A0A077Z6A1_TRITR Loading...

C2 and FYVE 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6A1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 505 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	39.4	Very low	51.3	Low	132 Å²	132	107 Å²	107	65%	0.65	53%	0.534	S	S	*	.				0	-29.9	0	-88.5	-178.9	175.2	0	0	111.9	K5	M1-K5 PolarHBondContact O-N 2.81Å
2	D	45.4	Very low	51	Low	110 Å²	110	103.4 Å²	103.4	59%	0.588	55%	0.545	S	S	*	.	H	α-helix	trans	-78.7	-29.4	-167.1	-50	-58.8	0	0	0	114.6	W4 K5 S6	D2-W4 VanDerWaalsContact C-N 3.34Å; D2-W4 PolarHBondContact O-N 3.04Å; D2-K5 PolarHBondContact O-N 2.79Å; D2-K5 IonicContact OD1-NZ 3.24Å; D2-S6 WeakPolarHBondContact O-CB 3.4Å; D2-S6 PolarHBondContact O-N 2.97Å
3	S	47	Very low	51.3	Low	95 Å²	95	96.9 Å²	96.9	66%	0.664	52%	0.515	S	S	*	.	H	α-helix	trans	-59.2	-41.6	173.8	-178.5	0	0	0	0	112.7	S6 Y7	S3-S6 WeakPolarHBondContact O-CB 3.11Å; S3-S6 PolarHBondContact O-N 3.11Å; S3-Y7 PolarHBondContact O-N 3.16Å
4	W	43.5	Very low	51.7	Low	148 Å²	148	103 Å²	103	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-80.9	-28.2	-179.5	-70.2	101.7	0	0	0	113.9	D2 S6 Y7 A8 M25	D2-W4 VanDerWaalsContact C-N 3.34Å; D2-W4 PolarHBondContact O-N 3.04Å; W4-S6 VanDerWaalsContact C-N 3.35Å; W4-Y7 AromaticContact CE3-CD1 3.96Å; W4-Y7 HydrophobicContact CE3-CD1 3.96Å; W4-Y7 HydrophobicContact CE3-CG 4.14Å; W4-Y7 AromaticContact CZ3-CD1 3.98Å; W4-Y7 HydrophobicContact CZ3-CD1 3.98Å; W4-Y7 HydrophobicContact CZ3-CE1 4.25Å; W4-Y7 HydrophobicContact CZ3-CG 4.26Å; W4-Y7 PolarHBondContact O-N 3.06Å; W4-A8 WeakPolarHBondContact O-CB 3.35Å; W4-A8 PolarHBondContact O-N 3.22Å; W4-M25 HydrophobicContact CB-CE 4.38Å; W4-M25 HydrophobicContact CB-SD 4.48Å; W4-M25 HydrophobicContact CG-CE 4.15Å
5	K	51.5	Low	51.9	Low	119 Å²	119	102.3 Å²	102.3	52%	0.517	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-46.1	167.5	-71.9	178.8	-171.7	162.1	0	110.1	M1 D2 Y7 A8 T9	M1-K5 PolarHBondContact O-N 2.81Å; D2-K5 PolarHBondContact O-N 2.79Å; D2-K5 IonicContact OD1-NZ 3.24Å; K5-Y7 VanDerWaalsContact C-N 3.32Å; K5-Y7 PolarHBondContact O-N 3.19Å; K5-A8 PolarHBondContact O-N 2.74Å; K5-T9 WeakPolarHBondContact O-CB 3.41Å; K5-T9 PolarHBondContact O-N 2.84Å; K5-T9 PolarHBondContact O-OG1 2.68Å
6	S	57.5	Low	51.5	Low	59 Å²	59	102.7 Å²	102.7	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-58.8	-43.6	174.4	-174.8	0	0	0	0	111.3	D2 S3 W4 T9 K10	D2-S6 WeakPolarHBondContact O-CB 3.4Å; D2-S6 PolarHBondContact O-N 2.97Å; S3-S6 WeakPolarHBondContact O-CB 3.11Å; S3-S6 PolarHBondContact O-N 3.11Å; W4-S6 VanDerWaalsContact C-N 3.35Å; S6-T9 PolarHBondContact O-N 3.27Å; S6-K10 VanDerWaalsContact O-CB 3.27Å; S6-K10 WeakPolarHBondContact O-CB 3.37Å; S6-K10 WeakPolarHBondContact O-CG 3.27Å; S6-K10 PolarHBondContact O-N 3.32Å
7	Y	51.9	Low	51.4	Low	135 Å²	135	98.5 Å²	98.5	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-46	174.9	-173.6	-92.7	0	0	0	113.2	S3 W4 K5 T9 K10 N11	S3-Y7 PolarHBondContact O-N 3.16Å; W4-Y7 AromaticContact CE3-CD1 3.96Å; W4-Y7 HydrophobicContact CE3-CD1 3.96Å; W4-Y7 HydrophobicContact CE3-CG 4.14Å; W4-Y7 AromaticContact CZ3-CD1 3.98Å; W4-Y7 HydrophobicContact CZ3-CD1 3.98Å; W4-Y7 HydrophobicContact CZ3-CE1 4.25Å; W4-Y7 HydrophobicContact CZ3-CG 4.26Å; W4-Y7 PolarHBondContact O-N 3.06Å; K5-Y7 VanDerWaalsContact C-N 3.32Å; K5-Y7 PolarHBondContact O-N 3.19Å; Y7-T9 PolarHBondContact O-N 2.83Å; Y7-K10 PolarHBondContact O-N 3.47Å; Y7-N11 WeakPolarHBondContact CD2-ND2 3.47Å; Y7-N11 WeakPolarHBondContact CE1-ND2 3.48Å; Y7-N11 WeakPolarHBondContact CE2-ND2 3.46Å; Y7-N11 VanDerWaalsContact CZ-ND2 3.3Å; Y7-N11 WeakPolarHBondContact O-CB 3.34Å; Y7-N11 PolarHBondContact O-N 3.49Å; Y7-N11 PolarHBondContact O-ND2 3.4Å
8	A	52.5	Low	51.4	Low	8 Å²	8	97.4 Å²	97.4	7%	0.066	50%	0.5	C	S	.	.	H	α-helix	trans	-66.1	-37.8	179.8	0	0	0	0	0	112	W4 K5 G12 A13 Q18	W4-A8 WeakPolarHBondContact O-CB 3.35Å; W4-A8 PolarHBondContact O-N 3.22Å; K5-A8 PolarHBondContact O-N 2.74Å; A8-G12 PolarHBondContact O-N 3.33Å; A8-A13 HydrophobicContact CB-CB 3.95Å; A8-A13 VanDerWaalsContact O-CB 3.23Å; A8-A13 WeakPolarHBondContact O-CB 3.25Å; A8-A13 PolarHBondContact O-N 2.86Å; A8-Q18 HydrophobicContact CB-CG 4.25Å
9	T	61.6	Low	51.3	Low	97 Å²	97	102.3 Å²	102.3	60%	0.595	51%	0.511	S	S	*	.	H	α-helix	trans	-69.6	-44.2	174.3	-53	0	0	0	0	111.4	K5 S6 Y7 N11 G12	K5-T9 WeakPolarHBondContact O-CB 3.41Å; K5-T9 PolarHBondContact O-N 2.84Å; K5-T9 PolarHBondContact O-OG1 2.68Å; S6-T9 PolarHBondContact O-N 3.27Å; Y7-T9 PolarHBondContact O-N 2.83Å; T9-N11 VanDerWaalsContact C-N 3.26Å; T9-N11 PolarHBondContact O-N 3.39Å; T9-G12 PolarHBondContact O-N 3.38Å
10	K	62.2	Low	51	Low	173 Å²	173	97.9 Å²	97.9	75%	0.752	49%	0.49	S	S	*	.	H	α-helix	trans	-61.7	-31.7	177	-83.9	-174.7	175	-174.3	0	113.2	S6 Y7	S6-K10 VanDerWaalsContact O-CB 3.27Å; S6-K10 WeakPolarHBondContact O-CB 3.37Å; S6-K10 WeakPolarHBondContact O-CG 3.27Å; S6-K10 PolarHBondContact O-N 3.32Å; Y7-K10 PolarHBondContact O-N 3.47Å
11	N	51.9	Low	51	Low	101 Å²	101	95.3 Å²	95.3	54%	0.54	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	16.3	-176.5	-66.4	-70	0	0	0	114	Y7 T9 A13	Y7-N11 WeakPolarHBondContact CD2-ND2 3.47Å; Y7-N11 WeakPolarHBondContact CE1-ND2 3.48Å; Y7-N11 WeakPolarHBondContact CE2-ND2 3.46Å; Y7-N11 VanDerWaalsContact CZ-ND2 3.3Å; Y7-N11 WeakPolarHBondContact O-CB 3.34Å; Y7-N11 PolarHBondContact O-N 3.49Å; Y7-N11 PolarHBondContact O-ND2 3.4Å; T9-N11 VanDerWaalsContact C-N 3.26Å; T9-N11 PolarHBondContact O-N 3.39Å; N11-A13 VanDerWaalsContact C-N 3.34Å; N11-A13 PolarHBondContact O-N 2.93Å
12	G	48.1	Very low	51.4	Low	64 Å²	64	95.3 Å²	95.3	66%	0.66	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	30.1	172.1	0	0	0	0	0	114.9	A8 T9 R14	A8-G12 PolarHBondContact O-N 3.33Å; T9-G12 PolarHBondContact O-N 3.38Å; G12-R14 PolarHBondContact O-N 3Å
13	A	54.1	Low	51.5	Low	19 Å²	19	93.2 Å²	93.2	16%	0.157	47%	0.465	C	S	.	.			trans	-60.8	124	177.3	0	0	0	0	0	111	A8 N11 L17 Q18	A8-A13 HydrophobicContact CB-CB 3.95Å; A8-A13 VanDerWaalsContact O-CB 3.23Å; A8-A13 WeakPolarHBondContact O-CB 3.25Å; A8-A13 PolarHBondContact O-N 2.86Å; N11-A13 VanDerWaalsContact C-N 3.34Å; N11-A13 PolarHBondContact O-N 2.93Å; A13-L17 HydrophobicContact CB-CB 4.32Å; A13-L17 HydrophobicContact CB-CD2 3.78Å; A13-L17 HydrophobicContact CB-CG 4.37Å; A13-Q18 HydrophobicContact CB-CG 4.12Å
14	R	57.2	Low	51.4	Low	182 Å²	182	89.4 Å²	89.4	69%	0.687	44%	0.437	S	S	*	.			trans	-58.1	152.1	174.6	-70	-172.6	179	-165.2	-0.2	110.7	G12 F16 L17 Q18	G12-R14 PolarHBondContact O-N 3Å; R14-F16 PolarHBondContact O-N 3.47Å; R14-L17 WeakPolarHBondContact O-CB 3.42Å; R14-L17 PolarHBondContact O-N 3.34Å; R14-Q18 PolarHBondContact O-N 3.28Å; R14-Q18 VanDerWaalsContact O-N 3.11Å
15	P	54.5	Low	51.4	Low	92 Å²	92	85.5 Å²	85.5	60%	0.597	43%	0.425	S	S	*	.	H	α-helix	trans	-52.6	-30.5	179.1	-28.5	34.6	0	0	0	114.6	R19	P15-R19 WeakPolarHBondContact O-CG 3.33Å; P15-R19 PolarHBondContact O-N 2.98Å; P15-R19 VanDerWaalsContact O-N 3.16Å
16	F	46.6	Very low	50.8	Low	109 Å²	109	84.6 Å²	84.6	48%	0.478	42%	0.424	S	S	.	.	H	α-helix	trans	-65.1	-46.9	173.5	-177	-98.9	0	0	0	112.4	R14 Q18 R19 C20	R14-F16 PolarHBondContact O-N 3.47Å; F16-Q18 VanDerWaalsContact C-N 3.34Å; F16-Q18 PolarHBondContact O-N 3.47Å; F16-R19 WeakPolarHBondContact O-CB 3.35Å; F16-R19 PolarHBondContact O-N 2.85Å; F16-R19 VanDerWaalsContact O-N 3.09Å; F16-C20 VanDerWaalsContact CE1-SG 3.59Å; F16-C20 PolarHBondContact O-N 2.84Å; F16-C20 PolarHBondContact O-SG 2.93Å
17	L	49.3	Very low	50.1	Low	32 Å²	32	87 Å²	87	17%	0.168	43%	0.427	C	S	.	.	H	α-helix	trans	-63.6	-39.8	178	-168.4	70.8	0	0	0	111.1	A13 R14 R19 C20 I21 P378 E400	A13-L17 HydrophobicContact CB-CB 4.32Å; A13-L17 HydrophobicContact CB-CD2 3.78Å; A13-L17 HydrophobicContact CB-CG 4.37Å; R14-L17 WeakPolarHBondContact O-CB 3.42Å; R14-L17 PolarHBondContact O-N 3.34Å; L17-R19 VanDerWaalsContact C-N 3.29Å; L17-R19 PolarHBondContact O-N 2.95Å; L17-C20 PolarHBondContact O-N 2.84Å; L17-I21 HydrophobicContact CG-CD1 4.03Å; L17-I21 WeakPolarHBondContact O-CB 3.46Å; L17-I21 VanDerWaalsContact O-CG1 3.26Å; L17-I21 WeakPolarHBondContact O-CG1 3.26Å; L17-I21 PolarHBondContact O-N 3.35Å; L17-P378 HydrophobicContact CD1-CG 3.53Å; L17-E400 VanDerWaalsContact CD1-OE2 3.27Å; L17-E400 WeakPolarHBondContact CD1-OE2 3.5Å
18	Q	51.6	Low	49.9	Very low	79 Å²	79	82.9 Å²	82.9	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-36.9	173.2	-72.3	-176.1	-17.9	0	0	112.7	A8 A13 R14 F16 K22	A8-Q18 HydrophobicContact CB-CG 4.25Å; A13-Q18 HydrophobicContact CB-CG 4.12Å; R14-Q18 PolarHBondContact O-N 3.28Å; R14-Q18 VanDerWaalsContact O-N 3.11Å; F16-Q18 VanDerWaalsContact C-N 3.34Å; F16-Q18 PolarHBondContact O-N 3.47Å; Q18-K22 WeakPolarHBondContact O-CB 3.47Å; Q18-K22 PolarHBondContact O-N 3.16Å; Q18-K22 VanDerWaalsContact O-N 3.1Å
19	R	48.4	Very low	49.5	Very low	189 Å²	189	86.9 Å²	86.9	71%	0.713	44%	0.438	S	S	*	.	H	α-helix	trans	-68.7	-44.2	174.1	-73.1	177.5	-176	-174.8	2.5	111.4	P15 F16 L17 K22 V23	P15-R19 WeakPolarHBondContact O-CG 3.33Å; P15-R19 PolarHBondContact O-N 2.98Å; P15-R19 VanDerWaalsContact O-N 3.16Å; F16-R19 WeakPolarHBondContact O-CB 3.35Å; F16-R19 PolarHBondContact O-N 2.85Å; F16-R19 VanDerWaalsContact O-N 3.09Å; L17-R19 VanDerWaalsContact C-N 3.29Å; L17-R19 PolarHBondContact O-N 2.95Å; R19-K22 PolarHBondContact O-N 3.45Å; R19-V23 WeakPolarHBondContact O-CG2 3.34Å; R19-V23 PolarHBondContact O-N 2.84Å
20	C	46.2	Very low	48.7	Very low	14 Å²	14	87.9 Å²	87.9	10%	0.095	43%	0.431	C	S	.	.	H	α-helix	trans	-61.1	-48.7	177	-66.7	0	0	0	0	111.7	F16 L17 K22 V23 H24 C376	F16-C20 VanDerWaalsContact CE1-SG 3.59Å; F16-C20 PolarHBondContact O-N 2.84Å; F16-C20 PolarHBondContact O-SG 2.93Å; L17-C20 PolarHBondContact O-N 2.84Å; C20-K22 VanDerWaalsContact C-N 3.28Å; C20-K22 PolarHBondContact O-N 2.99Å; C20-V23 PolarHBondContact O-N 3.15Å; C20-V23 VanDerWaalsContact O-N 3.1Å; C20-H24 WeakPolarHBondContact O-CB 3.43Å; C20-H24 PolarHBondContact O-N 3.06Å; C20-C376 PolarHBondContact SG-O 2.64Å
21	I	50.7	Low	48.2	Very low	45 Å²	45	84.7 Å²	84.7	23%	0.231	42%	0.415	C	S	.	.	H	α-helix	trans	-57.2	-42.1	175.5	-67.1	166	0	0	0	110.9	L17 V23 H24 M25	L17-I21 HydrophobicContact CG-CD1 4.03Å; L17-I21 WeakPolarHBondContact O-CB 3.46Å; L17-I21 VanDerWaalsContact O-CG1 3.26Å; L17-I21 WeakPolarHBondContact O-CG1 3.26Å; L17-I21 PolarHBondContact O-N 3.35Å; I21-V23 PolarHBondContact O-N 3.2Å; I21-H24 WeakPolarHBondContact O-CB 3.45Å; I21-H24 PolarHBondContact O-N 3.15Å; I21-M25 HydrophobicContact CG2-CG 4.32Å; I21-M25 HydrophobicContact CG2-SD 4.19Å; I21-M25 WeakPolarHBondContact O-CB 3.44Å; I21-M25 VanDerWaalsContact O-CG 3.25Å; I21-M25 WeakPolarHBondContact O-CG 3.42Å; I21-M25 PolarHBondContact O-N 3.34Å
22	K	47.8	Very low	48.3	Very low	131 Å²	131	87.9 Å²	87.9	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-63.8	-41.7	178.2	-168.4	175.2	-177.5	179.9	0	111.8	Q18 R19 C20 M26	Q18-K22 WeakPolarHBondContact O-CB 3.47Å; Q18-K22 PolarHBondContact O-N 3.16Å; Q18-K22 VanDerWaalsContact O-N 3.1Å; R19-K22 PolarHBondContact O-N 3.45Å; C20-K22 VanDerWaalsContact C-N 3.28Å; C20-K22 PolarHBondContact O-N 2.99Å; K22-M26 VanDerWaalsContact O-CG 3.23Å; K22-M26 WeakPolarHBondContact O-CG 3.37Å; K22-M26 PolarHBondContact O-N 2.82Å
23	V	46.7	Very low	48.5	Very low	66 Å²	66	89.1 Å²	89.1	40%	0.4	41%	0.41	S	S	.	.	H	α-helix	trans	-67.1	-48.6	176.9	173.6	0	0	0	0	110.7	R19 C20 I21 M25 M26 F27	R19-V23 WeakPolarHBondContact O-CG2 3.34Å; R19-V23 PolarHBondContact O-N 2.84Å; C20-V23 PolarHBondContact O-N 3.15Å; C20-V23 VanDerWaalsContact O-N 3.1Å; I21-V23 PolarHBondContact O-N 3.2Å; V23-M25 VanDerWaalsContact C-N 3.35Å; V23-M25 PolarHBondContact O-N 3.04Å; V23-M26 WeakPolarHBondContact O-CB 3.3Å; V23-M26 PolarHBondContact O-N 2.95Å; V23-F27 HydrophobicContact CG1-CD2 3.66Å; V23-F27 HydrophobicContact CG1-CE2 3.49Å; V23-F27 VanDerWaalsContact CG1-CE2 3.49Å; V23-F27 VanDerWaalsContact O-CD2 3.25Å; V23-F27 WeakPolarHBondContact O-CD2 3.37Å; V23-F27 PolarHBondContact O-N 2.9Å
24	H	46.6	Very low	48.7	Very low	16 Å²	16	90.8 Å²	90.8	7%	0.074	42%	0.415	C	S	.	.	H	α-helix	trans	-48.9	-52.2	172.7	-174.8	166.7	0	0	0	111	C20 I21 M26 F27 C28 E400 V402 L431	C20-H24 WeakPolarHBondContact O-CB 3.43Å; C20-H24 PolarHBondContact O-N 3.06Å; I21-H24 WeakPolarHBondContact O-CB 3.45Å; I21-H24 PolarHBondContact O-N 3.15Å; H24-M26 PolarHBondContact O-N 3.29Å; H24-F27 PolarHBondContact O-N 3.25Å; H24-C28 PolarHBondContact O-N 3.45Å; H24-E400 IonicContact CE1-OE1 3.81Å; H24-E400 IonicContact CG-OE1 2.82Å; H24-E400 IonicContact ND1-OE1 2.83Å; H24-E400 PolarHBondContact ND1-OE1 2.99Å; H24-V402 HydrophobicContact CB-CG1 3.77Å; H24-V402 HydrophobicContact CB-CG2 4.41Å; H24-L431 WeakPolarHBondContact NE2-CD1 3.23Å
25	M	43	Very low	49	Very low	65 Å²	65	84.4 Å²	84.4	32%	0.32	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-36	177.6	-70.7	-172.7	103.4	0	0	113.3	W4 I21 V23 N29	W4-M25 HydrophobicContact CB-CE 4.38Å; W4-M25 HydrophobicContact CB-SD 4.48Å; W4-M25 HydrophobicContact CG-CE 4.15Å; I21-M25 HydrophobicContact CG2-CG 4.32Å; I21-M25 HydrophobicContact CG2-SD 4.19Å; I21-M25 WeakPolarHBondContact O-CB 3.44Å; I21-M25 VanDerWaalsContact O-CG 3.25Å; I21-M25 WeakPolarHBondContact O-CG 3.42Å; I21-M25 PolarHBondContact O-N 3.34Å; V23-M25 VanDerWaalsContact C-N 3.35Å; V23-M25 PolarHBondContact O-N 3.04Å; M25-N29 VanDerWaalsContact O-CB 3.23Å; M25-N29 WeakPolarHBondContact O-CB 3.26Å; M25-N29 PolarHBondContact O-N 2.94Å
26	M	38.6	Very low	49.3	Very low	101 Å²	101	88 Å²	88	50%	0.498	39%	0.394	S	S	.	.	H	α-helix	trans	-65.4	-40	175.8	-73.8	178.2	84.8	0	0	111.4	K22 V23 H24 W30	K22-M26 VanDerWaalsContact O-CG 3.23Å; K22-M26 WeakPolarHBondContact O-CG 3.37Å; K22-M26 PolarHBondContact O-N 2.82Å; V23-M26 WeakPolarHBondContact O-CB 3.3Å; V23-M26 PolarHBondContact O-N 2.95Å; H24-M26 PolarHBondContact O-N 3.29Å; M26-W30 VanDerWaalsContact O-CB 3.24Å; M26-W30 WeakPolarHBondContact O-CB 3.32Å; M26-W30 PolarHBondContact O-N 3.32Å
27	F	42	Very low	50.2	Low	108 Å²	108	88.3 Å²	88.3	47%	0.474	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-47.7	174.3	-82	-73.6	0	0	0	112	V23 H24 N29 W30 Y31	V23-F27 HydrophobicContact CG1-CD2 3.66Å; V23-F27 HydrophobicContact CG1-CE2 3.49Å; V23-F27 VanDerWaalsContact CG1-CE2 3.49Å; V23-F27 VanDerWaalsContact O-CD2 3.25Å; V23-F27 WeakPolarHBondContact O-CD2 3.37Å; V23-F27 PolarHBondContact O-N 2.9Å; H24-F27 PolarHBondContact O-N 3.25Å; F27-N29 VanDerWaalsContact C-N 3.33Å; F27-N29 PolarHBondContact O-N 2.82Å; F27-W30 PolarHBondContact O-N 2.94Å; F27-Y31 VanDerWaalsContact O-CB 3.26Å; F27-Y31 WeakPolarHBondContact O-CB 3.33Å; F27-Y31 PolarHBondContact O-N 3.29Å
28	C	47.7	Very low	51	Low	49 Å²	49	87.3 Å²	87.3	33%	0.331	39%	0.391	S	S	.	.	H	α-helix	trans	-59.6	-43.3	176.7	-73.5	0	0	0	0	112	H24 W32	H24-C28 PolarHBondContact O-N 3.45Å; C28-W32 VanDerWaalsContact O-CB 3.26Å; C28-W32 WeakPolarHBondContact O-CB 3.47Å; C28-W32 VanDerWaalsContact O-CD1 3.3Å; C28-W32 PolarHBondContact O-N 3.38Å
29	N	45.5	Very low	52	Low	92 Å²	92	85.5 Å²	85.5	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-68	-41.6	178.8	-165.4	20.4	0	0	0	111.4	M25 F27 W32 I33	M25-N29 VanDerWaalsContact O-CB 3.23Å; M25-N29 WeakPolarHBondContact O-CB 3.26Å; M25-N29 PolarHBondContact O-N 2.94Å; F27-N29 VanDerWaalsContact C-N 3.33Å; F27-N29 PolarHBondContact O-N 2.82Å; N29-W32 PolarHBondContact O-N 2.98Å; N29-I33 WeakPolarHBondContact O-CB 3.45Å; N29-I33 WeakPolarHBondContact O-CD1 3.49Å; N29-I33 WeakPolarHBondContact O-CG1 3.35Å; N29-I33 PolarHBondContact O-N 3.39Å
30	W	45.1	Very low	53.1	Low	119 Å²	119	79.7 Å²	79.7	45%	0.451	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-46.7	175.6	-179.4	77.3	0	0	0	111.8	M26 F27 I33 H34	M26-W30 VanDerWaalsContact O-CB 3.24Å; M26-W30 WeakPolarHBondContact O-CB 3.32Å; M26-W30 PolarHBondContact O-N 3.32Å; F27-W30 PolarHBondContact O-N 2.94Å; W30-I33 PolarHBondContact O-N 3Å; W30-H34 WeakPolarHBondContact O-CB 3.46Å; W30-H34 PolarHBondContact O-N 2.84Å
31	Y	51.9	Low	54.4	Low	105 Å²	105	82.9 Å²	82.9	41%	0.412	38%	0.379	S	S	.	.	H	α-helix	trans	-63.8	-44.4	178	-168.1	-93.5	0	0	0	111.4	F27 H34 F35 K115 S116	F27-Y31 VanDerWaalsContact O-CB 3.26Å; F27-Y31 WeakPolarHBondContact O-CB 3.33Å; F27-Y31 PolarHBondContact O-N 3.29Å; Y31-H34 PolarHBondContact O-N 3.38Å; Y31-F35 WeakPolarHBondContact O-CB 3.24Å; Y31-F35 PolarHBondContact O-N 2.84Å; Y31-K115 PolarHBondContact OH-O 3.45Å; Y31-S116 VanDerWaalsContact OH-CA 3.29Å; Y31-S116 WeakPolarHBondContact OH-CA 3.5Å
32	W	52.1	Low	55.6	Low	169 Å²	169	81.4 Å²	81.4	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-62	-43.4	176.4	-94.9	116.4	0	0	0	113.2	C28 N29 F35 R36	C28-W32 VanDerWaalsContact O-CB 3.26Å; C28-W32 WeakPolarHBondContact O-CB 3.47Å; C28-W32 VanDerWaalsContact O-CD1 3.3Å; C28-W32 PolarHBondContact O-N 3.38Å; N29-W32 PolarHBondContact O-N 2.98Å; W32-F35 HydrophobicContact CE3-CD1 4.11Å; W32-F35 AromaticContact CZ3-CD1 3.9Å; W32-F35 HydrophobicContact CZ3-CD1 3.9Å; W32-F35 HydrophobicContact CZ3-CE1 4.23Å; W32-R36 WeakPolarHBondContact O-CB 3.23Å; W32-R36 PolarHBondContact O-N 3.38Å
33	I	54.1	Low	57	Low	89 Å²	89	78 Å²	78	46%	0.456	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-46.6	178	-69.1	164	0	0	0	110.2	N29 W30 R36 Q37	N29-I33 WeakPolarHBondContact O-CB 3.45Å; N29-I33 WeakPolarHBondContact O-CD1 3.49Å; N29-I33 WeakPolarHBondContact O-CG1 3.35Å; N29-I33 PolarHBondContact O-N 3.39Å; W30-I33 PolarHBondContact O-N 3Å; I33-R36 PolarHBondContact O-N 3.08Å; I33-Q37 WeakPolarHBondContact O-CG 3.3Å; I33-Q37 PolarHBondContact O-N 3.44Å
34	H	56.8	Low	58.5	Low	54 Å²	54	80.8 Å²	80.8	25%	0.25	36%	0.363	C	S	.	.	H	α-helix	trans	-68.4	-42.8	-178.9	-167.7	-99	0	0	0	111.9	W30 Y31 R36 Q37 L38	W30-H34 WeakPolarHBondContact O-CB 3.46Å; W30-H34 PolarHBondContact O-N 2.84Å; Y31-H34 PolarHBondContact O-N 3.38Å; H34-R36 PolarHBondContact O-N 3.03Å; H34-Q37 PolarHBondContact O-N 2.98Å; H34-L38 PolarHBondContact O-N 2.93Å
35	F	63.9	Low	60.2	Low	48 Å²	48	82.2 Å²	82.2	21%	0.211	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-42.5	176.3	179.5	-113	0	0	0	112	Y31 W32 Q37 L38 V39 I112	Y31-F35 WeakPolarHBondContact O-CB 3.24Å; Y31-F35 PolarHBondContact O-N 2.84Å; W32-F35 HydrophobicContact CE3-CD1 4.11Å; W32-F35 AromaticContact CZ3-CD1 3.9Å; W32-F35 HydrophobicContact CZ3-CD1 3.9Å; W32-F35 HydrophobicContact CZ3-CE1 4.23Å; F35-Q37 VanDerWaalsContact C-N 3.33Å; F35-Q37 PolarHBondContact O-N 3.13Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 2.97Å; F35-L38 VanDerWaalsContact O-N 3.16Å; F35-V39 HydrophobicContact CD1-CG2 4.29Å; F35-V39 HydrophobicContact CD2-CG2 4.39Å; F35-V39 HydrophobicContact CE1-CG2 3.79Å; F35-V39 HydrophobicContact CE2-CG2 3.84Å; F35-V39 HydrophobicContact CZ-CG2 3.55Å; F35-V39 WeakPolarHBondContact O-CG2 3.46Å; F35-V39 PolarHBondContact O-N 3.05Å; F35-I112 HydrophobicContact CE2-CG2 4.08Å
36	R	61.3	Low	62	Low	169 Å²	169	83.7 Å²	83.7	64%	0.638	38%	0.375	S	S	*	.	H	α-helix	trans	-60.4	-41.1	176.7	-172	174.3	-178.9	-175.3	2.2	112.2	W32 I33 H34 L38 V39 D40	W32-R36 WeakPolarHBondContact O-CB 3.23Å; W32-R36 PolarHBondContact O-N 3.38Å; I33-R36 PolarHBondContact O-N 3.08Å; H34-R36 PolarHBondContact O-N 3.03Å; R36-L38 VanDerWaalsContact C-N 3.3Å; R36-L38 PolarHBondContact O-N 3.44Å; R36-V39 PolarHBondContact O-N 3.42Å; R36-D40 WeakPolarHBondContact O-CB 3.35Å; R36-D40 PolarHBondContact O-N 2.87Å
37	Q	65.3	Low	64.1	Low	115 Å²	115	87.8 Å²	87.8	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-38.4	176.1	-72.4	177.1	-13.7	0	0	112.8	I33 H34 F35 R41	I33-Q37 WeakPolarHBondContact O-CG 3.3Å; I33-Q37 PolarHBondContact O-N 3.44Å; H34-Q37 PolarHBondContact O-N 2.98Å; F35-Q37 VanDerWaalsContact C-N 3.33Å; F35-Q37 PolarHBondContact O-N 3.13Å; Q37-R41 WeakPolarHBondContact O-CB 3.4Å; Q37-R41 PolarHBondContact O-N 3.11Å; Q37-R41 VanDerWaalsContact O-N 3.1Å
38	L	66.5	Low	66	Low	10 Å²	10	88.4 Å²	88.4	5%	0.052	39%	0.393	C	S	.	.	H	α-helix	trans	-66.6	-47	175.5	-65.8	169.8	0	0	0	111.2	H34 F35 R36 R41 L42 I112 K115 I336	H34-L38 PolarHBondContact O-N 2.93Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 2.97Å; F35-L38 VanDerWaalsContact O-N 3.16Å; R36-L38 VanDerWaalsContact C-N 3.3Å; R36-L38 PolarHBondContact O-N 3.44Å; L38-R41 PolarHBondContact O-N 3.16Å; L38-L42 PolarHBondContact O-N 3.18Å; L38-I112 HydrophobicContact CB-CD1 4.27Å; L38-I112 HydrophobicContact CB-CG1 3.92Å; L38-I112 WeakPolarHBondContact O-CD1 3.42Å; L38-K115 HydrophobicContact CD1-CB 4.31Å; L38-K115 HydrophobicContact CD1-CD 4Å; L38-I336 HydrophobicContact CD2-CG2 4.41Å
39	V	71.1	Confident	67.7	Low	42 Å²	42	88.7 Å²	88.7	26%	0.255	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-48.5	176.8	174.4	0	0	0	0	111.2	F35 R36 R41 L42 D43	F35-V39 HydrophobicContact CD1-CG2 4.29Å; F35-V39 HydrophobicContact CD2-CG2 4.39Å; F35-V39 HydrophobicContact CE1-CG2 3.79Å; F35-V39 HydrophobicContact CE2-CG2 3.84Å; F35-V39 HydrophobicContact CZ-CG2 3.55Å; F35-V39 WeakPolarHBondContact O-CG2 3.46Å; F35-V39 PolarHBondContact O-N 3.05Å; R36-V39 PolarHBondContact O-N 3.42Å; V39-R41 PolarHBondContact O-N 2.88Å; V39-L42 PolarHBondContact O-N 3.27Å; V39-L42 VanDerWaalsContact O-N 3.14Å; V39-D43 PolarHBondContact O-N 3.5Å
