A0A5K4F7Z9_SCHMA Loading...

Bifunctional lysine-specific demethylase and histidyl-hydroxylase

Oxygenase that can act as both a histone lysine demethylase and a ribosomal histidine hydroxylase.

AlphaFold DB , UniProt , Accession A0A5K4F7Z9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 742 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	33.1	Very low	45.7	Very low	178 Å²	178	77.8 Å²	77.8	88%	0.877	37%	0.372	S	S	*	.				0	154	0	-58.6	173.8	91.9	0	0	107.3	W387	M1-W387 HydrophobicContact CE-CB 3.55Å; M1-W387 HydrophobicContact CE-CD2 4.1Å; M1-W387 HydrophobicContact CE-CG 3.48Å; M1-W387 VanDerWaalsContact CE-CG 3.48Å; M1-W387 HydrophobicContact SD-CB 4.16Å; M1-W387 HydrophobicContact SD-CG 4.16Å
2	L	32.5	Very low	46.3	Very low	60 Å²	60	78.6 Å²	78.6	31%	0.314	37%	0.373	S	S	.	.			trans	-70	157.9	170.8	-67.7	168.1	0	0	0	109.6	D6 F7 L10 W387	L2-D6 HydrophobicContact CB-CB 3.98Å; L2-D6 HydrophobicContact CD2-CB 3.97Å; L2-D6 HydrophobicContact CG-CB 4.5Å; L2-F7 HydrophobicContact CB-CB 4.48Å; L2-L10 HydrophobicContact CD1-CB 4.35Å; L2-L10 HydrophobicContact CD1-CD2 3.96Å; L2-W387 PolarHBondContact O-NE1 3.05Å
3	S	43.2	Very low	46.7	Very low	19 Å²	19	78.7 Å²	78.7	13%	0.133	38%	0.376	C	S	.	.			trans	-71.2	166.5	162.4	75.4	0	0	0	0	110.1	R5 D6 F7	S3-R5 PolarHBondContact O-N 2.64Å; S3-R5 PolarHBondContact OG-N 3.27Å; S3-D6 VanDerWaalsContact CB-OD2 3.24Å; S3-D6 WeakPolarHBondContact CB-OD2 3.38Å; S3-D6 PolarHBondContact N-OD2 3.08Å; S3-D6 PolarHBondContact O-N 2.68Å; S3-D6 VanDerWaalsContact O-N 3.15Å; S3-D6 PolarHBondContact OG-N 3.08Å; S3-D6 VanDerWaalsContact OG-N 3.07Å; S3-D6 PolarHBondContact OG-OD2 3.31Å; S3-F7 PolarHBondContact O-N 3.21Å
4	A	40.3	Very low	46.9	Very low	41 Å²	41	78.6 Å²	78.6	34%	0.339	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-40.2	174.9	0	0	0	0	0	111.5	F7 Y8	A4-F7 PolarHBondContact O-N 3.41Å; A4-Y8 PolarHBondContact O-N 2.91Å
5	R	50	Low	46.9	Very low	49 Å²	49	79.7 Å²	79.7	19%	0.185	41%	0.407	C	S	.	.	H	α-helix	trans	-64.6	-40	174.4	178.8	173.1	171.1	-170.1	-11	112.7	S3 R9 Y288	S3-R5 PolarHBondContact O-N 2.64Å; S3-R5 PolarHBondContact OG-N 3.27Å; R5-R9 VanDerWaalsContact NH2-NH2 3.13Å; R5-R9 WeakPolarHBondContact O-CB 3.15Å; R5-R9 WeakPolarHBondContact O-CG 3.4Å; R5-R9 PolarHBondContact O-N 3.06Å; R5-Y288 PolarHBondContact NH1-O 3.1Å; R5-Y288 PolarHBondContact NH2-OH 2.87Å
6	D	50	Low	47.1	Very low	51 Å²	51	80.8 Å²	80.8	27%	0.273	41%	0.41	S	S	.	.	H	α-helix	trans	-71.2	-33.6	177.4	-57.9	-48.1	0	0	0	111.7	L2 S3 R9 L10	L2-D6 HydrophobicContact CB-CB 3.98Å; L2-D6 HydrophobicContact CD2-CB 3.97Å; L2-D6 HydrophobicContact CG-CB 4.5Å; S3-D6 VanDerWaalsContact CB-OD2 3.24Å; S3-D6 WeakPolarHBondContact CB-OD2 3.38Å; S3-D6 PolarHBondContact N-OD2 3.08Å; S3-D6 PolarHBondContact O-N 2.68Å; S3-D6 VanDerWaalsContact O-N 3.15Å; S3-D6 PolarHBondContact OG-N 3.08Å; S3-D6 VanDerWaalsContact OG-N 3.07Å; S3-D6 PolarHBondContact OG-OD2 3.31Å; D6-R9 PolarHBondContact O-N 2.82Å; D6-L10 WeakPolarHBondContact O-CB 3.48Å; D6-L10 PolarHBondContact O-N 3.48Å
7	F	49.3	Very low	46.6	Very low	69 Å²	69	79.6 Å²	79.6	30%	0.303	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-49.5	172.1	178.6	-90.6	0	0	0	111.2	L2 S3 A4 R9 L10 E11 L27 W387	L2-F7 HydrophobicContact CB-CB 4.48Å; S3-F7 PolarHBondContact O-N 3.21Å; A4-F7 PolarHBondContact O-N 3.41Å; F7-R9 VanDerWaalsContact C-N 3.33Å; F7-R9 PolarHBondContact O-N 3.4Å; F7-L10 PolarHBondContact O-N 3.22Å; F7-L10 VanDerWaalsContact O-N 3.08Å; F7-E11 PolarHBondContact O-N 2.71Å; F7-L27 HydrophobicContact CD2-CD1 4.15Å; F7-L27 HydrophobicContact CE2-CD1 4.34Å; F7-W387 HydrophobicContact CB-CH2 4.21Å; F7-W387 HydrophobicContact CB-CZ2 3.89Å; F7-W387 HydrophobicContact CD1-CH2 4.25Å; F7-W387 AromaticContact CD2-CH2 3.68Å; F7-W387 HydrophobicContact CD2-CH2 3.68Å; F7-W387 AromaticContact CD2-CZ2 3.93Å; F7-W387 HydrophobicContact CD2-CZ2 3.93Å; F7-W387 HydrophobicContact CE2-CH2 4.08Å; F7-W387 AromaticContact CG-CH2 3.77Å; F7-W387 HydrophobicContact CG-CH2 3.77Å; F7-W387 AromaticContact CG-CZ2 3.95Å; F7-W387 HydrophobicContact CG-CZ2 3.95Å
8	Y	50.6	Low	46.5	Very low	113 Å²	113	83.3 Å²	83.3	44%	0.443	44%	0.435	S	S	.	.	H	α-helix	trans	-59.8	-39.9	174	-95.7	-75.3	0	0	0	112.8	A4 K12 I526	A4-Y8 PolarHBondContact O-N 2.91Å; Y8-K12 VanDerWaalsContact O-CB 3.23Å; Y8-K12 WeakPolarHBondContact O-CB 3.22Å; Y8-K12 PolarHBondContact O-N 2.63Å; Y8-I526 HydrophobicContact CE2-CD1 4.02Å; Y8-I526 WeakPolarHBondContact OH-CD1 3.22Å
9	R	52.6	Low	46.3	Very low	119 Å²	119	82.1 Å²	82.1	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-63.2	-41.7	172	-82.3	179.7	160.7	-178.5	-8.5	111.7	R5 D6 F7 K12 L13	R5-R9 VanDerWaalsContact NH2-NH2 3.13Å; R5-R9 WeakPolarHBondContact O-CB 3.15Å; R5-R9 WeakPolarHBondContact O-CG 3.4Å; R5-R9 PolarHBondContact O-N 3.06Å; D6-R9 PolarHBondContact O-N 2.82Å; F7-R9 VanDerWaalsContact C-N 3.33Å; F7-R9 PolarHBondContact O-N 3.4Å; R9-K12 PolarHBondContact O-N 3.03Å; R9-L13 WeakPolarHBondContact O-CB 3.49Å; R9-L13 VanDerWaalsContact O-CG 3.24Å; R9-L13 WeakPolarHBondContact O-CG 3.19Å; R9-L13 PolarHBondContact O-N 2.89Å
10	L	49.3	Very low	46	Very low	85 Å²	85	88 Å²	88	45%	0.445	45%	0.453	S	S	.	.	H	α-helix	trans	-67.2	-43.8	179	-153.1	92.7	0	0	0	111.7	L2 D6 F7 L13 S14	L2-L10 HydrophobicContact CD1-CB 4.35Å; L2-L10 HydrophobicContact CD1-CD2 3.96Å; D6-L10 WeakPolarHBondContact O-CB 3.48Å; D6-L10 PolarHBondContact O-N 3.48Å; F7-L10 PolarHBondContact O-N 3.22Å; F7-L10 VanDerWaalsContact O-N 3.08Å; L10-L13 PolarHBondContact O-N 3.34Å; L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.38Å; L10-S14 PolarHBondContact O-N 3.03Å
11	E	51.5	Low	45.7	Very low	72 Å²	72	87.6 Å²	87.6	34%	0.336	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-39.4	176.5	-166.4	-179.3	-157.5	0	0	111.2	F7 S14 S15 R459	F7-E11 PolarHBondContact O-N 2.71Å; E11-S14 PolarHBondContact O-N 3.23Å; E11-S15 WeakPolarHBondContact O-CB 3.36Å; E11-S15 PolarHBondContact O-N 2.93Å; E11-S15 PolarHBondContact O-OG 2.79Å; E11-R459 IonicContact OE1-NH2 3.85Å; E11-R459 PolarHBondContact OE1-NH2 3.31Å
12	K	52.9	Low	45.8	Very low	87 Å²	87	85.2 Å²	85.2	38%	0.378	46%	0.459	S	S	.	.	H	α-helix	trans	-65.9	-36	174.2	-173.3	159.7	-177.8	158.1	0	112.7	Y8 R9 S15 Q16	Y8-K12 VanDerWaalsContact O-CB 3.23Å; Y8-K12 WeakPolarHBondContact O-CB 3.22Å; Y8-K12 PolarHBondContact O-N 2.63Å; R9-K12 PolarHBondContact O-N 3.03Å; K12-S15 WeakPolarHBondContact CA-OG 3.33Å; K12-S15 PolarHBondContact O-OG 3.5Å; K12-Q16 VanDerWaalsContact O-CG 3.3Å; K12-Q16 WeakPolarHBondContact O-CG 3.18Å; K12-Q16 PolarHBondContact O-N 3.27Å
13	L	51.7	Low	46.2	Very low	80 Å²	80	90 Å²	90	42%	0.419	48%	0.48	S	S	.	.	H	α-helix	trans	-76.2	-34	174.8	-69.7	167.8	0	0	0	112.2	R9 L10 Q16 G17 K18 V19	R9-L13 WeakPolarHBondContact O-CB 3.49Å; R9-L13 VanDerWaalsContact O-CG 3.24Å; R9-L13 WeakPolarHBondContact O-CG 3.19Å; R9-L13 PolarHBondContact O-N 2.89Å; L10-L13 PolarHBondContact O-N 3.34Å; L13-Q16 PolarHBondContact O-N 3.28Å; L13-G17 PolarHBondContact O-N 3.04Å; L13-K18 HydrophobicContact CD2-CB 4.35Å; L13-K18 PolarHBondContact O-N 2.91Å; L13-V19 HydrophobicContact CB-CG2 3.5Å
14	S	49.6	Very low	46	Very low	77 Å²	77	91.8 Å²	91.8	54%	0.538	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-44.4	176.1	-167	0	0	0	0	111.8	L10 E11 Q16 G17	L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.38Å; L10-S14 PolarHBondContact O-N 3.03Å; E11-S14 PolarHBondContact O-N 3.23Å; S14-Q16 PolarHBondContact O-N 2.99Å; S14-G17 PolarHBondContact O-N 2.92Å
15	S	46.9	Very low	46	Very low	96 Å²	96	92.8 Å²	92.8	67%	0.671	50%	0.499	S	S	*	.	H	α-helix	trans	-69.7	-18.3	175.5	52.5	0	0	0	0	113.7	E11 K12	E11-S15 WeakPolarHBondContact O-CB 3.36Å; E11-S15 PolarHBondContact O-N 2.93Å; E11-S15 PolarHBondContact O-OG 2.79Å; K12-S15 WeakPolarHBondContact CA-OG 3.33Å; K12-S15 PolarHBondContact O-OG 3.5Å
16	Q	50.3	Low	46.2	Very low	96 Å²	96	92.7 Å²	92.7	45%	0.449	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	2.9	166.7	-71.6	-173.7	14.3	0	0	113.8	K12 L13 S14 K18	K12-Q16 VanDerWaalsContact O-CG 3.3Å; K12-Q16 WeakPolarHBondContact O-CG 3.18Å; K12-Q16 PolarHBondContact O-N 3.27Å; L13-Q16 PolarHBondContact O-N 3.28Å; S14-Q16 PolarHBondContact O-N 2.99Å; Q16-K18 HydrophobicContact CB-CD 4.07Å; Q16-K18 HydrophobicContact CB-CG 4.19Å; Q16-K18 PolarHBondContact O-N 2.88Å; Q16-K18 VanDerWaalsContact O-N 3.16Å
17	G	38.8	Very low	45.9	Very low	62 Å²	62	93.6 Å²	93.6	64%	0.639	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	8.9	-177.6	0	0	0	0	0	115	L13 S14 V19	L13-G17 PolarHBondContact O-N 3.04Å; S14-G17 PolarHBondContact O-N 2.92Å; G17-V19 PolarHBondContact O-N 2.88Å
18	K	45.4	Very low	45.8	Very low	145 Å²	145	92.1 Å²	92.1	63%	0.63	51%	0.507	S	S	*	.			trans	-85.5	-3.7	-172.4	-71.8	174.2	-176.5	168	0	114.1	L13 Q16	L13-K18 HydrophobicContact CD2-CB 4.35Å; L13-K18 PolarHBondContact O-N 2.91Å; Q16-K18 HydrophobicContact CB-CD 4.07Å; Q16-K18 HydrophobicContact CB-CG 4.19Å; Q16-K18 PolarHBondContact O-N 2.88Å; Q16-K18 VanDerWaalsContact O-N 3.16Å
19	V	42.6	Very low	45.9	Very low	61 Å²	61	90.8 Å²	90.8	37%	0.37	51%	0.505	S	S	.	.			trans	-105.2	97.3	175.3	-172.4	0	0	0	0	110.4	L13 G17 S21	L13-V19 HydrophobicContact CB-CG2 3.5Å; G17-V19 PolarHBondContact O-N 2.88Å; V19-S21 PolarHBondContact O-N 3.39Å
20	K	39.2	Very low	46	Very low	200 Å²	200	89.4 Å²	89.4	87%	0.87	50%	0.502	S	S	*	.			trans	-76.4	108.8	158.8	-69.4	-175	179.3	-179.5	0	107.8	S22	K20-S22 PolarHBondContact O-N 3.32Å; K20-S22 VanDerWaalsContact O-N 3.13Å
21	S	39.6	Very low	46	Very low	80 Å²	80	89.7 Å²	89.7	56%	0.559	50%	0.504	S	S	*	.			trans	-73.8	101.8	-176.1	55.9	0	0	0	0	111.7	V19 E23 G24	V19-S21 PolarHBondContact O-N 3.39Å; S21-E23 PolarHBondContact O-N 3.48Å; S21-G24 WeakPolarHBondContact OG-CA 3.48Å
22	S	36.1	Very low	46.3	Very low	128 Å²	128	88.4 Å²	88.4	90%	0.895	50%	0.499	S	S	*	.	S	Bend	trans	-70.3	-18.6	175.3	48.1	0	0	0	0	113.5	K20	K20-S22 PolarHBondContact O-N 3.32Å; K20-S22 VanDerWaalsContact O-N 3.13Å
23	E	39.8	Very low	46.7	Very low	161 Å²	161	91.3 Å²	91.3	75%	0.752	51%	0.507	S	S	*	.	S	Bend	trans	-121.8	89.5	157.5	-69.2	-171.3	160.3	0	0	108.5	S21 M25	S21-E23 PolarHBondContact O-N 3.48Å; E23-M25 VanDerWaalsContact C-N 3.32Å; E23-M25 PolarHBondContact O-N 3.39Å
24	G	39.5	Very low	47.1	Very low	55 Å²	55	90.8 Å²	90.8	57%	0.567	51%	0.51	S	S	*	.			trans	-69.5	80.6	-177.4	0	0	0	0	0	112.9	S21	S21-G24 WeakPolarHBondContact OG-CA 3.48Å
25	M	40.9	Very low	47.3	Very low	62 Å²	62	88.3 Å²	88.3	31%	0.305	49%	0.491	S	S	.	.			trans	-156.3	112.8	177.8	-156	173.6	-56.9	0	0	112	E23 E29 K30 R33	E23-M25 VanDerWaalsContact C-N 3.32Å; E23-M25 PolarHBondContact O-N 3.39Å; M25-E29 VanDerWaalsContact CA-OE2 3.31Å; M25-E29 WeakPolarHBondContact CA-OE2 3.47Å; M25-E29 HydrophobicContact CG-CB 3.87Å; M25-K30 HydrophobicContact CG-CG 4.23Å; M25-K30 VanDerWaalsContact O-CE 3.27Å; M25-K30 WeakPolarHBondContact O-CE 3.33Å; M25-K30 PolarHBondContact O-NZ 2.85Å; M25-K30 HydrophobicContact SD-CG 4.37Å; M25-R33 VanDerWaalsContact SD-CZ 3.52Å; M25-R33 PolarHBondContact SD-NE 3.5Å
26	S	53.8	Low	47.8	Very low	47 Å²	47	87 Å²	87	33%	0.329	48%	0.476	S	S	.	.			trans	-66.2	166.6	-174.6	97.2	0	0	0	0	112.8	T28 E29 K30	S26-T28 VanDerWaalsContact C-N 3.31Å; S26-T28 PolarHBondContact OG-N 3.1Å; S26-T28 VanDerWaalsContact OG-N 3.14Å; S26-T28 PolarHBondContact OG-OG1 3.49Å; S26-E29 PolarHBondContact N-OE2 3.23Å; S26-E29 PolarHBondContact O-N 2.92Å; S26-E29 PolarHBondContact OG-N 3.49Å; S26-K30 WeakPolarHBondContact O-CG 3.17Å; S26-K30 PolarHBondContact O-N 2.93Å
27	L	44.2	Very low	48.2	Very low	70 Å²	70	87.5 Å²	87.5	37%	0.366	49%	0.486	S	S	.	.	H	α-helix	trans	-67.5	-32.8	174.4	-116.6	166.3	0	0	0	111.8	F7 L31	F7-L27 HydrophobicContact CD2-CD1 4.15Å; F7-L27 HydrophobicContact CE2-CD1 4.34Å; L27-L31 PolarHBondContact O-N 3.31Å; L27-L31 VanDerWaalsContact O-N 3.08Å
28	T	46.1	Very low	48.6	Very low	38 Å²	38	88.5 Å²	88.5	23%	0.233	48%	0.476	C	S	.	.	H	α-helix	trans	-73.3	-37.5	172.2	35.2	0	0	0	0	112.6	S26 K30 L31 I32 V453 E457	S26-T28 VanDerWaalsContact C-N 3.31Å; S26-T28 PolarHBondContact OG-N 3.1Å; S26-T28 VanDerWaalsContact OG-N 3.14Å; S26-T28 PolarHBondContact OG-OG1 3.49Å; T28-K30 VanDerWaalsContact C-N 3.28Å; T28-K30 PolarHBondContact O-N 3.26Å; T28-L31 CarbonylContact O-C 3.53Å; T28-L31 WeakPolarHBondContact O-CA 3.49Å; T28-L31 WeakPolarHBondContact O-CB 3.47Å; T28-L31 PolarHBondContact O-N 3.27Å; T28-L31 VanDerWaalsContact O-N 3.1Å; T28-I32 WeakPolarHBondContact O-CB 3.45Å; T28-I32 VanDerWaalsContact O-CG1 3.26Å; T28-I32 WeakPolarHBondContact O-CG1 3.29Å; T28-I32 PolarHBondContact O-N 3.19Å; T28-V453 HydrophobicContact CG2-CG1 3.82Å; T28-E457 WeakPolarHBondContact CB-OE1 2.98Å; T28-E457 HydrophobicContact CG2-CG 4.04Å; T28-E457 WeakPolarHBondContact CG2-OE1 3.28Å; T28-E457 PolarHBondContact OG1-OE1 3.25Å
29	E	54	Low	48.5	Very low	85 Å²	85	85.4 Å²	85.4	40%	0.397	47%	0.466	S	S	.	.	H	α-helix	trans	-63	-36.4	172.2	-71.2	180	105.7	0	0	111.8	M25 S26 I32 R33	M25-E29 VanDerWaalsContact CA-OE2 3.31Å; M25-E29 WeakPolarHBondContact CA-OE2 3.47Å; M25-E29 HydrophobicContact CG-CB 3.87Å; S26-E29 PolarHBondContact N-OE2 3.23Å; S26-E29 PolarHBondContact O-N 2.92Å; S26-E29 PolarHBondContact OG-N 3.49Å; E29-I32 PolarHBondContact O-N 3.46Å; E29-R33 WeakPolarHBondContact O-CB 3.44Å; E29-R33 WeakPolarHBondContact O-CG 3.35Å; E29-R33 PolarHBondContact O-N 2.97Å
30	K	54.2	Low	48.5	Very low	90 Å²	90	84.1 Å²	84.1	39%	0.391	47%	0.466	S	S	.	.	H	α-helix	trans	-66.7	-35.4	172.9	-72.7	166.4	-178.2	161.8	0	111.9	M25 S26 T28 S34	M25-K30 HydrophobicContact CG-CG 4.23Å; M25-K30 VanDerWaalsContact O-CE 3.27Å; M25-K30 WeakPolarHBondContact O-CE 3.33Å; M25-K30 PolarHBondContact O-NZ 2.85Å; M25-K30 HydrophobicContact SD-CG 4.37Å; S26-K30 WeakPolarHBondContact O-CG 3.17Å; S26-K30 PolarHBondContact O-N 2.93Å; T28-K30 VanDerWaalsContact C-N 3.28Å; T28-K30 PolarHBondContact O-N 3.26Å; K30-S34 WeakPolarHBondContact O-CB 3.07Å; K30-S34 PolarHBondContact O-N 2.83Å; K30-S34 VanDerWaalsContact O-N 3.11Å; K30-S34 PolarHBondContact O-OG 3.19Å
31	L	49.4	Very low	48.3	Very low	92 Å²	92	81.1 Å²	81.1	48%	0.482	47%	0.467	S	S	.	.	H	α-helix	trans	-68.6	-44	169.6	-81.1	163.9	0	0	0	112.5	L27 T28 S34 L35	L27-L31 PolarHBondContact O-N 3.31Å; L27-L31 VanDerWaalsContact O-N 3.08Å; T28-L31 CarbonylContact O-C 3.53Å; T28-L31 WeakPolarHBondContact O-CA 3.49Å; T28-L31 WeakPolarHBondContact O-CB 3.47Å; T28-L31 PolarHBondContact O-N 3.27Å; T28-L31 VanDerWaalsContact O-N 3.1Å; L31-S34 CarbonylContact O-C 3.53Å; L31-S34 WeakPolarHBondContact O-CA 3.46Å; L31-S34 WeakPolarHBondContact O-CB 3.29Å; L31-S34 PolarHBondContact O-N 2.91Å; L31-S34 VanDerWaalsContact O-N 3.09Å; L31-L35 WeakPolarHBondContact O-CG 3.2Å; L31-L35 PolarHBondContact O-N 2.75Å
32	I	58.4	Low	47.9	Very low	45 Å²	45	81.4 Å²	81.4	23%	0.231	47%	0.468	C	S	.	.	H	α-helix	trans	-62.5	-46.2	178.8	-69.7	162.7	0	0	0	110.2	T28 E29 S34 L35 D36	T28-I32 WeakPolarHBondContact O-CB 3.45Å; T28-I32 VanDerWaalsContact O-CG1 3.26Å; T28-I32 WeakPolarHBondContact O-CG1 3.29Å; T28-I32 PolarHBondContact O-N 3.19Å; E29-I32 PolarHBondContact O-N 3.46Å; I32-S34 VanDerWaalsContact C-N 3.27Å; I32-S34 PolarHBondContact O-N 2.84Å; I32-L35 CarbonylContact O-C 3.54Å; I32-L35 WeakPolarHBondContact O-CA 3.2Å; I32-L35 WeakPolarHBondContact O-CB 3.38Å; I32-L35 PolarHBondContact O-N 2.87Å; I32-D36 WeakPolarHBondContact CG2-OD2 3.33Å; I32-D36 PolarHBondContact O-N 3.49Å
33	R	61.1	Low	47.5	Very low	148 Å²	148	80.7 Å²	80.7	56%	0.558	46%	0.463	S	S	*	.	H	α-helix	trans	-63.1	-30.7	172.7	-71.1	179.9	-178.3	-141	3.7	113.1	M25 E29 T37	M25-R33 VanDerWaalsContact SD-CZ 3.52Å; M25-R33 PolarHBondContact SD-NE 3.5Å; E29-R33 WeakPolarHBondContact O-CB 3.44Å; E29-R33 WeakPolarHBondContact O-CG 3.35Å; E29-R33 PolarHBondContact O-N 2.97Å; R33-T37 PolarHBondContact O-N 3.12Å; R33-T37 PolarHBondContact O-OG1 3.44Å
34	S	58.9	Low	47	Very low	68 Å²	68	78.3 Å²	78.3	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-71.5	-32	172.4	-58.2	0	0	0	0	112.3	K30 L31 I32 T37	K30-S34 WeakPolarHBondContact O-CB 3.07Å; K30-S34 PolarHBondContact O-N 2.83Å; K30-S34 VanDerWaalsContact O-N 3.11Å; K30-S34 PolarHBondContact O-OG 3.19Å; L31-S34 CarbonylContact O-C 3.53Å; L31-S34 WeakPolarHBondContact O-CA 3.46Å; L31-S34 WeakPolarHBondContact O-CB 3.29Å; L31-S34 PolarHBondContact O-N 2.91Å; L31-S34 VanDerWaalsContact O-N 3.09Å; I32-S34 VanDerWaalsContact C-N 3.27Å; I32-S34 PolarHBondContact O-N 2.84Å; S34-T37 WeakPolarHBondContact CA-OG1 3.31Å; S34-T37 PolarHBondContact O-OG1 3.44Å
35	L	53.9	Low	46.5	Very low	26 Å²	26	82.7 Å²	82.7	14%	0.136	47%	0.469	C	S	.	.	H	α-helix	trans	-75.2	-34.6	171.8	-70.6	165.9	0	0	0	112	L31 I32 L38 K450	L31-L35 WeakPolarHBondContact O-CG 3.2Å; L31-L35 PolarHBondContact O-N 2.75Å; I32-L35 CarbonylContact O-C 3.54Å; I32-L35 WeakPolarHBondContact O-CA 3.2Å; I32-L35 WeakPolarHBondContact O-CB 3.38Å; I32-L35 PolarHBondContact O-N 2.87Å; L35-L38 WeakPolarHBondContact O-CB 3.45Å; L35-L38 PolarHBondContact O-N 2.83Å; L35-K450 HydrophobicContact CD1-CG 4.26Å
36	D	58.2	Low	45.9	Very low	69 Å²	69	89.4 Å²	89.4	37%	0.369	50%	0.497	S	S	.	.	H	α-helix	trans	-77.9	-26.9	178.8	-71.3	-43.4	0	0	0	113.1	I32 L38 N39 K450	I32-D36 WeakPolarHBondContact CG2-OD2 3.33Å; I32-D36 PolarHBondContact O-N 3.49Å; D36-L38 PolarHBondContact O-N 3.3Å; D36-N39 WeakPolarHBondContact O-CB 3.47Å; D36-N39 PolarHBondContact O-N 3.02Å; D36-N39 VanDerWaalsContact O-N 3.09Å; D36-N39 PolarHBondContact OD1-ND2 3.45Å; D36-N39 VanDerWaalsContact OD1-ND2 3.15Å; D36-K450 IonicContact OD1-NZ 3.14Å; D36-K450 PolarHBondContact OD1-NZ 2.98Å; D36-K450 IonicContact OD2-NZ 2.81Å; D36-K450 PolarHBondContact OD2-NZ 2.94Å
37	T	59	Low	44.7	Very low	105 Å²	105	95.5 Å²	95.5	64%	0.644	52%	0.524	S	S	*	.	H	α-helix	trans	-68.5	-20.8	166.2	36.2	0	0	0	0	113.1	R33 S34 N39 G40	R33-T37 PolarHBondContact O-N 3.12Å; R33-T37 PolarHBondContact O-OG1 3.44Å; S34-T37 WeakPolarHBondContact CA-OG1 3.31Å; S34-T37 PolarHBondContact O-OG1 3.44Å; T37-N39 VanDerWaalsContact C-N 3.3Å; T37-G40 PolarHBondContact O-N 3.25Å
38	L	45.5	Very low	44	Very low	84 Å²	84	97.4 Å²	97.4	44%	0.44	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.6	169.1	-68.1	168.1	0	0	0	113.8	L35 D36 I446	L35-L38 WeakPolarHBondContact O-CB 3.45Å; L35-L38 PolarHBondContact O-N 2.83Å; D36-L38 PolarHBondContact O-N 3.3Å; L38-I446 HydrophobicContact CB-CD1 4.47Å
39	N	44.4	Very low	43.1	Very low	79 Å²	79	105 Å²	105	42%	0.422	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	-8.1	171.2	-69.3	-39.5	0	0	0	112.9	D36 T37 I446	D36-N39 WeakPolarHBondContact O-CB 3.47Å; D36-N39 PolarHBondContact O-N 3.02Å; D36-N39 VanDerWaalsContact O-N 3.09Å; D36-N39 PolarHBondContact OD1-ND2 3.45Å; D36-N39 VanDerWaalsContact OD1-ND2 3.15Å; T37-N39 VanDerWaalsContact C-N 3.3Å; N39-I446 VanDerWaalsContact OD1-CD1 3.29Å; N39-I446 WeakPolarHBondContact OD1-CD1 3.5Å
40	G	42.2	Very low	42	Very low	35 Å²	35	106.9 Å²	106.9	36%	0.361	59%	0.592	S	S	.	*	S	Bend	trans	-67.5	156.9	171	0	0	0	0	0	112.3	T37 C42	T37-G40 PolarHBondContact O-N 3.25Å; G40-C42 VanDerWaalsContact C-N 3.27Å; G40-C42 PolarHBondContact O-N 3.07Å
41	P	34.4	Very low	40.8	Very low	137 Å²	137	111.2 Å²	111.2	89%	0.89	62%	0.619	S	S	*	*			trans	-72.3	78.7	179	30.5	-35.5	0	0	0	111.4	S43	P41-S43 PolarHBondContact O-N 2.93Å
42	C	31.3	Very low	39.9	Very low	86 Å²	86	110.9 Å²	110.9	58%	0.581	63%	0.629	S	S	*	*			trans	-58.2	121.4	172.9	-67.2	0	0	0	0	110.3	G40 V44	G40-C42 VanDerWaalsContact C-N 3.27Å; G40-C42 PolarHBondContact O-N 3.07Å; C42-V44 PolarHBondContact O-N 3.21Å
43	S	28.3	Very low	38.7	Very low	112 Å²	112	113.7 Å²	113.7	78%	0.783	65%	0.653	S	S	*	*			trans	-71.4	94.6	176.3	44	0	0	0	0	110.5	P41 N45	P41-S43 PolarHBondContact O-N 2.93Å; S43-N45 PolarHBondContact O-N 3.15Å
44	V	29.8	Very low	37	Very low	112 Å²	112	116.2 Å²	116.2	68%	0.679	67%	0.671	S	S	*	*			trans	-71.7	66.6	176.1	-170.4	0	0	0	0	110.3	C42	C42-V44 PolarHBondContact O-N 3.21Å
45	N	28	Very low	35.8	Very low	146 Å²	146	119 Å²	119	78%	0.781	69%	0.685	S	S	*	*			trans	-155.9	54.9	-176.1	-100.1	-32.8	0	0	0	111.4	S43	S43-N45 PolarHBondContact O-N 3.15Å
46	K	29.2	Very low	34.5	Very low	203 Å²	203	122.2 Å²	122.2	88%	0.883	71%	0.71	S	S	*	*	S	Bend	trans	-162	-1.4	168.3	-117.5	153.2	-172.1	173.7	0	118.6
47	I	27.8	Very low	33.3	Very low	176 Å²	176	126.2 Å²	126.2	90%	0.903	73%	0.731	S	S	*	*			trans	-118.9	69	-177.5	-48.6	-179.2	0	0	0	110.2
48	S	29.8	Very low	31.8	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	74%	0.739	S	S	*	*			trans	-161	44.7	178.9	51	0	0	0	0	113.6
49	K	27.7	Very low	31.2	Very low	199 Å²	199	133 Å²	133	87%	0.865	76%	0.758	S	S	*	*			trans	-132.8	127.5	159.4	-77.2	-168.4	173.9	-173.3	0	109.6
50	P	31.2	Very low	30.4	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	77%	0.773	S	S	*	*			trans	-69.7	139	169.5	30.3	-33.1	0	0	0	109.2	A52	P50-A52 VanDerWaalsContact C-N 3.26Å; P50-A52 PolarHBondContact O-N 3Å
51	L	28	Very low	30	Very low	182 Å²	182	141.2 Å²	141.2	95%	0.953	79%	0.789	S	S	*	*			trans	-82.2	74.3	178.3	-159.7	76.5	0	0	0	109.8
52	A	31.5	Very low	30	Very low	84 Å²	84	142.5 Å²	142.5	69%	0.694	78%	0.78	S	S	*	*			trans	-65.4	141.5	166.1	0	0	0	0	0	109.4	P50	P50-A52 VanDerWaalsContact C-N 3.26Å; P50-A52 PolarHBondContact O-N 3Å
53	S	31.9	Very low	30	Very low	104 Å²	104	143.1 Å²	143.1	73%	0.727	79%	0.786	S	S	*	*			trans	-61.1	132.9	-175.6	50	0	0	0	0	112.5	T55	S53-T55 PolarHBondContact O-N 3.39Å
54	E	27.2	Very low	30.4	Very low	201 Å²	201	144.3 Å²	144.3	94%	0.939	78%	0.783	S	S	*	*			trans	-70.7	110.8	167.6	-66.9	-177.6	145.8	0	0	109.9
55	T	31.9	Very low	30.6	Very low	126 Å²	126	144.1 Å²	144.1	77%	0.773	78%	0.783	S	S	*	*			trans	-130.9	128.6	159.8	-14.2	0	0	0	0	108.1	S53	S53-T55 PolarHBondContact O-N 3.39Å
56	S	27.8	Very low	30.8	Very low	94 Å²	94	146.1 Å²	146.1	66%	0.657	78%	0.784	S	S	*	*			trans	-60	136.1	-176.2	177.4	0	0	0	0	112.1
57	N	32	Very low	31.2	Very low	153 Å²	153	145.9 Å²	145.9	82%	0.818	78%	0.783	S	S	*	*				-168.5	162	109.5	-87.9	-18.2	0	0	0	113
58	Q	28.2	Very low	31.5	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	78%	0.778	S	S	*	*			trans	-91.6	149.5	-169.4	-54.3	168.1	12.6	0	0	111.2
59	L	32.3	Very low	31.8	Very low	161 Å²	161	151 Å²	151	84%	0.843	78%	0.779	S	S	*	*				176.5	158.6	120.8	-93.7	162.6	0	0	0	113.2
60	N	29	Very low	32.1	Very low	140 Å²	140	151.8 Å²	151.8	75%	0.749	78%	0.777	S	S	*	*			trans	-60	167.7	176.3	-60.1	-45	0	0	0	112.3
61	E	33.5	Very low	32.3	Very low	147 Å²	147	156.2 Å²	156.2	69%	0.687	78%	0.778	S	S	*	*			cis	-164.7	162.6	32.7	-156.8	159.6	-160.2	0	0	117.2
62	K	32.9	Very low	32.5	Very low	163 Å²	163	157.3 Å²	157.3	71%	0.709	77%	0.769	S	S	*	*			trans	-6.1	116.3	164.7	-58.5	157.7	-169.3	152.3	0	122.1
63	S	32.9	Very low	32.6	Very low	100 Å²	100	161.3 Å²	161.3	70%	0.699	77%	0.771	S	S	*	*				90.6	142.3	112.5	82.7	0	0	0	0	124.7
64	N	35.3	Very low	32.5	Very low	136 Å²	136	167.1 Å²	167.1	73%	0.727	78%	0.777	S	S	*	*			trans	80.7	95.5	138.4	-69.5	-17.1	0	0	0	125.3
65	T	34.6	Very low	32.7	Very low	109 Å²	109	165.6 Å²	165.6	67%	0.669	77%	0.767	S	S	*	*				86.4	118.7	121.8	61	0	0	0	0	124.2
66	K	33.1	Very low	32.8	Very low	187 Å²	187	168.2 Å²	168.2	81%	0.813	77%	0.768	S	S	*	*				53	108.6	129.8	-58.3	172.5	-179.4	171.5	0	120.1
67	K	36.2	Very low	32.9	Very low	199 Å²	199	169 Å²	169	87%	0.865	77%	0.773	S	S	*	*				180	128	108.5	-97.5	157.9	-175	171.4	0	116.6
68	K	34.7	Very low	33	Very low	182 Å²	182	165.4 Å²	165.4	79%	0.791	77%	0.773	S	S	*	*			trans	34.9	124.8	136.5	-69.4	179.6	175.6	175.2	0	122.4
69	R	35.1	Very low	33	Very low	209 Å²	209	164.1 Å²	164.1	79%	0.789	77%	0.772	S	S	*	*				98.5	137.5	121.9	-90.6	-177.9	167.2	177.5	-3.8	122.5
70	R	35.5	Very low	33.1	Very low	216 Å²	216	163.5 Å²	163.5	82%	0.815	77%	0.769	S	S	*	*			trans	89.8	92.4	142.2	-81.4	-179.7	169.1	-178.2	-5	122
71	R	34.5	Very low	33.3	Very low	216 Å²	216	160.8 Å²	160.8	82%	0.815	77%	0.774	S	S	*	*				46.5	119.6	119.8	-76.7	-172.9	172.9	-179.3	-1.3	121.7
72	R	33	Very low	33.1	Very low	206 Å²	206	158.3 Å²	158.3	78%	0.777	77%	0.773	S	S	*	*				85.1	109.6	127.8	-75.1	-173.5	170	-171.9	-2.4	121.9
73	K	32.7	Very low	33.1	Very low	168 Å²	168	160.1 Å²	160.1	73%	0.73	78%	0.782	S	S	*	*				66.2	116.9	127.7	-74.3	-168.6	172.6	-174.1	0	121.2
74	R	30	Very low	33.1	Very low	225 Å²	225	158.9 Å²	158.9	85%	0.849	78%	0.777	S	S	*	*			trans	69.2	154.7	146.6	-62.9	178.6	169	176.4	-6.5	114.3
75	K	31.6	Very low	33	Very low	169 Å²	169	158.6 Å²	158.6	74%	0.735	78%	0.78	S	S	*	*			cis	-155.8	-177.5	11.5	-147.7	-177.2	176.6	-165.2	0	110
76	F	32.9	Very low	32.8	Very low	181 Å²	181	159.9 Å²	159.9	79%	0.794	78%	0.783	S	S	*	*			trans	79.3	168.3	161.7	-92.9	-76.4	0	0	0	119.4
77	S	30.8	Very low	32.9	Very low	110 Å²	110	158.8 Å²	158.8	77%	0.769	79%	0.785	S	S	*	*			trans	-131.9	156.8	-153	49.7	0	0	0	0	111.9
78	G	33.7	Very low	32.8	Very low	79 Å²	79	152.9 Å²	152.9	81%	0.814	78%	0.78	S	S	*	*			trans	-154.6	159.7	170.6	0	0	0	0	0	109.2
79	N	28.8	Very low	32.6	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	79%	0.786	S	S	*	*			trans	-120.8	-179.1	-167.9	-147	64.3	0	0	0	111.7
80	D	34.2	Very low	32.4	Very low	148 Å²	148	145.7 Å²	145.7	79%	0.791	78%	0.783	S	S	*	*			trans	74.2	150.5	162.9	-45.4	-45.4	0	0	0	118.6
81	G	32.8	Very low	32.3	Very low	82 Å²	82	144.5 Å²	144.5	85%	0.845	78%	0.784	S	S	*	*			trans	129.7	118.7	175.6	0	0	0	0	0	113.9
82	S	30.5	Very low	32.2	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	78%	0.78	S	S	*	*			trans	-128	-175.6	-174.2	55.9	0	0	0	0	113.1
83	F	32.2	Very low	32.3	Very low	201 Å²	201	141.2 Å²	141.2	88%	0.882	79%	0.785	S	S	*	*			trans	76.2	145.2	178	-55.6	-83.6	0	0	0	116.3
84	A	32.4	Very low	32	Very low	73 Å²	73	140.4 Å²	140.4	60%	0.603	79%	0.788	S	S	*	*			cis	-169.2	-179.8	-17.8	0	0	0	0	0	111.3
85	T	33.6	Very low	32.1	Very low	130 Å²	130	138.1 Å²	138.1	80%	0.798	79%	0.792	S	S	*	*			trans	72.9	148.5	160.3	64.7	0	0	0	0	120.1
86	D	30.9	Very low	31.9	Very low	136 Å²	136	138.5 Å²	138.5	73%	0.727	80%	0.797	S	S	*	*			cis	-168.9	168.4	-38.9	-136.7	-45.4	0	0	0	111.8
87	I	34.9	Very low	31.7	Very low	165 Å²	165	135 Å²	135	85%	0.846	80%	0.795	S	S	*	*			trans	64.5	137.3	162.8	-56.9	149.5	0	0	0	116.1
88	G	33	Very low	31.5	Very low	75 Å²	75	134.3 Å²	134.3	77%	0.773	79%	0.79	S	S	*	*			cis	-164.6	-173.3	-2.7	0	0	0	0	0	107.9
89	C	31.3	Very low	31.1	Very low	135 Å²	135	137.8 Å²	137.8	91%	0.912	79%	0.789	S	S	*	*			cis	-154.4	169.5	15.1	-176	0	0	0	0	109.4
90	S	30.8	Very low	31.1	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	79%	0.786	S	S	*	*			trans	-131.1	157.6	-161.9	-43.3	0	0	0	0	115.7
91	K	34.2	Very low	30.6	Very low	192 Å²	192	136.7 Å²	136.7	84%	0.835	79%	0.788	S	S	*	*			trans	-176	107.7	148.3	-98.7	147.7	-172.3	177.5	0	110.4
92	T	32.5	Very low	30.5	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.724	79%	0.788	S	S	*	*				61.7	137.1	92.2	66.2	0	0	0	0	115.1
93	R	33.7	Very low	30.1	Very low	235 Å²	235	140.3 Å²	140.3	89%	0.887	79%	0.794	S	S	*	*			cis	-143.6	159.5	23.5	-67.1	178.5	172.1	112.2	-2.1	113.6
94	D	27.4	Very low	30	Very low	150 Å²	150	138.8 Å²	138.8	80%	0.802	80%	0.795	S	S	*	*			trans	-91.7	164.2	168	-34.5	-93.7	0	0	0	112.5
95	L	32.3	Very low	29.7	Very low	177 Å²	177	141.2 Å²	141.2	93%	0.927	80%	0.802	S	S	*	*				179.4	156.7	126	-99.9	162.7	0	0	0	112.7
96	E	26.6	Very low	29.5	Very low	178 Å²	178	140 Å²	140	83%	0.832	80%	0.799	S	S	*	*			trans	-111.5	169.8	-174.4	-61.7	-177.2	106.8	0	0	113.5
97	S	28.4	Very low	29.4	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	81%	0.807	S	S	*	*			trans	92.6	130.4	141.3	76.4	0	0	0	0	122.2
98	S	27.1	Very low	29.2	Very low	95 Å²	95	139.5 Å²	139.5	66%	0.664	80%	0.799	S	S	*	*			trans	72.1	109.5	140.1	51.1	0	0	0	0	124.5
99	L	25.2	Very low	29.1	Very low	153 Å²	153	141.3 Å²	141.3	80%	0.801	79%	0.791	S	S	*	*				85.5	139.8	120.3	-67.6	172.4	0	0	0	123
100	N	28.6	Very low	29	Very low	132 Å²	132	142.9 Å²	142.9	71%	0.706	79%	0.785	S	S	*	*			trans	76	98.6	149	-61.5	-6.7	0	0	0	122
101	T	24.6	Very low	28.8	Very low	137 Å²	137	145.5 Å²	145.5	84%	0.84	79%	0.786	S	S	*	*				16.9	123.4	124.8	55.8	0	0	0	0	120.7
102	A	29.4	Very low	28.6	Very low	101 Å²	101	145.3 Å²	145.3	84%	0.835	79%	0.785	S	S	*	*				-166.1	158.4	129.3	0	0	0	0	0	110.7
103	D	24.1	Very low	28.2	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	79%	0.789	S	S	*	*			trans	-74.6	161.6	178.2	-54.1	-87.8	0	0	0	114.1
104	L	29.2	Very low	27.9	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	79%	0.785	S	S	*	*				-170.3	166.1	123.4	-101.9	165.7	0	0	0	112.5
105	T	24.9	Very low	28	Very low	124 Å²	124	144.9 Å²	144.9	76%	0.761	79%	0.79	S	S	*	*			trans	-127.8	142.8	-155.5	51.6	0	0	0	0	115.8
106	S	30.8	Very low	27.8	Very low	103 Å²	103	145.3 Å²	145.3	72%	0.72	79%	0.787	S	S	*	*			trans	-168.7	115.5	153.8	54.9	0	0	0	0	108.2
107	E	28.2	Very low	28.1	Very low	194 Å²	194	141.8 Å²	141.8	91%	0.907	78%	0.779	S	S	*	*				63.8	126.9	86.7	-66.6	-179.3	169	0	0	113.4
108	S	31.1	Very low	28.2	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	79%	0.787	S	S	*	*			cis	-144.5	-168.4	0	68.7	0	0	0	0	109.8
109	D	30.7	Very low	28.1	Very low	113 Å²	113	152 Å²	152	60%	0.604	80%	0.799	S	S	*	*			cis	-151.7	163.8	5.4	-110.1	-40.5	0	0	0	108.6
110	Q	28.5	Very low	28.4	Very low	167 Å²	167	154.4 Å²	154.4	78%	0.78	81%	0.805	S	S	*	*				52.8	132.5	79.1	-52.1	-172.6	68.7	0	0	115.4
111	E	28.1	Very low	28.2	Very low	160 Å²	160	155.3 Å²	155.3	75%	0.748	80%	0.803	S	S	*	*			cis	-137	-169.9	20.6	-73.2	-168.9	108.3	0	0	114.9
112	F	28.6	Very low	28.3	Very low	187 Å²	187	155 Å²	155	82%	0.82	81%	0.805	S	S	*	*			trans	81.6	72.4	164.7	-75.8	-82.5	0	0	0	120
113	Q	24.5	Very low	28.3	Very low	171 Å²	171	155.6 Å²	155.6	80%	0.799	79%	0.794	S	S	*	*			trans	-81.6	144	139.4	-62.8	-179.6	1.1	0	0	110.3
114	N	27.6	Very low	28.4	Very low	152 Å²	152	154.6 Å²	154.6	81%	0.813	79%	0.788	S	S	*	*			trans	166.9	118.8	132	-94	-51.1	0	0	0	112.8
115	L	28.6	Very low	28.5	Very low	172 Å²	172	156 Å²	156	90%	0.901	79%	0.787	S	S	*	*				160.5	127.5	128.4	-87.4	165.4	0	0	0	110.8
116	H	28.1	Very low	28.6	Very low	186 Å²	186	157.6 Å²	157.6	86%	0.861	79%	0.786	S	S	*	*			trans	-129.6	178.2	-177.2	-128.4	-9.2	0	0	0	110.5
117	P	34.4	Very low	28.6	Very low	103 Å²	103	159.5 Å²	159.5	67%	0.669	79%	0.793	S	S	*	*				-107	174.3	-121.4	41	-33.5	0	0	0	114.7
118	K	29.8	Very low	28.6	Very low	211 Å²	211	156.1 Å²	156.1	92%	0.917	78%	0.78	S	S	*	*			trans	-112.6	127.9	160.9	-76	-174.1	175.4	179.4	0	111.1
119	K	26	Very low	28.7	Very low	207 Å²	207	158.3 Å²	158.3	90%	0.9	79%	0.785	S	S	*	*			trans	-83.6	150.8	166.1	-64	176.4	179	176.5	0	109.3
120	Q	29.7	Very low	28.6	Very low	202 Å²	202	157 Å²	157	94%	0.944	78%	0.784	S	S	*	*			trans	-135	153.7	153.3	-156.9	163.9	11.2	0	0	109
121	K	25	Very low	28.7	Very low	151 Å²	151	155.5 Å²	155.5	66%	0.657	78%	0.781	S	S	*	*			trans	-136.5	135.6	-161.3	175.9	-177.5	-173.6	-85.4	0	109.3	D123	K121-D123 IonicContact NZ-OD1 2.73Å; K121-D123 PolarHBondContact NZ-OD1 2.92Å; K121-D123 IonicContact NZ-OD2 3.16Å; K121-D123 PolarHBondContact NZ-OD2 3.36Å
122	C	26.3	Very low	28.7	Very low	131 Å²	131	153.5 Å²	153.5	89%	0.885	78%	0.78	S	S	*	*			trans	-139.4	139.4	158.9	-87.2	0	0	0	0	110.3
123	D	29.4	Very low	28.7	Very low	114 Å²	114	152.1 Å²	152.1	61%	0.61	78%	0.78	S	S	*	*			trans	-96.2	176.5	-180	-58.7	-85.3	0	0	0	109.1	K121	K121-D123 IonicContact NZ-OD1 2.73Å; K121-D123 PolarHBondContact NZ-OD1 2.92Å; K121-D123 IonicContact NZ-OD2 3.16Å; K121-D123 PolarHBondContact NZ-OD2 3.36Å
124	L	27.3	Very low	28.8	Very low	131 Å²	131	148.9 Å²	148.9	69%	0.686	78%	0.782	S	S	*	*			cis	176.3	140.7	-26.4	169.7	139.3	0	0	0	106.4
125	K	31.2	Very low	28.9	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	78%	0.78	S	S	*	*			trans	-176.1	150.1	146.2	-104.2	155	-170.5	-178.9	0	113
126	Q	27.8	Very low	29.1	Very low	157 Å²	157	146 Å²	146	73%	0.734	78%	0.776	S	S	*	*			trans	-105.2	159.6	-179.1	-52.1	138.5	-76	0	0	110.6
127	V	30.7	Very low	29	Very low	142 Å²	142	144.5 Å²	144.5	86%	0.861	77%	0.774	S	S	*	*			trans	-149.6	141.3	136.8	164.4	0	0	0	0	107.3
128	L	27.8	Very low	28.7	Very low	123 Å²	123	144.8 Å²	144.8	64%	0.644	78%	0.778	S	S	*	*			trans	-97.6	163.7	171.8	-74.3	78.8	0	0	0	108.4
129	D	31.8	Very low	28.5	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	78%	0.779	S	S	*	*				-172.1	169.6	67.3	-109.8	-51.8	0	0	0	116.1
130	S	29.2	Very low	28.7	Very low	84 Å²	84	140.8 Å²	140.8	59%	0.587	77%	0.769	S	S	*	*			trans	-49.8	147.1	179	55.5	0	0	0	0	117.2
131	N	31	Very low	28.6	Very low	136 Å²	136	136 Å²	136	73%	0.727	76%	0.758	S	S	*	*				-172.8	125.4	77.1	-94	-70.7	0	0	0	116.4
132	T	27.2	Very low	28.9	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	77%	0.765	S	S	*	*				51.1	141.9	120.5	-27.2	0	0	0	0	124.2
133	I	29.7	Very low	29	Very low	158 Å²	158	137.2 Å²	137.2	81%	0.81	76%	0.761	S	S	*	*			trans	96.1	87.7	161	-45.5	-174.1	0	0	0	119.3
134	A	26.5	Very low	29	Very low	102 Å²	102	139.1 Å²	139.1	84%	0.843	77%	0.771	S	S	*	*			trans	8.6	138.7	142.3	0	0	0	0	0	123.2
135	G	29.9	Very low	29	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	77%	0.772	S	S	*	*			trans	177.3	73.9	162.7	0	0	0	0	0	118.6
136	K	33	Very low	28.9	Very low	190 Å²	190	134.7 Å²	134.7	83%	0.826	77%	0.773	S	S	*	*			trans	58.1	115.7	159.4	-61.9	178.9	-179	176.2	0	120.4
137	D	26.1	Very low	29	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	78%	0.775	S	S	*	*			trans	49.3	93.4	132.1	-47.4	-29.9	0	0	0	119.6
138	C	27.2	Very low	28.9	Very low	109 Å²	109	135.4 Å²	135.4	74%	0.736	78%	0.776	S	S	*	*			trans	-139.6	107.9	160.6	-85.1	0	0	0	0	110.4	Q140	C138-Q140 HydrophobicContact CB-CG 4.41Å; C138-Q140 PolarHBondContact O-N 2.84Å; C138-Q140 VanDerWaalsContact O-N 3.1Å
139	I	26.2	Very low	28.8	Very low	183 Å²	183	133.3 Å²	133.3	94%	0.938	78%	0.776	S	S	*	*			trans	-76.8	94.1	170	-59.2	176.3	0	0	0	108.1
140	Q	29.2	Very low	28.6	Very low	151 Å²	151	132.6 Å²	132.6	71%	0.706	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.4	120	173.4	-63.4	-168.9	11.8	0	0	110.3	C138	C138-Q140 HydrophobicContact CB-CG 4.41Å; C138-Q140 PolarHBondContact O-N 2.84Å; C138-Q140 VanDerWaalsContact O-N 3.1Å
141	S	28.5	Very low	28.6	Very low	101 Å²	101	136.3 Å²	136.3	71%	0.706	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.8	145.6	168	47.2	0	0	0	0	110.6	K143	S141-K143 PolarHBondContact O-N 3Å
142	P	30.6	Very low	28.3	Very low	123 Å²	123	140.8 Å²	140.8	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-60.7	131.1	179.4	-24	34.5	0	0	0	111.9
143	K	29.4	Very low	28.3	Very low	186 Å²	186	140.2 Å²	140.2	81%	0.809	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-67.9	134.1	177.9	-64.2	176.9	-178.9	176.3	0	110.2	S141 G145	S141-K143 PolarHBondContact O-N 3Å; K143-G145 VanDerWaalsContact C-N 3.33Å; K143-G145 PolarHBondContact O-N 3.35Å
144	N	29	Very low	28.3	Very low	154 Å²	154	140 Å²	140	82%	0.824	79%	0.788	S	S	*	*			trans	-67.3	85.1	175	-80.4	-19.1	0	0	0	111.4
145	G	27.4	Very low	28.2	Very low	67 Å²	67	141.5 Å²	141.5	69%	0.691	79%	0.787	S	S	*	*			trans	-108.5	2	-177.1	0	0	0	0	0	116.1	K143	K143-G145 VanDerWaalsContact C-N 3.33Å; K143-G145 PolarHBondContact O-N 3.35Å
146	L	29.9	Very low	28.1	Very low	170 Å²	170	144.9 Å²	144.9	89%	0.89	79%	0.787	S	S	*	*			trans	-117	11.6	-166	-127.1	80.6	0	0	0	116.1
147	L	29.6	Very low	27.8	Very low	149 Å²	149	141.9 Å²	141.9	78%	0.78	79%	0.79	S	S	*	*			trans	-94.6	-3.6	-176.6	-74.4	169.5	0	0	0	115	A149	L147-A149 PolarHBondContact O-N 3.06Å
148	N	27.7	Very low	28.2	Very low	166 Å²	166	138 Å²	138	89%	0.888	77%	0.772	S	S	*	*			trans	-96.1	40.1	-177.3	-71.2	5.9	0	0	0	113.5
149	A	26.4	Very low	28.3	Very low	78 Å²	78	136.1 Å²	136.1	65%	0.645	76%	0.76	S	S	*	*	S	Bend	trans	-112.5	115.8	172.6	0	0	0	0	0	109.8	L147 F151	L147-A149 PolarHBondContact O-N 3.06Å; A149-F151 PolarHBondContact O-N 2.64Å
150	P	26.3	Very low	28.9	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	74%	0.743	S	S	*	*			trans	-71.5	102.3	-175.6	28.1	-33.9	0	0	0	110.8	R152	P150-R152 PolarHBondContact O-N 2.68Å
151	F	29.3	Very low	29.3	Very low	162 Å²	162	133 Å²	133	71%	0.711	75%	0.747	S	S	*	*			trans	-72.4	102.9	176.6	-152.1	-84.7	0	0	0	109.5	A149 S153	A149-F151 PolarHBondContact O-N 2.64Å; F151-S153 PolarHBondContact O-N 3Å
152	R	26.6	Very low	29.8	Very low	231 Å²	231	134.8 Å²	134.8	87%	0.872	75%	0.745	S	S	*	*			trans	-47.9	129	-177.9	-111.1	178.9	174.2	172.2	-2.3	111.5	P150 E154	P150-R152 PolarHBondContact O-N 2.68Å; R152-E154 PolarHBondContact O-N 2.87Å
153	S	26.7	Very low	30.6	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	72%	0.719	S	S	*	*			trans	-67.4	101.7	-178.1	-50.2	0	0	0	0	112.1	F151 T155	F151-S153 PolarHBondContact O-N 3Å; S153-T155 PolarHBondContact O-N 3.27Å; S153-T155 VanDerWaalsContact O-N 3.12Å
154	E	28.4	Very low	31.2	Very low	153 Å²	153	126.3 Å²	126.3	72%	0.715	70%	0.704	S	S	*	*			trans	-69.4	101.1	161	-70.6	-176.8	140.3	0	0	108.3	R152 L156	R152-E154 PolarHBondContact O-N 2.87Å; E154-L156 PolarHBondContact O-N 3.05Å
155	T	25.5	Very low	32.1	Very low	134 Å²	134	124.4 Å²	124.4	82%	0.822	70%	0.703	S	S	*	*			trans	-70	98.2	-172.9	49.4	0	0	0	0	112.3	S153	S153-T155 PolarHBondContact O-N 3.27Å; S153-T155 VanDerWaalsContact O-N 3.12Å
156	L	28.5	Very low	33.7	Very low	145 Å²	145	122.4 Å²	122.4	76%	0.759	68%	0.678	S	S	*	*			trans	-100.3	111.7	164.1	-76.6	170.3	0	0	0	109.9	E154 V158	E154-L156 PolarHBondContact O-N 3.05Å; L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 3.47Å
157	S	24.9	Very low	35.6	Very low	127 Å²	127	116.6 Å²	116.6	89%	0.888	65%	0.648	S	S	*	*			trans	-75	71	-172.7	58.9	0	0	0	0	113.4
158	V	34.8	Very low	38	Very low	74 Å²	74	111 Å²	111	45%	0.448	62%	0.619	S	S	.	*			trans	-69.7	141.3	151.2	-177.1	0	0	0	0	107.5	L156 S160	L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 3.47Å; V158-S160 VanDerWaalsContact C-N 3.29Å; V158-S160 PolarHBondContact O-N 3.27Å
159	S	30.6	Very low	40.6	Very low	68 Å²	68	103.3 Å²	103.3	48%	0.476	58%	0.578	S	S	.	*			trans	-71	80.5	179.5	-170.9	0	0	0	0	111.7	K161	S159-K161 PolarHBondContact O-N 2.85Å
160	S	37.9	Very low	43.6	Very low	85 Å²	85	101.9 Å²	101.9	59%	0.594	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-59.8	-29	172.8	48	0	0	0	0	112.4	V158 Q162 I163	V158-S160 VanDerWaalsContact C-N 3.29Å; V158-S160 PolarHBondContact O-N 3.27Å; S160-Q162 PolarHBondContact O-N 2.64Å; S160-I163 PolarHBondContact O-N 3.18Å
161	K	37.2	Very low	46.6	Very low	183 Å²	183	99.6 Å²	99.6	80%	0.796	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-60.5	-8.5	-178.4	-68.8	-166.8	173.1	-168.8	0	116.2	S159	S159-K161 PolarHBondContact O-N 2.85Å
162	Q	39.1	Very low	49.5	Very low	140 Å²	140	92.4 Å²	92.4	65%	0.654	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-104.5	-11.5	179.4	-75.9	-179.4	-61.6	0	0	114.9	S160	S160-Q162 PolarHBondContact O-N 2.64Å
163	I	46.6	Very low	52.6	Low	50 Å²	50	81.4 Å²	81.4	26%	0.256	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-17.8	179.2	-60.9	176.6	0	0	0	111.4	S160 S165 Q172	S160-I163 PolarHBondContact O-N 3.18Å; I163-S165 PolarHBondContact O-N 2.67Å; I163-Q172 HydrophobicContact CG2-CG 4.47Å
164	T	42.4	Very low	55.8	Low	81 Å²	81	78.6 Å²	78.6	50%	0.497	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.7	-168.3	48.1	0	0	0	0	116.2	S166	T164-S166 VanDerWaalsContact C-N 3.33Å; T164-S166 PolarHBondContact O-N 2.77Å
165	S	49.1	Very low	58.8	Low	114 Å²	114	75 Å²	75	80%	0.797	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.8	-174.4	60.7	0	0	0	0	115.5	I163	I163-S165 PolarHBondContact O-N 2.67Å
166	S	59.4	Low	62	Low	25 Å²	25	69 Å²	69	18%	0.175	38%	0.384	C	S	.	.			trans	-140.6	125.2	175.2	71.1	0	0	0	0	112.9	T164 N168 K171 Q172	T164-S166 VanDerWaalsContact C-N 3.33Å; T164-S166 PolarHBondContact O-N 2.77Å; S166-N168 PolarHBondContact O-N 3.26Å; S166-K171 WeakPolarHBondContact OG-CB 3.45Å; S166-Q172 WeakPolarHBondContact O-CG 3.31Å; S166-Q172 PolarHBondContact O-NE2 2.96Å
167	L	71.1	Confident	65.1	Low	47 Å²	47	62.1 Å²	62.1	25%	0.246	35%	0.348	C	S	.	.			trans	-81.8	38.4	173	-151.6	82.8	0	0	0	111.5	E546	L167-E546 HydrophobicContact CD1-CG 3.84Å
168	N	79.8	Confident	68.4	Low	31 Å²	31	59.6 Å²	59.6	17%	0.166	32%	0.321	C	S	.	.			trans	-125.2	109.5	-177.6	-177.7	-28.7	0	0	0	109.1	S166 L170 K171 Q172	S166-N168 PolarHBondContact O-N 3.26Å; N168-L170 PolarHBondContact O-N 2.8Å; N168-L170 VanDerWaalsContact O-N 3.15Å; N168-L170 WeakPolarHBondContact OD1-CB 3.42Å; N168-L170 PolarHBondContact OD1-N 2.89Å; N168-K171 HydrophobicContact CB-CB 4.2Å; N168-K171 HydrophobicContact CB-CD 4.42Å; N168-K171 HydrophobicContact CB-CG 4.25Å; N168-K171 PolarHBondContact O-N 2.98Å; N168-K171 PolarHBondContact OD1-N 2.89Å; N168-Q172 PolarHBondContact O-N 3.18Å
