å²	144.8	74%	0.742	82%	0.824	S	S	*	*			trans	170	96.2	164.3	0	0	0	0	0	115.4
528	Q	22.8	Very low	28	Very low	185 Å²	185	143 Å²	143	86%	0.864	81%	0.814	S	S	*	*			trans	57.8	122.8	143.5	-64.9	178.4	2.5	0	0	122.9
529	S	24.8	Very low	28.7	Very low	120 Å²	120	138 Å²	138	84%	0.839	79%	0.787	S	S	*	*			trans	55.5	114.4	138.1	65.5	0	0	0	0	120.6
530	G	23.4	Very low	29.2	Very low	68 Å²	68	132.4 Å²	132.4	70%	0.701	77%	0.771	S	S	*	*			trans	-170.3	108.4	157	0	0	0	0	0	109	D532	G530-D532 PolarHBondContact O-N 3Å
531	V	34	Very low	30.2	Very low	137 Å²	137	123.5 Å²	123.5	83%	0.83	74%	0.737	S	S	*	*			trans	-66.9	114.9	165.3	171.8	0	0	0	0	105.9
532	D	27.3	Very low	31.2	Very low	145 Å²	145	125.3 Å²	125.3	78%	0.775	73%	0.73	S	S	*	*			trans	-131.5	114	165.7	-82.1	-40.1	0	0	0	108.5	G530 V534	G530-D532 PolarHBondContact O-N 3Å; D532-V534 PolarHBondContact O-N 3.42Å
533	D	29.2	Very low	32.1	Very low	158 Å²	158	118 Å²	118	85%	0.845	70%	0.702	S	S	*	*			trans	-50.2	117.3	166	-78.1	-55.8	0	0	0	109.7	D535	D533-D535 PolarHBondContact O-N 3.41Å
534	V	32.6	Very low	32.2	Very low	142 Å²	142	116.4 Å²	116.4	86%	0.861	69%	0.694	S	S	*	*			trans	-87.1	99.6	170.6	-179.8	0	0	0	0	107.8	D532 G536	D532-V534 PolarHBondContact O-N 3.42Å; V534-G536 PolarHBondContact O-N 3.19Å
535	D	31.2	Very low	32.7	Very low	155 Å²	155	115 Å²	115	83%	0.829	68%	0.681	S	S	*	*			trans	-45.2	125.1	165.7	-106.8	-34.3	0	0	0	110.7	D533 D537	D533-D535 PolarHBondContact O-N 3.41Å; D535-D537 PolarHBondContact O-N 2.95Å
536	G	32.7	Very low	32.8	Very low	73 Å²	73	114.7 Å²	114.7	75%	0.753	68%	0.678	S	S	*	*			trans	-72.7	89.1	-179.9	0	0	0	0	0	111.5	V534 P538	V534-G536 PolarHBondContact O-N 3.19Å; G536-P538 WeakPolarHBondContact O-CD 3.28Å
537	D	29.6	Very low	33.1	Very low	157 Å²	157	124.8 Å²	124.8	84%	0.84	69%	0.693	S	S	*	*			trans	-71.3	118.9	166.5	-134.7	1.3	0	0	0	108.5	D535 F539	D535-D537 PolarHBondContact O-N 2.95Å; D537-F539 PolarHBondContact O-N 3.27Å; D537-F539 VanDerWaalsContact O-N 3.1Å
538	P	37.2	Very low	33.6	Very low	93 Å²	93	127.4 Å²	127.4	60%	0.604	69%	0.691	S	S	*	*			trans	-65.7	116.5	-175.2	24.1	-31.3	0	0	0	109.9	G536 T540	G536-P538 WeakPolarHBondContact O-CD 3.28Å; P538-T540 PolarHBondContact O-N 2.99Å