40	D	72.5	Confident	69.2	Low	67 Å²	67	87.9 Å²	87.9	36%	0.358	39%	0.394	S	S	.	.	H	α-helix	trans	-59.9	-36.6	179.6	-68.7	-22.3	0	0	0	111.6	R36 R44	R36-D40 WeakPolarHBondContact O-CB 3.35Å; R36-D40 PolarHBondContact O-N 2.87Å; D40-R44 WeakPolarHBondContact O-CG 3.42Å; D40-R44 PolarHBondContact O-N 3.44Å; D40-R44 PolarHBondContact O-NH1 3.38Å
41	R	73.7	Confident	70.5	Confident	81 Å²	81	82.5 Å²	82.5	31%	0.306	38%	0.376	S	S	.	.	H	α-helix	trans	-67.1	-47.1	175.2	176.6	175.7	158.3	169	-9	111.5	Q37 L38 V39 D43 R44 M45 E108 R335	Q37-R41 WeakPolarHBondContact O-CB 3.4Å; Q37-R41 PolarHBondContact O-N 3.11Å; Q37-R41 VanDerWaalsContact O-N 3.1Å; L38-R41 PolarHBondContact O-N 3.16Å; V39-R41 PolarHBondContact O-N 2.88Å; R41-D43 VanDerWaalsContact C-N 3.28Å; R41-D43 PolarHBondContact O-N 3.42Å; R41-R44 WeakPolarHBondContact O-CB 3.44Å; R41-R44 PolarHBondContact O-N 3.42Å; R41-M45 HydrophobicContact CG-SD 4.46Å; R41-M45 WeakPolarHBondContact O-CG 3.49Å; R41-M45 PolarHBondContact O-N 3.12Å; R41-E108 WeakPolarHBondContact CD-OE1 3.46Å; R41-E108 WeakPolarHBondContact CG-OE1 3.49Å; R41-E108 IonicContact CZ-OE1 2.75Å; R41-E108 IonicContact CZ-OE2 2.97Å; R41-E108 VanDerWaalsContact CZ-OE2 3.25Å; R41-E108 VanDerWaalsContact NE-CD 3.27Å; R41-E108 IonicContact NE-OE1 2.72Å; R41-E108 PolarHBondContact NE-OE1 3.14Å; R41-E108 IonicContact NE-OE2 3.89Å; R41-E108 PolarHBondContact NE-OE2 3.01Å; R41-E108 VanDerWaalsContact NE-OE2 3.07Å; R41-E108 IonicContact NH2-OE1 3.07Å; R41-E108 IonicContact NH2-OE2 2.92Å; R41-E108 PolarHBondContact NH2-OE2 2.97Å; R41-R335 VanDerWaalsContact CZ-O 3.3Å; R41-R335 PolarHBondContact NH1-O 3.42Å; R41-R335 PolarHBondContact NH2-O 3.05Å
42	L	76.4	Confident	71.3	Confident	13 Å²	13	84.4 Å²	84.4	7%	0.068	39%	0.393	C	S	.	.	H	α-helix	trans	-60.1	-42.1	177.7	-176.6	70.7	0	0	0	111.2	L38 V39 R44 M45 K46 L105 E108 T109 I112	L38-L42 PolarHBondContact O-N 3.18Å; V39-L42 PolarHBondContact O-N 3.27Å; V39-L42 VanDerWaalsContact O-N 3.14Å; L42-R44 VanDerWaalsContact C-N 3.34Å; L42-R44 PolarHBondContact O-N 3.34Å; L42-M45 WeakPolarHBondContact O-CB 3.1Å; L42-M45 PolarHBondContact O-N 3.42Å; L42-M45 VanDerWaalsContact O-N 3.17Å; L42-K46 WeakPolarHBondContact O-CG 3.41Å; L42-K46 PolarHBondContact O-N 2.67Å; L42-L105 HydrophobicContact CD1-CD1 3.73Å; L42-E108 HydrophobicContact CB-CG 4.39Å; L42-E108 HydrophobicContact CD1-CB 3.95Å; L42-E108 HydrophobicContact CD1-CG 3.6Å; L42-T109 WeakPolarHBondContact CD1-OG1 3.49Å; L42-I112 HydrophobicContact CB-CD1 3.41Å; L42-I112 VanDerWaalsContact CB-CD1 3.41Å; L42-I112 HydrophobicContact CD1-CD1 4.3Å; L42-I112 HydrophobicContact CD2-CD1 3.66Å; L42-I112 HydrophobicContact CG-CD1 3.95Å
43	D	75.3	Confident	72.1	Confident	61 Å²	61	85.3 Å²	85.3	33%	0.326	40%	0.396	S	S	.	.	H	α-helix	trans	-71.4	-28.2	178.7	-70	-21.7	0	0	0	112.7	V39 R41 K46 R47	V39-D43 PolarHBondContact O-N 3.5Å; R41-D43 VanDerWaalsContact C-N 3.28Å; R41-D43 PolarHBondContact O-N 3.42Å; D43-K46 IonicContact OD1-NZ 3.25Å; D43-K46 PolarHBondContact OD1-NZ 3.14Å; D43-R47 WeakPolarHBondContact O-CG 3.34Å; D43-R47 PolarHBondContact O-N 3.2Å; D43-R47 PolarHBondContact O-NE 3.2Å; D43-R47 VanDerWaalsContact O-NE 3.16Å
44	R	78.7	Confident	73.1	Confident	123 Å²	123	85.5 Å²	85.5	46%	0.464	41%	0.406	S	S	.	.	H	α-helix	trans	-64.6	-46	165.3	-76.6	-172	-60.5	-88.9	3	111.5	D40 R41 L42 K46 R47 N48	D40-R44 WeakPolarHBondContact O-CG 3.42Å; D40-R44 PolarHBondContact O-N 3.44Å; D40-R44 PolarHBondContact O-NH1 3.38Å; R41-R44 WeakPolarHBondContact O-CB 3.44Å; R41-R44 PolarHBondContact O-N 3.42Å; L42-R44 VanDerWaalsContact C-N 3.34Å; L42-R44 PolarHBondContact O-N 3.34Å; R44-K46 PolarHBondContact O-N 2.97Å; R44-R47 PolarHBondContact O-N 2.75Å; R44-N48 VanDerWaalsContact O-CG 3.31Å; R44-N48 PolarHBondContact O-N 2.85Å; R44-N48 VanDerWaalsContact O-N 3.11Å
45	M	82	Confident	74.1	Confident	46 Å²	46	87.8 Å²	87.8	23%	0.227	42%	0.42	C	S	.	.	H	α-helix	trans	-62	-42.1	179	-72	178.2	64.7	0	0	112.4	R41 L42 R47 N48 T49 K104 L105 E108	R41-M45 HydrophobicContact CG-SD 4.46Å; R41-M45 WeakPolarHBondContact O-CG 3.49Å; R41-M45 PolarHBondContact O-N 3.12Å; L42-M45 WeakPolarHBondContact O-CB 3.1Å; L42-M45 PolarHBondContact O-N 3.42Å; L42-M45 VanDerWaalsContact O-N 3.17Å; M45-R47 VanDerWaalsContact C-N 3.31Å; M45-R47 PolarHBondContact O-N 3.42Å; M45-N48 PolarHBondContact O-N 3.33Å; M45-T49 WeakPolarHBondContact O-CG2 3.44Å; M45-K104 HydrophobicContact CE-CB 4.09Å; M45-L105 HydrophobicContact CB-CD1 3.8Å; M45-E108 HydrophobicContact CE-CB 4.2Å; M45-E108 HydrophobicContact CE-CG 4.36Å; M45-E108 HydrophobicContact SD-CB 4.14Å; M45-E108 VanDerWaalsContact SD-CD 3.5Å; M45-E108 HydrophobicContact SD-CG 3.65Å; M45-E108 VanDerWaalsContact SD-OE2 3.32Å
46	K	82.5	Confident	75.1	Confident	97 Å²	97	87.8 Å²	87.8	42%	0.422	42%	0.42	S	S	.	.	H	α-helix	trans	-60.2	-39.2	175.2	-71.8	178.3	-167.6	150.6	0	112.4	L42 D43 R44 N48 T49 L105	L42-K46 WeakPolarHBondContact O-CG 3.41Å; L42-K46 PolarHBondContact O-N 2.67Å; D43-K46 IonicContact OD1-NZ 3.25Å; D43-K46 PolarHBondContact OD1-NZ 3.14Å; R44-K46 PolarHBondContact O-N 2.97Å; K46-N48 VanDerWaalsContact C-N 3.32Å; K46-T49 PolarHBondContact O-OG1 2.64Å; K46-T49 VanDerWaalsContact O-OG1 3.08Å; K46-L105 HydrophobicContact CG-CD1 3.8Å; K46-L105 HydrophobicContact CG-CD2 4.26Å
47	R	82.1	Confident	76.4	Confident	187 Å²	187	79.7 Å²	79.7	71%	0.706	39%	0.39	S	S	*	.	H	α-helix	trans	-71.3	-27.7	178.8	-76.1	-177.6	-72.2	176.6	-2.9	113.2	D43 R44 M45 T49	D43-R47 WeakPolarHBondContact O-CG 3.34Å; D43-R47 PolarHBondContact O-N 3.2Å; D43-R47 PolarHBondContact O-NE 3.2Å; D43-R47 VanDerWaalsContact O-NE 3.16Å; R44-R47 PolarHBondContact O-N 2.75Å; M45-R47 VanDerWaalsContact C-N 3.31Å; M45-R47 PolarHBondContact O-N 3.42Å; R47-T49 VanDerWaalsContact C-N 3.35Å
48	N	81.7	Confident	77.4	Confident	121 Å²	121	75 Å²	75	65%	0.647	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	9.6	-177.3	-66.8	-5.5	0	0	0	113.8	R44 M45 K46	R44-N48 VanDerWaalsContact O-CG 3.31Å; R44-N48 PolarHBondContact O-N 2.85Å; R44-N48 VanDerWaalsContact O-N 3.11Å; M45-N48 PolarHBondContact O-N 3.33Å; K46-N48 VanDerWaalsContact C-N 3.32Å
49	T	83.1	Confident	78.3	Confident	54 Å²	54	75.6 Å²	75.6	33%	0.331	37%	0.371	S	S	.	.			trans	-76	124.4	177.3	59	0	0	0	0	110.9	M45 K46 R47 M58 L59 L105	M45-T49 WeakPolarHBondContact O-CG2 3.44Å; K46-T49 PolarHBondContact O-OG1 2.64Å; K46-T49 VanDerWaalsContact O-OG1 3.08Å; R47-T49 VanDerWaalsContact C-N 3.35Å; T49-M58 WeakPolarHBondContact CB-O 3.46Å; T49-L59 HydrophobicContact CG2-CD2 3.78Å; T49-L105 HydrophobicContact CG2-CD2 4.3Å
50	S	76.2	Confident	79.1	Confident	75 Å²	75	76.6 Å²	76.6	52%	0.524	38%	0.38	S	S	.	.			trans	-107.8	-8.9	-173.2	-52.7	0	0	0	0	115.3	L59	S50-L59 PolarHBondContact N-O 3.1Å
51	G	72.6	Confident	79.7	Confident	6 Å²	6	74.2 Å²	74.2	6%	0.062	37%	0.371	C	S	.	.			trans	-91.4	116.6	-171.7	0	0	0	0	0	114.3	C57 M58	G51-C57 VanDerWaalsContact CA-O 3.31Å; G51-C57 WeakPolarHBondContact CA-O 3.36Å; G51-M58 PolarHBondContact N-O 2.71Å
52	N	69.5	Low	80.2	Confident	145 Å²	145	72 Å²	72	78%	0.775	37%	0.37	S	S	*	.			trans	-112.6	-4.5	-174.8	-66.8	-11.3	0	0	0	114.2
53	R	69	Low	80.4	Confident	188 Å²	188	74.5 Å²	74.5	71%	0.709	39%	0.389	S	S	*	.	S	Bend	trans	-123.9	156.1	-174	-59.6	-175.8	-179.4	-141.7	1.2	111.8	N55 Q56	R53-N55 PolarHBondContact O-N 3.05Å; R53-Q56 HydrophobicContact CB-CB 4.46Å; R53-Q56 HydrophobicContact CB-CG 4.26Å; R53-Q56 PolarHBondContact O-N 2.93Å; R53-Q56 VanDerWaalsContact O-N 3.16Å
54	S	74.2	Confident	80.4	Confident	94 Å²	94	73.1 Å²	73.1	66%	0.657	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.7	178.9	56.4	0	0	0	0	113.6	Q56	S54-Q56 VanDerWaalsContact C-N 3.33Å
55	N	78.6	Confident	79.8	Confident	101 Å²	101	69.7 Å²	69.7	54%	0.54	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	24.3	-179.7	-61.5	11	0	0	0	111.8	R53 S63 F64	R53-N55 PolarHBondContact O-N 3.05Å; N55-S63 CarbonylContact O-C 3.59Å; N55-S63 VanDerWaalsContact O-CA 3.32Å; N55-S63 WeakPolarHBondContact O-CA 3.34Å; N55-F64 PolarHBondContact O-N 2.83Å
56	Q	85.1	Confident	78.6	Confident	48 Å²	48	75 Å²	75	22%	0.224	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-132.4	147.2	177.8	-72.7	177.9	-26.3	0	0	110.4	R53 S54 M58 A62 F64	R53-Q56 HydrophobicContact CB-CB 4.46Å; R53-Q56 HydrophobicContact CB-CG 4.26Å; R53-Q56 PolarHBondContact O-N 2.93Å; R53-Q56 VanDerWaalsContact O-N 3.16Å; S54-Q56 VanDerWaalsContact C-N 3.33Å; Q56-M58 PolarHBondContact O-N 2.84Å; Q56-A62 CarbonylContact C-O 3.43Å; Q56-A62 VanDerWaalsContact CA-O 3.3Å; Q56-A62 WeakPolarHBondContact CA-O 3.35Å; Q56-F64 WeakPolarHBondContact O-CE2 3.46Å
57	C	87.8	Confident	77.2	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	44%	0.443	C	S	.	.			trans	-63.3	122.9	171.7	175.1	0	0	0	0	109.7	G51 L59 C60 G61 A62 F64 V83 C84 C88	G51-C57 VanDerWaalsContact CA-O 3.31Å; G51-C57 WeakPolarHBondContact CA-O 3.36Å; C57-L59 PolarHBondContact O-N 3.3Å; C57-L59 PolarHBondContact SG-N 3.26Å; C57-C60 WeakPolarHBondContact CB-SG 3.32Å; C57-C60 PolarHBondContact SG-SG 3.24Å; C57-G61 VanDerWaalsContact O-CA 3.25Å; C57-G61 WeakPolarHBondContact O-CA 3.38Å; C57-G61 PolarHBondContact O-N 3.37Å; C57-A62 HydrophobicContact CB-CB 4.46Å; C57-A62 PolarHBondContact N-O 3.34Å; C57-F64 HydrophobicContact CB-CE1 4.34Å; C57-F64 HydrophobicContact CB-CE2 4.28Å; C57-F64 HydrophobicContact CB-CZ 3.66Å; C57-F64 VanDerWaalsContact N-CE2 3.28Å; C57-V83 VanDerWaalsContact SG-CA 3.58Å; C57-C84 VanDerWaalsContact CB-SG 3.56Å; C57-C84 PolarHBondContact SG-N 3.14Å; C57-C84 VanDerWaalsContact SG-N 3.43Å; C57-C88 WeakPolarHBondContact SG-CB 3.2Å
58	M	87.2	Confident	75.8	Confident	15 Å²	15	72 Å²	72	7%	0.074	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.5	-179.6	63.8	173.2	-60.3	0	0	114.3	T49 G51 Q56 C79 R81 Y82 V83 C103	T49-M58 WeakPolarHBondContact CB-O 3.46Å; G51-M58 PolarHBondContact N-O 2.71Å; Q56-M58 PolarHBondContact O-N 2.84Å; M58-C79 PolarHBondContact SD-SG 3.03Å; M58-R81 HydrophobicContact CB-CB 4.18Å; M58-R81 HydrophobicContact CE-CB 4.41Å; M58-R81 HydrophobicContact CG-CB 4.2Å; M58-R81 HydrophobicContact SD-CB 3.51Å; M58-R81 VanDerWaalsContact SD-CB 3.51Å; M58-R81 HydrophobicContact SD-CG 4.4Å; M58-Y82 PolarHBondContact N-O 2.8Å; M58-V83 HydrophobicContact CG-CG1 3.29Å; M58-V83 HydrophobicContact SD-CG1 3.81Å; M58-C103 HydrophobicContact SD-CB 4Å
59	L	86.1	Confident	74.3	Confident	23 Å²	23	71.2 Å²	71.2	12%	0.12	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-59.6	-178.2	-58.7	-173.1	0	0	0	111.4	T49 S50 C57 V83 C88 C103 K104 L105	T49-L59 HydrophobicContact CG2-CD2 3.78Å; S50-L59 PolarHBondContact N-O 3.1Å; C57-L59 PolarHBondContact O-N 3.3Å; C57-L59 PolarHBondContact SG-N 3.26Å; L59-V83 HydrophobicContact CD1-CG1 4.4Å; L59-V83 HydrophobicContact CG-CG1 4.07Å; L59-C88 HydrophobicContact CB-CB 4.1Å; L59-C88 HydrophobicContact CD1-CB 3.99Å; L59-C88 VanDerWaalsContact CD1-O 3.29Å; L59-C88 WeakPolarHBondContact CD1-O 3.32Å; L59-C88 HydrophobicContact CG-CB 4.36Å; L59-C103 HydrophobicContact CD1-CB 4.3Å; L59-K104 HydrophobicContact CD1-CB 3.85Å; L59-L105 HydrophobicContact CD2-CB 3.92Å
60	C	87.7	Confident	72.9	Confident	64 Å²	64	76.4 Å²	76.4	43%	0.432	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.6	-175.1	68.1	0	0	0	0	115.1	C57 A62 C84 C88	C57-C60 WeakPolarHBondContact CB-SG 3.32Å; C57-C60 PolarHBondContact SG-SG 3.24Å; C60-A62 PolarHBondContact O-N 2.87Å; C60-A62 VanDerWaalsContact SG-CB 3.55Å; C60-C84 VanDerWaalsContact SG-SG 3.65Å; C60-C88 VanDerWaalsContact SG-SG 3.69Å
61	G	84.5	Confident	71.8	Confident	17 Å²	17	74.6 Å²	74.6	18%	0.175	43%	0.434	C	S	.	.			trans	77.4	-1.9	-178.3	0	0	0	0	0	115.6	C57 S63	C57-G61 VanDerWaalsContact O-CA 3.25Å; C57-G61 WeakPolarHBondContact O-CA 3.38Å; C57-G61 PolarHBondContact O-N 3.37Å; G61-S63 PolarHBondContact O-N 2.86Å
62	A	83.7	Confident	71.9	Confident	34 Å²	34	77.4 Å²	77.4	28%	0.281	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-58.5	131	179.3	0	0	0	0	0	111.7	Q56 C57 C60	Q56-A62 CarbonylContact C-O 3.43Å; Q56-A62 VanDerWaalsContact CA-O 3.3Å; Q56-A62 WeakPolarHBondContact CA-O 3.35Å; C57-A62 HydrophobicContact CB-CB 4.46Å; C57-A62 PolarHBondContact N-O 3.34Å; C60-A62 PolarHBondContact O-N 2.87Å; C60-A62 VanDerWaalsContact SG-CB 3.55Å
63	S	80.1	Confident	72.5	Confident	66 Å²	66	72.4 Å²	72.4	46%	0.462	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-74.6	136.4	-179.9	-59.8	0	0	0	0	111.8	N55 G61	N55-S63 CarbonylContact O-C 3.59Å; N55-S63 VanDerWaalsContact O-CA 3.32Å; N55-S63 WeakPolarHBondContact O-CA 3.34Å; G61-S63 PolarHBondContact O-N 2.86Å
64	F	77.2	Confident	73.4	Confident	32 Å²	32	64 Å²	64	14%	0.14	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-93.4	119.5	169.2	-52.1	-58.4	0	0	0	108.5	N55 Q56 C57 A73 Y82	N55-F64 PolarHBondContact O-N 2.83Å; Q56-F64 WeakPolarHBondContact O-CE2 3.46Å; C57-F64 HydrophobicContact CB-CE1 4.34Å; C57-F64 HydrophobicContact CB-CE2 4.28Å; C57-F64 HydrophobicContact CB-CZ 3.66Å; C57-F64 VanDerWaalsContact N-CE2 3.28Å; F64-A73 HydrophobicContact CB-CB 4.43Å; F64-A73 HydrophobicContact CD1-CB 3.64Å; F64-A73 HydrophobicContact CD2-CB 4.03Å; F64-A73 HydrophobicContact CE1-CB 3.77Å; F64-A73 HydrophobicContact CE2-CB 4.17Å; F64-A73 HydrophobicContact CG-CB 3.77Å; F64-A73 HydrophobicContact CZ-CB 4.04Å; F64-Y82 VanDerWaalsContact CE2-CB 3.5Å
65	G	66	Low	74.1	Confident	50 Å²	50	63.9 Å²	63.9	52%	0.515	39%	0.39	S	S	.	.	S	Bend	trans	163.5	173.5	-179.7	0	0	0	0	0	114.5	M67 G68	G65-M67 PolarHBondContact O-N 2.74Å; G65-G68 PolarHBondContact O-N 2.94Å
66	V	55.6	Low	74.7	Confident	157 Å²	157	59.1 Å²	59.1	95%	0.952	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.8	-164.4	-173	0	0	0	0	115.1
67	M	52.8	Low	75	Confident	196 Å²	196	61.1 Å²	61.1	97%	0.966	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.7	10.1	176.5	-57.2	-156.2	94.5	0	0	114.2	G65	G65-M67 PolarHBondContact O-N 2.74Å
68	G	52.2	Low	75	Confident	25 Å²	25	62 Å²	62	26%	0.258	38%	0.378	S	S	.	.	S	Bend	trans	-97.6	159.5	171.6	0	0	0	0	0	110.9	G65 I70	G65-G68 PolarHBondContact O-N 2.94Å; G68-I70 PolarHBondContact O-N 3Å; G68-I70 VanDerWaalsContact O-N 3.17Å
69	P	50.5	Low	75	Confident	105 Å²	105	62 Å²	62	68%	0.682	38%	0.38	S	S	*	.			trans	-51.5	131.2	168.7	22.1	-30.1	0	0	0	107.7	S71	P69-S71 PolarHBondContact O-N 3.09Å
70	I	53.5	Low	75.2	Confident	164 Å²	164	65.8 Å²	65.8	84%	0.841	40%	0.397	S	S	*	.			trans	-67.8	58.4	175.5	-47.1	169.3	0	0	0	107.9	G68 C72	G68-I70 PolarHBondContact O-N 3Å; G68-I70 VanDerWaalsContact O-N 3.17Å; I70-C72 VanDerWaalsContact C-N 3.32Å; I70-C72 PolarHBondContact O-N 3.44Å
71	S	55	Low	75.1	Confident	36 Å²	36	68.6 Å²	68.6	25%	0.252	40%	0.398	S	S	.	.			trans	-68.5	103.1	165.2	68.4	0	0	0	0	104.2	P69 A73 C84	P69-S71 PolarHBondContact O-N 3.09Å; S71-A73 PolarHBondContact O-N 3.18Å; S71-C84 PolarHBondContact OG-SG 3.36Å
72	C	73.9	Confident	75.4	Confident	65 Å²	65	72.4 Å²	72.4	44%	0.439	41%	0.408	S	S	.	.			trans	-47.6	115	-179.3	-60.8	0	0	0	0	108.3	I70 A74 Q85	I70-C72 VanDerWaalsContact C-N 3.32Å; I70-C72 PolarHBondContact O-N 3.44Å; C72-A74 PolarHBondContact O-N 2.71Å; C72-Q85 HydrophobicContact CB-CB 4.18Å; C72-Q85 VanDerWaalsContact O-CB 3.3Å; C72-Q85 WeakPolarHBondContact O-CB 3.42Å; C72-Q85 PolarHBondContact O-N 3.37Å
73	A	82.1	Confident	75.6	Confident	40 Å²	40	70.8 Å²	70.8	33%	0.331	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118.9	-179.6	0	0	0	0	0	107.4	F64 S71 Y82	F64-A73 HydrophobicContact CB-CB 4.43Å; F64-A73 HydrophobicContact CD1-CB 3.64Å; F64-A73 HydrophobicContact CD2-CB 4.03Å; F64-A73 HydrophobicContact CE1-CB 3.77Å; F64-A73 HydrophobicContact CE2-CB 4.17Å; F64-A73 HydrophobicContact CG-CB 3.77Å; F64-A73 HydrophobicContact CZ-CB 4.04Å; S71-A73 PolarHBondContact O-N 3.18Å; A73-Y82 HydrophobicContact CB-CD1 4Å
74	A	87.2	Confident	76	Confident	13 Å²	13	68 Å²	68	11%	0.107	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.3	178.3	0	0	0	0	0	109.8	C72 Y82 V83 Q85 F101	C72-A74 PolarHBondContact O-N 2.71Å; A74-Y82 WeakPolarHBondContact O-CA 3.34Å; A74-V83 PolarHBondContact N-O 3.03Å; A74-V83 PolarHBondContact O-N 3.08Å; A74-Q85 HydrophobicContact CB-CB 4.08Å; A74-Q85 HydrophobicContact CB-CG 4.32Å; A74-F101 HydrophobicContact CB-CD1 3.57Å; A74-F101 HydrophobicContact CB-CD2 4.15Å; A74-F101 HydrophobicContact CB-CE1 3.2Å; A74-F101 HydrophobicContact CB-CE2 3.86Å; A74-F101 HydrophobicContact CB-CG 4.05Å; A74-F101 HydrophobicContact CB-CZ 3.39Å
75	F	89.5	Confident	76.3	Confident	91 Å²	91	70.3 Å²	70.3	40%	0.399	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.4	-175.8	-168.2	-104.5	0	0	0	110.1	H77 H80 Y82	F75-H77 PolarHBondContact O-N 2.76Å; F75-H80 HydrophobicContact CE1-CB 4.14Å; F75-H80 AromaticContact CE1-ND1 3.62Å; F75-H80 VanDerWaalsContact CE2-C 3.47Å; F75-H80 HydrophobicContact CE2-CB 4.48Å; F75-H80 VanDerWaalsContact CE2-O 3.3Å; F75-H80 WeakPolarHBondContact CE2-O 3.27Å; F75-H80 VanDerWaalsContact CZ-CA 3.43Å; F75-H80 HydrophobicContact CZ-CB 3.65Å; F75-H80 AromaticContact CZ-ND1 3.94Å; F75-H80 WeakPolarHBondContact CZ-O 3.44Å; F75-Y82 HydrophobicContact CB-CD1 4.29Å; F75-Y82 HydrophobicContact CB-CE1 4.06Å; F75-Y82 HydrophobicContact CD2-CD1 4.11Å; F75-Y82 HydrophobicContact CD2-CD2 4.17Å; F75-Y82 AromaticContact CD2-CE1 3.86Å; F75-Y82 HydrophobicContact CD2-CE1 3.86Å; F75-Y82 AromaticContact CD2-CE2 3.9Å; F75-Y82 HydrophobicContact CD2-CE2 3.9Å; F75-Y82 HydrophobicContact CD2-CG 4.26Å; F75-Y82 AromaticContact CD2-CZ 3.75Å; F75-Y82 HydrophobicContact CE2-CE2 4.23Å; F75-Y82 HydrophobicContact CG-CE1 4.44Å
76	C	91.4	Very high	77	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.401	C	S	.	.			trans	-70.8	125.2	176.9	-179.6	0	0	0	0	110.4	D78 C79 H80 R81 C103	C76-D78 VanDerWaalsContact C-N 3.26Å; C76-D78 PolarHBondContact O-N 3.23Å; C76-C79 WeakPolarHBondContact CB-SG 3.26Å; C76-C79 PolarHBondContact SG-SG 3.09Å; C76-H80 WeakPolarHBondContact O-CA 3.48Å; C76-H80 PolarHBondContact O-N 3.15Å; C76-H80 VanDerWaalsContact O-N 3.09Å; C76-R81 WeakPolarHBondContact CB-O 3.36Å; C76-R81 PolarHBondContact N-O 3.14Å; C76-C103 HydrophobicContact CB-CB 4.05Å; C76-C103 PolarHBondContact SG-N 2.87Å
77	H	91.1	Very high	78.4	Confident	91 Å²	91	74.5 Å²	74.5	42%	0.421	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-38	176.8	176.1	-77.5	0	0	0	112.5	F75 H80 I100 F101 L102	F75-H77 PolarHBondContact O-N 2.76Å; H77-H80 PolarHBondContact O-CE1 2.78Å; H77-I100 HydrophobicContact CB-CB 4.19Å; H77-F101 WeakPolarHBondContact CB-O 3.35Å; H77-F101 PolarHBondContact N-O 2.99Å; H77-L102 HydrophobicContact CB-CD2 3.99Å
78	D	87.2	Confident	80.1	Confident	18 Å²	18	65.6 Å²	65.6	10%	0.096	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-57.5	-171.8	-76.3	2.8	0	0	0	112.6	C76 L102 C106 R110 V128	C76-D78 VanDerWaalsContact C-N 3.26Å; C76-D78 PolarHBondContact O-N 3.23Å; D78-L102 HydrophobicContact CB-CD2 3.86Å; D78-L102 WeakPolarHBondContact OD2-CD2 3.46Å; D78-C106 HydrophobicContact CB-CB 3.89Å; D78-R110 VanDerWaalsContact CG-NH2 3.3Å; D78-R110 IonicContact OD1-CZ 3.6Å; D78-R110 IonicContact OD1-NE 3.8Å; D78-R110 IonicContact OD1-NH2 2.67Å; D78-R110 PolarHBondContact OD1-NH2 3.48Å; D78-R110 IonicContact OD2-CZ 3.31Å; D78-R110 VanDerWaalsContact OD2-CZ 3.31Å; D78-R110 IonicContact OD2-NE 2.72Å; D78-R110 PolarHBondContact OD2-NE 2.94Å; D78-R110 IonicContact OD2-NH2 3.17Å; D78-R110 PolarHBondContact OD2-NH2 3.07Å; D78-V128 HydrophobicContact CB-CG1 4.08Å; D78-V128 WeakPolarHBondContact O-CB 3.39Å; D78-V128 WeakPolarHBondContact O-CG1 3.47Å
79	C	88.5	Confident	81.9	Confident	16 Å²	16	64.7 Å²	64.7	11%	0.108	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.4	-175.6	66.7	0	0	0	0	114.7	M58 C76 R81 V128	M58-C79 PolarHBondContact SD-SG 3.03Å; C76-C79 WeakPolarHBondContact CB-SG 3.26Å; C76-C79 PolarHBondContact SG-SG 3.09Å; C79-R81 VanDerWaalsContact C-N 3.26Å; C79-R81 PolarHBondContact O-N 2.97Å; C79-V128 HydrophobicContact CB-CG1 4.26Å
80	H	89	Confident	83.8	Confident	102 Å²	102	61.2 Å²	61.2	47%	0.472	31%	0.305	S	S	.	.			trans	55.1	37.6	179.5	-59.5	-68.9	0	0	0	114.1	F75 C76 H77	F75-H80 HydrophobicContact CE1-CB 4.14Å; F75-H80 AromaticContact CE1-ND1 3.62Å; F75-H80 VanDerWaalsContact CE2-C 3.47Å; F75-H80 HydrophobicContact CE2-CB 4.48Å; F75-H80 VanDerWaalsContact CE2-O 3.3Å; F75-H80 WeakPolarHBondContact CE2-O 3.27Å; F75-H80 VanDerWaalsContact CZ-CA 3.43Å; F75-H80 HydrophobicContact CZ-CB 3.65Å; F75-H80 AromaticContact CZ-ND1 3.94Å; F75-H80 WeakPolarHBondContact CZ-O 3.44Å; C76-H80 WeakPolarHBondContact O-CA 3.48Å; C76-H80 PolarHBondContact O-N 3.15Å; C76-H80 VanDerWaalsContact O-N 3.09Å; H77-H80 PolarHBondContact O-CE1 2.78Å