169	P	82.9	Confident	71	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-24.1	-175.6	24.9	-35.1	0	0	0	113.2	G173 L284 T574	P169-G173 PolarHBondContact O-N 2.71Å; P169-L284 HydrophobicContact CB-CD2 4.04Å; P169-T574 WeakPolarHBondContact CG-OG1 3.24Å
170	L	88.8	Confident	73.9	Confident	49 Å²	49	55.8 Å²	55.8	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-72.9	-38.6	174.1	-62.8	176	0	0	0	112.2	N168 E174 E287 Y288 T574	N168-L170 PolarHBondContact O-N 2.8Å; N168-L170 VanDerWaalsContact O-N 3.15Å; N168-L170 WeakPolarHBondContact OD1-CB 3.42Å; N168-L170 PolarHBondContact OD1-N 2.89Å; L170-E174 WeakPolarHBondContact O-CB 3.27Å; L170-E174 PolarHBondContact O-N 3.43Å; L170-E287 VanDerWaalsContact CD2-O 3.32Å; L170-E287 WeakPolarHBondContact CD2-O 3.47Å; L170-Y288 WeakPolarHBondContact O-CD2 3.42Å; L170-T574 HydrophobicContact CD1-CG2 4.13Å; L170-T574 HydrophobicContact CD2-CG2 3.82Å; L170-T574 HydrophobicContact CG-CG2 3.88Å
171	K	90	Very high	76.5	Confident	82 Å²	82	51.8 Å²	51.8	36%	0.357	26%	0.263	S	S	.	.	H	α-helix	trans	-66.6	-46.6	172.5	-76.1	-171.9	172.9	-175.3	0	110.2	S166 N168 E174 Q175 D736	S166-K171 WeakPolarHBondContact OG-CB 3.45Å; N168-K171 HydrophobicContact CB-CB 4.2Å; N168-K171 HydrophobicContact CB-CD 4.42Å; N168-K171 HydrophobicContact CB-CG 4.25Å; N168-K171 PolarHBondContact O-N 2.98Å; N168-K171 PolarHBondContact OD1-N 2.89Å; K171-E174 PolarHBondContact O-N 2.82Å; K171-Q175 WeakPolarHBondContact O-CB 3.29Å; K171-Q175 PolarHBondContact O-N 2.7Å; K171-D736 IonicContact NZ-OD2 2.67Å; K171-D736 PolarHBondContact NZ-OD2 3.23Å
172	Q	89	Confident	79	Confident	11 Å²	11	47.9 Å²	47.9	5%	0.051	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-44.7	177.7	-67.4	-179.1	4.4	0	0	112.6	I163 S166 N168 E174 Q175 L176 L284	I163-Q172 HydrophobicContact CG2-CG 4.47Å; S166-Q172 WeakPolarHBondContact O-CG 3.31Å; S166-Q172 PolarHBondContact O-NE2 2.96Å; N168-Q172 PolarHBondContact O-N 3.18Å; Q172-E174 VanDerWaalsContact C-N 3.35Å; Q172-Q175 PolarHBondContact O-N 2.71Å; Q172-L176 WeakPolarHBondContact O-CB 3.43Å; Q172-L176 PolarHBondContact O-N 2.91Å; Q172-L284 HydrophobicContact CB-CD1 3.98Å; Q172-L284 HydrophobicContact CB-CD2 3.88Å
173	G	91.8	Very high	81.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.2	-32.1	177	0	0	0	0	0	113.5	P169 L177	P169-G173 PolarHBondContact O-N 2.71Å; G173-L177 WeakPolarHBondContact O-CB 3.34Å; G173-L177 PolarHBondContact O-N 2.99Å
174	E	93.7	Very high	83.7	Confident	47 Å²	47	45.9 Å²	45.9	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-44.9	170.8	-165.8	162.5	109.3	0	0	112.2	L170 K171 Q172 L177 K178 L186 Y288	L170-E174 WeakPolarHBondContact O-CB 3.27Å; L170-E174 PolarHBondContact O-N 3.43Å; K171-E174 PolarHBondContact O-N 2.82Å; Q172-E174 VanDerWaalsContact C-N 3.35Å; E174-L177 PolarHBondContact O-N 3.42Å; E174-K178 HydrophobicContact CG-CD 4.42Å; E174-K178 WeakPolarHBondContact O-CG 3.46Å; E174-K178 PolarHBondContact O-N 2.97Å; E174-K178 WeakPolarHBondContact OE1-CE 3.46Å; E174-K178 IonicContact OE1-NZ 2.67Å; E174-K178 PolarHBondContact OE1-NZ 2.81Å; E174-L186 HydrophobicContact CG-CD2 3.53Å; E174-Y288 HydrophobicContact CB-CD2 4Å; E174-Y288 HydrophobicContact CB-CE2 3.37Å; E174-Y288 HydrophobicContact CG-CE2 3.72Å; E174-Y288 WeakPolarHBondContact CG-OH 3.31Å; E174-Y288 VanDerWaalsContact OE2-CE2 3.31Å; E174-Y288 WeakPolarHBondContact OE2-CE2 3.34Å; E174-Y288 PolarHBondContact OE2-OH 3.36Å
175	Q	92.2	Very high	86.1	Confident	76 Å²	76	44.3 Å²	44.3	36%	0.355	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-46.2	179.1	176.3	52.7	31.5	0	0	111.2	K171 Q172 L177 K178 E179	K171-Q175 WeakPolarHBondContact O-CB 3.29Å; K171-Q175 PolarHBondContact O-N 2.7Å; Q172-Q175 PolarHBondContact O-N 2.71Å; Q175-L177 VanDerWaalsContact C-N 3.29Å; Q175-L177 PolarHBondContact O-N 3.2Å; Q175-K178 WeakPolarHBondContact O-CB 3.38Å; Q175-K178 PolarHBondContact O-N 2.81Å; Q175-K178 VanDerWaalsContact O-N 3.14Å; Q175-E179 WeakPolarHBondContact CG-OE1 3.45Å; Q175-E179 PolarHBondContact NE2-OE1 3.04Å; Q175-E179 WeakPolarHBondContact O-CG 3.45Å; Q175-E179 PolarHBondContact O-N 2.99Å
176	L	92.5	Very high	88.3	Confident	9 Å²	9	39.2 Å²	39.2	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-58.2	-39.3	172.8	176.2	62.1	0	0	0	112.1	Q172 E179 I180 W211 R281 L284 L285	Q172-L176 WeakPolarHBondContact O-CB 3.43Å; Q172-L176 PolarHBondContact O-N 2.91Å; L176-E179 PolarHBondContact O-N 3.48Å; L176-I180 HydrophobicContact CD1-CD1 4.17Å; L176-I180 HydrophobicContact CD1-CG1 4.4Å; L176-I180 HydrophobicContact CG-CD1 3.95Å; L176-I180 WeakPolarHBondContact O-CD1 3.42Å; L176-I180 WeakPolarHBondContact O-CG1 3.46Å; L176-I180 PolarHBondContact O-N 3.35Å; L176-W211 HydrophobicContact CD1-CH2 4.45Å; L176-W211 HydrophobicContact CD1-CZ2 4.16Å; L176-R281 HydrophobicContact CD1-CG 4.18Å; L176-R281 HydrophobicContact CD2-CB 3.83Å; L176-R281 HydrophobicContact CD2-CG 4.1Å; L176-R281 VanDerWaalsContact CD2-O 3.24Å; L176-R281 WeakPolarHBondContact CD2-O 3.39Å; L176-L284 HydrophobicContact CD2-CB 4.05Å; L176-L284 HydrophobicContact CD2-CD1 4.3Å; L176-L285 HydrophobicContact CD2-CD2 4.34Å; L176-L285 HydrophobicContact CD2-CG 4.09Å; L176-L285 HydrophobicContact CG-CD2 4.46Å
177	L	94	Very high	90	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.1	-34.2	177.1	-174.2	59.9	0	0	0	112.5	G173 E174 Q175 I180 L181 L186 F190 L285 Y288 F289 F317	G173-L177 WeakPolarHBondContact O-CB 3.34Å; G173-L177 PolarHBondContact O-N 2.99Å; E174-L177 PolarHBondContact O-N 3.42Å; Q175-L177 VanDerWaalsContact C-N 3.29Å; Q175-L177 PolarHBondContact O-N 3.2Å; L177-I180 PolarHBondContact O-N 3.12Å; L177-L181 HydrophobicContact CD1-CD1 4.06Å; L177-L181 HydrophobicContact CD1-CG 4.3Å; L177-L181 HydrophobicContact CG-CD1 3.98Å; L177-L181 WeakPolarHBondContact O-CB 3.39Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.49Å; L177-L181 PolarHBondContact O-N 2.66Å; L177-L186 HydrophobicContact CD2-CD1 3.59Å; L177-L186 HydrophobicContact CG-CD1 3.77Å; L177-F190 HydrophobicContact CD2-CE2 4.43Å; L177-F190 HydrophobicContact CD2-CZ 4.22Å; L177-L285 HydrophobicContact CB-CD2 4.18Å; L177-L285 HydrophobicContact CD1-CD2 4.33Å; L177-Y288 HydrophobicContact CD2-CD1 3.89Å; L177-Y288 HydrophobicContact CD2-CE1 3.51Å; L177-F289 HydrophobicContact CD1-CE2 4.39Å; L177-F289 HydrophobicContact CD2-CE2 3.71Å; L177-F289 HydrophobicContact CD2-CZ 3.68Å; L177-F317 HydrophobicContact CD1-CE2 4.48Å; L177-F317 HydrophobicContact CD1-CZ 4.2Å
178	K	93.2	Very high	91.1	Very high	75 Å²	75	45.2 Å²	45.2	33%	0.326	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-45.5	170.8	-71.5	166.8	-176	164.3	0	111	E174 Q175 I180 L181 E182 L186	E174-K178 HydrophobicContact CG-CD 4.42Å; E174-K178 WeakPolarHBondContact O-CG 3.46Å; E174-K178 PolarHBondContact O-N 2.97Å; E174-K178 WeakPolarHBondContact OE1-CE 3.46Å; E174-K178 IonicContact OE1-NZ 2.67Å; E174-K178 PolarHBondContact OE1-NZ 2.81Å; Q175-K178 WeakPolarHBondContact O-CB 3.38Å; Q175-K178 PolarHBondContact O-N 2.81Å; Q175-K178 VanDerWaalsContact O-N 3.14Å; K178-I180 VanDerWaalsContact C-N 3.34Å; K178-I180 PolarHBondContact O-N 3.06Å; K178-L181 PolarHBondContact O-N 2.84Å; K178-L181 VanDerWaalsContact O-N 3.15Å; K178-E182 PolarHBondContact O-N 3.37Å; K178-L186 HydrophobicContact CD-CD2 4.5Å; K178-L186 HydrophobicContact CG-CB 4.11Å; K178-L186 HydrophobicContact CG-CD2 4.1Å
179	E	90.5	Very high	91.8	Very high	56 Å²	56	43.7 Å²	43.7	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-61.1	-38.3	174.1	-70	166.5	-156.5	0	0	112.9	Q175 L176 L181 R203	Q175-E179 WeakPolarHBondContact CG-OE1 3.45Å; Q175-E179 PolarHBondContact NE2-OE1 3.04Å; Q175-E179 WeakPolarHBondContact O-CG 3.45Å; Q175-E179 PolarHBondContact O-N 2.99Å; L176-E179 PolarHBondContact O-N 3.48Å; E179-L181 VanDerWaalsContact C-N 3.32Å; E179-L181 PolarHBondContact O-N 2.82Å; E179-R203 PolarHBondContact O-NH2 3.15Å
180	I	91.4	Very high	92.5	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-32.6	175.4	-70.3	162.9	0	0	0	111.7	L176 L177 K178 R203 W211 L285 L353	L176-I180 HydrophobicContact CD1-CD1 4.17Å; L176-I180 HydrophobicContact CD1-CG1 4.4Å; L176-I180 HydrophobicContact CG-CD1 3.95Å; L176-I180 WeakPolarHBondContact O-CD1 3.42Å; L176-I180 WeakPolarHBondContact O-CG1 3.46Å; L176-I180 PolarHBondContact O-N 3.35Å; L177-I180 PolarHBondContact O-N 3.12Å; K178-I180 VanDerWaalsContact C-N 3.34Å; K178-I180 PolarHBondContact O-N 3.06Å; I180-R203 VanDerWaalsContact C-NH2 3.33Å; I180-R203 PolarHBondContact O-NH2 3.32Å; I180-W211 HydrophobicContact CD1-CH2 3.79Å; I180-W211 HydrophobicContact CD1-CZ2 3.57Å; I180-W211 HydrophobicContact CG1-CH2 4.43Å; I180-W211 HydrophobicContact CG1-CZ2 3.71Å; I180-L285 HydrophobicContact CD1-CD1 3.9Å; I180-L285 HydrophobicContact CD1-CD2 4.12Å; I180-L353 HydrophobicContact CG2-CD1 3.89Å; I180-L353 HydrophobicContact CG2-CD2 4.02Å
181	L	92.6	Very high	92.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-95	-17.2	-175.3	-69.3	170.4	0	0	0	114.9	L177 K178 E179 I184 L186 F189 L199 F317 L353	L177-L181 HydrophobicContact CD1-CD1 4.06Å; L177-L181 HydrophobicContact CD1-CG 4.3Å; L177-L181 HydrophobicContact CG-CD1 3.98Å; L177-L181 WeakPolarHBondContact O-CB 3.39Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.49Å; L177-L181 PolarHBondContact O-N 2.66Å; K178-L181 PolarHBondContact O-N 2.84Å; K178-L181 VanDerWaalsContact O-N 3.15Å; E179-L181 VanDerWaalsContact C-N 3.32Å; E179-L181 PolarHBondContact O-N 2.82Å; L181-I184 WeakPolarHBondContact O-CB 3.32Å; L181-I184 PolarHBondContact O-N 2.9Å; L181-L186 HydrophobicContact CD1-CD1 3.68Å; L181-F189 HydrophobicContact CD1-CB 3.82Å; L181-F189 HydrophobicContact CD1-CD1 3.84Å; L181-F189 HydrophobicContact CD1-CD2 4.34Å; L181-F189 HydrophobicContact CD1-CG 3.72Å; L181-F189 HydrophobicContact CD2-CB 4.45Å; L181-F189 HydrophobicContact CD2-CD2 3.82Å; L181-F189 HydrophobicContact CD2-CE2 4.22Å; L181-F189 HydrophobicContact CD2-CG 4.05Å; L181-L199 HydrophobicContact CD2-CD2 4.37Å; L181-F317 HydrophobicContact CD2-CE1 4.28Å; L181-L353 HydrophobicContact CD2-CD2 3.89Å
182	E	89.3	Confident	92.9	Very high	102 Å²	102	50.1 Å²	50.1	48%	0.477	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	125.9	-176.5	-172.5	-162.3	165	0	0	112.4	K178 V201 R203	K178-E182 PolarHBondContact O-N 3.37Å; E182-V201 WeakPolarHBondContact O-CG1 3.24Å; E182-R203 VanDerWaalsContact O-CZ 3.24Å; E182-R203 PolarHBondContact O-NE 3.29Å; E182-R203 PolarHBondContact O-NH2 3.33Å
183	P	90.9	Very high	93.1	Very high	103 Å²	103	50.3 Å²	50.3	67%	0.669	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	cis	-93.8	10.4	13.3	37.1	-38.7	0	0	0	116
184	I	92.4	Very high	93.2	Very high	44 Å²	44	51.1 Å²	51.1	23%	0.226	25%	0.253	C	S	.	.	S	Bend	trans	-76.3	129	-179.1	-53.8	-58.2	0	0	0	110.4	L181 E188 L199 V201	L181-I184 WeakPolarHBondContact O-CB 3.32Å; L181-I184 PolarHBondContact O-N 2.9Å; I184-E188 HydrophobicContact CG2-CG 4.45Å; I184-L199 HydrophobicContact CB-CD2 4.49Å; I184-L199 HydrophobicContact CG1-CD1 4.36Å; I184-L199 HydrophobicContact CG1-CD2 4.26Å; I184-L199 HydrophobicContact CG2-CD2 4.16Å; I184-V201 HydrophobicContact CG1-CG1 4.32Å; I184-V201 HydrophobicContact CG1-CG2 3.88Å
185	A	94	Very high	93.1	Very high	49 Å²	49	52.9 Å²	52.9	41%	0.405	26%	0.261	S	S	.	.			trans	-64.7	141.7	176.6	0	0	0	0	0	111.4	E187 E188 F189	A185-E187 VanDerWaalsContact C-N 3.3Å; A185-E187 PolarHBondContact O-N 2.91Å; A185-E188 HydrophobicContact CB-CB 4.13Å; A185-E188 WeakPolarHBondContact O-CB 3.41Å; A185-E188 PolarHBondContact O-N 2.82Å; A185-E188 VanDerWaalsContact O-N 3.12Å; A185-F189 PolarHBondContact O-N 2.8Å
186	L	94.4	Very high	93	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-39.1	-175.3	-178.6	63	0	0	0	112	E174 L177 K178 L181 E188 F189 F190	E174-L186 HydrophobicContact CG-CD2 3.53Å; L177-L186 HydrophobicContact CD2-CD1 3.59Å; L177-L186 HydrophobicContact CG-CD1 3.77Å; K178-L186 HydrophobicContact CD-CD2 4.5Å; K178-L186 HydrophobicContact CG-CB 4.11Å; K178-L186 HydrophobicContact CG-CD2 4.1Å; L181-L186 HydrophobicContact CD1-CD1 3.68Å; L186-E188 VanDerWaalsContact C-N 3.3Å; L186-E188 PolarHBondContact O-N 2.62Å; L186-F189 PolarHBondContact O-N 2.92Å; L186-F190 HydrophobicContact CD1-CD2 3.99Å; L186-F190 HydrophobicContact CD1-CE2 3.56Å; L186-F190 HydrophobicContact CD1-CZ 4.45Å; L186-F190 HydrophobicContact CD2-CE2 4.4Å; L186-F190 HydrophobicContact CG-CD2 4Å; L186-F190 HydrophobicContact CG-CE2 3.84Å; L186-F190 VanDerWaalsContact O-CD2 3.26Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.29Å
187	E	94.9	Very high	93.1	Very high	123 Å²	123	56.2 Å²	56.2	58%	0.575	28%	0.279	S	S	*	.	H	α-helix	trans	-66.2	-36.2	177.9	-61.3	64.2	-138.9	0	0	110.5	A185 R191	A185-E187 VanDerWaalsContact C-N 3.3Å; A185-E187 PolarHBondContact O-N 2.91Å; E187-R191 WeakPolarHBondContact O-CB 3.26Å; E187-R191 PolarHBondContact O-N 2.93Å
188	E	94.4	Very high	93.1	Very high	75 Å²	75	57.8 Å²	57.8	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-69.3	-45.6	174.2	176.7	156.4	-119.7	0	0	111.7	I184 A185 L186 F190 R191 V192	I184-E188 HydrophobicContact CG2-CG 4.45Å; A185-E188 HydrophobicContact CB-CB 4.13Å; A185-E188 WeakPolarHBondContact O-CB 3.41Å; A185-E188 PolarHBondContact O-N 2.82Å; A185-E188 VanDerWaalsContact O-N 3.12Å; L186-E188 VanDerWaalsContact C-N 3.3Å; L186-E188 PolarHBondContact O-N 2.62Å; E188-F190 VanDerWaalsContact C-N 3.33Å; E188-F190 PolarHBondContact O-N 3.47Å; E188-R191 PolarHBondContact O-N 2.95Å; E188-R191 VanDerWaalsContact O-N 3.15Å; E188-R191 IonicContact OE1-NH2 2.68Å; E188-R191 PolarHBondContact OE1-NH2 3.3Å; E188-R191 VanDerWaalsContact OE1-NH2 3.16Å; E188-V192 HydrophobicContact CG-CB 4.5Å; E188-V192 HydrophobicContact CG-CG2 3.98Å; E188-V192 WeakPolarHBondContact O-CB 3.17Å; E188-V192 PolarHBondContact O-N 2.78Å
189	F	96.1	Very high	93.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.279	C	S	.	.	I	π-helix	trans	-53.9	-49.6	174.8	168.2	-101.6	0	0	0	111.4	L181 A185 L186 N193 Y194 L199 F317 Y355	L181-F189 HydrophobicContact CD1-CB 3.82Å; L181-F189 HydrophobicContact CD1-CD1 3.84Å; L181-F189 HydrophobicContact CD1-CD2 4.34Å; L181-F189 HydrophobicContact CD1-CG 3.72Å; L181-F189 HydrophobicContact CD2-CB 4.45Å; L181-F189 HydrophobicContact CD2-CD2 3.82Å; L181-F189 HydrophobicContact CD2-CE2 4.22Å; L181-F189 HydrophobicContact CD2-CG 4.05Å; A185-F189 PolarHBondContact O-N 2.8Å; L186-F189 PolarHBondContact O-N 2.92Å; F189-N193 HydrophobicContact CD2-CB 4.02Å; F189-N193 HydrophobicContact CE2-CB 4.34Å; F189-N193 PolarHBondContact O-N 2.95Å; F189-Y194 AromaticContact CE1-CD2 3.8Å; F189-Y194 HydrophobicContact CE1-CD2 3.8Å; F189-Y194 HydrophobicContact CE1-CG 4.18Å; F189-Y194 AromaticContact CZ-CD2 3.83Å; F189-Y194 HydrophobicContact CZ-CD2 3.83Å; F189-Y194 HydrophobicContact CZ-CG 4.43Å; F189-Y194 PolarHBondContact O-N 3.02Å; F189-L199 HydrophobicContact CD2-CD2 3.87Å; F189-F317 HydrophobicContact CE1-CZ 4.29Å; F189-F317 HydrophobicContact CE2-CE1 4.04Å; F189-F317 HydrophobicContact CE2-CZ 4.21Å; F189-F317 AromaticContact CZ-CE1 3.96Å; F189-F317 HydrophobicContact CZ-CE1 3.96Å; F189-F317 AromaticContact CZ-CZ 3.65Å; F189-F317 HydrophobicContact CZ-CZ 3.65Å; F189-Y355 AromaticContact CE2-CD1 3.76Å; F189-Y355 HydrophobicContact CE2-CD1 3.76Å; F189-Y355 HydrophobicContact CE2-CD2 4.11Å; F189-Y355 HydrophobicContact CE2-CE1 4.01Å; F189-Y355 HydrophobicContact CE2-CE2 4.34Å; F189-Y355 AromaticContact CE2-CG 3.81Å; F189-Y355 HydrophobicContact CE2-CG 3.81Å; F189-Y355 HydrophobicContact CZ-CD1 4.38Å; F189-Y355 HydrophobicContact CZ-CD2 4.14Å; F189-Y355 HydrophobicContact CZ-CE1 4.28Å; F189-Y355 HydrophobicContact CZ-CE2 4.04Å; F189-Y355 HydrophobicContact CZ-CG 4.31Å
190	F	95.7	Very high	93.4	Very high	42 Å²	42	54.9 Å²	54.9	18%	0.184	28%	0.277	C	S	.	.	I	π-helix	trans	-66.3	-37.9	177.3	-76.5	-60.5	0	0	0	113	L177 L186 E188 Y194 K196 Y288 F289	L177-F190 HydrophobicContact CD2-CE2 4.43Å; L177-F190 HydrophobicContact CD2-CZ 4.22Å; L186-F190 HydrophobicContact CD1-CD2 3.99Å; L186-F190 HydrophobicContact CD1-CE2 3.56Å; L186-F190 HydrophobicContact CD1-CZ 4.45Å; L186-F190 HydrophobicContact CD2-CE2 4.4Å; L186-F190 HydrophobicContact CG-CD2 4Å; L186-F190 HydrophobicContact CG-CE2 3.84Å; L186-F190 VanDerWaalsContact O-CD2 3.26Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.29Å; E188-F190 VanDerWaalsContact C-N 3.33Å; E188-F190 PolarHBondContact O-N 3.47Å; F190-Y194 AromaticContact CD1-CD1 3.55Å; F190-Y194 HydrophobicContact CD1-CD1 3.55Å; F190-Y194 HydrophobicContact CD1-CD2 4.36Å; F190-Y194 HydrophobicContact CD1-CE1 4.08Å; F190-Y194 AromaticContact CD1-CG 3.69Å; F190-Y194 HydrophobicContact CD1-CG 3.69Å; F190-Y194 AromaticContact CE1-CD1 3.9Å; F190-Y194 HydrophobicContact CE1-CD1 3.9Å; F190-Y194 HydrophobicContact CE1-CD2 4.24Å; F190-Y194 HydrophobicContact CE1-CE1 4Å; F190-Y194 HydrophobicContact CE1-CE2 4.37Å; F190-Y194 AromaticContact CE1-CG 4Å; F190-Y194 HydrophobicContact CE1-CG 4Å; F190-K196 PolarHBondContact O-NZ 3.17Å; F190-Y288 HydrophobicContact CE2-CE1 4.48Å; F190-Y288 HydrophobicContact CZ-CE1 4.3Å; F190-F289 HydrophobicContact CE1-CE1 4.04Å; F190-F289 HydrophobicContact CE1-CZ 4.49Å; F190-F289 HydrophobicContact CZ-CE1 4.09Å; F190-F289 HydrophobicContact CZ-CZ 4.22Å
191	R	94.7	Very high	93.5	Very high	168 Å²	168	54.8 Å²	54.8	63%	0.634	28%	0.277	S	S	*	.	I	π-helix	trans	-68.7	-42.9	178.6	-178.3	-178.3	67	-164.9	-2.2	112.9	E187 E188 K196	E187-R191 WeakPolarHBondContact O-CB 3.26Å; E187-R191 PolarHBondContact O-N 2.93Å; E188-R191 PolarHBondContact O-N 2.95Å; E188-R191 VanDerWaalsContact O-N 3.15Å; E188-R191 IonicContact OE1-NH2 2.68Å; E188-R191 PolarHBondContact OE1-NH2 3.3Å; E188-R191 VanDerWaalsContact OE1-NH2 3.16Å; R191-K196 PolarHBondContact O-NZ 3.12Å
192	V	92.5	Very high	93.4	Very high	61 Å²	61	62.1 Å²	62.1	37%	0.37	31%	0.309	S	S	.	.	I	π-helix	trans	-106.9	-45.8	-165.7	-177.4	0	0	0	0	112.9	E188 K196 T197	E188-V192 HydrophobicContact CG-CB 4.5Å; E188-V192 HydrophobicContact CG-CG2 3.98Å; E188-V192 WeakPolarHBondContact O-CB 3.17Å; E188-V192 PolarHBondContact O-N 2.78Å; V192-K196 WeakPolarHBondContact O-CB 3.43Å; V192-K196 WeakPolarHBondContact O-CD 3.25Å; V192-T197 PolarHBondContact O-OG1 2.75Å
193	N	94	Very high	93.1	Very high	14 Å²	14	59 Å²	59	8%	0.075	29%	0.293	C	S	.	.	I	π-helix	trans	-103.8	-44.9	-166.2	-56.2	106	0	0	0	113.5	F189 Q195 K196 T197 L199 Y355	F189-N193 HydrophobicContact CD2-CB 4.02Å; F189-N193 HydrophobicContact CE2-CB 4.34Å; F189-N193 PolarHBondContact O-N 2.95Å; N193-Q195 PolarHBondContact O-N 2.84Å; N193-K196 WeakPolarHBondContact O-CA 3.25Å; N193-K196 WeakPolarHBondContact O-CB 3.38Å; N193-K196 PolarHBondContact O-N 3.41Å; N193-T197 PolarHBondContact ND2-OG1 3.44Å; N193-T197 VanDerWaalsContact ND2-OG1 3.15Å; N193-T197 PolarHBondContact O-N 3.19Å; N193-T197 VanDerWaalsContact O-O 3.04Å; N193-L199 HydrophobicContact CB-CB 4.04Å; N193-L199 HydrophobicContact CB-CD2 4.46Å; N193-Y355 HydrophobicContact CB-CD1 4.45Å
194	Y	94.4	Very high	91.9	Very high	17 Å²	17	60.4 Å²	60.4	7%	0.067	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	121.8	-173.4	-174.5	-118.9	0	0	0	112.5	F189 F190 K196 F289 D315 Y355 F381 N382	F189-Y194 AromaticContact CE1-CD2 3.8Å; F189-Y194 HydrophobicContact CE1-CD2 3.8Å; F189-Y194 HydrophobicContact CE1-CG 4.18Å; F189-Y194 AromaticContact CZ-CD2 3.83Å; F189-Y194 HydrophobicContact CZ-CD2 3.83Å; F189-Y194 HydrophobicContact CZ-CG 4.43Å; F189-Y194 PolarHBondContact O-N 3.02Å; F190-Y194 AromaticContact CD1-CD1 3.55Å; F190-Y194 HydrophobicContact CD1-CD1 3.55Å; F190-Y194 HydrophobicContact CD1-CD2 4.36Å; F190-Y194 HydrophobicContact CD1-CE1 4.08Å; F190-Y194 AromaticContact CD1-CG 3.69Å; F190-Y194 HydrophobicContact CD1-CG 3.69Å; F190-Y194 AromaticContact CE1-CD1 3.9Å; F190-Y194 HydrophobicContact CE1-CD1 3.9Å; F190-Y194 HydrophobicContact CE1-CD2 4.24Å; F190-Y194 HydrophobicContact CE1-CE1 4Å; F190-Y194 HydrophobicContact CE1-CE2 4.37Å; F190-Y194 AromaticContact CE1-CG 4Å; F190-Y194 HydrophobicContact CE1-CG 4Å; Y194-K196 WeakPolarHBondContact O-CD 3.35Å; Y194-K196 VanDerWaalsContact O-CG 3.31Å; Y194-K196 WeakPolarHBondContact O-CG 3.31Å; Y194-K196 PolarHBondContact O-N 2.95Å; Y194-F289 AromaticContact CE2-CE1 3.95Å; Y194-F289 HydrophobicContact CE2-CE1 3.95Å; Y194-D315 WeakPolarHBondContact CE2-OD2 3.37Å; Y194-Y355 WeakPolarHBondContact CD2-OH 3.42Å; Y194-F381 AromaticContact CE2-CE2 3.92Å; Y194-F381 HydrophobicContact CE2-CE2 3.92Å; Y194-F381 HydrophobicContact CE2-CZ 4.23Å; Y194-N382 PolarHBondContact OH-ND2 2.97Å
195	Q	90.9	Very high	90.5	Very high	84 Å²	84	60.7 Å²	60.7	39%	0.393	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	12.7	-174.8	-59	-175.6	-1.2	0	0	115.4	N193 D315 Y355 N382	N193-Q195 PolarHBondContact O-N 2.84Å; Q195-D315 WeakPolarHBondContact CG-OD2 3.39Å; Q195-Y355 PolarHBondContact N-OH 2.78Å; Q195-N382 PolarHBondContact NE2-ND2 3.46Å; Q195-N382 VanDerWaalsContact NE2-ND2 3.16Å
196	K	91.2	Very high	88.8	Confident	97 Å²	97	62.4 Å²	62.4	42%	0.422	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-64.1	-172.4	-67.1	151.7	-170.4	166.6	0	112	F190 R191 V192 N193 Y194	F190-K196 PolarHBondContact O-NZ 3.17Å; R191-K196 PolarHBondContact O-NZ 3.12Å; V192-K196 WeakPolarHBondContact O-CB 3.43Å; V192-K196 WeakPolarHBondContact O-CD 3.25Å; N193-K196 WeakPolarHBondContact O-CA 3.25Å; N193-K196 WeakPolarHBondContact O-CB 3.38Å; N193-K196 PolarHBondContact O-N 3.41Å; Y194-K196 WeakPolarHBondContact O-CD 3.35Å; Y194-K196 VanDerWaalsContact O-CG 3.31Å; Y194-K196 WeakPolarHBondContact O-CG 3.31Å; Y194-K196 PolarHBondContact O-N 2.95Å
197	T	92.9	Very high	86.9	Confident	59 Å²	59	69.8 Å²	69.8	36%	0.362	35%	0.351	S	S	.	.	S	Bend	trans	-138.6	148.8	-171.2	59.7	0	0	0	0	111.5	V192 N193	V192-T197 PolarHBondContact O-OG1 2.75Å; N193-T197 PolarHBondContact ND2-OG1 3.44Å; N193-T197 VanDerWaalsContact ND2-OG1 3.15Å; N193-T197 PolarHBondContact O-N 3.19Å; N193-T197 VanDerWaalsContact O-O 3.04Å
198	P	95.1	Very high	85.1	Confident	33 Å²	33	64.4 Å²	64.4	21%	0.214	33%	0.328	C	S	.	.			trans	-61.9	152	170.2	-19.8	32.1	0	0	0	112.1	I329 Y355 F360	P198-I329 HydrophobicContact CB-CD1 3.82Å; P198-I329 HydrophobicContact CG-CD1 4.23Å; P198-I329 HydrophobicContact CG-CG2 3.87Å; P198-Y355 CarbonylContact C-O 3.55Å; P198-Y355 WeakPolarHBondContact CA-O 3.36Å; P198-Y355 WeakPolarHBondContact CB-O 3.14Å; P198-F360 HydrophobicContact CG-CD1 3.93Å; P198-F360 HydrophobicContact CG-CE1 3.86Å; P198-F360 HydrophobicContact CG-CG 4.43Å; P198-F360 HydrophobicContact CG-CZ 4.31Å
199	L	95.4	Very high	83.5	Confident	23 Å²	23	61.8 Å²	61.8	12%	0.12	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.3	176.4	174	65.6	0	0	0	109.8	L181 I184 F189 N193 V201 L354 Y355	L181-L199 HydrophobicContact CD2-CD2 4.37Å; I184-L199 HydrophobicContact CB-CD2 4.49Å; I184-L199 HydrophobicContact CG1-CD1 4.36Å; I184-L199 HydrophobicContact CG1-CD2 4.26Å; I184-L199 HydrophobicContact CG2-CD2 4.16Å; F189-L199 HydrophobicContact CD2-CD2 3.87Å; N193-L199 HydrophobicContact CB-CB 4.04Å; N193-L199 HydrophobicContact CB-CD2 4.46Å; L199-V201 HydrophobicContact CD2-CG2 3.99Å; L199-V201 HydrophobicContact CG-CG2 4Å; L199-L354 CarbonylContact O-C 3.56Å; L199-L354 WeakPolarHBondContact O-CA 3.38Å; L199-Y355 PolarHBondContact N-O 2.88Å; L199-Y355 PolarHBondContact O-N 3.45Å
200	H	95	Very high	82.4	Confident	47 Å²	47	66.8 Å²	66.8	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.4	172.1	176.6	-164.1	0	0	0	109.5	K202 V346 K347 L348 D352 L353 L354	H200-K202 VanDerWaalsContact CE1-CE 3.47Å; H200-K202 WeakPolarHBondContact CE1-CE 3.25Å; H200-K202 WeakPolarHBondContact CE1-CG 3.4Å; H200-K202 WeakPolarHBondContact NE2-CG 3.23Å; H200-V346 HydrophobicContact CB-CG1 4.41Å; H200-V346 HydrophobicContact CB-CG2 4.32Å; H200-V346 WeakPolarHBondContact ND1-CG1 3.46Å; H200-K347 PolarHBondContact CE1-O 3.07Å; H200-L348 WeakPolarHBondContact NE2-CD2 3.46Å; H200-D352 IonicContact NE2-OD2 3.55Å; H200-L353 WeakPolarHBondContact CA-O 3.28Å; H200-L354 HydrophobicContact CB-CD1 3.92Å
201	V	93.1	Very high	82	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	104.3	173.2	-168.4	0	0	0	0	108.4	E182 I184 L199 D352 L353	E182-V201 WeakPolarHBondContact O-CG1 3.24Å; I184-V201 HydrophobicContact CG1-CG1 4.32Å; I184-V201 HydrophobicContact CG1-CG2 3.88Å; L199-V201 HydrophobicContact CD2-CG2 3.99Å; L199-V201 HydrophobicContact CG-CG2 4Å; V201-D352 WeakPolarHBondContact O-CA 3.46Å; V201-L353 HydrophobicContact CB-CB 4.11Å; V201-L353 HydrophobicContact CG2-CB 4.36Å; V201-L353 HydrophobicContact CG2-CD2 4.02Å; V201-L353 PolarHBondContact N-O 3.5Å; V201-L353 PolarHBondContact O-N 3.47Å
202	K	90.2	Very high	81.7	Confident	154 Å²	154	57.1 Å²	57.1	67%	0.67	31%	0.306	S	S	*	.			trans	-80.6	139.1	174.7	-69.4	174.4	-178.4	171.7	0	110.4	H200 D352	H200-K202 VanDerWaalsContact CE1-CE 3.47Å; H200-K202 WeakPolarHBondContact CE1-CE 3.25Å; H200-K202 WeakPolarHBondContact CE1-CG 3.4Å; H200-K202 WeakPolarHBondContact NE2-CG 3.23Å; K202-D352 VanDerWaalsContact CA-OD1 3.3Å; K202-D352 WeakPolarHBondContact CA-OD1 3.47Å
203	R	83.1	Confident	81.5	Confident	37 Å²	37	56.3 Å²	56.3	14%	0.14	30%	0.3	C	S	.	.			trans	-123.5	147	175.3	-61.7	-161.2	172.2	99.6	-2.5	112.9	E179 I180 E182 C208 G351 D352	E179-R203 PolarHBondContact O-NH2 3.15Å; I180-R203 VanDerWaalsContact C-NH2 3.33Å; I180-R203 PolarHBondContact O-NH2 3.32Å; E182-R203 VanDerWaalsContact O-CZ 3.24Å; E182-R203 PolarHBondContact O-NE 3.29Å; E182-R203 PolarHBondContact O-NH2 3.33Å; R203-C208 VanDerWaalsContact NH1-CB 3.3Å; R203-G351 WeakPolarHBondContact CD-O 3.38Å; R203-G351 PolarHBondContact NH1-O 3.04Å; R203-D352 PolarHBondContact N-OD1 2.89Å
204	S	66.8	Low	81.3	Confident	131 Å²	131	58.7 Å²	58.7	92%	0.916	31%	0.309	S	S	*	.	S	Bend	trans	-90.3	-12.2	171.7	53.9	0	0	0	0	113.1
205	S	62.9	Low	81.1	Confident	51 Å²	51	61 Å²	61	36%	0.357	33%	0.327	S	S	.	.	S	Bend	trans	-143.7	153.1	-177.9	59.6	0	0	0	0	111.2	K207	S205-K207 PolarHBondContact O-N 3.4Å
206	S	56.8	Low	81	Confident	85 Å²	85	59.8 Å²	59.8	59%	0.594	32%	0.323	S	S	*	.			trans	-71.9	19.2	-178.3	50	0	0	0	0	114.7	C208	S206-C208 VanDerWaalsContact C-N 3.26Å; S206-C208 PolarHBondContact O-N 3Å; S206-C208 VanDerWaalsContact O-N 3.12Å
207	K	55.3	Low	80.9	Confident	160 Å²	160	55.2 Å²	55.2	70%	0.696	30%	0.303	S	S	*	.			trans	-62.9	-19.3	-169.2	-81.3	-173.4	174.7	-171.6	0	115.9	S205 G209	S205-K207 PolarHBondContact O-N 3.4Å; K207-G209 PolarHBondContact O-N 3.07Å
208	C	55.9	Low	80.9	Confident	11 Å²	11	57 Å²	57	7%	0.074	31%	0.306	C	S	.	.	S	Bend	trans	-72.9	68.3	168.8	-175.3	0	0	0	0	109.6	R203 S206 E210	R203-C208 VanDerWaalsContact NH1-CB 3.3Å; S206-C208 VanDerWaalsContact C-N 3.26Å; S206-C208 PolarHBondContact O-N 3Å; S206-C208 VanDerWaalsContact O-N 3.12Å; C208-E210 PolarHBondContact O-N 2.97Å
209	G	61.4	Low	80.8	Confident	20 Å²	20	59.8 Å²	59.8	21%	0.206	32%	0.315	C	S	.	.			trans	-62.9	127.1	-144.3	0	0	0	0	0	114.7	K207 W211 R281	K207-G209 PolarHBondContact O-N 3.07Å; G209-W211 PolarHBondContact O-N 2.86Å; G209-R281 PolarHBondContact O-NH1 2.77Å; G209-R281 PolarHBondContact O-NH2 3.22Å
210	E	72.5	Confident	80.5	Confident	104 Å²	104	59.4 Å²	59.4	49%	0.486	31%	0.313	S	S	.	.			trans	-2.8	98.3	178.8	-68.1	-179.5	-141.9	0	0	114.2	C208 N213 R277	C208-E210 PolarHBondContact O-N 2.97Å; E210-N213 PolarHBondContact OE2-ND2 2.97Å; E210-R277 VanDerWaalsContact O-CZ 3.24Å; E210-R277 PolarHBondContact O-NE 3.26Å; E210-R277 PolarHBondContact O-NH2 3.47Å
211	W	88	Confident	80.4	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.011	30%	0.303	C	S	.	.	S	Bend	trans	-75.1	-36.7	171.1	-72.8	64.9	0	0	0	110.1	L176 I180 G209 L278 R281 L285 L319 L377 I379	L176-W211 HydrophobicContact CD1-CH2 4.45Å; L176-W211 HydrophobicContact CD1-CZ2 4.16Å; I180-W211 HydrophobicContact CD1-CH2 3.79Å; I180-W211 HydrophobicContact CD1-CZ2 3.57Å; I180-W211 HydrophobicContact CG1-CH2 4.43Å; I180-W211 HydrophobicContact CG1-CZ2 3.71Å; G209-W211 PolarHBondContact O-N 2.86Å; W211-L278 HydrophobicContact CB-CD2 3.93Å; W211-L278 HydrophobicContact CE3-CD2 3.79Å; W211-L278 WeakPolarHBondContact O-CD2 3.4Å; W211-R281 HydrophobicContact CE3-CB 4.29Å; W211-R281 VanDerWaalsContact CG-NH1 3.3Å; W211-R281 HydrophobicContact CH2-CB 3.6Å; W211-R281 HydrophobicContact CH2-CG 4.21Å; W211-R281 HydrophobicContact CZ2-CB 4.41Å; W211-R281 HydrophobicContact CZ3-CB 3.53Å; W211-R281 HydrophobicContact CZ3-CG 4.32Å; W211-L285 HydrophobicContact CH2-CD1 4.25Å; W211-L319 HydrophobicContact CD2-CD1 3.84Å; W211-L319 HydrophobicContact CE3-CD1 4.4Å; W211-L319 HydrophobicContact CG-CD1 4.01Å; W211-L319 HydrophobicContact CZ2-CD1 4.32Å; W211-L377 HydrophobicContact CB-CD1 3.68Å; W211-L377 HydrophobicContact CB-CD2 4.46Å; W211-L377 HydrophobicContact CG-CD1 4.5Å; W211-I379 HydrophobicContact CE3-CD1 4.07Å; W211-I379 HydrophobicContact CH2-CD1 4.17Å; W211-I379 HydrophobicContact CZ3-CD1 3.74Å
212	L	88.2	Confident	80.3	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	32%	0.322	C	S	.	.			trans	-154.1	145.4	-178	-177.6	70.1	0	0	0	108.9	L216 V217 L271 A297 Q321 L375 L377	L212-L216 HydrophobicContact CD1-CB 4.19Å; L212-L216 HydrophobicContact CD1-CD2 4.03Å; L212-L216 HydrophobicContact CD1-CG 4.14Å; L212-V217 HydrophobicContact CD1-CG2 3.69Å; L212-V217 HydrophobicContact CD2-CG2 3.68Å; L212-V217 HydrophobicContact CG-CG2 3.69Å; L212-L271 HydrophobicContact CD1-CD2 3.7Å; L212-L271 HydrophobicContact CD2-CD2 3.42Å; L212-L271 VanDerWaalsContact CD2-CD2 3.42Å; L212-L271 HydrophobicContact CG-CD2 4.16Å; L212-A297 HydrophobicContact CD2-CB 3.65Å; L212-Q321 VanDerWaalsContact N-OE1 3.14Å; L212-Q321 WeakPolarHBondContact O-CB 3.26Å; L212-Q321 VanDerWaalsContact O-CG 3.32Å; L212-Q321 WeakPolarHBondContact O-CG 3.35Å; L212-Q321 PolarHBondContact O-OE1 2.72Å; L212-L375 HydrophobicContact CD2-CD1 4.09Å; L212-L375 HydrophobicContact CD2-CD2 4.29Å; L212-L375 HydrophobicContact CD2-CG 4.47Å; L212-L375 HydrophobicContact CG-CD2 4.21Å; L212-L377 HydrophobicContact CB-CD1 4.12Å; L212-L377 HydrophobicContact CB-CD2 3.93Å; L212-L377 HydrophobicContact CB-CG 4.26Å; L212-L377 HydrophobicContact CD2-CD2 3.99Å; L212-L377 HydrophobicContact CD2-CG 4.2Å
213	N	89	Confident	80.4	Confident	44 Å²	44	59.7 Å²	59.7	24%	0.235	32%	0.317	C	S	.	.			trans	-136.3	164.8	169.6	61.2	36.5	0	0	0	109.9	E210 S215 L216 V217 E322	E210-N213 PolarHBondContact OE2-ND2 2.97Å; N213-S215 PolarHBondContact O-N 3.43Å; N213-S215 WeakPolarHBondContact OD1-CB 3.45Å; N213-S215 PolarHBondContact OD1-N 2.81Å; N213-L216 PolarHBondContact O-N 2.74Å; N213-L216 PolarHBondContact OD1-N 2.76Å; N213-V217 PolarHBondContact O-N 2.9Å; N213-E322 WeakPolarHBondContact CA-OE1 3.39Å; N213-E322 VanDerWaalsContact CB-OE1 3.26Å; N213-E322 WeakPolarHBondContact CB-OE1 3.4Å
214	Y	90.5	Very high	80.7	Confident	65 Å²	65	61.6 Å²	61.6	26%	0.255	33%	0.327	S	S	.	.	H	α-helix	trans	-57.2	-33.5	-176.9	-175.3	-84.8	0	0	0	112	V217 K218 Y260 L299 E322 H373	Y214-V217 PolarHBondContact O-N 2.79Å; Y214-K218 VanDerWaalsContact O-CB 3.31Å; Y214-K218 WeakPolarHBondContact O-CB 3.49Å; Y214-K218 PolarHBondContact O-N 2.94Å; Y214-Y260 HydrophobicContact CE2-CE1 4.25Å; Y214-L299 HydrophobicContact CD2-CD1 3.73Å; Y214-L299 HydrophobicContact CD2-CD2 4Å; Y214-L299 HydrophobicContact CE2-CD1 3.91Å; Y214-L299 HydrophobicContact CE2-CD2 3.78Å; Y214-L299 HydrophobicContact CE2-CG 4.43Å; Y214-E322 PolarHBondContact N-OE1 3.41Å; Y214-H373 AromaticContact CD2-CD2 3.74Å; Y214-H373 AromaticContact CD2-NE2 3.62Å; Y214-H373 AromaticContact CG-NE2 3.94Å
215	S	89.9	Confident	81.8	Confident	65 Å²	65	62 Å²	62	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-41.9	174.9	-172.4	0	0	0	0	112	N213 K218 K219	N213-S215 PolarHBondContact O-N 3.43Å; N213-S215 WeakPolarHBondContact OD1-CB 3.45Å; N213-S215 PolarHBondContact OD1-N 2.81Å; S215-K218 PolarHBondContact O-N 3.48Å; S215-K219 WeakPolarHBondContact O-CB 3.45Å; S215-K219 VanDerWaalsContact O-CG 3.29Å; S215-K219 WeakPolarHBondContact O-CG 3.32Å; S215-K219 PolarHBondContact O-N 3.26Å
216	L	87.4	Confident	83.2	Confident	59 Å²	59	59.6 Å²	59.6	31%	0.309	30%	0.296	S	S	.	.	H	α-helix	trans	-71.6	-39.9	176	-172	60.3	0	0	0	112.2	L212 N213 K218 K219 L220	L212-L216 HydrophobicContact CD1-CB 4.19Å; L212-L216 HydrophobicContact CD1-CD2 4.03Å; L212-L216 HydrophobicContact CD1-CG 4.14Å; N213-L216 PolarHBondContact O-N 2.74Å; N213-L216 PolarHBondContact OD1-N 2.76Å; L216-K218 VanDerWaalsContact C-N 3.29Å; L216-K218 PolarHBondContact O-N 3Å; L216-K219 PolarHBondContact O-N 2.75Å; L216-L220 WeakPolarHBondContact O-CB 3.36Å; L216-L220 PolarHBondContact O-N 3.19Å
217	V	90.8	Very high	85	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-43.1	171.4	178	0	0	0	0	110.6	L212 N213 Y214 L220 V221 F268 L299 L375	L212-V217 HydrophobicContact CD1-CG2 3.69Å; L212-V217 HydrophobicContact CD2-CG2 3.68Å; L212-V217 HydrophobicContact CG-CG2 3.69Å; N213-V217 PolarHBondContact O-N 2.9Å; Y214-V217 PolarHBondContact O-N 2.79Å; V217-L220 WeakPolarHBondContact O-CB 3.25Å; V217-L220 PolarHBondContact O-N 2.82Å; V217-V221 PolarHBondContact O-N 2.75Å; V217-F268 HydrophobicContact CG1-CD2 4.32Å; V217-F268 HydrophobicContact CG1-CE1 4.29Å; V217-F268 HydrophobicContact CG1-CE2 3.45Å; V217-F268 VanDerWaalsContact CG1-CE2 3.45Å; V217-F268 HydrophobicContact CG1-CZ 3.43Å; V217-F268 VanDerWaalsContact CG1-CZ 3.43Å; V217-L299 HydrophobicContact CG1-CD2 3.98Å; V217-L375 HydrophobicContact CG2-CD1 4.2Å; V217-L375 HydrophobicContact CG2-CD2 4.22Å
218	K	92.1	Very high	86.8	Confident	96 Å²	96	53 Å²	53	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-49.9	177.2	-175.6	173.5	178.2	-178.1	0	112.3	Y214 S215 L216 L220 V221 D222 W257	Y214-K218 VanDerWaalsContact O-CB 3.31Å; Y214-K218 WeakPolarHBondContact O-CB 3.49Å; Y214-K218 PolarHBondContact O-N 2.94Å; S215-K218 PolarHBondContact O-N 3.48Å; L216-K218 VanDerWaalsContact C-N 3.29Å; L216-K218 PolarHBondContact O-N 3Å; K218-L220 PolarHBondContact O-N 2.82Å; K218-L220 VanDerWaalsContact O-N 3.15Å; K218-V221 PolarHBondContact O-N 3.47Å; K218-D222 WeakPolarHBondContact CE-OD2 3.21Å; K218-D222 VanDerWaalsContact CG-OD2 3.28Å; K218-D222 WeakPolarHBondContact CG-OD2 3.31Å; K218-D222 WeakPolarHBondContact O-CB 3.36Å; K218-D222 PolarHBondContact O-N 2.8Å; K218-W257 HydrophobicContact CB-CZ2 4.13Å; K218-W257 HydrophobicContact CG-CZ2 4.01Å
219	K	92	Very high	88.4	Confident	91 Å²	91	54.5 Å²	54.5	40%	0.396	27%	0.274	S	S	.	.	H	α-helix	trans	-56	-30.5	175.5	-74.3	173.1	-178.4	-176.1	0	112.6	S215 L216 K223	S215-K219 WeakPolarHBondContact O-CB 3.45Å; S215-K219 VanDerWaalsContact O-CG 3.29Å; S215-K219 WeakPolarHBondContact O-CG 3.32Å; S215-K219 PolarHBondContact O-N 3.26Å; L216-K219 PolarHBondContact O-N 2.75Å; K219-K223 VanDerWaalsContact O-CB 3.31Å; K219-K223 WeakPolarHBondContact O-CB 3.42Å; K219-K223 VanDerWaalsContact O-CG 3.27Å; K219-K223 WeakPolarHBondContact O-CG 3.27Å; K219-K223 PolarHBondContact O-N 2.89Å
220	L	90.2	Very high	89.7	Confident	15 Å²	15	57.8 Å²	57.8	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-73.9	-50.5	176.2	174.3	144.8	0	0	0	112.3	L216 V217 K218 D222 K223 E224 L226 F268 L271 F274	L216-L220 WeakPolarHBondContact O-CB 3.36Å; L216-L220 PolarHBondContact O-N 3.19Å; V217-L220 WeakPolarHBondContact O-CB 3.25Å; V217-L220 PolarHBondContact O-N 2.82Å; K218-L220 PolarHBondContact O-N 2.82Å; K218-L220 VanDerWaalsContact O-N 3.15Å; L220-D222 VanDerWaalsContact C-N 3.29Å; L220-D222 PolarHBondContact O-N 2.89Å; L220-K223 PolarHBondContact O-N 2.93Å; L220-E224 HydrophobicContact CG-CG 4.14Å; L220-E224 VanDerWaalsContact O-CB 3.31Å; L220-E224 WeakPolarHBondContact O-CB 3.39Å; L220-E224 WeakPolarHBondContact O-CG 3.42Å; L220-E224 PolarHBondContact O-N 3.26Å; L220-L226 HydrophobicContact CD2-CD1 3.75Å; L220-L226 HydrophobicContact CD2-CD2 4.31Å; L220-F268 HydrophobicContact CD2-CD1 3.95Å; L220-F268 HydrophobicContact CD2-CE1 3.89Å; L220-L271 HydrophobicContact CD1-CD1 3.52Å; L220-L271 HydrophobicContact CD1-CG 4.37Å; L220-L271 HydrophobicContact CD2-CD1 4.23Å; L220-F274 HydrophobicContact CD1-CB 3.38Å; L220-F274 HydrophobicContact CD1-CD2 4.35Å; L220-F274 HydrophobicContact CD1-CG 4.01Å; L220-F274 HydrophobicContact CG-CB 4.33Å
221	V	92.5	Very high	90.6	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-39.3	176.7	172	0	0	0	0	111.9	V217 K218 K223 L226 A253 V256 W257 F268	V217-V221 PolarHBondContact O-N 2.75Å; K218-V221 PolarHBondContact O-N 3.47Å; V221-K223 VanDerWaalsContact C-N 3.29Å; V221-K223 PolarHBondContact O-N 2.99Å; V221-L226 HydrophobicContact CG2-CD1 4.23Å; V221-A253 HydrophobicContact CG1-CB 3.85Å; V221-V256 HydrophobicContact CG1-CB 4.06Å; V221-V256 HydrophobicContact CG1-CG1 4.02Å; V221-V256 HydrophobicContact CG2-CG1 4.41Å; V221-W257 HydrophobicContact CB-CZ2 3.69Å; V221-W257 HydrophobicContact CG1-CZ2 3.82Å; V221-W257 HydrophobicContact CG2-CH2 4.38Å; V221-W257 HydrophobicContact CG2-CZ2 3.86Å; V221-F268 HydrophobicContact CG2-CE1 3.51Å; V221-F268 HydrophobicContact CG2-CZ 3.62Å
222	D	91.8	Very high	90.8	Very high	77 Å²	77	53.2 Å²	53.2	41%	0.412	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.4	-175.8	-64.6	-3.6	0	0	0	113.4	K218 L220 W257	K218-D222 WeakPolarHBondContact CE-OD2 3.21Å; K218-D222 VanDerWaalsContact CG-OD2 3.28Å; K218-D222 WeakPolarHBondContact CG-OD2 3.31Å; K218-D222 WeakPolarHBondContact O-CB 3.36Å; K218-D222 PolarHBondContact O-N 2.8Å; L220-D222 VanDerWaalsContact C-N 3.29Å; L220-D222 PolarHBondContact O-N 2.89Å; D222-W257 PolarHBondContact OD1-NE1 3.13Å
223	K	90.6	Very high	91.1	Very high	130 Å²	130	53.3 Å²	53.3	57%	0.565	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	-35.9	-174.6	-66.5	-174.7	175.3	-166.8	0	115.7	K219 L220 V221	K219-K223 VanDerWaalsContact O-CB 3.31Å; K219-K223 WeakPolarHBondContact O-CB 3.42Å; K219-K223 VanDerWaalsContact O-CG 3.27Å; K219-K223 WeakPolarHBondContact O-CG 3.27Å; K219-K223 PolarHBondContact O-N 2.89Å; L220-K223 PolarHBondContact O-N 2.93Å; V221-K223 VanDerWaalsContact C-N 3.29Å; V221-K223 PolarHBondContact O-N 2.99Å
224	E	90.6	Very high	91.2	Very high	77 Å²	77	51.2 Å²	51.2	36%	0.36	25%	0.252	S	S	.	.	S	Bend	trans	-82	159.2	-169.2	-64.9	-58.6	148.1	0	0	113.4	L220 L226 F274	L220-E224 HydrophobicContact CG-CG 4.14Å; L220-E224 VanDerWaalsContact O-CB 3.31Å; L220-E224 WeakPolarHBondContact O-CB 3.39Å; L220-E224 WeakPolarHBondContact O-CG 3.42Å; L220-E224 PolarHBondContact O-N 3.26Å; E224-L226 VanDerWaalsContact C-N 3.25Å; E224-L226 HydrophobicContact CB-CD2 3.78Å; E224-L226 HydrophobicContact CB-CG 3.9Å; E224-L226 PolarHBondContact O-N 3.19Å; E224-L226 VanDerWaalsContact O-N 3.07Å; E224-F274 HydrophobicContact CB-CD1 4.09Å; E224-F274 HydrophobicContact CB-CE1 4.28Å; E224-F274 HydrophobicContact CG-CD1 3.78Å; E224-F274 HydrophobicContact CG-CE1 4.45Å; E224-F274 HydrophobicContact CG-CG 4.46Å
225	F	90	Very high	91	Very high	139 Å²	139	48.2 Å²	48.2	61%	0.61	24%	0.241	S	C	*	.			trans	-87	66	175.8	-77.8	-106.1	0	0	0	110.8	F227 R250	F225-F227 WeakPolarHBondContact O-CD2 3.31Å; F225-R250 VanDerWaalsContact CD1-CZ 3.48Å; F225-R250 VanDerWaalsContact CE1-NH1 3.3Å
226	L	92.1	Very high	90.4	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.233	C	C	.	.			trans	-77.1	151	-177.6	-55.1	178.9	0	0	0	112.5	L220 V221 E224 H231 V232 R250 A251 F274	L220-L226 HydrophobicContact CD2-CD1 3.75Å; L220-L226 HydrophobicContact CD2-CD2 4.31Å; V221-L226 HydrophobicContact CG2-CD1 4.23Å; E224-L226 VanDerWaalsContact C-N 3.25Å; E224-L226 HydrophobicContact CB-CD2 3.78Å; E224-L226 HydrophobicContact CB-CG 3.9Å; E224-L226 PolarHBondContact O-N 3.19Å; E224-L226 VanDerWaalsContact O-N 3.07Å; L226-H231 HydrophobicContact CB-CB 4.41Å; L226-H231 HydrophobicContact CD2-CB 4.08Å; L226-V232 HydrophobicContact CB-CG2 4.01Å; L226-V232 HydrophobicContact CD1-CG2 3.8Å; L226-V232 HydrophobicContact CG-CG2 4.38Å; L226-R250 WeakPolarHBondContact O-CG 3.15Å; L226-A251 HydrophobicContact CB-CB 4Å; L226-A251 PolarHBondContact O-N 3.01Å; L226-F274 HydrophobicContact CD2-CD1 4.4Å; L226-F274 HydrophobicContact CD2-CE1 3.9Å; L226-F274 HydrophobicContact CD2-CE2 4.1Å; L226-F274 HydrophobicContact CD2-CZ 3.74Å
227	F	93.5	Very high	89.3	Confident	85 Å²	85	48.3 Å²	48.3	37%	0.373	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-130.6	141.5	177	-73.7	-96.8	0	0	0	109.8	F225 Q230 H231 V232 G249 R250	F225-F227 WeakPolarHBondContact O-CD2 3.31Å; F227-Q230 HydrophobicContact CB-CB 4.23Å; F227-H231 AromaticContact CD2-ND1 3.93Å; F227-H231 PolarHBondContact N-ND1 2.82Å; F227-H231 PolarHBondContact O-N 3.45Å; F227-V232 PolarHBondContact O-N 3.12Å; F227-V232 VanDerWaalsContact O-N 3.12Å; F227-G249 WeakPolarHBondContact CA-O 3.36Å; F227-R250 HydrophobicContact CD1-CB 4.43Å; F227-R250 HydrophobicContact CE1-CB 4.31Å