539	F	41.9	Very low	34.2	Very low	86 Å²	86	124.4 Å²	124.4	38%	0.377	68%	0.682	S	S	.	*			trans	-49.6	110.3	174.8	176.2	-98.5	0	0	0	110.9	P424 Y425 D537 W541	P424-F539 HydrophobicContact CB-CD1 4.26Å; P424-F539 HydrophobicContact CB-CE1 4.21Å; P424-F539 HydrophobicContact CG-CD1 4.19Å; P424-F539 HydrophobicContact CG-CD2 4.37Å; P424-F539 HydrophobicContact CG-CE1 3.8Å; P424-F539 HydrophobicContact CG-CE2 4Å; P424-F539 HydrophobicContact CG-CG 4.46Å; P424-F539 HydrophobicContact CG-CZ 3.7Å; Y425-F539 HydrophobicContact CE2-CZ 4.18Å; D537-F539 PolarHBondContact O-N 3.27Å; D537-F539 VanDerWaalsContact O-N 3.1Å; F539-W541 AromaticContact CD1-CD1 3.95Å; F539-W541 HydrophobicContact CD1-CG 4.46Å; F539-W541 AromaticContact CD1-NE1 3.95Å; F539-W541 HydrophobicContact CE1-CD2 4.24Å; F539-W541 HydrophobicContact CE1-CG 4.17Å; F539-W541 PolarHBondContact O-N 3.33Å
540	T	38.5	Very low	34.7	Very low	91 Å²	91	124.6 Å²	124.6	56%	0.558	67%	0.673	S	S	*	*			trans	-80.1	116.3	174.2	51.5	0	0	0	0	109.7	P538 K542	P538-T540 PolarHBondContact O-N 2.99Å; T540-K542 PolarHBondContact O-N 3.01Å
541	W	47	Very low	35.4	Very low	55 Å²	55	127.9 Å²	127.9	21%	0.208	67%	0.671	C	S	.	*			trans	-60.6	100.9	172.8	-81.2	77.4	0	0	0	110.3	L87 P397 Y425 F477 L478 F539	L87-W541 HydrophobicContact CB-CZ2 3.62Å; L87-W541 HydrophobicContact CD2-CH2 3.6Å; L87-W541 HydrophobicContact CD2-CZ2 3.45Å; L87-W541 VanDerWaalsContact CD2-CZ2 3.45Å; L87-W541 HydrophobicContact CG-CZ2 4.13Å; P397-W541 HydrophobicContact CG-CH2 3.89Å; P397-W541 HydrophobicContact CG-CZ3 4.22Å; Y425-W541 AromaticContact CD1-CH2 3.38Å; Y425-W541 HydrophobicContact CD1-CH2 3.38Å; Y425-W541 HydrophobicContact CD1-CZ2 4.39Å; Y425-W541 AromaticContact CD1-CZ3 3.6Å; Y425-W541 HydrophobicContact CD1-CZ3 3.6Å; Y425-W541 AromaticContact CE1-CE3 3.81Å; Y425-W541 HydrophobicContact CE1-CE3 3.81Å; Y425-W541 AromaticContact CE1-CH2 3.34Å; Y425-W541 HydrophobicContact CE1-CH2 3.34Å; Y425-W541 HydrophobicContact CE1-CZ2 4.33Å; Y425-W541 AromaticContact CE1-CZ3 3.07Å; Y425-W541 HydrophobicContact CE1-CZ3 3.07Å; Y425-W541 HydrophobicContact CG-CH2 4.36Å; Y425-W541 AromaticContact CZ-CZ3 3.93Å; F477-W541 HydrophobicContact CE1-CD2 4.26Å; F477-W541 HydrophobicContact CE1-CG 4.39Å; F477-W541 AromaticContact CE1-NE1 3.94Å; L478-W541 HydrophobicContact CD2-CE3 3.74Å; L478-W541 HydrophobicContact CD2-CZ3 3.8Å; F539-W541 AromaticContact CD1-CD1 3.95Å; F539-W541 HydrophobicContact CD1-CG 4.46Å; F539-W541 AromaticContact CD1-NE1 3.95Å; F539-W541 HydrophobicContact CE1-CD2 4.24Å; F539-W541 HydrophobicContact CE1-CG 4.17Å; F539-W541 PolarHBondContact O-N 3.33Å