81	R	87.3	Confident	85.5	Confident	123 Å²	123	60 Å²	60	46%	0.464	30%	0.296	S	S	.	.			trans	-126.1	153.5	178.2	-69.2	-179.4	-174.4	-150.6	3	111.3	M58 C76 C79	M58-R81 HydrophobicContact CB-CB 4.18Å; M58-R81 HydrophobicContact CE-CB 4.41Å; M58-R81 HydrophobicContact CG-CB 4.2Å; M58-R81 HydrophobicContact SD-CB 3.51Å; M58-R81 VanDerWaalsContact SD-CB 3.51Å; M58-R81 HydrophobicContact SD-CG 4.4Å; C76-R81 WeakPolarHBondContact CB-O 3.36Å; C76-R81 PolarHBondContact N-O 3.14Å; C79-R81 VanDerWaalsContact C-N 3.26Å; C79-R81 PolarHBondContact O-N 2.97Å
82	Y	88.9	Confident	87	Confident	96 Å²	96	60.8 Å²	60.8	38%	0.376	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	140.2	178.8	-71.5	-80.7	0	0	0	112.7	M58 F64 A73 A74 F75	M58-Y82 PolarHBondContact N-O 2.8Å; F64-Y82 VanDerWaalsContact CE2-CB 3.5Å; A73-Y82 HydrophobicContact CB-CD1 4Å; A74-Y82 WeakPolarHBondContact O-CA 3.34Å; F75-Y82 HydrophobicContact CB-CD1 4.29Å; F75-Y82 HydrophobicContact CB-CE1 4.06Å; F75-Y82 HydrophobicContact CD2-CD1 4.11Å; F75-Y82 HydrophobicContact CD2-CD2 4.17Å; F75-Y82 AromaticContact CD2-CE1 3.86Å; F75-Y82 HydrophobicContact CD2-CE1 3.86Å; F75-Y82 AromaticContact CD2-CE2 3.9Å; F75-Y82 HydrophobicContact CD2-CE2 3.9Å; F75-Y82 HydrophobicContact CD2-CG 4.26Å; F75-Y82 AromaticContact CD2-CZ 3.75Å; F75-Y82 HydrophobicContact CE2-CE2 4.23Å; F75-Y82 HydrophobicContact CG-CE1 4.44Å
83	V	89.4	Confident	87.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	155.9	173.3	-73.6	0	0	0	0	111.8	C57 M58 L59 A74 Q85 C88 F101 C103	C57-V83 VanDerWaalsContact SG-CA 3.58Å; M58-V83 HydrophobicContact CG-CG1 3.29Å; M58-V83 HydrophobicContact SD-CG1 3.81Å; L59-V83 HydrophobicContact CD1-CG1 4.4Å; L59-V83 HydrophobicContact CG-CG1 4.07Å; A74-V83 PolarHBondContact N-O 3.03Å; A74-V83 PolarHBondContact O-N 3.08Å; V83-Q85 PolarHBondContact O-N 3.01Å; V83-C88 HydrophobicContact CB-CB 3.77Å; V83-C88 HydrophobicContact CG1-CB 4.11Å; V83-F101 HydrophobicContact CG2-CE1 3.77Å; V83-C103 HydrophobicContact CB-CB 4.4Å; V83-C103 HydrophobicContact CG1-CB 3.55Å; V83-C103 HydrophobicContact CG2-CB 4.04Å
84	C	86.9	Confident	87.1	Confident	7 Å²	7	60.1 Å²	60.1	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	126.2	168.6	-56	0	0	0	0	110	C57 C60 S71 K86 C88 G89	C57-C84 VanDerWaalsContact CB-SG 3.56Å; C57-C84 PolarHBondContact SG-N 3.14Å; C57-C84 VanDerWaalsContact SG-N 3.43Å; C60-C84 VanDerWaalsContact SG-SG 3.65Å; S71-C84 PolarHBondContact OG-SG 3.36Å; C84-K86 PolarHBondContact O-N 3.21Å; C84-C88 HydrophobicContact CB-CB 4.17Å; C84-C88 CarbonylContact O-C 3.52Å; C84-C88 WeakPolarHBondContact O-CA 3.33Å; C84-C88 PolarHBondContact O-N 3.33Å; C84-G89 PolarHBondContact O-N 2.79Å; C84-G89 VanDerWaalsContact O-N 3.13Å
85	Q	85.1	Confident	86.2	Confident	81 Å²	81	63.8 Å²	63.8	38%	0.379	33%	0.332	S	S	.	.	H	α-helix	trans	-56.8	-46.7	-177.9	-169.5	175.9	8.6	0	0	112.7	C72 A74 V83 F101	C72-Q85 HydrophobicContact CB-CB 4.18Å; C72-Q85 VanDerWaalsContact O-CB 3.3Å; C72-Q85 WeakPolarHBondContact O-CB 3.42Å; C72-Q85 PolarHBondContact O-N 3.37Å; A74-Q85 HydrophobicContact CB-CB 4.08Å; A74-Q85 HydrophobicContact CB-CG 4.32Å; V83-Q85 PolarHBondContact O-N 3.01Å; Q85-F101 HydrophobicContact CB-CZ 4.38Å; Q85-F101 HydrophobicContact CG-CE2 3.81Å; Q85-F101 HydrophobicContact CG-CZ 3.97Å
86	K	79.7	Confident	85.5	Confident	189 Å²	189	68.7 Å²	68.7	82%	0.822	35%	0.353	S	S	*	.	H	α-helix	trans	-71.7	-45.6	-174.3	-166.4	177.5	-178.6	175.5	0	113.8	C84	C84-K86 PolarHBondContact O-N 3.21Å
87	N	84.6	Confident	84.7	Confident	107 Å²	107	71.6 Å²	71.6	57%	0.572	38%	0.383	S	S	*	.	H	α-helix	trans	-108	-21.7	-167.3	-71.5	3.8	0	0	0	114.3	K104	N87-K104 WeakPolarHBondContact O-CD 3.27Å; N87-K104 WeakPolarHBondContact O-CE 3.37Å; N87-K104 PolarHBondContact O-NZ 2.8Å
88	C	89.2	Confident	84.1	Confident	8 Å²	8	74.2 Å²	74.2	5%	0.054	39%	0.393	C	S	.	.	H	α-helix	trans	-124.1	-3.8	-169.7	-69.8	0	0	0	0	113.8	C57 L59 C60 V83 C84 C103 K104	C57-C88 WeakPolarHBondContact SG-CB 3.2Å; L59-C88 HydrophobicContact CB-CB 4.1Å; L59-C88 HydrophobicContact CD1-CB 3.99Å; L59-C88 VanDerWaalsContact CD1-O 3.29Å; L59-C88 WeakPolarHBondContact CD1-O 3.32Å; L59-C88 HydrophobicContact CG-CB 4.36Å; C60-C88 VanDerWaalsContact SG-SG 3.69Å; V83-C88 HydrophobicContact CB-CB 3.77Å; V83-C88 HydrophobicContact CG1-CB 4.11Å; C84-C88 HydrophobicContact CB-CB 4.17Å; C84-C88 CarbonylContact O-C 3.52Å; C84-C88 WeakPolarHBondContact O-CA 3.33Å; C84-C88 PolarHBondContact O-N 3.33Å; C88-C103 WeakPolarHBondContact O-CA 2.94Å; C88-K104 PolarHBondContact O-N 3.47Å
89	G	89.5	Confident	84.1	Confident	6 Å²	6	77.1 Å²	77.1	6%	0.062	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	179.5	175.3	0	0	0	0	0	113.3	C84 L102	C84-G89 PolarHBondContact O-N 2.79Å; C84-G89 VanDerWaalsContact O-N 3.13Å; G89-L102 CarbonylContact C-O 3.47Å; G89-L102 WeakPolarHBondContact CA-O 3.15Å
90	L	90.9	Very high	84.2	Confident	32 Å²	32	77.1 Å²	77.1	17%	0.168	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	154.9	176.4	60.6	91.5	0	0	0	110.4	T92 F101 L102	L90-T92 HydrophobicContact CD1-CG2 4.12Å; L90-F101 WeakPolarHBondContact O-CA 3.37Å; L90-L102 PolarHBondContact N-O 3.39Å; L90-L102 PolarHBondContact O-N 2.87Å
91	E	89.5	Confident	84.3	Confident	138 Å²	138	73.7 Å²	73.7	65%	0.645	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	139.1	167.5	-72.2	173	-159.3	0	0	109.9	F101	E91-F101 HydrophobicContact CG-CD2 3.52Å; E91-F101 HydrophobicContact CG-CE2 3.92Å
92	T	87.3	Confident	84.5	Confident	54 Å²	54	67.9 Å²	67.9	33%	0.331	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-178.2	178.1	-168.8	0	0	0	0	109.9	L90 A99 I100 L102	L90-T92 HydrophobicContact CD1-CG2 4.12Å; T92-A99 CarbonylContact O-C 3.41Å; T92-A99 WeakPolarHBondContact O-CA 3.43Å; T92-I100 HydrophobicContact CG2-CD1 3.93Å; T92-I100 HydrophobicContact CG2-CG1 3.65Å; T92-I100 PolarHBondContact N-O 3.06Å; T92-I100 PolarHBondContact O-N 3.13Å; T92-L102 HydrophobicContact CG2-CD1 3.56Å; T92-L102 HydrophobicContact CG2-CG 3.81Å
93	A	78.3	Confident	84.7	Confident	50 Å²	50	63.3 Å²	63.3	41%	0.413	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	147.3	175.6	0	0	0	0	0	111.4	K98	A93-K98 CarbonylContact C-O 3.51Å; A93-K98 VanDerWaalsContact CA-O 3.31Å; A93-K98 WeakPolarHBondContact CA-O 3.37Å
94	D	78.8	Confident	84.7	Confident	41 Å²	41	67.4 Å²	67.4	22%	0.219	38%	0.38	C	S	.	.			trans	-77	179.2	167.3	76.4	2	0	0	0	111.6	K96 G97 K98 I100	D94-K96 PolarHBondContact O-N 2.81Å; D94-K96 VanDerWaalsContact OD1-CA 3.32Å; D94-K96 WeakPolarHBondContact OD1-CA 3.33Å; D94-K96 WeakPolarHBondContact OD1-CB 3.46Å; D94-K96 PolarHBondContact OD1-N 3.43Å; D94-G97 PolarHBondContact O-N 3.14Å; D94-G97 PolarHBondContact OD1-N 3.05Å; D94-G97 VanDerWaalsContact OD1-N 3.09Å; D94-K98 PolarHBondContact N-O 3.44Å; D94-K98 WeakPolarHBondContact OD1-CB 3.36Å; D94-K98 PolarHBondContact OD1-N 2.92Å; D94-I100 HydrophobicContact CB-CD1 4.04Å; D94-I100 HydrophobicContact CB-CG1 4.47Å; D94-I100 HydrophobicContact CB-CG2 4.05Å
95	G	68.3	Low	84.7	Confident	90 Å²	90	68.3 Å²	68.3	93%	0.928	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.2	178.6	0	0	0	0	0	115
96	K	74.8	Confident	84.9	Confident	194 Å²	194	65 Å²	65	84%	0.843	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	6.4	176	-61.1	-177.4	179.1	-177.1	0	112.1	D94 K98	D94-K96 PolarHBondContact O-N 2.81Å; D94-K96 VanDerWaalsContact OD1-CA 3.32Å; D94-K96 WeakPolarHBondContact OD1-CA 3.33Å; D94-K96 WeakPolarHBondContact OD1-CB 3.46Å; D94-K96 PolarHBondContact OD1-N 3.43Å; K96-K98 VanDerWaalsContact C-N 3.3Å; K96-K98 PolarHBondContact O-N 3.3Å
97	G	74.8	Confident	85.3	Confident	60 Å²	60	56.6 Å²	56.6	62%	0.619	34%	0.335	S	S	*	.	S	Bend	trans	79.3	6.3	-177.6	0	0	0	0	0	114.5	D94	D94-G97 PolarHBondContact O-N 3.14Å; D94-G97 PolarHBondContact OD1-N 3.05Å; D94-G97 VanDerWaalsContact OD1-N 3.09Å
98	K	79	Confident	85.3	Confident	146 Å²	146	51.7 Å²	51.7	64%	0.635	31%	0.309	S	S	*	.			trans	-78.4	133.4	178.3	-176.7	-178.5	177.7	179	0	110.2	A93 D94 K96 I100	A93-K98 CarbonylContact C-O 3.51Å; A93-K98 VanDerWaalsContact CA-O 3.31Å; A93-K98 WeakPolarHBondContact CA-O 3.37Å; D94-K98 PolarHBondContact N-O 3.44Å; D94-K98 WeakPolarHBondContact OD1-CB 3.36Å; D94-K98 PolarHBondContact OD1-N 2.92Å; K96-K98 VanDerWaalsContact C-N 3.3Å; K96-K98 PolarHBondContact O-N 3.3Å; K98-I100 PolarHBondContact O-N 3.43Å
99	A	86	Confident	84.9	Confident	80 Å²	80	53.2 Å²	53.2	66%	0.661	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	128.6	174.9	0	0	0	0	0	111.5	T92	T92-A99 CarbonylContact O-C 3.41Å; T92-A99 WeakPolarHBondContact O-CA 3.43Å
100	I	90.1	Very high	84.5	Confident	15 Å²	15	55.1 Å²	55.1	8%	0.077	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	156.6	177.4	59.6	167.3	0	0	0	109.9	H77 T92 D94 K98 L102 R110	H77-I100 HydrophobicContact CB-CB 4.19Å; T92-I100 HydrophobicContact CG2-CD1 3.93Å; T92-I100 HydrophobicContact CG2-CG1 3.65Å; T92-I100 PolarHBondContact N-O 3.06Å; T92-I100 PolarHBondContact O-N 3.13Å; D94-I100 HydrophobicContact CB-CD1 4.04Å; D94-I100 HydrophobicContact CB-CG1 4.47Å; D94-I100 HydrophobicContact CB-CG2 4.05Å; K98-I100 PolarHBondContact O-N 3.43Å; I100-L102 HydrophobicContact CD1-CD1 4.4Å; I100-L102 HydrophobicContact CD1-CD2 4.3Å; I100-L102 HydrophobicContact CD1-CG 4.26Å; I100-R110 VanDerWaalsContact CD1-NH1 3.32Å
101	F	91.7	Very high	83.6	Confident	31 Å²	31	56 Å²	56	14%	0.136	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.6	176.2	-163	-84.6	0	0	0	110.3	A74 H77 V83 Q85 L90 E91	A74-F101 HydrophobicContact CB-CD1 3.57Å; A74-F101 HydrophobicContact CB-CD2 4.15Å; A74-F101 HydrophobicContact CB-CE1 3.2Å; A74-F101 HydrophobicContact CB-CE2 3.86Å; A74-F101 HydrophobicContact CB-CG 4.05Å; A74-F101 HydrophobicContact CB-CZ 3.39Å; H77-F101 WeakPolarHBondContact CB-O 3.35Å; H77-F101 PolarHBondContact N-O 2.99Å; V83-F101 HydrophobicContact CG2-CE1 3.77Å; Q85-F101 HydrophobicContact CB-CZ 4.38Å; Q85-F101 HydrophobicContact CG-CE2 3.81Å; Q85-F101 HydrophobicContact CG-CZ 3.97Å; L90-F101 WeakPolarHBondContact O-CA 3.37Å; E91-F101 HydrophobicContact CG-CD2 3.52Å; E91-F101 HydrophobicContact CG-CE2 3.92Å
102	L	91.9	Very high	82.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.4	178.1	-65.8	-177.9	0	0	0	111.5	H77 D78 G89 L90 T92 I100 C106	H77-L102 HydrophobicContact CB-CD2 3.99Å; D78-L102 HydrophobicContact CB-CD2 3.86Å; D78-L102 WeakPolarHBondContact OD2-CD2 3.46Å; G89-L102 CarbonylContact C-O 3.47Å; G89-L102 WeakPolarHBondContact CA-O 3.15Å; L90-L102 PolarHBondContact N-O 3.39Å; L90-L102 PolarHBondContact O-N 2.87Å; T92-L102 HydrophobicContact CG2-CD1 3.56Å; T92-L102 HydrophobicContact CG2-CG 3.81Å; I100-L102 HydrophobicContact CD1-CD1 4.4Å; I100-L102 HydrophobicContact CD1-CD2 4.3Å; I100-L102 HydrophobicContact CD1-CG 4.26Å; L102-C106 HydrophobicContact CD2-CB 4.39Å
103	C	91.9	Very high	81.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	153.3	162.5	73.3	0	0	0	0	110	M58 L59 C76 V83 C88 L105 C106 S107	M58-C103 HydrophobicContact SD-CB 4Å; L59-C103 HydrophobicContact CD1-CB 4.3Å; C76-C103 HydrophobicContact CB-CB 4.05Å; C76-C103 PolarHBondContact SG-N 2.87Å; V83-C103 HydrophobicContact CB-CB 4.4Å; V83-C103 HydrophobicContact CG1-CB 3.55Å; V83-C103 HydrophobicContact CG2-CB 4.04Å; C88-C103 WeakPolarHBondContact O-CA 2.94Å; C103-L105 PolarHBondContact O-N 3.47Å; C103-L105 VanDerWaalsContact O-N 3.16Å; C103-C106 PolarHBondContact O-N 2.82Å; C103-C106 VanDerWaalsContact O-N 3.12Å; C103-C106 PolarHBondContact SG-N 3.05Å; C103-C106 PolarHBondContact SG-SG 3.16Å; C103-S107 PolarHBondContact O-N 2.89Å
104	K	89.7	Confident	80.9	Confident	86 Å²	86	53.1 Å²	53.1	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-54	-37.2	178.6	-76.8	-178.1	172.2	176.2	0	112.6	M45 L59 N87 C88 S107 E108	M45-K104 HydrophobicContact CE-CB 4.09Å; L59-K104 HydrophobicContact CD1-CB 3.85Å; N87-K104 WeakPolarHBondContact O-CD 3.27Å; N87-K104 WeakPolarHBondContact O-CE 3.37Å; N87-K104 PolarHBondContact O-NZ 2.8Å; C88-K104 PolarHBondContact O-N 3.47Å; K104-S107 PolarHBondContact O-N 2.89Å; K104-E108 VanDerWaalsContact O-CB 3.22Å; K104-E108 WeakPolarHBondContact O-CB 3.28Å; K104-E108 PolarHBondContact O-N 3.5Å
105	L	88.3	Confident	80.1	Confident	25 Å²	25	53.8 Å²	53.8	13%	0.131	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-44.3	178.9	-173.7	69.2	0	0	0	112.7	L42 M45 K46 T49 L59 C103 T109	L42-L105 HydrophobicContact CD1-CD1 3.73Å; M45-L105 HydrophobicContact CB-CD1 3.8Å; K46-L105 HydrophobicContact CG-CD1 3.8Å; K46-L105 HydrophobicContact CG-CD2 4.26Å; T49-L105 HydrophobicContact CG2-CD2 4.3Å; L59-L105 HydrophobicContact CD2-CB 3.92Å; C103-L105 PolarHBondContact O-N 3.47Å; C103-L105 VanDerWaalsContact O-N 3.16Å; L105-T109 WeakPolarHBondContact O-CB 3.25Å; L105-T109 PolarHBondContact O-N 2.81Å; L105-T109 PolarHBondContact O-OG1 3.04Å
106	C	89	Confident	79.6	Confident	12 Å²	12	50.8 Å²	50.8	8%	0.081	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-38.5	176.2	-73	0	0	0	0	111.4	D78 L102 C103 T109 R110	D78-C106 HydrophobicContact CB-CB 3.89Å; L102-C106 HydrophobicContact CD2-CB 4.39Å; C103-C106 PolarHBondContact O-N 2.82Å; C103-C106 VanDerWaalsContact O-N 3.12Å; C103-C106 PolarHBondContact SG-N 3.05Å; C103-C106 PolarHBondContact SG-SG 3.16Å; C106-T109 WeakPolarHBondContact O-CB 3.38Å; C106-T109 PolarHBondContact O-N 2.86Å; C106-R110 WeakPolarHBondContact O-CG 3.27Å; C106-R110 PolarHBondContact O-N 2.87Å
107	S	88.6	Confident	78.5	Confident	13 Å²	13	42.5 Å²	42.5	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-49.9	174.1	-170	0	0	0	0	112.1	C103 K104 T109 R110 E111	C103-S107 PolarHBondContact O-N 2.89Å; K104-S107 PolarHBondContact O-N 2.89Å; S107-T109 VanDerWaalsContact C-N 3.26Å; S107-T109 PolarHBondContact O-N 2.75Å; S107-R110 PolarHBondContact O-N 3.1Å; S107-R110 VanDerWaalsContact O-N 3.14Å; S107-E111 PolarHBondContact O-N 2.63Å
108	E	83	Confident	77.2	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-40	175.1	-175.5	93.7	-159.5	0	0	111.2	R41 L42 M45 K104 E111 I112	R41-E108 WeakPolarHBondContact CD-OE1 3.46Å; R41-E108 WeakPolarHBondContact CG-OE1 3.49Å; R41-E108 IonicContact CZ-OE1 2.75Å; R41-E108 IonicContact CZ-OE2 2.97Å; R41-E108 VanDerWaalsContact CZ-OE2 3.25Å; R41-E108 VanDerWaalsContact NE-CD 3.27Å; R41-E108 IonicContact NE-OE1 2.72Å; R41-E108 PolarHBondContact NE-OE1 3.14Å; R41-E108 IonicContact NE-OE2 3.89Å; R41-E108 PolarHBondContact NE-OE2 3.01Å; R41-E108 VanDerWaalsContact NE-OE2 3.07Å; R41-E108 IonicContact NH2-OE1 3.07Å; R41-E108 IonicContact NH2-OE2 2.92Å; R41-E108 PolarHBondContact NH2-OE2 2.97Å; L42-E108 HydrophobicContact CB-CG 4.39Å; L42-E108 HydrophobicContact CD1-CB 3.95Å; L42-E108 HydrophobicContact CD1-CG 3.6Å; M45-E108 HydrophobicContact CE-CB 4.2Å; M45-E108 HydrophobicContact CE-CG 4.36Å; M45-E108 HydrophobicContact SD-CB 4.14Å; M45-E108 VanDerWaalsContact SD-CD 3.5Å; M45-E108 HydrophobicContact SD-CG 3.65Å; M45-E108 VanDerWaalsContact SD-OE2 3.32Å; K104-E108 VanDerWaalsContact O-CB 3.22Å; K104-E108 WeakPolarHBondContact O-CB 3.28Å; K104-E108 PolarHBondContact O-N 3.5Å; E108-E111 PolarHBondContact O-N 2.78Å; E108-I112 HydrophobicContact CG-CD1 4.5Å; E108-I112 WeakPolarHBondContact O-CG1 3.48Å; E108-I112 PolarHBondContact O-N 3.32Å; E108-I112 VanDerWaalsContact O-N 3.09Å
109	T	81.5	Confident	75.7	Confident	40 Å²	40	39.4 Å²	39.4	25%	0.245	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-50.6	174.1	-56	0	0	0	0	110.7	L42 L105 C106 S107 E111 I112 W113	L42-T109 WeakPolarHBondContact CD1-OG1 3.49Å; L105-T109 WeakPolarHBondContact O-CB 3.25Å; L105-T109 PolarHBondContact O-N 2.81Å; L105-T109 PolarHBondContact O-OG1 3.04Å; C106-T109 WeakPolarHBondContact O-CB 3.38Å; C106-T109 PolarHBondContact O-N 2.86Å; S107-T109 VanDerWaalsContact C-N 3.26Å; S107-T109 PolarHBondContact O-N 2.75Å; T109-E111 VanDerWaalsContact C-N 3.29Å; T109-E111 PolarHBondContact O-N 2.86Å; T109-I112 PolarHBondContact O-N 3.02Å; T109-W113 PolarHBondContact O-N 2.95Å
110	R	80.8	Confident	73.4	Confident	47 Å²	47	39.3 Å²	39.3	18%	0.177	19%	0.189	C	C	.	.	H	α-helix	trans	-57.3	-41.5	178.3	-75.7	-173.5	178.8	-159.3	0.1	112.4	D78 I100 C106 S107 W113 K114	D78-R110 VanDerWaalsContact CG-NH2 3.3Å; D78-R110 IonicContact OD1-CZ 3.6Å; D78-R110 IonicContact OD1-NE 3.8Å; D78-R110 IonicContact OD1-NH2 2.67Å; D78-R110 PolarHBondContact OD1-NH2 3.48Å; D78-R110 IonicContact OD2-CZ 3.31Å; D78-R110 VanDerWaalsContact OD2-CZ 3.31Å; D78-R110 IonicContact OD2-NE 2.72Å; D78-R110 PolarHBondContact OD2-NE 2.94Å; D78-R110 IonicContact OD2-NH2 3.17Å; D78-R110 PolarHBondContact OD2-NH2 3.07Å; I100-R110 VanDerWaalsContact CD1-NH1 3.32Å; C106-R110 WeakPolarHBondContact O-CG 3.27Å; C106-R110 PolarHBondContact O-N 2.87Å; S107-R110 PolarHBondContact O-N 3.1Å; S107-R110 VanDerWaalsContact O-N 3.14Å; R110-W113 WeakPolarHBondContact O-CB 3.25Å; R110-W113 PolarHBondContact O-N 2.72Å; R110-K114 WeakPolarHBondContact O-CG 3.31Å; R110-K114 PolarHBondContact O-N 3.16Å
111	E	73	Confident	70.8	Confident	49 Å²	49	44.1 Å²	44.1	23%	0.229	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-40.3	177.9	-70.3	-47.6	124.4	0	0	112.6	S107 E108 T109 W113 K114 K115 I336	S107-E111 PolarHBondContact O-N 2.63Å; E108-E111 PolarHBondContact O-N 2.78Å; T109-E111 VanDerWaalsContact C-N 3.29Å; T109-E111 PolarHBondContact O-N 2.86Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.02Å; E111-K114 PolarHBondContact O-N 3.09Å; E111-K114 WeakPolarHBondContact OE1-CE 3.05Å; E111-K114 IonicContact OE1-NZ 3.64Å; E111-K114 PolarHBondContact OE1-NZ 3.44Å; E111-K115 WeakPolarHBondContact O-CB 3.32Å; E111-K115 WeakPolarHBondContact O-CG 3.37Å; E111-K115 PolarHBondContact O-N 2.72Å; E111-I336 HydrophobicContact CB-CG2 4.41Å; E111-I336 HydrophobicContact CG-CD1 4.1Å
112	I	68.3	Low	68.4	Low	13 Å²	13	51.4 Å²	51.4	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-43.3	172.5	-75.5	164.8	0	0	0	110.9	F35 L38 L42 E108 T109 K114 K115 S116	F35-I112 HydrophobicContact CE2-CG2 4.08Å; L38-I112 HydrophobicContact CB-CD1 4.27Å; L38-I112 HydrophobicContact CB-CG1 3.92Å; L38-I112 WeakPolarHBondContact O-CD1 3.42Å; L42-I112 HydrophobicContact CB-CD1 3.41Å; L42-I112 VanDerWaalsContact CB-CD1 3.41Å; L42-I112 HydrophobicContact CD1-CD1 4.3Å; L42-I112 HydrophobicContact CD2-CD1 3.66Å; L42-I112 HydrophobicContact CG-CD1 3.95Å; E108-I112 HydrophobicContact CG-CD1 4.5Å; E108-I112 WeakPolarHBondContact O-CG1 3.48Å; E108-I112 PolarHBondContact O-N 3.32Å; E108-I112 VanDerWaalsContact O-N 3.09Å; T109-I112 PolarHBondContact O-N 3.02Å; I112-K114 PolarHBondContact O-N 2.78Å; I112-K115 PolarHBondContact O-N 2.76Å; I112-S116 WeakPolarHBondContact O-CB 3.4Å; I112-S116 PolarHBondContact O-N 3.27Å; I112-S116 PolarHBondContact O-OG 3.22Å
113	W	65.7	Low	65.9	Low	52 Å²	52	53.2 Å²	53.2	20%	0.197	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-48.6	176.5	-83.7	69.1	0	0	0	110.8	T109 R110 E111 S116 G117 A118 W119 R122 G123 P125	T109-W113 PolarHBondContact O-N 2.95Å; R110-W113 WeakPolarHBondContact O-CB 3.25Å; R110-W113 PolarHBondContact O-N 2.72Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.02Å; W113-S116 PolarHBondContact O-OG 2.92Å; W113-S116 VanDerWaalsContact O-OG 3.08Å; W113-G117 PolarHBondContact O-N 3.03Å; W113-A118 HydrophobicContact CD2-CB 3.91Å; W113-A118 VanDerWaalsContact CE3-C 3.42Å; W113-A118 HydrophobicContact CE3-CB 3.7Å; W113-A118 HydrophobicContact CG-CB 4.34Å; W113-A118 HydrophobicContact CZ3-CB 4.04Å; W113-A118 VanDerWaalsContact CZ3-O 3.28Å; W113-A118 WeakPolarHBondContact CZ3-O 3.4Å; W113-A118 PolarHBondContact O-N 2.87Å; W113-A118 VanDerWaalsContact O-N 3.09Å; W113-W119 HydrophobicContact CE3-CB 4.19Å; W113-W119 VanDerWaalsContact O-CD1 3.25Å; W113-R122 HydrophobicContact CH2-CB 3.84Å; W113-R122 HydrophobicContact CZ3-CB 3.85Å; W113-G123 WeakPolarHBondContact CZ3-O 3.33Å; W113-P125 HydrophobicContact CH2-CB 4.36Å; W113-P125 HydrophobicContact CH2-CG 3.71Å; W113-P125 HydrophobicContact CZ2-CG 3.56Å; W113-P125 HydrophobicContact CZ3-CG 4.36Å
114	K	64.6	Low	63.4	Low	118 Å²	118	58.7 Å²	58.7	51%	0.513	28%	0.281	S	S	.	.	H	α-helix	trans	-57.1	-55.4	175.5	-71.3	175.6	-173	171.5	0	112.4	R110 E111 I112 S116 G117	R110-K114 WeakPolarHBondContact O-CG 3.31Å; R110-K114 PolarHBondContact O-N 3.16Å; E111-K114 PolarHBondContact O-N 3.09Å; E111-K114 WeakPolarHBondContact OE1-CE 3.05Å; E111-K114 IonicContact OE1-NZ 3.64Å; E111-K114 PolarHBondContact OE1-NZ 3.44Å; I112-K114 PolarHBondContact O-N 2.78Å; K114-S116 PolarHBondContact O-N 3.42Å; K114-G117 PolarHBondContact O-N 2.96Å
115	K	61	Low	60.9	Low	55 Å²	55	55.4 Å²	55.4	24%	0.239	27%	0.268	C	S	.	.	H	α-helix	trans	-67	-34.2	-174.3	-70.7	-169.9	176.9	-168	0	112.7	Y31 L38 E111 I112 G117 I336 D339	Y31-K115 PolarHBondContact OH-O 3.45Å; L38-K115 HydrophobicContact CD1-CB 4.31Å; L38-K115 HydrophobicContact CD1-CD 4Å; E111-K115 WeakPolarHBondContact O-CB 3.32Å; E111-K115 WeakPolarHBondContact O-CG 3.37Å; E111-K115 PolarHBondContact O-N 2.72Å; I112-K115 PolarHBondContact O-N 2.76Å; K115-G117 VanDerWaalsContact C-N 3.34Å; K115-I336 PolarHBondContact NZ-O 2.78Å; K115-D339 IonicContact NZ-OD1 2.85Å; K115-D339 PolarHBondContact NZ-OD1 3.14Å