228	F	93.7	Very high	87.8	Confident	20 Å²	20	54.1 Å²	54.1	9%	0.088	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-67.4	145	173.7	-72.4	-64.1	0	0	0	110.6	Q230 V232 L234 N246 P247 G249 A251 T255 V256	F228-Q230 PolarHBondContact O-N 3.38Å; F228-V232 CarbonylContact C-O 3.46Å; F228-V232 WeakPolarHBondContact CA-O 3.41Å; F228-V232 HydrophobicContact CD1-CB 4.34Å; F228-V232 HydrophobicContact CD1-CG1 4.28Å; F228-V232 HydrophobicContact CE1-CG1 4.21Å; F228-L234 HydrophobicContact CD1-CG 4.47Å; F228-L234 HydrophobicContact CE1-CD1 4.24Å; F228-L234 HydrophobicContact CE1-CD2 4.08Å; F228-L234 HydrophobicContact CE1-CG 3.88Å; F228-N246 HydrophobicContact CB-CB 4.11Å; F228-P247 WeakPolarHBondContact CB-O 3.37Å; F228-P247 HydrophobicContact CD2-CB 3.93Å; F228-P247 HydrophobicContact CD2-CG 4.2Å; F228-P247 WeakPolarHBondContact CD2-O 3.44Å; F228-P247 HydrophobicContact CE2-CB 3.89Å; F228-P247 HydrophobicContact CE2-CG 3.88Å; F228-P247 HydrophobicContact CZ-CG 4.18Å; F228-G249 PolarHBondContact N-O 2.8Å; F228-A251 HydrophobicContact CD1-CB 3.93Å; F228-A251 HydrophobicContact CD2-CB 3.96Å; F228-A251 HydrophobicContact CE1-CB 3.89Å; F228-A251 HydrophobicContact CE2-CB 3.94Å; F228-A251 HydrophobicContact CG-CB 3.96Å; F228-A251 HydrophobicContact CZ-CB 3.89Å; F228-T255 HydrophobicContact CE2-CG2 4.27Å; F228-T255 HydrophobicContact CZ-CG2 4.24Å; F228-V256 HydrophobicContact CE1-CG2 4.06Å; F228-V256 HydrophobicContact CZ-CG2 3.9Å
229	G	89.2	Confident	85.9	Confident	43 Å²	43	51.9 Å²	51.9	44%	0.443	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-34.4	-176.9	0	0	0	0	0	115.1	V232 D233 N246	G229-V232 PolarHBondContact N-O 2.86Å; G229-D233 VanDerWaalsContact CA-OD1 3.32Å; G229-D233 WeakPolarHBondContact CA-OD1 3.4Å; G229-D233 PolarHBondContact N-OD1 2.87Å; G229-N246 WeakPolarHBondContact CA-ND2 3.39Å; G229-N246 PolarHBondContact N-ND2 2.98Å; G229-N246 VanDerWaalsContact N-ND2 3.19Å
230	Q	88.7	Confident	84.1	Confident	90 Å²	90	48.5 Å²	48.5	42%	0.421	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-44.8	177.6	-170.9	-177.3	14.2	0	0	112.6	F227 F228	F227-Q230 HydrophobicContact CB-CB 4.23Å; F228-Q230 PolarHBondContact O-N 3.38Å
231	H	92.1	Very high	82.2	Confident	11 Å²	11	54.2 Å²	54.2	5%	0.051	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-31.8	-172.1	-55.4	114	0	0	0	112.7	L226 F227 F268 H269 F274 N618	L226-H231 HydrophobicContact CB-CB 4.41Å; L226-H231 HydrophobicContact CD2-CB 4.08Å; F227-H231 AromaticContact CD2-ND1 3.93Å; F227-H231 PolarHBondContact N-ND1 2.82Å; F227-H231 PolarHBondContact O-N 3.45Å; H231-F268 WeakPolarHBondContact O-CA 3.47Å; H231-H269 PolarHBondContact O-N 3.29Å; H231-F274 AromaticContact CD2-CE2 3.85Å; H231-F274 AromaticContact CD2-CZ 3.56Å; H231-F274 AromaticContact NE2-CZ 3.98Å; H231-N618 PolarHBondContact NE2-OD1 2.89Å
232	V	92.7	Very high	80.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.6	-175.9	-176.8	0	0	0	0	109.4	L226 F227 F228 G229 A251 I266 R267 F268	L226-V232 HydrophobicContact CB-CG2 4.01Å; L226-V232 HydrophobicContact CD1-CG2 3.8Å; L226-V232 HydrophobicContact CG-CG2 4.38Å; F227-V232 PolarHBondContact O-N 3.12Å; F227-V232 VanDerWaalsContact O-N 3.12Å; F228-V232 CarbonylContact C-O 3.46Å; F228-V232 WeakPolarHBondContact CA-O 3.41Å; F228-V232 HydrophobicContact CD1-CB 4.34Å; F228-V232 HydrophobicContact CD1-CG1 4.28Å; F228-V232 HydrophobicContact CE1-CG1 4.21Å; G229-V232 PolarHBondContact N-O 2.86Å; V232-A251 HydrophobicContact CB-CB 4.16Å; V232-A251 HydrophobicContact CG2-CB 4.21Å; V232-I266 HydrophobicContact CG1-CG2 3.59Å; V232-R267 CarbonylContact C-O 3.6Å; V232-R267 WeakPolarHBondContact CA-O 3.34Å; V232-F268 HydrophobicContact CG2-CD1 3.93Å; V232-F268 HydrophobicContact CG2-CE1 4Å
233	D	93	Very high	78.5	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.027	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.2	164	-58.1	-42.9	0	0	0	111	G229 I244 N246 I266 R267 H269	G229-D233 VanDerWaalsContact CA-OD1 3.32Å; G229-D233 WeakPolarHBondContact CA-OD1 3.4Å; G229-D233 PolarHBondContact N-OD1 2.87Å; D233-I244 HydrophobicContact CB-CG2 3.92Å; D233-N246 VanDerWaalsContact CA-OD1 3.29Å; D233-N246 WeakPolarHBondContact CA-OD1 3.29Å; D233-N246 PolarHBondContact OD1-ND2 2.83Å; D233-I266 WeakPolarHBondContact O-CA 3.31Å; D233-R267 HydrophobicContact CB-CB 4.23Å; D233-R267 PolarHBondContact N-O 2.89Å; D233-R267 PolarHBondContact O-N 3.34Å; D233-R267 IonicContact OD2-CZ 3.43Å; D233-R267 IonicContact OD2-NE 3.51Å; D233-R267 PolarHBondContact OD2-NE 2.89Å; D233-R267 IonicContact OD2-NH2 2.63Å; D233-R267 PolarHBondContact OD2-NH2 2.94Å; D233-H269 IonicContact OD1-NE2 3.78Å; D233-H269 IonicContact OD2-CD2 2.71Å; D233-H269 IonicContact OD2-CE1 2.57Å; D233-H269 PolarHBondContact OD2-CE1 2.85Å; D233-H269 IonicContact OD2-NE2 2.8Å; D233-H269 PolarHBondContact OD2-NE2 3.14Å
234	L	91.3	Very high	77.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	140	163.3	-58.6	-179.6	0	0	0	109.8	F228 N246 P247 H259 K264	F228-L234 HydrophobicContact CD1-CG 4.47Å; F228-L234 HydrophobicContact CE1-CD1 4.24Å; F228-L234 HydrophobicContact CE1-CD2 4.08Å; F228-L234 HydrophobicContact CE1-CG 3.88Å; L234-N246 PolarHBondContact N-OD1 2.97Å; L234-P247 HydrophobicContact CD1-CG 4.21Å; L234-H259 HydrophobicContact CD1-CB 3.77Å; L234-H259 VanDerWaalsContact CD1-CG 3.42Å; L234-H259 HydrophobicContact CD2-CB 3.86Å; L234-H259 HydrophobicContact CG-CB 4.46Å; L234-K264 HydrophobicContact CB-CD 4.4Å; L234-K264 HydrophobicContact CD1-CD 4.41Å
235	I	87	Confident	76.7	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.7	-178.3	-48.7	172.6	0	0	0	108.8	L240 K264 G265 R267 Y298 L300 L307	I235-L240 HydrophobicContact CB-CD2 4.49Å; I235-L240 HydrophobicContact CD1-CD2 4.46Å; I235-L240 HydrophobicContact CG1-CD2 4.15Å; I235-L240 HydrophobicContact CG2-CD2 3.74Å; I235-L240 HydrophobicContact CG2-CG 4.44Å; I235-K264 WeakPolarHBondContact O-CA 3.4Å; I235-K264 WeakPolarHBondContact O-CB 3.28Å; I235-G265 PolarHBondContact N-O 3.34Å; I235-G265 PolarHBondContact O-N 3.25Å; I235-R267 HydrophobicContact CD1-CB 4Å; I235-R267 HydrophobicContact CG1-CB 4.27Å; I235-Y298 HydrophobicContact CD1-CD1 3.78Å; I235-Y298 HydrophobicContact CD1-CE1 4.15Å; I235-L300 HydrophobicContact CD1-CD2 3.87Å; I235-L307 HydrophobicContact CD1-CD1 4.45Å; I235-L307 HydrophobicContact CG2-CD2 3.5Å; I235-L307 VanDerWaalsContact CG2-CD2 3.5Å
236	E	77.2	Confident	76.6	Confident	62 Å²	62	52.7 Å²	52.7	29%	0.29	27%	0.266	S	S	.	.			trans	-96.8	162.2	169.2	-65.2	-179.6	-162.9	0	0	111.2	K238 E243 K264	E236-K238 PolarHBondContact O-N 3.03Å; E236-E243 HydrophobicContact CB-CB 4.16Å; E236-E243 PolarHBondContact N-O 3.17Å; E236-K264 HydrophobicContact CG-CD 3.77Å; E236-K264 HydrophobicContact CG-CG 4.16Å; E236-K264 WeakPolarHBondContact OE1-CE 3.46Å; E236-K264 IonicContact OE1-NZ 2.64Å; E236-K264 PolarHBondContact OE1-NZ 2.77Å
237	D	64.9	Low	76.5	Confident	64 Å²	64	54.3 Å²	54.3	34%	0.342	28%	0.277	S	S	.	.	S	Bend	trans	-87.7	98.1	-162.7	174.8	54.7	0	0	0	113.3	T305 E306	D237-T305 HydrophobicContact CB-CG2 4.49Å; D237-T305 WeakPolarHBondContact OD1-CA 3.24Å; D237-E306 PolarHBondContact OD1-N 2.97Å
238	K	57.9	Low	76.4	Confident	123 Å²	123	56.5 Å²	56.5	54%	0.535	30%	0.3	S	S	.	.	S	Bend		174.9	-32.3	129.9	-91.5	151.3	-150.5	85.8	0	113.1	E236 E306	E236-K238 PolarHBondContact O-N 3.03Å; K238-E306 CarbonylContact C-O 3.57Å
239	T	52.4	Low	76.3	Confident	50 Å²	50	57.4 Å²	57.4	31%	0.307	32%	0.315	S	S	.	.			trans	-147.9	115.9	-176.8	61.5	0	0	0	0	113.8	K241 H242 E243	T239-K241 PolarHBondContact O-N 2.72Å; T239-H242 PolarHBondContact O-N 2.77Å; T239-E243 WeakPolarHBondContact CA-OE2 3.37Å; T239-E243 WeakPolarHBondContact CB-OE2 3.42Å; T239-E243 PolarHBondContact N-OE2 3.1Å; T239-E243 PolarHBondContact O-N 2.98Å; T239-E243 PolarHBondContact OG1-OE2 3.48Å
240	L	54.9	Low	76.5	Confident	20 Å²	20	59.2 Å²	59.2	11%	0.105	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-1.5	173.5	-79.3	168.6	0	0	0	115.3	I235 I244 Y298 L307 F309	I235-L240 HydrophobicContact CB-CD2 4.49Å; I235-L240 HydrophobicContact CD1-CD2 4.46Å; I235-L240 HydrophobicContact CG1-CD2 4.15Å; I235-L240 HydrophobicContact CG2-CD2 3.74Å; I235-L240 HydrophobicContact CG2-CG 4.44Å; L240-I244 HydrophobicContact CD2-CD1 3.94Å; L240-I244 HydrophobicContact CD2-CG1 4.09Å; L240-Y298 HydrophobicContact CD1-CE1 4.23Å; L240-L307 HydrophobicContact CD1-CB 3.97Å; L240-L307 HydrophobicContact CD1-CD1 4.32Å; L240-L307 HydrophobicContact CD1-CD2 4.16Å; L240-L307 HydrophobicContact CD1-CG 4.38Å; L240-L307 HydrophobicContact CG-CD2 4.04Å; L240-F309 HydrophobicContact CD1-CD1 4.37Å; L240-F309 HydrophobicContact CD1-CE1 3.52Å; L240-F309 HydrophobicContact CD1-CE2 3.83Å; L240-F309 HydrophobicContact CD1-CZ 3.21Å
241	K	49.4	Very low	76.8	Confident	135 Å²	135	55 Å²	55	59%	0.587	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-17.3	172.8	-88.6	-167.4	164.9	-174.3	0	114.2	T239 N310	T239-K241 PolarHBondContact O-N 2.72Å; K241-N310 WeakPolarHBondContact CE-OD1 3.41Å; K241-N310 PolarHBondContact NZ-OD1 3.05Å
242	H	48.4	Very low	76.9	Confident	156 Å²	156	60 Å²	60	72%	0.722	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	-14.6	-173.8	-62.2	-64.9	0	0	0	114.5	T239	T239-H242 PolarHBondContact O-N 2.77Å
243	E	59.5	Low	77	Confident	56 Å²	56	61.3 Å²	61.3	26%	0.262	32%	0.322	S	S	.	.			trans	-121.5	34.6	-171.5	-71.5	142.5	137.7	0	0	113.7	E236 T239 V245	E236-E243 HydrophobicContact CB-CB 4.16Å; E236-E243 PolarHBondContact N-O 3.17Å; T239-E243 WeakPolarHBondContact CA-OE2 3.37Å; T239-E243 WeakPolarHBondContact CB-OE2 3.42Å; T239-E243 PolarHBondContact N-OE2 3.1Å; T239-E243 PolarHBondContact O-N 2.98Å; T239-E243 PolarHBondContact OG1-OE2 3.48Å; E243-V245 PolarHBondContact O-N 2.83Å
244	I	69.5	Low	77.1	Confident	53 Å²	53	63.7 Å²	63.7	27%	0.272	35%	0.347	S	S	.	.			trans	-94	88.6	166.7	-59.1	-177.1	0	0	0	108.7	D233 L240 N246	D233-I244 HydrophobicContact CB-CG2 3.92Å; L240-I244 HydrophobicContact CD2-CD1 3.94Å; L240-I244 HydrophobicContact CD2-CG1 4.09Å; I244-N246 PolarHBondContact O-N 3.24Å
245	V	73.5	Confident	77.3	Confident	83 Å²	83	65.8 Å²	65.8	50%	0.503	36%	0.36	S	S	.	.			trans	-98	87.7	178.3	-173.6	0	0	0	0	109.3	E243	E243-V245 PolarHBondContact O-N 2.83Å
246	N	88.4	Confident	77.6	Confident	46 Å²	46	65.7 Å²	65.7	25%	0.246	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-87.9	129.5	178.9	-81.6	-17.9	0	0	0	111.8	F228 G229 D233 L234 I244	F228-N246 HydrophobicContact CB-CB 4.11Å; G229-N246 WeakPolarHBondContact CA-ND2 3.39Å; G229-N246 PolarHBondContact N-ND2 2.98Å; G229-N246 VanDerWaalsContact N-ND2 3.19Å; D233-N246 VanDerWaalsContact CA-OD1 3.29Å; D233-N246 WeakPolarHBondContact CA-OD1 3.29Å; D233-N246 PolarHBondContact OD1-ND2 2.83Å; L234-N246 PolarHBondContact N-OD1 2.97Å; I244-N246 PolarHBondContact O-N 3.24Å
247	P	90.1	Very high	78.5	Confident	37 Å²	37	64.9 Å²	64.9	24%	0.24	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-59.2	145.2	162.8	-20.4	32.3	0	0	0	110.7	F228 L234	F228-P247 WeakPolarHBondContact CB-O 3.37Å; F228-P247 HydrophobicContact CD2-CB 3.93Å; F228-P247 HydrophobicContact CD2-CG 4.2Å; F228-P247 WeakPolarHBondContact CD2-O 3.44Å; F228-P247 HydrophobicContact CE2-CB 3.89Å; F228-P247 HydrophobicContact CE2-CG 3.88Å; F228-P247 HydrophobicContact CZ-CG 4.18Å; L234-P247 HydrophobicContact CD1-CG 4.21Å
248	P	90.4	Very high	79.8	Confident	130 Å²	130	66.7 Å²	66.7	84%	0.844	36%	0.36	S	S	*	.	S	Bend	trans	-70.7	141	178.9	28.6	-34.4	0	0	0	112
249	G	92.2	Very high	81.4	Confident	40 Å²	40	62.3 Å²	62.3	41%	0.412	34%	0.342	S	S	.	.	S	Bend	trans	88	-138.5	168.7	0	0	0	0	0	115.2	F227 F228	F227-G249 WeakPolarHBondContact CA-O 3.36Å; F228-G249 PolarHBondContact N-O 2.8Å
250	R	93.5	Very high	83.3	Confident	80 Å²	80	61 Å²	61	30%	0.302	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-74.5	130.3	-167.9	-167.9	-174.6	174.6	169.5	3	111.7	F225 L226 F227 F252	F225-R250 VanDerWaalsContact CD1-CZ 3.48Å; F225-R250 VanDerWaalsContact CE1-NH1 3.3Å; L226-R250 WeakPolarHBondContact O-CG 3.15Å; F227-R250 HydrophobicContact CD1-CB 4.43Å; F227-R250 HydrophobicContact CE1-CB 4.31Å; R250-F252 VanDerWaalsContact C-N 3.34Å; R250-F252 HydrophobicContact CB-CD2 4.12Å; R250-F252 HydrophobicContact CB-CE2 3.88Å; R250-F252 HydrophobicContact CB-CZ 4.37Å; R250-F252 HydrophobicContact CG-CD2 4.37Å; R250-F252 HydrophobicContact CG-CE2 4.31Å; R250-F252 HydrophobicContact CG-CZ 4.48Å; R250-F252 PolarHBondContact O-N 3.43Å
251	A	94.2	Very high	84.9	Confident	2 Å²	2	64.8 Å²	64.8	2%	0.017	36%	0.359	C	S	.	.			trans	-81.1	79	172.6	0	0	0	0	0	110.2	L226 F228 V232 V256	L226-A251 HydrophobicContact CB-CB 4Å; L226-A251 PolarHBondContact O-N 3.01Å; F228-A251 HydrophobicContact CD1-CB 3.93Å; F228-A251 HydrophobicContact CD2-CB 3.96Å; F228-A251 HydrophobicContact CE1-CB 3.89Å; F228-A251 HydrophobicContact CE2-CB 3.94Å; F228-A251 HydrophobicContact CG-CB 3.96Å; F228-A251 HydrophobicContact CZ-CB 3.89Å; V232-A251 HydrophobicContact CB-CB 4.16Å; V232-A251 HydrophobicContact CG2-CB 4.21Å; A251-V256 HydrophobicContact CB-CG2 3.93Å
252	F	94.6	Very high	86.8	Confident	117 Å²	117	62.7 Å²	62.7	51%	0.513	35%	0.352	S	S	.	.			trans	-65.5	140	174.1	-70.7	-83.8	0	0	0	111.3	R250 G254 T255 V256	R250-F252 VanDerWaalsContact C-N 3.34Å; R250-F252 HydrophobicContact CB-CD2 4.12Å; R250-F252 HydrophobicContact CB-CE2 3.88Å; R250-F252 HydrophobicContact CB-CZ 4.37Å; R250-F252 HydrophobicContact CG-CD2 4.37Å; R250-F252 HydrophobicContact CG-CE2 4.31Å; R250-F252 HydrophobicContact CG-CZ 4.48Å; R250-F252 PolarHBondContact O-N 3.43Å; F252-G254 VanDerWaalsContact C-N 3.31Å; F252-G254 PolarHBondContact O-N 3.04Å; F252-T255 PolarHBondContact O-N 2.87Å; F252-T255 VanDerWaalsContact O-N 3.08Å; F252-V256 WeakPolarHBondContact O-CG2 3.26Å; F252-V256 PolarHBondContact O-N 3.21Å
253	A	95	Very high	88.6	Confident	27 Å²	27	55.7 Å²	55.7	22%	0.223	32%	0.322	C	S	.	.	H	α-helix	trans	-52.6	-44.6	-177	0	0	0	0	0	113.7	V221 T255 V256 W257	V221-A253 HydrophobicContact CG1-CB 3.85Å; A253-T255 PolarHBondContact O-N 3.06Å; A253-V256 PolarHBondContact O-N 3.05Å; A253-W257 WeakPolarHBondContact O-CB 3.45Å; A253-W257 PolarHBondContact O-N 2.73Å
254	G	94.6	Very high	90	Very high	54 Å²	54	55 Å²	55	56%	0.557	32%	0.318	S	S	*	.	H	α-helix	trans	-55.7	-52.2	176.3	0	0	0	0	0	112.3	F252 V256 W257 E258	F252-G254 VanDerWaalsContact C-N 3.31Å; F252-G254 PolarHBondContact O-N 3.04Å; G254-V256 VanDerWaalsContact C-N 3.34Å; G254-V256 PolarHBondContact O-N 2.79Å; G254-W257 PolarHBondContact O-N 3.38Å; G254-E258 WeakPolarHBondContact O-CB 3.06Å; G254-E258 PolarHBondContact O-N 3.24Å
255	T	94.8	Very high	90.9	Very high	45 Å²	45	52.6 Å²	52.6	28%	0.276	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-35.8	178.7	-47.9	0	0	0	0	112.8	F228 F252 A253 H259	F228-T255 HydrophobicContact CE2-CG2 4.27Å; F228-T255 HydrophobicContact CZ-CG2 4.24Å; F252-T255 PolarHBondContact O-N 2.87Å; F252-T255 VanDerWaalsContact O-N 3.08Å; A253-T255 PolarHBondContact O-N 3.06Å; T255-H259 PolarHBondContact O-N 2.83Å; T255-H259 PolarHBondContact O-ND1 2.95Å
256	V	94.8	Very high	91.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-46.8	176.1	174.3	0	0	0	0	110.8	V221 F228 A251 F252 A253 G254 Y260 I266	V221-V256 HydrophobicContact CG1-CB 4.06Å; V221-V256 HydrophobicContact CG1-CG1 4.02Å; V221-V256 HydrophobicContact CG2-CG1 4.41Å; F228-V256 HydrophobicContact CE1-CG2 4.06Å; F228-V256 HydrophobicContact CZ-CG2 3.9Å; A251-V256 HydrophobicContact CB-CG2 3.93Å; F252-V256 WeakPolarHBondContact O-CG2 3.26Å; F252-V256 PolarHBondContact O-N 3.21Å; A253-V256 PolarHBondContact O-N 3.05Å; G254-V256 VanDerWaalsContact C-N 3.34Å; G254-V256 PolarHBondContact O-N 2.79Å; V256-Y260 WeakPolarHBondContact O-CB 3.46Å; V256-Y260 PolarHBondContact O-N 2.93Å; V256-I266 HydrophobicContact CG1-CD1 3.59Å; V256-I266 HydrophobicContact CG1-CG1 4.27Å
257	W	94.4	Very high	92.1	Very high	44 Å²	44	48.5 Å²	48.5	17%	0.167	28%	0.278	C	S	.	.	H	α-helix	trans	-73.3	-29.4	-179.6	-64.7	128.3	0	0	0	113.7	K218 V221 D222 A253 G254 Y260 S261 I266 L299	K218-W257 HydrophobicContact CB-CZ2 4.13Å; K218-W257 HydrophobicContact CG-CZ2 4.01Å; V221-W257 HydrophobicContact CB-CZ2 3.69Å; V221-W257 HydrophobicContact CG1-CZ2 3.82Å; V221-W257 HydrophobicContact CG2-CH2 4.38Å; V221-W257 HydrophobicContact CG2-CZ2 3.86Å; D222-W257 PolarHBondContact OD1-NE1 3.13Å; A253-W257 WeakPolarHBondContact O-CB 3.45Å; A253-W257 PolarHBondContact O-N 2.73Å; G254-W257 PolarHBondContact O-N 3.38Å; W257-Y260 AromaticContact CE3-CD1 3.85Å; W257-Y260 HydrophobicContact CE3-CD1 3.85Å; W257-Y260 HydrophobicContact CE3-CG 4.2Å; W257-Y260 AromaticContact CZ3-CD1 3.93Å; W257-Y260 HydrophobicContact CZ3-CD1 3.93Å; W257-Y260 HydrophobicContact CZ3-CE1 4.35Å; W257-Y260 HydrophobicContact CZ3-CG 4.27Å; W257-Y260 PolarHBondContact O-N 2.83Å; W257-S261 WeakPolarHBondContact O-CB 3.47Å; W257-S261 PolarHBondContact O-N 2.96Å; W257-S261 PolarHBondContact O-OG 2.78Å; W257-S261 VanDerWaalsContact O-OG 3.08Å; W257-I266 HydrophobicContact CZ3-CD1 4.04Å; W257-L299 HydrophobicContact CH2-CD2 4.17Å; W257-L299 HydrophobicContact CZ3-CD2 4.11Å
258	E	93.5	Very high	92.2	Very high	103 Å²	103	46.8 Å²	46.8	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-57.8	170	177	178.7	-163.4	0	0	110.3	G254 Y260 S261 Q262	G254-E258 WeakPolarHBondContact O-CB 3.06Å; G254-E258 PolarHBondContact O-N 3.24Å; E258-Y260 VanDerWaalsContact C-N 3.26Å; E258-Y260 PolarHBondContact O-N 3.01Å; E258-S261 PolarHBondContact O-N 2.91Å; E258-S261 PolarHBondContact O-OG 3.47Å; E258-Q262 WeakPolarHBondContact O-CG 3.43Å; E258-Q262 PolarHBondContact O-N 2.92Å
259	H	92	Very high	92.3	Very high	30 Å²	30	42.5 Å²	42.5	14%	0.139	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-35.1	178	-76	109	0	0	0	113.4	L234 T255 Q262 G263 K264	L234-H259 HydrophobicContact CD1-CB 3.77Å; L234-H259 VanDerWaalsContact CD1-CG 3.42Å; L234-H259 HydrophobicContact CD2-CB 3.86Å; L234-H259 HydrophobicContact CG-CB 4.46Å; T255-H259 PolarHBondContact O-N 2.83Å; T255-H259 PolarHBondContact O-ND1 2.95Å; H259-Q262 PolarHBondContact CD2-OE1 2.82Å; H259-Q262 WeakPolarHBondContact O-CB 3.38Å; H259-G263 PolarHBondContact O-N 2.81Å; H259-K264 HydrophobicContact CB-CD 4.18Å; H259-K264 PolarHBondContact CD2-NZ 2.92Å; H259-K264 VanDerWaalsContact CD2-NZ 3.34Å; H259-K264 WeakPolarHBondContact O-CB 3.38Å; H259-K264 PolarHBondContact O-N 3.04Å
260	Y	91.1	Very high	92	Very high	24 Å²	24	43.5 Å²	43.5	9%	0.094	23%	0.231	C	C	.	.	H	α-helix	trans	-69.2	-36.5	174.5	-174.6	-108	0	0	0	113.1	Y214 V256 W257 E258 G263 K264 I266 L299 H373	Y214-Y260 HydrophobicContact CE2-CE1 4.25Å; V256-Y260 WeakPolarHBondContact O-CB 3.46Å; V256-Y260 PolarHBondContact O-N 2.93Å; W257-Y260 AromaticContact CE3-CD1 3.85Å; W257-Y260 HydrophobicContact CE3-CD1 3.85Å; W257-Y260 HydrophobicContact CE3-CG 4.2Å; W257-Y260 AromaticContact CZ3-CD1 3.93Å; W257-Y260 HydrophobicContact CZ3-CD1 3.93Å; W257-Y260 HydrophobicContact CZ3-CE1 4.35Å; W257-Y260 HydrophobicContact CZ3-CG 4.27Å; W257-Y260 PolarHBondContact O-N 2.83Å; E258-Y260 VanDerWaalsContact C-N 3.26Å; E258-Y260 PolarHBondContact O-N 3.01Å; Y260-G263 WeakPolarHBondContact O-CA 3.49Å; Y260-G263 PolarHBondContact O-N 2.9Å; Y260-K264 WeakPolarHBondContact CD2-O 3.3Å; Y260-I266 HydrophobicContact CD2-CD1 3.75Å; Y260-I266 HydrophobicContact CD2-CG1 3.98Å; Y260-I266 HydrophobicContact CG-CD1 3.95Å; Y260-L299 HydrophobicContact CE2-CD1 4.35Å; Y260-L299 HydrophobicContact CE2-CD2 4.29Å; Y260-L299 HydrophobicContact CE2-CG 3.77Å; Y260-L299 WeakPolarHBondContact OH-CD1 3.32Å; Y260-H373 WeakPolarHBondContact OH-CB 3.34Å
261	S	89.9	Confident	91.7	Very high	98 Å²	98	39.9 Å²	39.9	69%	0.685	22%	0.217	S	C	*	.	H	α-helix	trans	-75.7	-29	175.7	64.2	0	0	0	0	112.9	W257 E258 G263	W257-S261 WeakPolarHBondContact O-CB 3.47Å; W257-S261 PolarHBondContact O-N 2.96Å; W257-S261 PolarHBondContact O-OG 2.78Å; W257-S261 VanDerWaalsContact O-OG 3.08Å; E258-S261 PolarHBondContact O-N 2.91Å; E258-S261 PolarHBondContact O-OG 3.47Å; S261-G263 PolarHBondContact O-N 3.2Å
262	Q	88.4	Confident	91.4	Very high	92 Å²	92	40.1 Å²	40.1	43%	0.43	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.3	160.6	-65	168.3	6.3	0	0	112.4	E258 H259 K303	E258-Q262 WeakPolarHBondContact O-CG 3.43Å; E258-Q262 PolarHBondContact O-N 2.92Å; H259-Q262 PolarHBondContact CD2-OE1 2.82Å; H259-Q262 WeakPolarHBondContact O-CB 3.38Å; Q262-K303 PolarHBondContact O-NZ 2.83Å
263	G	85.8	Confident	90.9	Very high	9 Å²	9	35.1 Å²	35.1	9%	0.093	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.2	5.1	169.6	0	0	0	0	0	115.7	H259 Y260 S261 S301	H259-G263 PolarHBondContact O-N 2.81Å; Y260-G263 WeakPolarHBondContact O-CA 3.49Å; Y260-G263 PolarHBondContact O-N 2.9Å; S261-G263 PolarHBondContact O-N 3.2Å; G263-S301 PolarHBondContact O-OG 2.84Å
264	K	88.2	Confident	90.4	Very high	42 Å²	42	35.7 Å²	35.7	18%	0.183	20%	0.195	C	C	.	.			trans	-62.1	148	172.4	-56.7	-171.3	-172	-175.6	0	109.8	L234 I235 E236 H259 Y260	L234-K264 HydrophobicContact CB-CD 4.4Å; L234-K264 HydrophobicContact CD1-CD 4.41Å; I235-K264 WeakPolarHBondContact O-CA 3.4Å; I235-K264 WeakPolarHBondContact O-CB 3.28Å; E236-K264 HydrophobicContact CG-CD 3.77Å; E236-K264 HydrophobicContact CG-CG 4.16Å; E236-K264 WeakPolarHBondContact OE1-CE 3.46Å; E236-K264 IonicContact OE1-NZ 2.64Å; E236-K264 PolarHBondContact OE1-NZ 2.77Å; H259-K264 HydrophobicContact CB-CD 4.18Å; H259-K264 PolarHBondContact CD2-NZ 2.92Å; H259-K264 VanDerWaalsContact CD2-NZ 3.34Å; H259-K264 WeakPolarHBondContact O-CB 3.38Å; H259-K264 PolarHBondContact O-N 3.04Å; Y260-K264 WeakPolarHBondContact CD2-O 3.3Å
265	G	89.9	Confident	89.9	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	161.7	169.2	0	0	0	0	0	111.3	I235	I235-G265 PolarHBondContact N-O 3.34Å; I235-G265 PolarHBondContact O-N 3.25Å
266	I	92.7	Very high	89.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.9	170.6	-53.4	162.2	0	0	0	109.2	V232 D233 V256 W257 Y260 F268 L299	V232-I266 HydrophobicContact CG1-CG2 3.59Å; D233-I266 WeakPolarHBondContact O-CA 3.31Å; V256-I266 HydrophobicContact CG1-CD1 3.59Å; V256-I266 HydrophobicContact CG1-CG1 4.27Å; W257-I266 HydrophobicContact CZ3-CD1 4.04Å; Y260-I266 HydrophobicContact CD2-CD1 3.75Å; Y260-I266 HydrophobicContact CD2-CG1 3.98Å; Y260-I266 HydrophobicContact CG-CD1 3.95Å; I266-F268 HydrophobicContact CB-CE2 3.97Å; I266-F268 HydrophobicContact CB-CZ 4.34Å; I266-F268 HydrophobicContact CD1-CZ 4.48Å; I266-F268 HydrophobicContact CG2-CD2 3.95Å; I266-F268 HydrophobicContact CG2-CE1 4.12Å; I266-F268 HydrophobicContact CG2-CE2 3.42Å; I266-F268 VanDerWaalsContact CG2-CE2 3.42Å; I266-F268 HydrophobicContact CG2-CZ 3.51Å; I266-L299 HydrophobicContact CB-CB 4.49Å; I266-L299 HydrophobicContact CD1-CD2 4.26Å; I266-L299 PolarHBondContact N-O 2.99Å; I266-L299 PolarHBondContact O-N 2.84Å
267	R	93.1	Very high	89	Confident	43 Å²	43	42 Å²	42	16%	0.162	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.5	165.8	173	168.9	73.7	-179.5	9.2	109.3	V232 D233 I235 H269 T296 A297 Y298	V232-R267 CarbonylContact C-O 3.6Å; V232-R267 WeakPolarHBondContact CA-O 3.34Å; D233-R267 HydrophobicContact CB-CB 4.23Å; D233-R267 PolarHBondContact N-O 2.89Å; D233-R267 PolarHBondContact O-N 3.34Å; D233-R267 IonicContact OD2-CZ 3.43Å; D233-R267 IonicContact OD2-NE 3.51Å; D233-R267 PolarHBondContact OD2-NE 2.89Å; D233-R267 IonicContact OD2-NH2 2.63Å; D233-R267 PolarHBondContact OD2-NH2 2.94Å; I235-R267 HydrophobicContact CD1-CB 4Å; I235-R267 HydrophobicContact CG1-CB 4.27Å; R267-H269 PolarHBondContact NE-CE1 2.93Å; R267-H269 VanDerWaalsContact NE-CE1 3.26Å; R267-T296 HydrophobicContact CG-CG2 3.61Å; R267-A297 CarbonylContact C-O 3.51Å; R267-A297 WeakPolarHBondContact CA-O 3.46Å; R267-Y298 HydrophobicContact CB-CD1 4.2Å; R267-Y298 HydrophobicContact CB-CE1 4.02Å; R267-Y298 VanDerWaalsContact CD-OH 3.24Å; R267-Y298 WeakPolarHBondContact CD-OH 3.32Å; R267-Y298 HydrophobicContact CG-CD1 4.42Å; R267-Y298 HydrophobicContact CG-CE1 3.94Å
268	F	93.3	Very high	88.8	Confident	2 Å²	2	40 Å²	40	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.6	172.2	-61.8	-91.4	0	0	0	110.3	V217 L220 V221 H231 V232 I266 L271 T296 A297 L299	V217-F268 HydrophobicContact CG1-CD2 4.32Å; V217-F268 HydrophobicContact CG1-CE1 4.29Å; V217-F268 HydrophobicContact CG1-CE2 3.45Å; V217-F268 VanDerWaalsContact CG1-CE2 3.45Å; V217-F268 HydrophobicContact CG1-CZ 3.43Å; V217-F268 VanDerWaalsContact CG1-CZ 3.43Å; L220-F268 HydrophobicContact CD2-CD1 3.95Å; L220-F268 HydrophobicContact CD2-CE1 3.89Å; V221-F268 HydrophobicContact CG2-CE1 3.51Å; V221-F268 HydrophobicContact CG2-CZ 3.62Å; H231-F268 WeakPolarHBondContact O-CA 3.47Å; V232-F268 HydrophobicContact CG2-CD1 3.93Å; V232-F268 HydrophobicContact CG2-CE1 4Å; I266-F268 HydrophobicContact CB-CE2 3.97Å; I266-F268 HydrophobicContact CB-CZ 4.34Å; I266-F268 HydrophobicContact CD1-CZ 4.48Å; I266-F268 HydrophobicContact CG2-CD2 3.95Å; I266-F268 HydrophobicContact CG2-CE1 4.12Å; I266-F268 HydrophobicContact CG2-CE2 3.42Å; I266-F268 VanDerWaalsContact CG2-CE2 3.42Å; I266-F268 HydrophobicContact CG2-CZ 3.51Å; F268-L271 HydrophobicContact CB-CD1 3.91Å; F268-L271 HydrophobicContact CD1-CD1 4.49Å; F268-L271 HydrophobicContact CG-CD1 4.36Å; F268-T296 CarbonylContact O-C 3.52Å; F268-T296 WeakPolarHBondContact O-CA 3.35Å; F268-T296 VanDerWaalsContact O-CG2 3.31Å; F268-T296 WeakPolarHBondContact O-CG2 3.37Å; F268-A297 HydrophobicContact CB-CB 4.38Å; F268-A297 PolarHBondContact N-O 3.02Å; F268-A297 PolarHBondContact O-N 2.76Å; F268-L299 HydrophobicContact CE2-CB 4.32Å
269	H	91.5	Very high	88.6	Confident	39 Å²	39	38.1 Å²	38.1	18%	0.181	18%	0.18	C	C	.	.			trans	-97.5	151.5	176.1	-62.1	-66.9	0	0	0	111.8	H231 D233 R267 L271	H231-H269 PolarHBondContact O-N 3.29Å; D233-H269 IonicContact OD1-NE2 3.78Å; D233-H269 IonicContact OD2-CD2 2.71Å; D233-H269 IonicContact OD2-CE1 2.57Å; D233-H269 PolarHBondContact OD2-CE1 2.85Å; D233-H269 IonicContact OD2-NE2 2.8Å; D233-H269 PolarHBondContact OD2-NE2 3.14Å; R267-H269 PolarHBondContact NE-CE1 2.93Å; R267-H269 VanDerWaalsContact NE-CE1 3.26Å; H269-L271 VanDerWaalsContact C-N 3.26Å; H269-L271 PolarHBondContact O-N 2.71Å; H269-L271 VanDerWaalsContact O-N 3.12Å
270	N	86.8	Confident	88.4	Confident	62 Å²	62	38.6 Å²	38.6	33%	0.332	18%	0.182	S	C	.	.			trans	45.2	45.7	171.5	-71	-34.7	0	0	0	114.8	Q272 T273 V295	N270-Q272 VanDerWaalsContact CA-OE1 3.29Å; N270-Q272 PolarHBondContact O-N 3.39Å; N270-Q272 PolarHBondContact OD1-NE2 2.92Å; N270-T273 WeakPolarHBondContact O-CB 3.39Å; N270-T273 PolarHBondContact O-N 3.38Å; N270-T273 PolarHBondContact O-OG1 3.05Å; N270-V295 PolarHBondContact N-O 2.98Å; N270-V295 VanDerWaalsContact N-O 3.17Å
271	L	86.7	Confident	88.4	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.6	-173.1	-153.8	70	0	0	0	113.3	L212 L220 F268 H269 T273 F274 S275 L278 V295 A297	L212-L271 HydrophobicContact CD1-CD2 3.7Å; L212-L271 HydrophobicContact CD2-CD2 3.42Å; L212-L271 VanDerWaalsContact CD2-CD2 3.42Å; L212-L271 HydrophobicContact CG-CD2 4.16Å; L220-L271 HydrophobicContact CD1-CD1 3.52Å; L220-L271 HydrophobicContact CD1-CG 4.37Å; L220-L271 HydrophobicContact CD2-CD1 4.23Å; F268-L271 HydrophobicContact CB-CD1 3.91Å; F268-L271 HydrophobicContact CD1-CD1 4.49Å; F268-L271 HydrophobicContact CG-CD1 4.36Å; H269-L271 VanDerWaalsContact C-N 3.26Å; H269-L271 PolarHBondContact O-N 2.71Å; H269-L271 VanDerWaalsContact O-N 3.12Å; L271-T273 PolarHBondContact O-N 3.31Å; L271-F274 PolarHBondContact O-N 3.1Å; L271-S275 PolarHBondContact O-N 3.2Å; L271-S275 VanDerWaalsContact O-N 3.15Å; L271-L278 HydrophobicContact CB-CD1 3.9Å; L271-L278 HydrophobicContact CD2-CD1 3.73Å; L271-L278 HydrophobicContact CG-CD1 3.81Å; L271-V295 HydrophobicContact CB-CG1 4.38Å; L271-V295 PolarHBondContact N-O 3.03Å; L271-A297 HydrophobicContact CD2-CB 3.84Å
272	Q	87.6	Confident	88.5	Confident	7 Å²	7	34.1 Å²	34.1	3%	0.033	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.1	169.1	72.4	-79	-2	0	0	113.8	N270 L278 R279 V282 V295 C538	N270-Q272 VanDerWaalsContact CA-OE1 3.29Å; N270-Q272 PolarHBondContact O-N 3.39Å; N270-Q272 PolarHBondContact OD1-NE2 2.92Å; Q272-L278 HydrophobicContact CB-CB 4.37Å; Q272-R279 VanDerWaalsContact O-CB 3.31Å; Q272-R279 WeakPolarHBondContact O-CB 3.35Å; Q272-R279 PolarHBondContact O-NE 2.76Å; Q272-V282 HydrophobicContact CB-CB 4.3Å; Q272-V282 HydrophobicContact CB-CG1 4.28Å; Q272-V282 HydrophobicContact CB-CG2 4.16Å; Q272-V282 HydrophobicContact CG-CG1 4.27Å; Q272-V295 HydrophobicContact CB-CG2 4.41Å; Q272-C538 HydrophobicContact CG-CB 4.21Å; Q272-C538 VanDerWaalsContact CG-SG 3.56Å
273	T	84.9	Confident	88.5	Confident	13 Å²	13	29.8 Å²	29.8	8%	0.08	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-40.9	176.4	-60.3	0	0	0	0	111.7	N270 L271 R279 G617 N618	N270-T273 WeakPolarHBondContact O-CB 3.39Å; N270-T273 PolarHBondContact O-N 3.38Å; N270-T273 PolarHBondContact O-OG1 3.05Å; L271-T273 PolarHBondContact O-N 3.31Å; T273-R279 PolarHBondContact O-NH2 2.7Å; T273-G617 VanDerWaalsContact CG2-C 3.43Å; T273-G617 VanDerWaalsContact OG1-C 3.27Å; T273-G617 WeakPolarHBondContact OG1-CA 3.38Å; T273-G617 PolarHBondContact OG1-O 2.81Å; T273-N618 HydrophobicContact CG2-CB 4.45Å; T273-N618 VanDerWaalsContact CG2-OD1 3.25Å; T273-N618 WeakPolarHBondContact CG2-OD1 3.27Å
274	F	84.2	Confident	88.8	Confident	38 Å²	38	29.5 Å²	29.5	17%	0.167	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-18.6	-175.7	-56.6	-78.8	0	0	0	113.8	L220 E224 L226 H231 L271	L220-F274 HydrophobicContact CD1-CB 3.38Å; L220-F274 HydrophobicContact CD1-CD2 4.35Å; L220-F274 HydrophobicContact CD1-CG 4.01Å; L220-F274 HydrophobicContact CG-CB 4.33Å; E224-F274 HydrophobicContact CB-CD1 4.09Å; E224-F274 HydrophobicContact CB-CE1 4.28Å; E224-F274 HydrophobicContact CG-CD1 3.78Å; E224-F274 HydrophobicContact CG-CE1 4.45Å; E224-F274 HydrophobicContact CG-CG 4.46Å; L226-F274 HydrophobicContact CD2-CD1 4.4Å; L226-F274 HydrophobicContact CD2-CE1 3.9Å; L226-F274 HydrophobicContact CD2-CE2 4.1Å; L226-F274 HydrophobicContact CD2-CZ 3.74Å; H231-F274 AromaticContact CD2-CE2 3.85Å; H231-F274 AromaticContact CD2-CZ 3.56Å; H231-F274 AromaticContact NE2-CZ 3.98Å; L271-F274 PolarHBondContact O-N 3.1Å
275	S	84.9	Confident	89	Confident	12 Å²	12	27.5 Å²	27.5	8%	0.084	12%	0.117	C	C	.	.			trans	-116.7	109.1	-178.4	176.5	0	0	0	0	112.4	L271 R277 L278 R279	L271-S275 PolarHBondContact O-N 3.2Å; L271-S275 VanDerWaalsContact O-N 3.15Å; S275-R277 PolarHBondContact O-N 3.34Å; S275-L278 PolarHBondContact O-N 3.43Å; S275-L278 PolarHBondContact OG-N 2.82Å; S275-R279 PolarHBondContact O-N 3.26Å
276	R	84.9	Confident	89	Confident	119 Å²	119	27.9 Å²	27.9	45%	0.449	12%	0.118	S	C	.	.	H	α-helix	trans	-51.1	-40.9	175.2	-161.3	177	-166.8	-134.8	-13.8	112.7	R279 F280 E541 L542	R276-R279 PolarHBondContact O-N 2.79Å; R276-F280 PolarHBondContact O-N 3.13Å; R276-E541 VanDerWaalsContact CG-CD 3.46Å; R276-E541 HydrophobicContact CG-CG 3.59Å; R276-E541 IonicContact CZ-OE1 2.71Å; R276-E541 VanDerWaalsContact NE-CD 3.35Å; R276-E541 IonicContact NE-OE1 3.13Å; R276-E541 PolarHBondContact NE-OE1 2.86Å; R276-E541 IonicContact NH2-OE1 3.92Å; R276-E541 PolarHBondContact NH2-OE1 3.22Å; R276-L542 PolarHBondContact NH2-O 3.49Å
277	R	86.1	Confident	88.8	Confident	102 Å²	102	28.6 Å²	28.6	39%	0.385	12%	0.121	S	C	.	.	H	α-helix	trans	-65.8	-38.9	178	-179.8	179.2	175.6	119.3	-10.1	112.7	E210 S275	E210-R277 VanDerWaalsContact O-CZ 3.24Å; E210-R277 PolarHBondContact O-NE 3.26Å; E210-R277 PolarHBondContact O-NH2 3.47Å; S275-R277 PolarHBondContact O-N 3.34Å
278	L	89.5	Confident	88.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.7	-46	172.7	-67.9	179.1	0	0	0	110.1	W211 L271 Q272 S275 F280 R281 V282 V295 L377	W211-L278 HydrophobicContact CB-CD2 3.93Å; W211-L278 HydrophobicContact CE3-CD2 3.79Å; W211-L278 WeakPolarHBondContact O-CD2 3.4Å; L271-L278 HydrophobicContact CB-CD1 3.9Å; L271-L278 HydrophobicContact CD2-CD1 3.73Å; L271-L278 HydrophobicContact CG-CD1 3.81Å; Q272-L278 HydrophobicContact CB-CB 4.37Å; S275-L278 PolarHBondContact O-N 3.43Å; S275-L278 PolarHBondContact OG-N 2.82Å; L278-F280 VanDerWaalsContact C-N 3.34Å; L278-F280 PolarHBondContact O-N 3.46Å; L278-R281 PolarHBondContact O-N 3.22Å; L278-V282 VanDerWaalsContact O-CB 3.26Å; L278-V282 WeakPolarHBondContact O-CB 3.47Å; L278-V282 WeakPolarHBondContact O-CG2 3.41Å; L278-V282 PolarHBondContact O-N 3.49Å; L278-V295 HydrophobicContact CD1-CG1 4.48Å; L278-L377 HydrophobicContact CD1-CD2 4.22Å; L278-L377 HydrophobicContact CD2-CD2 4Å
279	R	88.5	Confident	88.6	Confident	65 Å²	65	27.2 Å²	27.2	25%	0.245	12%	0.117	C	C	.	.	H	α-helix	trans	-54.1	-46.8	179.7	-154	-174.1	-62	163.4	-14.5	113	Q272 T273 S275 R276 V282 G283 A539 E541	Q272-R279 VanDerWaalsContact O-CB 3.31Å; Q272-R279 WeakPolarHBondContact O-CB 3.35Å; Q272-R279 PolarHBondContact O-NE 2.76Å; T273-R279 PolarHBondContact O-NH2 2.7Å; S275-R279 PolarHBondContact O-N 3.26Å; R276-R279 PolarHBondContact O-N 2.79Å; R279-V282 PolarHBondContact O-N 3.16Å; R279-G283 PolarHBondContact O-N 2.88Å; R279-A539 WeakPolarHBondContact CD-O 3.01Å; R279-A539 WeakPolarHBondContact CG-O 3.4Å; R279-E541 HydrophobicContact CB-CB 4.09Å; R279-E541 WeakPolarHBondContact CD-OE2 3.38Å; R279-E541 HydrophobicContact CG-CB 4.19Å; R279-E541 IonicContact CZ-OE2 2.7Å; R279-E541 IonicContact NE-OE2 2.66Å; R279-E541 IonicContact NH1-OE2 2.62Å; R279-E541 PolarHBondContact NH1-OE2 2.88Å
280	F	88.7	Confident	88.5	Confident	40 Å²	40	27 Å²	27	18%	0.175	13%	0.125	C	C	.	.	H	α-helix	trans	-56.6	-56.2	176.7	-178.4	-98	0	0	0	112	R276 L278 V282 G283 L284 E541	R276-F280 PolarHBondContact O-N 3.13Å; L278-F280 VanDerWaalsContact C-N 3.34Å; L278-F280 PolarHBondContact O-N 3.46Å; F280-V282 PolarHBondContact O-N 3.09Å; F280-G283 PolarHBondContact O-N 3.29Å; F280-L284 HydrophobicContact CD1-CD1 4.13Å; F280-L284 HydrophobicContact CE1-CD1 3.55Å; F280-L284 HydrophobicContact CZ-CD1 3.77Å; F280-L284 WeakPolarHBondContact O-CG 3.37Å; F280-L284 PolarHBondContact O-N 2.94Å; F280-L284 VanDerWaalsContact O-N 3.13Å; F280-E541 HydrophobicContact CB-CB 4.08Å; F280-E541 HydrophobicContact CB-CG 4.33Å; F280-E541 WeakPolarHBondContact CD2-O 3.42Å
281	R	90.8	Very high	88.6	Confident	28 Å²	28	24.1 Å²	24.1	11%	0.106	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-41.2	-179.5	-71.8	179.5	168	177.5	-3.6	112.5	L176 G209 W211 L278 L284 L285	L176-R281 HydrophobicContact CD1-CG 4.18Å; L176-R281 HydrophobicContact CD2-CB 3.83Å; L176-R281 HydrophobicContact CD2-CG 4.1Å; L176-R281 VanDerWaalsContact CD2-O 3.24Å; L176-R281 WeakPolarHBondContact CD2-O 3.39Å; G209-R281 PolarHBondContact O-NH1 2.77Å; G209-R281 PolarHBondContact O-NH2 3.22Å; W211-R281 HydrophobicContact CE3-CB 4.29Å; W211-R281 VanDerWaalsContact CG-NH1 3.3Å; W211-R281 HydrophobicContact CH2-CB 3.6Å; W211-R281 HydrophobicContact CH2-CG 4.21Å; W211-R281 HydrophobicContact CZ2-CB 4.41Å; W211-R281 HydrophobicContact CZ3-CB 3.53Å; W211-R281 HydrophobicContact CZ3-CG 4.32Å; L278-R281 PolarHBondContact O-N 3.22Å; R281-L284 PolarHBondContact O-N 3.3Å; R281-L285 WeakPolarHBondContact O-CG 3.38Å; R281-L285 PolarHBondContact O-N 2.94Å
282	V	91.1	Very high	88.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-41.7	178.7	170.2	0	0	0	0	111.4	Q272 L278 R279 F280 L284 L285 Q286 F293 V295	Q272-V282 HydrophobicContact CB-CB 4.3Å; Q272-V282 HydrophobicContact CB-CG1 4.28Å; Q272-V282 HydrophobicContact CB-CG2 4.16Å; Q272-V282 HydrophobicContact CG-CG1 4.27Å; L278-V282 VanDerWaalsContact O-CB 3.26Å; L278-V282 WeakPolarHBondContact O-CB 3.47Å; L278-V282 WeakPolarHBondContact O-CG2 3.41Å; L278-V282 PolarHBondContact O-N 3.49Å; R279-V282 PolarHBondContact O-N 3.16Å; F280-V282 PolarHBondContact O-N 3.09Å; V282-L284 PolarHBondContact O-N 2.77Å; V282-L285 PolarHBondContact O-N 3.24Å; V282-Q286 WeakPolarHBondContact O-CB 3.37Å; V282-Q286 PolarHBondContact O-N 2.95Å; V282-F293 HydrophobicContact CG1-CB 3.74Å; V282-V295 HydrophobicContact CG2-CG2 3.35Å
283	G	89.7	Confident	88.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61	-41.5	176	0	0	0	0	0	112.7	R279 F280 Q286 E287	R279-G283 PolarHBondContact O-N 2.88Å; F280-G283 PolarHBondContact O-N 3.29Å; G283-Q286 WeakPolarHBondContact O-CB 3.44Å; G283-Q286 PolarHBondContact O-N 3.34Å; G283-E287 WeakPolarHBondContact O-CG 3.37Å; G283-E287 PolarHBondContact O-N 3.16Å
284	L	90.8	Very high	89.1	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-39.2	175.2	-68.4	178.8	0	0	0	113	P169 Q172 L176 F280 R281 V282 Y288	P169-L284 HydrophobicContact CB-CD2 4.04Å; Q172-L284 HydrophobicContact CB-CD1 3.98Å; Q172-L284 HydrophobicContact CB-CD2 3.88Å; L176-L284 HydrophobicContact CD2-CB 4.05Å; L176-L284 HydrophobicContact CD2-CD1 4.3Å; F280-L284 HydrophobicContact CD1-CD1 4.13Å; F280-L284 HydrophobicContact CE1-CD1 3.55Å; F280-L284 HydrophobicContact CZ-CD1 3.77Å; F280-L284 WeakPolarHBondContact O-CG 3.37Å; F280-L284 PolarHBondContact O-N 2.94Å; F280-L284 VanDerWaalsContact O-N 3.13Å; R281-L284 PolarHBondContact O-N 3.3Å; V282-L284 PolarHBondContact O-N 2.77Å; L284-Y288 WeakPolarHBondContact O-CB 3.38Å; L284-Y288 PolarHBondContact O-N 3.02Å
285	L	92.8	Very high	89.6	Confident	1 Å²	1	25 Å²	25	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-68.5	-42.9	174	-65.9	174.7	0	0	0	111.7	L176 L177 I180 W211 R281 V282 E287 Y288 F289 F293	L176-L285 HydrophobicContact CD2-CD2 4.34Å; L176-L285 HydrophobicContact CD2-CG 4.09Å; L176-L285 HydrophobicContact CG-CD2 4.46Å; L177-L285 HydrophobicContact CB-CD2 4.18Å; L177-L285 HydrophobicContact CD1-CD2 4.33Å; I180-L285 HydrophobicContact CD1-CD1 3.9Å; I180-L285 HydrophobicContact CD1-CD2 4.12Å; W211-L285 HydrophobicContact CH2-CD1 4.25Å; R281-L285 WeakPolarHBondContact O-CG 3.38Å; R281-L285 PolarHBondContact O-N 2.94Å; V282-L285 PolarHBondContact O-N 3.24Å; L285-E287 VanDerWaalsContact C-N 3.33Å; L285-E287 PolarHBondContact O-N 2.74Å; L285-Y288 PolarHBondContact O-N 3.36Å; L285-F289 WeakPolarHBondContact O-CD2 3.42Å; L285-F289 PolarHBondContact O-N 2.88Å; L285-F293 HydrophobicContact CB-CD1 3.79Å; L285-F293 HydrophobicContact CB-CE1 3.7Å; L285-F293 HydrophobicContact CB-CE2 4.43Å; L285-F293 HydrophobicContact CB-CG 4.24Å; L285-F293 HydrophobicContact CB-CZ 4.05Å; L285-F293 HydrophobicContact CD1-CD1 4.12Å; L285-F293 HydrophobicContact CD1-CE1 4.02Å; L285-F293 HydrophobicContact CG-CE1 4.41Å
286	Q	91.3	Very high	90	Very high	9 Å²	9	25.4 Å²	25.4	4%	0.042	12%	0.12	C	C	.	.	H	α-helix	trans	-56.2	-45.4	175.8	179.2	-178	-92.2	0	0	111.5	V282 G283 G290 C291 F293 C538	V282-Q286 WeakPolarHBondContact O-CB 3.37Å; V282-Q286 PolarHBondContact O-N 2.95Å; G283-Q286 WeakPolarHBondContact O-CB 3.44Å; G283-Q286 PolarHBondContact O-N 3.34Å; Q286-G290 WeakPolarHBondContact O-CA 3.3Å; Q286-G290 PolarHBondContact O-N 3.49Å; Q286-C291 WeakPolarHBondContact CA-O 3.41Å; Q286-C291 WeakPolarHBondContact CG-O 3.33Å; Q286-C291 PolarHBondContact O-N 3.27Å; Q286-F293 HydrophobicContact CB-CD2 4.36Å; Q286-C538 PolarHBondContact NE2-O 3.13Å
287	E	87.8	Confident	90.4	Very high	14 Å²	14	19.7 Å²	19.7	7%	0.065	10%	0.098	C	C	.	.	H	α-helix	trans	-69.9	-37.9	176	-71.1	174.9	111.7	0	0	112.8	L170 G283 L285 R572 T574	L170-E287 VanDerWaalsContact CD2-O 3.32Å; L170-E287 WeakPolarHBondContact CD2-O 3.47Å; G283-E287 WeakPolarHBondContact O-CG 3.37Å; G283-E287 PolarHBondContact O-N 3.16Å; L285-E287 VanDerWaalsContact C-N 3.33Å; L285-E287 PolarHBondContact O-N 2.74Å; E287-R572 IonicContact OE1-NE 2.75Å; E287-R572 PolarHBondContact OE1-NE 3.08Å; E287-R572 IonicContact OE2-CZ 2.95Å; E287-R572 IonicContact OE2-NE 3.89Å; E287-R572 PolarHBondContact OE2-NE 3.42Å; E287-R572 IonicContact OE2-NH2 3.76Å; E287-R572 PolarHBondContact OE2-NH2 3.17Å; E287-T574 HydrophobicContact CB-CG2 4.5Å; E287-T574 VanDerWaalsContact CD-OG1 3.26Å; E287-T574 WeakPolarHBondContact OE1-CB 3.33Å; E287-T574 PolarHBondContact OE1-OG1 3.17Å
288	Y	91.6	Very high	90.7	Very high	7 Å²	7	15.4 Å²	15.4	3%	0.027	8%	0.082	C	C	.	.	H	α-helix	trans	-65.6	-42.8	177.5	-174.2	-107.1	0	0	0	112.8	R5 L170 E174 L177 F190 L284 L285	R5-Y288 PolarHBondContact NH1-O 3.1Å; R5-Y288 PolarHBondContact NH2-OH 2.87Å; L170-Y288 WeakPolarHBondContact O-CD2 3.42Å; E174-Y288 HydrophobicContact CB-CD2 4Å; E174-Y288 HydrophobicContact CB-CE2 3.37Å; E174-Y288 HydrophobicContact CG-CE2 3.72Å; E174-Y288 WeakPolarHBondContact CG-OH 3.31Å; E174-Y288 VanDerWaalsContact OE2-CE2 3.31Å; E174-Y288 WeakPolarHBondContact OE2-CE2 3.34Å; E174-Y288 PolarHBondContact OE2-OH 3.36Å; L177-Y288 HydrophobicContact CD2-CD1 3.89Å; L177-Y288 HydrophobicContact CD2-CE1 3.51Å; F190-Y288 HydrophobicContact CE2-CE1 4.48Å; F190-Y288 HydrophobicContact CZ-CE1 4.3Å; L284-Y288 WeakPolarHBondContact O-CB 3.38Å; L284-Y288 PolarHBondContact O-N 3.02Å; L285-Y288 PolarHBondContact O-N 3.36Å