542	K	44.9	Very low	35.5	Very low	156 Å²	156	127.4 Å²	127.4	68%	0.678	66%	0.661	S	S	*	*			trans	-108.8	97.2	174.3	-71.9	-177.8	-176.6	172.9	0	109.1	T540 S544	T540-K542 PolarHBondContact O-N 3.01Å; K542-S544 PolarHBondContact O-N 3.26Å; K542-S544 VanDerWaalsContact O-N 3.16Å
543	R	43.3	Very low	36	Very low	80 Å²	80	126.2 Å²	126.2	30%	0.302	65%	0.654	S	S	.	*			trans	-72.9	103.2	165.2	-162.3	164.4	-176.2	-173.3	15.8	107.6	E482 Y545	E482-R543 IonicContact OE1-NH1 3.34Å; E482-R543 PolarHBondContact OE1-NH1 3.26Å; R543-Y545 VanDerWaalsContact C-N 3.34Å; R543-Y545 HydrophobicContact CB-CD2 4.21Å; R543-Y545 HydrophobicContact CB-CE2 3.79Å; R543-Y545 WeakPolarHBondContact CD-OH 3.44Å; R543-Y545 HydrophobicContact CG-CD2 4.2Å; R543-Y545 HydrophobicContact CG-CE1 4.36Å; R543-Y545 HydrophobicContact CG-CE2 3.76Å; R543-Y545 PolarHBondContact NH1-OH 3.43Å; R543-Y545 VanDerWaalsContact NH1-OH 3.16Å; R543-Y545 WeakPolarHBondContact O-CD2 3.46Å; R543-Y545 PolarHBondContact O-N 3.45Å
544	S	36.1	Very low	36.5	Very low	69 Å²	69	123.9 Å²	123.9	48%	0.483	64%	0.64	S	S	.	*			trans	-71.9	90.2	173.6	44.2	0	0	0	0	109.1	K542 T546	K542-S544 PolarHBondContact O-N 3.26Å; K542-S544 VanDerWaalsContact O-N 3.16Å; S544-T546 PolarHBondContact O-N 3.49Å
545	Y	35.1	Very low	36.8	Very low	149 Å²	149	122.5 Å²	122.5	58%	0.584	62%	0.623	S	S	*	*			trans	-75	77.3	167.5	-65.8	-86.5	0	0	0	109.6	E482 R543	E482-Y545 PolarHBondContact OE1-OH 3.48Å; R543-Y545 VanDerWaalsContact C-N 3.34Å; R543-Y545 HydrophobicContact CB-CD2 4.21Å; R543-Y545 HydrophobicContact CB-CE2 3.79Å; R543-Y545 WeakPolarHBondContact CD-OH 3.44Å; R543-Y545 HydrophobicContact CG-CD2 4.2Å; R543-Y545 HydrophobicContact CG-CE1 4.36Å; R543-Y545 HydrophobicContact CG-CE2 3.76Å; R543-Y545 PolarHBondContact NH1-OH 3.43Å; R543-Y545 VanDerWaalsContact NH1-OH 3.16Å; R543-Y545 WeakPolarHBondContact O-CD2 3.46Å; R543-Y545 PolarHBondContact O-N 3.45Å
546	T	29.6	Very low	37.3	Very low	112 Å²	112	119.8 Å²	119.8	69%	0.687	61%	0.606	S	S	*	*			trans	-90.5	112.3	159.7	42.1	0	0	0	0	108	S544	S544-T546 PolarHBondContact O-N 3.49Å
547	R	31.1	Very low	37.7	Very low	317 Å²	317	124.1 Å²	124.1	100%	1.196	59%	0.593	S	S	*	*			trans	-54	0	-178	-92.1	-178.5	173.4	-179.1	-2.5	114.7

Retrieved 547 of 547 residues in 146.9 ms (Link to these results)

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