116	S	57.5	Low	58.8	Low	26 Å²	26	62.7 Å²	62.7	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-79.7	-13.6	177.9	63.1	0	0	0	0	114.8	Y31 I112 W113 K114 A118	Y31-S116 VanDerWaalsContact OH-CA 3.29Å; Y31-S116 WeakPolarHBondContact OH-CA 3.5Å; I112-S116 WeakPolarHBondContact O-CB 3.4Å; I112-S116 PolarHBondContact O-N 3.27Å; I112-S116 PolarHBondContact O-OG 3.22Å; W113-S116 PolarHBondContact O-OG 2.92Å; W113-S116 VanDerWaalsContact O-OG 3.08Å; K114-S116 PolarHBondContact O-N 3.42Å; S116-A118 PolarHBondContact O-N 3.25Å; S116-A118 WeakPolarHBondContact OG-CB 3.29Å; S116-A118 PolarHBondContact OG-N 3.11Å
117	G	51.1	Low	56.4	Low	21 Å²	21	68.1 Å²	68.1	22%	0.216	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	11.9	-165	0	0	0	0	0	113.2	W113 K114 K115 W119 F120 Y121	W113-G117 PolarHBondContact O-N 3.03Å; K114-G117 PolarHBondContact O-N 2.96Å; K115-G117 VanDerWaalsContact C-N 3.34Å; G117-W119 PolarHBondContact O-N 2.83Å; G117-W119 VanDerWaalsContact O-N 3.12Å; G117-F120 WeakPolarHBondContact O-CB 3.48Å; G117-F120 PolarHBondContact O-N 2.9Å; G117-Y121 WeakPolarHBondContact O-CD2 3.21Å
118	A	49.1	Very low	54	Low	26 Å²	26	69.9 Å²	69.9	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-57.7	-29.2	178.7	0	0	0	0	0	112.6	W113 S116 F120 Y121 R122	W113-A118 HydrophobicContact CD2-CB 3.91Å; W113-A118 VanDerWaalsContact CE3-C 3.42Å; W113-A118 HydrophobicContact CE3-CB 3.7Å; W113-A118 HydrophobicContact CG-CB 4.34Å; W113-A118 HydrophobicContact CZ3-CB 4.04Å; W113-A118 VanDerWaalsContact CZ3-O 3.28Å; W113-A118 WeakPolarHBondContact CZ3-O 3.4Å; W113-A118 PolarHBondContact O-N 2.87Å; W113-A118 VanDerWaalsContact O-N 3.09Å; S116-A118 PolarHBondContact O-N 3.25Å; S116-A118 WeakPolarHBondContact OG-CB 3.29Å; S116-A118 PolarHBondContact OG-N 3.11Å; A118-F120 PolarHBondContact O-N 2.84Å; A118-Y121 PolarHBondContact O-N 3.44Å; A118-R122 PolarHBondContact O-N 3.04Å
119	W	47.7	Very low	51.6	Low	115 Å²	115	77 Å²	77	44%	0.436	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-23	175.6	68.9	-89.6	0	0	0	113.2	W113 G117 Y121 G123	W113-W119 HydrophobicContact CE3-CB 4.19Å; W113-W119 VanDerWaalsContact O-CD1 3.25Å; G117-W119 PolarHBondContact O-N 2.83Å; G117-W119 VanDerWaalsContact O-N 3.12Å; W119-Y121 VanDerWaalsContact C-N 3.35Å; W119-G123 WeakPolarHBondContact CA-O 3.22Å; W119-G123 CarbonylContact O-C 3.49Å; W119-G123 WeakPolarHBondContact O-CA 3.47Å; W119-G123 PolarHBondContact O-N 2.9Å
120	F	37.7	Very low	49.4	Very low	77 Å²	77	79.5 Å²	79.5	34%	0.338	38%	0.381	S	S	.	.	H	α-helix	trans	-68.6	-32	172.8	-174.5	-100.5	0	0	0	112.5	G117 A118 D461	G117-F120 WeakPolarHBondContact O-CB 3.48Å; G117-F120 PolarHBondContact O-N 2.9Å; A118-F120 PolarHBondContact O-N 2.84Å; F120-D461 WeakPolarHBondContact CE2-OD1 3.23Å; F120-D461 VanDerWaalsContact CZ-OD1 3.23Å; F120-D461 WeakPolarHBondContact CZ-OD1 3.46Å
121	Y	35.8	Very low	47	Very low	116 Å²	116	82.7 Å²	82.7	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-94.2	-18.2	-171.3	-61.3	-76.1	0	0	0	114.6	G117 A118 W119 R429	G117-Y121 WeakPolarHBondContact O-CD2 3.21Å; A118-Y121 PolarHBondContact O-N 3.44Å; W119-Y121 VanDerWaalsContact C-N 3.35Å; Y121-R429 HydrophobicContact CE1-CG 4.12Å
122	R	39.7	Very low	45.3	Very low	184 Å²	184	84.8 Å²	84.8	69%	0.694	43%	0.434	S	S	*	.	H	α-helix	trans	-142.1	8.5	-176.8	-83.6	-176.2	168.1	176.2	-5	114.2	W113 A118	W113-R122 HydrophobicContact CH2-CB 3.84Å; W113-R122 HydrophobicContact CZ3-CB 3.85Å; A118-R122 PolarHBondContact O-N 3.04Å
123	G	39	Very low	43.8	Very low	40 Å²	40	95.2 Å²	95.2	41%	0.412	47%	0.473	S	S	.	.	S	Bend	trans	61	-149.1	-165	0	0	0	0	0	110.7	W113 W119	W113-G123 WeakPolarHBondContact CZ3-O 3.33Å; W119-G123 WeakPolarHBondContact CA-O 3.22Å; W119-G123 CarbonylContact O-C 3.49Å; W119-G123 WeakPolarHBondContact O-CA 3.47Å; W119-G123 PolarHBondContact O-N 2.9Å
124	I	39.5	Very low	42.3	Very low	115 Å²	115	98.4 Å²	98.4	59%	0.59	50%	0.5	S	S	*	.	S	Bend	trans	-85.8	125.2	157.1	-61.6	170.8	0	0	0	105.9	E126	I124-E126 PolarHBondContact O-N 3.41Å
125	P	38.6	Very low	41.1	Very low	17 Å²	17	104.4 Å²	104.4	11%	0.11	52%	0.52	C	S	.	.			trans	-58.2	126.3	-178	16.9	-27.7	0	0	0	112.2	W113 H127	W113-P125 HydrophobicContact CH2-CB 4.36Å; W113-P125 HydrophobicContact CH2-CG 3.71Å; W113-P125 HydrophobicContact CZ2-CG 3.56Å; W113-P125 HydrophobicContact CZ3-CG 4.36Å; P125-H127 WeakPolarHBondContact CB-CE1 3.49Å; P125-H127 WeakPolarHBondContact CB-ND1 3.39Å; P125-H127 PolarHBondContact O-N 2.95Å
126	E	43.6	Very low	40.1	Very low	177 Å²	177	107 Å²	107	83%	0.827	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-60.3	-11.5	172	-74.7	-171.1	145	0	0	113.1	I124 V128	I124-E126 PolarHBondContact O-N 3.41Å; E126-V128 VanDerWaalsContact C-N 3.33Å; E126-V128 PolarHBondContact O-N 3.26Å
127	H	39.3	Very low	39.1	Very low	127 Å²	127	110.3 Å²	110.3	59%	0.588	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-87.2	23.6	-177.7	65	-101.5	0	0	0	115.5	P125	P125-H127 WeakPolarHBondContact CB-CE1 3.49Å; P125-H127 WeakPolarHBondContact CB-ND1 3.39Å; P125-H127 PolarHBondContact O-N 2.95Å
128	V	36.8	Very low	38.4	Very low	49 Å²	49	118.5 Å²	118.5	30%	0.297	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-79.1	-3	156.6	-150.5	0	0	0	0	111.7	D78 C79 E126 V130	D78-V128 HydrophobicContact CB-CG1 4.08Å; D78-V128 WeakPolarHBondContact O-CB 3.39Å; D78-V128 WeakPolarHBondContact O-CG1 3.47Å; C79-V128 HydrophobicContact CB-CG1 4.26Å; E126-V128 VanDerWaalsContact C-N 3.33Å; E126-V128 PolarHBondContact O-N 3.26Å; V128-V130 PolarHBondContact O-N 2.96Å
129	K	32.7	Very low	38.1	Very low	152 Å²	152	121.7 Å²	121.7	66%	0.661	63%	0.632	S	S	*	*	S	Bend	trans	-75.3	106	160.6	-65.6	177.7	-177.2	173.9	0	109
130	V	35.2	Very low	37.4	Very low	93 Å²	93	122.8 Å²	122.8	56%	0.564	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-48.8	130.6	162.5	179	0	0	0	0	107.4	V128 A132	V128-V130 PolarHBondContact O-N 2.96Å; V130-A132 PolarHBondContact O-N 2.88Å; V130-A132 VanDerWaalsContact O-N 3.09Å
131	P	32	Very low	37.4	Very low	114 Å²	114	122.2 Å²	122.2	74%	0.74	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-56.8	122.5	176.1	21.4	-29.6	0	0	0	108.4	R133	P131-R133 PolarHBondContact O-N 2.91Å
132	A	35.8	Very low	37.5	Very low	94 Å²	94	122 Å²	122	78%	0.777	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-54.9	129.1	169.8	0	0	0	0	0	107.4	V130	V130-A132 PolarHBondContact O-N 2.88Å; V130-A132 VanDerWaalsContact O-N 3.09Å
133	R	37.6	Very low	37.2	Very low	231 Å²	231	119.1 Å²	119.1	87%	0.872	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-46.6	137	173.2	-91.9	-177.8	175.1	-169.7	-2.7	109	P131 R135	P131-R133 PolarHBondContact O-N 2.91Å; R133-R135 PolarHBondContact O-N 2.82Å; R133-R135 VanDerWaalsContact O-N 3.12Å
134	P	35.2	Very low	37	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-56.8	122.7	168.7	-11.9	24.9	0	0	0	107.1	S136	P134-S136 PolarHBondContact O-N 3.11Å; P134-S136 VanDerWaalsContact O-N 3.13Å
135	R	38.8	Very low	36.5	Very low	244 Å²	244	126.6 Å²	126.6	92%	0.921	72%	0.721	S	S	*	*			trans	-68.9	108.5	165.4	-77.9	-177.7	175.2	178.2	-1.6	105.9	R133 A137	R133-R135 PolarHBondContact O-N 2.82Å; R133-R135 VanDerWaalsContact O-N 3.12Å; R135-A137 PolarHBondContact O-N 2.91Å
136	S	40.7	Very low	36.2	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	76%	0.759	S	S	*	*			trans	-48.1	132.4	166.1	-28.8	0	0	0	0	108.8	P134 E138	P134-S136 PolarHBondContact O-N 3.11Å; P134-S136 VanDerWaalsContact O-N 3.13Å; S136-E138 PolarHBondContact O-N 3.35Å
137	A	34.8	Very low	35.5	Very low	97 Å²	97	139.6 Å²	139.6	80%	0.802	76%	0.761	S	S	*	*			trans	-61.1	124.2	171.2	0	0	0	0	0	109.4	R135	R135-A137 PolarHBondContact O-N 2.91Å
138	E	37.7	Very low	35	Very low	193 Å²	193	145.3 Å²	145.3	90%	0.902	78%	0.777	S	S	*	*			trans	-154.3	135.8	162.7	-110.7	161.3	-167.3	0	0	109.2	S136	S136-E138 PolarHBondContact O-N 3.35Å
139	A	41.8	Very low	34.8	Very low	92 Å²	92	151.4 Å²	151.4	76%	0.76	81%	0.807	S	S	*	*			trans	-71.5	168.7	-157.7	0	0	0	0	0	114.7
140	P	34.1	Very low	34.7	Very low	138 Å²	138	149.7 Å²	149.7	90%	0.896	81%	0.805	S	S	*	*			trans	-81.1	123.3	-174.7	31.5	-27.5	0	0	0	110.9
141	G	37.9	Very low	34.8	Very low	66 Å²	66	148 Å²	148	68%	0.68	81%	0.806	S	S	*	*			trans	-174.1	98.8	177.7	0	0	0	0	0	115.9
142	S	37.2	Very low	35	Very low	111 Å²	111	145.4 Å²	145.4	78%	0.776	79%	0.791	S	S	*	*			trans	72.9	141.3	154.5	78.7	0	0	0	0	120.8
143	P	32.7	Very low	34.9	Very low	124 Å²	124	147.9 Å²	147.9	81%	0.805	79%	0.789	S	S	*	*			trans	-96.3	119.7	-170.9	35.2	-26.1	0	0	0	111.5
144	T	35.8	Very low	34.9	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	77%	0.774	S	S	*	*			trans	-142.2	97.2	163.7	29.7	0	0	0	0	110.4	R146	T144-R146 PolarHBondContact O-N 2.78Å
145	E	29.2	Very low	34.9	Very low	185 Å²	185	146 Å²	146	86%	0.864	77%	0.773	S	S	*	*			trans	31	84.6	136.6	-150.5	172.7	176.1	0	0	117.2
146	R	30.5	Very low	34.7	Very low	238 Å²	238	138.3 Å²	138.3	90%	0.898	76%	0.756	S	S	*	*			trans	-129.6	109.2	154.6	-75.4	-171.9	-176.2	-178	2.3	109.9	T144 R148	T144-R146 PolarHBondContact O-N 2.78Å; R146-R148 PolarHBondContact O-N 2.8Å
147	R	30.1	Very low	34.4	Very low	230 Å²	230	139.3 Å²	139.3	87%	0.868	75%	0.751	S	S	*	*			trans	-40.9	115.1	177.8	-73	174.4	178.3	174.1	-1.5	111.8	L149	R147-L149 PolarHBondContact O-N 3.06Å
148	R	28.8	Very low	34.5	Very low	246 Å²	246	138.7 Å²	138.7	93%	0.928	74%	0.737	S	S	*	*			trans	-65.4	108.5	159.2	-76.8	-177.7	179.4	179.2	1.7	107.7	R146 D150	R146-R148 PolarHBondContact O-N 2.8Å; R148-D150 PolarHBondContact O-N 3.35Å; R148-D150 VanDerWaalsContact O-N 3.15Å
149	L	31.8	Very low	34.4	Very low	178 Å²	178	136.4 Å²	136.4	93%	0.932	73%	0.73	S	S	*	*			trans	-72.5	102.6	161.7	-88.2	151.9	0	0	0	107.4	R147	R147-L149 PolarHBondContact O-N 3.06Å
150	D	32.2	Very low	33.9	Very low	115 Å²	115	136.1 Å²	136.1	62%	0.615	72%	0.722	S	S	*	*			trans	-68.7	122.2	-173.2	-170.7	0.7	0	0	0	111.7	R148 S152	R148-D150 PolarHBondContact O-N 3.35Å; R148-D150 VanDerWaalsContact O-N 3.15Å; D150-S152 PolarHBondContact O-N 3.26Å; D150-S152 WeakPolarHBondContact OD1-CB 3.4Å; D150-S152 PolarHBondContact OD1-N 3.14Å; D150-S152 WeakPolarHBondContact OD2-CB 3.18Å
151	G	35.6	Very low	34	Very low	57 Å²	57	133.8 Å²	133.8	59%	0.588	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	3.8	170.2	0	0	0	0	0	114.1
152	S	36.8	Very low	33.8	Very low	61 Å²	61	135.5 Å²	135.5	43%	0.427	71%	0.707	S	S	.	*	H	α-helix	trans	-62.2	-35.1	171.2	177.7	0	0	0	0	113.7	D150 I154 R155 S156	D150-S152 PolarHBondContact O-N 3.26Å; D150-S152 WeakPolarHBondContact OD1-CB 3.4Å; D150-S152 PolarHBondContact OD1-N 3.14Å; D150-S152 WeakPolarHBondContact OD2-CB 3.18Å; S152-I154 VanDerWaalsContact C-N 3.33Å; S152-I154 PolarHBondContact O-N 3.49Å; S152-R155 PolarHBondContact O-N 3.42Å; S152-S156 PolarHBondContact O-N 3.42Å
153	M	33	Very low	33.6	Very low	146 Å²	146	142 Å²	142	72%	0.719	72%	0.715	S	S	*	*	H	α-helix	trans	-67.6	-29.3	-175.3	-109.2	-177.1	173.4	0	0	113.8	M157	M153-M157 PolarHBondContact O-N 3.21Å
154	I	38.4	Very low	33.5	Very low	109 Å²	109	139.9 Å²	139.9	56%	0.559	71%	0.708	S	S	*	*	H	α-helix	trans	-81.2	-29	178	-56.8	179	0	0	0	111.1	S152 S156 V158	S152-I154 VanDerWaalsContact C-N 3.33Å; S152-I154 PolarHBondContact O-N 3.49Å; I154-S156 VanDerWaalsContact C-N 3.35Å; I154-V158 HydrophobicContact CG2-CG2 4.41Å; I154-V158 WeakPolarHBondContact O-CG2 3.47Å; I154-V158 PolarHBondContact O-N 3.21Å
155	R	35.7	Very low	33.4	Very low	203 Å²	203	141.7 Å²	141.7	77%	0.766	71%	0.711	S	S	*	*	H	α-helix	trans	-69.1	-32.9	173.2	-99.9	179.5	172.7	176.5	-2.4	112.5	S152 L159	S152-R155 PolarHBondContact O-N 3.42Å; R155-L159 WeakPolarHBondContact O-CD1 3.49Å
156	S	33.9	Very low	33.4	Very low	81 Å²	81	144.5 Å²	144.5	57%	0.566	71%	0.714	S	S	*	*	H	α-helix	trans	-73.7	-35.2	179.6	179.6	0	0	0	0	113.6	S152 I154 S160	S152-S156 PolarHBondContact O-N 3.42Å; I154-S156 VanDerWaalsContact C-N 3.35Å; S156-S160 PolarHBondContact O-OG 3.47Å
157	M	33.9	Very low	33.3	Very low	130 Å²	130	138 Å²	138	64%	0.64	70%	0.704	S	S	*	*	H	α-helix	trans	-81.1	-18.7	-179.6	-70.6	-178.2	171.7	0	0	114.4	M153 S160 T161	M153-M157 PolarHBondContact O-N 3.21Å; M157-S160 PolarHBondContact O-OG 2.75Å; M157-T161 PolarHBondContact O-OG1 2.89Å
158	V	37.9	Very low	33.3	Very low	84 Å²	84	135.6 Å²	135.6	51%	0.509	70%	0.703	S	S	.	*	H	α-helix	trans	-87.9	-20.8	-178.3	175.5	0	0	0	0	112.4	I154 S162	I154-V158 HydrophobicContact CG2-CG2 4.41Å; I154-V158 WeakPolarHBondContact O-CG2 3.47Å; I154-V158 PolarHBondContact O-N 3.21Å; V158-S162 PolarHBondContact O-OG 3.17Å
159	L	34.6	Very low	33.6	Very low	145 Å²	145	129.7 Å²	129.7	76%	0.759	70%	0.7	S	S	*	*	S	Bend	trans	-85.9	-15.6	177	-78.9	157.9	0	0	0	113.6	R155	R155-L159 WeakPolarHBondContact O-CD1 3.49Å
160	S	32.7	Very low	33.5	Very low	86 Å²	86	129 Å²	129	60%	0.601	70%	0.696	S	S	*	*	S	Bend	trans	-96.9	-10.7	-175.8	33.5	0	0	0	0	114.3	S156 M157	S156-S160 PolarHBondContact O-OG 3.47Å; M157-S160 PolarHBondContact O-OG 2.75Å
161	T	35.5	Very low	33.6	Very low	89 Å²	89	127.9 Å²	127.9	55%	0.546	70%	0.697	S	S	.	*	S	Bend	trans	-107.2	-3.3	-179.2	39.3	0	0	0	0	114.3	M157 R163	M157-T161 PolarHBondContact O-OG1 2.89Å; T161-R163 VanDerWaalsContact C-N 3.31Å; T161-R163 PolarHBondContact O-N 3.27Å
162	S	34.2	Very low	33.6	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	8.1	179.2	-61.3	0	0	0	0	114.8	V158	V158-S162 PolarHBondContact O-OG 3.17Å
163	R	32.7	Very low	33.5	Very low	248 Å²	248	135.2 Å²	135.2	94%	0.936	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	4.7	176.2	-79.6	-177.4	-177.8	168.3	1	114.7	T161	T161-R163 VanDerWaalsContact C-N 3.31Å; T161-R163 PolarHBondContact O-N 3.27Å
164	A	31.1	Very low	33.6	Very low	79 Å²	79	138.4 Å²	138.4	65%	0.653	73%	0.73	S	S	*	*			trans	-121.8	15.3	-168.2	0	0	0	0	0	116.3
165	I	32.9	Very low	33.2	Very low	163 Å²	163	136.7 Å²	136.7	84%	0.836	74%	0.74	S	S	*	*			trans	-113.4	68.9	175.3	-47.6	177.3	0	0	0	109.3
166	R	28.4	Very low	33.2	Very low	245 Å²	245	136.3 Å²	136.3	93%	0.925	75%	0.746	S	S	*	*			trans	-142.3	79.4	164.3	-87	-170.1	176.6	-178	-0.8	107.8
167	S	29.3	Very low	33.2	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	75%	0.751	S	S	*	*			trans	-173.9	147	160.2	48.7	0	0	0	0	110.7
168	E	31	Very low	33.3	Very low	180 Å²	180	139.2 Å²	139.2	84%	0.841	76%	0.758	S	S	*	*			trans	90.1	89.4	159.7	-64.5	171.6	176.4	0	0	119.3
169	S	34.1	Very low	33.1	Very low	123 Å²	123	141.8 Å²	141.8	86%	0.86	77%	0.768	S	S	*	*				-156.9	99.5	116.9	62.3	0	0	0	0	111.2
170	L	30.7	Very low	33.2	Very low	162 Å²	162	138.9 Å²	138.9	85%	0.848	76%	0.76	S	S	*	*			trans	-54	157.8	154	-79.4	139.3	0	0	0	109.9
171	S	34	Very low	33.3	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	77%	0.774	S	S	*	*			cis	-168.3	146.9	10.9	38.1	0	0	0	0	106.4
172	Q	35.6	Very low	33.3	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	79%	0.785	S	S	*	*				169.7	109.4	98	-84.8	172.2	-0.5	0	0	105.2
173	S	34.6	Very low	33.4	Very low	97 Å²	97	148.8 Å²	148.8	68%	0.678	79%	0.786	S	S	*	*				86.5	139.9	77.5	66.8	0	0	0	0	115.9
174	F	34.2	Very low	33.4	Very low	213 Å²	213	146.8 Å²	146.8	93%	0.934	78%	0.778	S	S	*	*			trans	84.9	108.4	-175.6	-65.7	-83.4	0	0	0	114.5
175	G	31.6	Very low	33.5	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	79%	0.785	S	S	*	*			cis	119	133.5	41.1	0	0	0	0	0	105.2
176	E	34.3	Very low	33.8	Very low	194 Å²	194	147.5 Å²	147.5	91%	0.907	78%	0.784	S	S	*	*			cis	-155.1	168.6	19.9	-76	171	126.3	0	0	110.5
177	S	34.1	Very low	33.9	Very low	94 Å²	94	140.7 Å²	140.7	66%	0.657	77%	0.774	S	S	*	*			trans	-47.6	169.4	178	54.2	0	0	0	0	118.7
178	F	35.9	Very low	34.2	Very low	179 Å²	179	143.1 Å²	143.1	79%	0.785	78%	0.778	S	S	*	*			cis	-156	133.6	35.6	-106.7	-94.8	0	0	0	107.2
179	D	34.8	Very low	34.3	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	77%	0.773	S	S	*	*				75.4	136.5	95	-147.5	38.4	0	0	0	113.3
180	S	34.9	Very low	34.2	Very low	85 Å²	85	141.6 Å²	141.6	59%	0.594	77%	0.771	S	S	*	*			cis	-169.4	171.2	-7	-119.9	0	0	0	0	107.8
181	N	36.7	Very low	34.5	Very low	165 Å²	165	139.8 Å²	139.8	88%	0.882	77%	0.771	S	S	*	*			trans	97.7	106.7	160.4	-59.8	-39.8	0	0	0	120.3
182	R	35.1	Very low	34.6	Very low	206 Å²	206	147 Å²	147	78%	0.777	78%	0.784	S	S	*	*			trans	-119.3	149.7	161.7	147.5	-179.4	-111.1	-106.4	5.7	105.7
183	P	36.3	Very low	34.7	Very low	113 Å²	113	143.8 Å²	143.8	73%	0.734	78%	0.779	S	S	*	*				-152.4	142.5	101.5	31.2	-8.2	0	0	0	119.3
184	R	31.7	Very low	34.6	Very low	207 Å²	207	146 Å²	146	78%	0.781	79%	0.788	S	S	*	*			trans	55.6	137.5	139	-62.9	178.8	-162.8	-115.9	2.1	122
185	P	32.9	Very low	34.5	Very low	123 Å²	123	140 Å²	140	80%	0.799	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-101.7	143.3	149.5	33.6	-22.7	0	0	0	112.3
186	V	39	Very low	34.7	Very low	134 Å²	134	146 Å²	146	81%	0.812	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-100.2	137.8	175.9	177	0	0	0	0	109.2
187	S	30.5	Very low	34.4	Very low	101 Å²	101	146 Å²	146	71%	0.706	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76.2	153.6	171.7	42.2	0	0	0	0	113.1
188	L	36.9	Very low	34.3	Very low	152 Å²	152	147.1 Å²	147.1	80%	0.796	79%	0.794	S	S	*	*			trans	168.5	105.8	143.7	-88.6	156.2	0	0	0	108.7
189	T	32.6	Very low	34.2	Very low	117 Å²	117	144.8 Å²	144.8	72%	0.718	80%	0.797	S	S	*	*				78.3	125.8	95.3	57.7	0	0	0	0	117.3
190	D	31.9	Very low	33.9	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	80%	0.799	S	S	*	*			trans	54.1	121	147.5	-90.6	-33.9	0	0	0	121.8
191	S	37.8	Very low	34.2	Very low	124 Å²	124	145.6 Å²	145.6	87%	0.867	81%	0.81	S	S	*	*				-177.1	149.9	114.4	-76.9	0	0	0	0	112.3
192	R	35.2	Very low	34	Very low	244 Å²	244	143.4 Å²	143.4	92%	0.921	81%	0.805	S	S	*	*			trans	-97.5	-173.2	-163.4	-127	-170.7	-175	-171.9	2.6	112.1
193	P	37.7	Very low	34.1	Very low	108 Å²	108	141.5 Å²	141.5	70%	0.701	81%	0.807	S	S	*	*				-112.1	165.1	-126.1	40.4	-25	0	0	0	115.3
194	V	33.6	Very low	34	Very low	144 Å²	144	145 Å²	145	87%	0.873	81%	0.811	S	S	*	*			trans	-143.9	135.4	163.8	175.1	0	0	0	0	110.8
195	A	31.7	Very low	33.8	Very low	88 Å²	88	140 Å²	140	73%	0.727	81%	0.814	S	S	*	*			trans	-79.9	152.7	177.2	0	0	0	0	0	112.4
196	Q	34.7	Very low	33.9	Very low	197 Å²	197	140 Å²	140	92%	0.921	82%	0.816	S	S	*	*			trans	-163.2	129.2	148	-109.9	161.6	4.4	0	0	112.2
197	Q	28	Very low	33.6	Very low	195 Å²	195	141.2 Å²	141.2	91%	0.911	81%	0.813	S	S	*	*			trans	-86.8	154.7	171.9	-67.7	168.6	-1.1	0	0	109.9
198	S	33.4	Very low	33.8	Very low	118 Å²	118	142.9 Å²	142.9	83%	0.825	81%	0.814	S	S	*	*			trans	-153.5	154.9	159.4	47.8	0	0	0	0	111.6
199	P	32	Very low	33.5	Very low	129 Å²	129	142.4 Å²	142.4	84%	0.838	81%	0.812	S	S	*	*			trans	-119.7	172.2	-139.6	38.5	-24.7	0	0	0	115.1
200	S	29.5	Very low	33.4	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	81%	0.805	S	S	*	*			trans	-103.3	150.8	172	45.5	0	0	0	0	112.9
201	P	40	Very low	33.4	Very low	128 Å²	128	141 Å²	141	83%	0.831	81%	0.806	S	S	*	*			trans	-97.2	153.6	178.2	36.4	-34.4	0	0	0	114.9
202	P	33.4	Very low	33.1	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	80%	0.803	S	S	*	*			trans	-128.9	131.1	174.7	36	-19.7	0	0	0	116.2
203	M	36.3	Very low	32.7	Very low	165 Å²	165	136.2 Å²	136.2	81%	0.813	80%	0.802	S	S	*	*			trans	-151.9	149.4	167.3	-66.9	-172.8	78.1	0	0	109.1
204	K	34.5	Very low	32.5	Very low	188 Å²	188	135.9 Å²	135.9	82%	0.817	80%	0.802	S	S	*	*			cis	-164.3	157.3	-13.6	-109.1	-174.2	-176.6	176.6	0	105.4
205	A	27.7	Very low	32.4	Very low	101 Å²	101	140.2 Å²	140.2	84%	0.835	80%	0.803	S	S	*	*			trans	-70	158	-179	0	0	0	0	0	114.9
206	S	35	Very low	32.6	Very low	123 Å²	123	141.9 Å²	141.9	86%	0.86	80%	0.804	S	S	*	*			trans	-155.8	125.7	142.6	-176.8	0	0	0	0	110.1
207	E	32.2	Very low	32.4	Very low	160 Å²	160	137 Å²	137	75%	0.748	79%	0.792	S	S	*	*			trans	-67.1	152.9	170.5	-60.9	160.7	133.9	0	0	110.9
208	N	35.5	Very low	32.5	Very low	136 Å²	136	135.4 Å²	135.4	73%	0.727	79%	0.789	S	S	*	*				164.3	140.3	109.1	-92.4	-28	0	0	0	115.8
209	L	30.8	Very low	32.5	Very low	142 Å²	142	136.7 Å²	136.7	74%	0.743	79%	0.786	S	S	*	*			trans	70.4	99.1	144.7	-85.6	92.3	0	0	0	122.8
210	S	30.3	Very low	32.4	Very low	81 Å²	81	138.3 Å²	138.3	57%	0.566	78%	0.783	S	S	*	*				47.7	141.3	109.7	66.5	0	0	0	0	123.4
211	N	32.3	Very low	32.7	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	78%	0.784	S	S	*	*			trans	82.5	134.8	158.8	-55.2	-22.8	0	0	0	114.9
212	A	32.1	Very low	32.3	Very low	98 Å²	98	138.1 Å²	138.1	81%	0.81	78%	0.777	S	S	*	*			cis	-155.1	145.4	22.1	0	0	0	0	0	111.3
213	L	25.9	Very low	32.2	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	78%	0.783	S	S	*	*			trans	-74	140.6	156.6	-75.9	159.2	0	0	0	109.1
214	S	33.3	Very low	31.9	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	78%	0.777	S	S	*	*			trans	174.5	128.1	135.2	-83.6	0	0	0	0	114
215	R	32.5	Very low	31.5	Very low	235 Å²	235	141.4 Å²	141.4	89%	0.887	79%	0.786	S	S	*	*			trans	70	136.4	141.5	-64.1	176.2	169.9	-172.9	-3.6	116.4