289	F	91	Very high	90.9	Very high	9 Å²	9	15.4 Å²	15.4	4%	0.039	8%	0.082	C	C	.	.	H	α-helix	trans	-86.7	-23.7	-179.4	-79.5	-88.2	0	0	0	113.7	L177 F190 Y194 L285 C291 F293 F381	L177-F289 HydrophobicContact CD1-CE2 4.39Å; L177-F289 HydrophobicContact CD2-CE2 3.71Å; L177-F289 HydrophobicContact CD2-CZ 3.68Å; F190-F289 HydrophobicContact CE1-CE1 4.04Å; F190-F289 HydrophobicContact CE1-CZ 4.49Å; F190-F289 HydrophobicContact CZ-CE1 4.09Å; F190-F289 HydrophobicContact CZ-CZ 4.22Å; Y194-F289 AromaticContact CE2-CE1 3.95Å; Y194-F289 HydrophobicContact CE2-CE1 3.95Å; L285-F289 WeakPolarHBondContact O-CD2 3.42Å; L285-F289 PolarHBondContact O-N 2.88Å; F289-C291 VanDerWaalsContact C-N 3.35Å; F289-F293 HydrophobicContact CB-CE2 3.73Å; F289-F293 HydrophobicContact CB-CZ 4.17Å; F289-F293 HydrophobicContact CD2-CE1 4.36Å; F289-F293 AromaticContact CD2-CE2 3.77Å; F289-F293 HydrophobicContact CD2-CE2 3.77Å; F289-F293 AromaticContact CD2-CZ 3.33Å; F289-F293 HydrophobicContact CD2-CZ 3.33Å; F289-F293 AromaticContact CE2-CZ 3.77Å; F289-F293 HydrophobicContact CE2-CZ 3.77Å; F289-F293 AromaticContact CG-CE2 3.9Å; F289-F293 HydrophobicContact CG-CE2 3.9Å; F289-F293 AromaticContact CG-CZ 3.81Å; F289-F293 HydrophobicContact CG-CZ 3.81Å; F289-F381 HydrophobicContact CD1-CD2 4.3Å; F289-F381 AromaticContact CD1-CE2 3.99Å; F289-F381 HydrophobicContact CD1-CE2 3.99Å; F289-F381 HydrophobicContact CE1-CD2 4.42Å; F289-F381 AromaticContact CE1-CE2 3.69Å; F289-F381 HydrophobicContact CE1-CE2 3.69Å; F289-F381 HydrophobicContact CE2-CE2 4.49Å; F289-F381 AromaticContact CZ-CE2 3.97Å; F289-F381 HydrophobicContact CZ-CE2 3.97Å; F289-F381 HydrophobicContact CZ-CZ 4.49Å
290	G	88	Confident	91	Very high	35 Å²	35	12.3 Å²	12.3	36%	0.361	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	23	-175.9	0	0	0	0	0	113.9	Q286 Y385	Q286-G290 WeakPolarHBondContact O-CA 3.3Å; Q286-G290 PolarHBondContact O-N 3.49Å; G290-Y385 PolarHBondContact O-OH 2.78Å
291	C	89.4	Confident	90.8	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.014	7%	0.065	C	C	.	.	S	Bend	trans	-143.1	164.1	178.8	70.3	0	0	0	0	110.8	Q286 F289 F293 N382 Y385	Q286-C291 WeakPolarHBondContact CA-O 3.41Å; Q286-C291 WeakPolarHBondContact CG-O 3.33Å; Q286-C291 PolarHBondContact O-N 3.27Å; F289-C291 VanDerWaalsContact C-N 3.35Å; C291-F293 WeakPolarHBondContact O-CD2 3.21Å; C291-N382 PolarHBondContact SG-OD1 3.5Å; C291-Y385 HydrophobicContact CB-CD1 3.46Å; C291-Y385 VanDerWaalsContact CB-CD1 3.46Å; C291-Y385 HydrophobicContact CB-CD2 4.05Å; C291-Y385 HydrophobicContact CB-CE1 3.74Å; C291-Y385 HydrophobicContact CB-CE2 4.32Å; C291-Y385 HydrophobicContact CB-CG 3.61Å
292	N	88.2	Confident	90.2	Very high	29 Å²	29	12.8 Å²	12.8	16%	0.155	8%	0.083	C	C	.	.			trans	-70.9	142	-175.1	-67.1	-25.6	0	0	0	112.7	F381 I533 E536 S537	N292-F381 WeakPolarHBondContact O-CA 3.44Å; N292-I533 PolarHBondContact ND2-O 3.34Å; N292-I533 VanDerWaalsContact ND2-O 3.1Å; N292-I533 WeakPolarHBondContact OD1-CG2 3.19Å; N292-I533 PolarHBondContact OD1-O 2.92Å; N292-I533 VanDerWaalsContact OD1-O 3.05Å; N292-E536 WeakPolarHBondContact ND2-CB 3.32Å; N292-S537 WeakPolarHBondContact OD1-CA 3.41Å; N292-S537 WeakPolarHBondContact OD1-CB 3.18Å; N292-S537 PolarHBondContact OD1-N 3.43Å; N292-S537 PolarHBondContact OD1-OG 2.93Å
293	F	92	Very high	89.5	Confident	2 Å²	2	18 Å²	18	1%	0.009	11%	0.106	C	C	.	.			trans	-121.4	129.6	175.4	-84.7	-117.2	0	0	0	109.4	V282 L285 Q286 F289 C291 I379 S380 F381	V282-F293 HydrophobicContact CG1-CB 3.74Å; L285-F293 HydrophobicContact CB-CD1 3.79Å; L285-F293 HydrophobicContact CB-CE1 3.7Å; L285-F293 HydrophobicContact CB-CE2 4.43Å; L285-F293 HydrophobicContact CB-CG 4.24Å; L285-F293 HydrophobicContact CB-CZ 4.05Å; L285-F293 HydrophobicContact CD1-CD1 4.12Å; L285-F293 HydrophobicContact CD1-CE1 4.02Å; L285-F293 HydrophobicContact CG-CE1 4.41Å; Q286-F293 HydrophobicContact CB-CD2 4.36Å; F289-F293 HydrophobicContact CB-CE2 3.73Å; F289-F293 HydrophobicContact CB-CZ 4.17Å; F289-F293 HydrophobicContact CD2-CE1 4.36Å; F289-F293 AromaticContact CD2-CE2 3.77Å; F289-F293 HydrophobicContact CD2-CE2 3.77Å; F289-F293 AromaticContact CD2-CZ 3.33Å; F289-F293 HydrophobicContact CD2-CZ 3.33Å; F289-F293 AromaticContact CE2-CZ 3.77Å; F289-F293 HydrophobicContact CE2-CZ 3.77Å; F289-F293 AromaticContact CG-CE2 3.9Å; F289-F293 HydrophobicContact CG-CE2 3.9Å; F289-F293 AromaticContact CG-CZ 3.81Å; F289-F293 HydrophobicContact CG-CZ 3.81Å; C291-F293 WeakPolarHBondContact O-CD2 3.21Å; F293-I379 HydrophobicContact CD1-CG2 3.61Å; F293-I379 HydrophobicContact CE1-CG2 4.25Å; F293-S380 WeakPolarHBondContact CA-O 3.21Å; F293-F381 HydrophobicContact CD1-CB 3.94Å; F293-F381 HydrophobicContact CD1-CG 4.38Å; F293-F381 HydrophobicContact CD2-CB 3.65Å; F293-F381 HydrophobicContact CD2-CG 4.49Å; F293-F381 HydrophobicContact CE1-CB 3.73Å; F293-F381 AromaticContact CE1-CD1 4Å; F293-F381 HydrophobicContact CE1-CD1 4Å; F293-F381 HydrophobicContact CE1-CD2 4.08Å; F293-F381 AromaticContact CE1-CG 3.7Å; F293-F381 HydrophobicContact CE1-CG 3.7Å; F293-F381 HydrophobicContact CE2-CB 3.41Å; F293-F381 VanDerWaalsContact CE2-CB 3.41Å; F293-F381 AromaticContact CE2-CD2 3.76Å; F293-F381 HydrophobicContact CE2-CD2 3.76Å; F293-F381 AromaticContact CE2-CG 3.83Å; F293-F381 HydrophobicContact CE2-CG 3.83Å; F293-F381 HydrophobicContact CG-CB 3.88Å; F293-F381 HydrophobicContact CZ-CB 3.44Å; F293-F381 VanDerWaalsContact CZ-CB 3.44Å; F293-F381 HydrophobicContact CZ-CD1 4.08Å; F293-F381 AromaticContact CZ-CD2 3.32Å; F293-F381 HydrophobicContact CZ-CD2 3.32Å; F293-F381 AromaticContact CZ-CE2 3.99Å; F293-F381 HydrophobicContact CZ-CE2 3.99Å; F293-F381 AromaticContact CZ-CG 3.37Å; F293-F381 HydrophobicContact CZ-CG 3.37Å
294	T	90.8	Very high	88.7	Confident	47 Å²	47	22 Å²	22	29%	0.288	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.3	176.3	59.2	0	0	0	0	111.2	I379 S380	T294-I379 WeakPolarHBondContact O-CA 3.31Å; T294-S380 PolarHBondContact N-O 2.83Å; T294-S380 PolarHBondContact O-N 2.96Å; T294-S380 PolarHBondContact O-OG 2.98Å; T294-S380 PolarHBondContact OG1-OG 3.08Å
295	V	92.9	Very high	88	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	112.1	-178.7	-173.4	0	0	0	0	110.2	N270 L271 Q272 L278 V282 L377 I379	N270-V295 PolarHBondContact N-O 2.98Å; N270-V295 VanDerWaalsContact N-O 3.17Å; L271-V295 HydrophobicContact CB-CG1 4.38Å; L271-V295 PolarHBondContact N-O 3.03Å; Q272-V295 HydrophobicContact CB-CG2 4.41Å; L278-V295 HydrophobicContact CD1-CG1 4.48Å; V282-V295 HydrophobicContact CG2-CG2 3.35Å; V295-L377 HydrophobicContact CG1-CB 4.17Å; V295-L377 HydrophobicContact CG1-CD2 3.45Å; V295-L377 VanDerWaalsContact CG1-CD2 3.45Å; V295-L377 HydrophobicContact CG1-CG 4.43Å; V295-I379 HydrophobicContact CG1-CG1 4.49Å; V295-I379 HydrophobicContact CG2-CG1 4.22Å
296	T	93.3	Very high	87.4	Confident	21 Å²	21	27 Å²	27	13%	0.129	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	143.5	165.9	-53.4	0	0	0	0	108.7	R267 F268 Y298 L377 C378	R267-T296 HydrophobicContact CG-CG2 3.61Å; F268-T296 CarbonylContact O-C 3.52Å; F268-T296 WeakPolarHBondContact O-CA 3.35Å; F268-T296 VanDerWaalsContact O-CG2 3.31Å; F268-T296 WeakPolarHBondContact O-CG2 3.37Å; T296-Y298 HydrophobicContact CG2-CD2 4.16Å; T296-Y298 HydrophobicContact CG2-CE2 3.5Å; T296-Y298 VanDerWaalsContact CG2-CE2 3.5Å; T296-L377 CarbonylContact O-C 3.58Å; T296-L377 WeakPolarHBondContact O-CA 3.43Å; T296-C378 PolarHBondContact N-O 3.23Å; T296-C378 PolarHBondContact O-N 2.88Å
297	A	94	Very high	87	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.4	170.3	0	0	0	0	0	111.2	L212 R267 F268 L271 H376	L212-A297 HydrophobicContact CD2-CB 3.65Å; R267-A297 CarbonylContact C-O 3.51Å; R267-A297 WeakPolarHBondContact CA-O 3.46Å; F268-A297 HydrophobicContact CB-CB 4.38Å; F268-A297 PolarHBondContact N-O 3.02Å; F268-A297 PolarHBondContact O-N 2.76Å; L271-A297 HydrophobicContact CD2-CB 3.84Å; A297-H376 WeakPolarHBondContact CA-O 3.49Å
298	Y	93.4	Very high	86.8	Confident	11 Å²	11	27.8 Å²	27.8	4%	0.043	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.2	178.1	-69.9	-94.6	0	0	0	109.4	I235 L240 R267 T296 L307 F309 L375 H376 C378	I235-Y298 HydrophobicContact CD1-CD1 3.78Å; I235-Y298 HydrophobicContact CD1-CE1 4.15Å; L240-Y298 HydrophobicContact CD1-CE1 4.23Å; R267-Y298 HydrophobicContact CB-CD1 4.2Å; R267-Y298 HydrophobicContact CB-CE1 4.02Å; R267-Y298 VanDerWaalsContact CD-OH 3.24Å; R267-Y298 WeakPolarHBondContact CD-OH 3.32Å; R267-Y298 HydrophobicContact CG-CD1 4.42Å; R267-Y298 HydrophobicContact CG-CE1 3.94Å; T296-Y298 HydrophobicContact CG2-CD2 4.16Å; T296-Y298 HydrophobicContact CG2-CE2 3.5Å; T296-Y298 VanDerWaalsContact CG2-CE2 3.5Å; Y298-L307 HydrophobicContact CD1-CD1 4.28Å; Y298-F309 HydrophobicContact CE1-CZ 4.03Å; Y298-F309 AromaticContact CZ-CZ 3.79Å; Y298-F309 WeakPolarHBondContact OH-CE1 3.39Å; Y298-L375 WeakPolarHBondContact O-CA 3.43Å; Y298-H376 AromaticContact CD2-CD2 3.96Å; Y298-H376 AromaticContact CD2-NE2 3.4Å; Y298-H376 WeakPolarHBondContact CD2-NE2 3.43Å; Y298-H376 AromaticContact CG-NE2 3.68Å; Y298-H376 PolarHBondContact N-O 3.38Å; Y298-H376 PolarHBondContact O-N 2.86Å; Y298-C378 HydrophobicContact CE2-CB 4.27Å
299	L	93	Very high	86.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	106.7	174	173.3	57.1	0	0	0	108.2	Y214 V217 W257 Y260 I266 F268 H373 T374 L375	Y214-L299 HydrophobicContact CD2-CD1 3.73Å; Y214-L299 HydrophobicContact CD2-CD2 4Å; Y214-L299 HydrophobicContact CE2-CD1 3.91Å; Y214-L299 HydrophobicContact CE2-CD2 3.78Å; Y214-L299 HydrophobicContact CE2-CG 4.43Å; V217-L299 HydrophobicContact CG1-CD2 3.98Å; W257-L299 HydrophobicContact CH2-CD2 4.17Å; W257-L299 HydrophobicContact CZ3-CD2 4.11Å; Y260-L299 HydrophobicContact CE2-CD1 4.35Å; Y260-L299 HydrophobicContact CE2-CD2 4.29Å; Y260-L299 HydrophobicContact CE2-CG 3.77Å; Y260-L299 WeakPolarHBondContact OH-CD1 3.32Å; I266-L299 HydrophobicContact CB-CB 4.49Å; I266-L299 HydrophobicContact CD1-CD2 4.26Å; I266-L299 PolarHBondContact N-O 2.99Å; I266-L299 PolarHBondContact O-N 2.84Å; F268-L299 HydrophobicContact CE2-CB 4.32Å; L299-H373 HydrophobicContact CD1-CB 4.2Å; L299-T374 WeakPolarHBondContact CA-O 3.42Å; L299-L375 HydrophobicContact CB-CD1 4.14Å
300	L	90.1	Very high	86.2	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.3	180	-47.3	-176.7	0	0	0	110.4	I235 L307 H373 T374	I235-L300 HydrophobicContact CD1-CD2 3.87Å; L300-L307 HydrophobicContact CD1-CD1 3.84Å; L300-L307 HydrophobicContact CD2-CD1 4.01Å; L300-H373 CarbonylContact O-C 3.51Å; L300-H373 WeakPolarHBondContact O-CA 3.29Å; L300-H373 VanDerWaalsContact O-CB 3.29Å; L300-H373 WeakPolarHBondContact O-CB 3.46Å; L300-T374 PolarHBondContact N-O 3.19Å; L300-T374 PolarHBondContact O-N 3.48Å
301	S	85.5	Confident	86.2	Confident	9 Å²	9	35.9 Å²	35.9	6%	0.063	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	177	173.3	78.6	0	0	0	0	111.5	G263 K303	G263-S301 PolarHBondContact O-OG 2.84Å; S301-K303 PolarHBondContact O-N 2.81Å; S301-K303 PolarHBondContact OG-N 3.43Å
302	S	77.4	Confident	86.2	Confident	68 Å²	68	36.6 Å²	36.6	48%	0.476	20%	0.198	S	C	.	.	S	Bend	trans	-70.3	-6.9	174.9	56.5	0	0	0	0	114.6	H366 K372	S302-H366 PolarHBondContact O-CE1 2.74Å; S302-K372 WeakPolarHBondContact CB-O 3.47Å; S302-K372 PolarHBondContact N-O 3.01Å
303	K	77.6	Confident	86.3	Confident	111 Å²	111	38.5 Å²	38.5	48%	0.483	21%	0.208	S	C	.	.	S	Bend	trans	-64.7	145.2	176.1	-69.6	-169.6	177.7	179.3	0	110.2	Q262 S301 T305	Q262-K303 PolarHBondContact O-NZ 2.83Å; S301-K303 PolarHBondContact O-N 2.81Å; S301-K303 PolarHBondContact OG-N 3.43Å; K303-T305 PolarHBondContact O-N 2.86Å
304	P	71.9	Confident	86.3	Confident	83 Å²	83	40 Å²	40	54%	0.539	22%	0.215	S	C	.	.			trans	-59.9	128.1	166	27.4	-33.2	0	0	0	108.4
305	T	76	Confident	86.6	Confident	11 Å²	11	37.8 Å²	37.8	7%	0.067	20%	0.202	C	C	.	.			trans	-141.6	134.5	175.3	-51.4	0	0	0	0	107.6	D237 K303 L307 H366	D237-T305 HydrophobicContact CB-CG2 4.49Å; D237-T305 WeakPolarHBondContact OD1-CA 3.24Å; K303-T305 PolarHBondContact O-N 2.86Å; T305-L307 HydrophobicContact CG2-CD2 3.75Å; T305-L307 HydrophobicContact CG2-CG 4.3Å; T305-H366 PolarHBondContact O-N 2.66Å
306	E	79.9	Confident	86.7	Confident	98 Å²	98	38.1 Å²	38.1	46%	0.458	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.2	175	-166.4	177.3	126.2	0	0	111	D237 K238 T363 I364	D237-E306 PolarHBondContact OD1-N 2.97Å; K238-E306 CarbonylContact C-O 3.57Å; E306-T363 HydrophobicContact CG-CG2 3.42Å; E306-T363 VanDerWaalsContact CG-CG2 3.42Å; E306-T363 WeakPolarHBondContact OE1-CG2 3.22Å; E306-I364 CarbonylContact C-O 3.56Å; E306-I364 WeakPolarHBondContact CA-O 3.34Å
307	L	83.9	Confident	86.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	94.6	-177.2	-54.1	-178.3	0	0	0	109.4	I235 L240 Y298 L300 T305 F309 T363 I364	I235-L307 HydrophobicContact CD1-CD1 4.45Å; I235-L307 HydrophobicContact CG2-CD2 3.5Å; I235-L307 VanDerWaalsContact CG2-CD2 3.5Å; L240-L307 HydrophobicContact CD1-CB 3.97Å; L240-L307 HydrophobicContact CD1-CD1 4.32Å; L240-L307 HydrophobicContact CD1-CD2 4.16Å; L240-L307 HydrophobicContact CD1-CG 4.38Å; L240-L307 HydrophobicContact CG-CD2 4.04Å; Y298-L307 HydrophobicContact CD1-CD1 4.28Å; L300-L307 HydrophobicContact CD1-CD1 3.84Å; L300-L307 HydrophobicContact CD2-CD1 4.01Å; T305-L307 HydrophobicContact CG2-CD2 3.75Å; T305-L307 HydrophobicContact CG2-CG 4.3Å; L307-F309 HydrophobicContact CB-CE2 3.77Å; L307-F309 HydrophobicContact CB-CZ 4.43Å; L307-F309 VanDerWaalsContact O-CD2 3.31Å; L307-F309 WeakPolarHBondContact O-CD2 3.45Å; L307-T363 WeakPolarHBondContact O-CA 3.45Å; L307-I364 HydrophobicContact CB-CB 4.26Å; L307-I364 PolarHBondContact N-O 3.41Å; L307-I364 PolarHBondContact O-N 2.86Å
308	S	83.2	Confident	86.9	Confident	39 Å²	39	37.3 Å²	37.3	27%	0.273	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.2	178.1	-82.9	0	0	0	0	112.4	T363	S308-T363 VanDerWaalsContact OG-CG2 3.25Å; S308-T363 WeakPolarHBondContact OG-CG2 3.33Å; S308-T363 PolarHBondContact OG-OG1 3.34Å
309	F	85.2	Confident	87	Confident	37 Å²	37	36.8 Å²	36.8	16%	0.162	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	144.7	176.5	-62.8	-98.4	0	0	0	111.4	L240 Y298 L307 H362 I364	L240-F309 HydrophobicContact CD1-CD1 4.37Å; L240-F309 HydrophobicContact CD1-CE1 3.52Å; L240-F309 HydrophobicContact CD1-CE2 3.83Å; L240-F309 HydrophobicContact CD1-CZ 3.21Å; Y298-F309 HydrophobicContact CE1-CZ 4.03Å; Y298-F309 AromaticContact CZ-CZ 3.79Å; Y298-F309 WeakPolarHBondContact OH-CE1 3.39Å; L307-F309 HydrophobicContact CB-CE2 3.77Å; L307-F309 HydrophobicContact CB-CZ 4.43Å; L307-F309 VanDerWaalsContact O-CD2 3.31Å; L307-F309 WeakPolarHBondContact O-CD2 3.45Å; F309-H362 WeakPolarHBondContact CA-O 3.4Å; F309-H362 VanDerWaalsContact CB-O 3.31Å; F309-H362 WeakPolarHBondContact CB-O 3.45Å; F309-H362 AromaticContact CD2-CD2 3.7Å; F309-H362 AromaticContact CD2-NE2 3.39Å; F309-H362 WeakPolarHBondContact CD2-NE2 3.36Å; F309-H362 AromaticContact CE2-NE2 3.9Å; F309-H362 AromaticContact CG-CE1 3.84Å; F309-H362 AromaticContact CG-NE2 3.66Å; F309-H362 PolarHBondContact N-O 3Å; F309-H362 PolarHBondContact O-N 3.42Å; F309-I364 HydrophobicContact CD2-CD1 4.38Å; F309-I364 HydrophobicContact CD2-CG1 4.28Å; F309-I364 HydrophobicContact CE2-CD1 3.58Å; F309-I364 HydrophobicContact CE2-CG1 3.86Å; F309-I364 HydrophobicContact CZ-CD1 4.28Å
310	N	85.2	Confident	87	Confident	88 Å²	88	36.8 Å²	36.8	47%	0.471	20%	0.196	S	C	.	.			trans	-79.8	-179	178.8	-75.6	-132.2	0	0	0	110.5	K241 L312	K241-N310 WeakPolarHBondContact CE-OD1 3.41Å; K241-N310 PolarHBondContact NZ-OD1 3.05Å; N310-L312 PolarHBondContact O-N 2.9Å
311	Q	86.8	Confident	87.1	Confident	96 Å²	96	37.8 Å²	37.8	45%	0.449	20%	0.201	S	C	.	.			trans	-59.2	122.9	175.4	-69.2	-178	-100.6	0	0	110.7	N332 G359 F360 A361	Q311-N332 PolarHBondContact OE1-ND2 3.41Å; Q311-G359 PolarHBondContact NE2-O 3.09Å; Q311-F360 WeakPolarHBondContact CA-O 3.19Å; Q311-A361 HydrophobicContact CG-CB 4.14Å
312	L	89.3	Confident	87.3	Confident	17 Å²	17	39.6 Å²	39.6	9%	0.089	21%	0.208	C	C	.	.			trans	-67.1	138	-179.1	-55.1	180	0	0	0	111.1	N310 H314 L316 I356 K358 G359 F360	N310-L312 PolarHBondContact O-N 2.9Å; L312-H314 VanDerWaalsContact C-N 3.32Å; L312-H314 WeakPolarHBondContact CB-O 3.48Å; L312-L316 HydrophobicContact CD1-CB 3.75Å; L312-L316 HydrophobicContact CD1-CD2 3.77Å; L312-L316 HydrophobicContact CD1-CG 4.42Å; L312-I356 HydrophobicContact CD1-CB 4.28Å; L312-I356 HydrophobicContact CD1-CG2 3.92Å; L312-K358 WeakPolarHBondContact O-CG 3.44Å; L312-G359 PolarHBondContact O-N 3.41Å; L312-F360 PolarHBondContact N-O 2.74Å
313	D	90.6	Very high	87.8	Confident	69 Å²	69	36.8 Å²	36.8	37%	0.369	19%	0.19	S	C	.	.	S	Bend	trans	-90.5	-0.3	171.3	73	-41.1	0	0	0	112.9	K358 Q383	D313-K358 VanDerWaalsContact O-CD 3.26Å; D313-K358 WeakPolarHBondContact O-CD 3.47Å; D313-K358 WeakPolarHBondContact O-CE 3.41Å; D313-K358 PolarHBondContact O-NZ 2.79Å; D313-Q383 WeakPolarHBondContact OD2-CG 3.37Å; D313-Q383 PolarHBondContact OD2-NE2 2.78Å
314	H	93.2	Very high	88.4	Confident	34 Å²	34	32.2 Å²	32.2	16%	0.157	17%	0.172	C	C	.	.	S	Bend	trans	-133.5	167.6	-175.5	55.8	-96.2	0	0	0	110.3	L312 K358 S380 F381 Q383	L312-H314 VanDerWaalsContact C-N 3.32Å; L312-H314 WeakPolarHBondContact CB-O 3.48Å; H314-K358 VanDerWaalsContact O-CA 3.29Å; H314-K358 WeakPolarHBondContact O-CA 3.19Å; H314-K358 PolarHBondContact O-N 2.59Å; H314-S380 VanDerWaalsContact CD2-CB 3.42Å; H314-S380 WeakPolarHBondContact CD2-CB 3.41Å; H314-F381 WeakPolarHBondContact CB-O 3.28Å; H314-Q383 HydrophobicContact CB-CB 4.03Å; H314-Q383 HydrophobicContact CB-CG 4.35Å
315	D	95.3	Very high	89.3	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	148.8	165.6	-79	-2.6	0	0	0	109.8	Y194 Q195 Y355 P357 K358 S380 F381 N382	Y194-D315 WeakPolarHBondContact CE2-OD2 3.37Å; Q195-D315 WeakPolarHBondContact CG-OD2 3.39Å; D315-Y355 HydrophobicContact CB-CE2 4.03Å; D315-Y355 VanDerWaalsContact CG-OH 3.23Å; D315-Y355 PolarHBondContact OD2-OH 2.81Å; D315-P357 WeakPolarHBondContact OD1-CA 3.25Å; D315-K358 PolarHBondContact OD1-N 3.34Å; D315-S380 WeakPolarHBondContact O-CA 3.01Å; D315-F381 HydrophobicContact CB-CD1 3.93Å; D315-F381 HydrophobicContact CB-CD2 4.44Å; D315-F381 HydrophobicContact CB-CE1 3.56Å; D315-F381 HydrophobicContact CB-CE2 4.15Å; D315-F381 HydrophobicContact CB-CG 4.35Å; D315-F381 HydrophobicContact CB-CZ 3.69Å; D315-F381 PolarHBondContact N-O 2.91Å; D315-F381 WeakPolarHBondContact O-CD1 3.49Å; D315-F381 PolarHBondContact O-N 3.24Å; D315-N382 HydrophobicContact CB-CB 4.23Å; D315-N382 PolarHBondContact OD2-ND2 2.88Å
316	L	96.2	Very high	90	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132.4	-172.3	174.9	64.5	0	0	0	111.8	L312 I318 Y355 I356 C378	L312-L316 HydrophobicContact CD1-CB 3.75Å; L312-L316 HydrophobicContact CD1-CD2 3.77Å; L312-L316 HydrophobicContact CD1-CG 4.42Å; L316-I318 HydrophobicContact CD1-CG1 4.43Å; L316-I318 HydrophobicContact CD2-CD1 3.94Å; L316-I318 HydrophobicContact CD2-CG1 3.92Å; L316-I318 HydrophobicContact CG-CD1 4.4Å; L316-I318 HydrophobicContact CG-CG1 3.99Å; L316-Y355 CarbonylContact O-C 3.57Å; L316-Y355 WeakPolarHBondContact O-CA 3.39Å; L316-Y355 WeakPolarHBondContact O-CD2 3.42Å; L316-I356 HydrophobicContact CB-CB 4.49Å; L316-I356 PolarHBondContact N-O 3.48Å; L316-I356 PolarHBondContact O-N 3.15Å; L316-C378 HydrophobicContact CD1-CB 3.71Å
317	F	96.4	Very high	90.6	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.018	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.5	161.6	-70.5	-69.5	0	0	0	109.9	L177 L181 F189 L353 Y355 I379 F381	L177-F317 HydrophobicContact CD1-CE2 4.48Å; L177-F317 HydrophobicContact CD1-CZ 4.2Å; L181-F317 HydrophobicContact CD2-CE1 4.28Å; F189-F317 HydrophobicContact CE1-CZ 4.29Å; F189-F317 HydrophobicContact CE2-CE1 4.04Å; F189-F317 HydrophobicContact CE2-CZ 4.21Å; F189-F317 AromaticContact CZ-CE1 3.96Å; F189-F317 HydrophobicContact CZ-CE1 3.96Å; F189-F317 AromaticContact CZ-CZ 3.65Å; F189-F317 HydrophobicContact CZ-CZ 3.65Å; F317-L353 HydrophobicContact CB-CD1 4.07Å; F317-L353 HydrophobicContact CD1-CD1 3.93Å; F317-L353 HydrophobicContact CD1-CD2 3.97Å; F317-L353 HydrophobicContact CD1-CG 4.26Å; F317-L353 HydrophobicContact CE1-CD2 4.19Å; F317-L353 HydrophobicContact CG-CD1 4.36Å; F317-Y355 AromaticContact CD1-CD2 3.69Å; F317-Y355 HydrophobicContact CD1-CD2 3.69Å; F317-Y355 HydrophobicContact CD1-CG 4.19Å; F317-Y355 AromaticContact CE1-CD2 3.49Å; F317-Y355 HydrophobicContact CE1-CD2 3.49Å; F317-Y355 VanDerWaalsContact CE1-CD2 3.49Å; F317-Y355 HydrophobicContact CE1-CE2 4.37Å; F317-Y355 AromaticContact CE1-CG 3.96Å; F317-Y355 HydrophobicContact CE1-CG 3.96Å; F317-Y355 HydrophobicContact CE2-CD2 4.47Å; F317-Y355 HydrophobicContact CG-CD2 4.27Å; F317-Y355 AromaticContact CZ-CD2 3.93Å; F317-Y355 HydrophobicContact CZ-CD2 3.93Å; F317-Y355 HydrophobicContact CZ-CE2 4.38Å; F317-I379 HydrophobicContact CB-CB 4.33Å; F317-I379 PolarHBondContact N-O 3.25Å; F317-I379 PolarHBondContact O-N 3.1Å; F317-F381 HydrophobicContact CD2-CD1 4.14Å; F317-F381 AromaticContact CD2-CE1 3.41Å; F317-F381 HydrophobicContact CD2-CE1 3.41Å; F317-F381 VanDerWaalsContact CD2-CE1 3.41Å; F317-F381 AromaticContact CD2-CZ 3.98Å; F317-F381 HydrophobicContact CD2-CZ 3.98Å; F317-F381 HydrophobicContact CE2-CD1 4.34Å; F317-F381 AromaticContact CE2-CE1 3.38Å; F317-F381 HydrophobicContact CE2-CE1 3.38Å; F317-F381 HydrophobicContact CE2-CE2 4.41Å; F317-F381 AromaticContact CE2-CZ 3.41Å; F317-F381 HydrophobicContact CE2-CZ 3.41Å; F317-F381 VanDerWaalsContact CE2-CZ 3.41Å; F317-F381 HydrophobicContact CG-CE1 4.35Å; F317-F381 HydrophobicContact CZ-CE1 4.3Å; F317-F381 HydrophobicContact CZ-CZ 4.08Å
318	I	95.6	Very high	91.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.3	173	-61.2	150.9	0	0	0	108.7	L316 F327 L348 L353 L354 I356 H376 L377	L316-I318 HydrophobicContact CD1-CG1 4.43Å; L316-I318 HydrophobicContact CD2-CD1 3.94Å; L316-I318 HydrophobicContact CD2-CG1 3.92Å; L316-I318 HydrophobicContact CG-CD1 4.4Å; L316-I318 HydrophobicContact CG-CG1 3.99Å; I318-F327 HydrophobicContact CD1-CD1 3.99Å; I318-F327 HydrophobicContact CD1-CE1 3.73Å; I318-F327 HydrophobicContact CG1-CE1 4.48Å; I318-F327 HydrophobicContact CG2-CE1 4.01Å; I318-F327 HydrophobicContact CG2-CZ 3.79Å; I318-L348 HydrophobicContact CG2-CD1 3.93Å; I318-L353 WeakPolarHBondContact O-CA 3.48Å; I318-L354 HydrophobicContact CB-CB 4.21Å; I318-L354 HydrophobicContact CD1-CB 4.49Å; I318-L354 HydrophobicContact CD1-CD2 4.19Å; I318-L354 HydrophobicContact CD1-CG 4.43Å; I318-L354 PolarHBondContact N-O 2.86Å; I318-L354 PolarHBondContact O-N 3.35Å; I318-I356 HydrophobicContact CD1-CD1 3.61Å; I318-I356 HydrophobicContact CD1-CG1 4.23Å; I318-H376 HydrophobicContact CG2-CB 4.29Å; I318-L377 CarbonylContact C-O 3.49Å; I318-L377 VanDerWaalsContact CA-O 3.29Å; I318-L377 WeakPolarHBondContact CA-O 3.19Å
319	L	94.1	Very high	91.5	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	107.9	178	-76.6	168.1	0	0	0	109.5	W211 Q321 L353 H376 L377 I379	W211-L319 HydrophobicContact CD2-CD1 3.84Å; W211-L319 HydrophobicContact CE3-CD1 4.4Å; W211-L319 HydrophobicContact CG-CD1 4.01Å; W211-L319 HydrophobicContact CZ2-CD1 4.32Å; L319-Q321 PolarHBondContact O-N 3.37Å; L319-L353 HydrophobicContact CD2-CB 4.36Å; L319-L353 HydrophobicContact CD2-CD1 3.49Å; L319-L353 VanDerWaalsContact CD2-CD1 3.49Å; L319-L353 HydrophobicContact CG-CD1 3.87Å; L319-H376 CarbonylContact O-C 3.57Å; L319-H376 VanDerWaalsContact O-CA 3.27Å; L319-H376 WeakPolarHBondContact O-CA 3.48Å; L319-H376 WeakPolarHBondContact O-CB 3.37Å; L319-L377 HydrophobicContact CB-CD1 4.12Å; L319-L377 PolarHBondContact N-O 3.07Å; L319-L377 PolarHBondContact O-N 3.14Å; L319-I379 HydrophobicContact CD1-CD1 3.81Å
320	Q	93	Very high	91.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	122.9	175.3	-168.6	78.3	49	0	0	109.3	E322 L348 K349 G351 D352 L375	Q320-E322 PolarHBondContact NE2-O 2.93Å; Q320-L348 HydrophobicContact CB-CB 3.89Å; Q320-L348 HydrophobicContact CB-CD1 4.37Å; Q320-L348 HydrophobicContact CG-CB 4.13Å; Q320-K349 WeakPolarHBondContact CB-O 3.08Å; Q320-G351 PolarHBondContact O-N 2.61Å; Q320-D352 PolarHBondContact N-O 3.06Å; Q320-L375 PolarHBondContact NE2-O 3.43Å
321	Q	91.8	Very high	91.6	Very high	21 Å²	21	25.4 Å²	25.4	10%	0.098	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-47.7	179.5	-56.9	-60.4	-94.8	0	0	111.4	L212 L319 P350 L375 L377	L212-Q321 VanDerWaalsContact N-OE1 3.14Å; L212-Q321 WeakPolarHBondContact O-CB 3.26Å; L212-Q321 VanDerWaalsContact O-CG 3.32Å; L212-Q321 WeakPolarHBondContact O-CG 3.35Å; L212-Q321 PolarHBondContact O-OE1 2.72Å; L319-Q321 PolarHBondContact O-N 3.37Å; Q321-P350 WeakPolarHBondContact O-CB 3.29Å; Q321-L375 HydrophobicContact CB-CB 4.44Å; Q321-L375 HydrophobicContact CB-CD2 4.22Å; Q321-L375 HydrophobicContact CB-CG 4.19Å; Q321-L375 PolarHBondContact N-O 3.13Å; Q321-L377 VanDerWaalsContact CD-CD1 3.44Å; Q321-L377 HydrophobicContact CG-CD1 3.38Å; Q321-L377 HydrophobicContact CG-CG 4.43Å
322	E	90.6	Very high	90.6	Very high	47 Å²	47	24.4 Å²	24.4	22%	0.22	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153	-176.8	-58.3	179.6	-149.9	0	0	111.6	N213 Y214 Q320 H373 T374 L375	N213-E322 WeakPolarHBondContact CA-OE1 3.39Å; N213-E322 VanDerWaalsContact CB-OE1 3.26Å; N213-E322 WeakPolarHBondContact CB-OE1 3.4Å; Y214-E322 PolarHBondContact N-OE1 3.41Å; Q320-E322 PolarHBondContact NE2-O 2.93Å; E322-H373 IonicContact OE2-CD2 2.67Å; E322-H373 IonicContact OE2-CE1 2.68Å; E322-H373 IonicContact OE2-NE2 3.82Å; E322-H373 PolarHBondContact OE2-NE2 2.88Å; E322-T374 WeakPolarHBondContact O-CA 3.36Å; E322-L375 HydrophobicContact CB-CB 3.97Å; E322-L375 HydrophobicContact CG-CB 4.42Å; E322-L375 PolarHBondContact N-O 3.3Å; E322-L375 PolarHBondContact O-N 3.19Å
323	G	88.6	Confident	89.1	Confident	10 Å²	10	28.4 Å²	28.4	10%	0.103	15%	0.145	C	C	.	.	S	Bend	trans	66	-154.6	-175.7	0	0	0	0	0	113.4	P350	G323-P350 VanDerWaalsContact O-CD 3.25Å; G323-P350 WeakPolarHBondContact O-CD 3.32Å; G323-P350 WeakPolarHBondContact O-CG 3.47Å
324	S	89.1	Confident	87	Confident	15 Å²	15	31 Å²	31	11%	0.105	16%	0.163	C	C	.	.			trans	-151.1	138.5	176.1	-61.8	0	0	0	0	111.4	L348	S324-L348 VanDerWaalsContact CA-O 3.25Å; S324-L348 WeakPolarHBondContact CA-O 3.26Å; S324-L348 VanDerWaalsContact CB-O 3.23Å; S324-L348 WeakPolarHBondContact CB-O 3.49Å
325	Q	90.4	Very high	84.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.2	-174.9	-66.5	173.2	-90.5	0	0	111	F327 K347 L348 I364 T374 H376	Q325-F327 HydrophobicContact CB-CD2 4.37Å; Q325-F327 HydrophobicContact CB-CE2 3.74Å; Q325-F327 HydrophobicContact CB-CZ 4.47Å; Q325-K347 WeakPolarHBondContact O-CA 3.31Å; Q325-L348 PolarHBondContact N-O 2.96Å; Q325-L348 PolarHBondContact O-N 3.21Å; Q325-I364 HydrophobicContact CB-CG2 4.11Å; Q325-T374 VanDerWaalsContact CD-OG1 3.31Å; Q325-T374 HydrophobicContact CG-CG2 3.63Å; Q325-T374 PolarHBondContact NE2-OG1 2.79Å; Q325-H376 PolarHBondContact OE1-ND1 2.88Å
326	K	91.9	Very high	81.9	Confident	75 Å²	75	43 Å²	43	33%	0.326	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.6	177.3	-77.3	161.8	169.4	162.5	0	109.2	V346 K347 I364 S365 D367	K326-V346 CarbonylContact C-O 3.57Å; K326-V346 WeakPolarHBondContact CA-O 3.31Å; K326-K347 HydrophobicContact CG-CB 4.4Å; K326-I364 CarbonylContact O-C 3.56Å; K326-I364 WeakPolarHBondContact O-CA 3.4Å; K326-S365 WeakPolarHBondContact CB-OG 3.46Å; K326-S365 PolarHBondContact N-O 2.94Å; K326-S365 PolarHBondContact O-N 3.13Å; K326-S365 PolarHBondContact O-OG 3.27Å; K326-D367 HydrophobicContact CD-CB 4.31Å; K326-D367 WeakPolarHBondContact CE-OD1 3.12Å; K326-D367 HydrophobicContact CG-CB 4.49Å; K326-D367 IonicContact NZ-OD1 3.81Å; K326-D367 PolarHBondContact NZ-OD1 3.43Å
327	F	93.2	Very high	78.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.8	178.1	-70.7	-101.3	0	0	0	109.4	I318 Q325 V346 L348 L354 T363 I364	I318-F327 HydrophobicContact CD1-CD1 3.99Å; I318-F327 HydrophobicContact CD1-CE1 3.73Å; I318-F327 HydrophobicContact CG1-CE1 4.48Å; I318-F327 HydrophobicContact CG2-CE1 4.01Å; I318-F327 HydrophobicContact CG2-CZ 3.79Å; Q325-F327 HydrophobicContact CB-CD2 4.37Å; Q325-F327 HydrophobicContact CB-CE2 3.74Å; Q325-F327 HydrophobicContact CB-CZ 4.47Å; F327-V346 HydrophobicContact CB-CB 4.42Å; F327-V346 PolarHBondContact N-O 3.21Å; F327-V346 PolarHBondContact O-N 2.88Å; F327-L348 HydrophobicContact CD2-CB 4.48Å; F327-L348 HydrophobicContact CD2-CD1 3.74Å; F327-L348 HydrophobicContact CD2-CG 3.73Å; F327-L348 HydrophobicContact CE2-CB 4.31Å; F327-L348 HydrophobicContact CE2-CD1 3.45Å; F327-L348 VanDerWaalsContact CE2-CD1 3.45Å; F327-L348 HydrophobicContact CE2-CG 3.82Å; F327-L348 HydrophobicContact CZ-CD1 4.05Å; F327-L354 HydrophobicContact CB-CD2 3.62Å; F327-L354 HydrophobicContact CD1-CD2 3.96Å; F327-L354 HydrophobicContact CD2-CD2 4.29Å; F327-L354 HydrophobicContact CG-CD2 3.7Å; F327-T363 CarbonylContact C-O 3.52Å; F327-T363 WeakPolarHBondContact CA-O 3.3Å; F327-I364 HydrophobicContact CD1-CB 4.48Å; F327-I364 HydrophobicContact CD1-CD1 4.26Å; F327-I364 HydrophobicContact CD1-CG1 3.8Å; F327-I364 HydrophobicContact CD1-CG2 4.29Å; F327-I364 HydrophobicContact CE1-CB 4.27Å; F327-I364 HydrophobicContact CE1-CD1 3.48Å; F327-I364 VanDerWaalsContact CE1-CD1 3.48Å; F327-I364 HydrophobicContact CE1-CG1 3.52Å; F327-I364 HydrophobicContact CE1-CG2 3.89Å; F327-I364 HydrophobicContact CE2-CG2 4.13Å; F327-I364 HydrophobicContact CZ-CD1 4.07Å; F327-I364 HydrophobicContact CZ-CG1 4.27Å; F327-I364 HydrophobicContact CZ-CG2 3.79Å
328	Q	92.6	Very high	75.8	Confident	86 Å²	86	56.1 Å²	56.1	40%	0.402	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	103.7	175	-177.1	179.2	-25.2	0	0	108.6	V343 L345 H362 T363	Q328-V343 HydrophobicContact CG-CG1 3.43Å; Q328-V343 VanDerWaalsContact CG-CG1 3.43Å; Q328-L345 HydrophobicContact CB-CD1 4.09Å; Q328-H362 CarbonylContact O-C 3.57Å; Q328-H362 VanDerWaalsContact O-CA 3.28Å; Q328-H362 WeakPolarHBondContact O-CA 3.43Å; Q328-T363 PolarHBondContact N-O 2.83Å; Q328-T363 PolarHBondContact O-N 3.29Å
329	I	93	Very high	72.6	Confident	3 Å²	3	60 Å²	60	2%	0.015	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.7	179.8	-54.9	170.1	0	0	0	109.6	P198 V343 S344 L354 I356 F360 H362	P198-I329 HydrophobicContact CB-CD1 3.82Å; P198-I329 HydrophobicContact CG-CD1 4.23Å; P198-I329 HydrophobicContact CG-CG2 3.87Å; I329-V343 CarbonylContact O-C 3.59Å; I329-V343 VanDerWaalsContact O-CA 3.3Å; I329-V343 WeakPolarHBondContact O-CA 3.39Å; I329-S344 PolarHBondContact N-O 3.33Å; I329-S344 PolarHBondContact O-N 3Å; I329-L354 HydrophobicContact CD1-CD1 3.84Å; I329-L354 HydrophobicContact CD1-CD2 4.06Å; I329-L354 HydrophobicContact CD1-CG 4.15Å; I329-I356 HydrophobicContact CD1-CD1 3.88Å; I329-I356 HydrophobicContact CD1-CG1 3.88Å; I329-I356 HydrophobicContact CG1-CD1 3.94Å; I329-I356 HydrophobicContact CG1-CG1 4.44Å; I329-F360 HydrophobicContact CG2-CB 4.19Å; I329-F360 HydrophobicContact CG2-CD1 3.86Å; I329-F360 HydrophobicContact CG2-CG 4.42Å; I329-H362 HydrophobicContact CG1-CB 4.28Å
330	S	89.6	Confident	70.1	Confident	26 Å²	26	66.9 Å²	66.9	18%	0.182	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	160	176	65.6	0	0	0	0	112.1	F360 A361	S330-F360 WeakPolarHBondContact O-CA 3.39Å; S330-F360 WeakPolarHBondContact O-CD1 3.4Å; S330-A361 PolarHBondContact N-O 3Å; S330-A361 PolarHBondContact O-N 3.25Å; S330-A361 PolarHBondContact OG-O 3.49Å
331	S	83.1	Confident	68.2	Low	23 Å²	23	74.1 Å²	74.1	16%	0.161	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.7	179	-151.4	0	0	0	0	111.3	K333 F360	S331-K333 PolarHBondContact O-N 3.5Å; S331-K333 WeakPolarHBondContact OG-CG 3.38Å; S331-F360 VanDerWaalsContact CB-CE1 3.48Å; S331-F360 WeakPolarHBondContact OG-CE1 3.35Å
332	N	64	Low	66.6	Low	74 Å²	74	78.6 Å²	78.6	40%	0.396	44%	0.435	S	S	.	.			trans	-89.8	27.9	172.5	-62	-23.7	0	0	0	111.8	Q311 T334	Q311-N332 PolarHBondContact OE1-ND2 3.41Å; N332-T334 PolarHBondContact O-N 3.15Å
333	K	59.3	Low	65.4	Low	102 Å²	102	79.7 Å²	79.7	44%	0.443	45%	0.445	S	S	.	.			trans	-74.8	70.8	176.5	-72	-180	-178.4	178.7	0	110.4	S331 N335 L336	S331-K333 PolarHBondContact O-N 3.5Å; S331-K333 WeakPolarHBondContact OG-CG 3.38Å; K333-N335 PolarHBondContact O-N 3.41Å; K333-L336 PolarHBondContact O-N 3.47Å
334	T	46.9	Very low	65.1	Low	123 Å²	123	82.2 Å²	82.2	76%	0.755	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.3	-178.2	47.7	0	0	0	0	115.6	N332 L336	N332-T334 PolarHBondContact O-N 3.15Å; T334-L336 VanDerWaalsContact C-N 3.3Å; T334-L336 PolarHBondContact O-N 2.94Å
335	N	42.7	Very low	65.1	Low	156 Å²	156	87.2 Å²	87.2	83%	0.834	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-2.7	-179.6	-67.2	-8.7	0	0	0	114	K333	K333-N335 PolarHBondContact O-N 3.41Å
336	L	38	Very low	65.2	Low	131 Å²	131	88 Å²	88	69%	0.686	49%	0.491	S	S	*	.	S	Bend	trans	-83.5	117.7	162.9	-67.3	175.5	0	0	0	109	K333 T334 G338	K333-L336 PolarHBondContact O-N 3.47Å; T334-L336 VanDerWaalsContact C-N 3.3Å; T334-L336 PolarHBondContact O-N 2.94Å; L336-G338 PolarHBondContact O-N 2.89Å
337	K	31.1	Very low	65.2	Low	223 Å²	223	88.6 Å²	88.6	97%	0.97	49%	0.494	S	S	*	.	S	Bend	trans	-66.7	99.5	175.9	-70.5	-177.8	179.2	178	0	109.9
338	G	32.5	Very low	65.2	Low	62 Å²	62	88.6 Å²	88.6	64%	0.639	49%	0.494	S	S	*	.	S	Bend	trans	137.4	79.9	-173.9	0	0	0	0	0	109.5	L336 N340	L336-G338 PolarHBondContact O-N 2.89Å; G338-N340 PolarHBondContact O-N 3.34Å
339	G	29.9	Very low	65.1	Low	83 Å²	83	90.4 Å²	90.4	86%	0.856	50%	0.5	S	S	*	.			trans	-74.1	46.3	-163.5	0	0	0	0	0	116.9
340	N	40.5	Very low	64.9	Low	144 Å²	144	93.1 Å²	93.1	77%	0.77	52%	0.518	S	S	*	.			trans	-79.1	125.7	165.2	-81.5	-13.2	0	0	0	109.8	G338 N342	G338-N340 PolarHBondContact O-N 3.34Å; N340-N342 PolarHBondContact O-N 3.2Å
341	K	53.6	Low	64.9	Low	153 Å²	153	92.2 Å²	92.2	67%	0.665	51%	0.513	S	S	*	.			trans	-66.1	103.4	164.2	-70.3	178.4	179.7	176.1	0	107.2	V343	K341-V343 VanDerWaalsContact C-N 3.34Å; K341-V343 HydrophobicContact CB-CG2 4.22Å; K341-V343 PolarHBondContact O-N 2.92Å
342	N	57.1	Low	65.4	Low	114 Å²	114	91.4 Å²	91.4	61%	0.61	51%	0.506	S	S	*	.			trans	-66.6	97.1	172	-76	-4.4	0	0	0	108.6	N340	N340-N342 PolarHBondContact O-N 3.2Å
343	V	67.3	Low	66.8	Low	70 Å²	70	87.9 Å²	87.9	42%	0.424	49%	0.487	S	S	.	.			trans	-95.1	110.3	178.7	173.6	0	0	0	0	108.7	Q328 I329 K341	Q328-V343 HydrophobicContact CG-CG1 3.43Å; Q328-V343 VanDerWaalsContact CG-CG1 3.43Å; I329-V343 CarbonylContact O-C 3.59Å; I329-V343 VanDerWaalsContact O-CA 3.3Å; I329-V343 WeakPolarHBondContact O-CA 3.39Å; K341-V343 VanDerWaalsContact C-N 3.34Å; K341-V343 HydrophobicContact CB-CG2 4.22Å; K341-V343 PolarHBondContact O-N 2.92Å
344	S	81.7	Confident	68.5	Low	64 Å²	64	83 Å²	83	45%	0.448	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	108	174.3	-63.3	0	0	0	0	109.3	I329	I329-S344 PolarHBondContact N-O 3.33Å; I329-S344 PolarHBondContact O-N 3Å
345	L	89.3	Confident	70.9	Confident	120 Å²	120	77.2 Å²	77.2	63%	0.628	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	123	172	-171.6	67.2	0	0	0	110.2	Q328	Q328-L345 HydrophobicContact CB-CD1 4.09Å
346	V	92.5	Very high	73.4	Confident	17 Å²	17	69.8 Å²	69.8	10%	0.103	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.6	-177.4	164.7	0	0	0	0	108.6	H200 K326 F327 L348 L354	H200-V346 HydrophobicContact CB-CG1 4.41Å; H200-V346 HydrophobicContact CB-CG2 4.32Å; H200-V346 WeakPolarHBondContact ND1-CG1 3.46Å; K326-V346 CarbonylContact C-O 3.57Å; K326-V346 WeakPolarHBondContact CA-O 3.31Å; F327-V346 HydrophobicContact CB-CB 4.42Å; F327-V346 PolarHBondContact N-O 3.21Å; F327-V346 PolarHBondContact O-N 2.88Å; V346-L348 HydrophobicContact CG1-CD2 3.46Å; V346-L348 VanDerWaalsContact CG1-CD2 3.46Å; V346-L348 HydrophobicContact CG1-CG 4.15Å; V346-L354 HydrophobicContact CG1-CD1 4.21Å; V346-L354 HydrophobicContact CG1-CD2 4.13Å; V346-L354 HydrophobicContact CG2-CD1 4.35Å
347	K	92.3	Very high	76.1	Confident	87 Å²	87	63.5 Å²	63.5	38%	0.378	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.9	165.7	178.4	175.2	173.7	174.6	0	108.5	H200 Q325 K326 D367	H200-K347 PolarHBondContact CE1-O 3.07Å; Q325-K347 WeakPolarHBondContact O-CA 3.31Å; K326-K347 HydrophobicContact CG-CB 4.4Å; K347-D367 VanDerWaalsContact CE-OD2 3.28Å; K347-D367 WeakPolarHBondContact CE-OD2 3.35Å; K347-D367 IonicContact NZ-OD2 2.64Å; K347-D367 PolarHBondContact NZ-OD2 3.43Å
348	L	92	Very high	79	Confident	0 Å²	0	57 Å²	57	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	144.8	175.3	-55	-173.1	0	0	0	111.1	H200 I318 Q320 S324 Q325 F327 V346 D352 L354	H200-L348 WeakPolarHBondContact NE2-CD2 3.46Å; I318-L348 HydrophobicContact CG2-CD1 3.93Å; Q320-L348 HydrophobicContact CB-CB 3.89Å; Q320-L348 HydrophobicContact CB-CD1 4.37Å; Q320-L348 HydrophobicContact CG-CB 4.13Å; S324-L348 VanDerWaalsContact CA-O 3.25Å; S324-L348 WeakPolarHBondContact CA-O 3.26Å; S324-L348 VanDerWaalsContact CB-O 3.23Å; S324-L348 WeakPolarHBondContact CB-O 3.49Å; Q325-L348 PolarHBondContact N-O 2.96Å; Q325-L348 PolarHBondContact O-N 3.21Å; F327-L348 HydrophobicContact CD2-CB 4.48Å; F327-L348 HydrophobicContact CD2-CD1 3.74Å; F327-L348 HydrophobicContact CD2-CG 3.73Å; F327-L348 HydrophobicContact CE2-CB 4.31Å; F327-L348 HydrophobicContact CE2-CD1 3.45Å; F327-L348 VanDerWaalsContact CE2-CD1 3.45Å; F327-L348 HydrophobicContact CE2-CG 3.82Å; F327-L348 HydrophobicContact CZ-CD1 4.05Å; V346-L348 HydrophobicContact CG1-CD2 3.46Å; V346-L348 VanDerWaalsContact CG1-CD2 3.46Å; V346-L348 HydrophobicContact CG1-CG 4.15Å; L348-D352 HydrophobicContact CB-CB 4.23Å; L348-D352 HydrophobicContact CD2-CB 3.96Å; L348-L354 HydrophobicContact CD1-CB 3.84Å; L348-L354 HydrophobicContact CD1-CD2 4.17Å; L348-L354 HydrophobicContact CD2-CB 4.02Å; L348-L354 HydrophobicContact CD2-CD2 4.4Å
349	K	90.4	Very high	81.8	Confident	124 Å²	124	54.9 Å²	54.9	54%	0.539	31%	0.308	S	S	.	.			trans	-120	166.3	171.6	-62.6	179.6	179.9	-179.9	0	109.7	Q320 G351 D352	Q320-K349 WeakPolarHBondContact CB-O 3.08Å; K349-G351 PolarHBondContact O-N 3.35Å; K349-D352 WeakPolarHBondContact CB-OD2 3.37Å; K349-D352 PolarHBondContact N-OD2 3.38Å; K349-D352 WeakPolarHBondContact O-CB 3.38Å; K349-D352 PolarHBondContact O-N 2.82Å
350	P	89.9	Confident	84.7	Confident	60 Å²	60	52 Å²	52	39%	0.39	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	122.1	178.1	-29.8	41.1	0	0	0	112.6	Q321 G323	Q321-P350 WeakPolarHBondContact O-CB 3.29Å; G323-P350 VanDerWaalsContact O-CD 3.25Å; G323-P350 WeakPolarHBondContact O-CD 3.32Å; G323-P350 WeakPolarHBondContact O-CG 3.47Å
351	G	89.3	Confident	87.2	Confident	7 Å²	7	45.7 Å²	45.7	7%	0.072	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	-12.4	-177.1	0	0	0	0	0	115.8	R203 Q320 K349	R203-G351 WeakPolarHBondContact CD-O 3.38Å; R203-G351 PolarHBondContact NH1-O 3.04Å; Q320-G351 PolarHBondContact O-N 2.61Å; K349-G351 PolarHBondContact O-N 3.35Å
352	D	92.9	Very high	88.9	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.027	21%	0.209	C	C	.	.			trans	-70.5	144.8	174	-66.6	-22.9	0	0	0	111.4	H200 V201 K202 R203 Q320 L348 K349	H200-D352 IonicContact NE2-OD2 3.55Å; V201-D352 WeakPolarHBondContact O-CA 3.46Å; K202-D352 VanDerWaalsContact CA-OD1 3.3Å; K202-D352 WeakPolarHBondContact CA-OD1 3.47Å; R203-D352 PolarHBondContact N-OD1 2.89Å; Q320-D352 PolarHBondContact N-O 3.06Å; L348-D352 HydrophobicContact CB-CB 4.23Å; L348-D352 HydrophobicContact CD2-CB 3.96Å; K349-D352 WeakPolarHBondContact CB-OD2 3.37Å; K349-D352 PolarHBondContact N-OD2 3.38Å; K349-D352 WeakPolarHBondContact O-CB 3.38Å; K349-D352 PolarHBondContact O-N 2.82Å
353	L	94	Very high	90.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.8	172.9	179.2	86	0	0	0	110.4	I180 L181 H200 V201 F317 I318 L319	I180-L353 HydrophobicContact CG2-CD1 3.89Å; I180-L353 HydrophobicContact CG2-CD2 4.02Å; L181-L353 HydrophobicContact CD2-CD2 3.89Å; H200-L353 WeakPolarHBondContact CA-O 3.28Å; V201-L353 HydrophobicContact CB-CB 4.11Å; V201-L353 HydrophobicContact CG2-CB 4.36Å; V201-L353 HydrophobicContact CG2-CD2 4.02Å; V201-L353 PolarHBondContact N-O 3.5Å; V201-L353 PolarHBondContact O-N 3.47Å; F317-L353 HydrophobicContact CB-CD1 4.07Å; F317-L353 HydrophobicContact CD1-CD1 3.93Å; F317-L353 HydrophobicContact CD1-CD2 3.97Å; F317-L353 HydrophobicContact CD1-CG 4.26Å; F317-L353 HydrophobicContact CE1-CD2 4.19Å; F317-L353 HydrophobicContact CG-CD1 4.36Å; I318-L353 WeakPolarHBondContact O-CA 3.48Å; L319-L353 HydrophobicContact CD2-CB 4.36Å; L319-L353 HydrophobicContact CD2-CD1 3.49Å; L319-L353 VanDerWaalsContact CD2-CD1 3.49Å; L319-L353 HydrophobicContact CG-CD1 3.87Å