216	T	34.5	Very low	31.3	Very low	122 Å²	122	145 Å²	145	75%	0.748	79%	0.786	S	S	*	*			cis	-164	126.5	34.1	39.5	0	0	0	0	107.8
217	S	30.8	Very low	31	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	79%	0.785	S	S	*	*				55	127.4	92.5	91.7	0	0	0	0	119.3
218	L	31.2	Very low	30.7	Very low	162 Å²	162	142 Å²	142	85%	0.848	78%	0.783	S	S	*	*			trans	78.9	138.4	155.9	-49	170.2	0	0	0	115.4
219	N	33.4	Very low	30.6	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	79%	0.791	S	S	*	*			cis	-162.1	159.3	27.5	-161.7	12.2	0	0	0	111.2
220	E	30.2	Very low	30.4	Very low	163 Å²	163	147.8 Å²	147.8	76%	0.762	80%	0.798	S	S	*	*			trans	-76.3	150.9	171.5	-67.5	173.4	112.4	0	0	112.1
221	N	34.7	Very low	30.5	Very low	151 Å²	151	151.2 Å²	151.2	81%	0.807	82%	0.815	S	S	*	*				163	126.4	126.2	-81.7	-36.9	0	0	0	115
222	A	32.2	Very low	30.4	Very low	83 Å²	83	148.9 Å²	148.9	69%	0.686	81%	0.812	S	S	*	*			trans	59.1	114.4	130.8	0	0	0	0	0	124.2
223	L	29.8	Very low	30.3	Very low	170 Å²	170	149.7 Å²	149.7	89%	0.89	81%	0.809	S	S	*	*				85.9	150.9	126.8	-66	172.9	0	0	0	122.5
224	P	30.1	Very low	30.6	Very low	108 Å²	108	153.8 Å²	153.8	70%	0.701	81%	0.812	S	S	*	*			trans	-113.2	160.9	-153.6	40.2	-27.7	0	0	0	114.8
225	W	26.2	Very low	30.3	Very low	265 Å²	265	158 Å²	158	100%	1.004	82%	0.821	S	S	*	*			trans	-129.2	146.6	174.1	-96.9	56.5	0	0	0	113.1
226	Q	25	Very low	30.3	Very low	177 Å²	177	153.9 Å²	153.9	83%	0.827	82%	0.816	S	S	*	*			trans	-127.8	155.8	-174.5	-144.3	-176.7	16	0	0	109.4
227	S	27.8	Very low	30.1	Very low	119 Å²	119	152.8 Å²	152.8	83%	0.832	81%	0.814	S	S	*	*			trans	76.7	149	166.6	86.3	0	0	0	0	115.6
228	S	27.2	Very low	29.9	Very low	101 Å²	101	153.4 Å²	153.4	71%	0.706	82%	0.818	S	S	*	*			cis	-167.8	157.7	1.1	-174.3	0	0	0	0	105.8
229	E	32.6	Very low	29.9	Very low	193 Å²	193	156.6 Å²	156.6	90%	0.902	82%	0.82	S	S	*	*				163.9	140.8	128.3	-88.1	178.5	154.4	0	0	113.8
230	K	26.3	Very low	29.5	Very low	205 Å²	205	157.7 Å²	157.7	89%	0.891	82%	0.821	S	S	*	*			trans	-96.1	149.6	-174.3	-70.1	173.3	176.2	177.1	0	111
231	V	32.9	Very low	29.7	Very low	153 Å²	153	155.2 Å²	155.2	93%	0.927	82%	0.821	S	S	*	*			trans	-140	139.7	153.6	-177.6	0	0	0	0	110
232	S	29	Very low	29.5	Very low	111 Å²	111	153.4 Å²	153.4	78%	0.776	82%	0.82	S	S	*	*			trans	-100.4	166.1	-170.4	-151.4	0	0	0	0	112.7
233	P	31.3	Very low	29.9	Very low	115 Å²	115	154.7 Å²	154.7	75%	0.747	82%	0.822	S	S	*	*			trans	-106.7	172.4	-159.9	40	-31.4	0	0	0	115.9
234	R	31.6	Very low	30	Very low	255 Å²	255	153.4 Å²	153.4	96%	0.962	82%	0.816	S	S	*	*			trans	-134.8	146.1	168.2	-78.6	-174.1	175.2	-176	-1.6	112.7
235	Q	27.5	Very low	30.1	Very low	191 Å²	191	155.2 Å²	155.2	89%	0.893	82%	0.82	S	S	*	*			trans	-95.9	159	-178.2	-66.6	167	-71.1	0	0	112.5
236	D	31.3	Very low	30.1	Very low	148 Å²	148	149.1 Å²	149.1	79%	0.791	81%	0.807	S	S	*	*			trans	-168.4	116.8	142.6	-109.8	-34.6	0	0	0	108.4
237	S	30.8	Very low	30.2	Very low	99 Å²	99	148.1 Å²	148.1	69%	0.692	81%	0.805	S	S	*	*				68.1	147	91.4	74.2	0	0	0	0	113.9
238	S	27.5	Very low	30.1	Very low	108 Å²	108	146 Å²	146	76%	0.755	80%	0.803	S	S	*	*			cis	177.8	136.9	-26.5	48.2	0	0	0	0	105.6
239	Y	30.5	Very low	29.9	Very low	228 Å²	228	151.1 Å²	151.1	89%	0.894	81%	0.812	S	S	*	*			trans	-163.1	127.7	151.8	-150	-102.7	0	0	0	112.7
240	E	25.6	Very low	29.5	Very low	169 Å²	169	150.5 Å²	150.5	79%	0.79	81%	0.807	S	S	*	*			trans	-95.6	158.8	176.9	-77.1	176.3	120.1	0	0	112.3
241	S	33.3	Very low	29.4	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	80%	0.804	S	S	*	*			trans	173.9	128.6	146.5	32.3	0	0	0	0	109
242	S	31.6	Very low	28.9	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	79%	0.794	S	S	*	*			trans	-118.4	-72.8	-146.6	-64.4	0	0	0	0	119.9
243	P	39.5	Very low	28.7	Very low	111 Å²	111	151.2 Å²	151.2	72%	0.721	79%	0.791	S	S	*	*			trans	-126.8	155	-152.4	38.6	-21.9	0	0	0	116.8
244	D	32	Very low	28.3	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	78%	0.775	S	S	*	*				-175.8	146.6	118.9	-112.2	-16	0	0	0	113.9
245	N	32.4	Very low	28	Very low	146 Å²	146	138.6 Å²	138.6	78%	0.781	75%	0.745	S	S	*	*			trans	72.9	139.4	164.2	-52.1	-39.1	0	0	0	119.3
246	D	27.4	Very low	28	Very low	137 Å²	137	136.4 Å²	136.4	73%	0.733	74%	0.739	S	S	*	*			cis	-174.8	162.9	-22.8	-171.9	6.7	0	0	0	103.8
247	I	26.4	Very low	27.8	Very low	156 Å²	156	135.2 Å²	135.2	80%	0.8	73%	0.732	S	S	*	*			trans	79.5	97.4	159.6	-45.4	173.6	0	0	0	117.5
248	G	25.4	Very low	27.7	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	73%	0.728	S	S	*	*			trans	160.3	59.8	158.7	0	0	0	0	0	117.2	K250	G248-K250 PolarHBondContact O-N 2.87Å
249	K	23.4	Very low	28.3	Very low	208 Å²	208	132.5 Å²	132.5	90%	0.904	70%	0.702	S	S	*	*			trans	-44.8	125.8	173.4	-63.2	172.8	178.8	173.6	0	113.3
250	K	24.8	Very low	28.9	Very low	180 Å²	180	122.6 Å²	122.6	78%	0.783	67%	0.665	S	S	*	*				164.2	106.9	116.7	-91.2	-168.5	168	169.4	0	114.3	G248	G248-K250 PolarHBondContact O-N 2.87Å
251	W	23.4	Very low	29.9	Very low	218 Å²	218	115.4 Å²	115.4	83%	0.826	63%	0.634	S	S	*	*			trans	57.3	120.9	143.7	-48.8	101.6	0	0	0	121.7
252	S	22.3	Very low	30.7	Very low	104 Å²	104	111.4 Å²	111.4	73%	0.727	61%	0.606	S	S	*	*			trans	-132.9	139.6	172.9	34.9	0	0	0	0	111.6
253	F	24.3	Very low	31.6	Very low	162 Å²	162	108.4 Å²	108.4	71%	0.711	58%	0.583	S	S	*	*			trans	-157.3	156.1	164	-72.5	-71.7	0	0	0	106.2	Q310	F253-Q310 PolarHBondContact O-NE2 2.62Å
254	G	24.1	Very low	32.1	Very low	39 Å²	39	105.3 Å²	105.3	40%	0.402	56%	0.558	S	S	.	*			cis	162.9	139.5	-5.7	0	0	0	0	0	110.1
255	I	25.4	Very low	33.4	Very low	66 Å²	66	106.1 Å²	106.1	34%	0.338	55%	0.55	S	S	.	*			trans	-140	103.1	171.7	-66.6	170.3	0	0	0	109.1	T259 A261	I255-T259 WeakPolarHBondContact CG1-O 3.19Å; I255-T259 WeakPolarHBondContact CG2-O 3.19Å; I255-A261 HydrophobicContact CD1-CB 3.49Å; I255-A261 VanDerWaalsContact CD1-CB 3.49Å; I255-A261 WeakPolarHBondContact CD1-O 3.48Å; I255-A261 HydrophobicContact CG1-CB 3.38Å
256	D	25.9	Very low	34.7	Very low	144 Å²	144	103.4 Å²	103.4	77%	0.77	54%	0.535	S	S	*	.			trans	-81.3	154.6	155.5	-84.4	-41.5	0	0	0	110.5	L258 T259	D256-L258 PolarHBondContact O-N 3.28Å; D256-T259 PolarHBondContact O-N 2.81Å; D256-T259 PolarHBondContact O-OG1 2.91Å
257	L	27	Very low	36.8	Very low	123 Å²	123	97.5 Å²	97.5	64%	0.644	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	68.2	-175.8	-90.7	146.3	0	0	0	113.7	L318 P353	L257-L318 HydrophobicContact CD2-CD2 3.92Å; L257-P353 HydrophobicContact CD2-CB 4.03Å
258	L	28.8	Very low	39	Very low	118 Å²	118	94 Å²	94	62%	0.618	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.9	0.1	154.6	-131	93.1	0	0	0	111.5	D256 H314 G315	D256-L258 PolarHBondContact O-N 3.28Å; L258-H314 CarbonylContact O-C 3.59Å; L258-H314 WeakPolarHBondContact O-CA 3.19Å; L258-G315 PolarHBondContact O-N 2.98Å
259	T	40.2	Very low	41.4	Very low	33 Å²	33	96.8 Å²	96.8	20%	0.202	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	105.6	-162.6	19.3	0	0	0	0	113.4	I255 D256 A261 I312 Y313 H314	I255-T259 WeakPolarHBondContact CG1-O 3.19Å; I255-T259 WeakPolarHBondContact CG2-O 3.19Å; D256-T259 PolarHBondContact O-N 2.81Å; D256-T259 PolarHBondContact O-OG1 2.91Å; T259-A261 PolarHBondContact O-N 2.85Å; T259-A261 VanDerWaalsContact O-N 3.16Å; T259-I312 HydrophobicContact CG2-CG2 3.29Å; T259-Y313 CarbonylContact C-O 3.54Å; T259-Y313 VanDerWaalsContact CA-O 3.25Å; T259-Y313 WeakPolarHBondContact CA-O 3.49Å; T259-H314 HydrophobicContact CG2-CB 4.36Å; T259-H314 VanDerWaalsContact CG2-CE1 3.45Å; T259-H314 WeakPolarHBondContact CG2-CE1 3.45Å; T259-H314 WeakPolarHBondContact CG2-ND1 3.46Å
260	L	42.8	Very low	44	Very low	20 Å²	20	87.4 Å²	87.4	11%	0.105	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	97.5	173.4	-174.8	125.6	0	0	0	110	I312 Y313 V316 M321 L326 L348	L260-I312 WeakPolarHBondContact O-CA 3.5Å; L260-Y313 HydrophobicContact CD2-CD2 3.97Å; L260-Y313 PolarHBondContact N-O 3.46Å; L260-Y313 PolarHBondContact O-N 3.47Å; L260-V316 HydrophobicContact CB-CG2 4.01Å; L260-M321 HydrophobicContact CD1-SD 4.2Å; L260-L326 HydrophobicContact CD2-CD1 4.38Å; L260-L326 HydrophobicContact CD2-CD2 4.16Å; L260-L348 HydrophobicContact CD1-CD1 3.91Å; L260-L348 HydrophobicContact CD1-CD2 3.61Å; L260-L348 HydrophobicContact CD1-CG 4.41Å
261	A	47.8	Very low	46.1	Very low	18 Å²	18	81.5 Å²	81.5	15%	0.149	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.5	169.4	0	0	0	0	0	111.5	I255 T259 L311 I312	I255-A261 HydrophobicContact CD1-CB 3.49Å; I255-A261 VanDerWaalsContact CD1-CB 3.49Å; I255-A261 WeakPolarHBondContact CD1-O 3.48Å; I255-A261 HydrophobicContact CG1-CB 3.38Å; T259-A261 PolarHBondContact O-N 2.85Å; T259-A261 VanDerWaalsContact O-N 3.16Å; A261-L311 CarbonylContact C-O 3.57Å; A261-L311 WeakPolarHBondContact CA-O 3.36Å; A261-I312 HydrophobicContact CB-CD1 4.47Å; A261-I312 HydrophobicContact CB-CG1 3.86Å
262	C	50	Low	48.8	Very low	26 Å²	26	73.4 Å²	73.4	18%	0.176	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.6	172	-176.2	0	0	0	0	108.8	L285 L311 L326	C262-L285 HydrophobicContact CB-CD2 3.7Å; C262-L311 PolarHBondContact N-O 3.29Å; C262-L311 PolarHBondContact O-N 2.63Å; C262-L311 VanDerWaalsContact O-N 3.15Å; C262-L326 HydrophobicContact CB-CD2 4.47Å
263	T	49.5	Very low	51.7	Low	50 Å²	50	72.4 Å²	72.4	31%	0.307	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	108	-179.9	-27.3	0	0	0	0	108.9	R265 Q310	T263-R265 HydrophobicContact CG2-CG 4.41Å; T263-R265 PolarHBondContact O-N 3.31Å; T263-R265 VanDerWaalsContact O-N 3.14Å; T263-Q310 HydrophobicContact CG2-CG 3.96Å
264	K	51.4	Low	54.1	Low	45 Å²	45	66.4 Å²	66.4	20%	0.196	37%	0.367	C	S	.	.			trans	-90.1	80.5	-174.7	-145.2	-49.2	92	174.8	0	112.4	L266 V283 W307 E309	K264-L266 PolarHBondContact NZ-O 3.47Å; K264-V283 HydrophobicContact CD-CG2 4.33Å; K264-V283 HydrophobicContact CG-CB 4.37Å; K264-V283 HydrophobicContact CG-CG1 4.47Å; K264-V283 HydrophobicContact CG-CG2 3.97Å; K264-W307 HydrophobicContact CB-CE3 4.32Å; K264-W307 HydrophobicContact CD-CE3 3.63Å; K264-W307 HydrophobicContact CD-CZ3 3.55Å; K264-W307 HydrophobicContact CG-CE3 4.04Å; K264-W307 HydrophobicContact CG-CZ3 4.26Å; K264-E309 PolarHBondContact N-O 3.16Å
265	R	58.4	Low	56.7	Low	160 Å²	160	71 Å²	71	60%	0.604	39%	0.394	S	S	*	.			trans	-82.3	121.1	176.6	-64	-170.9	178.7	-162.1	-0.8	111	T263	T263-R265 HydrophobicContact CG2-CG 4.41Å; T263-R265 PolarHBondContact O-N 3.31Å; T263-R265 VanDerWaalsContact O-N 3.14Å
266	L	59.3	Low	59.3	Low	88 Å²	88	71.2 Å²	71.2	46%	0.461	40%	0.395	S	S	.	.			trans	46.2	129.3	174.7	-160.2	69.9	0	0	0	117.9	K264 V268 P305 C306	K264-L266 PolarHBondContact NZ-O 3.47Å; L266-V268 HydrophobicContact CD1-CG2 4.44Å; L266-V268 HydrophobicContact CD2-CG2 3.39Å; L266-V268 HydrophobicContact CG-CG2 3.59Å; L266-P305 WeakPolarHBondContact CA-O 3.45Å; L266-C306 HydrophobicContact CD1-CB 4.26Å
267	A	72.6	Confident	61.8	Low	14 Å²	14	66.4 Å²	66.4	12%	0.116	38%	0.38	C	S	.	.			trans	-109.5	148.7	150.3	0	0	0	0	0	108.3	L270 N304 P305 W307	A267-L270 HydrophobicContact CB-CD1 4.09Å; A267-L270 HydrophobicContact CB-CD2 4.08Å; A267-L270 HydrophobicContact CB-CG 4.13Å; A267-N304 CarbonylContact O-C 3.54Å; A267-N304 VanDerWaalsContact O-C 3.28Å; A267-N304 WeakPolarHBondContact O-CA 2.99Å; A267-P305 HydrophobicContact CB-CG 3.88Å; A267-P305 PolarHBondContact N-O 3.41Å; A267-W307 HydrophobicContact CB-CH2 3.79Å; A267-W307 HydrophobicContact CB-CZ3 3.75Å
268	V	72.5	Confident	64.7	Low	82 Å²	82	65 Å²	65	50%	0.497	37%	0.369	S	S	.	.			trans	-129.7	141.2	-176.6	-173.5	0	0	0	0	108.3	L266 L270 N304	L266-V268 HydrophobicContact CD1-CG2 4.44Å; L266-V268 HydrophobicContact CD2-CG2 3.39Å; L266-V268 HydrophobicContact CG-CG2 3.59Å; V268-L270 PolarHBondContact O-N 2.79Å; V268-N304 VanDerWaalsContact CA-OD1 3.24Å; V268-N304 WeakPolarHBondContact CA-OD1 3.4Å; V268-N304 WeakPolarHBondContact CG1-OD1 3.43Å
269	N	75.8	Confident	67.4	Low	135 Å²	135	59.3 Å²	59.3	72%	0.722	34%	0.339	S	S	*	.	S	Bend	trans	55.8	47.3	175.3	-60.8	-29.5	0	0	0	113.8	L303 N304	N269-L303 PolarHBondContact N-O 3.27Å; N269-N304 PolarHBondContact N-OD1 3.2Å
270	L	77.6	Confident	69.7	Low	11 Å²	11	59.5 Å²	59.5	6%	0.058	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-65.8	150.9	170.2	-63.7	178.5	0	0	0	110.9	A267 V268 P281 L303 P305 V330 L341 L363	A267-L270 HydrophobicContact CB-CD1 4.09Å; A267-L270 HydrophobicContact CB-CD2 4.08Å; A267-L270 HydrophobicContact CB-CG 4.13Å; V268-L270 PolarHBondContact O-N 2.79Å; L270-P281 HydrophobicContact CD1-CB 3.59Å; L270-P281 HydrophobicContact CD1-CG 3.87Å; L270-L303 HydrophobicContact CB-CB 4.44Å; L270-L303 WeakPolarHBondContact CB-O 3.45Å; L270-L303 WeakPolarHBondContact CG-O 3.23Å; L270-L303 PolarHBondContact N-O 3.38Å; L270-L303 WeakPolarHBondContact O-CD2 3.29Å; L270-P305 HydrophobicContact CD1-CG 3.6Å; L270-V330 HydrophobicContact CD1-CG1 4.27Å; L270-V330 HydrophobicContact CD2-CG1 4.39Å; L270-L341 HydrophobicContact CD1-CD1 4.38Å; L270-L363 HydrophobicContact CD2-CD1 3.6Å
271	P	68.2	Low	71.9	Confident	56 Å²	56	58.5 Å²	58.5	36%	0.364	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-61.7	145.1	169.3	-20.1	31.5	0	0	0	111.6	M273 S279 L341	P271-M273 HydrophobicContact CB-SD 4.25Å; P271-S279 PolarHBondContact O-OG 2.94Å; P271-S279 VanDerWaalsContact O-OG 3.06Å; P271-L341 HydrophobicContact CB-CD2 4.2Å; P271-L341 HydrophobicContact CG-CD2 4.33Å; P271-L341 VanDerWaalsContact O-CD2 3.3Å; P271-L341 WeakPolarHBondContact O-CD2 3.21Å
272	A	81.7	Confident	74	Confident	47 Å²	47	58.3 Å²	58.3	39%	0.388	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-82.7	116.8	166.8	0	0	0	0	0	109.7	G277 F278 L303	A272-G277 VanDerWaalsContact CB-O 3.23Å; A272-G277 WeakPolarHBondContact CB-O 3.08Å; A272-F278 CarbonylContact C-O 3.52Å; A272-F278 WeakPolarHBondContact CA-O 3.21Å; A272-L303 HydrophobicContact CB-CD1 4.42Å; A272-L303 HydrophobicContact CB-CD2 4.12Å
273	M	81.9	Confident	75.7	Confident	83 Å²	83	57.2 Å²	57.2	41%	0.409	32%	0.322	S	S	.	.			trans	-103.2	-20.2	176.5	-49.7	-69.1	-62.1	0	0	112.6	P271 F278 S279 D332 D339 L341	P271-M273 HydrophobicContact CB-SD 4.25Å; M273-F278 PolarHBondContact N-O 2.98Å; M273-S279 PolarHBondContact N-OG 3.16Å; M273-D332 HydrophobicContact CB-CB 4.31Å; M273-D332 VanDerWaalsContact CB-OD2 3.27Å; M273-D332 WeakPolarHBondContact CB-OD2 3.37Å; M273-D332 HydrophobicContact CG-CB 4.33Å; M273-D339 HydrophobicContact CB-CB 4.49Å; M273-D339 HydrophobicContact CE-CB 4.19Å; M273-L341 HydrophobicContact CG-CD2 3.5Å; M273-L341 HydrophobicContact CG-CG 4.38Å; M273-L341 HydrophobicContact SD-CD2 4.33Å
274	D	75.8	Confident	77.5	Confident	36 Å²	36	58.4 Å²	58.4	19%	0.193	32%	0.322	C	S	.	.	S	Bend	trans	-81	151.7	174.7	-83.4	-31.5	0	0	0	112.5	N276 G277 F278	D274-N276 WeakPolarHBondContact CB-OD1 3.41Å; D274-N276 PolarHBondContact O-N 3.44Å; D274-N276 PolarHBondContact OD2-ND2 3.44Å; D274-G277 PolarHBondContact O-N 2.9Å; D274-G277 VanDerWaalsContact O-N 3.1Å; D274-F278 WeakPolarHBondContact CB-O 3.29Å; D274-F278 PolarHBondContact N-O 2.95Å
275	S	78	Confident	79.2	Confident	136 Å²	136	56.3 Å²	56.3	95%	0.951	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-12.2	173.4	60.4	0	0	0	0	114.3	G277	S275-G277 VanDerWaalsContact C-N 3.27Å
276	N	80.2	Confident	80.5	Confident	70 Å²	70	49.8 Å²	49.8	37%	0.374	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.6	176.5	65	25.2	0	0	0	113.2	D274 F278	D274-N276 WeakPolarHBondContact CB-OD1 3.41Å; D274-N276 PolarHBondContact O-N 3.44Å; D274-N276 PolarHBondContact OD2-ND2 3.44Å; N276-F278 WeakPolarHBondContact O-CD2 3.36Å; N276-F278 WeakPolarHBondContact OD1-CA 3.41Å; N276-F278 WeakPolarHBondContact OD1-CB 3.29Å; N276-F278 PolarHBondContact OD1-N 2.85Å
277	G	79.4	Confident	81.7	Confident	43 Å²	43	45.7 Å²	45.7	44%	0.443	27%	0.268	S	S	.	.	S	Bend	trans	84.2	10.3	-177.1	0	0	0	0	0	114.8	A272 D274 S275	A272-G277 VanDerWaalsContact CB-O 3.23Å; A272-G277 WeakPolarHBondContact CB-O 3.08Å; D274-G277 PolarHBondContact O-N 2.9Å; D274-G277 VanDerWaalsContact O-N 3.1Å; S275-G277 VanDerWaalsContact C-N 3.27Å
278	F	87.2	Confident	82.2	Confident	93 Å²	93	46.6 Å²	46.6	41%	0.408	27%	0.271	S	S	.	.			trans	-126.3	-168	176.4	-62.2	-86.5	0	0	0	110.6	A272 M273 D274 N276 K301 L303	A272-F278 CarbonylContact C-O 3.52Å; A272-F278 WeakPolarHBondContact CA-O 3.21Å; M273-F278 PolarHBondContact N-O 2.98Å; D274-F278 WeakPolarHBondContact CB-O 3.29Å; D274-F278 PolarHBondContact N-O 2.95Å; N276-F278 WeakPolarHBondContact O-CD2 3.36Å; N276-F278 WeakPolarHBondContact OD1-CA 3.41Å; N276-F278 WeakPolarHBondContact OD1-CB 3.29Å; N276-F278 PolarHBondContact OD1-N 2.85Å; F278-K301 HydrophobicContact CB-CB 4.21Å; F278-K301 WeakPolarHBondContact CD1-O 3.37Å; F278-K301 HydrophobicContact CG-CB 4.34Å; F278-L303 HydrophobicContact CD1-CG 4.38Å
279	S	84.6	Confident	82.4	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.			trans	-140.8	162.9	167.3	-83.2	0	0	0	0	108.7	P271 M273 P281 K301 T302 D332	P271-S279 PolarHBondContact O-OG 2.94Å; P271-S279 VanDerWaalsContact O-OG 3.06Å; M273-S279 PolarHBondContact N-OG 3.16Å; S279-P281 WeakPolarHBondContact O-CD 3.45Å; S279-K301 CarbonylContact O-C 3.55Å; S279-K301 VanDerWaalsContact O-CA 3.28Å; S279-K301 WeakPolarHBondContact O-CA 3.42Å; S279-K301 PolarHBondContact O-N 2.78Å; S279-K301 VanDerWaalsContact O-N 3.17Å; S279-T302 PolarHBondContact O-N 2.84Å; S279-D332 VanDerWaalsContact CA-OD2 3.27Å; S279-D332 WeakPolarHBondContact CA-OD2 3.21Å; S279-D332 WeakPolarHBondContact CB-OD2 3.4Å; S279-D332 PolarHBondContact OG-OD2 3.12Å
280	D	90.1	Very high	82	Confident	36 Å²	36	46.1 Å²	46.1	19%	0.193	27%	0.269	C	S	.	.			trans	-105.4	68.4	170.1	-65.2	-28.9	0	0	0	110	T298 M299 P300 K301 D332 E333	D280-T298 HydrophobicContact CB-CG2 3.86Å; D280-T298 WeakPolarHBondContact O-CG2 3.41Å; D280-M299 CarbonylContact C-O 3.45Å; D280-M299 VanDerWaalsContact CA-O 3.31Å; D280-M299 WeakPolarHBondContact CA-O 3.42Å; D280-P300 WeakPolarHBondContact OD1-CA 3.02Å; D280-K301 PolarHBondContact OD1-N 2.84Å; D280-D332 WeakPolarHBondContact CA-OD1 3.28Å; D280-D332 WeakPolarHBondContact CB-OD1 3.39Å; D280-D332 PolarHBondContact N-OD1 3.47Å; D280-E333 HydrophobicContact CB-CB 4.48Å; D280-E333 PolarHBondContact O-N 2.92Å
281	P	88.9	Confident	80.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	141.4	-167.6	31.3	-42.4	0	0	0	115.1	L270 S279 M299 T302 P305 W307 V330 L331 L341	L270-P281 HydrophobicContact CD1-CB 3.59Å; L270-P281 HydrophobicContact CD1-CG 3.87Å; S279-P281 WeakPolarHBondContact O-CD 3.45Å; P281-M299 WeakPolarHBondContact CD-O 3.28Å; P281-M299 HydrophobicContact CG-CB 4.45Å; P281-M299 PolarHBondContact O-N 3.38Å; P281-T302 VanDerWaalsContact CD-O 3.23Å; P281-T302 WeakPolarHBondContact CD-O 3.41Å; P281-T302 HydrophobicContact CG-CG2 4.07Å; P281-T302 WeakPolarHBondContact CG-O 3.05Å; P281-P305 HydrophobicContact CB-CG 4.06Å; P281-P305 HydrophobicContact CG-CB 3.65Å; P281-P305 HydrophobicContact CG-CG 3.51Å; P281-W307 HydrophobicContact CB-CZ2 4.02Å; P281-W307 HydrophobicContact CG-CZ2 4.47Å; P281-W307 PolarHBondContact O-NE1 3.48Å; P281-V330 HydrophobicContact CB-CG1 4.48Å; P281-L331 CarbonylContact C-O 3.46Å; P281-L331 VanDerWaalsContact CA-O 3.3Å; P281-L331 WeakPolarHBondContact CA-O 3.37Å; P281-L341 HydrophobicContact CB-CD1 3.85Å
282	Y	90	Very high	81.1	Confident	14 Å²	14	50.1 Å²	50.1	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157	166.3	73.2	-83.4	0	0	0	111.7	K284 R295 V330 L331 E333 S338	Y282-K284 HydrophobicContact CE2-CB 4.26Å; Y282-R295 HydrophobicContact CD2-CB 4.31Å; Y282-V330 WeakPolarHBondContact O-CA 3.39Å; Y282-L331 HydrophobicContact CD1-CB 4.29Å; Y282-L331 WeakPolarHBondContact CD1-O 3.26Å; Y282-L331 HydrophobicContact CE1-CB 3.67Å; Y282-L331 HydrophobicContact CE2-CB 4.4Å; Y282-L331 HydrophobicContact CE2-CD1 3.87Å; Y282-L331 PolarHBondContact N-O 3.21Å; Y282-L331 PolarHBondContact O-N 3.09Å; Y282-E333 HydrophobicContact CD1-CB 3.79Å; Y282-E333 HydrophobicContact CE1-CB 3.83Å; Y282-E333 HydrophobicContact CE1-CG 4.33Å; Y282-S338 WeakPolarHBondContact CE1-OG 3.23Å; Y282-S338 VanDerWaalsContact OH-CB 3.3Å; Y282-S338 WeakPolarHBondContact OH-CB 3.31Å; Y282-S338 PolarHBondContact OH-OG 3.28Å
283	V	86.9	Confident	81.2	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.1	177.5	-163.8	0	0	0	0	110.9	K264 L285 R295 T296 W307 L328 T329 V330	K264-V283 HydrophobicContact CD-CG2 4.33Å; K264-V283 HydrophobicContact CG-CB 4.37Å; K264-V283 HydrophobicContact CG-CG1 4.47Å; K264-V283 HydrophobicContact CG-CG2 3.97Å; V283-L285 HydrophobicContact CB-CD1 4.46Å; V283-L285 HydrophobicContact CG1-CD1 4.02Å; V283-R295 VanDerWaalsContact O-CA 3.3Å; V283-R295 WeakPolarHBondContact O-CA 3.49Å; V283-T296 HydrophobicContact CB-CG2 4.15Å; V283-T296 PolarHBondContact N-OG1 2.88Å; V283-T296 PolarHBondContact O-N 2.89Å; V283-W307 HydrophobicContact CG2-CD2 3.98Å; V283-W307 HydrophobicContact CG2-CE3 3.85Å; V283-W307 HydrophobicContact CG2-CH2 3.23Å; V283-W307 HydrophobicContact CG2-CZ2 3.38Å; V283-W307 HydrophobicContact CG2-CZ3 3.5Å; V283-L328 HydrophobicContact CG1-CB 4.19Å; V283-T329 CarbonylContact C-O 3.49Å; V283-T329 WeakPolarHBondContact CA-O 3.23Å; V283-V330 HydrophobicContact CG1-CG2 4.27Å; V283-V330 HydrophobicContact CG2-CG2 4.11Å