354	L	95.7	Very high	91.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	109.1	169	-175.3	60.5	0	0	0	110.8	L199 H200 I318 F327 I329 V346 L348 I356	L199-L354 CarbonylContact O-C 3.56Å; L199-L354 WeakPolarHBondContact O-CA 3.38Å; H200-L354 HydrophobicContact CB-CD1 3.92Å; I318-L354 HydrophobicContact CB-CB 4.21Å; I318-L354 HydrophobicContact CD1-CB 4.49Å; I318-L354 HydrophobicContact CD1-CD2 4.19Å; I318-L354 HydrophobicContact CD1-CG 4.43Å; I318-L354 PolarHBondContact N-O 2.86Å; I318-L354 PolarHBondContact O-N 3.35Å; F327-L354 HydrophobicContact CB-CD2 3.62Å; F327-L354 HydrophobicContact CD1-CD2 3.96Å; F327-L354 HydrophobicContact CD2-CD2 4.29Å; F327-L354 HydrophobicContact CG-CD2 3.7Å; I329-L354 HydrophobicContact CD1-CD1 3.84Å; I329-L354 HydrophobicContact CD1-CD2 4.06Å; I329-L354 HydrophobicContact CD1-CG 4.15Å; V346-L354 HydrophobicContact CG1-CD1 4.21Å; V346-L354 HydrophobicContact CG1-CD2 4.13Å; V346-L354 HydrophobicContact CG2-CD1 4.35Å; L348-L354 HydrophobicContact CD1-CB 3.84Å; L348-L354 HydrophobicContact CD1-CD2 4.17Å; L348-L354 HydrophobicContact CD2-CB 4.02Å; L348-L354 HydrophobicContact CD2-CD2 4.4Å; L354-I356 HydrophobicContact CD2-CD1 4.4Å; L354-I356 HydrophobicContact CG-CD1 4.45Å; L354-I356 HydrophobicContact CG-CG1 4.2Å
355	Y	96.7	Very high	91.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.8	169.6	173.1	-107	0	0	0	110.4	F189 N193 Y194 Q195 P198 L199 D315 L316 F317 P357 F381	F189-Y355 AromaticContact CE2-CD1 3.76Å; F189-Y355 HydrophobicContact CE2-CD1 3.76Å; F189-Y355 HydrophobicContact CE2-CD2 4.11Å; F189-Y355 HydrophobicContact CE2-CE1 4.01Å; F189-Y355 HydrophobicContact CE2-CE2 4.34Å; F189-Y355 AromaticContact CE2-CG 3.81Å; F189-Y355 HydrophobicContact CE2-CG 3.81Å; F189-Y355 HydrophobicContact CZ-CD1 4.38Å; F189-Y355 HydrophobicContact CZ-CD2 4.14Å; F189-Y355 HydrophobicContact CZ-CE1 4.28Å; F189-Y355 HydrophobicContact CZ-CE2 4.04Å; F189-Y355 HydrophobicContact CZ-CG 4.31Å; N193-Y355 HydrophobicContact CB-CD1 4.45Å; Y194-Y355 WeakPolarHBondContact CD2-OH 3.42Å; Q195-Y355 PolarHBondContact N-OH 2.78Å; P198-Y355 CarbonylContact C-O 3.55Å; P198-Y355 WeakPolarHBondContact CA-O 3.36Å; P198-Y355 WeakPolarHBondContact CB-O 3.14Å; L199-Y355 PolarHBondContact N-O 2.88Å; L199-Y355 PolarHBondContact O-N 3.45Å; D315-Y355 HydrophobicContact CB-CE2 4.03Å; D315-Y355 VanDerWaalsContact CG-OH 3.23Å; D315-Y355 PolarHBondContact OD2-OH 2.81Å; L316-Y355 CarbonylContact O-C 3.57Å; L316-Y355 WeakPolarHBondContact O-CA 3.39Å; L316-Y355 WeakPolarHBondContact O-CD2 3.42Å; F317-Y355 AromaticContact CD1-CD2 3.69Å; F317-Y355 HydrophobicContact CD1-CD2 3.69Å; F317-Y355 HydrophobicContact CD1-CG 4.19Å; F317-Y355 AromaticContact CE1-CD2 3.49Å; F317-Y355 HydrophobicContact CE1-CD2 3.49Å; F317-Y355 VanDerWaalsContact CE1-CD2 3.49Å; F317-Y355 HydrophobicContact CE1-CE2 4.37Å; F317-Y355 AromaticContact CE1-CG 3.96Å; F317-Y355 HydrophobicContact CE1-CG 3.96Å; F317-Y355 HydrophobicContact CE2-CD2 4.47Å; F317-Y355 HydrophobicContact CG-CD2 4.27Å; F317-Y355 AromaticContact CZ-CD2 3.93Å; F317-Y355 HydrophobicContact CZ-CD2 3.93Å; F317-Y355 HydrophobicContact CZ-CE2 4.38Å; Y355-P357 HydrophobicContact CE1-CB 3.81Å; Y355-P357 HydrophobicContact CE1-CG 4.03Å; Y355-F381 HydrophobicContact CE2-CE1 4.14Å; Y355-F381 AromaticContact CE2-CZ 3.93Å; Y355-F381 HydrophobicContact CE2-CZ 3.93Å
356	I	95.7	Very high	91.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	112.2	175.1	-52.8	-176.5	0	0	0	108	L312 L316 I318 I329 L354 F360 H362	L312-I356 HydrophobicContact CD1-CB 4.28Å; L312-I356 HydrophobicContact CD1-CG2 3.92Å; L316-I356 HydrophobicContact CB-CB 4.49Å; L316-I356 PolarHBondContact N-O 3.48Å; L316-I356 PolarHBondContact O-N 3.15Å; I318-I356 HydrophobicContact CD1-CD1 3.61Å; I318-I356 HydrophobicContact CD1-CG1 4.23Å; I329-I356 HydrophobicContact CD1-CD1 3.88Å; I329-I356 HydrophobicContact CD1-CG1 3.88Å; I329-I356 HydrophobicContact CG1-CD1 3.94Å; I329-I356 HydrophobicContact CG1-CG1 4.44Å; L354-I356 HydrophobicContact CD2-CD1 4.4Å; L354-I356 HydrophobicContact CG-CD1 4.45Å; L354-I356 HydrophobicContact CG-CG1 4.2Å; I356-F360 HydrophobicContact CG2-CB 3.74Å; I356-H362 HydrophobicContact CD1-CB 3.94Å
357	P	94.5	Very high	89.9	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.			trans	-75.3	161.9	176.6	27.8	-31.6	0	0	0	112.6	D315 Y355 F360	D315-P357 WeakPolarHBondContact OD1-CA 3.25Å; Y355-P357 HydrophobicContact CE1-CB 3.81Å; Y355-P357 HydrophobicContact CE1-CG 4.03Å; P357-F360 HydrophobicContact CG-CD2 3.8Å; P357-F360 HydrophobicContact CG-CE2 3.72Å; P357-F360 WeakPolarHBondContact O-CD2 3.49Å; P357-F360 PolarHBondContact O-N 2.82Å
358	K	91.9	Very high	88.2	Confident	87 Å²	87	26.5 Å²	26.5	38%	0.378	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	139.1	175.1	-176.3	169.7	-178.9	148.6	0	113.6	L312 D313 H314 D315	L312-K358 WeakPolarHBondContact O-CG 3.44Å; D313-K358 VanDerWaalsContact O-CD 3.26Å; D313-K358 WeakPolarHBondContact O-CD 3.47Å; D313-K358 WeakPolarHBondContact O-CE 3.41Å; D313-K358 PolarHBondContact O-NZ 2.79Å; H314-K358 VanDerWaalsContact O-CA 3.29Å; H314-K358 WeakPolarHBondContact O-CA 3.19Å; H314-K358 PolarHBondContact O-N 2.59Å; D315-K358 PolarHBondContact OD1-N 3.34Å
359	G	90.5	Very high	86.6	Confident	17 Å²	17	28.4 Å²	28.4	18%	0.175	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	0.1	176.2	0	0	0	0	0	115.7	Q311 L312	Q311-G359 PolarHBondContact NE2-O 3.09Å; L312-G359 PolarHBondContact O-N 3.41Å
360	F	91.9	Very high	85.5	Confident	21 Å²	21	32.8 Å²	32.8	9%	0.092	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	148.5	167.1	-72.5	-104.5	0	0	0	110.3	P198 Q311 L312 I329 S330 S331 I356 P357	P198-F360 HydrophobicContact CG-CD1 3.93Å; P198-F360 HydrophobicContact CG-CE1 3.86Å; P198-F360 HydrophobicContact CG-CG 4.43Å; P198-F360 HydrophobicContact CG-CZ 4.31Å; Q311-F360 WeakPolarHBondContact CA-O 3.19Å; L312-F360 PolarHBondContact N-O 2.74Å; I329-F360 HydrophobicContact CG2-CB 4.19Å; I329-F360 HydrophobicContact CG2-CD1 3.86Å; I329-F360 HydrophobicContact CG2-CG 4.42Å; S330-F360 WeakPolarHBondContact O-CA 3.39Å; S330-F360 WeakPolarHBondContact O-CD1 3.4Å; S331-F360 VanDerWaalsContact CB-CE1 3.48Å; S331-F360 WeakPolarHBondContact OG-CE1 3.35Å; I356-F360 HydrophobicContact CG2-CB 3.74Å; P357-F360 HydrophobicContact CG-CD2 3.8Å; P357-F360 HydrophobicContact CG-CE2 3.72Å; P357-F360 WeakPolarHBondContact O-CD2 3.49Å; P357-F360 PolarHBondContact O-N 2.82Å
361	A	91.6	Very high	84.5	Confident	13 Å²	13	32.9 Å²	32.9	11%	0.107	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	152	171.5	0	0	0	0	0	109	Q311 S330	Q311-A361 HydrophobicContact CG-CB 4.14Å; S330-A361 PolarHBondContact N-O 3Å; S330-A361 PolarHBondContact O-N 3.25Å; S330-A361 PolarHBondContact OG-O 3.49Å
362	H	91	Very high	84	Confident	3 Å²	3	41 Å²	41	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	148.1	-179.6	69.7	-89.9	0	0	0	112.9	F309 Q328 I329 I356	F309-H362 WeakPolarHBondContact CA-O 3.4Å; F309-H362 VanDerWaalsContact CB-O 3.31Å; F309-H362 WeakPolarHBondContact CB-O 3.45Å; F309-H362 AromaticContact CD2-CD2 3.7Å; F309-H362 AromaticContact CD2-NE2 3.39Å; F309-H362 WeakPolarHBondContact CD2-NE2 3.36Å; F309-H362 AromaticContact CE2-NE2 3.9Å; F309-H362 AromaticContact CG-CE1 3.84Å; F309-H362 AromaticContact CG-NE2 3.66Å; F309-H362 PolarHBondContact N-O 3Å; F309-H362 PolarHBondContact O-N 3.42Å; Q328-H362 CarbonylContact O-C 3.57Å; Q328-H362 VanDerWaalsContact O-CA 3.28Å; Q328-H362 WeakPolarHBondContact O-CA 3.43Å; I329-H362 HydrophobicContact CG1-CB 4.28Å; I356-H362 HydrophobicContact CD1-CB 3.94Å
363	T	90	Very high	83.9	Confident	23 Å²	23	42.6 Å²	42.6	14%	0.141	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133.4	175.4	-61.5	0	0	0	0	109.4	E306 L307 S308 F327 Q328	E306-T363 HydrophobicContact CG-CG2 3.42Å; E306-T363 VanDerWaalsContact CG-CG2 3.42Å; E306-T363 WeakPolarHBondContact OE1-CG2 3.22Å; L307-T363 WeakPolarHBondContact O-CA 3.45Å; S308-T363 VanDerWaalsContact OG-CG2 3.25Å; S308-T363 WeakPolarHBondContact OG-CG2 3.33Å; S308-T363 PolarHBondContact OG-OG1 3.34Å; F327-T363 CarbonylContact C-O 3.52Å; F327-T363 WeakPolarHBondContact CA-O 3.3Å; Q328-T363 PolarHBondContact N-O 2.83Å; Q328-T363 PolarHBondContact O-N 3.29Å
364	I	89.2	Confident	83.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.9	175.9	-40.6	-179.4	0	0	0	108.3	E306 L307 F309 Q325 K326 F327	E306-I364 CarbonylContact C-O 3.56Å; E306-I364 WeakPolarHBondContact CA-O 3.34Å; L307-I364 HydrophobicContact CB-CB 4.26Å; L307-I364 PolarHBondContact N-O 3.41Å; L307-I364 PolarHBondContact O-N 2.86Å; F309-I364 HydrophobicContact CD2-CD1 4.38Å; F309-I364 HydrophobicContact CD2-CG1 4.28Å; F309-I364 HydrophobicContact CE2-CD1 3.58Å; F309-I364 HydrophobicContact CE2-CG1 3.86Å; F309-I364 HydrophobicContact CZ-CD1 4.28Å; Q325-I364 HydrophobicContact CB-CG2 4.11Å; K326-I364 CarbonylContact O-C 3.56Å; K326-I364 WeakPolarHBondContact O-CA 3.4Å; F327-I364 HydrophobicContact CD1-CB 4.48Å; F327-I364 HydrophobicContact CD1-CD1 4.26Å; F327-I364 HydrophobicContact CD1-CG1 3.8Å; F327-I364 HydrophobicContact CD1-CG2 4.29Å; F327-I364 HydrophobicContact CE1-CB 4.27Å; F327-I364 HydrophobicContact CE1-CD1 3.48Å; F327-I364 VanDerWaalsContact CE1-CD1 3.48Å; F327-I364 HydrophobicContact CE1-CG1 3.52Å; F327-I364 HydrophobicContact CE1-CG2 3.89Å; F327-I364 HydrophobicContact CE2-CG2 4.13Å; F327-I364 HydrophobicContact CZ-CD1 4.07Å; F327-I364 HydrophobicContact CZ-CG1 4.27Å; F327-I364 HydrophobicContact CZ-CG2 3.79Å
365	S	84.6	Confident	83.6	Confident	33 Å²	33	42.5 Å²	42.5	23%	0.231	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.8	170.1	45.8	0	0	0	0	110.4	K326	K326-S365 WeakPolarHBondContact CB-OG 3.46Å; K326-S365 PolarHBondContact N-O 2.94Å; K326-S365 PolarHBondContact O-N 3.13Å; K326-S365 PolarHBondContact O-OG 3.27Å
366	H	76.3	Confident	83.4	Confident	13 Å²	13	42.5 Å²	42.5	6%	0.06	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	135.6	170.7	-172.2	-102.9	0	0	0	109.9	S302 T305 T374	S302-H366 PolarHBondContact O-CE1 2.74Å; T305-H366 PolarHBondContact O-N 2.66Å; H366-T374 VanDerWaalsContact CD2-CG2 3.46Å; H366-T374 WeakPolarHBondContact CD2-CG2 3.33Å; H366-T374 WeakPolarHBondContact NE2-CG2 3.44Å
367	D	67.3	Low	83.4	Confident	24 Å²	24	42.5 Å²	42.5	13%	0.128	21%	0.214	C	C	.	.			trans	-93	118	174	-167.2	37.6	0	0	0	109.1	K326 K347 S369	K326-D367 HydrophobicContact CD-CB 4.31Å; K326-D367 WeakPolarHBondContact CE-OD1 3.12Å; K326-D367 HydrophobicContact CG-CB 4.49Å; K326-D367 IonicContact NZ-OD1 3.81Å; K326-D367 PolarHBondContact NZ-OD1 3.43Å; K347-D367 VanDerWaalsContact CE-OD2 3.28Å; K347-D367 WeakPolarHBondContact CE-OD2 3.35Å; K347-D367 IonicContact NZ-OD2 2.64Å; K347-D367 PolarHBondContact NZ-OD2 3.43Å; D367-S369 WeakPolarHBondContact O-CB 3.27Å; D367-S369 PolarHBondContact O-N 3.09Å; D367-S369 PolarHBondContact O-OG 2.79Å
368	N	56.9	Low	83.4	Confident	124 Å²	124	42.9 Å²	42.9	66%	0.663	22%	0.217	S	C	*	.			trans	-64.9	60.9	-173.7	-66.9	-9.6	0	0	0	113.1
369	S	59.3	Low	83.6	Confident	40 Å²	40	38.9 Å²	38.9	28%	0.28	20%	0.199	S	C	.	.	S	Bend	trans	-115.5	168.8	-171.2	61.5	0	0	0	0	109.7	D367 N371	D367-S369 WeakPolarHBondContact O-CB 3.27Å; D367-S369 PolarHBondContact O-N 3.09Å; D367-S369 PolarHBondContact O-OG 2.79Å; S369-N371 PolarHBondContact O-N 3.37Å; S369-N371 PolarHBondContact OG-ND2 3.32Å
370	K	66.2	Low	83.8	Confident	217 Å²	217	39 Å²	39	94%	0.943	20%	0.197	S	C	*	.	S	Bend	trans	-63.9	9.3	-166.8	-56.4	-178.9	179	-177.6	0	116.5
371	N	69.2	Low	83.9	Confident	61 Å²	61	38 Å²	38	33%	0.326	19%	0.193	S	C	.	.			trans	-84.3	141.2	-177.6	-57.8	-57.5	0	0	0	110.7	S369 H373	S369-N371 PolarHBondContact O-N 3.37Å; S369-N371 PolarHBondContact OG-ND2 3.32Å; N371-H373 VanDerWaalsContact C-N 3.25Å; N371-H373 PolarHBondContact O-N 3.07Å
372	K	79.7	Confident	83.8	Confident	179 Å²	179	37.7 Å²	37.7	78%	0.778	19%	0.189	S	C	*	.	S	Bend	trans	-72.3	-21.7	176	-66.3	-174.6	178	-176.9	0	112.9	S302	S302-K372 WeakPolarHBondContact CB-O 3.47Å; S302-K372 PolarHBondContact N-O 3.01Å
373	H	89.1	Confident	83.7	Confident	37 Å²	37	42.6 Å²	42.6	17%	0.171	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	173.5	-175	61.6	-80.1	0	0	0	110.8	Y214 Y260 L299 L300 E322 N371	Y214-H373 AromaticContact CD2-CD2 3.74Å; Y214-H373 AromaticContact CD2-NE2 3.62Å; Y214-H373 AromaticContact CG-NE2 3.94Å; Y260-H373 WeakPolarHBondContact OH-CB 3.34Å; L299-H373 HydrophobicContact CD1-CB 4.2Å; L300-H373 CarbonylContact O-C 3.51Å; L300-H373 WeakPolarHBondContact O-CA 3.29Å; L300-H373 VanDerWaalsContact O-CB 3.29Å; L300-H373 WeakPolarHBondContact O-CB 3.46Å; E322-H373 IonicContact OE2-CD2 2.67Å; E322-H373 IonicContact OE2-CE1 2.68Å; E322-H373 IonicContact OE2-NE2 3.82Å; E322-H373 PolarHBondContact OE2-NE2 2.88Å; N371-H373 VanDerWaalsContact C-N 3.25Å; N371-H373 PolarHBondContact O-N 3.07Å
374	T	91.1	Very high	83.4	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.2	169.1	51.8	0	0	0	0	110.8	L299 L300 E322 Q325 H366	L299-T374 WeakPolarHBondContact CA-O 3.42Å; L300-T374 PolarHBondContact N-O 3.19Å; L300-T374 PolarHBondContact O-N 3.48Å; E322-T374 WeakPolarHBondContact O-CA 3.36Å; Q325-T374 VanDerWaalsContact CD-OG1 3.31Å; Q325-T374 HydrophobicContact CG-CG2 3.63Å; Q325-T374 PolarHBondContact NE2-OG1 2.79Å; H366-T374 VanDerWaalsContact CD2-CG2 3.46Å; H366-T374 WeakPolarHBondContact CD2-CG2 3.33Å; H366-T374 WeakPolarHBondContact NE2-CG2 3.44Å
375	L	92.6	Very high	83.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.9	178.7	-177.9	63.4	0	0	0	110	L212 V217 Y298 L299 Q320 Q321 E322	L212-L375 HydrophobicContact CD2-CD1 4.09Å; L212-L375 HydrophobicContact CD2-CD2 4.29Å; L212-L375 HydrophobicContact CD2-CG 4.47Å; L212-L375 HydrophobicContact CG-CD2 4.21Å; V217-L375 HydrophobicContact CG2-CD1 4.2Å; V217-L375 HydrophobicContact CG2-CD2 4.22Å; Y298-L375 WeakPolarHBondContact O-CA 3.43Å; L299-L375 HydrophobicContact CB-CD1 4.14Å; Q320-L375 PolarHBondContact NE2-O 3.43Å; Q321-L375 HydrophobicContact CB-CB 4.44Å; Q321-L375 HydrophobicContact CB-CD2 4.22Å; Q321-L375 HydrophobicContact CB-CG 4.19Å; Q321-L375 PolarHBondContact N-O 3.13Å; E322-L375 HydrophobicContact CB-CB 3.97Å; E322-L375 HydrophobicContact CG-CB 4.42Å; E322-L375 PolarHBondContact N-O 3.3Å; E322-L375 PolarHBondContact O-N 3.19Å
376	H	93.1	Very high	83.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153	168.8	66.4	-99.3	0	0	0	111.6	A297 Y298 I318 L319 Q325	A297-H376 WeakPolarHBondContact CA-O 3.49Å; Y298-H376 AromaticContact CD2-CD2 3.96Å; Y298-H376 AromaticContact CD2-NE2 3.4Å; Y298-H376 WeakPolarHBondContact CD2-NE2 3.43Å; Y298-H376 AromaticContact CG-NE2 3.68Å; Y298-H376 PolarHBondContact N-O 3.38Å; Y298-H376 PolarHBondContact O-N 2.86Å; I318-H376 HydrophobicContact CG2-CB 4.29Å; L319-H376 CarbonylContact O-C 3.57Å; L319-H376 VanDerWaalsContact O-CA 3.27Å; L319-H376 WeakPolarHBondContact O-CA 3.48Å; L319-H376 WeakPolarHBondContact O-CB 3.37Å; Q325-H376 PolarHBondContact OE1-ND1 2.88Å
377	L	94.9	Very high	83.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	145.8	166.7	-49.8	106.9	0	0	0	110.3	W211 L212 L278 V295 T296 I318 L319 Q321	W211-L377 HydrophobicContact CB-CD1 3.68Å; W211-L377 HydrophobicContact CB-CD2 4.46Å; W211-L377 HydrophobicContact CG-CD1 4.5Å; L212-L377 HydrophobicContact CB-CD1 4.12Å; L212-L377 HydrophobicContact CB-CD2 3.93Å; L212-L377 HydrophobicContact CB-CG 4.26Å; L212-L377 HydrophobicContact CD2-CD2 3.99Å; L212-L377 HydrophobicContact CD2-CG 4.2Å; L278-L377 HydrophobicContact CD1-CD2 4.22Å; L278-L377 HydrophobicContact CD2-CD2 4Å; V295-L377 HydrophobicContact CG1-CB 4.17Å; V295-L377 HydrophobicContact CG1-CD2 3.45Å; V295-L377 VanDerWaalsContact CG1-CD2 3.45Å; V295-L377 HydrophobicContact CG1-CG 4.43Å; T296-L377 CarbonylContact O-C 3.58Å; T296-L377 WeakPolarHBondContact O-CA 3.43Å; I318-L377 CarbonylContact C-O 3.49Å; I318-L377 VanDerWaalsContact CA-O 3.29Å; I318-L377 WeakPolarHBondContact CA-O 3.19Å; L319-L377 HydrophobicContact CB-CD1 4.12Å; L319-L377 PolarHBondContact N-O 3.07Å; L319-L377 PolarHBondContact O-N 3.14Å; Q321-L377 VanDerWaalsContact CD-CD1 3.44Å; Q321-L377 HydrophobicContact CG-CD1 3.38Å; Q321-L377 HydrophobicContact CG-CG 4.43Å
378	C	95.1	Very high	85.1	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.054	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	109.5	169.7	-76.5	0	0	0	0	107.8	T296 Y298 L316	T296-C378 PolarHBondContact N-O 3.23Å; T296-C378 PolarHBondContact O-N 2.88Å; Y298-C378 HydrophobicContact CE2-CB 4.27Å; L316-C378 HydrophobicContact CD1-CB 3.71Å
379	I	95.3	Very high	86.6	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	104	177.1	-51.6	-177.3	0	0	0	107.9	W211 F293 T294 V295 F317 L319	W211-I379 HydrophobicContact CE3-CD1 4.07Å; W211-I379 HydrophobicContact CH2-CD1 4.17Å; W211-I379 HydrophobicContact CZ3-CD1 3.74Å; F293-I379 HydrophobicContact CD1-CG2 3.61Å; F293-I379 HydrophobicContact CE1-CG2 4.25Å; T294-I379 WeakPolarHBondContact O-CA 3.31Å; V295-I379 HydrophobicContact CG1-CG1 4.49Å; V295-I379 HydrophobicContact CG2-CG1 4.22Å; F317-I379 HydrophobicContact CB-CB 4.33Å; F317-I379 PolarHBondContact N-O 3.25Å; F317-I379 PolarHBondContact O-N 3.1Å; L319-I379 HydrophobicContact CD1-CD1 3.81Å
380	S	94.7	Very high	88.2	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	142.6	-178.9	49.9	0	0	0	0	112.1	F293 T294 H314 D315	F293-S380 WeakPolarHBondContact CA-O 3.21Å; T294-S380 PolarHBondContact N-O 2.83Å; T294-S380 PolarHBondContact O-N 2.96Å; T294-S380 PolarHBondContact O-OG 2.98Å; T294-S380 PolarHBondContact OG1-OG 3.08Å; H314-S380 VanDerWaalsContact CD2-CB 3.42Å; H314-S380 WeakPolarHBondContact CD2-CB 3.41Å; D315-S380 WeakPolarHBondContact O-CA 3.01Å
381	F	94.8	Very high	89.5	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	179.3	-175.6	69.8	-70.5	0	0	0	111.8	Y194 F289 N292 F293 H314 D315 F317 Y355 Q383	Y194-F381 AromaticContact CE2-CE2 3.92Å; Y194-F381 HydrophobicContact CE2-CE2 3.92Å; Y194-F381 HydrophobicContact CE2-CZ 4.23Å; F289-F381 HydrophobicContact CD1-CD2 4.3Å; F289-F381 AromaticContact CD1-CE2 3.99Å; F289-F381 HydrophobicContact CD1-CE2 3.99Å; F289-F381 HydrophobicContact CE1-CD2 4.42Å; F289-F381 AromaticContact CE1-CE2 3.69Å; F289-F381 HydrophobicContact CE1-CE2 3.69Å; F289-F381 HydrophobicContact CE2-CE2 4.49Å; F289-F381 AromaticContact CZ-CE2 3.97Å; F289-F381 HydrophobicContact CZ-CE2 3.97Å; F289-F381 HydrophobicContact CZ-CZ 4.49Å; N292-F381 WeakPolarHBondContact O-CA 3.44Å; F293-F381 HydrophobicContact CD1-CB 3.94Å; F293-F381 HydrophobicContact CD1-CG 4.38Å; F293-F381 HydrophobicContact CD2-CB 3.65Å; F293-F381 HydrophobicContact CD2-CG 4.49Å; F293-F381 HydrophobicContact CE1-CB 3.73Å; F293-F381 AromaticContact CE1-CD1 4Å; F293-F381 HydrophobicContact CE1-CD1 4Å; F293-F381 HydrophobicContact CE1-CD2 4.08Å; F293-F381 AromaticContact CE1-CG 3.7Å; F293-F381 HydrophobicContact CE1-CG 3.7Å; F293-F381 HydrophobicContact CE2-CB 3.41Å; F293-F381 VanDerWaalsContact CE2-CB 3.41Å; F293-F381 AromaticContact CE2-CD2 3.76Å; F293-F381 HydrophobicContact CE2-CD2 3.76Å; F293-F381 AromaticContact CE2-CG 3.83Å; F293-F381 HydrophobicContact CE2-CG 3.83Å; F293-F381 HydrophobicContact CG-CB 3.88Å; F293-F381 HydrophobicContact CZ-CB 3.44Å; F293-F381 VanDerWaalsContact CZ-CB 3.44Å; F293-F381 HydrophobicContact CZ-CD1 4.08Å; F293-F381 AromaticContact CZ-CD2 3.32Å; F293-F381 HydrophobicContact CZ-CD2 3.32Å; F293-F381 AromaticContact CZ-CE2 3.99Å; F293-F381 HydrophobicContact CZ-CE2 3.99Å; F293-F381 AromaticContact CZ-CG 3.37Å; F293-F381 HydrophobicContact CZ-CG 3.37Å; H314-F381 WeakPolarHBondContact CB-O 3.28Å; D315-F381 HydrophobicContact CB-CD1 3.93Å; D315-F381 HydrophobicContact CB-CD2 4.44Å; D315-F381 HydrophobicContact CB-CE1 3.56Å; D315-F381 HydrophobicContact CB-CE2 4.15Å; D315-F381 HydrophobicContact CB-CG 4.35Å; D315-F381 HydrophobicContact CB-CZ 3.69Å; D315-F381 PolarHBondContact N-O 2.91Å; D315-F381 WeakPolarHBondContact O-CD1 3.49Å; D315-F381 PolarHBondContact O-N 3.24Å; F317-F381 HydrophobicContact CD2-CD1 4.14Å; F317-F381 AromaticContact CD2-CE1 3.41Å; F317-F381 HydrophobicContact CD2-CE1 3.41Å; F317-F381 VanDerWaalsContact CD2-CE1 3.41Å; F317-F381 AromaticContact CD2-CZ 3.98Å; F317-F381 HydrophobicContact CD2-CZ 3.98Å; F317-F381 HydrophobicContact CE2-CD1 4.34Å; F317-F381 AromaticContact CE2-CE1 3.38Å; F317-F381 HydrophobicContact CE2-CE1 3.38Å; F317-F381 HydrophobicContact CE2-CE2 4.41Å; F317-F381 AromaticContact CE2-CZ 3.41Å; F317-F381 HydrophobicContact CE2-CZ 3.41Å; F317-F381 VanDerWaalsContact CE2-CZ 3.41Å; F317-F381 HydrophobicContact CG-CE1 4.35Å; F317-F381 HydrophobicContact CZ-CE1 4.3Å; F317-F381 HydrophobicContact CZ-CZ 4.08Å; Y355-F381 HydrophobicContact CE2-CE1 4.14Å; Y355-F381 AromaticContact CE2-CZ 3.93Å; Y355-F381 HydrophobicContact CE2-CZ 3.93Å; F381-Q383 PolarHBondContact O-N 2.97Å; F381-Q383 VanDerWaalsContact O-N 3.09Å
382	N	90.4	Very high	90.5	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	23%	0.229	C	C	.	.			trans	60.1	11.1	-174.8	-71.3	-28	0	0	0	115.8	Y194 Q195 C291 D315 K384 Y385	Y194-N382 PolarHBondContact OH-ND2 2.97Å; Q195-N382 PolarHBondContact NE2-ND2 3.46Å; Q195-N382 VanDerWaalsContact NE2-ND2 3.16Å; C291-N382 PolarHBondContact SG-OD1 3.5Å; D315-N382 HydrophobicContact CB-CB 4.23Å; D315-N382 PolarHBondContact OD2-ND2 2.88Å; N382-K384 PolarHBondContact O-N 3.15Å; N382-Y385 PolarHBondContact O-N 3.31Å
383	Q	87	Confident	91	Very high	106 Å²	106	38.2 Å²	38.2	50%	0.495	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	131.6	174.2	-158.3	-178.3	24.9	0	0	110.1	D313 H314 F381 Y385	D313-Q383 WeakPolarHBondContact OD2-CG 3.37Å; D313-Q383 PolarHBondContact OD2-NE2 2.78Å; H314-Q383 HydrophobicContact CB-CB 4.03Å; H314-Q383 HydrophobicContact CB-CG 4.35Å; F381-Q383 PolarHBondContact O-N 2.97Å; F381-Q383 VanDerWaalsContact O-N 3.09Å; Q383-Y385 PolarHBondContact O-N 2.91Å
384	K	83.8	Confident	91	Very high	136 Å²	136	36.7 Å²	36.7	59%	0.591	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	22.8	-175.2	-60.2	173.1	-172.5	163.9	0	115.3	N382 D389	N382-K384 PolarHBondContact O-N 3.15Å; K384-D389 VanDerWaalsContact C-OD2 3.26Å; K384-D389 WeakPolarHBondContact CA-OD2 3.43Å; K384-D389 VanDerWaalsContact O-CB 3.26Å; K384-D389 WeakPolarHBondContact O-CB 3.43Å
385	Y	85.6	Confident	91.1	Very high	56 Å²	56	40.1 Å²	40.1	22%	0.22	21%	0.211	C	C	.	.			trans	-114.8	74.6	-177	-168.8	-117.9	0	0	0	110.8	G290 C291 N382 Q383 I533	G290-Y385 PolarHBondContact O-OH 2.78Å; C291-Y385 HydrophobicContact CB-CD1 3.46Å; C291-Y385 VanDerWaalsContact CB-CD1 3.46Å; C291-Y385 HydrophobicContact CB-CD2 4.05Å; C291-Y385 HydrophobicContact CB-CE1 3.74Å; C291-Y385 HydrophobicContact CB-CE2 4.32Å; C291-Y385 HydrophobicContact CB-CG 3.61Å; N382-Y385 PolarHBondContact O-N 3.31Å; Q383-Y385 PolarHBondContact O-N 2.91Å; Y385-I533 HydrophobicContact CD2-CD1 3.67Å; Y385-I533 HydrophobicContact CE2-CD1 3.63Å
386	N	87.1	Confident	90.9	Very high	71 Å²	71	43.9 Å²	43.9	38%	0.38	24%	0.235	S	C	.	.	S	Bend	trans	-155.7	175.8	179.4	65.7	87.2	0	0	0	112.1	G388 D389 Y390	N386-G388 PolarHBondContact O-N 2.85Å; N386-G388 PolarHBondContact OD1-N 3.2Å; N386-D389 PolarHBondContact ND2-OD2 2.68Å; N386-D389 PolarHBondContact O-N 2.86Å; N386-Y390 PolarHBondContact O-N 3.03Å
387	W	89.4	Confident	90.6	Very high	49 Å²	49	44.6 Å²	44.6	19%	0.186	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-28	-178.5	-70.3	96.1	0	0	0	115	M1 L2 F7 Y390 L391	M1-W387 HydrophobicContact CE-CB 3.55Å; M1-W387 HydrophobicContact CE-CD2 4.1Å; M1-W387 HydrophobicContact CE-CG 3.48Å; M1-W387 VanDerWaalsContact CE-CG 3.48Å; M1-W387 HydrophobicContact SD-CB 4.16Å; M1-W387 HydrophobicContact SD-CG 4.16Å; L2-W387 PolarHBondContact O-NE1 3.05Å; F7-W387 HydrophobicContact CB-CH2 4.21Å; F7-W387 HydrophobicContact CB-CZ2 3.89Å; F7-W387 HydrophobicContact CD1-CH2 4.25Å; F7-W387 AromaticContact CD2-CH2 3.68Å; F7-W387 HydrophobicContact CD2-CH2 3.68Å; F7-W387 AromaticContact CD2-CZ2 3.93Å; F7-W387 HydrophobicContact CD2-CZ2 3.93Å; F7-W387 HydrophobicContact CE2-CH2 4.08Å; F7-W387 AromaticContact CG-CH2 3.77Å; F7-W387 HydrophobicContact CG-CH2 3.77Å; F7-W387 AromaticContact CG-CZ2 3.95Å; F7-W387 HydrophobicContact CG-CZ2 3.95Å; W387-Y390 AromaticContact CE3-CD1 3.87Å; W387-Y390 HydrophobicContact CE3-CD1 3.87Å; W387-Y390 AromaticContact CZ3-CD1 3.89Å; W387-Y390 HydrophobicContact CZ3-CD1 3.89Å; W387-Y390 HydrophobicContact CZ3-CE1 4.14Å; W387-L391 WeakPolarHBondContact O-CB 3.43Å; W387-L391 VanDerWaalsContact O-CG 3.23Å; W387-L391 WeakPolarHBondContact O-CG 3.37Å; W387-L391 PolarHBondContact O-N 3.26Å
388	G	91.4	Very high	90.3	Very high	39 Å²	39	44.7 Å²	44.7	40%	0.402	24%	0.239	S	C	.	.	H	α-helix	trans	-66.8	-48.3	176.1	0	0	0	0	0	111.6	N386 Y390 S392	N386-G388 PolarHBondContact O-N 2.85Å; N386-G388 PolarHBondContact OD1-N 3.2Å; G388-Y390 VanDerWaalsContact C-N 3.34Å; G388-S392 WeakPolarHBondContact O-CB 3.32Å; G388-S392 PolarHBondContact O-N 2.93Å; G388-S392 PolarHBondContact O-OG 3.16Å
389	D	89.5	Confident	90	Very high	58 Å²	58	48 Å²	48	31%	0.31	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-38.5	174.7	-58.9	-81.2	0	0	0	111.3	K384 N386 S392 E393	K384-D389 VanDerWaalsContact C-OD2 3.26Å; K384-D389 WeakPolarHBondContact CA-OD2 3.43Å; K384-D389 VanDerWaalsContact O-CB 3.26Å; K384-D389 WeakPolarHBondContact O-CB 3.43Å; N386-D389 PolarHBondContact ND2-OD2 2.68Å; N386-D389 PolarHBondContact O-N 2.86Å; D389-S392 WeakPolarHBondContact O-CB 3.31Å; D389-S392 PolarHBondContact O-N 3.19Å; D389-E393 PolarHBondContact O-N 2.89Å
390	Y	92	Very high	89.5	Confident	33 Å²	33	51.8 Å²	51.8	13%	0.129	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-52.1	175.3	178.2	-120	0	0	0	113.4	N386 W387 G388 S392 E393 L394 L522 A525 I526 I529	N386-Y390 PolarHBondContact O-N 3.03Å; W387-Y390 AromaticContact CE3-CD1 3.87Å; W387-Y390 HydrophobicContact CE3-CD1 3.87Å; W387-Y390 AromaticContact CZ3-CD1 3.89Å; W387-Y390 HydrophobicContact CZ3-CD1 3.89Å; W387-Y390 HydrophobicContact CZ3-CE1 4.14Å; G388-Y390 VanDerWaalsContact C-N 3.34Å; Y390-S392 PolarHBondContact O-N 3.44Å; Y390-E393 PolarHBondContact O-N 2.83Å; Y390-E393 VanDerWaalsContact O-N 3.08Å; Y390-L394 HydrophobicContact CE1-CD2 3.9Å; Y390-L394 PolarHBondContact O-N 3.36Å; Y390-L522 VanDerWaalsContact OH-CD2 3.23Å; Y390-L522 WeakPolarHBondContact OH-CD2 3.44Å; Y390-A525 HydrophobicContact CD2-CB 4.43Å; Y390-A525 HydrophobicContact CE2-CB 3.7Å; Y390-I526 HydrophobicContact CD2-CG1 4.36Å; Y390-I526 HydrophobicContact CE2-CD1 4.35Å; Y390-I526 HydrophobicContact CE2-CG1 3.6Å; Y390-I529 HydrophobicContact CD2-CD1 3.66Å; Y390-I529 HydrophobicContact CG-CD1 4.44Å
391	L	93.5	Very high	88.8	Confident	67 Å²	67	51.4 Å²	51.4	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-25	179	-68.7	170.8	0	0	0	111.9	W387 E393 L394 L395	W387-L391 WeakPolarHBondContact O-CB 3.43Å; W387-L391 VanDerWaalsContact O-CG 3.23Å; W387-L391 WeakPolarHBondContact O-CG 3.37Å; W387-L391 PolarHBondContact O-N 3.26Å; L391-E393 VanDerWaalsContact C-N 3.31Å; L391-E393 PolarHBondContact O-N 3.35Å; L391-L394 HydrophobicContact CD2-CD2 4.26Å; L391-L394 PolarHBondContact O-N 3.03Å; L391-L395 HydrophobicContact CB-CD1 4.14Å; L391-L395 HydrophobicContact CB-CG 4.42Å; L391-L395 VanDerWaalsContact O-CB 3.25Å; L391-L395 WeakPolarHBondContact O-CB 3.42Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.48Å; L391-L395 PolarHBondContact O-N 3.2Å
392	S	91.6	Very high	88.5	Confident	81 Å²	81	51.4 Å²	51.4	57%	0.566	27%	0.268	S	S	*	.	H	α-helix	trans	-69.4	-23.8	174.1	-59.9	0	0	0	0	113.5	G388 D389 Y390 P396	G388-S392 WeakPolarHBondContact O-CB 3.32Å; G388-S392 PolarHBondContact O-N 2.93Å; G388-S392 PolarHBondContact O-OG 3.16Å; D389-S392 WeakPolarHBondContact O-CB 3.31Å; D389-S392 PolarHBondContact O-N 3.19Å; Y390-S392 PolarHBondContact O-N 3.44Å; S392-P396 WeakPolarHBondContact O-CD 3.43Å; S392-P396 VanDerWaalsContact O-CG 3.31Å; S392-P396 WeakPolarHBondContact O-CG 3.44Å
393	E	88.7	Confident	88.4	Confident	32 Å²	32	53.7 Å²	53.7	15%	0.15	28%	0.282	C	S	.	.	H	α-helix	trans	-88.7	-44.1	167.4	-72.3	-63.6	166.4	0	0	112.1	D389 Y390 L391 P396 I397 A525 K528 I529 K532	D389-E393 PolarHBondContact O-N 2.89Å; Y390-E393 PolarHBondContact O-N 2.83Å; Y390-E393 VanDerWaalsContact O-N 3.08Å; L391-E393 VanDerWaalsContact C-N 3.31Å; L391-E393 PolarHBondContact O-N 3.35Å; E393-P396 WeakPolarHBondContact O-CD 3.46Å; E393-I397 WeakPolarHBondContact O-CB 3.41Å; E393-I397 VanDerWaalsContact O-CD1 3.23Å; E393-I397 WeakPolarHBondContact O-CD1 3.45Å; E393-I397 WeakPolarHBondContact O-CG1 3.39Å; E393-I397 PolarHBondContact O-N 2.94Å; E393-A525 HydrophobicContact CB-CB 4.24Å; E393-K528 HydrophobicContact CG-CB 4.49Å; E393-K528 HydrophobicContact CG-CD 4.46Å; E393-K528 WeakPolarHBondContact OE2-CD 3.46Å; E393-K528 IonicContact OE2-NZ 2.8Å; E393-K528 PolarHBondContact OE2-NZ 3.4Å; E393-I529 HydrophobicContact CB-CD1 4.45Å; E393-I529 HydrophobicContact CG-CD1 4.32Å; E393-I529 HydrophobicContact CG-CG1 4.01Å; E393-K532 IonicContact OE1-NZ 2.77Å; E393-K532 PolarHBondContact OE1-NZ 3.08Å
394	L	90.1	Very high	88.1	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-43.9	-175.2	-178.8	64.4	0	0	0	113	Y390 L391 I397 M398 I456 P521 L522 A525	Y390-L394 HydrophobicContact CE1-CD2 3.9Å; Y390-L394 PolarHBondContact O-N 3.36Å; L391-L394 HydrophobicContact CD2-CD2 4.26Å; L391-L394 PolarHBondContact O-N 3.03Å; L394-I397 WeakPolarHBondContact O-CB 3.11Å; L394-I397 PolarHBondContact O-N 2.69Å; L394-M398 HydrophobicContact CD1-CG 3.97Å; L394-M398 HydrophobicContact CG-CG 4.16Å; L394-M398 WeakPolarHBondContact O-CB 3.38Å; L394-M398 WeakPolarHBondContact O-CG 3.34Å; L394-M398 PolarHBondContact O-N 3.41Å; L394-I456 HydrophobicContact CD2-CD1 4.49Å; L394-P521 HydrophobicContact CD1-CB 3.89Å; L394-L522 HydrophobicContact CD1-CD2 4.04Å; L394-L522 HydrophobicContact CD2-CD2 3.77Å; L394-A525 HydrophobicContact CB-CB 3.85Å; L394-A525 HydrophobicContact CD1-CB 3.94Å
395	L	91.8	Very high	88	Confident	73 Å²	73	48.2 Å²	48.2	38%	0.382	26%	0.26	S	S	.	.	H	α-helix	trans	-67.6	-44	-173.2	-67.6	172.3	0	0	0	113.1	L391 I397 M398 M399 L452	L391-L395 HydrophobicContact CB-CD1 4.14Å; L391-L395 HydrophobicContact CB-CG 4.42Å; L391-L395 VanDerWaalsContact O-CB 3.25Å; L391-L395 WeakPolarHBondContact O-CB 3.42Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.48Å; L391-L395 PolarHBondContact O-N 3.2Å; L395-I397 VanDerWaalsContact C-N 3.31Å; L395-I397 PolarHBondContact O-N 2.99Å; L395-M398 PolarHBondContact O-N 2.95Å; L395-M399 VanDerWaalsContact O-CB 3.29Å; L395-M399 WeakPolarHBondContact O-CB 3.01Å; L395-M399 VanDerWaalsContact O-CG 3.26Å; L395-M399 WeakPolarHBondContact O-CG 3.28Å; L395-M399 PolarHBondContact O-N 3.14Å; L395-L452 HydrophobicContact CD2-CD2 4.05Å
396	P	89.9	Confident	88.1	Confident	78 Å²	78	45.9 Å²	45.9	51%	0.506	25%	0.252	S	S	.	.	H	α-helix	trans	-61.7	-37.4	172.8	-25.5	36.1	0	0	0	113.3	S392 E393 K400	S392-P396 WeakPolarHBondContact O-CD 3.43Å; S392-P396 VanDerWaalsContact O-CG 3.31Å; S392-P396 WeakPolarHBondContact O-CG 3.44Å; E393-P396 WeakPolarHBondContact O-CD 3.46Å; P396-K400 WeakPolarHBondContact O-CB 3.37Å; P396-K400 PolarHBondContact O-N 2.7Å
397	I	86	Confident	88.3	Confident	16 Å²	16	47 Å²	47	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-49.6	175.5	-71.7	172	0	0	0	110.5	E393 L394 L395 F462 P521 L524 A525 K528	E393-I397 WeakPolarHBondContact O-CB 3.41Å; E393-I397 VanDerWaalsContact O-CD1 3.23Å; E393-I397 WeakPolarHBondContact O-CD1 3.45Å; E393-I397 WeakPolarHBondContact O-CG1 3.39Å; E393-I397 PolarHBondContact O-N 2.94Å; L394-I397 WeakPolarHBondContact O-CB 3.11Å; L394-I397 PolarHBondContact O-N 2.69Å; L395-I397 VanDerWaalsContact C-N 3.31Å; L395-I397 PolarHBondContact O-N 2.99Å; I397-F462 HydrophobicContact CG2-CE2 3.36Å; I397-F462 HydrophobicContact CG2-CZ 3.71Å; I397-P521 HydrophobicContact CG2-CB 4.23Å; I397-L524 HydrophobicContact CD1-CD2 4.43Å; I397-L524 HydrophobicContact CD1-CG 4.25Å; I397-L524 HydrophobicContact CG2-CD2 4.04Å; I397-A525 HydrophobicContact CD1-CB 4.02Å; I397-K528 HydrophobicContact CD1-CD 4.1Å
398	M	87.8	Confident	88.4	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-47.8	177.6	-82.3	-64	-55.1	0	0	113	L394 L395 K400 N401 V402 L452 K455 I456 F462 P521	L394-M398 HydrophobicContact CD1-CG 3.97Å; L394-M398 HydrophobicContact CG-CG 4.16Å; L394-M398 WeakPolarHBondContact O-CB 3.38Å; L394-M398 WeakPolarHBondContact O-CG 3.34Å; L394-M398 PolarHBondContact O-N 3.41Å; L395-M398 PolarHBondContact O-N 2.95Å; M398-K400 VanDerWaalsContact C-N 3.26Å; M398-K400 PolarHBondContact O-N 2.98Å; M398-N401 PolarHBondContact O-N 3.21Å; M398-V402 HydrophobicContact CE-CG1 4.4Å; M398-V402 PolarHBondContact O-N 2.9Å; M398-V402 VanDerWaalsContact O-N 3.13Å; M398-L452 HydrophobicContact CB-CD1 4.14Å; M398-L452 HydrophobicContact CE-CD1 3.86Å; M398-L452 HydrophobicContact CE-CG 4.39Å; M398-K455 HydrophobicContact CE-CB 4.09Å; M398-I456 HydrophobicContact CE-CD1 4.31Å; M398-I456 HydrophobicContact CE-CG1 3.6Å; M398-I456 HydrophobicContact CG-CD1 4.23Å; M398-I456 HydrophobicContact CG-CG1 4.22Å; M398-I456 HydrophobicContact SD-CG1 3.86Å; M398-F462 HydrophobicContact SD-CE1 4.34Å; M398-F462 HydrophobicContact SD-CZ 4.25Å; M398-P521 HydrophobicContact CG-CB 4.06Å; M398-P521 HydrophobicContact SD-CB 3.48Å; M398-P521 WeakPolarHBondContact SD-CB 3.25Å; M398-P521 HydrophobicContact SD-CG 3.33Å; M398-P521 WeakPolarHBondContact SD-CG 3.34Å
399	M	89	Confident	88.4	Confident	77 Å²	77	47.2 Å²	47.2	38%	0.379	26%	0.255	S	S	.	.	H	α-helix	trans	-58.5	-39	-177.8	-79.4	-58.3	-54.1	0	0	112	L395 V402 V403 F409 L452	L395-M399 VanDerWaalsContact O-CB 3.29Å; L395-M399 WeakPolarHBondContact O-CB 3.01Å; L395-M399 VanDerWaalsContact O-CG 3.26Å; L395-M399 WeakPolarHBondContact O-CG 3.28Å; L395-M399 PolarHBondContact O-N 3.14Å; M399-V402 HydrophobicContact CE-CG2 4.49Å; M399-V402 VanDerWaalsContact O-CG2 3.31Å; M399-V402 WeakPolarHBondContact O-CG2 3.36Å; M399-V402 PolarHBondContact O-N 3.34Å; M399-V402 HydrophobicContact SD-CG2 4.3Å; M399-V403 HydrophobicContact CE-CG2 4.43Å; M399-V403 VanDerWaalsContact O-CG2 3.31Å; M399-V403 WeakPolarHBondContact O-CG2 3.24Å; M399-V403 PolarHBondContact O-N 3.43Å; M399-V403 VanDerWaalsContact O-N 3.07Å; M399-F409 HydrophobicContact CE-CD1 4.09Å; M399-F409 HydrophobicContact SD-CD1 4.48Å; M399-F409 HydrophobicContact SD-CE1 4.41Å; M399-L452 HydrophobicContact SD-CD1 4.22Å; M399-L452 HydrophobicContact SD-CD2 4.06Å
400	K	85	Confident	88.5	Confident	83 Å²	83	49.9 Å²	49.9	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-52	176.6	-174.3	169.9	-177	171.9	0	112.1	P396 M398 V402 V403 E404 L490	P396-K400 WeakPolarHBondContact O-CB 3.37Å; P396-K400 PolarHBondContact O-N 2.7Å; M398-K400 VanDerWaalsContact C-N 3.26Å; M398-K400 PolarHBondContact O-N 2.98Å; K400-V402 PolarHBondContact O-N 3.05Å; K400-V403 PolarHBondContact O-N 3.43Å; K400-E404 WeakPolarHBondContact CG-OE1 3.45Å; K400-E404 WeakPolarHBondContact O-CG 3.39Å; K400-E404 PolarHBondContact O-N 2.81Å; K400-L490 WeakPolarHBondContact CE-O 3.23Å; K400-L490 PolarHBondContact NZ-O 3.31Å
401	N	81.3	Confident	88.5	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.053	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-40.4	178.6	173.2	59.7	0	0	0	113.5	M398 E404 N405 F462	M398-N401 PolarHBondContact O-N 3.21Å; N401-E404 PolarHBondContact O-N 2.65Å; N401-N405 WeakPolarHBondContact O-CB 3.25Å; N401-N405 PolarHBondContact O-N 3.33Å; N401-N405 PolarHBondContact O-ND2 2.98Å; N401-N405 VanDerWaalsContact O-ND2 3.11Å; N401-N405 PolarHBondContact OD1-ND2 3.15Å; N401-F462 HydrophobicContact CB-CD1 3.48Å; N401-F462 VanDerWaalsContact CB-CD1 3.48Å; N401-F462 HydrophobicContact CB-CE1 3.18Å; N401-F462 HydrophobicContact CB-CG 4.34Å; N401-F462 HydrophobicContact CB-CZ 3.8Å; N401-F462 WeakPolarHBondContact ND2-CD1 3.29Å; N401-F462 VanDerWaalsContact ND2-CE1 3.33Å; N401-F462 WeakPolarHBondContact ND2-CE1 3.27Å
402	V	87.7	Confident	88.5	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-73.9	-33.5	-177.9	-58.6	0	0	0	0	112.7	M398 M399 K400 E404 N405 D406 F409 L452 K455	M398-V402 HydrophobicContact CE-CG1 4.4Å; M398-V402 PolarHBondContact O-N 2.9Å; M398-V402 VanDerWaalsContact O-N 3.13Å; M399-V402 HydrophobicContact CE-CG2 4.49Å; M399-V402 VanDerWaalsContact O-CG2 3.31Å; M399-V402 WeakPolarHBondContact O-CG2 3.36Å; M399-V402 PolarHBondContact O-N 3.34Å; M399-V402 HydrophobicContact SD-CG2 4.3Å; K400-V402 PolarHBondContact O-N 3.05Å; V402-E404 VanDerWaalsContact C-N 3.26Å; V402-E404 PolarHBondContact O-N 2.96Å; V402-N405 PolarHBondContact O-N 3.5Å; V402-D406 HydrophobicContact CB-CB 4.4Å; V402-D406 WeakPolarHBondContact O-CA 3.43Å; V402-D406 VanDerWaalsContact O-CB 3.27Å; V402-D406 WeakPolarHBondContact O-CB 3.31Å; V402-D406 PolarHBondContact O-N 2.85Å; V402-D406 VanDerWaalsContact O-O 3.09Å; V402-F409 HydrophobicContact CB-CB 4.44Å; V402-F409 HydrophobicContact CB-CD1 4.25Å; V402-F409 HydrophobicContact CB-CD2 3.83Å; V402-F409 HydrophobicContact CB-CE1 4.43Å; V402-F409 HydrophobicContact CB-CE2 4.02Å; V402-F409 HydrophobicContact CB-CG 3.93Å; V402-F409 HydrophobicContact CB-CZ 4.31Å; V402-F409 HydrophobicContact CG2-CB 4.12Å; V402-F409 HydrophobicContact CG2-CD1 3.46Å; V402-F409 VanDerWaalsContact CG2-CD1 3.46Å; V402-F409 HydrophobicContact CG2-CD2 3.98Å; V402-F409 HydrophobicContact CG2-CE1 3.71Å; V402-F409 HydrophobicContact CG2-CE2 4.19Å; V402-F409 HydrophobicContact CG2-CG 3.59Å; V402-F409 HydrophobicContact CG2-CZ 4.06Å; V402-L452 HydrophobicContact CB-CD1 4.46Å; V402-L452 HydrophobicContact CG1-CD1 3.8Å; V402-L452 HydrophobicContact CG2-CD1 3.84Å; V402-K455 HydrophobicContact CG1-CD 3.4Å
403	V	87.4	Confident	88.5	Confident	54 Å²	54	56.8 Å²	56.8	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-64.1	-34.4	172.2	171.7	0	0	0	0	111.1	M399 K400 F409 N410	M399-V403 HydrophobicContact CE-CG2 4.43Å; M399-V403 VanDerWaalsContact O-CG2 3.31Å; M399-V403 WeakPolarHBondContact O-CG2 3.24Å; M399-V403 PolarHBondContact O-N 3.43Å; M399-V403 VanDerWaalsContact O-N 3.07Å; K400-V403 PolarHBondContact O-N 3.43Å; V403-F409 HydrophobicContact CG2-CB 4.08Å; V403-N410 HydrophobicContact CG1-CB 4.42Å
404	E	80.8	Confident	88.6	Confident	63 Å²	63	57.3 Å²	57.3	29%	0.294	31%	0.309	S	S	.	.	H	α-helix	trans	-76.4	-35.8	177.8	-70.6	175.2	-145.9	0	0	114.3	K400 N401 V402 M492	K400-E404 WeakPolarHBondContact CG-OE1 3.45Å; K400-E404 WeakPolarHBondContact O-CG 3.39Å; K400-E404 PolarHBondContact O-N 2.81Å; N401-E404 PolarHBondContact O-N 2.65Å; V402-E404 VanDerWaalsContact C-N 3.26Å; V402-E404 PolarHBondContact O-N 2.96Å; E404-M492 HydrophobicContact CG-CB 4.46Å; E404-M492 WeakPolarHBondContact OE1-CB 3.49Å; E404-M492 WeakPolarHBondContact OE2-CB 3.16Å; E404-M492 WeakPolarHBondContact OE2-CE 3.09Å; E404-M492 VanDerWaalsContact OE2-CG 3.24Å; E404-M492 WeakPolarHBondContact OE2-CG 3.03Å
405	N	82.9	Confident	88.4	Confident	65 Å²	65	64.3 Å²	64.3	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-121.9	2.9	-166.9	-59.4	-73.5	0	0	0	114.7	N401 V402	N401-N405 WeakPolarHBondContact O-CB 3.25Å; N401-N405 PolarHBondContact O-N 3.33Å; N401-N405 PolarHBondContact O-ND2 2.98Å; N401-N405 VanDerWaalsContact O-ND2 3.11Å; N401-N405 PolarHBondContact OD1-ND2 3.15Å; V402-N405 PolarHBondContact O-N 3.5Å
406	D	87.6	Confident	88	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	35%	0.347	C	S	.	.			trans	-136	104.3	177.3	-164.1	-33.7	0	0	0	110.6	V402 E408 F409 R451 K455	V402-D406 HydrophobicContact CB-CB 4.4Å; V402-D406 WeakPolarHBondContact O-CA 3.43Å; V402-D406 VanDerWaalsContact O-CB 3.27Å; V402-D406 WeakPolarHBondContact O-CB 3.31Å; V402-D406 PolarHBondContact O-N 2.85Å; V402-D406 VanDerWaalsContact O-O 3.09Å; D406-E408 PolarHBondContact O-N 2.99Å; D406-F409 HydrophobicContact CB-CD2 3.87Å; D406-F409 HydrophobicContact CB-CE2 4.4Å; D406-F409 PolarHBondContact O-N 3.03Å; D406-R451 VanDerWaalsContact CG-NE 3.33Å; D406-R451 IonicContact OD1-CZ 3.34Å; D406-R451 IonicContact OD1-NE 2.72Å; D406-R451 PolarHBondContact OD1-NE 2.84Å; D406-R451 VanDerWaalsContact OD1-NE 3.14Å; D406-R451 IonicContact OD1-NH2 3.15Å; D406-R451 PolarHBondContact OD1-NH2 2.99Å; D406-R451 IonicContact OD2-CZ 2.61Å; D406-R451 IonicContact OD2-NE 2.83Å; D406-R451 PolarHBondContact OD2-NE 2.98Å; D406-R451 IonicContact OD2-NH2 2.79Å; D406-R451 PolarHBondContact OD2-NH2 3.37Å; D406-K455 WeakPolarHBondContact OD2-CE 3.48Å; D406-K455 IonicContact OD2-NZ 2.79Å; D406-K455 PolarHBondContact OD2-NZ 2.63Å
407	P	90.9	Very high	87.9	Confident	93 Å²	93	61 Å²	61	60%	0.604	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-63.6	-19.4	-167.3	25.7	-35.1	0	0	0	113.8	F409 N410 K411	P407-F409 VanDerWaalsContact C-N 3.28Å; P407-F409 PolarHBondContact O-N 3.48Å; P407-N410 PolarHBondContact O-N 2.86Å; P407-K411 PolarHBondContact O-N 3Å
408	E	92	Very high	87.8	Confident	64 Å²	64	68.3 Å²	68.3	30%	0.299	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-62	-34.4	173.5	-66.3	-57.2	135.9	0	0	112.8	D406 N410 K411 L448	D406-E408 PolarHBondContact O-N 2.99Å; E408-N410 VanDerWaalsContact C-N 3.33Å; E408-K411 WeakPolarHBondContact OE1-CE 3.41Å; E408-K411 IonicContact OE1-NZ 3.24Å; E408-K411 PolarHBondContact OE1-NZ 3.04Å; E408-K411 WeakPolarHBondContact OE2-CE 3.49Å; E408-K411 IonicContact OE2-NZ 2.7Å; E408-K411 PolarHBondContact OE2-NZ 3.24Å; E408-L448 HydrophobicContact CB-CD2 3.98Å
409	F	91.6	Very high	87.6	Confident	29 Å²	29	74.4 Å²	74.4	13%	0.127	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-81.2	-14.3	178.4	-70.3	-97.4	0	0	0	113.1	M399 V402 V403 D406 P407 L448 R451 L452	M399-F409 HydrophobicContact CE-CD1 4.09Å; M399-F409 HydrophobicContact SD-CD1 4.48Å; M399-F409 HydrophobicContact SD-CE1 4.41Å; V402-F409 HydrophobicContact CB-CB 4.44Å; V402-F409 HydrophobicContact CB-CD1 4.25Å; V402-F409 HydrophobicContact CB-CD2 3.83Å; V402-F409 HydrophobicContact CB-CE1 4.43Å; V402-F409 HydrophobicContact CB-CE2 4.02Å; V402-F409 HydrophobicContact CB-CG 3.93Å; V402-F409 HydrophobicContact CB-CZ 4.31Å; V402-F409 HydrophobicContact CG2-CB 4.12Å; V402-F409 HydrophobicContact CG2-CD1 3.46Å; V402-F409 VanDerWaalsContact CG2-CD1 3.46Å; V402-F409 HydrophobicContact CG2-CD2 3.98Å; V402-F409 HydrophobicContact CG2-CE1 3.71Å; V402-F409 HydrophobicContact CG2-CE2 4.19Å; V402-F409 HydrophobicContact CG2-CG 3.59Å; V402-F409 HydrophobicContact CG2-CZ 4.06Å; V403-F409 HydrophobicContact CG2-CB 4.08Å; D406-F409 HydrophobicContact CB-CD2 3.87Å; D406-F409 HydrophobicContact CB-CE2 4.4Å; D406-F409 PolarHBondContact O-N 3.03Å; P407-F409 VanDerWaalsContact C-N 3.28Å; P407-F409 PolarHBondContact O-N 3.48Å; F409-L448 HydrophobicContact CD1-CD2 4.2Å; F409-L448 HydrophobicContact CD2-CD2 4.11Å; F409-L448 HydrophobicContact CE1-CB 4.1Å; F409-L448 HydrophobicContact CE1-CD2 4.18Å; F409-L448 HydrophobicContact CE2-CD2 4.1Å; F409-L448 HydrophobicContact CG-CD2 4.19Å; F409-L448 HydrophobicContact CZ-CB 4.35Å; F409-L448 HydrophobicContact CZ-CD2 4.13Å; F409-L448 VanDerWaalsContact CZ-O 3.3Å; F409-L448 WeakPolarHBondContact CZ-O 3.24Å; F409-R451 HydrophobicContact CE2-CB 4.3Å; F409-R451 HydrophobicContact CE2-CG 4.01Å; F409-R451 HydrophobicContact CZ-CB 4.26Å; F409-R451 HydrophobicContact CZ-CG 4.44Å; F409-L452 HydrophobicContact CE1-CB 4.46Å; F409-L452 HydrophobicContact CE1-CD1 4.31Å; F409-L452 HydrophobicContact CZ-CB 4.21Å; F409-L452 HydrophobicContact CZ-CD1 4.35Å
410	N	90.1	Very high	87.2	Confident	114 Å²	114	73 Å²	73	61%	0.61	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-103	8.3	178.9	-158.6	18.1	0	0	0	112.8	V403 P407 E408	V403-N410 HydrophobicContact CG1-CB 4.42Å; P407-N410 PolarHBondContact O-N 2.86Å; E408-N410 VanDerWaalsContact C-N 3.33Å
411	K	92.6	Very high	87.2	Confident	105 Å²	105	71 Å²	71	46%	0.457	37%	0.368	S	S	.	.	S	Bend	trans	-70.6	144.1	171.6	-76.5	177	-176.1	172.9	0	110.5	P407 E408	P407-K411 PolarHBondContact O-N 3Å; E408-K411 WeakPolarHBondContact OE1-CE 3.41Å; E408-K411 IonicContact OE1-NZ 3.24Å; E408-K411 PolarHBondContact OE1-NZ 3.04Å; E408-K411 WeakPolarHBondContact OE2-CE 3.49Å; E408-K411 IonicContact OE2-NZ 2.7Å; E408-K411 PolarHBondContact OE2-NZ 3.24Å
412	P	92.8	Very high	87.2	Confident	117 Å²	117	73 Å²	73	76%	0.76	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-63.5	151.5	169.5	29.3	-35.1	0	0	0	110.6
413	L	92.6	Very high	86.8	Confident	105 Å²	105	81 Å²	81	55%	0.55	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-60.4	147.8	171	-62.6	179.4	0	0	0	110.5	F418 F441	L413-F418 HydrophobicContact CD1-CZ 4.42Å; L413-F441 HydrophobicContact CD2-CE2 4.17Å; L413-F441 HydrophobicContact CD2-CZ 4.33Å
414	P	90.2	Very high	86.1	Confident	43 Å²	43	88.1 Å²	88.1	28%	0.279	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-55.7	143.1	-179.9	-25.4	33.9	0	0	0	113	N416 S417 F437 F441	P414-N416 PolarHBondContact O-N 3.05Å; P414-S417 PolarHBondContact O-N 3.27Å; P414-S417 VanDerWaalsContact O-N 3.16Å; P414-S417 PolarHBondContact O-OG 3.07Å; P414-F437 HydrophobicContact CB-CE2 3.94Å; P414-F437 HydrophobicContact CB-CZ 3.86Å; P414-F441 HydrophobicContact CG-CD2 4.48Å
415	L	87.2	Confident	85.7	Confident	152 Å²	152	89.4 Å²	89.4	80%	0.796	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	136.9	178.7	-66.5	178.1	0	0	0	110.2
416	N	83.1	Confident	84.5	Confident	77 Å²	77	92.1 Å²	92.1	41%	0.412	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	14.9	-176.9	-45.9	-70.7	0	0	0	116.8	P414 F418 K419 H420	P414-N416 PolarHBondContact O-N 3.05Å; N416-F418 VanDerWaalsContact C-N 3.25Å; N416-F418 PolarHBondContact O-N 3.3Å; N416-K419 HydrophobicContact CB-CB 4.17Å; N416-K419 HydrophobicContact CB-CD 3.99Å; N416-K419 HydrophobicContact CB-CG 4.18Å; N416-K419 WeakPolarHBondContact O-CA 3.4Å; N416-K419 WeakPolarHBondContact O-CB 3.45Å; N416-K419 PolarHBondContact O-N 3.32Å; N416-K419 WeakPolarHBondContact OD1-CD 3.26Å; N416-K419 VanDerWaalsContact OD1-CE 3.24Å; N416-K419 WeakPolarHBondContact OD1-CE 3.27Å; N416-K419 PolarHBondContact OD1-NZ 3.27Å; N416-H420 PolarHBondContact O-CD2 3.13Å; N416-H420 PolarHBondContact O-N 2.9Å
417	S	86.7	Confident	83.2	Confident	5 Å²	5	97.6 Å²	97.6	4%	0.035	50%	0.502	C	S	.	.	H	α-helix	trans	-45.6	-49.5	171.6	-67.7	0	0	0	0	113	P414 K419 H420 L421 F437	P414-S417 PolarHBondContact O-N 3.27Å; P414-S417 VanDerWaalsContact O-N 3.16Å; P414-S417 PolarHBondContact O-OG 3.07Å; S417-K419 PolarHBondContact O-N 2.97Å; S417-H420 PolarHBondContact O-N 2.91Å; S417-H420 VanDerWaalsContact O-N 3.15Å; S417-L421 WeakPolarHBondContact O-CB 3.45Å; S417-L421 PolarHBondContact O-N 3.44Å; S417-F437 VanDerWaalsContact CA-CZ 3.47Å
418	F	85.1	Confident	81.7	Confident	168 Å²	168	98.2 Å²	98.2	74%	0.737	50%	0.5	S	S	*	.	H	α-helix	trans	-76.6	18.4	177.7	-46.8	-58.3	0	0	0	114.9	L413 N416 F425	L413-F418 HydrophobicContact CD1-CZ 4.42Å; N416-F418 VanDerWaalsContact C-N 3.25Å; N416-F418 PolarHBondContact O-N 3.3Å; F418-F425 VanDerWaalsContact O-CE2 3.28Å; F418-F425 WeakPolarHBondContact O-CE2 3.24Å; F418-F425 WeakPolarHBondContact O-CZ 3.26Å
419	K	82.9	Confident	80.2	Confident	130 Å²	130	99.4 Å²	99.4	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-115.5	-11.2	166	-58.8	-173.8	-173.3	160.2	0	113.1	N416 S417 F425	N416-K419 HydrophobicContact CB-CB 4.17Å; N416-K419 HydrophobicContact CB-CD 3.99Å; N416-K419 HydrophobicContact CB-CG 4.18Å; N416-K419 WeakPolarHBondContact O-CA 3.4Å; N416-K419 WeakPolarHBondContact O-CB 3.45Å; N416-K419 PolarHBondContact O-N 3.32Å; N416-K419 WeakPolarHBondContact OD1-CD 3.26Å; N416-K419 VanDerWaalsContact OD1-CE 3.24Å; N416-K419 WeakPolarHBondContact OD1-CE 3.27Å; N416-K419 PolarHBondContact OD1-NZ 3.27Å; S417-K419 PolarHBondContact O-N 2.97Å; K419-F425 VanDerWaalsContact O-CD1 3.25Å; K419-F425 WeakPolarHBondContact O-CD1 3.25Å; K419-F425 VanDerWaalsContact O-CE1 3.23Å; K419-F425 WeakPolarHBondContact O-CE1 3.32Å
420	H	81.4	Confident	78.7	Confident	48 Å²	48	102.3 Å²	102.3	22%	0.222	55%	0.55	C	S	.	*	H	α-helix	trans	-123.8	-21.1	-176.5	-57	-61.7	0	0	0	112.4	N416 S417 A434 F437	N416-H420 PolarHBondContact O-CD2 3.13Å; N416-H420 PolarHBondContact O-N 2.9Å; S417-H420 PolarHBondContact O-N 2.91Å; S417-H420 VanDerWaalsContact O-N 3.15Å; H420-A434 HydrophobicContact CB-CB 4.36Å; H420-F437 HydrophobicContact CB-CB 4.19Å; H420-F437 HydrophobicContact CB-CD1 3.7Å; H420-F437 HydrophobicContact CB-CE1 4.31Å; H420-F437 HydrophobicContact CB-CG 3.99Å; H420-F437 AromaticContact CD2-CD2 3.92Å; H420-F437 AromaticContact CD2-CG 3.91Å
421	L	83.4	Confident	78.1	Confident	42 Å²	42	100.5 Å²	100.5	22%	0.22	54%	0.54	C	S	.	.			trans	-122.1	133.6	-176.9	-55	177.3	0	0	0	111.5	S417 F425 F437 E438 F441	S417-L421 WeakPolarHBondContact O-CB 3.45Å; S417-L421 PolarHBondContact O-N 3.44Å; L421-F425 WeakPolarHBondContact O-CD2 3.23Å; L421-F437 HydrophobicContact CD1-CD1 4.29Å; L421-F437 HydrophobicContact CD1-CE1 3.83Å; L421-F437 HydrophobicContact CD2-CD1 4.46Å; L421-F437 HydrophobicContact CG-CD1 4.15Å; L421-F437 HydrophobicContact CG-CE1 4.03Å; L421-E438 HydrophobicContact CD2-CB 4.08Å; L421-E438 HydrophobicContact CD2-CG 4.14Å; L421-F441 HydrophobicContact CD1-CB 4.15Å; L421-F441 HydrophobicContact CD1-CD1 3.59Å; L421-F441 HydrophobicContact CD1-CD2 3.67Å; L421-F441 HydrophobicContact CD1-CE1 3.8Å; L421-F441 HydrophobicContact CD1-CE2 3.86Å; L421-F441 HydrophobicContact CD1-CG 3.52Å; L421-F441 HydrophobicContact CD1-CZ 3.93Å
422	G	81.8	Confident	77.6	Confident	51 Å²	51	100.5 Å²	100.5	53%	0.526	54%	0.544	S	S	.	.	S	Bend	trans	143.1	155.7	174.7	0	0	0	0	0	112.3	F424 F425	G422-F424 PolarHBondContact O-N 2.91Å; G422-F425 PolarHBondContact O-N 3.32Å; G422-F425 VanDerWaalsContact O-N 3.08Å
423	I	79.5	Confident	77	Confident	170 Å²	170	101.3 Å²	101.3	87%	0.872	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-32	-174.7	-61.1	173.4	0	0	0	112.2
424	F	73.7	Confident	76.5	Confident	203 Å²	203	97.2 Å²	97.2	89%	0.89	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.3	179.5	-60.4	-71.1	0	0	0	114.4	G422 N426	G422-F424 PolarHBondContact O-N 2.91Å; F424-N426 PolarHBondContact O-N 2.72Å
425	F	71.1	Confident	76.1	Confident	90 Å²	90	98.3 Å²	98.3	40%	0.395	52%	0.522	S	S	.	.	S	Bend	trans	-78.7	107.6	173.1	-80.9	-77.5	0	0	0	110	F418 K419 L421 G422 K427	F418-F425 VanDerWaalsContact O-CE2 3.28Å; F418-F425 WeakPolarHBondContact O-CE2 3.24Å; F418-F425 WeakPolarHBondContact O-CZ 3.26Å; K419-F425 VanDerWaalsContact O-CD1 3.25Å; K419-F425 WeakPolarHBondContact O-CD1 3.25Å; K419-F425 VanDerWaalsContact O-CE1 3.23Å; K419-F425 WeakPolarHBondContact O-CE1 3.32Å; L421-F425 WeakPolarHBondContact O-CD2 3.23Å; G422-F425 PolarHBondContact O-N 3.32Å; G422-F425 VanDerWaalsContact O-N 3.08Å; F425-K427 PolarHBondContact O-N 2.74Å
426	N	57.8	Low	76.1	Confident	122 Å²	122	95.7 Å²	95.7	65%	0.652	51%	0.505	S	S	*	.			trans	-58.8	113.4	175	-174.7	35.1	0	0	0	109.4	F424 D428	F424-N426 PolarHBondContact O-N 2.72Å; N426-D428 PolarHBondContact ND2-OD1 3.17Å; N426-D428 PolarHBondContact ND2-OD2 3.42Å; N426-D428 PolarHBondContact O-N 3.42Å
427	K	60.8	Low	76.3	Confident	122 Å²	122	93.2 Å²	93.2	53%	0.53	49%	0.491	S	S	.	.			trans	-77.5	65.4	175	-65.4	-161.4	178.7	-163.2	0	110.2	F425 A429 E438	F425-K427 PolarHBondContact O-N 2.74Å; K427-A429 PolarHBondContact O-N 3.06Å; K427-E438 IonicContact NZ-OE1 3.32Å; K427-E438 PolarHBondContact NZ-OE1 3.15Å; K427-E438 IonicContact NZ-OE2 3.44Å; K427-E438 PolarHBondContact NZ-OE2 2.94Å
428	D	60.4	Low	76.4	Confident	106 Å²	106	95.6 Å²	95.6	57%	0.567	50%	0.502	S	S	*	.			trans	-58.8	102.6	162.7	-74.2	-44.5	0	0	0	107.5	N426 A430 N431	N426-D428 PolarHBondContact ND2-OD1 3.17Å; N426-D428 PolarHBondContact ND2-OD2 3.42Å; N426-D428 PolarHBondContact O-N 3.42Å; D428-A430 PolarHBondContact O-N 3.44Å; D428-N431 PolarHBondContact O-N 3.27Å
429	A	58.5	Low	76.6	Confident	88 Å²	88	93.8 Å²	93.8	73%	0.727	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-4	-168	0	0	0	0	0	115	K427	K427-A429 PolarHBondContact O-N 3.06Å
430	A	61.8	Low	76.9	Confident	91 Å²	91	94 Å²	94	75%	0.752	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-11.6	171.5	0	0	0	0	0	114	D428 I432	D428-A430 PolarHBondContact O-N 3.44Å; A430-I432 VanDerWaalsContact C-N 3.31Å; A430-I432 PolarHBondContact O-N 3Å
431	N	76.3	Confident	77.4	Confident	76 Å²	76	94.2 Å²	94.2	41%	0.406	50%	0.497	S	S	.	.			trans	-80.5	79.3	178.4	-169.1	-12.6	0	0	0	111	D428 H433 A434 I435	D428-N431 PolarHBondContact O-N 3.27Å; N431-H433 VanDerWaalsContact C-N 3.28Å; N431-H433 PolarHBondContact O-N 2.84Å; N431-A434 HydrophobicContact CB-CB 4.11Å; N431-A434 PolarHBondContact O-N 3.27Å; N431-A434 VanDerWaalsContact O-N 3.08Å; N431-A434 PolarHBondContact OD1-N 2.82Å; N431-I435 PolarHBondContact O-N 3.29Å
432	I	81.7	Confident	77.8	Confident	105 Å²	105	97.8 Å²	97.8	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-49.9	-47.3	-179.2	-66.7	171.7	0	0	0	111.2	A430 A434 I435 E436	A430-I432 VanDerWaalsContact C-N 3.31Å; A430-I432 PolarHBondContact O-N 3Å; I432-A434 VanDerWaalsContact C-N 3.35Å; I432-A434 PolarHBondContact O-N 3.06Å; I432-I435 CarbonylContact O-C 3.59Å; I432-I435 WeakPolarHBondContact O-CA 3.39Å; I432-I435 WeakPolarHBondContact O-CB 3.47Å; I432-I435 PolarHBondContact O-N 2.74Å; I432-E436 VanDerWaalsContact CG2-CD 3.47Å; I432-E436 HydrophobicContact CG2-CG 4.16Å; I432-E436 WeakPolarHBondContact CG2-OE1 3.43Å; I432-E436 WeakPolarHBondContact O-CG 3.29Å; I432-E436 PolarHBondContact O-N 3.49Å
433	H	80.9	Confident	78.4	Confident	133 Å²	133	98.6 Å²	98.6	62%	0.616	50%	0.502	S	S	*	.	H	α-helix	trans	-63.1	-34.7	-179.7	-60.4	-37.1	0	0	0	114.1	N431 I435 E436 F437	N431-H433 VanDerWaalsContact C-N 3.28Å; N431-H433 PolarHBondContact O-N 2.84Å; H433-I435 VanDerWaalsContact C-N 3.32Å; H433-E436 WeakPolarHBondContact CA-OE2 3.49Å; H433-E436 IonicContact CE1-OE2 3.25Å; H433-E436 IonicContact CG-OE2 3.21Å; H433-E436 IonicContact ND1-OE2 2.72Å; H433-E436 PolarHBondContact ND1-OE2 3.17Å; H433-F437 WeakPolarHBondContact O-CB 3.45Å; H433-F437 PolarHBondContact O-N 2.86Å
434	A	81.6	Confident	79	Confident	19 Å²	19	93.3 Å²	93.3	16%	0.157	47%	0.473	C	S	.	.	H	α-helix	trans	-68.4	-33.9	173.9	0	0	0	0	0	112	H420 N431 I432 E438	H420-A434 HydrophobicContact CB-CB 4.36Å; N431-A434 HydrophobicContact CB-CB 4.11Å; N431-A434 PolarHBondContact O-N 3.27Å; N431-A434 VanDerWaalsContact O-N 3.08Å; N431-A434 PolarHBondContact OD1-N 2.82Å; I432-A434 VanDerWaalsContact C-N 3.35Å; I432-A434 PolarHBondContact O-N 3.06Å; A434-E438 WeakPolarHBondContact O-CB 3.23Å; A434-E438 PolarHBondContact O-N 3.24Å
435	I	82.7	Confident	80	Confident	66 Å²	66	86.4 Å²	86.4	34%	0.338	45%	0.448	S	S	.	.	H	α-helix	trans	-73.7	-39.2	177	-62.8	168.2	0	0	0	110.9	N431 I432 H433 K439	N431-I435 PolarHBondContact O-N 3.29Å; I432-I435 CarbonylContact O-C 3.59Å; I432-I435 WeakPolarHBondContact O-CA 3.39Å; I432-I435 WeakPolarHBondContact O-CB 3.47Å; I432-I435 PolarHBondContact O-N 2.74Å; H433-I435 VanDerWaalsContact C-N 3.32Å; I435-K439 HydrophobicContact CG2-CD 4.48Å; I435-K439 VanDerWaalsContact O-CG 3.28Å; I435-K439 WeakPolarHBondContact O-CG 3.23Å; I435-K439 PolarHBondContact O-N 3.15Å; I435-K439 VanDerWaalsContact O-N 3.13Å
436	E	86.7	Confident	81.1	Confident	97 Å²	97	82.8 Å²	82.8	45%	0.453	43%	0.433	S	S	.	.	H	α-helix	trans	-62.2	-48.6	172.7	-70.9	167.4	157.1	0	0	110.8	I432 H433 E438 K439 E440	I432-E436 VanDerWaalsContact CG2-CD 3.47Å; I432-E436 HydrophobicContact CG2-CG 4.16Å; I432-E436 WeakPolarHBondContact CG2-OE1 3.43Å; I432-E436 WeakPolarHBondContact O-CG 3.29Å; I432-E436 PolarHBondContact O-N 3.49Å; H433-E436 WeakPolarHBondContact CA-OE2 3.49Å; H433-E436 IonicContact CE1-OE2 3.25Å; H433-E436 IonicContact CG-OE2 3.21Å; H433-E436 IonicContact ND1-OE2 2.72Å; H433-E436 PolarHBondContact ND1-OE2 3.17Å; E436-E438 PolarHBondContact O-N 2.96Å; E436-K439 WeakPolarHBondContact O-CB 3.17Å; E436-K439 PolarHBondContact O-N 3.06Å; E436-K439 VanDerWaalsContact O-N 3.15Å; E436-E440 PolarHBondContact O-N 2.82Å
437	F	88.4	Confident	82.8	Confident	26 Å²	26	82.9 Å²	82.9	11%	0.114	43%	0.429	C	S	.	.	H	α-helix	trans	-61	-42.4	176.9	-168.6	-79.4	0	0	0	112.5	P414 S417 H420 L421 H433 K439 E440 F441	P414-F437 HydrophobicContact CB-CE2 3.94Å; P414-F437 HydrophobicContact CB-CZ 3.86Å; S417-F437 VanDerWaalsContact CA-CZ 3.47Å; H420-F437 HydrophobicContact CB-CB 4.19Å; H420-F437 HydrophobicContact CB-CD1 3.7Å; H420-F437 HydrophobicContact CB-CE1 4.31Å; H420-F437 HydrophobicContact CB-CG 3.99Å; H420-F437 AromaticContact CD2-CD2 3.92Å; H420-F437 AromaticContact CD2-CG 3.91Å; L421-F437 HydrophobicContact CD1-CD1 4.29Å; L421-F437 HydrophobicContact CD1-CE1 3.83Å; L421-F437 HydrophobicContact CD2-CD1 4.46Å; L421-F437 HydrophobicContact CG-CD1 4.15Å; L421-F437 HydrophobicContact CG-CE1 4.03Å; H433-F437 WeakPolarHBondContact O-CB 3.45Å; H433-F437 PolarHBondContact O-N 2.86Å; F437-K439 VanDerWaalsContact C-N 3.31Å; F437-K439 PolarHBondContact O-N 2.9Å; F437-E440 PolarHBondContact O-N 2.75Å; F437-F441 HydrophobicContact CE1-CB 4.41Å; F437-F441 HydrophobicContact CE1-CD2 4.13Å; F437-F441 WeakPolarHBondContact O-CB 3.5Å; F437-F441 PolarHBondContact O-N 2.82Å
438	E	87.8	Confident	84.4	Confident	54 Å²	54	79 Å²	79	25%	0.252	41%	0.414	S	S	.	.	H	α-helix	trans	-63.7	-35.1	175.8	-176.4	176.3	-165.1	0	0	112.4	L421 K427 A434 E436 R442	L421-E438 HydrophobicContact CD2-CB 4.08Å; L421-E438 HydrophobicContact CD2-CG 4.14Å; K427-E438 IonicContact NZ-OE1 3.32Å; K427-E438 PolarHBondContact NZ-OE1 3.15Å; K427-E438 IonicContact NZ-OE2 3.44Å; K427-E438 PolarHBondContact NZ-OE2 2.94Å; A434-E438 WeakPolarHBondContact O-CB 3.23Å; A434-E438 PolarHBondContact O-N 3.24Å; E436-E438 PolarHBondContact O-N 2.96Å; E438-R442 VanDerWaalsContact O-CB 3.22Å; E438-R442 WeakPolarHBondContact O-CB 3.45Å; E438-R442 PolarHBondContact O-N 2.79Å; E438-R442 VanDerWaalsContact O-N 3.13Å
439	K	89.1	Confident	86	Confident	131 Å²	131	77.7 Å²	77.7	57%	0.57	41%	0.407	S	S	*	.	H	α-helix	trans	-67.8	-51	174.1	-71.6	165.6	179.6	175.7	0	111.4	I435 E436 F437 R442 V443	I435-K439 HydrophobicContact CG2-CD 4.48Å; I435-K439 VanDerWaalsContact O-CG 3.28Å; I435-K439 WeakPolarHBondContact O-CG 3.23Å; I435-K439 PolarHBondContact O-N 3.15Å; I435-K439 VanDerWaalsContact O-N 3.13Å; E436-K439 WeakPolarHBondContact O-CB 3.17Å; E436-K439 PolarHBondContact O-N 3.06Å; E436-K439 VanDerWaalsContact O-N 3.15Å; F437-K439 VanDerWaalsContact C-N 3.31Å; F437-K439 PolarHBondContact O-N 2.9Å; K439-R442 PolarHBondContact O-N 3.38Å; K439-V443 WeakPolarHBondContact O-CG2 3.49Å; K439-V443 PolarHBondContact O-N 3.16Å
440	E	90.3	Very high	87.7	Confident	135 Å²	135	76.2 Å²	76.2	63%	0.631	38%	0.384	S	S	*	.	H	α-helix	trans	-59.9	-48.7	-179	-174.2	178.6	-168	0	0	111.2	E436 F437 R442 V443 Q444	E436-E440 PolarHBondContact O-N 2.82Å; F437-E440 PolarHBondContact O-N 2.75Å; E440-R442 VanDerWaalsContact C-N 3.31Å; E440-R442 PolarHBondContact O-N 2.91Å; E440-V443 PolarHBondContact O-N 3.5Å; E440-V443 VanDerWaalsContact O-N 3.15Å; E440-Q444 PolarHBondContact O-N 2.91Å
441	F	91.8	Very high	89.2	Confident	51 Å²	51	77.1 Å²	77.1	22%	0.224	37%	0.368	C	S	.	.	H	α-helix	trans	-60.4	-38.8	177.7	-167.9	-84.2	0	0	0	112.2	L413 P414 L421 F437 T445	L413-F441 HydrophobicContact CD2-CE2 4.17Å; L413-F441 HydrophobicContact CD2-CZ 4.33Å; P414-F441 HydrophobicContact CG-CD2 4.48Å; L421-F441 HydrophobicContact CD1-CB 4.15Å; L421-F441 HydrophobicContact CD1-CD1 3.59Å; L421-F441 HydrophobicContact CD1-CD2 3.67Å; L421-F441 HydrophobicContact CD1-CE1 3.8Å; L421-F441 HydrophobicContact CD1-CE2 3.86Å; L421-F441 HydrophobicContact CD1-CG 3.52Å; L421-F441 HydrophobicContact CD1-CZ 3.93Å; F437-F441 HydrophobicContact CE1-CB 4.41Å; F437-F441 HydrophobicContact CE1-CD2 4.13Å; F437-F441 WeakPolarHBondContact O-CB 3.5Å; F437-F441 PolarHBondContact O-N 2.82Å; F441-T445 WeakPolarHBondContact O-CB 3.28Å; F441-T445 PolarHBondContact O-N 2.57Å; F441-T445 PolarHBondContact O-OG1 2.95Å
442	R	91.6	Very high	89.9	Confident	118 Å²	118	73.8 Å²	73.8	45%	0.445	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-44.5	174.4	176.8	178.8	-66.4	-94.8	-5.1	111.9	E438 K439 E440 T445 I446	E438-R442 VanDerWaalsContact O-CB 3.22Å; E438-R442 WeakPolarHBondContact O-CB 3.45Å; E438-R442 PolarHBondContact O-N 2.79Å; E438-R442 VanDerWaalsContact O-N 3.13Å; K439-R442 PolarHBondContact O-N 3.38Å; E440-R442 VanDerWaalsContact C-N 3.31Å; E440-R442 PolarHBondContact O-N 2.91Å; R442-T445 PolarHBondContact O-N 3.07Å; R442-I446 HydrophobicContact CG-CD1 3.97Å; R442-I446 WeakPolarHBondContact O-CG1 3.39Å; R442-I446 PolarHBondContact O-N 3.5Å
443	V	93.6	Very high	90.3	Very high	68 Å²	68	70 Å²	70	41%	0.412	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-48	177.5	169.1	0	0	0	0	110.4	K439 E440 T445 I446 Q447	K439-V443 WeakPolarHBondContact O-CG2 3.49Å; K439-V443 PolarHBondContact O-N 3.16Å; E440-V443 PolarHBondContact O-N 3.5Å; E440-V443 VanDerWaalsContact O-N 3.15Å; V443-T445 VanDerWaalsContact C-N 3.33Å; V443-T445 PolarHBondContact O-N 3.36Å; V443-I446 PolarHBondContact O-N 3.12Å; V443-Q447 HydrophobicContact CG1-CG 4.4Å; V443-Q447 WeakPolarHBondContact O-CB 2.99Å; V443-Q447 VanDerWaalsContact O-CG 3.31Å; V443-Q447 WeakPolarHBondContact O-CG 3.45Å; V443-Q447 PolarHBondContact O-N 3.48Å
444	Q	93	Very high	90.8	Very high	58 Å²	58	67.2 Å²	67.2	27%	0.271	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-42.2	176.6	-168.1	-178.6	23	0	0	111.7	E440 I446 Q447 L448	E440-Q444 PolarHBondContact O-N 2.91Å; Q444-I446 PolarHBondContact O-N 3.36Å; Q444-Q447 PolarHBondContact O-N 2.76Å; Q444-L448 HydrophobicContact CG-CD1 4.39Å; Q444-L448 WeakPolarHBondContact O-CG 3.41Å; Q444-L448 PolarHBondContact O-N 3.21Å
445	T	93.5	Very high	91	Very high	58 Å²	58	67.5 Å²	67.5	36%	0.356	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-45.9	176	-58.7	0	0	0	0	111.7	F441 R442 V443 L448 L449	F441-T445 WeakPolarHBondContact O-CB 3.28Å; F441-T445 PolarHBondContact O-N 2.57Å; F441-T445 PolarHBondContact O-OG1 2.95Å; R442-T445 PolarHBondContact O-N 3.07Å; V443-T445 VanDerWaalsContact C-N 3.33Å; V443-T445 PolarHBondContact O-N 3.36Å; T445-L448 PolarHBondContact O-N 3.31Å; T445-L449 HydrophobicContact CG2-CD1 4.21Å; T445-L449 WeakPolarHBondContact O-CG 3.43Å; T445-L449 PolarHBondContact O-N 2.86Å
446	I	94.8	Very high	91.2	Very high	14 Å²	14	66.2 Å²	66.2	7%	0.072	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-36.9	179.3	-67.7	169.8	0	0	0	111.2	L38 N39 R442 V443 Q444 L449 K450	L38-I446 HydrophobicContact CB-CD1 4.47Å; N39-I446 VanDerWaalsContact OD1-CD1 3.29Å; N39-I446 WeakPolarHBondContact OD1-CD1 3.5Å; R442-I446 HydrophobicContact CG-CD1 3.97Å; R442-I446 WeakPolarHBondContact O-CG1 3.39Å; R442-I446 PolarHBondContact O-N 3.5Å; V443-I446 PolarHBondContact O-N 3.12Å; Q444-I446 PolarHBondContact O-N 3.36Å; I446-L449 PolarHBondContact O-N 3.43Å; I446-K450 WeakPolarHBondContact O-CG 3.22Å; I446-K450 PolarHBondContact O-N 3.32Å
447	Q	94.2	Very high	91.1	Very high	124 Å²	124	66.1 Å²	66.1	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-62.5	-45.3	174.2	-74.1	172.3	-7.7	0	0	112	V443 Q444 K450 R451	V443-Q447 HydrophobicContact CG1-CG 4.4Å; V443-Q447 WeakPolarHBondContact O-CB 2.99Å; V443-Q447 VanDerWaalsContact O-CG 3.31Å; V443-Q447 WeakPolarHBondContact O-CG 3.45Å; V443-Q447 PolarHBondContact O-N 3.48Å; Q444-Q447 PolarHBondContact O-N 2.76Å; Q447-K450 PolarHBondContact O-N 3.47Å; Q447-R451 WeakPolarHBondContact O-CB 3.04Å; Q447-R451 PolarHBondContact O-N 3.23Å
448	L	94.5	Very high	91	Very high	42 Å²	42	71.7 Å²	71.7	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-40.5	175.1	-71.2	171.9	0	0	0	111.8	E408 F409 Q444 T445 R451 L452	E408-L448 HydrophobicContact CB-CD2 3.98Å; F409-L448 HydrophobicContact CD1-CD2 4.2Å; F409-L448 HydrophobicContact CD2-CD2 4.11Å; F409-L448 HydrophobicContact CE1-CB 4.1Å; F409-L448 HydrophobicContact CE1-CD2 4.18Å; F409-L448 HydrophobicContact CE2-CD2 4.1Å; F409-L448 HydrophobicContact CG-CD2 4.19Å; F409-L448 HydrophobicContact CZ-CB 4.35Å; F409-L448 HydrophobicContact CZ-CD2 4.13Å; F409-L448 VanDerWaalsContact CZ-O 3.3Å; F409-L448 WeakPolarHBondContact CZ-O 3.24Å; Q444-L448 HydrophobicContact CG-CD1 4.39Å; Q444-L448 WeakPolarHBondContact O-CG 3.41Å; Q444-L448 PolarHBondContact O-N 3.21Å; T445-L448 PolarHBondContact O-N 3.31Å; L448-R451 CarbonylContact O-C 3.6Å; L448-R451 PolarHBondContact O-N 3.35Å; L448-L452 PolarHBondContact O-N 2.87Å
449	L	94	Very high	90.5	Very high	78 Å²	78	74.8 Å²	74.8	41%	0.408	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-41.8	175	-72.4	172	0	0	0	112.6	T445 I446 L452 V453	T445-L449 HydrophobicContact CG2-CD1 4.21Å; T445-L449 WeakPolarHBondContact O-CG 3.43Å; T445-L449 PolarHBondContact O-N 2.86Å; I446-L449 PolarHBondContact O-N 3.43Å; L449-L452 WeakPolarHBondContact O-CB 3.35Å; L449-L452 PolarHBondContact O-N 3.15Å; L449-V453 WeakPolarHBondContact O-CG2 3.11Å; L449-V453 PolarHBondContact O-N 3.5Å
450	K	93.3	Very high	89.8	Confident	57 Å²	57	71.7 Å²	71.7	25%	0.248	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-43.5	172	-74.8	-172.9	170.5	-168.8	0	111	L35 D36 I446 Q447 L452 V453 N454	L35-K450 HydrophobicContact CD1-CG 4.26Å; D36-K450 IonicContact OD1-NZ 3.14Å; D36-K450 PolarHBondContact OD1-NZ 2.98Å; D36-K450 IonicContact OD2-NZ 2.81Å; D36-K450 PolarHBondContact OD2-NZ 2.94Å; I446-K450 WeakPolarHBondContact O-CG 3.22Å; I446-K450 PolarHBondContact O-N 3.32Å; Q447-K450 PolarHBondContact O-N 3.47Å; K450-L452 VanDerWaalsContact C-N 3.27Å; K450-L452 PolarHBondContact O-N 3.36Å; K450-V453 PolarHBondContact O-N 3.16Å; K450-N454 VanDerWaalsContact O-CG 3.32Å; K450-N454 PolarHBondContact O-N 2.98Å; K450-N454 PolarHBondContact O-OD1 3.38Å
451	R	92.8	Very high	89	Confident	110 Å²	110	68.1 Å²	68.1	42%	0.415	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-31.3	175.5	-167.5	175.4	178.5	117.1	-13.1	113	D406 F409 Q447 L448 K455	D406-R451 VanDerWaalsContact CG-NE 3.33Å; D406-R451 IonicContact OD1-CZ 3.34Å; D406-R451 IonicContact OD1-NE 2.72Å; D406-R451 PolarHBondContact OD1-NE 2.84Å; D406-R451 VanDerWaalsContact OD1-NE 3.14Å; D406-R451 IonicContact OD1-NH2 3.15Å; D406-R451 PolarHBondContact OD1-NH2 2.99Å; D406-R451 IonicContact OD2-CZ 2.61Å; D406-R451 IonicContact OD2-NE 2.83Å; D406-R451 PolarHBondContact OD2-NE 2.98Å; D406-R451 IonicContact OD2-NH2 2.79Å; D406-R451 PolarHBondContact OD2-NH2 3.37Å; F409-R451 HydrophobicContact CE2-CB 4.3Å; F409-R451 HydrophobicContact CE2-CG 4.01Å; F409-R451 HydrophobicContact CZ-CB 4.26Å; F409-R451 HydrophobicContact CZ-CG 4.44Å; Q447-R451 WeakPolarHBondContact O-CB 3.04Å; Q447-R451 PolarHBondContact O-N 3.23Å; L448-R451 CarbonylContact O-C 3.6Å; L448-R451 PolarHBondContact O-N 3.35Å; R451-K455 WeakPolarHBondContact O-CG 3.33Å
452	L	91.3	Very high	87.8	Confident	6 Å²	6	66.8 Å²	66.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-69.4	-46.7	172.4	-167.3	71	0	0	0	111.5	L395 M398 M399 V402 F409 L448 L449 K450 K455 I456	L395-L452 HydrophobicContact CD2-CD2 4.05Å; M398-L452 HydrophobicContact CB-CD1 4.14Å; M398-L452 HydrophobicContact CE-CD1 3.86Å; M398-L452 HydrophobicContact CE-CG 4.39Å; M399-L452 HydrophobicContact SD-CD1 4.22Å; M399-L452 HydrophobicContact SD-CD2 4.06Å; V402-L452 HydrophobicContact CB-CD1 4.46Å; V402-L452 HydrophobicContact CG1-CD1 3.8Å; V402-L452 HydrophobicContact CG2-CD1 3.84Å; F409-L452 HydrophobicContact CE1-CB 4.46Å; F409-L452 HydrophobicContact CE1-CD1 4.31Å; F409-L452 HydrophobicContact CZ-CB 4.21Å; F409-L452 HydrophobicContact CZ-CD1 4.35Å; L448-L452 PolarHBondContact O-N 2.87Å; L449-L452 WeakPolarHBondContact O-CB 3.35Å; L449-L452 PolarHBondContact O-N 3.15Å; K450-L452 VanDerWaalsContact C-N 3.27Å; K450-L452 PolarHBondContact O-N 3.36Å; L452-K455 PolarHBondContact O-N 3.07Å; L452-I456 PolarHBondContact O-N 2.73Å
453	V	91.5	Very high	86.5	Confident	26 Å²	26	63.9 Å²	63.9	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-47.9	177	170.8	0	0	0	0	111.1	T28 L449 K450 K455 I456 E457	T28-V453 HydrophobicContact CG2-CG1 3.82Å; L449-V453 WeakPolarHBondContact O-CG2 3.11Å; L449-V453 PolarHBondContact O-N 3.5Å; K450-V453 PolarHBondContact O-N 3.16Å; V453-K455 PolarHBondContact O-N 2.99Å; V453-K455 VanDerWaalsContact O-N 3.14Å; V453-I456 WeakPolarHBondContact O-CA 3.43Å; V453-I456 WeakPolarHBondContact O-CB 3.33Å; V453-I456 PolarHBondContact O-N 3.36Å; V453-E457 HydrophobicContact CG1-CG 4.36Å; V453-E457 PolarHBondContact O-N 3.48Å
454	N	89.9	Confident	84.9	Confident	74 Å²	74	62 Å²	62	40%	0.396	30%	0.301	S	S	.	.	H	α-helix	trans	-57	-33.3	-180	-68.4	21.9	0	0	0	112.7	K450 E457 Q458	K450-N454 VanDerWaalsContact O-CG 3.32Å; K450-N454 PolarHBondContact O-N 2.98Å; K450-N454 PolarHBondContact O-OD1 3.38Å; N454-E457 PolarHBondContact O-N 3.5Å; N454-Q458 WeakPolarHBondContact O-CB 3.31Å; N454-Q458 WeakPolarHBondContact O-CG 3.31Å; N454-Q458 PolarHBondContact O-N 3.23Å
455	K	86.8	Confident	82.9	Confident	24 Å²	24	64.9 Å²	64.9	10%	0.104	31%	0.309	C	S	.	.	H	α-helix	trans	-72	-30.9	176.6	-69.1	172.2	-176.2	-66.8	0	113.3	M398 V402 D406 R451 L452 V453 R459 Q460	M398-K455 HydrophobicContact CE-CB 4.09Å; V402-K455 HydrophobicContact CG1-CD 3.4Å; D406-K455 WeakPolarHBondContact OD2-CE 3.48Å; D406-K455 IonicContact OD2-NZ 2.79Å; D406-K455 PolarHBondContact OD2-NZ 2.63Å; R451-K455 WeakPolarHBondContact O-CG 3.33Å; L452-K455 PolarHBondContact O-N 3.07Å; V453-K455 PolarHBondContact O-N 2.99Å; V453-K455 VanDerWaalsContact O-N 3.14Å; K455-R459 PolarHBondContact O-N 2.96Å; K455-Q460 HydrophobicContact CB-CB 4.32Å; K455-Q460 WeakPolarHBondContact O-CB 3.48Å; K455-Q460 PolarHBondContact O-N 2.85Å
456	I	86.7	Confident	80.4	Confident	39 Å²	39	69.3 Å²	69.3	20%	0.2	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-44.4	173.3	-59.3	170.4	0	0	0	109.2	L394 M398 L452 V453 Q458 R459 L522	L394-I456 HydrophobicContact CD2-CD1 4.49Å; M398-I456 HydrophobicContact CE-CD1 4.31Å; M398-I456 HydrophobicContact CE-CG1 3.6Å; M398-I456 HydrophobicContact CG-CD1 4.23Å; M398-I456 HydrophobicContact CG-CG1 4.22Å; M398-I456 HydrophobicContact SD-CG1 3.86Å; L452-I456 PolarHBondContact O-N 2.73Å; V453-I456 WeakPolarHBondContact O-CA 3.43Å; V453-I456 WeakPolarHBondContact O-CB 3.33Å; V453-I456 PolarHBondContact O-N 3.36Å; I456-Q458 VanDerWaalsContact C-N 3.32Å; I456-Q458 PolarHBondContact O-N 3.24Å; I456-R459 PolarHBondContact O-N 2.57Å; I456-L522 HydrophobicContact CG2-CD1 4.23Å; I456-L522 HydrophobicContact CG2-CD2 3.9Å; I456-L522 HydrophobicContact CG2-CG 4.33Å
457	E	85.3	Confident	77.4	Confident	95 Å²	95	71.3 Å²	71.3	44%	0.444	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-37.5	176.1	-66.4	-174.1	131.2	0	0	112.6	T28 V453 N454 R459	T28-E457 WeakPolarHBondContact CB-OE1 2.98Å; T28-E457 HydrophobicContact CG2-CG 4.04Å; T28-E457 WeakPolarHBondContact CG2-OE1 3.28Å; T28-E457 PolarHBondContact OG1-OE1 3.25Å; V453-E457 HydrophobicContact CG1-CG 4.36Å; V453-E457 PolarHBondContact O-N 3.48Å; N454-E457 PolarHBondContact O-N 3.5Å; E457-R459 PolarHBondContact O-N 3.44Å
458	Q	84.4	Confident	74.3	Confident	144 Å²	144	71.1 Å²	71.1	67%	0.673	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-0.4	173.2	-71.9	170.2	-1.4	0	0	113.9	N454 I456 Q460	N454-Q458 WeakPolarHBondContact O-CB 3.31Å; N454-Q458 WeakPolarHBondContact O-CG 3.31Å; N454-Q458 PolarHBondContact O-N 3.23Å; I456-Q458 VanDerWaalsContact C-N 3.32Å; I456-Q458 PolarHBondContact O-N 3.24Å; Q458-Q460 PolarHBondContact O-N 3.05Å
459	R	79.1	Confident	71.1	Confident	118 Å²	118	72.6 Å²	72.6	45%	0.445	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.4	47	-173.1	-64.2	-170.2	177.1	-163.1	-2.9	112.4	E11 K455 I456 E457 T461	E11-R459 IonicContact OE1-NH2 3.85Å; E11-R459 PolarHBondContact OE1-NH2 3.31Å; K455-R459 PolarHBondContact O-N 2.96Å; I456-R459 PolarHBondContact O-N 2.57Å; E457-R459 PolarHBondContact O-N 3.44Å; R459-T461 PolarHBondContact O-N 2.87Å
460	Q	73.4	Confident	67.9	Low	67 Å²	67	73.8 Å²	73.8	31%	0.313	36%	0.357	S	S	.	.			trans	-65.8	101.4	-177.4	-172.6	-179.8	10	0	0	110.2	K455 Q458	K455-Q460 HydrophobicContact CB-CB 4.32Å; K455-Q460 WeakPolarHBondContact O-CB 3.48Å; K455-Q460 PolarHBondContact O-N 2.85Å; Q458-Q460 PolarHBondContact O-N 3.05Å
461	T	72.7	Confident	64.6	Low	59 Å²	59	76.9 Å²	76.9	36%	0.362	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-69.7	151.9	179.1	59.6	0	0	0	0	112.3	R459 S518 I519 D520	R459-T461 PolarHBondContact O-N 2.87Å; T461-S518 VanDerWaalsContact CB-OG 3.3Å; T461-S518 WeakPolarHBondContact CB-OG 3.42Å; T461-S518 VanDerWaalsContact OG1-CB 3.27Å; T461-S518 WeakPolarHBondContact OG1-CB 3.48Å; T461-S518 PolarHBondContact OG1-OG 2.91Å; T461-I519 CarbonylContact C-O 3.52Å; T461-I519 VanDerWaalsContact CA-O 3.31Å; T461-I519 WeakPolarHBondContact CA-O 3.21Å; T461-I519 WeakPolarHBondContact CB-O 3.44Å; T461-D520 HydrophobicContact CG2-CB 4.49Å
462	F	68.3	Low	61.6	Low	24 Å²	24	78.7 Å²	78.7	11%	0.105	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.4	175.8	-51.1	-31.3	0	0	0	110.3	I397 M398 N401 I464 S518 I519 P521 L524	I397-F462 HydrophobicContact CG2-CE2 3.36Å; I397-F462 HydrophobicContact CG2-CZ 3.71Å; M398-F462 HydrophobicContact SD-CE1 4.34Å; M398-F462 HydrophobicContact SD-CZ 4.25Å; N401-F462 HydrophobicContact CB-CD1 3.48Å; N401-F462 VanDerWaalsContact CB-CD1 3.48Å; N401-F462 HydrophobicContact CB-CE1 3.18Å; N401-F462 HydrophobicContact CB-CG 4.34Å; N401-F462 HydrophobicContact CB-CZ 3.8Å; N401-F462 WeakPolarHBondContact ND2-CD1 3.29Å; N401-F462 VanDerWaalsContact ND2-CE1 3.33Å; N401-F462 WeakPolarHBondContact ND2-CE1 3.27Å; F462-I464 PolarHBondContact O-N 3.25Å; F462-S518 CarbonylContact O-C 3.57Å; F462-S518 WeakPolarHBondContact O-CA 3.33Å; F462-S518 WeakPolarHBondContact O-CB 3.45Å; F462-I519 HydrophobicContact CB-CG2 4.45Å; F462-I519 HydrophobicContact CD2-CG2 4.38Å; F462-I519 PolarHBondContact N-O 2.84Å; F462-I519 PolarHBondContact O-N 2.94Å; F462-I519 VanDerWaalsContact O-N 3.1Å; F462-P521 HydrophobicContact CD1-CG 4.39Å; F462-P521 HydrophobicContact CE1-CB 4.05Å; F462-P521 HydrophobicContact CE1-CG 3.58Å; F462-P521 HydrophobicContact CE2-CB 3.76Å; F462-P521 HydrophobicContact CE2-CG 4.08Å; F462-P521 HydrophobicContact CZ-CB 3.37Å; F462-P521 HydrophobicContact CZ-CG 3.46Å; F462-P521 VanDerWaalsContact CZ-CG 3.46Å; F462-L524 HydrophobicContact CD2-CD2 4.47Å; F462-L524 HydrophobicContact CE2-CD2 4.36Å
463	P	64.1	Low	58.5	Low	56 Å²	56	83.6 Å²	83.6	36%	0.364	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	121.2	174.4	27.4	-33.5	0	0	0	110.3	R465	P463-R465 VanDerWaalsContact C-N 3.32Å; P463-R465 PolarHBondContact O-N 2.9Å
464	I	59.2	Low	55.4	Low	30 Å²	30	89.6 Å²	89.6	15%	0.154	46%	0.464	C	S	.	.			trans	-76.6	87.8	176	-64.9	171.7	0	0	0	107.5	F462 K466 I516 Q517 I519 L580 Y582 P605	F462-I464 PolarHBondContact O-N 3.25Å; I464-K466 PolarHBondContact O-N 2.96Å; I464-I516 HydrophobicContact CD1-CB 4.21Å; I464-I516 HydrophobicContact CD1-CG2 3.72Å; I464-I516 WeakPolarHBondContact CD1-O 3.23Å; I464-Q517 PolarHBondContact N-O 2.85Å; I464-I519 HydrophobicContact CD1-CB 4.18Å; I464-I519 HydrophobicContact CD1-CG2 4.14Å; I464-I519 HydrophobicContact CG1-CG2 4.19Å; I464-L580 HydrophobicContact CD1-CD2 3.77Å; I464-Y582 HydrophobicContact CG2-CE1 3.73Å; I464-P605 HydrophobicContact CG2-CB 4.3Å; I464-P605 HydrophobicContact CG2-CG 4.37Å
465	R	51.8	Low	52.4	Low	118 Å²	118	94.7 Å²	94.7	45%	0.445	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-69.2	121	176.9	-69.4	-168.1	-170.2	129.5	1.2	109.9	P463 S467 M492	P463-R465 VanDerWaalsContact C-N 3.32Å; P463-R465 PolarHBondContact O-N 2.9Å; R465-S467 PolarHBondContact O-N 2.76Å; R465-M492 HydrophobicContact CB-CE 4.4Å; R465-M492 HydrophobicContact CB-SD 3.96Å; R465-M492 HydrophobicContact CG-CE 3.92Å; R465-M492 HydrophobicContact CG-SD 3.97Å; R465-M492 VanDerWaalsContact NH1-CE 3.32Å; R465-M492 PolarHBondContact NH1-SD 2.92Å; R465-M492 VanDerWaalsContact NH1-SD 3.36Å
466	K	40.1	Very low	49.7	Very low	150 Å²	150	102.9 Å²	102.9	65%	0.652	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-54.5	137	155	-64.9	175.1	-178.5	174.3	0	107.7	I464 K468	I464-K466 PolarHBondContact O-N 2.96Å; K466-K468 PolarHBondContact O-N 2.71Å
467	S	33	Very low	46.8	Very low	56 Å²	56	110.4 Å²	110.4	39%	0.392	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-47.9	129.9	-174	54.4	0	0	0	0	113.7	R465 H601 S602	R465-S467 PolarHBondContact O-N 2.76Å; S467-H601 WeakPolarHBondContact CB-O 3.43Å; S467-H601 PolarHBondContact OG-O 2.64Å; S467-H601 VanDerWaalsContact OG-O 3.07Å; S467-S602 WeakPolarHBondContact OG-CA 3.49Å
468	K	29.1	Very low	44.1	Very low	120 Å²	120	114.1 Å²	114.1	52%	0.522	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-75.1	151.1	159.7	-83.7	-165.3	171.9	-164.4	0	110.2	K466 V470 E495	K466-K468 PolarHBondContact O-N 2.71Å; K468-V470 PolarHBondContact O-N 3.21Å; K468-E495 PolarHBondContact NZ-O 3.11Å
469	T	25.5	Very low	41.2	Very low	73 Å²	73	116.1 Å²	116.1	45%	0.448	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-52	130.6	176	-41.1	0	0	0	0	111.6
470	V	28.3	Very low	38.7	Very low	104 Å²	104	115.9 Å²	115.9	63%	0.63	60%	0.598	S	S	*	*			trans	-109.6	104.8	171.1	-175	0	0	0	0	108.7	K468 L472	K468-V470 PolarHBondContact O-N 3.21Å; V470-L472 VanDerWaalsContact C-N 3.35Å; V470-L472 HydrophobicContact CG1-CG 4.13Å; V470-L472 PolarHBondContact O-N 3.36Å
471	T	24.2	Very low	36.4	Very low	122 Å²	122	117.5 Å²	117.5	75%	0.748	62%	0.617	S	S	*	*			trans	-73.3	87.5	171.3	7	0	0	0	0	109.8	S473	T471-S473 PolarHBondContact O-N 3.02Å
472	L	28.9	Very low	34.1	Very low	147 Å²	147	124.5 Å²	124.5	77%	0.77	64%	0.643	S	S	*	*			trans	-78.2	113.9	168.5	-84.3	161.6	0	0	0	109.8	V470	V470-L472 VanDerWaalsContact C-N 3.35Å; V470-L472 HydrophobicContact CG1-CG 4.13Å; V470-L472 PolarHBondContact O-N 3.36Å
473	S	26.3	Very low	32	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	67%	0.665	S	S	*	*			trans	-66.8	130.2	165.6	49.9	0	0	0	0	109.9	T471 Q475	T471-S473 PolarHBondContact O-N 3.02Å; S473-Q475 PolarHBondContact O-N 3.16Å
474	N	26.1	Very low	30.4	Very low	152 Å²	152	130.1 Å²	130.1	81%	0.813	68%	0.68	S	S	*	*	S	Bend	trans	-63.3	97.8	-173.9	-76.2	-42.1	0	0	0	113.7
475	Q	27.6	Very low	29.1	Very low	181 Å²	181	137 Å²	137	85%	0.846	71%	0.705	S	S	*	*			trans	-152.9	163.9	155.6	-107.3	158.1	17.7	0	0	109	S473	S473-Q475 PolarHBondContact O-N 3.16Å
476	E	29.6	Very low	28.2	Very low	195 Å²	195	135.1 Å²	135.1	91%	0.911	71%	0.71	S	S	*	*			trans	63.2	75.8	179.8	-57.5	-173.2	174.9	0	0	116.4
477	K	24.9	Very low	28	Very low	197 Å²	197	129.8 Å²	129.8	86%	0.857	69%	0.689	S	S	*	*			trans	-77.3	132.5	143.6	-67.5	177.1	178.6	177	0	107.8
478	H	28.7	Very low	28.1	Very low	174 Å²	174	130.6 Å²	130.6	81%	0.806	69%	0.694	S	S	*	*			trans	174.9	139.3	130.9	-92.1	-64.3	0	0	0	112.2
479	Q	24.4	Very low	28.3	Very low	186 Å²	186	128.6 Å²	128.6	87%	0.869	69%	0.692	S	S	*	*			trans	44.4	108	153.1	-65.6	173.9	-23.4	0	0	120.1
480	S	25.6	Very low	28.7	Very low	112 Å²	112	128.2 Å²	128.2	78%	0.783	69%	0.687	S	S	*	*			trans	-144.1	145.6	146.8	61.7	0	0	0	0	111
481	S	25.3	Very low	28.9	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	69%	0.694	S	S	*	*			trans	-82.6	150.6	179.2	46.7	0	0	0	0	111.7	T483	S481-T483 PolarHBondContact O-N 2.71Å
482	F	24.9	Very low	29.4	Very low	207 Å²	207	126 Å²	126	91%	0.908	67%	0.671	S	S	*	*			trans	-66.3	100.6	177.1	-87	-88.7	0	0	0	111.6
483	T	25.5	Very low	29.3	Very low	94 Å²	94	127.9 Å²	127.9	58%	0.577	67%	0.673	S	S	*	*			trans	-112.8	136.6	158.8	57.7	0	0	0	0	109	S481 Y485	S481-T483 PolarHBondContact O-N 2.71Å; T483-Y485 PolarHBondContact O-N 3.22Å; T483-Y485 VanDerWaalsContact O-N 3.16Å
484	P	28.9	Very low	29.4	Very low	104 Å²	104	127.8 Å²	127.8	68%	0.675	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-62.5	120.1	177.6	25.6	-33.1	0	0	0	109.8	S486	P484-S486 PolarHBondContact O-N 3.07Å
485	Y	33	Very low	29.5	Very low	174 Å²	174	127.7 Å²	127.7	68%	0.682	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.8	-165	-73.1	-75.5	0	0	0	113.6	T483	T483-Y485 PolarHBondContact O-N 3.22Å; T483-Y485 VanDerWaalsContact O-N 3.16Å
486	S	31.6	Very low	29.3	Very low	79 Å²	79	124.9 Å²	124.9	55%	0.552	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-63	137.2	172.8	168.3	0	0	0	0	111.4	P484 S488 T489	P484-S486 PolarHBondContact O-N 3.07Å; S486-S488 WeakPolarHBondContact CB-OG 3.31Å; S486-S488 PolarHBondContact O-N 3.44Å; S486-S488 PolarHBondContact O-OG 3.24Å; S486-S488 PolarHBondContact OG-N 3.44Å; S486-S488 PolarHBondContact OG-OG 2.83Å; S486-T489 PolarHBondContact O-N 3.08Å; S486-T489 PolarHBondContact O-OG1 2.82Å
487	L	37.7	Very low	29.3	Very low	38 Å²	38	121.8 Å²	121.8	20%	0.199	66%	0.662	C	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	3.9	175.4	-125.1	74.1	0	0	0	114.7	T489 L524 Y582	L487-T489 VanDerWaalsContact C-N 3.3Å; L487-T489 PolarHBondContact O-N 3.41Å; L487-L524 HydrophobicContact CD2-CD1 3.57Å; L487-Y582 HydrophobicContact CD1-CD2 4.42Å