284	K	88	Confident	81.5	Confident	74 Å²	74	51.7 Å²	51.7	32%	0.322	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.4	174.9	-170.7	173.3	-169.7	160.8	0	110.3	Y282 L294 T329 L331	Y282-K284 HydrophobicContact CE2-CB 4.26Å; K284-L294 CarbonylContact C-O 3.51Å; K284-L294 WeakPolarHBondContact CA-O 3.47Å; K284-T329 PolarHBondContact N-O 2.78Å; K284-T329 PolarHBondContact O-N 3.38Å; K284-L331 HydrophobicContact CB-CD1 3.87Å; K284-L331 HydrophobicContact CD-CD1 4.46Å
285	L	86.9	Confident	82.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.3	176.1	-75.3	60.8	0	0	0	108.6	C262 V283 K293 L294 L311 Y313 L326 R327	C262-L285 HydrophobicContact CB-CD2 3.7Å; V283-L285 HydrophobicContact CB-CD1 4.46Å; V283-L285 HydrophobicContact CG1-CD1 4.02Å; L285-K293 VanDerWaalsContact O-CA 3.23Å; L285-K293 WeakPolarHBondContact O-CA 3.31Å; L285-L294 HydrophobicContact CB-CB 4.34Å; L285-L294 PolarHBondContact N-O 3.04Å; L285-L294 PolarHBondContact O-N 2.74Å; L285-L294 VanDerWaalsContact O-N 3.11Å; L285-L311 HydrophobicContact CD1-CD1 3.48Å; L285-L311 VanDerWaalsContact CD1-CD1 3.48Å; L285-L311 HydrophobicContact CD2-CB 3.85Å; L285-L311 HydrophobicContact CD2-CD1 3.82Å; L285-L311 HydrophobicContact CD2-CG 4.48Å; L285-L311 HydrophobicContact CG-CD1 4.19Å; L285-Y313 HydrophobicContact CB-CE2 4.09Å; L285-Y313 HydrophobicContact CD2-CE2 4.4Å; L285-Y313 PolarHBondContact O-OH 2.99Å; L285-L326 HydrophobicContact CB-CD1 4.18Å; L285-L326 HydrophobicContact CD2-CD1 4.43Å; L285-L326 HydrophobicContact CG-CD1 4.38Å; L285-R327 CarbonylContact C-O 3.45Å; L285-R327 WeakPolarHBondContact CA-O 3.25Å
286	H	84.7	Confident	82.6	Confident	23 Å²	23	50 Å²	50	11%	0.106	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	118.3	175.9	-173.1	-155.6	0	0	0	109.6	L288 Q290 T292 K293 R327	H286-L288 WeakPolarHBondContact CE1-CD2 3.23Å; H286-L288 VanDerWaalsContact ND1-CD2 3.31Å; H286-L288 WeakPolarHBondContact ND1-CD2 3.22Å; H286-L288 PolarHBondContact O-N 3.37Å; H286-Q290 PolarHBondContact CD2-O 2.79Å; H286-Q290 VanDerWaalsContact CD2-O 3.26Å; H286-Q290 PolarHBondContact NE2-O 2.85Å; H286-T292 PolarHBondContact CD2-O 3.18Å; H286-K293 HydrophobicContact CB-CG 4.3Å; H286-R327 HydrophobicContact CB-CB 4.37Å; H286-R327 PolarHBondContact N-O 3.31Å; H286-R327 PolarHBondContact ND1-NH2 3.09Å; H286-R327 VanDerWaalsContact ND1-NH2 3.14Å; H286-R327 PolarHBondContact O-N 2.94Å
287	L	84.2	Confident	83.1	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	90.1	-176.9	-176.9	59.6	0	0	0	111.1	Q290 T292 Y313 V316 K324 L348	L287-Q290 CarbonylContact O-C 3.56Å; L287-Q290 WeakPolarHBondContact O-CA 3.49Å; L287-Q290 WeakPolarHBondContact O-CB 3.33Å; L287-Q290 PolarHBondContact O-N 2.85Å; L287-T292 PolarHBondContact N-O 3.24Å; L287-Y313 HydrophobicContact CB-CD1 4.36Å; L287-Y313 HydrophobicContact CB-CE1 4.02Å; L287-Y313 HydrophobicContact CB-CE2 4.34Å; L287-Y313 HydrophobicContact CD2-CD1 4.36Å; L287-Y313 HydrophobicContact CD2-CG 4.32Å; L287-V316 HydrophobicContact CD2-CG2 3.93Å; L287-K324 HydrophobicContact CD1-CB 3.85Å; L287-K324 HydrophobicContact CD1-CD 4.08Å; L287-K324 HydrophobicContact CD2-CD 3.9Å; L287-K324 HydrophobicContact CG-CB 4.41Å; L287-K324 HydrophobicContact CG-CD 3.74Å; L287-L348 HydrophobicContact CD1-CD1 3.67Å; L287-L348 HydrophobicContact CD1-CG 4.2Å
288	L	82.9	Confident	83.7	Confident	33 Å²	33	55.2 Å²	55.2	17%	0.173	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	140	-175.5	-63.5	176.9	0	0	0	112.2	H286 K324 T325 R327	H286-L288 WeakPolarHBondContact CE1-CD2 3.23Å; H286-L288 VanDerWaalsContact ND1-CD2 3.31Å; H286-L288 WeakPolarHBondContact ND1-CD2 3.22Å; H286-L288 PolarHBondContact O-N 3.37Å; L288-K324 WeakPolarHBondContact O-CA 3.46Å; L288-K324 WeakPolarHBondContact O-CB 3.43Å; L288-K324 WeakPolarHBondContact O-CG 3.32Å; L288-T325 WeakPolarHBondContact CB-O 3.24Å; L288-T325 PolarHBondContact N-O 2.97Å; L288-T325 PolarHBondContact O-N 3.11Å; L288-R327 HydrophobicContact CD1-CB 4.13Å; L288-R327 HydrophobicContact CG-CB 4.4Å
289	P	78	Confident	83.9	Confident	113 Å²	113	53.5 Å²	53.5	73%	0.734	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.8	5.3	7.6	35.1	-35.3	0	0	0	115.7
290	Q	65.8	Low	84.3	Confident	94 Å²	94	58 Å²	58	44%	0.439	30%	0.297	S	S	.	.	S	Bend	trans	-79.4	154.7	-179.2	-77	177.8	-13.4	0	0	112.5	H286 L287 T292	H286-Q290 PolarHBondContact CD2-O 2.79Å; H286-Q290 VanDerWaalsContact CD2-O 3.26Å; H286-Q290 PolarHBondContact NE2-O 2.85Å; L287-Q290 CarbonylContact O-C 3.56Å; L287-Q290 WeakPolarHBondContact O-CA 3.49Å; L287-Q290 WeakPolarHBondContact O-CB 3.33Å; L287-Q290 PolarHBondContact O-N 2.85Å; Q290-T292 VanDerWaalsContact C-N 3.35Å
291	A	56.4	Low	84.3	Confident	80 Å²	80	62.9 Å²	62.9	66%	0.661	32%	0.317	S	S	*	.			trans	-86.6	0.6	-172.5	0	0	0	0	0	114.6	K293	A291-K293 PolarHBondContact O-N 2.74Å
292	T	71.2	Confident	84.3	Confident	71 Å²	71	64.4 Å²	64.4	44%	0.436	33%	0.326	S	S	.	.			trans	-67.5	127	-179.9	50.8	0	0	0	0	109.2	H286 L287 Q290 Y313	H286-T292 PolarHBondContact CD2-O 3.18Å; L287-T292 PolarHBondContact N-O 3.24Å; Q290-T292 VanDerWaalsContact C-N 3.35Å; T292-Y313 PolarHBondContact O-OH 2.95Å; T292-Y313 WeakPolarHBondContact OG1-CE1 3.48Å
293	K	84.7	Confident	84	Confident	113 Å²	113	65.7 Å²	65.7	49%	0.491	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.2	-175.8	-69.9	157.7	-178	171.5	0	108.3	L285 H286 A291	L285-K293 VanDerWaalsContact O-CA 3.23Å; L285-K293 WeakPolarHBondContact O-CA 3.31Å; H286-K293 HydrophobicContact CB-CG 4.3Å; A291-K293 PolarHBondContact O-N 2.74Å
294	L	87.2	Confident	83.7	Confident	51 Å²	51	69 Å²	69	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	156.6	169.9	-57.9	174.4	0	0	0	107.9	K284 L285 L311 I312 Y313	K284-L294 CarbonylContact C-O 3.51Å; K284-L294 WeakPolarHBondContact CA-O 3.47Å; L285-L294 HydrophobicContact CB-CB 4.34Å; L285-L294 PolarHBondContact N-O 3.04Å; L285-L294 PolarHBondContact O-N 2.74Å; L285-L294 VanDerWaalsContact O-N 3.11Å; L294-L311 HydrophobicContact CB-CB 4.15Å; L294-L311 HydrophobicContact CB-CD1 4.18Å; L294-L311 HydrophobicContact CB-CD2 4.42Å; L294-L311 HydrophobicContact CB-CG 4.49Å; L294-L311 HydrophobicContact CD1-CB 3.99Å; L294-I312 VanDerWaalsContact CD1-O 3.31Å; L294-I312 WeakPolarHBondContact CD1-O 3.25Å; L294-Y313 HydrophobicContact CD1-CD1 4.06Å; L294-Y313 HydrophobicContact CD1-CD2 3.69Å; L294-Y313 HydrophobicContact CD1-CE1 3.98Å; L294-Y313 HydrophobicContact CD1-CE2 3.6Å; L294-Y313 HydrophobicContact CD1-CG 3.93Å; L294-Y313 HydrophobicContact CG-CD1 4.38Å; L294-Y313 HydrophobicContact CG-CE1 3.89Å; L294-Y313 HydrophobicContact CG-CE2 4.08Å; L294-Y313 PolarHBondContact N-OH 2.78Å
295	R	89.7	Confident	83.5	Confident	133 Å²	133	65.6 Å²	65.6	50%	0.502	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.2	174	75.2	170.6	-161.6	161.7	6	110.8	Y282 V283 L311 E333	Y282-R295 HydrophobicContact CD2-CB 4.31Å; V283-R295 VanDerWaalsContact O-CA 3.3Å; V283-R295 WeakPolarHBondContact O-CA 3.49Å; R295-L311 WeakPolarHBondContact O-CD2 3.46Å; R295-E333 IonicContact CZ-OE1 3.56Å; R295-E333 IonicContact NH1-OE1 2.78Å; R295-E333 PolarHBondContact NH1-OE1 2.9Å; R295-E333 IonicContact NH2-OE1 3.9Å
296	T	87.9	Confident	83.3	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.018	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-74.9	172.2	167.7	64	0	0	0	0	110.5	V283 W307 E309 L311	V283-T296 HydrophobicContact CB-CG2 4.15Å; V283-T296 PolarHBondContact N-OG1 2.88Å; V283-T296 PolarHBondContact O-N 2.89Å; T296-W307 HydrophobicContact CG2-CB 4.21Å; T296-W307 HydrophobicContact CG2-CG 4.12Å; T296-W307 VanDerWaalsContact OG1-CD1 3.3Å; T296-W307 PolarHBondContact OG1-NE1 3.5Å; T296-E309 WeakPolarHBondContact CA-OE2 3.36Å; T296-E309 HydrophobicContact CG2-CB 4.44Å; T296-L311 HydrophobicContact CG2-CD1 3.81Å
297	R	90.7	Very high	83.1	Confident	188 Å²	188	67.7 Å²	67.7	71%	0.709	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-62.9	160.8	158.6	-58.9	165.1	-174.2	-165.2	0.3	109.9	W307 E309	R297-W307 PolarHBondContact O-NE1 2.87Å; R297-E309 WeakPolarHBondContact CA-OE1 3.25Å; R297-E309 WeakPolarHBondContact CB-OE1 3.37Å; R297-E309 WeakPolarHBondContact CD-OE1 2.83Å; R297-E309 VanDerWaalsContact CG-OE1 3.22Å; R297-E309 WeakPolarHBondContact CG-OE1 3.44Å; R297-E309 VanDerWaalsContact N-CD 3.28Å; R297-E309 PolarHBondContact N-OE1 2.81Å; R297-E309 PolarHBondContact N-OE2 3.28Å
298	T	92.6	Very high	82.7	Confident	34 Å²	34	72.5 Å²	72.5	21%	0.209	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-90.8	130.7	175.3	-56.8	0	0	0	0	108.7	D280 E333	D280-T298 HydrophobicContact CB-CG2 3.86Å; D280-T298 WeakPolarHBondContact O-CG2 3.41Å; T298-E333 VanDerWaalsContact CB-OE2 3.23Å; T298-E333 WeakPolarHBondContact CB-OE2 3.41Å; T298-E333 HydrophobicContact CG2-CB 3.62Å; T298-E333 HydrophobicContact CG2-CG 4.47Å; T298-E333 WeakPolarHBondContact CG2-OE2 3.46Å; T298-E333 PolarHBondContact OG1-OE2 3.25Å
299	M	90.4	Very high	82.4	Confident	58 Å²	58	72.6 Å²	72.6	29%	0.286	38%	0.377	S	S	.	.			trans	-98	111.4	176.7	-63.6	-60.3	-67.5	0	0	108.2	D280 P281 T302 P305 W307	D280-M299 CarbonylContact C-O 3.45Å; D280-M299 VanDerWaalsContact CA-O 3.31Å; D280-M299 WeakPolarHBondContact CA-O 3.42Å; P281-M299 WeakPolarHBondContact CD-O 3.28Å; P281-M299 HydrophobicContact CG-CB 4.45Å; P281-M299 PolarHBondContact O-N 3.38Å; M299-T302 HydrophobicContact CB-CG2 3.6Å; M299-P305 HydrophobicContact CB-CB 3.8Å; M299-P305 HydrophobicContact CG-CB 3.78Å; M299-W307 HydrophobicContact CG-CG 4.27Å
300	P	92.6	Very high	82.2	Confident	94 Å²	94	71.7 Å²	71.7	61%	0.61	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	141.7	-174.2	28.2	-34.2	0	0	0	112	D280 T302	D280-P300 WeakPolarHBondContact OD1-CA 3.02Å; P300-T302 PolarHBondContact O-N 2.78Å
301	K	91.3	Very high	82.9	Confident	139 Å²	139	68.1 Å²	68.1	60%	0.604	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	52.5	168.7	-57.4	178.6	-176.6	175.6	0	113.8	F278 S279 D280	F278-K301 HydrophobicContact CB-CB 4.21Å; F278-K301 WeakPolarHBondContact CD1-O 3.37Å; F278-K301 HydrophobicContact CG-CB 4.34Å; S279-K301 CarbonylContact O-C 3.55Å; S279-K301 VanDerWaalsContact O-CA 3.28Å; S279-K301 WeakPolarHBondContact O-CA 3.42Å; S279-K301 PolarHBondContact O-N 2.78Å; S279-K301 VanDerWaalsContact O-N 3.17Å; D280-K301 PolarHBondContact OD1-N 2.84Å
302	T	88.3	Confident	83.9	Confident	32 Å²	32	67 Å²	67	20%	0.196	33%	0.329	C	S	.	.			trans	-143.1	138.8	178.2	-176.3	0	0	0	0	112.4	S279 P281 M299 P300 N304 P305	S279-T302 PolarHBondContact O-N 2.84Å; P281-T302 VanDerWaalsContact CD-O 3.23Å; P281-T302 WeakPolarHBondContact CD-O 3.41Å; P281-T302 HydrophobicContact CG-CG2 4.07Å; P281-T302 WeakPolarHBondContact CG-O 3.05Å; M299-T302 HydrophobicContact CB-CG2 3.6Å; P300-T302 PolarHBondContact O-N 2.78Å; T302-N304 PolarHBondContact OG1-N 3.32Å; T302-P305 HydrophobicContact CG2-CB 3.9Å
303	L	83.4	Confident	84.3	Confident	40 Å²	40	64.1 Å²	64.1	21%	0.209	31%	0.31	C	S	.	.	S	Bend	trans	-94.7	-4.6	170	-55.8	-176.4	0	0	0	112.1	N269 L270 A272 F278 P305	N269-L303 PolarHBondContact N-O 3.27Å; L270-L303 HydrophobicContact CB-CB 4.44Å; L270-L303 WeakPolarHBondContact CB-O 3.45Å; L270-L303 WeakPolarHBondContact CG-O 3.23Å; L270-L303 PolarHBondContact N-O 3.38Å; L270-L303 WeakPolarHBondContact O-CD2 3.29Å; A272-L303 HydrophobicContact CB-CD1 4.42Å; A272-L303 HydrophobicContact CB-CD2 4.12Å; F278-L303 HydrophobicContact CD1-CG 4.38Å; L303-P305 VanDerWaalsContact C-CD 3.42Å
304	N	80.4	Confident	83.9	Confident	74 Å²	74	65.6 Å²	65.6	40%	0.396	32%	0.318	S	S	.	.	S	Bend	trans	-128.6	58.9	-177.4	-57.9	-66	0	0	0	110.8	A267 V268 N269 T302	A267-N304 CarbonylContact O-C 3.54Å; A267-N304 VanDerWaalsContact O-C 3.28Å; A267-N304 WeakPolarHBondContact O-CA 2.99Å; V268-N304 VanDerWaalsContact CA-OD1 3.24Å; V268-N304 WeakPolarHBondContact CA-OD1 3.4Å; V268-N304 WeakPolarHBondContact CG1-OD1 3.43Å; N269-N304 PolarHBondContact N-OD1 3.2Å; T302-N304 PolarHBondContact OG1-N 3.32Å
305	P	83.9	Confident	83.3	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.006	33%	0.33	C	S	.	.			trans	-67.6	138.7	-174	29.8	-37.6	0	0	0	111.8	L266 A267 L270 P281 M299 T302 L303 W307	L266-P305 WeakPolarHBondContact CA-O 3.45Å; A267-P305 HydrophobicContact CB-CG 3.88Å; A267-P305 PolarHBondContact N-O 3.41Å; L270-P305 HydrophobicContact CD1-CG 3.6Å; P281-P305 HydrophobicContact CB-CG 4.06Å; P281-P305 HydrophobicContact CG-CB 3.65Å; P281-P305 HydrophobicContact CG-CG 3.51Å; M299-P305 HydrophobicContact CB-CB 3.8Å; M299-P305 HydrophobicContact CG-CB 3.78Å; T302-P305 HydrophobicContact CG2-CB 3.9Å; L303-P305 VanDerWaalsContact C-CD 3.42Å; P305-W307 HydrophobicContact CB-CD2 4.2Å; P305-W307 HydrophobicContact CB-CE3 4.44Å; P305-W307 HydrophobicContact CB-CH2 4.01Å; P305-W307 HydrophobicContact CB-CZ2 3.71Å; P305-W307 HydrophobicContact CB-CZ3 4.34Å; P305-W307 HydrophobicContact CG-CD2 4.5Å; P305-W307 HydrophobicContact CG-CE3 4.39Å; P305-W307 HydrophobicContact CG-CH2 3.29Å; P305-W307 HydrophobicContact CG-CZ2 3.4Å; P305-W307 HydrophobicContact CG-CZ3 3.81Å
306	C	83.1	Confident	82.7	Confident	54 Å²	54	60.1 Å²	60.1	37%	0.365	31%	0.312	S	S	.	.			trans	-117	92.4	169.9	-167.6	0	0	0	0	108.5	L266 N308	L266-C306 HydrophobicContact CD1-CB 4.26Å; C306-N308 VanDerWaalsContact SG-CG 3.54Å; C306-N308 PolarHBondContact SG-ND2 3.26Å; C306-N308 PolarHBondContact SG-OD1 3.07Å
307	W	81	Confident	82.4	Confident	14 Å²	14	62.5 Å²	62.5	5%	0.053	33%	0.328	C	S	.	.			trans	-72.9	-43.9	-178.1	-61.5	-78.7	0	0	0	112.3	K264 A267 P281 V283 T296 R297 M299 P305 E309 V330	K264-W307 HydrophobicContact CB-CE3 4.32Å; K264-W307 HydrophobicContact CD-CE3 3.63Å; K264-W307 HydrophobicContact CD-CZ3 3.55Å; K264-W307 HydrophobicContact CG-CE3 4.04Å; K264-W307 HydrophobicContact CG-CZ3 4.26Å; A267-W307 HydrophobicContact CB-CH2 3.79Å; A267-W307 HydrophobicContact CB-CZ3 3.75Å; P281-W307 HydrophobicContact CB-CZ2 4.02Å; P281-W307 HydrophobicContact CG-CZ2 4.47Å; P281-W307 PolarHBondContact O-NE1 3.48Å; V283-W307 HydrophobicContact CG2-CD2 3.98Å; V283-W307 HydrophobicContact CG2-CE3 3.85Å; V283-W307 HydrophobicContact CG2-CH2 3.23Å; V283-W307 HydrophobicContact CG2-CZ2 3.38Å; V283-W307 HydrophobicContact CG2-CZ3 3.5Å; T296-W307 HydrophobicContact CG2-CB 4.21Å; T296-W307 HydrophobicContact CG2-CG 4.12Å; T296-W307 VanDerWaalsContact OG1-CD1 3.3Å; T296-W307 PolarHBondContact OG1-NE1 3.5Å; R297-W307 PolarHBondContact O-NE1 2.87Å; M299-W307 HydrophobicContact CG-CG 4.27Å; P305-W307 HydrophobicContact CB-CD2 4.2Å; P305-W307 HydrophobicContact CB-CE3 4.44Å; P305-W307 HydrophobicContact CB-CH2 4.01Å; P305-W307 HydrophobicContact CB-CZ2 3.71Å; P305-W307 HydrophobicContact CB-CZ3 4.34Å; P305-W307 HydrophobicContact CG-CD2 4.5Å; P305-W307 HydrophobicContact CG-CE3 4.39Å; P305-W307 HydrophobicContact CG-CH2 3.29Å; P305-W307 HydrophobicContact CG-CZ2 3.4Å; P305-W307 HydrophobicContact CG-CZ3 3.81Å; W307-E309 PolarHBondContact O-N 3.38Å; W307-E309 VanDerWaalsContact O-N 3.1Å; W307-V330 HydrophobicContact CH2-CG1 4.33Å
308	N	75.1	Confident	81.9	Confident	103 Å²	103	58.7 Å²	58.7	55%	0.551	32%	0.321	S	S	*	.			trans	49.7	34.2	-176.3	-73.1	-15.2	0	0	0	114	C306	C306-N308 VanDerWaalsContact SG-CG 3.54Å; C306-N308 PolarHBondContact SG-ND2 3.26Å; C306-N308 PolarHBondContact SG-OD1 3.07Å
309	E	76.9	Confident	81.4	Confident	36 Å²	36	60.3 Å²	60.3	17%	0.168	33%	0.329	C	S	.	.			trans	-102.5	143	177.9	-76	173	-111.3	0	0	111.4	K264 T296 R297 W307	K264-E309 PolarHBondContact N-O 3.16Å; T296-E309 WeakPolarHBondContact CA-OE2 3.36Å; T296-E309 HydrophobicContact CG2-CB 4.44Å; R297-E309 WeakPolarHBondContact CA-OE1 3.25Å; R297-E309 WeakPolarHBondContact CB-OE1 3.37Å; R297-E309 WeakPolarHBondContact CD-OE1 2.83Å; R297-E309 VanDerWaalsContact CG-OE1 3.22Å; R297-E309 WeakPolarHBondContact CG-OE1 3.44Å; R297-E309 VanDerWaalsContact N-CD 3.28Å; R297-E309 PolarHBondContact N-OE1 2.81Å; R297-E309 PolarHBondContact N-OE2 3.28Å; W307-E309 PolarHBondContact O-N 3.38Å; W307-E309 VanDerWaalsContact O-N 3.1Å
310	Q	74.3	Confident	81.1	Confident	94 Å²	94	58.7 Å²	58.7	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.6	170	-72.1	-174.2	-5.9	0	0	109.7	F253 T263	F253-Q310 PolarHBondContact O-NE2 2.62Å; T263-Q310 HydrophobicContact CG2-CG 3.96Å
311	L	79.2	Confident	80.6	Confident	19 Å²	19	55.4 Å²	55.4	10%	0.099	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.9	175.5	-60.9	178.2	0	0	0	109.1	A261 C262 L285 L294 R295 T296	A261-L311 CarbonylContact C-O 3.57Å; A261-L311 WeakPolarHBondContact CA-O 3.36Å; C262-L311 PolarHBondContact N-O 3.29Å; C262-L311 PolarHBondContact O-N 2.63Å; C262-L311 VanDerWaalsContact O-N 3.15Å; L285-L311 HydrophobicContact CD1-CD1 3.48Å; L285-L311 VanDerWaalsContact CD1-CD1 3.48Å; L285-L311 HydrophobicContact CD2-CB 3.85Å; L285-L311 HydrophobicContact CD2-CD1 3.82Å; L285-L311 HydrophobicContact CD2-CG 4.48Å; L285-L311 HydrophobicContact CG-CD1 4.19Å; L294-L311 HydrophobicContact CB-CB 4.15Å; L294-L311 HydrophobicContact CB-CD1 4.18Å; L294-L311 HydrophobicContact CB-CD2 4.42Å; L294-L311 HydrophobicContact CB-CG 4.49Å; L294-L311 HydrophobicContact CD1-CB 3.99Å; R295-L311 WeakPolarHBondContact O-CD2 3.46Å; T296-L311 HydrophobicContact CG2-CD1 3.81Å
312	I	78.9	Confident	80.3	Confident	57 Å²	57	55.5 Å²	55.5	29%	0.292	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.5	-169.1	-53.3	-179.5	0	0	0	110.6	T259 L260 A261 L294	T259-I312 HydrophobicContact CG2-CG2 3.29Å; L260-I312 WeakPolarHBondContact O-CA 3.5Å; A261-I312 HydrophobicContact CB-CD1 4.47Å; A261-I312 HydrophobicContact CB-CG1 3.86Å; L294-I312 VanDerWaalsContact CD1-O 3.31Å; L294-I312 WeakPolarHBondContact CD1-O 3.25Å
313	Y	78.7	Confident	80.1	Confident	10 Å²	10	61.4 Å²	61.4	4%	0.039	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116	165.4	-72.8	-83.7	0	0	0	110.2	T259 L260 L285 L287 T292 L294 L326	T259-Y313 CarbonylContact C-O 3.54Å; T259-Y313 VanDerWaalsContact CA-O 3.25Å; T259-Y313 WeakPolarHBondContact CA-O 3.49Å; L260-Y313 HydrophobicContact CD2-CD2 3.97Å; L260-Y313 PolarHBondContact N-O 3.46Å; L260-Y313 PolarHBondContact O-N 3.47Å; L285-Y313 HydrophobicContact CB-CE2 4.09Å; L285-Y313 HydrophobicContact CD2-CE2 4.4Å; L285-Y313 PolarHBondContact O-OH 2.99Å; L287-Y313 HydrophobicContact CB-CD1 4.36Å; L287-Y313 HydrophobicContact CB-CE1 4.02Å; L287-Y313 HydrophobicContact CB-CE2 4.34Å; L287-Y313 HydrophobicContact CD2-CD1 4.36Å; L287-Y313 HydrophobicContact CD2-CG 4.32Å; T292-Y313 PolarHBondContact O-OH 2.95Å; T292-Y313 WeakPolarHBondContact OG1-CE1 3.48Å; L294-Y313 HydrophobicContact CD1-CD1 4.06Å; L294-Y313 HydrophobicContact CD1-CD2 3.69Å; L294-Y313 HydrophobicContact CD1-CE1 3.98Å; L294-Y313 HydrophobicContact CD1-CE2 3.6Å; L294-Y313 HydrophobicContact CD1-CG 3.93Å; L294-Y313 HydrophobicContact CG-CD1 4.38Å; L294-Y313 HydrophobicContact CG-CE1 3.89Å; L294-Y313 HydrophobicContact CG-CE2 4.08Å; L294-Y313 PolarHBondContact N-OH 2.78Å; Y313-L326 HydrophobicContact CE2-CD1 3.94Å
314	H	76.5	Confident	80.1	Confident	143 Å²	143	60 Å²	60	66%	0.662	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	151.3	172.4	-56.8	-85.7	0	0	0	111.5	L258 T259	L258-H314 CarbonylContact O-C 3.59Å; L258-H314 WeakPolarHBondContact O-CA 3.19Å; T259-H314 HydrophobicContact CG2-CB 4.36Å; T259-H314 VanDerWaalsContact CG2-CE1 3.45Å; T259-H314 WeakPolarHBondContact CG2-CE1 3.45Å; T259-H314 WeakPolarHBondContact CG2-ND1 3.46Å
315	G	74.7	Confident	80.2	Confident	49 Å²	49	58.1 Å²	58.1	51%	0.505	30%	0.301	S	S	.	.			trans	75.3	24.5	173.7	0	0	0	0	0	115.4	L258 S317	L258-G315 PolarHBondContact O-N 2.98Å; G315-S317 PolarHBondContact O-N 3.2Å
316	V	77.4	Confident	80.2	Confident	21 Å²	21	58.6 Å²	58.6	13%	0.127	30%	0.303	C	S	.	.			trans	-79.2	109.3	176.9	-175.9	0	0	0	0	109.6	L260 L287 D320 M321 L348	L260-V316 HydrophobicContact CB-CG2 4.01Å; L287-V316 HydrophobicContact CD2-CG2 3.93Å; V316-D320 HydrophobicContact CG1-CB 3.81Å; V316-M321 HydrophobicContact CG1-CG 4.47Å; V316-M321 HydrophobicContact CG1-SD 4Å; V316-L348 HydrophobicContact CG1-CD1 4.11Å
317	S	80.6	Confident	80.1	Confident	52 Å²	52	58.2 Å²	58.2	36%	0.364	29%	0.294	S	S	.	.			trans	-74.4	160.3	-179.6	65.8	0	0	0	0	112.8	G315 D319 D320 M321	G315-S317 PolarHBondContact O-N 3.2Å; S317-D319 PolarHBondContact O-N 3.19Å; S317-D319 VanDerWaalsContact O-N 3.14Å; S317-D320 PolarHBondContact N-OD2 3Å; S317-D320 VanDerWaalsContact N-OD2 3.15Å; S317-D320 WeakPolarHBondContact O-CA 3.41Å; S317-D320 VanDerWaalsContact O-CB 3.28Å; S317-D320 WeakPolarHBondContact O-CB 3.26Å; S317-D320 PolarHBondContact O-N 3.15Å; S317-D320 PolarHBondContact OG-N 3.07Å; S317-D320 VanDerWaalsContact OG-N 3.08Å; S317-D320 PolarHBondContact OG-OD2 3.27Å; S317-D320 VanDerWaalsContact OG-OD2 3.09Å; S317-M321 PolarHBondContact O-N 2.77Å