488	S	33.4	Very low	29.2	Very low	73 Å²	73	116.2 Å²	116.2	51%	0.51	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-29.2	173.1	43.4	0	0	0	0	113.7	S486 L490	S486-S488 WeakPolarHBondContact CB-OG 3.31Å; S486-S488 PolarHBondContact O-N 3.44Å; S486-S488 PolarHBondContact O-OG 3.24Å; S486-S488 PolarHBondContact OG-N 3.44Å; S486-S488 PolarHBondContact OG-OG 2.83Å; S488-L490 PolarHBondContact O-N 3.13Å
489	T	33.7	Very low	29.1	Very low	78 Å²	78	116.9 Å²	116.9	48%	0.479	66%	0.661	S	S	.	*			trans	-84.2	33.8	-162.9	-36.7	0	0	0	0	114.6	S486 L487 T491	S486-T489 PolarHBondContact O-N 3.08Å; S486-T489 PolarHBondContact O-OG1 2.82Å; L487-T489 VanDerWaalsContact C-N 3.3Å; L487-T489 PolarHBondContact O-N 3.41Å; T489-T491 VanDerWaalsContact C-N 3.28Å; T489-T491 PolarHBondContact O-N 3.45Å
490	L	34.7	Very low	29	Very low	65 Å²	65	117.6 Å²	117.6	34%	0.34	66%	0.664	S	S	.	*			trans	-73.7	76.7	167	-80.1	167.1	0	0	0	110.4	K400 S488	K400-L490 WeakPolarHBondContact CE-O 3.23Å; K400-L490 PolarHBondContact NZ-O 3.31Å; S488-L490 PolarHBondContact O-N 3.13Å
491	T	31.1	Very low	29.1	Very low	126 Å²	126	120.1 Å²	120.1	77%	0.773	67%	0.666	S	S	*	*			trans	-82.2	117.4	176.3	48.5	0	0	0	0	111.3	T489	T489-T491 VanDerWaalsContact C-N 3.28Å; T489-T491 PolarHBondContact O-N 3.45Å
492	M	34.6	Very low	29.1	Very low	54 Å²	54	123.3 Å²	123.3	27%	0.266	68%	0.675	S	S	.	*			trans	-119.6	124.7	179.8	-67.8	-87.3	-107.2	0	0	109.6	E404 R465	E404-M492 HydrophobicContact CG-CB 4.46Å; E404-M492 WeakPolarHBondContact OE1-CB 3.49Å; E404-M492 WeakPolarHBondContact OE2-CB 3.16Å; E404-M492 WeakPolarHBondContact OE2-CE 3.09Å; E404-M492 VanDerWaalsContact OE2-CG 3.24Å; E404-M492 WeakPolarHBondContact OE2-CG 3.03Å; R465-M492 HydrophobicContact CB-CE 4.4Å; R465-M492 HydrophobicContact CB-SD 3.96Å; R465-M492 HydrophobicContact CG-CE 3.92Å; R465-M492 HydrophobicContact CG-SD 3.97Å; R465-M492 VanDerWaalsContact NH1-CE 3.32Å; R465-M492 PolarHBondContact NH1-SD 2.92Å; R465-M492 VanDerWaalsContact NH1-SD 3.36Å
493	K	28.5	Very low	29.3	Very low	185 Å²	185	119.8 Å²	119.8	80%	0.804	67%	0.67	S	S	*	*			trans	-116.2	134.1	166.1	-79.3	-173.2	175.2	-178.6	0	109.7
494	S	27.1	Very low	29.6	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	68%	0.68	S	S	*	*			trans	-81.1	122.3	172	53	0	0	0	0	110.4
495	E	27.8	Very low	29.6	Very low	150 Å²	150	126.4 Å²	126.4	70%	0.701	69%	0.691	S	S	*	*			trans	-138.9	125.9	161.3	-79.5	-174.3	163.3	0	0	108.8	K468	K468-E495 PolarHBondContact NZ-O 3.11Å
496	S	25.1	Very low	29.6	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	70%	0.698	S	S	*	*			trans	-113	97.1	-174.4	52.6	0	0	0	0	110.2
497	T	28.2	Very low	29.6	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	71%	0.713	S	S	*	*			trans	-129	99	171.7	53.4	0	0	0	0	108.5
498	G	23.1	Very low	29.4	Very low	80 Å²	80	135.2 Å²	135.2	83%	0.825	74%	0.739	S	S	*	*			trans	-72.6	131.7	175.7	0	0	0	0	0	111.3
499	K	27	Very low	29.5	Very low	189 Å²	189	135.4 Å²	135.4	82%	0.822	73%	0.734	S	S	*	*			trans	-150.5	110.8	158.4	-103	177	-178.6	177.8	0	107.1
500	E	22.4	Very low	29.5	Very low	200 Å²	200	136.4 Å²	136.4	94%	0.935	74%	0.742	S	S	*	*			trans	-68.3	132.5	168.3	-65.4	177.6	122.2	0	0	108.6
501	M	27.5	Very low	29.7	Very low	166 Å²	166	138.4 Å²	138.4	82%	0.818	75%	0.745	S	S	*	*			trans	-132.1	140.1	166.9	-79.4	-169.1	165.2	0	0	108.6	T503	M501-T503 PolarHBondContact O-N 3.36Å
502	N	26.2	Very low	29.9	Very low	167 Å²	167	135.8 Å²	135.8	89%	0.893	73%	0.727	S	S	*	*			trans	-62.9	122.1	-162.1	-64.5	-45.2	0	0	0	112.8	T504	N502-T504 PolarHBondContact O-N 2.91Å
503	T	28.6	Very low	30.1	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	75%	0.751	S	S	*	*			trans	-75.1	105.8	173.3	53.9	0	0	0	0	110.8	M501	M501-T503 PolarHBondContact O-N 3.36Å
504	T	31.2	Very low	30.7	Very low	127 Å²	127	137.5 Å²	137.5	78%	0.779	75%	0.745	S	S	*	*			trans	-61.5	139.4	158.3	29.7	0	0	0	0	109.7	N502 Q506	N502-T504 PolarHBondContact O-N 2.91Å; T504-Q506 PolarHBondContact O-N 3.23Å
505	K	28.9	Very low	31.8	Very low	211 Å²	211	136.2 Å²	136.2	92%	0.917	73%	0.726	S	S	*	*			trans	-77.6	81.3	-175.7	-66.6	175.7	-177.8	168.8	0	111.4
506	Q	33.8	Very low	33.2	Very low	177 Å²	177	131.9 Å²	131.9	83%	0.827	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-71.1	145.1	157	-72	179.8	-31	0	0	109.2	T504	T504-Q506 PolarHBondContact O-N 3.23Å
507	Q	30.6	Very low	34.8	Very low	184 Å²	184	132.6 Å²	132.6	86%	0.86	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-65.8	145.2	167.5	-76.5	-179	-32.6	0	0	109	N509	Q507-N509 PolarHBondContact O-N 3.41Å
508	P	33	Very low	36.6	Very low	114 Å²	114	128.6 Å²	128.6	74%	0.74	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-60.8	130.5	174	27.3	-33.9	0	0	0	108.9
509	N	36.9	Very low	39	Very low	78 Å²	78	125.6 Å²	125.6	42%	0.417	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-68.2	127.1	177.8	-176.9	5.9	0	0	0	107.7	Q507 Y511 D512	Q507-N509 PolarHBondContact O-N 3.41Å; N509-Y511 PolarHBondContact O-N 2.99Å; N509-Y511 VanDerWaalsContact OD1-CD2 3.31Å; N509-Y511 WeakPolarHBondContact OD1-CD2 3.47Å; N509-D512 WeakPolarHBondContact CB-OD2 3.29Å; N509-D512 PolarHBondContact N-OD2 2.82Å; N509-D512 WeakPolarHBondContact O-CB 3.46Å; N509-D512 PolarHBondContact O-N 3.19Å
510	P	34.1	Very low	41.5	Very low	98 Å²	98	117 Å²	117	64%	0.636	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-56	-25.8	-179.2	19.8	-33.1	0	0	0	113.1
511	Y	38.3	Very low	44.3	Very low	107 Å²	107	107.6 Å²	107.6	42%	0.42	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-76.2	-13.7	175.3	-56.2	-77.2	0	0	0	114.7	N509 N513 L514 F515	N509-Y511 PolarHBondContact O-N 2.99Å; N509-Y511 VanDerWaalsContact OD1-CD2 3.31Å; N509-Y511 WeakPolarHBondContact OD1-CD2 3.47Å; Y511-N513 PolarHBondContact O-N 3.11Å; Y511-L514 HydrophobicContact CD1-CD1 3.84Å; Y511-L514 WeakPolarHBondContact O-CB 3.28Å; Y511-L514 PolarHBondContact O-N 2.94Å; Y511-F515 VanDerWaalsContact O-CD2 3.28Å; Y511-F515 WeakPolarHBondContact O-CD2 3.32Å; Y511-F515 VanDerWaalsContact O-CE2 3.29Å; Y511-F515 WeakPolarHBondContact O-CE2 3.31Å
512	D	35.3	Very low	47	Very low	72 Å²	72	101.6 Å²	101.6	39%	0.385	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-64.6	-26	178.6	-74.3	-30.4	0	0	0	112.7	N509 L514	N509-D512 WeakPolarHBondContact CB-OD2 3.29Å; N509-D512 PolarHBondContact N-OD2 2.82Å; N509-D512 WeakPolarHBondContact O-CB 3.46Å; N509-D512 PolarHBondContact O-N 3.19Å; D512-L514 VanDerWaalsContact C-N 3.34Å
513	N	37.5	Very low	49.6	Very low	145 Å²	145	99 Å²	99	78%	0.775	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-78.3	-13.9	175.5	-69.8	-26.1	0	0	0	113.7	Y511	Y511-N513 PolarHBondContact O-N 3.11Å
514	L	41.1	Very low	52.1	Low	129 Å²	129	92.9 Å²	92.9	68%	0.675	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-86.1	-11.3	-179.9	-81.3	161.8	0	0	0	113.3	Y511 D512	Y511-L514 HydrophobicContact CD1-CD1 3.84Å; Y511-L514 WeakPolarHBondContact O-CB 3.28Å; Y511-L514 PolarHBondContact O-N 2.94Å; D512-L514 VanDerWaalsContact C-N 3.34Å
515	F	50.9	Low	54.7	Low	83 Å²	83	86.9 Å²	86.9	36%	0.364	43%	0.433	S	S	.	.	S	Bend	trans	-85.3	126.4	175.1	-61.2	-75.4	0	0	0	110.8	Y511 Q517	Y511-F515 VanDerWaalsContact O-CD2 3.28Å; Y511-F515 WeakPolarHBondContact O-CD2 3.32Å; Y511-F515 VanDerWaalsContact O-CE2 3.29Å; Y511-F515 WeakPolarHBondContact O-CE2 3.31Å; F515-Q517 WeakPolarHBondContact O-CG 3.5Å; F515-Q517 PolarHBondContact O-N 2.83Å
516	I	57.1	Low	57.4	Low	58 Å²	58	78.5 Å²	78.5	30%	0.297	40%	0.398	S	S	.	.			trans	-62	109.4	166.7	-58.6	167.8	0	0	0	107.8	I464 S518 L580 F607	I464-I516 HydrophobicContact CD1-CB 4.21Å; I464-I516 HydrophobicContact CD1-CG2 3.72Å; I464-I516 WeakPolarHBondContact CD1-O 3.23Å; I516-S518 WeakPolarHBondContact CG2-O 3.43Å; I516-L580 HydrophobicContact CD1-CD1 4.13Å; I516-F607 HydrophobicContact CD1-CE1 3.66Å; I516-F607 HydrophobicContact CD1-CE2 4.19Å; I516-F607 HydrophobicContact CD1-CZ 3.35Å; I516-F607 HydrophobicContact CG1-CZ 4.16Å
517	Q	59.2	Low	59.6	Low	136 Å²	136	71.2 Å²	71.2	64%	0.636	37%	0.365	S	S	*	.			trans	-84.1	-21	177.8	-57.6	-173	8.9	0	0	112.2	I464 F515	I464-Q517 PolarHBondContact N-O 2.85Å; F515-Q517 WeakPolarHBondContact O-CG 3.5Å; F515-Q517 PolarHBondContact O-N 2.83Å
518	S	66.8	Low	62.1	Low	46 Å²	46	64.5 Å²	64.5	32%	0.322	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	147.8	175.7	69	0	0	0	0	112.8	T461 F462 I516	T461-S518 VanDerWaalsContact CB-OG 3.3Å; T461-S518 WeakPolarHBondContact CB-OG 3.42Å; T461-S518 VanDerWaalsContact OG1-CB 3.27Å; T461-S518 WeakPolarHBondContact OG1-CB 3.48Å; T461-S518 PolarHBondContact OG1-OG 2.91Å; F462-S518 CarbonylContact O-C 3.57Å; F462-S518 WeakPolarHBondContact O-CA 3.33Å; F462-S518 WeakPolarHBondContact O-CB 3.45Å; I516-S518 WeakPolarHBondContact CG2-O 3.43Å
519	I	72.2	Confident	64.6	Low	17 Å²	17	60.4 Å²	60.4	9%	0.087	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144	-178.5	-176.2	159.8	0	0	0	111.7	T461 F462 I464 L524 L580	T461-I519 CarbonylContact C-O 3.52Å; T461-I519 VanDerWaalsContact CA-O 3.31Å; T461-I519 WeakPolarHBondContact CA-O 3.21Å; T461-I519 WeakPolarHBondContact CB-O 3.44Å; F462-I519 HydrophobicContact CB-CG2 4.45Å; F462-I519 HydrophobicContact CD2-CG2 4.38Å; F462-I519 PolarHBondContact N-O 2.84Å; F462-I519 PolarHBondContact O-N 2.94Å; F462-I519 VanDerWaalsContact O-N 3.1Å; I464-I519 HydrophobicContact CD1-CB 4.18Å; I464-I519 HydrophobicContact CD1-CG2 4.14Å; I464-I519 HydrophobicContact CG1-CG2 4.19Å; I519-L524 HydrophobicContact CD1-CB 4.33Å; I519-L524 HydrophobicContact CD1-CD1 4.19Å; I519-L580 HydrophobicContact CD1-CB 4.3Å; I519-L580 HydrophobicContact CD1-CD2 3.65Å
520	D	79.3	Confident	66.8	Low	10 Å²	10	58.9 Å²	58.9	5%	0.053	30%	0.295	C	S	.	.			trans	-73.8	127.7	172.7	-167.1	-42.1	0	0	0	110.6	T461 L522 Y523 L524	T461-D520 HydrophobicContact CG2-CB 4.49Å; D520-L522 PolarHBondContact O-N 2.87Å; D520-L522 VanDerWaalsContact O-N 3.11Å; D520-L522 VanDerWaalsContact OD1-CB 3.27Å; D520-L522 WeakPolarHBondContact OD1-CB 3.28Å; D520-L522 VanDerWaalsContact OD1-CG 3.29Å; D520-L522 WeakPolarHBondContact OD1-CG 3.37Å; D520-L522 PolarHBondContact OD1-N 3.24Å; D520-Y523 HydrophobicContact CB-CD2 3.55Å; D520-Y523 HydrophobicContact CB-CE2 3.8Å; D520-Y523 HydrophobicContact CB-CG 4.28Å; D520-Y523 PolarHBondContact O-N 3.1Å; D520-L524 PolarHBondContact O-N 3.18Å
521	P	81.9	Confident	69	Low	1 Å²	1	55.4 Å²	55.4	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-43.5	-38.4	169.5	-2.6	-11.6	0	0	0	115.4	L394 I397 M398 F462 L524 A525	L394-P521 HydrophobicContact CD1-CB 3.89Å; I397-P521 HydrophobicContact CG2-CB 4.23Å; M398-P521 HydrophobicContact CG-CB 4.06Å; M398-P521 HydrophobicContact SD-CB 3.48Å; M398-P521 WeakPolarHBondContact SD-CB 3.25Å; M398-P521 HydrophobicContact SD-CG 3.33Å; M398-P521 WeakPolarHBondContact SD-CG 3.34Å; F462-P521 HydrophobicContact CD1-CG 4.39Å; F462-P521 HydrophobicContact CE1-CB 4.05Å; F462-P521 HydrophobicContact CE1-CG 3.58Å; F462-P521 HydrophobicContact CE2-CB 3.76Å; F462-P521 HydrophobicContact CE2-CG 4.08Å; F462-P521 HydrophobicContact CZ-CB 3.37Å; F462-P521 HydrophobicContact CZ-CG 3.46Å; F462-P521 VanDerWaalsContact CZ-CG 3.46Å; P521-L524 PolarHBondContact O-N 2.95Å; P521-A525 WeakPolarHBondContact O-CB 3.21Å; P521-A525 PolarHBondContact O-N 3.31Å
522	L	84.6	Confident	71.2	Confident	40 Å²	40	55.5 Å²	55.5	21%	0.209	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-45.9	-175.9	-64.4	169.5	0	0	0	110.9	Y390 L394 I456 D520 A525 I526	Y390-L522 VanDerWaalsContact OH-CD2 3.23Å; Y390-L522 WeakPolarHBondContact OH-CD2 3.44Å; L394-L522 HydrophobicContact CD1-CD2 4.04Å; L394-L522 HydrophobicContact CD2-CD2 3.77Å; I456-L522 HydrophobicContact CG2-CD1 4.23Å; I456-L522 HydrophobicContact CG2-CD2 3.9Å; I456-L522 HydrophobicContact CG2-CG 4.33Å; D520-L522 PolarHBondContact O-N 2.87Å; D520-L522 VanDerWaalsContact O-N 3.11Å; D520-L522 VanDerWaalsContact OD1-CB 3.27Å; D520-L522 WeakPolarHBondContact OD1-CB 3.28Å; D520-L522 VanDerWaalsContact OD1-CG 3.29Å; D520-L522 WeakPolarHBondContact OD1-CG 3.37Å; D520-L522 PolarHBondContact OD1-N 3.24Å; L522-A525 PolarHBondContact O-N 2.98Å; L522-I526 VanDerWaalsContact O-CG1 3.28Å; L522-I526 WeakPolarHBondContact O-CG1 3.49Å; L522-I526 PolarHBondContact O-N 2.82Å; L522-I526 VanDerWaalsContact O-N 3.16Å
523	Y	81.3	Confident	73.5	Confident	112 Å²	112	53.2 Å²	53.2	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-44.9	176.1	-56.6	-40.8	0	0	0	111	D520 A525 I526 D527	D520-Y523 HydrophobicContact CB-CD2 3.55Å; D520-Y523 HydrophobicContact CB-CE2 3.8Å; D520-Y523 HydrophobicContact CB-CG 4.28Å; D520-Y523 PolarHBondContact O-N 3.1Å; Y523-A525 VanDerWaalsContact C-N 3.25Å; Y523-A525 PolarHBondContact O-N 3.05Å; Y523-I526 PolarHBondContact O-N 3.06Å; Y523-D527 PolarHBondContact O-N 3.11Å
524	L	80.5	Confident	75.5	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-32	179.7	-168.1	66.6	0	0	0	113.2	I397 F462 L487 I519 D520 P521 K528	I397-L524 HydrophobicContact CD1-CD2 4.43Å; I397-L524 HydrophobicContact CD1-CG 4.25Å; I397-L524 HydrophobicContact CG2-CD2 4.04Å; F462-L524 HydrophobicContact CD2-CD2 4.47Å; F462-L524 HydrophobicContact CE2-CD2 4.36Å; L487-L524 HydrophobicContact CD2-CD1 3.57Å; I519-L524 HydrophobicContact CD1-CB 4.33Å; I519-L524 HydrophobicContact CD1-CD1 4.19Å; D520-L524 PolarHBondContact O-N 3.18Å; P521-L524 PolarHBondContact O-N 2.95Å; L524-K528 WeakPolarHBondContact O-CG 3.38Å
525	A	85.4	Confident	77.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.5	-35.2	173.2	0	0	0	0	0	112.6	Y390 E393 L394 I397 P521 L522 Y523 I529	Y390-A525 HydrophobicContact CD2-CB 4.43Å; Y390-A525 HydrophobicContact CE2-CB 3.7Å; E393-A525 HydrophobicContact CB-CB 4.24Å; L394-A525 HydrophobicContact CB-CB 3.85Å; L394-A525 HydrophobicContact CD1-CB 3.94Å; I397-A525 HydrophobicContact CD1-CB 4.02Å; P521-A525 WeakPolarHBondContact O-CB 3.21Å; P521-A525 PolarHBondContact O-N 3.31Å; L522-A525 PolarHBondContact O-N 2.98Å; Y523-A525 VanDerWaalsContact C-N 3.25Å; Y523-A525 PolarHBondContact O-N 3.05Å; A525-I529 WeakPolarHBondContact O-CD1 3.36Å; A525-I529 WeakPolarHBondContact O-CG1 3.42Å
526	I	85.4	Confident	78.7	Confident	35 Å²	35	48.7 Å²	48.7	18%	0.179	23%	0.229	C	C	.	.	H	α-helix	trans	-72	-48.7	178.3	-71.5	176.2	0	0	0	110.8	Y8 Y390 L522 Y523 K528 I529 M530	Y8-I526 HydrophobicContact CE2-CD1 4.02Å; Y8-I526 WeakPolarHBondContact OH-CD1 3.22Å; Y390-I526 HydrophobicContact CD2-CG1 4.36Å; Y390-I526 HydrophobicContact CE2-CD1 4.35Å; Y390-I526 HydrophobicContact CE2-CG1 3.6Å; L522-I526 VanDerWaalsContact O-CG1 3.28Å; L522-I526 WeakPolarHBondContact O-CG1 3.49Å; L522-I526 PolarHBondContact O-N 2.82Å; L522-I526 VanDerWaalsContact O-N 3.16Å; Y523-I526 PolarHBondContact O-N 3.06Å; I526-K528 VanDerWaalsContact C-N 3.26Å; I526-K528 PolarHBondContact O-N 2.79Å; I526-I529 PolarHBondContact O-N 2.86Å; I526-M530 HydrophobicContact CG2-CG 4.15Å; I526-M530 HydrophobicContact CG2-SD 3.39Å; I526-M530 WeakPolarHBondContact CG2-SD 3.43Å; I526-M530 WeakPolarHBondContact O-CG 3.4Å; I526-M530 PolarHBondContact O-N 3.2Å
527	D	81	Confident	79.9	Confident	25 Å²	25	46.4 Å²	46.4	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-50.2	-45.2	176.2	-80.6	16	0	0	0	111.8	Y523 I529 M530 L531 M579 L580	Y523-D527 PolarHBondContact O-N 3.11Å; D527-I529 VanDerWaalsContact C-N 3.34Å; D527-I529 PolarHBondContact O-N 3.01Å; D527-M530 PolarHBondContact O-N 3.32Å; D527-L531 WeakPolarHBondContact O-CB 3.44Å; D527-L531 WeakPolarHBondContact O-CG 3.48Å; D527-L531 PolarHBondContact O-N 3.47Å; D527-M579 HydrophobicContact CB-CB 4.45Å; D527-M579 HydrophobicContact CB-CG 4.14Å; D527-M579 HydrophobicContact CB-SD 3.92Å; D527-M579 WeakPolarHBondContact OD2-CB 3.38Å; D527-L580 PolarHBondContact OD2-N 2.77Å
528	K	82.2	Confident	80.8	Confident	43 Å²	43	40.3 Å²	40.3	19%	0.187	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-36.4	177.4	-77.2	-175.3	179.4	-179.7	0	114.2	E393 I397 L524 I526 K532	E393-K528 HydrophobicContact CG-CB 4.49Å; E393-K528 HydrophobicContact CG-CD 4.46Å; E393-K528 WeakPolarHBondContact OE2-CD 3.46Å; E393-K528 IonicContact OE2-NZ 2.8Å; E393-K528 PolarHBondContact OE2-NZ 3.4Å; I397-K528 HydrophobicContact CD1-CD 4.1Å; L524-K528 WeakPolarHBondContact O-CG 3.38Å; I526-K528 VanDerWaalsContact C-N 3.26Å; I526-K528 PolarHBondContact O-N 2.79Å; K528-K532 WeakPolarHBondContact O-CG 3.39Å; K528-K532 PolarHBondContact O-N 3.35Å
529	I	85.8	Confident	81.5	Confident	28 Å²	28	38.7 Å²	38.7	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-75.4	-40	179	-67.5	165.8	0	0	0	109.4	Y390 E393 A525 I526 D527 L531 K532 I533	Y390-I529 HydrophobicContact CD2-CD1 3.66Å; Y390-I529 HydrophobicContact CG-CD1 4.44Å; E393-I529 HydrophobicContact CB-CD1 4.45Å; E393-I529 HydrophobicContact CG-CD1 4.32Å; E393-I529 HydrophobicContact CG-CG1 4.01Å; A525-I529 WeakPolarHBondContact O-CD1 3.36Å; A525-I529 WeakPolarHBondContact O-CG1 3.42Å; I526-I529 PolarHBondContact O-N 2.86Å; D527-I529 VanDerWaalsContact C-N 3.34Å; D527-I529 PolarHBondContact O-N 3.01Å; I529-L531 VanDerWaalsContact C-N 3.34Å; I529-L531 PolarHBondContact O-N 3.27Å; I529-K532 WeakPolarHBondContact O-CB 3.35Å; I529-K532 PolarHBondContact O-N 2.96Å; I529-K532 VanDerWaalsContact O-N 3.15Å; I529-I533 HydrophobicContact CG2-CD1 3.78Å; I529-I533 HydrophobicContact CG2-CG1 4.4Å; I529-I533 VanDerWaalsContact O-CG1 3.31Å; I529-I533 WeakPolarHBondContact O-CG1 3.41Å; I529-I533 PolarHBondContact O-N 3.08Å
530	M	82.8	Confident	81.9	Confident	45 Å²	45	38.3 Å²	38.3	22%	0.222	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-39.6	175	-64.5	176.2	79.8	0	0	111.1	I526 D527 K532 I533 M534 R577 M579	I526-M530 HydrophobicContact CG2-CG 4.15Å; I526-M530 HydrophobicContact CG2-SD 3.39Å; I526-M530 WeakPolarHBondContact CG2-SD 3.43Å; I526-M530 WeakPolarHBondContact O-CG 3.4Å; I526-M530 PolarHBondContact O-N 3.2Å; D527-M530 PolarHBondContact O-N 3.32Å; M530-K532 VanDerWaalsContact C-N 3.34Å; M530-K532 PolarHBondContact O-N 3.28Å; M530-I533 PolarHBondContact O-N 3.21Å; M530-M534 VanDerWaalsContact O-CB 3.25Å; M530-M534 WeakPolarHBondContact O-CB 3.5Å; M530-M534 WeakPolarHBondContact O-CG 3.29Å; M530-M534 PolarHBondContact O-N 3.13Å; M530-R577 HydrophobicContact CE-CG 3.95Å; M530-M579 HydrophobicContact CB-SD 4.31Å
531	L	81.3	Confident	82.1	Confident	25 Å²	25	39 Å²	39	13%	0.131	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-40.5	169.8	-82.6	167.5	0	0	0	113.4	D527 I529 R535 M579 Y610	D527-L531 WeakPolarHBondContact O-CB 3.44Å; D527-L531 WeakPolarHBondContact O-CG 3.48Å; D527-L531 PolarHBondContact O-N 3.47Å; I529-L531 VanDerWaalsContact C-N 3.34Å; I529-L531 PolarHBondContact O-N 3.27Å; L531-R535 WeakPolarHBondContact O-CD 3.48Å; L531-R535 WeakPolarHBondContact O-CG 3.42Å; L531-R535 PolarHBondContact O-N 2.99Å; L531-M579 HydrophobicContact CD1-CE 4.49Å; L531-M579 HydrophobicContact CD2-CE 3.52Å; L531-M579 HydrophobicContact CG-CE 3.59Å; L531-M579 HydrophobicContact CG-SD 3.95Å; L531-Y610 HydrophobicContact CD2-CD1 3.72Å; L531-Y610 HydrophobicContact CD2-CD2 4.04Å; L531-Y610 HydrophobicContact CD2-CE1 3.65Å; L531-Y610 HydrophobicContact CD2-CE2 3.96Å; L531-Y610 HydrophobicContact CD2-CG 3.9Å
532	K	83.3	Confident	81.9	Confident	109 Å²	109	40.6 Å²	40.6	47%	0.474	19%	0.189	S	C	.	.	H	α-helix	trans	-67.3	-48.9	175.9	-73.3	169.4	173.1	-179.4	0	111.1	E393 K528 I529 M530 R535 E536	E393-K532 IonicContact OE1-NZ 2.77Å; E393-K532 PolarHBondContact OE1-NZ 3.08Å; K528-K532 WeakPolarHBondContact O-CG 3.39Å; K528-K532 PolarHBondContact O-N 3.35Å; I529-K532 WeakPolarHBondContact O-CB 3.35Å; I529-K532 PolarHBondContact O-N 2.96Å; I529-K532 VanDerWaalsContact O-N 3.15Å; M530-K532 VanDerWaalsContact C-N 3.34Å; M530-K532 PolarHBondContact O-N 3.28Å; K532-R535 PolarHBondContact O-N 3.24Å; K532-E536 PolarHBondContact O-N 3.45Å
533	I	83.6	Confident	81.5	Confident	25 Å²	25	39.7 Å²	39.7	13%	0.128	19%	0.187	C	C	.	.	H	α-helix	trans	-57.7	-54.6	177.6	-68.5	168.7	0	0	0	109.8	N292 Y385 I529 M530 R535 E536 S537	N292-I533 PolarHBondContact ND2-O 3.34Å; N292-I533 VanDerWaalsContact ND2-O 3.1Å; N292-I533 WeakPolarHBondContact OD1-CG2 3.19Å; N292-I533 PolarHBondContact OD1-O 2.92Å; N292-I533 VanDerWaalsContact OD1-O 3.05Å; Y385-I533 HydrophobicContact CD2-CD1 3.67Å; Y385-I533 HydrophobicContact CE2-CD1 3.63Å; I529-I533 HydrophobicContact CG2-CD1 3.78Å; I529-I533 HydrophobicContact CG2-CG1 4.4Å; I529-I533 VanDerWaalsContact O-CG1 3.31Å; I529-I533 WeakPolarHBondContact O-CG1 3.41Å; I529-I533 PolarHBondContact O-N 3.08Å; M530-I533 PolarHBondContact O-N 3.21Å; I533-R535 VanDerWaalsContact C-N 3.26Å; I533-R535 PolarHBondContact O-N 2.84Å; I533-E536 CarbonylContact O-C 3.55Å; I533-E536 PolarHBondContact O-N 2.94Å; I533-E536 VanDerWaalsContact O-N 3.14Å; I533-S537 WeakPolarHBondContact O-CB 3.45Å; I533-S537 PolarHBondContact O-N 3.43Å; I533-S537 PolarHBondContact O-OG 3.25Å
534	M	80.6	Confident	81	Confident	16 Å²	16	41 Å²	41	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-23	-176.4	-71.5	178.9	74.8	0	0	114.9	M530 A575 R577 M579 Y610 N615	M530-M534 VanDerWaalsContact O-CB 3.25Å; M530-M534 WeakPolarHBondContact O-CB 3.5Å; M530-M534 WeakPolarHBondContact O-CG 3.29Å; M530-M534 PolarHBondContact O-N 3.13Å; M534-A575 WeakPolarHBondContact CE-O 3.3Å; M534-R577 HydrophobicContact CE-CB 4.16Å; M534-R577 HydrophobicContact CE-CG 4.08Å; M534-R577 HydrophobicContact SD-CB 3.72Å; M534-R577 HydrophobicContact SD-CG 3.42Å; M534-R577 WeakPolarHBondContact SD-CG 3.45Å; M534-M579 HydrophobicContact SD-CE 4.28Å; M534-Y610 WeakPolarHBondContact CE-O 3.49Å; M534-N615 PolarHBondContact O-ND2 3.03Å
535	R	80	Confident	80.6	Confident	112 Å²	112	44.2 Å²	44.2	42%	0.423	21%	0.214	S	C	.	.	H	α-helix	trans	-71	-56.2	170.2	-77.6	167.3	-172.7	-156.5	-0.7	110.3	L531 K532 I533 S537 N615 S622 A624	L531-R535 WeakPolarHBondContact O-CD 3.48Å; L531-R535 WeakPolarHBondContact O-CG 3.42Å; L531-R535 PolarHBondContact O-N 2.99Å; K532-R535 PolarHBondContact O-N 3.24Å; I533-R535 VanDerWaalsContact C-N 3.26Å; I533-R535 PolarHBondContact O-N 2.84Å; R535-S537 PolarHBondContact O-N 2.93Å; R535-N615 PolarHBondContact O-ND2 2.79Å; R535-N615 VanDerWaalsContact O-ND2 3.17Å; R535-S622 VanDerWaalsContact C-OG 3.28Å; R535-S622 WeakPolarHBondContact CB-OG 3.38Å; R535-S622 WeakPolarHBondContact O-CB 3.31Å; R535-S622 PolarHBondContact O-OG 3.41Å; R535-S622 VanDerWaalsContact O-OG 3.05Å; R535-A624 HydrophobicContact CG-CB 3.63Å
536	E	78.5	Confident	80	Confident	133 Å²	133	44.2 Å²	44.2	62%	0.621	21%	0.214	S	C	*	.	H	α-helix	trans	-72.8	-11.3	-179.5	-69.1	171.1	-167.3	0	0	114	N292 K532 I533	N292-E536 WeakPolarHBondContact ND2-CB 3.32Å; K532-E536 PolarHBondContact O-N 3.45Å; I533-E536 CarbonylContact O-C 3.55Å; I533-E536 PolarHBondContact O-N 2.94Å; I533-E536 VanDerWaalsContact O-N 3.14Å
537	S	81.8	Confident	79.2	Confident	10 Å²	10	46.5 Å²	46.5	7%	0.07	23%	0.226	C	C	.	.	S	Bend	trans	-62.1	143.2	178.1	-78	0	0	0	0	112.6	N292 I533 R535 N615	N292-S537 WeakPolarHBondContact OD1-CA 3.41Å; N292-S537 WeakPolarHBondContact OD1-CB 3.18Å; N292-S537 PolarHBondContact OD1-N 3.43Å; N292-S537 PolarHBondContact OD1-OG 2.93Å; I533-S537 WeakPolarHBondContact O-CB 3.45Å; I533-S537 PolarHBondContact O-N 3.43Å; I533-S537 PolarHBondContact O-OG 3.25Å; R535-S537 PolarHBondContact O-N 2.93Å; S537-N615 PolarHBondContact O-ND2 3.15Å
538	C	79.4	Confident	78.6	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.061	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-71.8	142.6	167.5	-160	0	0	0	0	110.1	Q272 Q286	Q272-C538 HydrophobicContact CG-CB 4.21Å; Q272-C538 VanDerWaalsContact CG-SG 3.56Å; Q286-C538 PolarHBondContact NE2-O 3.13Å
539	A	81.1	Confident	77.8	Confident	11 Å²	11	58.4 Å²	58.4	9%	0.091	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-60.9	129.2	176.1	0	0	0	0	0	111.1	R279 E541 S612 N615	R279-A539 WeakPolarHBondContact CD-O 3.01Å; R279-A539 WeakPolarHBondContact CG-O 3.4Å; A539-E541 PolarHBondContact O-N 3.4Å; A539-S612 WeakPolarHBondContact CA-O 3.3Å; A539-S612 WeakPolarHBondContact CB-O 3.45Å; A539-N615 HydrophobicContact CB-CB 4.25Å; A539-N615 WeakPolarHBondContact CB-O 3.26Å
540	P	80.9	Confident	76.9	Confident	10 Å²	10	57.8 Å²	57.8	7%	0.065	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-54.9	122.9	170.6	-25.4	32.6	0	0	0	111.5	R572 A575 L613	P540-R572 HydrophobicContact CB-CG 4.3Å; P540-A575 HydrophobicContact CG-CB 3.38Å; P540-L613 HydrophobicContact CB-CD2 4.12Å; P540-L613 HydrophobicContact CG-CD2 3.97Å
541	E	82.1	Confident	75.8	Confident	24 Å²	24	60.7 Å²	60.7	11%	0.112	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-84.6	129.5	168.3	-167.3	62.9	-127.6	0	0	109	R276 R279 F280 A539 R572	R276-E541 VanDerWaalsContact CG-CD 3.46Å; R276-E541 HydrophobicContact CG-CG 3.59Å; R276-E541 IonicContact CZ-OE1 2.71Å; R276-E541 VanDerWaalsContact NE-CD 3.35Å; R276-E541 IonicContact NE-OE1 3.13Å; R276-E541 PolarHBondContact NE-OE1 2.86Å; R276-E541 IonicContact NH2-OE1 3.92Å; R276-E541 PolarHBondContact NH2-OE1 3.22Å; R279-E541 HydrophobicContact CB-CB 4.09Å; R279-E541 WeakPolarHBondContact CD-OE2 3.38Å; R279-E541 HydrophobicContact CG-CB 4.19Å; R279-E541 IonicContact CZ-OE2 2.7Å; R279-E541 IonicContact NE-OE2 2.66Å; R279-E541 IonicContact NH1-OE2 2.62Å; R279-E541 PolarHBondContact NH1-OE2 2.88Å; F280-E541 HydrophobicContact CB-CB 4.08Å; F280-E541 HydrophobicContact CB-CG 4.33Å; F280-E541 WeakPolarHBondContact CD2-O 3.42Å; A539-E541 PolarHBondContact O-N 3.4Å; E541-R572 PolarHBondContact O-NH1 3.28Å
542	L	78.2	Confident	74.5	Confident	34 Å²	34	67.8 Å²	67.8	18%	0.178	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-82.4	145.4	177.8	-62.2	-178.5	0	0	0	111.3	R276 E546 L547 I571 R572	R276-L542 PolarHBondContact NH2-O 3.49Å; L542-E546 WeakPolarHBondContact CA-OE2 3.27Å; L542-E546 HydrophobicContact CB-CB 3.98Å; L542-E546 HydrophobicContact CD2-CB 4.24Å; L542-L547 HydrophobicContact CD1-CD1 4.22Å; L542-I571 HydrophobicContact CD2-CG2 3.78Å; L542-R572 HydrophobicContact CD2-CG 3.52Å
543	S	75.8	Confident	72.8	Confident	22 Å²	22	70.2 Å²	70.2	15%	0.154	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-67	166.8	166.9	83.4	0	0	0	0	111.4	D545 E546 L547	S543-D545 VanDerWaalsContact C-N 3.31Å; S543-D545 PolarHBondContact O-N 2.79Å; S543-D545 PolarHBondContact OG-N 3.17Å; S543-E546 PolarHBondContact N-OE2 2.9Å; S543-E546 PolarHBondContact O-N 3.41Å; S543-E546 WeakPolarHBondContact OG-CG 3.36Å; S543-E546 PolarHBondContact OG-N 3.33Å; S543-L547 WeakPolarHBondContact O-CB 3.49Å; S543-L547 PolarHBondContact O-N 3.15Å
544	E	71.8	Confident	70.6	Confident	140 Å²	140	78.4 Å²	78.4	65%	0.654	37%	0.368	S	S	*	.	H	α-helix	trans	-63.8	-38.2	174.4	-66.2	179.7	175.3	0	0	111.1	L547 I548	E544-L547 PolarHBondContact O-N 3.34Å; E544-I548 WeakPolarHBondContact O-CB 2.93Å; E544-I548 WeakPolarHBondContact O-CD1 3.41Å; E544-I548 WeakPolarHBondContact O-CG1 3.39Å; E544-I548 PolarHBondContact O-N 2.96Å
545	D	70.9	Confident	68.5	Low	72 Å²	72	79.9 Å²	79.9	39%	0.385	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-42.1	174.1	-52.2	-67.3	0	0	0	112.8	S543 L547 R549	S543-D545 VanDerWaalsContact C-N 3.31Å; S543-D545 PolarHBondContact O-N 2.79Å; S543-D545 PolarHBondContact OG-N 3.17Å; D545-L547 VanDerWaalsContact C-N 3.33Å; D545-R549 WeakPolarHBondContact O-CB 3.48Å; D545-R549 VanDerWaalsContact O-CG 3.28Å; D545-R549 WeakPolarHBondContact O-CG 3.24Å; D545-R549 PolarHBondContact O-N 2.98Å; D545-R549 VanDerWaalsContact O-N 3.1Å
546	E	73	Confident	66.6	Low	1 Å²	1	80.2 Å²	80.2	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-63	-41	174.4	-74.4	-176.3	127.6	0	0	111	L167 L542 S543 S550 I571 R572	L167-E546 HydrophobicContact CD1-CG 3.84Å; L542-E546 WeakPolarHBondContact CA-OE2 3.27Å; L542-E546 HydrophobicContact CB-CB 3.98Å; L542-E546 HydrophobicContact CD2-CB 4.24Å; S543-E546 PolarHBondContact N-OE2 2.9Å; S543-E546 PolarHBondContact O-N 3.41Å; S543-E546 WeakPolarHBondContact OG-CG 3.36Å; S543-E546 PolarHBondContact OG-N 3.33Å; E546-S550 WeakPolarHBondContact O-CB 3.37Å; E546-S550 PolarHBondContact O-N 3.48Å; E546-I571 HydrophobicContact CB-CG2 4.45Å; E546-I571 HydrophobicContact CG-CG2 4.42Å; E546-R572 VanDerWaalsContact OE1-CD 3.27Å; E546-R572 WeakPolarHBondContact OE1-CD 3.45Å; E546-R572 IonicContact OE2-NH1 2.72Å; E546-R572 PolarHBondContact OE2-NH1 3.02Å
547	L	70	Confident	65	Low	82 Å²	82	78.3 Å²	78.3	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-68.3	-44.9	179.7	-161.3	79.9	0	0	0	111.7	L542 S543 E544 D545 R549 S550	L542-L547 HydrophobicContact CD1-CD1 4.22Å; S543-L547 WeakPolarHBondContact O-CB 3.49Å; S543-L547 PolarHBondContact O-N 3.15Å; E544-L547 PolarHBondContact O-N 3.34Å; D545-L547 VanDerWaalsContact C-N 3.33Å; L547-R549 VanDerWaalsContact C-N 3.29Å; L547-R549 PolarHBondContact O-N 3.23Å; L547-S550 WeakPolarHBondContact O-CB 3.41Å; L547-S550 PolarHBondContact O-N 3.06Å; L547-S550 VanDerWaalsContact O-N 3.08Å; L547-S550 PolarHBondContact O-OG 2.86Å
548	I	66.8	Low	63.4	Low	128 Å²	128	86.3 Å²	86.3	66%	0.656	44%	0.435	S	S	*	.	H	α-helix	trans	-61.8	-37	177.9	-72.3	163.9	0	0	0	111.4	E544 S550	E544-I548 WeakPolarHBondContact O-CB 2.93Å; E544-I548 WeakPolarHBondContact O-CD1 3.41Å; E544-I548 WeakPolarHBondContact O-CG1 3.39Å; E544-I548 PolarHBondContact O-N 2.96Å; I548-S550 VanDerWaalsContact C-N 3.3Å
549	R	66.3	Low	61.9	Low	190 Å²	190	90.5 Å²	90.5	72%	0.717	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	2.3	176.7	-63.5	176.6	-171.7	-128.8	5.6	113.6	D545 L547	D545-R549 WeakPolarHBondContact O-CB 3.48Å; D545-R549 VanDerWaalsContact O-CG 3.28Å; D545-R549 WeakPolarHBondContact O-CG 3.24Å; D545-R549 PolarHBondContact O-N 2.98Å; D545-R549 VanDerWaalsContact O-N 3.1Å; L547-R549 VanDerWaalsContact C-N 3.29Å; L547-R549 PolarHBondContact O-N 3.23Å
550	S	67	Low	60.5	Low	15 Å²	15	94.8 Å²	94.8	11%	0.105	49%	0.485	C	S	.	.	S	Bend	trans	-94.5	148.4	-179.8	80.1	0	0	0	0	112.8	E546 L547 I548 F552	E546-S550 WeakPolarHBondContact O-CB 3.37Å; E546-S550 PolarHBondContact O-N 3.48Å; L547-S550 WeakPolarHBondContact O-CB 3.41Å; L547-S550 PolarHBondContact O-N 3.06Å; L547-S550 VanDerWaalsContact O-N 3.08Å; L547-S550 PolarHBondContact O-OG 2.86Å; I548-S550 VanDerWaalsContact C-N 3.3Å; S550-F552 PolarHBondContact O-N 2.68Å; S550-F552 VanDerWaalsContact O-N 3.16Å
551	I	60.2	Low	59.4	Low	106 Å²	106	101 Å²	101	54%	0.544	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.1	176.8	-55.4	156	0	0	0	111.5	K553 L562	I551-K553 PolarHBondContact O-N 3.09Å; I551-L562 HydrophobicContact CD1-CD1 3.73Å; I551-L562 HydrophobicContact CD1-CD2 3.88Å; I551-L562 HydrophobicContact CD1-CG 3.83Å
552	F	53.5	Low	58.6	Low	175 Å²	175	104.6 Å²	104.6	77%	0.768	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	11	-177.8	-71.2	-73	0	0	0	115	S550 Q554	S550-F552 PolarHBondContact O-N 2.68Å; S550-F552 VanDerWaalsContact O-N 3.16Å; F552-Q554 VanDerWaalsContact C-N 3.32Å; F552-Q554 PolarHBondContact O-N 3.34Å
553	K	47.7	Very low	58.1	Low	159 Å²	159	106.8 Å²	106.8	69%	0.691	55%	0.548	S	S	*	.			trans	-70.5	86	174.2	-163.9	-177.3	-178.1	-168.6	0	110.5	I551 G555	I551-K553 PolarHBondContact O-N 3.09Å; K553-G555 PolarHBondContact O-N 3.11Å
554	Q	36.3	Very low	58	Low	197 Å²	197	112.1 Å²	112.1	92%	0.921	57%	0.574	S	S	*	*			trans	-60.3	100.4	179.4	-68.7	-179.2	-16.3	0	0	111.6	F552	F552-Q554 VanDerWaalsContact C-N 3.32Å; F552-Q554 PolarHBondContact O-N 3.34Å
555	G	37.7	Very low	58.2	Low	48 Å²	48	113.7 Å²	113.7	50%	0.495	58%	0.58	S	S	.	*	S	Bend	trans	166.5	105.9	173.6	0	0	0	0	0	113.7	K553 D557	K553-G555 PolarHBondContact O-N 3.11Å; G555-D557 VanDerWaalsContact C-N 3.26Å; G555-D557 PolarHBondContact O-N 2.95Å
556	S	40.8	Very low	58.2	Low	118 Å²	118	112.3 Å²	112.3	83%	0.825	58%	0.577	S	S	*	*	S	Bend	trans	51.2	-31.8	157.3	55	0	0	0	0	122.6	K558	S556-K558 PolarHBondContact O-N 3.38Å; S556-K558 VanDerWaalsContact O-N 3.13Å
557	D	44.6	Very low	58.1	Low	93 Å²	93	122.7 Å²	122.7	50%	0.497	62%	0.622	S	S	.	*			trans	-82.6	101.6	-160.2	-69.9	-4.8	0	0	0	112.8	G555 S559 N560	G555-D557 VanDerWaalsContact C-N 3.26Å; G555-D557 PolarHBondContact O-N 2.95Å; D557-S559 PolarHBondContact O-N 3.33Å; D557-N560 PolarHBondContact O-N 2.89Å
558	K	47.3	Very low	58.1	Low	178 Å²	178	123.7 Å²	123.7	77%	0.774	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-53.9	-23	174	-71.9	-173.7	176.8	-177.4	0	113.7	S556 N560 Q561	S556-K558 PolarHBondContact O-N 3.38Å; S556-K558 VanDerWaalsContact O-N 3.13Å; K558-N560 PolarHBondContact O-N 3.37Å; K558-Q561 PolarHBondContact O-N 2.99Å
559	S	47.6	Very low	58.4	Low	98 Å²	98	125.4 Å²	125.4	69%	0.685	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-64.5	-19.3	179.6	50.3	0	0	0	0	114.7	D557	D557-S559 PolarHBondContact O-N 3.33Å
560	N	52.5	Low	58.7	Low	100 Å²	100	121.3 Å²	121.3	54%	0.535	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-98	13.8	-180	-70.3	-46.1	0	0	0	114	D557 K558	D557-N560 PolarHBondContact O-N 2.89Å; K558-N560 PolarHBondContact O-N 3.37Å
561	Q	57.3	Low	59	Low	142 Å²	142	122.5 Å²	122.5	66%	0.664	62%	0.621	S	S	*	*	S	Bend	trans	-70.2	137.2	170.1	-69.1	-169	-5	0	0	110.8	K558 T563	K558-Q561 PolarHBondContact O-N 2.99Å; Q561-T563 PolarHBondContact O-N 3.44Å
562	L	64.7	Low	59.7	Low	98 Å²	98	117.6 Å²	117.6	51%	0.513	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-67.7	118	174.4	-74.2	179.8	0	0	0	110.4	I551 I568	I551-L562 HydrophobicContact CD1-CD1 3.73Å; I551-L562 HydrophobicContact CD1-CD2 3.88Å; I551-L562 HydrophobicContact CD1-CG 3.83Å; L562-I568 HydrophobicContact CD1-CD1 3.83Å; L562-I568 HydrophobicContact CD2-CD1 3.72Å; L562-I568 HydrophobicContact CD2-CG1 3.79Å; L562-I568 HydrophobicContact CG-CD1 4.33Å
563	T	68.4	Low	60.6	Low	80 Å²	80	111.5 Å²	111.5	49%	0.491	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-99.9	167.1	171.4	70.3	0	0	0	0	110.2	Q561 H565 S566	Q561-T563 PolarHBondContact O-N 3.44Å; T563-H565 PolarHBondContact O-N 3.36Å; T563-H565 VanDerWaalsContact O-N 3.17Å; T563-H565 PolarHBondContact OG1-N 2.98Å; T563-S566 PolarHBondContact N-OG 2.75Å; T563-S566 WeakPolarHBondContact O-CB 3.3Å; T563-S566 PolarHBondContact O-N 3.08Å; T563-S566 PolarHBondContact O-OG 3.1Å; T563-S566 PolarHBondContact OG1-N 3.32Å; T563-S566 PolarHBondContact OG1-OG 3.42Å
564	I	74.7	Confident	61.9	Low	135 Å²	135	104.7 Å²	104.7	69%	0.692	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.6	172.9	-60.5	173.6	0	0	0	111.4
565	H	74.7	Confident	63.8	Low	172 Å²	172	95.5 Å²	95.5	80%	0.796	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.4	178.5	-51.3	-54.5	0	0	0	114.1	T563 K567	T563-H565 PolarHBondContact O-N 3.36Å; T563-H565 VanDerWaalsContact O-N 3.17Å; T563-H565 PolarHBondContact OG1-N 2.98Å; H565-K567 PolarHBondContact O-N 2.99Å
566	S	70.7	Confident	65.7	Low	44 Å²	44	94.7 Å²	94.7	31%	0.308	49%	0.488	S	S	.	.			trans	-73.4	123.3	-178.4	-64.5	0	0	0	0	111.4	T563 I568	T563-S566 PolarHBondContact N-OG 2.75Å; T563-S566 WeakPolarHBondContact O-CB 3.3Å; T563-S566 PolarHBondContact O-N 3.08Å; T563-S566 PolarHBondContact O-OG 3.1Å; T563-S566 PolarHBondContact OG1-N 3.32Å; T563-S566 PolarHBondContact OG1-OG 3.42Å; S566-I568 PolarHBondContact O-N 2.87Å
567	K	70.5	Confident	67.3	Low	218 Å²	218	90.5 Å²	90.5	95%	0.948	46%	0.455	S	S	*	.			trans	-71.7	120.1	167	-68.2	-174.4	179	-177.2	0	109.3	H565	H565-K567 PolarHBondContact O-N 2.99Å
568	I	71.8	Confident	68.7	Low	104 Å²	104	90 Å²	90	53%	0.533	45%	0.451	S	S	.	.			trans	-113.9	136.6	-176.4	-49.7	176.6	0	0	0	110.2	L562 S566	L562-I568 HydrophobicContact CD1-CD1 3.83Å; L562-I568 HydrophobicContact CD2-CD1 3.72Å; L562-I568 HydrophobicContact CD2-CG1 3.79Å; L562-I568 HydrophobicContact CG-CD1 4.33Å; S566-I568 PolarHBondContact O-N 2.87Å
569	R	71.6	Confident	69.8	Low	164 Å²	164	81.7 Å²	81.7	62%	0.619	42%	0.415	S	S	*	.			trans	-118.5	131.6	171.2	-176.7	172.8	178.6	149.5	-0.2	110.3	I571	R569-I571 PolarHBondContact O-N 3.32Å
570	L	73.8	Confident	70.7	Confident	104 Å²	104	77.6 Å²	77.6	55%	0.545	39%	0.386	S	S	.	.			trans	-75.7	113.8	177	-169.4	63.2	0	0	0	110.6	I576	L570-I576 HydrophobicContact CD1-CD1 3.7Å; L570-I576 HydrophobicContact CD2-CD1 4.38Å; L570-I576 HydrophobicContact CG-CD1 4.14Å
571	I	72.8	Confident	71.2	Confident	39 Å²	39	73.4 Å²	73.4	20%	0.2	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	140	175.9	-66.8	171.6	0	0	0	109.2	L542 E546 R569 S573	L542-I571 HydrophobicContact CD2-CG2 3.78Å; E546-I571 HydrophobicContact CB-CG2 4.45Å; E546-I571 HydrophobicContact CG-CG2 4.42Å; R569-I571 PolarHBondContact O-N 3.32Å; I571-S573 VanDerWaalsContact C-N 3.28Å; I571-S573 PolarHBondContact O-N 3.14Å
572	R	75.6	Confident	71.1	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.011	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	46	45.4	-175.5	-53.6	-57.2	-85.6	-97.1	-1.5	114.4	E287 P540 E541 L542 E546 T574 A575 L613	E287-R572 IonicContact OE1-NE 2.75Å; E287-R572 PolarHBondContact OE1-NE 3.08Å; E287-R572 IonicContact OE2-CZ 2.95Å; E287-R572 IonicContact OE2-NE 3.89Å; E287-R572 PolarHBondContact OE2-NE 3.42Å; E287-R572 IonicContact OE2-NH2 3.76Å; E287-R572 PolarHBondContact OE2-NH2 3.17Å; P540-R572 HydrophobicContact CB-CG 4.3Å; E541-R572 PolarHBondContact O-NH1 3.28Å; L542-R572 HydrophobicContact CD2-CG 3.52Å; E546-R572 VanDerWaalsContact OE1-CD 3.27Å; E546-R572 WeakPolarHBondContact OE1-CD 3.45Å; E546-R572 IonicContact OE2-NH1 2.72Å; E546-R572 PolarHBondContact OE2-NH1 3.02Å; R572-T574 PolarHBondContact O-N 3.25Å; R572-T574 VanDerWaalsContact O-N 3.09Å; R572-A575 HydrophobicContact CB-CB 4.41Å; R572-A575 WeakPolarHBondContact O-CB 3.27Å; R572-A575 PolarHBondContact O-N 3.02Å; R572-L613 HydrophobicContact CB-CD2 4.33Å
573	S	72.8	Confident	70.3	Confident	47 Å²	47	67.5 Å²	67.5	33%	0.329	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-51.5	-33.3	178.8	56.4	0	0	0	0	113.9	I571 A575 I576	I571-S573 VanDerWaalsContact C-N 3.28Å; I571-S573 PolarHBondContact O-N 3.14Å; S573-A575 PolarHBondContact O-N 2.84Å; S573-I576 PolarHBondContact O-N 3.47Å; S573-I576 VanDerWaalsContact O-N 3.13Å
574	T	74.4	Confident	69.1	Low	17 Å²	17	68 Å²	68	10%	0.104	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-60.6	-26.8	175.7	24.6	0	0	0	0	114.9	P169 L170 E287 R572 R577	P169-T574 WeakPolarHBondContact CG-OG1 3.24Å; L170-T574 HydrophobicContact CD1-CG2 4.13Å; L170-T574 HydrophobicContact CD2-CG2 3.82Å; L170-T574 HydrophobicContact CG-CG2 3.88Å; E287-T574 HydrophobicContact CB-CG2 4.5Å; E287-T574 VanDerWaalsContact CD-OG1 3.26Å; E287-T574 WeakPolarHBondContact OE1-CB 3.33Å; E287-T574 PolarHBondContact OE1-OG1 3.17Å; R572-T574 PolarHBondContact O-N 3.25Å; R572-T574 VanDerWaalsContact O-N 3.09Å; T574-R577 PolarHBondContact O-NH2 2.95Å
575	A	75.2	Confident	67.6	Low	4 Å²	4	62.6 Å²	62.6	3%	0.033	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-93.3	7	178.3	0	0	0	0	0	113.9	M534 P540 R572 S573 H611 S612	M534-A575 WeakPolarHBondContact CE-O 3.3Å; P540-A575 HydrophobicContact CG-CB 3.38Å; R572-A575 HydrophobicContact CB-CB 4.41Å; R572-A575 WeakPolarHBondContact O-CB 3.27Å; R572-A575 PolarHBondContact O-N 3.02Å; S573-A575 PolarHBondContact O-N 2.84Å; A575-H611 VanDerWaalsContact O-CA 3.3Å; A575-H611 WeakPolarHBondContact O-CA 3.4Å; A575-S612 PolarHBondContact O-N 3.09Å; A575-S612 VanDerWaalsContact O-N 3.09Å
576	I	77.6	Confident	66.2	Low	30 Å²	30	62.7 Å²	62.7	15%	0.154	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.1	179.8	-58.3	173	0	0	0	107.4	L570 S573 V609 Y610 H611 L613	L570-I576 HydrophobicContact CD1-CD1 3.7Å; L570-I576 HydrophobicContact CD2-CD1 4.38Å; L570-I576 HydrophobicContact CG-CD1 4.14Å; S573-I576 PolarHBondContact O-N 3.47Å; S573-I576 VanDerWaalsContact O-N 3.13Å; I576-V609 HydrophobicContact CG2-CG1 3.46Å; I576-V609 VanDerWaalsContact CG2-CG1 3.46Å; I576-Y610 CarbonylContact C-O 3.57Å; I576-Y610 WeakPolarHBondContact CA-O 3.4Å; I576-H611 HydrophobicContact CG1-CB 4.02Å; I576-L613 HydrophobicContact CD1-CD1 4.33Å; I576-L613 HydrophobicContact CG1-CD1 4.42Å
577	R	75.1	Confident	64.8	Low	31 Å²	31	66.2 Å²	66.2	12%	0.117	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	127.7	177.5	-64.7	-63.2	163.1	155.5	4.4	112.2	M530 M534 T574 M579 Y610 N742	M530-R577 HydrophobicContact CE-CG 3.95Å; M534-R577 HydrophobicContact CE-CB 4.16Å; M534-R577 HydrophobicContact CE-CG 4.08Å; M534-R577 HydrophobicContact SD-CB 3.72Å; M534-R577 HydrophobicContact SD-CG 3.42Å; M534-R577 WeakPolarHBondContact SD-CG 3.45Å; T574-R577 PolarHBondContact O-NH2 2.95Å; R577-M579 HydrophobicContact CB-CE 3.86Å; R577-M579 HydrophobicContact CB-CG 4.18Å; R577-M579 HydrophobicContact CB-SD 4.18Å; R577-Y610 PolarHBondContact N-O 3.32Å; R577-Y610 PolarHBondContact O-N 3.25Å; R577-N742 PolarHBondContact NH1-OD1 3.42Å; R577-N742 PolarHBondContact NH1-OXT 2.77Å; R577-N742 PolarHBondContact NH2-ND2 3.4Å
578	L	73.1	Confident	63.2	Low	81 Å²	81	58.3 Å²	58.3	42%	0.424	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	109.4	171.9	177.8	130	0	0	0	107.9	F607 V609	L578-F607 HydrophobicContact CD1-CB 4.01Å; L578-F607 HydrophobicContact CD1-CG 4.35Å; L578-F607 HydrophobicContact CD2-CB 4.35Å; L578-F607 HydrophobicContact CD2-CD1 3.4Å; L578-F607 HydrophobicContact CD2-CE1 3.7Å; L578-F607 HydrophobicContact CD2-CG 3.95Å; L578-F607 HydrophobicContact CD2-CZ 4.47Å; L578-F607 HydrophobicContact CG-CB 4.02Å; L578-F607 HydrophobicContact CG-CD1 3.92Å; L578-F607 HydrophobicContact CG-CG 4.18Å; L578-V609 HydrophobicContact CD1-CG2 4.15Å
579	M	71.3	Confident	61.4	Low	5 Å²	5	59.6 Å²	59.6	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	155	-175.4	-69	178.2	-68.4	0	0	110.8	D527 M530 L531 M534 R577 M608 Y610	D527-M579 HydrophobicContact CB-CB 4.45Å; D527-M579 HydrophobicContact CB-CG 4.14Å; D527-M579 HydrophobicContact CB-SD 3.92Å; D527-M579 WeakPolarHBondContact OD2-CB 3.38Å; M530-M579 HydrophobicContact CB-SD 4.31Å; L531-M579 HydrophobicContact CD1-CE 4.49Å; L531-M579 HydrophobicContact CD2-CE 3.52Å; L531-M579 HydrophobicContact CG-CE 3.59Å; L531-M579 HydrophobicContact CG-SD 3.95Å; M534-M579 HydrophobicContact SD-CE 4.28Å; R577-M579 HydrophobicContact CB-CE 3.86Å; R577-M579 HydrophobicContact CB-CG 4.18Å; R577-M579 HydrophobicContact CB-SD 4.18Å; M579-M608 PolarHBondContact N-O 3.14Å; M579-M608 PolarHBondContact O-N 3Å; M579-Y610 HydrophobicContact CB-CD2 4.28Å; M579-Y610 HydrophobicContact CB-CE2 4.3Å; M579-Y610 HydrophobicContact CE-CD2 3.33Å; M579-Y610 HydrophobicContact CE-CE2 4.03Å; M579-Y610 HydrophobicContact CE-CG 3.71Å
580	L	67	Low	59.5	Low	11 Å²	11	55.4 Å²	55.4	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.4	-178.4	-177.1	64.8	0	0	0	110.9	I464 I516 I519 D527 P605	I464-L580 HydrophobicContact CD1-CD2 3.77Å; I516-L580 HydrophobicContact CD1-CD1 4.13Å; I519-L580 HydrophobicContact CD1-CB 4.3Å; I519-L580 HydrophobicContact CD1-CD2 3.65Å; D527-L580 PolarHBondContact OD2-N 2.77Å; L580-P605 HydrophobicContact CD1-CB 4.02Å
581	T	61.7	Low	57.6	Low	13 Å²	13	57.7 Å²	57.7	8%	0.08	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	174	172.6	-161.8	0	0	0	0	111.5	F583 S606 M608	T581-F583 HydrophobicContact CG2-CD2 4.08Å; T581-F583 HydrophobicContact CG2-CE2 3.51Å; T581-F583 HydrophobicContact CG2-CZ 3.86Å; T581-S606 WeakPolarHBondContact CG2-O 3.31Å; T581-S606 PolarHBondContact N-O 3.28Å; T581-S606 PolarHBondContact O-N 2.92Å; T581-S606 VanDerWaalsContact O-O 3.12Å; T581-M608 HydrophobicContact CG2-CB 3.62Å; T581-M608 HydrophobicContact CG2-CG 4.44Å; T581-M608 HydrophobicContact CG2-SD 4.01Å
582	Y	55.4	Low	55.6	Low	42 Å²	42	60.4 Å²	60.4	17%	0.165	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.4	178.3	-61.2	-82.3	0	0	0	109.5	I464 L487 P605	I464-Y582 HydrophobicContact CG2-CE1 3.73Å; L487-Y582 HydrophobicContact CD1-CD2 4.42Å; Y582-P605 HydrophobicContact CD1-CB 4.36Å; Y582-P605 HydrophobicContact CE1-CB 4.01Å
583	F	49.1	Very low	53.5	Low	73 Å²	73	66.9 Å²	66.9	32%	0.32	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.2	169.7	-66	-71.7	0	0	0	109.9	T581 M603 I604 M608	T581-F583 HydrophobicContact CG2-CD2 4.08Å; T581-F583 HydrophobicContact CG2-CE2 3.51Å; T581-F583 HydrophobicContact CG2-CZ 3.86Å; F583-M603 WeakPolarHBondContact O-CA 3.41Å; F583-I604 PolarHBondContact N-O 3.24Å; F583-I604 PolarHBondContact O-N 3.3Å; F583-M608 HydrophobicContact CZ-SD 4.06Å
584	E	41.9	Very low	51.5	Low	91 Å²	91	71.8 Å²	71.8	43%	0.425	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.7	165.7	-63.6	-172.1	155.3	0	0	109.6	K586 M603	E584-K586 PolarHBondContact O-N 2.98Å; E584-K586 VanDerWaalsContact O-N 3.13Å; E584-M603 HydrophobicContact CG-CE 4.24Å; E584-M603 HydrophobicContact CG-CG 4.48Å
585	N	44.6	Very low	49.5	Very low	21 Å²	21	78 Å²	78	11%	0.112	42%	0.42	C	S	.	.			trans	-71.3	106.8	177.1	-174.3	12.3	0	0	0	111.1	E587 S588 S602 I604	N585-E587 PolarHBondContact O-N 2.81Å; N585-E587 VanDerWaalsContact OD1-CB 3.29Å; N585-E587 WeakPolarHBondContact OD1-CB 3.33Å; N585-E587 WeakPolarHBondContact OD1-CG 3.34Å; N585-E587 PolarHBondContact OD1-N 3.25Å; N585-E587 VanDerWaalsContact OD1-N 3.1Å; N585-E587 PolarHBondContact OD1-OE2 3.33Å; N585-S588 PolarHBondContact O-OG 3Å; N585-S602 VanDerWaalsContact CB-O 3.25Å; N585-S602 WeakPolarHBondContact CB-O 3.37Å; N585-S602 WeakPolarHBondContact CB-OG 3.33Å; N585-S602 PolarHBondContact N-O 3.48Å; N585-I604 HydrophobicContact CB-CD1 3.86Å; N585-I604 HydrophobicContact CB-CG1 4.26Å
586	K	44	Very low	47.5	Very low	174 Å²	174	83.6 Å²	83.6	76%	0.757	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-69.8	-11.4	176.6	-69.9	-172.7	176.2	-177	0	114.3	E584 S588	E584-K586 PolarHBondContact O-N 2.98Å; E584-K586 VanDerWaalsContact O-N 3.13Å; K586-S588 PolarHBondContact O-N 3.36Å
587	E	42.6	Very low	45.3	Very low	119 Å²	119	87.2 Å²	87.2	56%	0.556	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-71.8	-6.2	-179.1	-59.4	173.2	145.2	0	0	113.2	N585 N589 K632	N585-E587 PolarHBondContact O-N 2.81Å; N585-E587 VanDerWaalsContact OD1-CB 3.29Å; N585-E587 WeakPolarHBondContact OD1-CB 3.33Å; N585-E587 WeakPolarHBondContact OD1-CG 3.34Å; N585-E587 PolarHBondContact OD1-N 3.25Å; N585-E587 VanDerWaalsContact OD1-N 3.1Å; N585-E587 PolarHBondContact OD1-OE2 3.33Å; E587-N589 PolarHBondContact O-N 3.25Å; E587-K632 IonicContact OE2-NZ 2.74Å; E587-K632 PolarHBondContact OE2-NZ 2.91Å
588	S	35.9	Very low	43.1	Very low	51 Å²	51	90.1 Å²	90.1	36%	0.357	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-75.4	16.4	-179.7	59.3	0	0	0	0	115.6	N585 K586	N585-S588 PolarHBondContact O-OG 3Å; K586-S588 PolarHBondContact O-N 3.36Å
589	N	34	Very low	41.2	Very low	132 Å²	132	94.9 Å²	94.9	71%	0.706	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-103.1	-1	-178.2	-75.9	-31.5	0	0	0	114.4	E587	E587-N589 PolarHBondContact O-N 3.25Å
590	A	31.9	Very low	39.4	Very low	75 Å²	75	100.7 Å²	100.7	62%	0.62	54%	0.539	S	S	*	.	S	Bend	trans	-100.3	149.6	171.1	0	0	0	0	0	110.6
591	I	33.4	Very low	38	Very low	153 Å²	153	104.1 Å²	104.1	79%	0.785	55%	0.554	S	S	*	*			trans	67.1	75.6	-170.5	-45.8	171.3	0	0	0	111.9
592	A	30.3	Very low	37	Very low	95 Å²	95	105.3 Å²	105.3	79%	0.785	56%	0.563	S	S	*	*			trans	-95	72.9	163.9	0	0	0	0	0	109.6
593	D	32.4	Very low	36.5	Very low	140 Å²	140	106.7 Å²	106.7	75%	0.749	57%	0.572	S	S	*	*			trans	-62.6	139.4	169.8	-88.3	-38.8	0	0	0	110.4
594	N	31.4	Very low	36.7	Very low	150 Å²	150	104.4 Å²	104.4	80%	0.802	56%	0.563	S	S	*	*	S	Bend	trans	-70.4	136.5	-177.4	-78.9	-59.2	0	0	0	111.3
595	N	31.1	Very low	37.4	Very low	148 Å²	148	101.2 Å²	101.2	79%	0.791	55%	0.55	S	S	*	.	S	Bend	trans	88.2	126.8	-176.8	-49.5	-67.4	0	0	0	116.1
596	T	33.7	Very low	38.1	Very low	121 Å²	121	100.7 Å²	100.7	74%	0.742	55%	0.548	S	S	*	.			trans	67.9	94.9	-177.7	70	0	0	0	0	116.4	N598	T596-N598 VanDerWaalsContact C-N 3.29Å; T596-N598 PolarHBondContact O-N 2.75Å
597	S	30.7	Very low	39.3	Very low	106 Å²	106	96.4 Å²	96.4	74%	0.741	53%	0.53	S	S	*	.			trans	-76.9	62.9	-178.7	59.8	0	0	0	0	114.2	R599	S597-R599 PolarHBondContact O-N 3.44Å
598	N	29.9	Very low	40.5	Very low	91 Å²	91	91.2 Å²	91.2	49%	0.487	51%	0.505	S	S	.	.			trans	-83.3	80.4	177.7	-80.3	-45.7	0	0	0	112.3	T596 Q600	T596-N598 VanDerWaalsContact C-N 3.29Å; T596-N598 PolarHBondContact O-N 2.75Å; N598-Q600 PolarHBondContact O-N 2.86Å; N598-Q600 VanDerWaalsContact O-N 3.13Å
599	R	32	Very low	42.3	Very low	182 Å²	182	90.6 Å²	90.6	69%	0.687	50%	0.499	S	S	*	.			trans	-69	106.7	175.8	-73.9	-174.4	172.4	173	-2.9	112.2	S597 H601	S597-R599 PolarHBondContact O-N 3.44Å; R599-H601 PolarHBondContact O-N 2.72Å
600	Q	34.7	Very low	44.3	Very low	126 Å²	126	85.6 Å²	85.6	59%	0.589	47%	0.471	S	S	*	.			trans	-85.9	87.4	173.2	-69.9	-169.8	-5.5	0	0	111.9	N598 S602	N598-Q600 PolarHBondContact O-N 2.86Å; N598-Q600 VanDerWaalsContact O-N 3.13Å; Q600-S602 VanDerWaalsContact C-N 3.29Å; Q600-S602 PolarHBondContact O-N 3.35Å
601	H	37.9	Very low	46.6	Very low	83 Å²	83	84 Å²	84	38%	0.384	45%	0.451	S	S	.	.			trans	-72.6	80.1	171	-71.9	-95	0	0	0	111.3	S467 R599 M603	S467-H601 WeakPolarHBondContact CB-O 3.43Å; S467-H601 PolarHBondContact OG-O 2.64Å; S467-H601 VanDerWaalsContact OG-O 3.07Å; R599-H601 PolarHBondContact O-N 2.72Å; H601-M603 PolarHBondContact O-N 2.93Å
602	S	39.7	Very low	48.7	Very low	38 Å²	38	76.9 Å²	76.9	27%	0.266	41%	0.414	S	S	.	.			trans	-70.5	114.6	177	46.8	0	0	0	0	111.7	S467 N585 Q600	S467-S602 WeakPolarHBondContact OG-CA 3.49Å; N585-S602 VanDerWaalsContact CB-O 3.25Å; N585-S602 WeakPolarHBondContact CB-O 3.37Å; N585-S602 WeakPolarHBondContact CB-OG 3.33Å; N585-S602 PolarHBondContact N-O 3.48Å; Q600-S602 VanDerWaalsContact C-N 3.29Å; Q600-S602 PolarHBondContact O-N 3.35Å
603	M	45.7	Very low	50.8	Low	71 Å²	71	75.2 Å²	75.2	35%	0.35	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	130.8	167.7	-75.9	-172.6	174.5	0	0	110.7	F583 E584 H601	F583-M603 WeakPolarHBondContact O-CA 3.41Å; E584-M603 HydrophobicContact CG-CE 4.24Å; E584-M603 HydrophobicContact CG-CG 4.48Å; H601-M603 PolarHBondContact O-N 2.93Å
604	I	53	Low	52.5	Low	26 Å²	26	73.2 Å²	73.2	13%	0.133	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.2	178.8	-59	177.3	0	0	0	108.8	F583 N585 S606	F583-I604 PolarHBondContact N-O 3.24Å; F583-I604 PolarHBondContact O-N 3.3Å; N585-I604 HydrophobicContact CB-CD1 3.86Å; N585-I604 HydrophobicContact CB-CG1 4.26Å; I604-S606 PolarHBondContact O-N 3.48Å; I604-S606 PolarHBondContact O-OG 2.79Å
605	P	57.1	Low	54.4	Low	23 Å²	23	66.6 Å²	66.6	15%	0.149	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	123.9	171.9	26.4	-32.3	0	0	0	109	I464 L580 Y582	I464-P605 HydrophobicContact CG2-CB 4.3Å; I464-P605 HydrophobicContact CG2-CG 4.37Å; L580-P605 HydrophobicContact CD1-CB 4.02Å; Y582-P605 HydrophobicContact CD1-CB 4.36Å; Y582-P605 HydrophobicContact CE1-CB 4.01Å
606	S	58.4	Low	55.7	Low	10 Å²	10	66.8 Å²	66.8	7%	0.07	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.8	-171	-55	0	0	0	0	109.8	T581 I604	T581-S606 WeakPolarHBondContact CG2-O 3.31Å; T581-S606 PolarHBondContact N-O 3.28Å; T581-S606 PolarHBondContact O-N 2.92Å; T581-S606 VanDerWaalsContact O-O 3.12Å; I604-S606 PolarHBondContact O-N 3.48Å; I604-S606 PolarHBondContact O-OG 2.79Å
607	F	68.7	Low	56.5	Low	85 Å²	85	62.4 Å²	62.4	37%	0.373	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	138.8	170	-68.4	-69.7	0	0	0	110.6	I516 L578	I516-F607 HydrophobicContact CD1-CE1 3.66Å; I516-F607 HydrophobicContact CD1-CE2 4.19Å; I516-F607 HydrophobicContact CD1-CZ 3.35Å; I516-F607 HydrophobicContact CG1-CZ 4.16Å; L578-F607 HydrophobicContact CD1-CB 4.01Å; L578-F607 HydrophobicContact CD1-CG 4.35Å; L578-F607 HydrophobicContact CD2-CB 4.35Å; L578-F607 HydrophobicContact CD2-CD1 3.4Å; L578-F607 HydrophobicContact CD2-CE1 3.7Å; L578-F607 HydrophobicContact CD2-CG 3.95Å; L578-F607 HydrophobicContact CD2-CZ 4.47Å; L578-F607 HydrophobicContact CG-CB 4.02Å; L578-F607 HydrophobicContact CG-CD1 3.92Å; L578-F607 HydrophobicContact CG-CG 4.18Å
608	M	68.8	Low	57	Low	9 Å²	9	60.1 Å²	60.1	4%	0.044	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.6	178.2	-177.3	170.1	177.3	0	0	109.9	M579 T581 F583 Y610 V626 G627	M579-M608 PolarHBondContact N-O 3.14Å; M579-M608 PolarHBondContact O-N 3Å; T581-M608 HydrophobicContact CG2-CB 3.62Å; T581-M608 HydrophobicContact CG2-CG 4.44Å; T581-M608 HydrophobicContact CG2-SD 4.01Å; F583-M608 HydrophobicContact CZ-SD 4.06Å; M608-Y610 HydrophobicContact CB-CD2 4.37Å; M608-Y610 HydrophobicContact CB-CE2 3.83Å; M608-Y610 HydrophobicContact CE-CD1 4.42Å; M608-Y610 HydrophobicContact CE-CE1 3.76Å; M608-Y610 HydrophobicContact CG-CD2 4.13Å; M608-Y610 HydrophobicContact CG-CE1 4.46Å; M608-Y610 HydrophobicContact CG-CE2 3.68Å; M608-Y610 WeakPolarHBondContact O-CD2 3.34Å; M608-Y610 PolarHBondContact O-N 3.34Å; M608-Y610 HydrophobicContact SD-CE1 4.04Å; M608-Y610 HydrophobicContact SD-CE2 3.91Å; M608-Y610 PolarHBondContact SD-OH 2.95Å; M608-V626 HydrophobicContact CE-CB 4.11Å; M608-V626 HydrophobicContact CE-CG1 3.68Å; M608-G627 VanDerWaalsContact CE-N 3.3Å
609	V	74.6	Confident	57.4	Low	39 Å²	39	60.3 Å²	60.3	24%	0.236	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	92.3	-176.3	-178.7	0	0	0	0	109.7	I576 L578 G627 F630	I576-V609 HydrophobicContact CG2-CG1 3.46Å; I576-V609 VanDerWaalsContact CG2-CG1 3.46Å; L578-V609 HydrophobicContact CD1-CG2 4.15Å; V609-G627 WeakPolarHBondContact O-CA 3.37Å; V609-F630 HydrophobicContact CG2-CE2 4Å
610	Y	74.1	Confident	57.5	Low	27 Å²	27	57.9 Å²	57.9	11%	0.106	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	149.3	172.9	-63.5	-92.8	0	0	0	110.1	L531 M534 I576 R577 M579 M608	L531-Y610 HydrophobicContact CD2-CD1 3.72Å; L531-Y610 HydrophobicContact CD2-CD2 4.04Å; L531-Y610 HydrophobicContact CD2-CE1 3.65Å; L531-Y610 HydrophobicContact CD2-CE2 3.96Å; L531-Y610 HydrophobicContact CD2-CG 3.9Å; M534-Y610 WeakPolarHBondContact CE-O 3.49Å; I576-Y610 CarbonylContact C-O 3.57Å; I576-Y610 WeakPolarHBondContact CA-O 3.4Å; R577-Y610 PolarHBondContact N-O 3.32Å; R577-Y610 PolarHBondContact O-N 3.25Å; M579-Y610 HydrophobicContact CB-CD2 4.28Å; M579-Y610 HydrophobicContact CB-CE2 4.3Å; M579-Y610 HydrophobicContact CE-CD2 3.33Å; M579-Y610 HydrophobicContact CE-CE2 4.03Å; M579-Y610 HydrophobicContact CE-CG 3.71Å; M608-Y610 HydrophobicContact CB-CD2 4.37Å; M608-Y610 HydrophobicContact CB-CE2 3.83Å; M608-Y610 HydrophobicContact CE-CD1 4.42Å; M608-Y610 HydrophobicContact CE-CE1 3.76Å; M608-Y610 HydrophobicContact CG-CD2 4.13Å; M608-Y610 HydrophobicContact CG-CE1 4.46Å; M608-Y610 HydrophobicContact CG-CE2 3.68Å; M608-Y610 WeakPolarHBondContact O-CD2 3.34Å; M608-Y610 PolarHBondContact O-N 3.34Å; M608-Y610 HydrophobicContact SD-CE1 4.04Å; M608-Y610 HydrophobicContact SD-CE2 3.91Å; M608-Y610 PolarHBondContact SD-OH 2.95Å
611	H	80.2	Confident	57.2	Low	42 Å²	42	58.1 Å²	58.1	19%	0.194	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.1	175.3	62.9	88.3	0	0	0	111.3	A575 I576 L613	A575-H611 VanDerWaalsContact O-CA 3.3Å; A575-H611 WeakPolarHBondContact O-CA 3.4Å; I576-H611 HydrophobicContact CG1-CB 4.02Å; H611-L613 HydrophobicContact CB-CD1 4.35Å; H611-L613 HydrophobicContact CB-CG 4.28Å
612	S	78.1	Confident	56.8	Low	2 Å²	2	55.2 Å²	55.2	1%	0.014	30%	0.301	C	S	.	.	S	Bend	trans	-90	-1.6	175.1	57	0	0	0	0	114	A539 A575 N614 N615	A539-S612 WeakPolarHBondContact CA-O 3.3Å; A539-S612 WeakPolarHBondContact CB-O 3.45Å; A575-S612 PolarHBondContact O-N 3.09Å; A575-S612 VanDerWaalsContact O-N 3.09Å; S612-N614 PolarHBondContact O-N 2.99Å; S612-N615 WeakPolarHBondContact CB-ND2 3.46Å; S612-N615 WeakPolarHBondContact O-CB 3.36Å; S612-N615 VanDerWaalsContact O-CG 3.28Å; S612-N615 PolarHBondContact O-N 2.9Å; S612-N615 PolarHBondContact O-OD1 3.15Å
613	L	74	Confident	56.3	Low	60 Å²	60	59.3 Å²	59.3	31%	0.314	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-29.7	-176.3	-57.7	170.5	0	0	0	114.6	P540 R572 I576 H611	P540-L613 HydrophobicContact CB-CD2 4.12Å; P540-L613 HydrophobicContact CG-CD2 3.97Å; R572-L613 HydrophobicContact CB-CD2 4.33Å; I576-L613 HydrophobicContact CD1-CD1 4.33Å; I576-L613 HydrophobicContact CG1-CD1 4.42Å; H611-L613 HydrophobicContact CB-CD1 4.35Å; H611-L613 HydrophobicContact CB-CG 4.28Å
614	N	68.8	Low	55.6	Low	98 Å²	98	57 Å²	57	52%	0.524	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	14.3	-177.8	-69.6	-4.2	0	0	0	113.2	S612 Q616	S612-N614 PolarHBondContact O-N 2.99Å; N614-Q616 PolarHBondContact O-N 2.8Å; N614-Q616 VanDerWaalsContact O-N 3.1Å
615	N	71.2	Confident	54.8	Low	11 Å²	11	59.2 Å²	59.2	6%	0.059	32%	0.324	C	S	.	.			trans	-67.5	110	-179.8	-72.5	6.9	0	0	0	110.8	M534 R535 S537 A539 S612 G617	M534-N615 PolarHBondContact O-ND2 3.03Å; R535-N615 PolarHBondContact O-ND2 2.79Å; R535-N615 VanDerWaalsContact O-ND2 3.17Å; S537-N615 PolarHBondContact O-ND2 3.15Å; A539-N615 HydrophobicContact CB-CB 4.25Å; A539-N615 WeakPolarHBondContact CB-O 3.26Å; S612-N615 WeakPolarHBondContact CB-ND2 3.46Å; S612-N615 WeakPolarHBondContact O-CB 3.36Å; S612-N615 VanDerWaalsContact O-CG 3.28Å; S612-N615 PolarHBondContact O-N 2.9Å; S612-N615 PolarHBondContact O-OD1 3.15Å; N615-G617 PolarHBondContact O-N 2.68Å
616	Q	58.6	Low	53.7	Low	153 Å²	153	63.3 Å²	63.3	72%	0.715	35%	0.348	S	S	*	.			trans	-57.8	110.6	168.2	-68.2	-78.1	-9.2	0	0	108.6	N614 N618	N614-Q616 PolarHBondContact O-N 2.8Å; N614-Q616 VanDerWaalsContact O-N 3.1Å; Q616-N618 PolarHBondContact O-N 2.86Å
617	G	50.2	Low	52.4	Low	28 Å²	28	63 Å²	63	29%	0.289	35%	0.347	S	S	.	.	S	Bend	trans	-65.9	-4.8	-177.5	0	0	0	0	0	114.9	T273 N615	T273-G617 VanDerWaalsContact CG2-C 3.43Å; T273-G617 VanDerWaalsContact OG1-C 3.27Å; T273-G617 WeakPolarHBondContact OG1-CA 3.38Å; T273-G617 PolarHBondContact OG1-O 2.81Å; N615-G617 PolarHBondContact O-N 2.68Å
618	N	41.9	Very low	50.6	Low	59 Å²	59	65.2 Å²	65.2	32%	0.316	36%	0.361	S	S	.	.	S	Bend	trans	-117.1	65.8	176.6	-75.2	-21	0	0	0	110.3	H231 T273 Q616	H231-N618 PolarHBondContact NE2-OD1 2.89Å; T273-N618 HydrophobicContact CG2-CB 4.45Å; T273-N618 VanDerWaalsContact CG2-OD1 3.25Å; T273-N618 WeakPolarHBondContact CG2-OD1 3.27Å; Q616-N618 PolarHBondContact O-N 2.86Å
619	N	38.1	Very low	48.7	Very low	94 Å²	94	66.4 Å²	66.4	50%	0.503	38%	0.376	S	S	.	.			trans	179.5	155.8	143.8	-93.3	-14.7	0	0	0	112.7	D621	N619-D621 HydrophobicContact CB-CB 4.49Å
620	T	33.3	Very low	46.6	Very low	131 Å²	131	69.3 Å²	69.3	80%	0.804	39%	0.385	S	S	*	.	S	Bend	trans	-67	-26.3	166.3	44.1	0	0	0	0	112.4	S622	T620-S622 PolarHBondContact O-N 3.38Å; T620-S622 PolarHBondContact O-OG 3.03Å
621	D	28.6	Very low	44.6	Very low	132 Å²	132	72 Å²	72	71%	0.706	40%	0.399	S	S	*	.			trans	-77.2	58.2	171.7	-59.2	-37.2	0	0	0	111.2	N619 N623	N619-D621 HydrophobicContact CB-CB 4.49Å; D621-N623 PolarHBondContact O-N 3.42Å
622	S	30.3	Very low	42.3	Very low	21 Å²	21	76.1 Å²	76.1	15%	0.147	42%	0.416	C	S	.	.			trans	-67.5	94.8	170.2	47.6	0	0	0	0	109.5	R535 T620 A624	R535-S622 VanDerWaalsContact C-OG 3.28Å; R535-S622 WeakPolarHBondContact CB-OG 3.38Å; R535-S622 WeakPolarHBondContact O-CB 3.31Å; R535-S622 PolarHBondContact O-OG 3.41Å; R535-S622 VanDerWaalsContact O-OG 3.05Å; T620-S622 PolarHBondContact O-N 3.38Å; T620-S622 PolarHBondContact O-OG 3.03Å; S622-A624 PolarHBondContact O-N 2.85Å
623	N	28.1	Very low	39.9	Very low	125 Å²	125	85.4 Å²	85.4	67%	0.668	46%	0.456	S	S	*	.			trans	-63.9	82.5	159.4	-79.5	-21.5	0	0	0	108.6	D621 N625	D621-N623 PolarHBondContact O-N 3.42Å; N623-N625 PolarHBondContact O-N 2.67Å; N623-N625 PolarHBondContact O-ND2 2.67Å
624	A	30.7	Very low	37.7	Very low	21 Å²	21	87.8 Å²	87.8	17%	0.174	47%	0.469	C	S	.	.			trans	-60.8	89.8	160.1	0	0	0	0	0	106.3	R535 S622	R535-A624 HydrophobicContact CG-CB 3.63Å; S622-A624 PolarHBondContact O-N 2.85Å
625	N	36.2	Very low	35.7	Very low	73 Å²	73	89.1 Å²	89.1	39%	0.39	48%	0.476	S	S	.	.			trans	-62.5	152.3	-156.4	-90.8	-49.5	0	0	0	111.9	N623 G627	N623-N625 PolarHBondContact O-N 2.67Å; N623-N625 PolarHBondContact O-ND2 2.67Å; N625-G627 PolarHBondContact O-N 2.93Å
626	V	34.3	Very low	33.7	Very low	109 Å²	109	92 Å²	92	66%	0.661	49%	0.494	S	S	*	.			trans	-60.7	102.8	-173.2	177.9	0	0	0	0	109.5	M608	M608-V626 HydrophobicContact CE-CB 4.11Å; M608-V626 HydrophobicContact CE-CG1 3.68Å
627	G	31.1	Very low	32.2	Very low	5 Å²	5	87.7 Å²	87.7	5%	0.052	48%	0.484	C	S	.	.			trans	-54.8	147.5	171.7	0	0	0	0	0	112.1	M608 V609 N625 G629	M608-G627 VanDerWaalsContact CE-N 3.3Å; V609-G627 WeakPolarHBondContact O-CA 3.37Å; N625-G627 PolarHBondContact O-N 2.93Å; G627-G629 PolarHBondContact O-N 2.94Å; G627-G629 VanDerWaalsContact O-N 3.07Å
628	I	32.1	Very low	31.2	Very low	130 Å²	130	90.3 Å²	90.3	67%	0.667	49%	0.491	S	S	*	.			trans	-57.4	115.5	177.7	-62.5	167.4	0	0	0	108.8	F630	I628-F630 HydrophobicContact CG2-CE1 4.5Å; I628-F630 HydrophobicContact CG2-CZ 4.49Å
629	G	28.8	Very low	30.4	Very low	34 Å²	34	91.2 Å²	91.2	35%	0.351	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-83.3	112.6	174.5	0	0	0	0	0	110.3	G627 H631	G627-G629 PolarHBondContact O-N 2.94Å; G627-G629 VanDerWaalsContact O-N 3.07Å; G629-H631 PolarHBondContact O-N 2.59Å; G629-H631 VanDerWaalsContact O-N 3.14Å
630	F	30.7	Very low	29.9	Very low	100 Å²	100	94.6 Å²	94.6	44%	0.439	51%	0.509	S	S	.	.			trans	-75.2	101.3	179.3	-66.9	-80.8	0	0	0	110.8	V609 I628 L634	V609-F630 HydrophobicContact CG2-CE2 4Å; I628-F630 HydrophobicContact CG2-CE1 4.5Å; I628-F630 HydrophobicContact CG2-CZ 4.49Å; F630-L634 HydrophobicContact CD1-CD2 3.59Å; F630-L634 HydrophobicContact CE1-CD2 3.65Å
631	H	30.7	Very low	29.4	Very low	84 Å²	84	97.7 Å²	97.7	39%	0.389	51%	0.507	S	S	.	.			trans	-108.6	113.5	-174.1	-159.5	-102.9	0	0	0	112.9	G629 K633	G629-H631 PolarHBondContact O-N 2.59Å; G629-H631 VanDerWaalsContact O-N 3.14Å; H631-K633 VanDerWaalsContact C-N 3.26Å; H631-K633 PolarHBondContact O-N 2.76Å
632	K	32.4	Very low	29.2	Very low	129 Å²	129	98.2 Å²	98.2	56%	0.561	50%	0.503	S	S	*	.	S	Bend	trans	50.1	-17.8	160.6	-77.5	-173.8	-175.8	173.3	0	122.3	E587	E587-K632 IonicContact OE2-NZ 2.74Å; E587-K632 PolarHBondContact OE2-NZ 2.91Å
633	K	28.1	Very low	28.9	Very low	197 Å²	197	103.4 Å²	103.4	86%	0.857	53%	0.529	S	S	*	.			trans	-127.3	-4.4	-173.3	-81.8	-170.7	173.9	-176.6	0	116	H631 N635	H631-K633 VanDerWaalsContact C-N 3.26Å; H631-K633 PolarHBondContact O-N 2.76Å; K633-N635 PolarHBondContact O-N 2.91Å
634	L	28.4	Very low	28.7	Very low	110 Å²	110	100.2 Å²	100.2	58%	0.576	53%	0.525	S	S	*	.			trans	-86	95.3	175.4	-163.8	76.4	0	0	0	110.4	F630 V636	F630-L634 HydrophobicContact CD1-CD2 3.59Å; F630-L634 HydrophobicContact CE1-CD2 3.65Å; L634-V636 HydrophobicContact CD1-CG2 4.48Å; L634-V636 HydrophobicContact CD2-CB 4.47Å; L634-V636 HydrophobicContact CD2-CG2 3.96Å; L634-V636 HydrophobicContact CG-CG2 3.89Å; L634-V636 PolarHBondContact O-N 3.25Å
635	N	26	Very low	28.4	Very low	126 Å²	126	107.1 Å²	107.1	67%	0.674	55%	0.552	S	S	*	*			trans	-73.9	55.8	175.6	-89.4	-4.9	0	0	0	112.6	K633	K633-N635 PolarHBondContact O-N 2.91Å
636	V	29.2	Very low	27.8	Very low	71 Å²	71	110 Å²	110	43%	0.43	57%	0.566	S	S	.	*			trans	-94.9	104.3	167.3	176.4	0	0	0	0	108.2	L634 I638	L634-V636 HydrophobicContact CD1-CG2 4.48Å; L634-V636 HydrophobicContact CD2-CB 4.47Å; L634-V636 HydrophobicContact CD2-CG2 3.96Å; L634-V636 HydrophobicContact CG-CG2 3.89Å; L634-V636 PolarHBondContact O-N 3.25Å; V636-I638 VanDerWaalsContact C-N 3.28Å; V636-I638 HydrophobicContact CG1-CG1 3.76Å; V636-I638 PolarHBondContact O-N 2.72Å
637	A	26.3	Very low	27.4	Very low	63 Å²	63	110.5 Å²	110.5	52%	0.521	56%	0.563	S	S	.	*			trans	-72.4	81.2	172.6	0	0	0	0	0	110.3	T639	A637-T639 PolarHBondContact O-N 3.14Å; A637-T639 PolarHBondContact O-OG1 3.5Å
638	I	30	Very low	27.1	Very low	83 Å²	83	114.1 Å²	114.1	43%	0.426	58%	0.584	S	S	.	*			trans	-68.8	83.5	169.7	-51.6	-177.9	0	0	0	108	V636 F640 F645	V636-I638 VanDerWaalsContact C-N 3.28Å; V636-I638 HydrophobicContact CG1-CG1 3.76Å; V636-I638 PolarHBondContact O-N 2.72Å; I638-F640 HydrophobicContact CB-CE2 4.17Å; I638-F640 HydrophobicContact CG2-CD2 3.92Å; I638-F640 HydrophobicContact CG2-CE1 4.47Å; I638-F640 HydrophobicContact CG2-CE2 3.53Å; I638-F640 HydrophobicContact CG2-CZ 3.84Å; I638-F640 WeakPolarHBondContact O-CD2 3.18Å; I638-F640 PolarHBondContact O-N 2.81Å; I638-F640 VanDerWaalsContact O-N 3.11Å; I638-F645 HydrophobicContact CG2-CE1 4.11Å
639	T	25.3	Very low	26.8	Very low	78 Å²	78	115.8 Å²	115.8	48%	0.479	59%	0.589	S	S	.	*			trans	-79.3	97.1	-179.7	-47.9	0	0	0	0	108	A637 Y641	A637-T639 PolarHBondContact O-N 3.14Å; A637-T639 PolarHBondContact O-OG1 3.5Å; T639-Y641 HydrophobicContact CG2-CD2 3.66Å; T639-Y641 HydrophobicContact CG2-CE2 3.92Å; T639-Y641 PolarHBondContact O-N 2.94Å
640	F	26.7	Very low	26.7	Very low	165 Å²	165	122.7 Å²	122.7	72%	0.724	61%	0.612	S	S	*	*			trans	-68.3	73.3	177.9	-76	-88.8	0	0	0	111.8	I638	I638-F640 HydrophobicContact CB-CE2 4.17Å; I638-F640 HydrophobicContact CG2-CD2 3.92Å; I638-F640 HydrophobicContact CG2-CE1 4.47Å; I638-F640 HydrophobicContact CG2-CE2 3.53Å; I638-F640 HydrophobicContact CG2-CZ 3.84Å; I638-F640 WeakPolarHBondContact O-CD2 3.18Å; I638-F640 PolarHBondContact O-N 2.81Å; I638-F640 VanDerWaalsContact O-N 3.11Å
641	Y	24	Very low	26.4	Very low	196 Å²	196	127.1 Å²	127.1	77%	0.769	63%	0.631	S	S	*	*			trans	-81.2	162.8	160.7	-95.4	-82.5	0	0	0	110.9	T639 L643	T639-Y641 HydrophobicContact CG2-CD2 3.66Å; T639-Y641 HydrophobicContact CG2-CE2 3.92Å; T639-Y641 PolarHBondContact O-N 2.94Å; Y641-L643 PolarHBondContact O-N 2.97Å
642	K	24	Very low	26.1	Very low	142 Å²	142	131.9 Å²	131.9	62%	0.617	66%	0.656	S	S	*	*	S	Bend	trans	-78.1	12.3	-166	-134.9	171.3	-170.6	170	0	115.4	I739	K642-I739 WeakPolarHBondContact O-CD1 3.32Å
643	L	23.9	Very low	25.7	Very low	131 Å²	131	134.1 Å²	134.1	69%	0.686	67%	0.668	S	S	*	*	S	Bend	trans	-139.1	176.4	-179.5	-78.7	95.1	0	0	0	109.5	Y641 I739	Y641-L643 PolarHBondContact O-N 2.97Å; L643-I739 HydrophobicContact CG-CD1 4.12Å; L643-I739 HydrophobicContact CG-CG1 4.46Å
644	G	24	Very low	25.5	Very low	57 Å²	57	132.9 Å²	132.9	59%	0.588	67%	0.665	S	S	*	*	S	Bend	trans	-54.4	153.7	-168.9	0	0	0	0	0	116.4	I646	G644-I646 PolarHBondContact O-N 3.35Å
645	F	24.8	Very low	25.4	Very low	167 Å²	167	135.1 Å²	135.1	73%	0.732	68%	0.676	S	S	*	*			trans	-53.8	124.8	-177.2	-75.4	-98.4	0	0	0	113.1	I638	I638-F645 HydrophobicContact CG2-CE1 4.11Å
646	I	23.7	Very low	25.4	Very low	133 Å²	133	134.2 Å²	134.2	68%	0.682	67%	0.671	S	S	*	*			trans	-125.7	127.7	158.9	-54.5	179.3	0	0	0	106.9	G644 T648	G644-I646 PolarHBondContact O-N 3.35Å; I646-T648 HydrophobicContact CG2-CG2 3.91Å
647	I	24.8	Very low	25.4	Very low	119 Å²	119	138.5 Å²	138.5	61%	0.61	69%	0.692	S	S	*	*			trans	-85.6	111.9	167.7	-60.1	174.3	0	0	0	106.7
648	T	24.6	Very low	25.6	Very low	81 Å²	81	142.8 Å²	142.8	50%	0.497	71%	0.706	S	S	.	*			trans	-107.5	120.1	173.4	42.6	0	0	0	0	110.3	I646	I646-T648 HydrophobicContact CG2-CG2 3.91Å
649	E	26.5	Very low	25.6	Very low	165 Å²	165	142.2 Å²	142.2	77%	0.771	72%	0.721	S	S	*	*			trans	-69.2	129.4	162.1	-71.4	-167.1	128.2	0	0	109.4
650	H	27	Very low	25.9	Very low	180 Å²	180	145.1 Å²	145.1	83%	0.833	74%	0.738	S	S	*	*			trans	-96.8	115.6	163.3	-128.2	-78.4	0	0	0	108.5	M652	H650-M652 PolarHBondContact O-N 3.16Å
651	K	24.2	Very low	25.9	Very low	192 Å²	192	144.9 Å²	144.9	84%	0.835	74%	0.739	S	S	*	*			trans	-45.7	119.7	-176.3	-63.2	176.7	177.6	-179.1	0	111.9
652	M	24.3	Very low	26.1	Very low	184 Å²	184	141.3 Å²	141.3	91%	0.906	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-75.8	134.3	148.8	-66.9	-142.6	83.6	0	0	107.7	H650 Q654	H650-M652 PolarHBondContact O-N 3.16Å; M652-Q654 PolarHBondContact O-N 3.37Å
653	H	24.9	Very low	26.3	Very low	176 Å²	176	141.5 Å²	141.5	82%	0.815	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-67.1	131.7	171.7	-86.1	-79.3	0	0	0	109.7	I655	H653-I655 PolarHBondContact O-N 3.44Å
654	Q	23.8	Very low	26.3	Very low	171 Å²	171	142 Å²	142	80%	0.799	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-59.2	124.9	153.6	-70.1	170.1	-66.7	0	0	107.8	M652	M652-Q654 PolarHBondContact O-N 3.37Å
655	I	25.3	Very low	26.5	Very low	158 Å²	158	143.1 Å²	143.1	81%	0.81	77%	0.767	S	S	*	*			trans	-95.6	114.6	149.7	-63.1	177.3	0	0	0	103.6	H653	H653-I655 PolarHBondContact O-N 3.44Å
656	N	25.7	Very low	26.5	Very low	106 Å²	106	145 Å²	145	57%	0.567	78%	0.778	S	S	*	*			trans	-76.5	134.9	174.4	-63.6	4.9	0	0	0	108.6
657	D	30.4	Very low	26.6	Very low	162 Å²	162	143.3 Å²	143.3	87%	0.866	78%	0.784	S	S	*	*			trans	-121.5	129.3	142.1	-87.2	-52.3	0	0	0	105.6
658	D	29.8	Very low	26.6	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	80%	0.795	S	S	*	*			trans	-80.5	140.1	-164.8	-59.5	-58.1	0	0	0	112.7
659	G	29.5	Very low	26.7	Very low	71 Å²	71	148.1 Å²	148.1	73%	0.732	81%	0.812	S	S	*	*			trans	-156.9	24.9	-162.4	0	0	0	0	0	119.7
660	V	31.4	Very low	26.7	Very low	139 Å²	139	147.1 Å²	147.1	84%	0.842	81%	0.812	S	S	*	*			trans	61.3	97.4	163.5	-169.8	0	0	0	0	118.6
661	E	28.2	Very low	26.5	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.743	82%	0.816	S	S	*	*			trans	27.5	131.3	134.9	-70	-155	111.4	0	0	124.6
662	N	26.8	Very low	26.6	Very low	122 Å²	122	146.3 Å²	146.3	65%	0.652	81%	0.812	S	S	*	*			trans	60.5	117.8	133.1	-51.1	-23.8	0	0	0	119.6
663	T	28.5	Very low	26.5	Very low	145 Å²	145	145.3 Å²	145.3	89%	0.89	81%	0.81	S	S	*	*				-166.3	172.2	76	23.1	0	0	0	0	113.7
664	T	25.4	Very low	26.7	Very low	143 Å²	143	143.2 Å²	143.2	88%	0.877	81%	0.81	S	S	*	*			trans	-79.9	147.4	-171.9	50.2	0	0	0	0	115.8
665	G	27.4	Very low	26.7	Very low	80 Å²	80	139.8 Å²	139.8	83%	0.825	80%	0.804	S	S	*	*			trans	-171.6	118.4	161.3	0	0	0	0	0	113.5
666	E	24.4	Very low	26.7	Very low	206 Å²	206	140.2 Å²	140.2	96%	0.963	81%	0.808	S	S	*	*			trans	-85.7	133	171.2	-66	-174.7	117.9	0	0	111
667	A	26.2	Very low	27	Very low	98 Å²	98	140 Å²	140	81%	0.81	82%	0.822	S	S	*	*			trans	-154.5	145.7	161.7	0	0	0	0	0	112.3
668	N	24.5	Very low	26.8	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	82%	0.821	S	S	*	*			trans	-63.1	153	-177.5	-50.2	-65.6	0	0	0	114
669	V	27.7	Very low	26.9	Very low	144 Å²	144	143.5 Å²	143.5	87%	0.873	83%	0.827	S	S	*	*			trans	-136.3	134.4	155	-176.5	0	0	0	0	109
670	D	25.1	Very low	26.8	Very low	144 Å²	144	147.4 Å²	147.4	77%	0.77	83%	0.831	S	S	*	*			trans	-83.9	164.2	-174.2	-72.1	-70	0	0	0	114.8
671	Y	22.9	Very low	26.9	Very low	233 Å²	233	146.5 Å²	146.5	91%	0.914	83%	0.831	S	S	*	*			trans	-72.7	128.1	168.8	-92.2	-103.1	0	0	0	111.6
672	V	26.6	Very low	26.9	Very low	122 Å²	122	141.9 Å²	141.9	74%	0.739	83%	0.826	S	S	*	*			trans	-132.3	118.6	161.5	-172.5	0	0	0	0	109.9	V674	V672-V674 HydrophobicContact CG1-CG2 3.93Å
673	N	23.3	Very low	27	Very low	163 Å²	163	141.9 Å²	141.9	87%	0.872	84%	0.836	S	S	*	*			trans	-82.2	132.2	165.2	-93.9	-28.1	0	0	0	109.1
674	V	27.5	Very low	27.1	Very low	133 Å²	133	143.4 Å²	143.4	81%	0.806	83%	0.833	S	S	*	*			trans	-135.1	131	164.9	-172.6	0	0	0	0	109.5	V672	V672-V674 HydrophobicContact CG1-CG2 3.93Å
675	S	25	Very low	27.2	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	84%	0.835	S	S	*	*			trans	-105.3	143.2	172.8	52.3	0	0	0	0	110.9
676	D	25.4	Very low	27.3	Very low	167 Å²	167	144.9 Å²	144.9	89%	0.893	83%	0.828	S	S	*	*			trans	42.7	99.3	158.3	-59.4	-18.3	0	0	0	119.1
677	A	30.6	Very low	27.5	Very low	103 Å²	103	144.2 Å²	144.2	85%	0.851	83%	0.825	S	S	*	*			trans	-148.6	132.8	148.5	0	0	0	0	0	110.9
678	H	27	Very low	27.7	Very low	186 Å²	186	146.8 Å²	146.8	86%	0.861	82%	0.824	S	S	*	*			trans	-82.2	144.8	163.8	-78	-92.4	0	0	0	109.8
679	H	32.4	Very low	28	Very low	202 Å²	202	144.9 Å²	144.9	94%	0.935	82%	0.82	S	S	*	*			trans	-160.4	166	133.4	-112	-72.8	0	0	0	111.1
680	D	26.9	Very low	28	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	82%	0.816	S	S	*	*			trans	-137.4	125.2	-160	-171.4	11.1	0	0	0	111.6
681	S	32.9	Very low	28.1	Very low	119 Å²	119	147.1 Å²	147.1	83%	0.832	82%	0.819	S	S	*	*			trans	171.4	141.4	172.2	55.5	0	0	0	0	110.1
682	G	28	Very low	28.6	Very low	63 Å²	63	141 Å²	141	65%	0.649	81%	0.808	S	S	*	*			cis	152.4	120.9	-9.3	0	0	0	0	0	112.6
683	S	29.1	Very low	28.5	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	81%	0.809	S	S	*	*			trans	62.9	159.3	175.5	67.8	0	0	0	0	116.3
684	E	31.4	Very low	28.7	Very low	177 Å²	177	138 Å²	138	83%	0.827	80%	0.804	S	S	*	*			cis	-129.9	138.4	5.4	-73.5	-177.3	122.8	0	0	109.3
685	M	26.7	Very low	28.7	Very low	187 Å²	187	139.2 Å²	139.2	92%	0.921	81%	0.805	S	S	*	*				64.4	129.1	82.6	-72.9	-67.4	-71.3	0	0	117.1
686	G	29.4	Very low	28.7	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	81%	0.807	S	S	*	*			trans	141.7	61.2	179.3	0	0	0	0	0	115
687	E	29.9	Very low	28.9	Very low	191 Å²	191	141.8 Å²	141.8	89%	0.893	81%	0.806	S	S	*	*				92	149.9	105.9	-75.2	-158.9	148.7	0	0	116.6
688	I	29.9	Very low	28.7	Very low	152 Å²	152	143.1 Å²	143.1	78%	0.779	80%	0.799	S	S	*	*			trans	-146.9	129.5	-169.8	-55.7	171.6	0	0	0	112
689	P	29.9	Very low	28.9	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	80%	0.8	S	S	*	*			trans	-123.9	137.9	138.5	0	22.9	0	0	0	110.4
690	K	27.5	Very low	28.8	Very low	181 Å²	181	140 Å²	140	79%	0.787	79%	0.794	S	S	*	*				50.3	115.4	60.3	-62.4	-175.6	-178.6	176.5	0	111.3
691	D	28.5	Very low	28.7	Very low	154 Å²	154	136 Å²	136	82%	0.824	79%	0.789	S	S	*	*			cis	-161.2	-175.5	45.8	-120.2	10.1	0	0	0	112.4
692	P	31.8	Very low	28.6	Very low	105 Å²	105	140.9 Å²	140.9	68%	0.682	80%	0.795	S	S	*	*			trans	-105	179	-163.5	40.8	-38.2	0	0	0	117.1
693	S	25.7	Very low	28.4	Very low	111 Å²	111	148.7 Å²	148.7	78%	0.776	81%	0.805	S	S	*	*			trans	103.8	163.8	156.5	84.1	0	0	0	0	118.6
694	S	27.3	Very low	28.4	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	81%	0.805	S	S	*	*			trans	68.9	144.5	-165.1	84.7	0	0	0	0	114.3
695	L	27	Very low	28.1	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	80%	0.8	S	S	*	*			cis	-123.6	154.7	-2.9	-95.3	109.9	0	0	0	112.5
696	V	24.5	Very low	28.1	Very low	118 Å²	118	151.4 Å²	151.4	72%	0.715	80%	0.799	S	S	*	*			trans	-104.1	140.1	168.4	171.9	0	0	0	0	109.6
697	K	31.1	Very low	27.8	Very low	202 Å²	202	151.5 Å²	151.5	88%	0.878	80%	0.8	S	S	*	*			trans	-149.2	142.3	149.7	-110.8	161.2	-171.8	175.5	0	111
698	N	26.4	Very low	27.6	Very low	131 Å²	131	149.7 Å²	149.7	70%	0.701	80%	0.796	S	S	*	*			trans	-91	163.9	-169	-56	-56.5	0	0	0	112.5
699	I	31.5	Very low	27.4	Very low	171 Å²	171	147.8 Å²	147.8	88%	0.877	79%	0.791	S	S	*	*				-152.3	147.7	125.1	-101.3	149.3	0	0	0	109.3
700	N	28.7	Very low	27.1	Very low	152 Å²	152	147.5 Å²	147.5	81%	0.813	79%	0.792	S	S	*	*			trans	-84.5	157.8	-178	-57.3	-61.9	0	0	0	111.1
701	G	26.5	Very low	27.1	Very low	69 Å²	69	147 Å²	147	71%	0.711	80%	0.797	S	S	*	*			cis	123.8	139	-1.6	0	0	0	0	0	113.6
702	K	29.1	Very low	26.9	Very low	220 Å²	220	148.6 Å²	148.6	96%	0.957	80%	0.8	S	S	*	*			trans	-167.4	132.2	157.5	-112.3	165.9	-175.3	176.8	0	111.1
703	R	24.8	Very low	26.6	Very low	228 Å²	228	147.1 Å²	147.1	86%	0.86	80%	0.804	S	S	*	*			trans	-92.9	146	171.5	-73.1	172.5	165.7	171.8	-6.4	110.3
704	I	29.2	Very low	26.8	Very low	166 Å²	166	149 Å²	149	85%	0.851	81%	0.811	S	S	*	*			trans	-133.9	132	140.2	-61.9	-174.7	0	0	0	107.9
705	N	24.3	Very low	26.8	Very low	135 Å²	135	152.3 Å²	152.3	72%	0.722	81%	0.811	S	S	*	*			trans	-107.1	169.2	170.1	-97.5	-8.6	0	0	0	109
706	R	27.3	Very low	26.8	Very low	241 Å²	241	151.6 Å²	151.6	91%	0.909	81%	0.808	S	S	*	*			trans	93.4	131.8	-171.1	-56.6	156.4	-175.4	-172.8	0.6	110.8
707	G	24	Very low	27.2	Very low	69 Å²	69	154 Å²	154	71%	0.711	82%	0.817	S	S	*	*			cis	89.8	98.5	1.8	0	0	0	0	0	113.1
708	L	24.8	Very low	26.9	Very low	153 Å²	153	153.6 Å²	153.6	80%	0.801	82%	0.818	S	S	*	*			trans	174.8	114.2	168	-95	155.7	0	0	0	105.1
709	T	24.7	Very low	26.9	Very low	112 Å²	112	153.4 Å²	153.4	69%	0.687	83%	0.826	S	S	*	*				65	136.2	102.2	62	0	0	0	0	117.4
710	S	24.5	Very low	26.6	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	82%	0.818	S	S	*	*			trans	-30.8	138.3	166	51.5	0	0	0	0	117.1
711	L	27.7	Very low	26.6	Very low	171 Å²	171	150.6 Å²	150.6	90%	0.895	82%	0.819	S	S	*	*			trans	-149.8	120.6	152.8	-112.7	144.1	0	0	0	109.8
712	E	23.9	Very low	26.7	Very low	187 Å²	187	154.3 Å²	154.3	87%	0.874	82%	0.823	S	S	*	*			trans	-82.4	155.5	167.1	-65.7	174.3	102.9	0	0	110
713	G	25.5	Very low	26.5	Very low	75 Å²	75	153.1 Å²	153.1	77%	0.773	82%	0.818	S	S	*	*			trans	83.8	85.4	154	0	0	0	0	0	117.6
714	V	29.9	Very low	26.7	Very low	151 Å²	151	149.6 Å²	149.6	92%	0.915	82%	0.816	S	S	*	*			trans	-123.4	135.5	137.9	-177.9	0	0	0	0	107.2
715	K	27.1	Very low	26.8	Very low	179 Å²	179	149.6 Å²	149.6	78%	0.778	82%	0.818	S	S	*	*			trans	-90	160.1	-178.6	-74.7	-175.4	178.4	-179.7	0	112
716	D	27.2	Very low	27	Very low	143 Å²	143	152 Å²	152	77%	0.765	82%	0.824	S	S	*	*			trans	21.6	111.6	139.6	-45.3	-41.2	0	0	0	117.2
717	N	32	Very low	27.1	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	82%	0.817	S	S	*	*			trans	-145.8	136.9	138.7	-106.3	-33	0	0	0	109.6
718	Q	25.8	Very low	27.2	Very low	192 Å²	192	151.4 Å²	151.4	90%	0.897	82%	0.823	S	S	*	*			trans	-82.2	150.2	-178.7	-65.5	157.3	-85.1	0	0	110.2
719	C	27.2	Very low	27.4	Very low	128 Å²	128	151.3 Å²	151.3	87%	0.865	82%	0.823	S	S	*	*			trans	-137.9	115.7	153.7	-148.5	0	0	0	0	108.1
720	S	24.9	Very low	27.5	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	82%	0.824	S	S	*	*			trans	-93.6	147	175.5	48.5	0	0	0	0	110.2
721	I	28.4	Very low	27.6	Very low	161 Å²	161	153.4 Å²	153.4	83%	0.826	83%	0.825	S	S	*	*			trans	-151.6	152.7	155.6	-96.1	135	0	0	0	106.6
722	D	28.4	Very low	27.7	Very low	147 Å²	147	153.1 Å²	153.1	79%	0.786	82%	0.824	S	S	*	*			trans	-87.7	166	-145.1	-61.1	-81.7	0	0	0	117.2
723	F	25.8	Very low	28	Very low	195 Å²	195	152.3 Å²	152.3	86%	0.855	82%	0.821	S	S	*	*			trans	-80.3	133.2	156.6	-66.9	-104.8	0	0	0	108.8
724	N	28.5	Very low	28.2	Very low	154 Å²	154	157.2 Å²	157.2	82%	0.824	83%	0.829	S	S	*	*			trans	173.1	121.6	135.6	-87.2	-20.9	0	0	0	109.1
725	D	31.6	Very low	28.2	Very low	166 Å²	166	156.5 Å²	156.5	89%	0.888	82%	0.82	S	S	*	*			trans	174.9	118.4	134.1	-88	-15.5	0	0	0	107
726	E	27.6	Very low	28.3	Very low	185 Å²	185	153.2 Å²	153.2	86%	0.864	81%	0.811	S	S	*	*			trans	-92.4	176.7	171.2	-71.2	-167.7	128	0	0	110.4
727	D	28.6	Very low	28.2	Very low	142 Å²	142	151 Å²	151	76%	0.759	81%	0.806	S	S	*	*			trans	61.1	93.3	171.4	-62	-23.3	0	0	0	117.3
728	N	27.4	Very low	28.1	Very low	155 Å²	155	147 Å²	147	83%	0.829	78%	0.784	S	S	*	*				174.8	168.2	105.2	-94.1	-76.6	0	0	0	111.9
729	L	28.5	Very low	28.1	Very low	152 Å²	152	141.8 Å²	141.8	80%	0.796	76%	0.761	S	S	*	*			trans	70.4	88.4	177	-50.7	170.5	0	0	0	114.2
730	T	26.2	Very low	28.1	Very low	115 Å²	115	139.3 Å²	139.3	71%	0.706	74%	0.742	S	S	*	*				59.5	108.5	76.4	71.7	0	0	0	0	115.2
731	D	28.1	Very low	28.1	Very low	151 Å²	151	140.1 Å²	140.1	81%	0.807	73%	0.734	S	S	*	*			trans	35.1	105.1	148.1	-51.8	-19.5	0	0	0	119.4
732	D	29.9	Very low	28.1	Very low	165 Å²	165	139.3 Å²	139.3	88%	0.882	73%	0.732	S	S	*	*				-167.4	143.8	127.8	-101.7	-24.6	0	0	0	114.9
733	E	30	Very low	28.1	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	73%	0.729	S	S	*	*			trans	13.1	108.9	169.2	-51.4	-157.6	139.4	0	0	124.8	D735	E733-D735 PolarHBondContact O-N 2.95Å
734	D	30.4	Very low	28.3	Very low	177 Å²	177	135.9 Å²	135.9	95%	0.947	72%	0.722	S	S	*	*				48	33	107.4	-101.7	11.1	0	0	0	123.3
735	D	28.4	Very low	28.2	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	72%	0.717	S	S	*	*			trans	-105.6	64	174.6	-137.8	-21.2	0	0	0	115.6	E733 C737	E733-D735 PolarHBondContact O-N 2.95Å; D735-C737 VanDerWaalsContact C-N 3.28Å; D735-C737 PolarHBondContact O-N 2.95Å
736	D	29.9	Very low	28	Very low	110 Å²	110	133.1 Å²	133.1	59%	0.588	71%	0.706	S	S	*	*			trans	-70.4	70.4	178.8	-176.5	43.4	0	0	0	113.2	K171 I738	K171-D736 IonicContact NZ-OD2 2.67Å; K171-D736 PolarHBondContact NZ-OD2 3.23Å; D736-I738 VanDerWaalsContact C-N 3.3Å; D736-I738 PolarHBondContact O-N 3.3Å; D736-I738 WeakPolarHBondContact OD2-CD1 3.41Å
737	C	25	Very low	28.1	Very low	95 Å²	95	129.9 Å²	129.9	64%	0.642	70%	0.697	S	S	*	*			trans	-74	63.4	-170.1	-116.3	0	0	0	0	114.8	D735 I739	D735-C737 VanDerWaalsContact C-N 3.28Å; D735-C737 PolarHBondContact O-N 2.95Å; C737-I739 PolarHBondContact O-N 3.46Å
738	I	28.9	Very low	28	Very low	87 Å²	87	129.1 Å²	129.1	45%	0.446	69%	0.692	S	S	.	*			trans	-79.2	109.2	-178.2	-60.9	177.8	0	0	0	112.4	D736 T740	D736-I738 VanDerWaalsContact C-N 3.3Å; D736-I738 PolarHBondContact O-N 3.3Å; D736-I738 WeakPolarHBondContact OD2-CD1 3.41Å; I738-T740 HydrophobicContact CG2-CG2 4.46Å; I738-T740 PolarHBondContact O-N 3.13Å
739	I	25.6	Very low	28.1	Very low	82 Å²	82	127.2 Å²	127.2	42%	0.421	68%	0.683	S	S	.	*			trans	-63.7	110.4	178.2	-55.8	156.3	0	0	0	111.6	K642 L643 C737 E741	K642-I739 WeakPolarHBondContact O-CD1 3.32Å; L643-I739 HydrophobicContact CG-CD1 4.12Å; L643-I739 HydrophobicContact CG-CG1 4.46Å; C737-I739 PolarHBondContact O-N 3.46Å; I739-E741 HydrophobicContact CG2-CG 4.15Å
740	T	27.8	Very low	28.1	Very low	75 Å²	75	125.3 Å²	125.3	46%	0.46	67%	0.674	S	S	.	*			trans	-119.4	75.3	171.8	47.9	0	0	0	0	111.4	I738 N742	I738-T740 HydrophobicContact CG2-CG2 4.46Å; I738-T740 PolarHBondContact O-N 3.13Å; T740-N742 PolarHBondContact O-N 3.35Å
741	E	26.3	Very low	28.2	Very low	120 Å²	120	126.2 Å²	126.2	56%	0.561	67%	0.671	S	S	*	*			trans	-55.4	118.9	161.4	-64.6	163.2	139	0	0	109	I739	I739-E741 HydrophobicContact CG2-CG 4.15Å
742	N	28.5	Very low	28.2	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	66%	0.659	S	S	*	*			trans	-166.7	0	-174.2	-148.9	5.3	0	0	0	110	R577 T740	R577-N742 PolarHBondContact NH1-OD1 3.42Å; R577-N742 PolarHBondContact NH1-OXT 2.77Å; R577-N742 PolarHBondContact NH2-ND2 3.4Å; T740-N742 PolarHBondContact O-N 3.35Å

Retrieved 742 of 742 residues in 666.3 ms (Link to these results)

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