318	L	81	Confident	80.1	Confident	108 Å²	108	58.5 Å²	58.5	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-56.3	-30.2	170.8	-71.8	175.9	0	0	0	112.5	L257 M321 K322 P353	L257-L318 HydrophobicContact CD2-CD2 3.92Å; L318-M321 WeakPolarHBondContact O-CB 3.44Å; L318-M321 PolarHBondContact O-N 3.1Å; L318-K322 PolarHBondContact O-N 2.93Å; L318-P353 HydrophobicContact CD2-CG 4.04Å
319	D	82.6	Confident	80.6	Confident	69 Å²	69	54 Å²	54	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-73.1	-34.4	178.6	-118.5	30.3	0	0	0	112	S317 K322 R323	S317-D319 PolarHBondContact O-N 3.19Å; S317-D319 VanDerWaalsContact O-N 3.14Å; D319-K322 PolarHBondContact O-N 3.14Å; D319-K322 IonicContact OD1-NZ 3.58Å; D319-R323 VanDerWaalsContact CB-NH2 3.27Å; D319-R323 VanDerWaalsContact CG-NH2 3.29Å; D319-R323 PolarHBondContact O-N 3.34Å; D319-R323 IonicContact OD1-NH1 2.64Å; D319-R323 IonicContact OD2-CZ 2.68Å; D319-R323 VanDerWaalsContact OD2-CZ 3.26Å; D319-R323 IonicContact OD2-NH1 2.93Å; D319-R323 PolarHBondContact OD2-NH1 3.2Å; D319-R323 IonicContact OD2-NH2 3.18Å; D319-R323 PolarHBondContact OD2-NH2 3.42Å
320	D	83.4	Confident	80.9	Confident	24 Å²	24	52.7 Å²	52.7	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-38.6	168.5	-65.7	-33.6	0	0	0	111.9	V316 S317 K322 R323 K324	V316-D320 HydrophobicContact CG1-CB 3.81Å; S317-D320 PolarHBondContact N-OD2 3Å; S317-D320 VanDerWaalsContact N-OD2 3.15Å; S317-D320 WeakPolarHBondContact O-CA 3.41Å; S317-D320 VanDerWaalsContact O-CB 3.28Å; S317-D320 WeakPolarHBondContact O-CB 3.26Å; S317-D320 PolarHBondContact O-N 3.15Å; S317-D320 PolarHBondContact OG-N 3.07Å; S317-D320 VanDerWaalsContact OG-N 3.08Å; S317-D320 PolarHBondContact OG-OD2 3.27Å; S317-D320 VanDerWaalsContact OG-OD2 3.09Å; D320-K322 PolarHBondContact O-N 3.01Å; D320-R323 PolarHBondContact O-N 2.78Å; D320-R323 VanDerWaalsContact O-N 3.13Å; D320-K324 HydrophobicContact CB-CD 3.75Å; D320-K324 HydrophobicContact CB-CG 3.95Å; D320-K324 VanDerWaalsContact O-CB 3.25Å; D320-K324 WeakPolarHBondContact O-CB 3.07Å; D320-K324 WeakPolarHBondContact O-CG 3.47Å; D320-K324 PolarHBondContact O-N 3.14Å; D320-K324 WeakPolarHBondContact OD1-CE 3.04Å; D320-K324 IonicContact OD1-NZ 3.77Å; D320-K324 PolarHBondContact OD1-NZ 3.45Å; D320-K324 IonicContact OD2-NZ 2.84Å; D320-K324 PolarHBondContact OD2-NZ 3.28Å
321	M	82.5	Confident	81.5	Confident	25 Å²	25	49.2 Å²	49.2	12%	0.123	25%	0.251	C	S	.	.	H	α-helix	trans	-57.2	-34	175.7	-64.6	-63.2	-67.7	0	0	111.8	L260 V316 S317 L318 L348 K349 V351	L260-M321 HydrophobicContact CD1-SD 4.2Å; V316-M321 HydrophobicContact CG1-CG 4.47Å; V316-M321 HydrophobicContact CG1-SD 4Å; S317-M321 PolarHBondContact O-N 2.77Å; L318-M321 WeakPolarHBondContact O-CB 3.44Å; L318-M321 PolarHBondContact O-N 3.1Å; M321-L348 HydrophobicContact CE-CB 4.21Å; M321-L348 CarbonylContact O-C 3.56Å; M321-L348 VanDerWaalsContact O-CB 3.32Å; M321-L348 WeakPolarHBondContact O-CB 3.38Å; M321-L348 HydrophobicContact SD-CB 4.07Å; M321-L348 HydrophobicContact SD-CD1 3.75Å; M321-L348 HydrophobicContact SD-CG 4.46Å; M321-K349 VanDerWaalsContact O-CA 3.31Å; M321-K349 WeakPolarHBondContact O-CA 3.47Å; M321-K349 PolarHBondContact O-N 2.93Å; M321-V351 HydrophobicContact CE-CB 3.92Å; M321-V351 HydrophobicContact CE-CG1 4.13Å
322	K	84.1	Confident	81.8	Confident	141 Å²	141	48.3 Å²	48.3	61%	0.613	25%	0.247	S	C	*	.	H	α-helix	trans	-73.7	-33.6	178.4	-66.2	172.7	-173.7	168.6	0	113.5	L318 D319 D320	L318-K322 PolarHBondContact O-N 2.93Å; D319-K322 PolarHBondContact O-N 3.14Å; D319-K322 IonicContact OD1-NZ 3.58Å; D320-K322 PolarHBondContact O-N 3.01Å
323	R	84.4	Confident	82.4	Confident	156 Å²	156	48.4 Å²	48.4	59%	0.589	25%	0.246	S	C	*	.	H	α-helix	trans	-112.1	-29.2	-165.3	-62.9	-174.7	-70.2	-98.7	6.3	114.4	D319 D320	D319-R323 VanDerWaalsContact CB-NH2 3.27Å; D319-R323 VanDerWaalsContact CG-NH2 3.29Å; D319-R323 PolarHBondContact O-N 3.34Å; D319-R323 IonicContact OD1-NH1 2.64Å; D319-R323 IonicContact OD2-CZ 2.68Å; D319-R323 VanDerWaalsContact OD2-CZ 3.26Å; D319-R323 IonicContact OD2-NH1 2.93Å; D319-R323 PolarHBondContact OD2-NH1 3.2Å; D319-R323 IonicContact OD2-NH2 3.18Å; D319-R323 PolarHBondContact OD2-NH2 3.42Å; D320-R323 PolarHBondContact O-N 2.78Å; D320-R323 VanDerWaalsContact O-N 3.13Å
324	K	83.7	Confident	82.5	Confident	9 Å²	9	49.6 Å²	49.6	4%	0.039	25%	0.253	C	S	.	.			trans	-84.8	156.6	-172.9	-63.2	-163.5	-176.2	150.9	0	112.3	L287 L288 D320 L348	L287-K324 HydrophobicContact CD1-CB 3.85Å; L287-K324 HydrophobicContact CD1-CD 4.08Å; L287-K324 HydrophobicContact CD2-CD 3.9Å; L287-K324 HydrophobicContact CG-CB 4.41Å; L287-K324 HydrophobicContact CG-CD 3.74Å; L288-K324 WeakPolarHBondContact O-CA 3.46Å; L288-K324 WeakPolarHBondContact O-CB 3.43Å; L288-K324 WeakPolarHBondContact O-CG 3.32Å; D320-K324 HydrophobicContact CB-CD 3.75Å; D320-K324 HydrophobicContact CB-CG 3.95Å; D320-K324 VanDerWaalsContact O-CB 3.25Å; D320-K324 WeakPolarHBondContact O-CB 3.07Å; D320-K324 WeakPolarHBondContact O-CG 3.47Å; D320-K324 PolarHBondContact O-N 3.14Å; D320-K324 WeakPolarHBondContact OD1-CE 3.04Å; D320-K324 IonicContact OD1-NZ 3.77Å; D320-K324 PolarHBondContact OD1-NZ 3.45Å; D320-K324 IonicContact OD2-NZ 2.84Å; D320-K324 PolarHBondContact OD2-NZ 3.28Å; K324-L348 HydrophobicContact CB-CD1 4.01Å; K324-L348 HydrophobicContact CB-CG 4.32Å; K324-L348 WeakPolarHBondContact O-CB 3.5Å; K324-L348 PolarHBondContact O-N 2.97Å
325	T	83.2	Confident	82.4	Confident	35 Å²	35	52 Å²	52	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.8	176.4	-63.7	0	0	0	0	108.7	L288 R327 R345	L288-T325 WeakPolarHBondContact CB-O 3.24Å; L288-T325 PolarHBondContact N-O 2.97Å; L288-T325 PolarHBondContact O-N 3.11Å; T325-R327 PolarHBondContact O-N 2.63Å; T325-R345 HydrophobicContact CG2-CB 3.86Å; T325-R345 HydrophobicContact CG2-CG 4.44Å
326	L	82.9	Confident	81.6	Confident	11 Å²	11	50.8 Å²	50.8	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	120	171.4	-177.7	67.1	0	0	0	108.7	L260 C262 L285 Y313 L328 R345 V346 L348	L260-L326 HydrophobicContact CD2-CD1 4.38Å; L260-L326 HydrophobicContact CD2-CD2 4.16Å; C262-L326 HydrophobicContact CB-CD2 4.47Å; L285-L326 HydrophobicContact CB-CD1 4.18Å; L285-L326 HydrophobicContact CD2-CD1 4.43Å; L285-L326 HydrophobicContact CG-CD1 4.38Å; Y313-L326 HydrophobicContact CE2-CD1 3.94Å; L326-L328 HydrophobicContact CD2-CD1 4Å; L326-L328 HydrophobicContact CD2-CG 4.49Å; L326-L328 HydrophobicContact CG-CD1 3.95Å; L326-L328 HydrophobicContact CG-CG 4.48Å; L326-R345 CarbonylContact O-C 3.11Å; L326-R345 WeakPolarHBondContact O-CA 3.42Å; L326-V346 PolarHBondContact N-O 3.27Å; L326-V346 PolarHBondContact O-N 3.08Å; L326-L348 HydrophobicContact CB-CD2 3.91Å
327	R	81.6	Confident	81.3	Confident	47 Å²	47	51 Å²	51	18%	0.177	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.9	173.5	-174.1	176.7	80.9	171.4	4.3	109.2	L285 H286 L288 T325 E343 R345	L285-R327 CarbonylContact C-O 3.45Å; L285-R327 WeakPolarHBondContact CA-O 3.25Å; H286-R327 HydrophobicContact CB-CB 4.37Å; H286-R327 PolarHBondContact N-O 3.31Å; H286-R327 PolarHBondContact ND1-NH2 3.09Å; H286-R327 VanDerWaalsContact ND1-NH2 3.14Å; H286-R327 PolarHBondContact O-N 2.94Å; L288-R327 HydrophobicContact CD1-CB 4.13Å; L288-R327 HydrophobicContact CG-CB 4.4Å; T325-R327 PolarHBondContact O-N 2.63Å; R327-E343 WeakPolarHBondContact CD-OE1 3.49Å; R327-E343 WeakPolarHBondContact CD-OE2 3.5Å; R327-E343 VanDerWaalsContact CG-CD 3.42Å; R327-E343 HydrophobicContact CG-CG 3.79Å; R327-E343 VanDerWaalsContact CG-OE2 3.29Å; R327-E343 WeakPolarHBondContact CG-OE2 3.26Å; R327-E343 IonicContact CZ-OE2 3.45Å; R327-E343 IonicContact NE-OE2 3.74Å; R327-E343 PolarHBondContact NE-OE2 2.87Å; R327-R345 HydrophobicContact CB-CG 4.34Å; R327-R345 HydrophobicContact CG-CG 4.02Å
328	L	81.4	Confident	81.2	Confident	19 Å²	19	49.5 Å²	49.5	10%	0.099	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.2	176.5	-60.4	89.3	0	0	0	108	V283 L326 E343 T344 V346	V283-L328 HydrophobicContact CG1-CB 4.19Å; L326-L328 HydrophobicContact CD2-CD1 4Å; L326-L328 HydrophobicContact CD2-CG 4.49Å; L326-L328 HydrophobicContact CG-CD1 3.95Å; L326-L328 HydrophobicContact CG-CG 4.48Å; L328-E343 CarbonylContact O-C 3.6Å; L328-E343 VanDerWaalsContact O-CA 3.28Å; L328-E343 WeakPolarHBondContact O-CA 3.39Å; L328-E343 WeakPolarHBondContact O-CG 3.28Å; L328-T344 HydrophobicContact CB-CG2 3.94Å; L328-T344 HydrophobicContact CD1-CG2 4.13Å; L328-T344 PolarHBondContact N-O 3.01Å; L328-T344 PolarHBondContact O-N 3.43Å; L328-V346 HydrophobicContact CD1-CG2 4.1Å
329	T	83.9	Confident	81	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.8	178.6	-45.8	0	0	0	0	108.2	V283 K284 L331 F340 E343	V283-T329 CarbonylContact C-O 3.49Å; V283-T329 WeakPolarHBondContact CA-O 3.23Å; K284-T329 PolarHBondContact N-O 2.78Å; K284-T329 PolarHBondContact O-N 3.38Å; T329-L331 HydrophobicContact CG2-CD1 3.69Å; T329-L331 HydrophobicContact CG2-CD2 4.49Å; T329-L331 HydrophobicContact CG2-CG 3.99Å; T329-L331 WeakPolarHBondContact O-CD1 3.4Å; T329-F340 HydrophobicContact CG2-CD2 3.82Å; T329-F340 HydrophobicContact CG2-CE2 3.7Å; T329-E343 HydrophobicContact CG2-CB 4.5Å; T329-E343 PolarHBondContact OG1-OE2 2.96Å
330	V	84.2	Confident	80.8	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.5	173.1	-170.9	0	0	0	0	107.7	L270 P281 Y282 V283 W307 L341 G342 L363	L270-V330 HydrophobicContact CD1-CG1 4.27Å; L270-V330 HydrophobicContact CD2-CG1 4.39Å; P281-V330 HydrophobicContact CB-CG1 4.48Å; Y282-V330 WeakPolarHBondContact O-CA 3.39Å; V283-V330 HydrophobicContact CG1-CG2 4.27Å; V283-V330 HydrophobicContact CG2-CG2 4.11Å; W307-V330 HydrophobicContact CH2-CG1 4.33Å; V330-L341 HydrophobicContact CB-CB 4.23Å; V330-L341 HydrophobicContact CG1-CB 4.03Å; V330-L341 HydrophobicContact CG1-CD1 3.9Å; V330-L341 WeakPolarHBondContact O-CB 2.96Å; V330-L341 PolarHBondContact O-N 2.93Å; V330-G342 PolarHBondContact N-O 3.02Å; V330-G342 PolarHBondContact O-N 3.44Å; V330-L363 HydrophobicContact CB-CD1 4.02Å; V330-L363 HydrophobicContact CG1-CD1 4.45Å; V330-L363 HydrophobicContact CG2-CD1 3.72Å; V330-L363 HydrophobicContact CG2-CD2 3.6Å; V330-L363 HydrophobicContact CG2-CG 4.33Å
331	L	85.7	Confident	80.3	Confident	21 Å²	21	44.5 Å²	44.5	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	152.3	179.7	-54.7	99.5	0	0	0	110.4	P281 Y282 K284 T329 D339 L341	P281-L331 CarbonylContact C-O 3.46Å; P281-L331 VanDerWaalsContact CA-O 3.3Å; P281-L331 WeakPolarHBondContact CA-O 3.37Å; Y282-L331 HydrophobicContact CD1-CB 4.29Å; Y282-L331 WeakPolarHBondContact CD1-O 3.26Å; Y282-L331 HydrophobicContact CE1-CB 3.67Å; Y282-L331 HydrophobicContact CE2-CB 4.4Å; Y282-L331 HydrophobicContact CE2-CD1 3.87Å; Y282-L331 PolarHBondContact N-O 3.21Å; Y282-L331 PolarHBondContact O-N 3.09Å; K284-L331 HydrophobicContact CB-CD1 3.87Å; K284-L331 HydrophobicContact CD-CD1 4.46Å; T329-L331 HydrophobicContact CG2-CD1 3.69Å; T329-L331 HydrophobicContact CG2-CD2 4.49Å; T329-L331 HydrophobicContact CG2-CG 3.99Å; T329-L331 WeakPolarHBondContact O-CD1 3.4Å; L331-D339 CarbonylContact C-O 3.28Å; L331-D339 WeakPolarHBondContact CA-O 3.31Å; L331-D339 WeakPolarHBondContact CB-O 3.38Å; L331-L341 VanDerWaalsContact C-CD1 3.46Å
332	D	86.1	Confident	79.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123.1	169.4	-167.2	-5.8	0	0	0	109.1	M273 S279 D280 D334 S338 D339 L341	M273-D332 HydrophobicContact CB-CB 4.31Å; M273-D332 VanDerWaalsContact CB-OD2 3.27Å; M273-D332 WeakPolarHBondContact CB-OD2 3.37Å; M273-D332 HydrophobicContact CG-CB 4.33Å; S279-D332 VanDerWaalsContact CA-OD2 3.27Å; S279-D332 WeakPolarHBondContact CA-OD2 3.21Å; S279-D332 WeakPolarHBondContact CB-OD2 3.4Å; S279-D332 PolarHBondContact OG-OD2 3.12Å; D280-D332 WeakPolarHBondContact CA-OD1 3.28Å; D280-D332 WeakPolarHBondContact CB-OD1 3.39Å; D280-D332 PolarHBondContact N-OD1 3.47Å; D332-D334 PolarHBondContact O-N 2.84Å; D332-S338 CarbonylContact O-C 3.59Å; D332-S338 WeakPolarHBondContact O-CA 3.14Å; D332-S338 WeakPolarHBondContact O-CB 3.29Å; D332-D339 HydrophobicContact CB-CB 4.28Å; D332-D339 PolarHBondContact N-O 3.49Å; D332-D339 PolarHBondContact O-N 2.72Å; D332-L341 HydrophobicContact CB-CD1 3.97Å; D332-L341 HydrophobicContact CB-CG 4.14Å
333	E	91.3	Very high	79.3	Confident	59 Å²	59	37.6 Å²	37.6	28%	0.276	18%	0.175	S	C	.	.			trans	-83.8	92.9	179.2	-165.2	165	-129.9	0	0	111.6	D280 Y282 R295 T298	D280-E333 HydrophobicContact CB-CB 4.48Å; D280-E333 PolarHBondContact O-N 2.92Å; Y282-E333 HydrophobicContact CD1-CB 3.79Å; Y282-E333 HydrophobicContact CE1-CB 3.83Å; Y282-E333 HydrophobicContact CE1-CG 4.33Å; R295-E333 IonicContact CZ-OE1 3.56Å; R295-E333 IonicContact NH1-OE1 2.78Å; R295-E333 PolarHBondContact NH1-OE1 2.9Å; R295-E333 IonicContact NH2-OE1 3.9Å; T298-E333 VanDerWaalsContact CB-OE2 3.23Å; T298-E333 WeakPolarHBondContact CB-OE2 3.41Å; T298-E333 HydrophobicContact CG2-CB 3.62Å; T298-E333 HydrophobicContact CG2-CG 4.47Å; T298-E333 WeakPolarHBondContact CG2-OE2 3.46Å; T298-E333 PolarHBondContact OG1-OE2 3.25Å
334	D	81.9	Confident	78.7	Confident	35 Å²	35	30.8 Å²	30.8	19%	0.187	15%	0.151	C	C	.	.			trans	-74.8	165.3	171	-59.8	-69.7	0	0	0	112.8	D332 I336 D339	D332-D334 PolarHBondContact O-N 2.84Å; D334-I336 PolarHBondContact O-N 2.83Å; D334-D339 PolarHBondContact OD2-N 3.3Å
335	R	74.2	Confident	78.5	Confident	193 Å²	193	36 Å²	36	73%	0.728	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-27.5	162.1	-63.6	179.8	-178.6	177.2	1	112.8	R41	R41-R335 VanDerWaalsContact CZ-O 3.3Å; R41-R335 PolarHBondContact NH1-O 3.42Å; R41-R335 PolarHBondContact NH2-O 3.05Å
336	I	56.6	Low	78.2	Confident	25 Å²	25	34.9 Å²	34.9	13%	0.128	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.8	58.4	-164.8	-39.9	-171.2	0	0	0	112.6	L38 E111 K115 D334	L38-I336 HydrophobicContact CD2-CG2 4.41Å; E111-I336 HydrophobicContact CB-CG2 4.41Å; E111-I336 HydrophobicContact CG-CD1 4.1Å; K115-I336 PolarHBondContact NZ-O 2.78Å; D334-I336 PolarHBondContact O-N 2.83Å
337	G	71.1	Confident	78.3	Confident	24 Å²	24	35.7 Å²	35.7	25%	0.247	17%	0.17	C	C	.	.	S	Bend	trans	110	-142.6	178.2	0	0	0	0	0	110.6
338	S	78.8	Confident	78.5	Confident	22 Å²	22	33.5 Å²	33.5	15%	0.154	16%	0.162	C	C	.	.			trans	-149.4	137.9	168.3	-48.1	0	0	0	0	109.7	Y282 D332	Y282-S338 WeakPolarHBondContact CE1-OG 3.23Å; Y282-S338 VanDerWaalsContact OH-CB 3.3Å; Y282-S338 WeakPolarHBondContact OH-CB 3.31Å; Y282-S338 PolarHBondContact OH-OG 3.28Å; D332-S338 CarbonylContact O-C 3.59Å; D332-S338 WeakPolarHBondContact O-CA 3.14Å; D332-S338 WeakPolarHBondContact O-CB 3.29Å
339	D	77.4	Confident	78.6	Confident	46 Å²	46	40 Å²	40	25%	0.246	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	142.9	178.1	-74.7	-9.9	0	0	0	110.5	K115 M273 L331 D332 D334 L341	K115-D339 IonicContact NZ-OD1 2.85Å; K115-D339 PolarHBondContact NZ-OD1 3.14Å; M273-D339 HydrophobicContact CB-CB 4.49Å; M273-D339 HydrophobicContact CE-CB 4.19Å; L331-D339 CarbonylContact C-O 3.28Å; L331-D339 WeakPolarHBondContact CA-O 3.31Å; L331-D339 WeakPolarHBondContact CB-O 3.38Å; D332-D339 HydrophobicContact CB-CB 4.28Å; D332-D339 PolarHBondContact N-O 3.49Å; D332-D339 PolarHBondContact O-N 2.72Å; D334-D339 PolarHBondContact OD2-N 3.3Å; D339-L341 PolarHBondContact O-N 2.94Å
340	F	78.4	Confident	78.4	Confident	40 Å²	40	46.8 Å²	46.8	18%	0.175	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.8	-173.3	177.6	-85.1	0	0	0	110.2	T329 G342 E343 Q366	T329-F340 HydrophobicContact CG2-CD2 3.82Å; T329-F340 HydrophobicContact CG2-CE2 3.7Å; F340-G342 VanDerWaalsContact CZ-CA 3.45Å; F340-E343 HydrophobicContact CE2-CB 3.73Å; F340-E343 HydrophobicContact CZ-CB 3.6Å; F340-Q366 HydrophobicContact CB-CG 4.45Å; F340-Q366 HydrophobicContact CD1-CB 3.65Å; F340-Q366 HydrophobicContact CD1-CG 3.42Å; F340-Q366 VanDerWaalsContact CD1-CG 3.42Å; F340-Q366 HydrophobicContact CD2-CG 4.39Å; F340-Q366 HydrophobicContact CE1-CB 3.73Å; F340-Q366 HydrophobicContact CE1-CG 3.61Å; F340-Q366 HydrophobicContact CE2-CG 4.49Å; F340-Q366 HydrophobicContact CG-CG 3.85Å; F340-Q366 HydrophobicContact CZ-CG 4.13Å
341	L	72.4	Confident	78.1	Confident	9 Å²	9	48 Å²	48	5%	0.047	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-35.4	174.7	-69.3	162	0	0	0	111.4	L270 P271 M273 P281 V330 L331 D332 D339	L270-L341 HydrophobicContact CD1-CD1 4.38Å; P271-L341 HydrophobicContact CB-CD2 4.2Å; P271-L341 HydrophobicContact CG-CD2 4.33Å; P271-L341 VanDerWaalsContact O-CD2 3.3Å; P271-L341 WeakPolarHBondContact O-CD2 3.21Å; M273-L341 HydrophobicContact CG-CD2 3.5Å; M273-L341 HydrophobicContact CG-CG 4.38Å; M273-L341 HydrophobicContact SD-CD2 4.33Å; P281-L341 HydrophobicContact CB-CD1 3.85Å; V330-L341 HydrophobicContact CB-CB 4.23Å; V330-L341 HydrophobicContact CG1-CB 4.03Å; V330-L341 HydrophobicContact CG1-CD1 3.9Å; V330-L341 WeakPolarHBondContact O-CB 2.96Å; V330-L341 PolarHBondContact O-N 2.93Å; L331-L341 VanDerWaalsContact C-CD1 3.46Å; D332-L341 HydrophobicContact CB-CD1 3.97Å; D332-L341 HydrophobicContact CB-CG 4.14Å; D339-L341 PolarHBondContact O-N 2.94Å
342	G	67.2	Low	77.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.7	164.8	-175.5	0	0	0	0	0	114.7	V330 F340 E364	V330-G342 PolarHBondContact N-O 3.02Å; V330-G342 PolarHBondContact O-N 3.44Å; F340-G342 VanDerWaalsContact CZ-CA 3.45Å; G342-E364 WeakPolarHBondContact CA-O 3.23Å
343	E	78.3	Confident	77	Confident	21 Å²	21	53.8 Å²	53.8	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.7	176.1	-179.2	170.5	96.2	0	0	112	R327 L328 T329 F340 R345 E364	R327-E343 WeakPolarHBondContact CD-OE1 3.49Å; R327-E343 WeakPolarHBondContact CD-OE2 3.5Å; R327-E343 VanDerWaalsContact CG-CD 3.42Å; R327-E343 HydrophobicContact CG-CG 3.79Å; R327-E343 VanDerWaalsContact CG-OE2 3.29Å; R327-E343 WeakPolarHBondContact CG-OE2 3.26Å; R327-E343 IonicContact CZ-OE2 3.45Å; R327-E343 IonicContact NE-OE2 3.74Å; R327-E343 PolarHBondContact NE-OE2 2.87Å; L328-E343 CarbonylContact O-C 3.6Å; L328-E343 VanDerWaalsContact O-CA 3.28Å; L328-E343 WeakPolarHBondContact O-CA 3.39Å; L328-E343 WeakPolarHBondContact O-CG 3.28Å; T329-E343 HydrophobicContact CG2-CB 4.5Å; T329-E343 PolarHBondContact OG1-OE2 2.96Å; F340-E343 HydrophobicContact CE2-CB 3.73Å; F340-E343 HydrophobicContact CZ-CB 3.6Å; E343-R345 IonicContact OE1-CZ 3.51Å; E343-R345 IonicContact OE1-NE 2.75Å; E343-R345 IonicContact OE1-NH1 2.75Å; E343-R345 IonicContact OE1-NH2 3.26Å; E343-R345 PolarHBondContact OE1-NH2 2.78Å; E343-E364 PolarHBondContact N-O 3.25Å; E343-E364 WeakPolarHBondContact O-CB 3.35Å; E343-E364 PolarHBondContact O-N 2.77Å
344	T	72.3	Confident	75.9	Confident	13 Å²	13	53.9 Å²	53.9	8%	0.08	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	162.5	167.4	-171.2	0	0	0	0	110.8	L328 V361	L328-T344 HydrophobicContact CB-CG2 3.94Å; L328-T344 HydrophobicContact CD1-CG2 4.13Å; L328-T344 PolarHBondContact N-O 3.01Å; L328-T344 PolarHBondContact O-N 3.43Å; T344-V361 HydrophobicContact CG2-CB 4.12Å; T344-V361 HydrophobicContact CG2-CG2 3.84Å
345	R	79.1	Confident	75.3	Confident	118 Å²	118	59.4 Å²	59.4	45%	0.445	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.9	-176.3	-66.8	-178.5	-173.5	89.2	-0.9	110.6	T325 L326 R327 E343 E364	T325-R345 HydrophobicContact CG2-CB 3.86Å; T325-R345 HydrophobicContact CG2-CG 4.44Å; L326-R345 CarbonylContact O-C 3.11Å; L326-R345 WeakPolarHBondContact O-CA 3.42Å; R327-R345 HydrophobicContact CB-CG 4.34Å; R327-R345 HydrophobicContact CG-CG 4.02Å; E343-R345 IonicContact OE1-CZ 3.51Å; E343-R345 IonicContact OE1-NE 2.75Å; E343-R345 IonicContact OE1-NH1 2.75Å; E343-R345 IonicContact OE1-NH2 3.26Å; E343-R345 PolarHBondContact OE1-NH2 2.78Å; R345-E364 IonicContact NH1-OE2 2.98Å
346	V	78.3	Confident	74.9	Confident	12 Å²	12	55.6 Å²	55.6	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	103.5	178.6	-176.3	0	0	0	0	108.8	L326 L328 L348 V351 F359	L326-V346 PolarHBondContact N-O 3.27Å; L326-V346 PolarHBondContact O-N 3.08Å; L328-V346 HydrophobicContact CD1-CG2 4.1Å; V346-L348 PolarHBondContact O-N 3.42Å; V346-V351 HydrophobicContact CG1-CG2 4.37Å; V346-F359 HydrophobicContact CG1-CD1 4.47Å; V346-F359 HydrophobicContact CG1-CD2 4.43Å; V346-F359 HydrophobicContact CG1-CE1 3.84Å; V346-F359 HydrophobicContact CG1-CE2 3.79Å; V346-F359 HydrophobicContact CG1-CZ 3.45Å; V346-F359 VanDerWaalsContact CG1-CZ 3.45Å
347	P	84.9	Confident	75.4	Confident	29 Å²	29	59.6 Å²	59.6	19%	0.188	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	127.1	170.3	-23.7	34.1	0	0	0	110	K349 R350	P347-K349 HydrophobicContact CB-CG 3.97Å; P347-K349 PolarHBondContact O-N 3.1Å; P347-K349 VanDerWaalsContact O-N 3.14Å; P347-R350 WeakPolarHBondContact O-CB 3.3Å; P347-R350 PolarHBondContact O-N 2.98Å
348	L	84.4	Confident	75.3	Confident	1 Å²	1	66 Å²	66	1%	0.005	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-63.6	-23.9	-174.8	-67.9	-163.2	0	0	0	112.8	L260 L287 V316 M321 K324 L326 V346 R350 V351	L260-L348 HydrophobicContact CD1-CD1 3.91Å; L260-L348 HydrophobicContact CD1-CD2 3.61Å; L260-L348 HydrophobicContact CD1-CG 4.41Å; L287-L348 HydrophobicContact CD1-CD1 3.67Å; L287-L348 HydrophobicContact CD1-CG 4.2Å; V316-L348 HydrophobicContact CG1-CD1 4.11Å; M321-L348 HydrophobicContact CE-CB 4.21Å; M321-L348 CarbonylContact O-C 3.56Å; M321-L348 VanDerWaalsContact O-CB 3.32Å; M321-L348 WeakPolarHBondContact O-CB 3.38Å; M321-L348 HydrophobicContact SD-CB 4.07Å; M321-L348 HydrophobicContact SD-CD1 3.75Å; M321-L348 HydrophobicContact SD-CG 4.46Å; K324-L348 HydrophobicContact CB-CD1 4.01Å; K324-L348 HydrophobicContact CB-CG 4.32Å; K324-L348 WeakPolarHBondContact O-CB 3.5Å; K324-L348 PolarHBondContact O-N 2.97Å; L326-L348 HydrophobicContact CB-CD2 3.91Å; V346-L348 PolarHBondContact O-N 3.42Å; L348-R350 PolarHBondContact O-N 3.45Å; L348-V351 WeakPolarHBondContact O-CB 3.48Å; L348-V351 PolarHBondContact O-N 3.06Å
349	K	84.1	Confident	74.5	Confident	154 Å²	154	68.5 Å²	68.5	67%	0.67	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-60	-16.4	174.6	66.2	176.7	-177.8	175.7	0	114.1	M321 P347 V351	M321-K349 VanDerWaalsContact O-CA 3.31Å; M321-K349 WeakPolarHBondContact O-CA 3.47Å; M321-K349 PolarHBondContact O-N 2.93Å; P347-K349 HydrophobicContact CB-CG 3.97Å; P347-K349 PolarHBondContact O-N 3.1Å; P347-K349 VanDerWaalsContact O-N 3.14Å; K349-V351 VanDerWaalsContact C-N 3.34Å
350	R	79.9	Confident	73.8	Confident	154 Å²	154	74.3 Å²	74.3	58%	0.581	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-87.1	-6	175.7	-64.2	-176	174.9	179.1	-2.4	112.7	P347 L348 K357	P347-R350 WeakPolarHBondContact O-CB 3.3Å; P347-R350 PolarHBondContact O-N 2.98Å; L348-R350 PolarHBondContact O-N 3.45Å; R350-K357 VanDerWaalsContact O-CD 3.23Å; R350-K357 WeakPolarHBondContact O-CD 3.49Å; R350-K357 WeakPolarHBondContact O-CE 3.46Å; R350-K357 PolarHBondContact O-NZ 3.21Å
351	V	78.8	Confident	72.9	Confident	33 Å²	33	75.3 Å²	75.3	20%	0.2	37%	0.37	C	S	.	.	S	Bend	trans	-104.3	124.8	178.9	-177.4	0	0	0	0	107.6	M321 V346 L348 K349 F359	M321-V351 HydrophobicContact CE-CB 3.92Å; M321-V351 HydrophobicContact CE-CG1 4.13Å; V346-V351 HydrophobicContact CG1-CG2 4.37Å; L348-V351 WeakPolarHBondContact O-CB 3.48Å; L348-V351 PolarHBondContact O-N 3.06Å; K349-V351 VanDerWaalsContact C-N 3.34Å; V351-F359 HydrophobicContact CG2-CE2 4.17Å; V351-F359 HydrophobicContact CG2-CZ 4.04Å
352	T	76.4	Confident	71.9	Confident	81 Å²	81	85.2 Å²	85.2	50%	0.497	41%	0.409	S	S	.	.			trans	-83.1	123.6	176	-55	0	0	0	0	108.2	G354 K355	T352-G354 PolarHBondContact O-N 3.32Å; T352-K355 HydrophobicContact CG2-CB 4.43Å; T352-K355 HydrophobicContact CG2-CD 4.08Å; T352-K355 HydrophobicContact CG2-CG 4.19Å; T352-K355 PolarHBondContact O-N 3.39Å; T352-K355 VanDerWaalsContact O-N 3.09Å; T352-K355 VanDerWaalsContact O-O 3.13Å
353	P	71.4	Confident	71.7	Confident	61 Å²	61	87.8 Å²	87.8	40%	0.396	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	138.4	177.1	-25.1	33.9	0	0	0	111.8	L257 L318 K355	L257-P353 HydrophobicContact CD2-CB 4.03Å; L318-P353 HydrophobicContact CD2-CG 4.04Å; P353-K355 PolarHBondContact O-N 3.16Å; P353-K355 VanDerWaalsContact O-N 3.16Å
354	G	68.6	Low	70.5	Confident	61 Å²	61	92.3 Å²	92.3	63%	0.629	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	-5.8	-178.4	0	0	0	0	0	115.6	T352	T352-G354 PolarHBondContact O-N 3.32Å
355	K	69.7	Low	69.5	Low	150 Å²	150	99.8 Å²	99.8	65%	0.652	48%	0.475	S	S	*	.	S	Bend	trans	-110.6	126	174.2	-61.6	-167.9	177.6	-171.7	0	110.4	T352 P353	T352-K355 HydrophobicContact CG2-CB 4.43Å; T352-K355 HydrophobicContact CG2-CD 4.08Å; T352-K355 HydrophobicContact CG2-CG 4.19Å; T352-K355 PolarHBondContact O-N 3.39Å; T352-K355 VanDerWaalsContact O-N 3.09Å; T352-K355 VanDerWaalsContact O-O 3.13Å; P353-K355 PolarHBondContact O-N 3.16Å; P353-K355 VanDerWaalsContact O-N 3.16Å
356	E	65.5	Low	67.7	Low	114 Å²	114	99.3 Å²	99.3	53%	0.533	48%	0.478	S	S	.	.			trans	-64.3	141.7	171.1	-65.3	-169.3	165.5	0	0	110.7	Y358	E356-Y358 HydrophobicContact CB-CE2 4.34Å; E356-Y358 PolarHBondContact OE2-OH 3.11Å
357	K	67	Low	65.4	Low	108 Å²	108	103 Å²	103	47%	0.47	50%	0.495	S	S	.	.			trans	-136.1	125.4	176.8	-172.7	164.9	-178.4	163.7	0	110.6	R350 F359	R350-K357 VanDerWaalsContact O-CD 3.23Å; R350-K357 WeakPolarHBondContact O-CD 3.49Å; R350-K357 WeakPolarHBondContact O-CE 3.46Å; R350-K357 PolarHBondContact O-NZ 3.21Å; K357-F359 HydrophobicContact CB-CE2 4.09Å; K357-F359 HydrophobicContact CB-CZ 4.38Å; K357-F359 HydrophobicContact CD-CE1 4.14Å; K357-F359 HydrophobicContact CD-CE2 4.17Å; K357-F359 HydrophobicContact CD-CZ 3.61Å; K357-F359 HydrophobicContact CG-CD2 4.46Å; K357-F359 HydrophobicContact CG-CE1 4.33Å; K357-F359 HydrophobicContact CG-CE2 3.82Å; K357-F359 HydrophobicContact CG-CZ 3.75Å
358	Y	67.5	Low	62.9	Low	158 Å²	158	105 Å²	105	62%	0.62	51%	0.508	S	S	*	.			trans	-93.3	138.4	178.2	-60.7	-87.7	0	0	0	110.1	E356	E356-Y358 HydrophobicContact CB-CE2 4.34Å; E356-Y358 PolarHBondContact OE2-OH 3.11Å
359	F	63	Low	60.5	Low	75 Å²	75	108.8 Å²	108.8	33%	0.329	53%	0.531	S	S	.	.			trans	-125.6	118.1	178.5	-64.5	-86.6	0	0	0	109.5	V346 V351 K357 V361	V346-F359 HydrophobicContact CG1-CD1 4.47Å; V346-F359 HydrophobicContact CG1-CD2 4.43Å; V346-F359 HydrophobicContact CG1-CE1 3.84Å; V346-F359 HydrophobicContact CG1-CE2 3.79Å; V346-F359 HydrophobicContact CG1-CZ 3.45Å; V346-F359 VanDerWaalsContact CG1-CZ 3.45Å; V351-F359 HydrophobicContact CG2-CE2 4.17Å; V351-F359 HydrophobicContact CG2-CZ 4.04Å; K357-F359 HydrophobicContact CB-CE2 4.09Å; K357-F359 HydrophobicContact CB-CZ 4.38Å; K357-F359 HydrophobicContact CD-CE1 4.14Å; K357-F359 HydrophobicContact CD-CE2 4.17Å; K357-F359 HydrophobicContact CD-CZ 3.61Å; K357-F359 HydrophobicContact CG-CD2 4.46Å; K357-F359 HydrophobicContact CG-CE1 4.33Å; K357-F359 HydrophobicContact CG-CE2 3.82Å; K357-F359 HydrophobicContact CG-CZ 3.75Å; F359-V361 HydrophobicContact CB-CG1 4.09Å
360	N	61.7	Low	58.1	Low	168 Å²	168	110.9 Å²	110.9	90%	0.898	54%	0.535	S	S	*	.			trans	-90	105.5	163.5	-68.3	-33.7	0	0	0	107.3
361	V	61.2	Low	55.9	Low	61 Å²	61	109.7 Å²	109.7	37%	0.37	53%	0.534	S	S	.	.			trans	-121.9	124.3	-171.6	-82.9	0	0	0	0	109.4	T344 F359	T344-V361 HydrophobicContact CG2-CB 4.12Å; T344-V361 HydrophobicContact CG2-CG2 3.84Å; F359-V361 HydrophobicContact CB-CG1 4.09Å
362	Y	51.3	Low	53.7	Low	217 Å²	217	110.2 Å²	110.2	85%	0.851	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-68.8	136.6	165.1	-62.7	-81.5	0	0	0	108.7	E364	Y362-E364 PolarHBondContact O-N 3.45Å
363	L	61.7	Low	51.8	Low	54 Å²	54	107.7 Å²	107.7	28%	0.283	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-74.8	119	172.7	-66.9	179.3	0	0	0	108.7	L270 V330 K365	L270-L363 HydrophobicContact CD2-CD1 3.6Å; V330-L363 HydrophobicContact CB-CD1 4.02Å; V330-L363 HydrophobicContact CG1-CD1 4.45Å; V330-L363 HydrophobicContact CG2-CD1 3.72Å; V330-L363 HydrophobicContact CG2-CD2 3.6Å; V330-L363 HydrophobicContact CG2-CG 4.33Å; L363-K365 PolarHBondContact O-N 2.98Å
364	E	54.2	Low	50.1	Low	117 Å²	117	105.8 Å²	105.8	55%	0.547	51%	0.507	S	S	.	.	B	Isolated β-bridge	trans	-66.3	117.9	169.4	-63.7	177.8	173.4	0	0	107.1	G342 E343 R345 Y362	G342-E364 WeakPolarHBondContact CA-O 3.23Å; E343-E364 PolarHBondContact N-O 3.25Å; E343-E364 WeakPolarHBondContact O-CB 3.35Å; E343-E364 PolarHBondContact O-N 2.77Å; R345-E364 IonicContact NH1-OE2 2.98Å; Y362-E364 PolarHBondContact O-N 3.45Å
365	K	50.3	Low	48.7	Very low	169 Å²	169	109 Å²	109	74%	0.735	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-59.1	153.9	170.2	-69	-174.1	178.7	-177.5	0	109	L363 M367	L363-K365 PolarHBondContact O-N 2.98Å; K365-M367 PolarHBondContact O-N 3.17Å
366	Q	41.1	Very low	47.4	Very low	108 Å²	108	103 Å²	103	51%	0.505	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-55.4	116.3	168.7	-117.2	176.2	6.7	0	0	106.2	F340 P368	F340-Q366 HydrophobicContact CB-CG 4.45Å; F340-Q366 HydrophobicContact CD1-CB 3.65Å; F340-Q366 HydrophobicContact CD1-CG 3.42Å; F340-Q366 VanDerWaalsContact CD1-CG 3.42Å; F340-Q366 HydrophobicContact CD2-CG 4.39Å; F340-Q366 HydrophobicContact CE1-CB 3.73Å; F340-Q366 HydrophobicContact CE1-CG 3.61Å; F340-Q366 HydrophobicContact CE2-CG 4.49Å; F340-Q366 HydrophobicContact CG-CG 3.85Å; F340-Q366 HydrophobicContact CZ-CG 4.13Å; Q366-P368 VanDerWaalsContact O-CD 3.23Å; Q366-P368 WeakPolarHBondContact O-CD 3.44Å
367	M	31.5	Very low	46.8	Very low	91 Å²	91	97.7 Å²	97.7	45%	0.448	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-57.1	116.3	179.8	-169.6	143.1	59.5	0	0	106.1	K365 V369 F371 L372	K365-M367 PolarHBondContact O-N 3.17Å; M367-V369 PolarHBondContact O-N 3.49Å; M367-F371 HydrophobicContact CG-CB 3.77Å; M367-F371 HydrophobicContact SD-CB 4.46Å; M367-L372 HydrophobicContact CE-CD2 4.1Å; M367-L372 HydrophobicContact CE-CG 4.33Å
368	P	32.5	Very low	46.1	Very low	70 Å²	70	93.2 Å²	93.2	46%	0.455	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-53.8	139.2	-175.3	-21	28	0	0	0	107.9	Q366 R370 F371	Q366-P368 VanDerWaalsContact O-CD 3.23Å; Q366-P368 WeakPolarHBondContact O-CD 3.44Å; P368-R370 PolarHBondContact O-N 3.01Å; P368-F371 HydrophobicContact CB-CD2 3.87Å; P368-F371 HydrophobicContact CB-CE2 4.44Å; P368-F371 HydrophobicContact CG-CD2 3.68Å; P368-F371 HydrophobicContact CG-CE2 4.07Å; P368-F371 PolarHBondContact O-N 2.91Å
369	V	33.4	Very low	45.7	Very low	80 Å²	80	85.7 Å²	85.7	49%	0.485	41%	0.409	S	S	.	.	H	α-helix	trans	-49.3	-35	-176.8	-170.6	0	0	0	0	110.6	M367 F371 L372 F373 P404	M367-V369 PolarHBondContact O-N 3.49Å; V369-F371 VanDerWaalsContact C-N 3.27Å; V369-F371 PolarHBondContact O-N 3.18Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 3.4Å; V369-L372 VanDerWaalsContact O-N 3.09Å; V369-F373 HydrophobicContact CG1-CD2 4.46Å; V369-F373 HydrophobicContact CG1-CE2 3.64Å; V369-F373 HydrophobicContact CG1-CZ 4.13Å; V369-F373 WeakPolarHBondContact O-CD2 3.35Å; V369-F373 WeakPolarHBondContact O-CE2 3.46Å; V369-P404 HydrophobicContact CG1-CG 4.47Å
370	R	32.5	Very low	45.6	Very low	199 Å²	199	83 Å²	83	75%	0.751	40%	0.397	S	S	*	.	H	α-helix	trans	-49.1	-36.1	171.2	-60.6	-177.4	178.7	172	-1.7	115	P368	P368-R370 PolarHBondContact O-N 3.01Å
371	F	34.2	Very low	45.6	Very low	128 Å²	128	75 Å²	75	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-91.8	-16.5	-179.8	-71.2	-80.5	0	0	0	114.4	M367 P368 V369 F373	M367-F371 HydrophobicContact CG-CB 3.77Å; M367-F371 HydrophobicContact SD-CB 4.46Å; P368-F371 HydrophobicContact CB-CD2 3.87Å; P368-F371 HydrophobicContact CB-CE2 4.44Å; P368-F371 HydrophobicContact CG-CD2 3.68Å; P368-F371 HydrophobicContact CG-CE2 4.07Å; P368-F371 PolarHBondContact O-N 2.91Å; V369-F371 VanDerWaalsContact C-N 3.27Å; V369-F371 PolarHBondContact O-N 3.18Å; F371-F373 VanDerWaalsContact C-N 3.32Å
372	L	33.1	Very low	45.7	Very low	45 Å²	45	73.6 Å²	73.6	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-68.4	-34.6	171.4	-83.8	153.6	0	0	0	110.9	M367 V369 A374 K375 C376	M367-L372 HydrophobicContact CE-CD2 4.1Å; M367-L372 HydrophobicContact CE-CG 4.33Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 3.4Å; V369-L372 VanDerWaalsContact O-N 3.09Å; L372-A374 PolarHBondContact O-N 3.02Å; L372-K375 PolarHBondContact O-N 2.75Å; L372-C376 WeakPolarHBondContact O-CB 3.28Å; L372-C376 PolarHBondContact O-N 2.75Å; L372-C376 PolarHBondContact O-SG 3.07Å
373	F	36.9	Very low	46.4	Very low	27 Å²	27	63.2 Å²	63.2	12%	0.118	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-38.2	178.6	-68	-75.7	0	0	0	113.7	V369 F371 N377 I401 I469	V369-F373 HydrophobicContact CG1-CD2 4.46Å; V369-F373 HydrophobicContact CG1-CE2 3.64Å; V369-F373 HydrophobicContact CG1-CZ 4.13Å; V369-F373 WeakPolarHBondContact O-CD2 3.35Å; V369-F373 WeakPolarHBondContact O-CE2 3.46Å; F371-F373 VanDerWaalsContact C-N 3.32Å; F373-N377 PolarHBondContact O-ND2 3.09Å; F373-I401 HydrophobicContact CD1-CG2 3.59Å; F373-I401 HydrophobicContact CE1-CG2 3.62Å; F373-I469 HydrophobicContact CB-CG2 4.15Å; F373-I469 HydrophobicContact CD1-CG2 3.78Å; F373-I469 HydrophobicContact CE1-CG2 4.48Å; F373-I469 HydrophobicContact CG-CG2 4.18Å
374	A	34.9	Very low	46.5	Very low	22 Å²	22	61.8 Å²	61.8	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-77.9	-18.6	-176.8	0	0	0	0	0	114.2	L372 R502 V505	L372-A374 PolarHBondContact O-N 3.02Å; A374-R502 PolarHBondContact O-NE 3Å; A374-R502 PolarHBondContact O-NH2 2.9Å; A374-V505 HydrophobicContact CB-CG2 3.68Å
375	K	38.7	Very low	46.9	Very low	127 Å²	127	56.3 Å²	56.3	55%	0.552	27%	0.272	S	S	*	.	H	α-helix	trans	-109.8	-33.2	-172.7	-85.6	-179.2	178.1	177.6	0	114.7	L372	L372-K375 PolarHBondContact O-N 2.75Å
376	C	43.1	Very low	47.1	Very low	25 Å²	25	49 Å²	49	17%	0.169	24%	0.244	C	C	.	.	H	α-helix	trans	-83.5	-27.7	-172	-67.8	0	0	0	0	114.5	C20 L372 P378	C20-C376 PolarHBondContact SG-O 2.64Å; L372-C376 WeakPolarHBondContact O-CB 3.28Å; L372-C376 PolarHBondContact O-N 2.75Å; L372-C376 PolarHBondContact O-SG 3.07Å; C376-P378 WeakPolarHBondContact O-CD 3.4Å
377	N	51.9	Low	47.8	Very low	3 Å²	3	48.5 Å²	48.5	2%	0.016	24%	0.238	C	C	.	.			trans	-102.5	118	-146.1	-67.1	-10.6	0	0	0	114.7	F373 E400 I401	F373-N377 PolarHBondContact O-ND2 3.09Å; N377-E400 WeakPolarHBondContact CB-O 3.08Å; N377-I401 VanDerWaalsContact CG-O 3.32Å; N377-I401 WeakPolarHBondContact ND2-CA 3.3Å; N377-I401 PolarHBondContact ND2-O 3.02Å; N377-I401 PolarHBondContact OD1-O 3.06Å; N377-I401 VanDerWaalsContact OD1-O 3.11Å
378	P	54.2	Low	48.7	Very low	13 Å²	13	53.2 Å²	53.2	8%	0.084	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.2	170	34.5	-31.1	0	0	0	112	L17 C376 E400 W500 H501	L17-P378 HydrophobicContact CD1-CG 3.53Å; C376-P378 WeakPolarHBondContact O-CD 3.4Å; P378-E400 HydrophobicContact CG-CB 4.46Å; P378-E400 PolarHBondContact O-N 3.17Å; P378-W500 HydrophobicContact CB-CD2 4.41Å; P378-W500 HydrophobicContact CB-CE3 3.65Å; P378-W500 HydrophobicContact CB-CZ3 4.17Å; P378-W500 HydrophobicContact CG-CE3 4.26Å; P378-W500 HydrophobicContact CG-CZ3 4.31Å; P378-W500 WeakPolarHBondContact O-CZ3 3.49Å; P378-H501 CarbonylContact C-O 3.58Å; P378-H501 WeakPolarHBondContact CA-O 3.14Å
379	F	57.3	Low	49.6	Very low	1 Å²	1	61 Å²	61	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	112.6	-175.6	-179	-99	0	0	0	110.6	V381 L397 Y399 L409 V455 V457 L472 W500 H501 L503	F379-V381 HydrophobicContact CD1-CG2 3.4Å; F379-V381 VanDerWaalsContact CD1-CG2 3.4Å; F379-V381 HydrophobicContact CE1-CG2 3.11Å; F379-V381 HydrophobicContact CZ-CG2 4.19Å; F379-L397 HydrophobicContact CE1-CD2 4.24Å; F379-L397 HydrophobicContact CZ-CB 4.46Å; F379-L397 HydrophobicContact CZ-CD2 4.05Å; F379-Y399 AromaticContact CD2-CD1 3.5Å; F379-Y399 HydrophobicContact CD2-CD1 3.5Å; F379-Y399 VanDerWaalsContact CD2-CD1 3.5Å; F379-Y399 AromaticContact CD2-CD2 3.92Å; F379-Y399 HydrophobicContact CD2-CD2 3.92Å; F379-Y399 HydrophobicContact CD2-CE1 4.02Å; F379-Y399 HydrophobicContact CD2-CE2 4.37Å; F379-Y399 AromaticContact CD2-CG 3.46Å; F379-Y399 HydrophobicContact CD2-CG 3.46Å; F379-Y399 VanDerWaalsContact CD2-CG 3.46Å; F379-Y399 AromaticContact CE2-CD1 3.28Å; F379-Y399 HydrophobicContact CE2-CD1 3.28Å; F379-Y399 HydrophobicContact CE2-CD2 4.27Å; F379-Y399 AromaticContact CE2-CE1 3.42Å; F379-Y399 HydrophobicContact CE2-CE1 3.42Å; F379-Y399 VanDerWaalsContact CE2-CE1 3.42Å; F379-Y399 HydrophobicContact CE2-CE2 4.35Å; F379-Y399 AromaticContact CE2-CG 3.77Å; F379-Y399 HydrophobicContact CE2-CG 3.77Å; F379-Y399 AromaticContact CE2-CZ 3.95Å; F379-Y399 HydrophobicContact CZ-CD1 4.36Å; F379-Y399 HydrophobicContact CZ-CE1 4.43Å; F379-L409 HydrophobicContact CE2-CD1 3.74Å; F379-L409 HydrophobicContact CZ-CD1 3.65Å; F379-V455 HydrophobicContact CE1-CB 4.28Å; F379-V455 HydrophobicContact CE1-CG1 3.85Å; F379-V455 HydrophobicContact CE2-CG1 4.3Å; F379-V455 HydrophobicContact CZ-CB 4.29Å; F379-V455 HydrophobicContact CZ-CG1 3.4Å; F379-V457 HydrophobicContact CD2-CG2 4.33Å; F379-V457 HydrophobicContact CE2-CG2 4.02Å; F379-L472 HydrophobicContact CD1-CD2 3.53Å; F379-L472 HydrophobicContact CE1-CD2 3.72Å; F379-W500 CarbonylContact O-C 3.57Å; F379-W500 WeakPolarHBondContact O-CA 3.41Å; F379-H501 PolarHBondContact N-O 3.15Å; F379-H501 PolarHBondContact O-N 3.46Å; F379-L503 HydrophobicContact CB-CD2 4.15Å; F379-L503 HydrophobicContact CB-CG 4.2Å; F379-L503 HydrophobicContact CD1-CD2 4.36Å; F379-L503 HydrophobicContact CD2-CD2 4Å; F379-L503 HydrophobicContact CD2-CG 4.46Å; F379-L503 HydrophobicContact CG-CD2 3.93Å; F379-L503 HydrophobicContact CG-CG 4.43Å
380	N	61	Low	50.4	Low	18 Å²	18	62.2 Å²	62.2	10%	0.096	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.4	179.9	-163.4	-36.5	0	0	0	110.4	Q398 R499 W500	N380-Q398 WeakPolarHBondContact CA-O 3.22Å; N380-Q398 WeakPolarHBondContact CB-O 3.15Å; N380-Q398 PolarHBondContact N-O 3.21Å; N380-Q398 PolarHBondContact O-N 2.57Å; N380-Q398 VanDerWaalsContact O-N 3.14Å; N380-R499 WeakPolarHBondContact CA-O 3.3Å; N380-W500 HydrophobicContact CB-CD2 3.78Å; N380-W500 HydrophobicContact CB-CE3 3.65Å; N380-W500 HydrophobicContact CB-CH2 3.88Å; N380-W500 HydrophobicContact CB-CZ2 3.98Å; N380-W500 HydrophobicContact CB-CZ3 3.72Å; N380-W500 VanDerWaalsContact ND2-CE2 3.32Å; N380-W500 WeakPolarHBondContact ND2-CZ2 3.16Å; N380-W500 PolarHBondContact ND2-NE1 3.23Å
381	V	62.3	Low	51.3	Low	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.3	170.7	-176	0	0	0	0	109.4	F379 L383 L397 L472 L474 H485 K498 R499	F379-V381 HydrophobicContact CD1-CG2 3.4Å; F379-V381 VanDerWaalsContact CD1-CG2 3.4Å; F379-V381 HydrophobicContact CE1-CG2 3.11Å; F379-V381 HydrophobicContact CZ-CG2 4.19Å; V381-L383 HydrophobicContact CG1-CD2 3.47Å; V381-L383 VanDerWaalsContact CG1-CD2 3.47Å; V381-L383 HydrophobicContact CG1-CG 3.83Å; V381-L397 HydrophobicContact CB-CD2 4.17Å; V381-L397 HydrophobicContact CG1-CD2 3.79Å; V381-L397 HydrophobicContact CG2-CD2 3.92Å; V381-L472 HydrophobicContact CG2-CD2 3.63Å; V381-L474 HydrophobicContact CB-CD1 4.26Å; V381-L474 HydrophobicContact CG1-CD1 3.7Å; V381-L474 HydrophobicContact CG2-CD1 4.16Å; V381-H485 PolarHBondContact O-CE1 3.3Å; V381-K498 WeakPolarHBondContact O-CA 3.4Å; V381-R499 PolarHBondContact N-O 3.36Å; V381-R499 PolarHBondContact O-N 3.15Å
382	I	63.7	Low	51.9	Low	31 Å²	31	53.2 Å²	53.2	16%	0.159	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114	172.7	-54.1	-177.7	0	0	0	107.5	F395 V396 I496 V497 K498	I382-F395 WeakPolarHBondContact O-CA 3.42Å; I382-V396 WeakPolarHBondContact CA-O 3.44Å; I382-V396 HydrophobicContact CB-CB 4.02Å; I382-V396 VanDerWaalsContact CB-O 3.3Å; I382-V396 WeakPolarHBondContact CB-O 3.04Å; I382-V396 HydrophobicContact CD1-CB 4.2Å; I382-V396 HydrophobicContact CD1-CG1 4.4Å; I382-V396 HydrophobicContact CG1-CB 4.49Å; I382-V396 HydrophobicContact CG2-CB 4.46Å; I382-V396 PolarHBondContact N-O 2.67Å; I382-V396 PolarHBondContact O-N 2.87Å; I382-I496 HydrophobicContact CG2-CG2 3.26Å; I382-V497 CarbonylContact C-O 3.54Å; I382-V497 WeakPolarHBondContact CA-O 3.32Å; I382-K498 HydrophobicContact CB-CG 4.36Å; I382-K498 HydrophobicContact CD1-CD 4.01Å; I382-K498 HydrophobicContact CD1-CG 4.3Å; I382-K498 HydrophobicContact CG1-CB 4.37Å; I382-K498 HydrophobicContact CG1-CD 4.14Å; I382-K498 HydrophobicContact CG1-CG 3.89Å; I382-K498 HydrophobicContact CG2-CG 4.02Å
383	L	66.6	Low	52.7	Low	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.5	176.3	-52.8	175.6	0	0	0	110.1	V381 F395 L453 L474 W486 C489 V497	V381-L383 HydrophobicContact CG1-CD2 3.47Å; V381-L383 VanDerWaalsContact CG1-CD2 3.47Å; V381-L383 HydrophobicContact CG1-CG 3.83Å; L383-F395 HydrophobicContact CB-CD1 4.18Å; L383-F395 HydrophobicContact CB-CE1 4.4Å; L383-F395 HydrophobicContact CD2-CD1 3.47Å; L383-F395 VanDerWaalsContact CD2-CD1 3.47Å; L383-F395 HydrophobicContact CD2-CE1 3.94Å; L383-F395 HydrophobicContact CG-CD1 4.44Å; L383-L453 HydrophobicContact CD2-CD2 3.88Å; L383-L474 HydrophobicContact CD1-CD1 4.38Å; L383-L474 HydrophobicContact CD2-CD1 4.22Å; L383-W486 HydrophobicContact CD1-CE3 3.86Å; L383-W486 HydrophobicContact CD1-CZ3 4.31Å; L383-W486 HydrophobicContact CD2-CZ3 4.38Å; L383-C489 HydrophobicContact CB-CB 3.83Å; L383-C489 WeakPolarHBondContact CB-SG 3.5Å; L383-C489 HydrophobicContact CD1-CB 3.88Å; L383-V497 PolarHBondContact N-O 3.48Å; L383-V497 PolarHBondContact O-N 3.21Å
384	N	63.7	Low	53.3	Low	23 Å²	23	52.9 Å²	52.9	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	112.5	168.6	-177.9	-4.4	0	0	0	109.6	G386 Q394 I496	N384-G386 PolarHBondContact O-N 3.2Å; N384-G386 PolarHBondContact OD1-N 2.94Å; N384-Q394 CarbonylContact C-O 3.6Å; N384-Q394 WeakPolarHBondContact CA-O 3.3Å; N384-Q394 WeakPolarHBondContact CB-O 3.43Å; N384-Q394 PolarHBondContact N-O 2.9Å; N384-Q394 PolarHBondContact O-N 3.46Å; N384-I496 HydrophobicContact CB-CG1 4.12Å
385	A	61	Low	54.1	Low	3 Å²	3	52.3 Å²	52.3	3%	0.025	24%	0.237	C	C	.	.			trans	-88.4	87.6	170.3	0	0	0	0	0	109.2	M448 P493 N494	A385-M448 HydrophobicContact CB-CE 4.07Å; A385-P493 CarbonylContact O-C 3.54Å; A385-P493 WeakPolarHBondContact O-CA 3.14Å; A385-N494 PolarHBondContact O-N 3.23Å
386	G	54.8	Low	54.4	Low	16 Å²	16	47.8 Å²	47.8	17%	0.165	22%	0.219	C	C	.	.			trans	-75.9	147.8	176.6	0	0	0	0	0	112.8	N384 N494	N384-G386 PolarHBondContact O-N 3.2Å; N384-G386 PolarHBondContact OD1-N 2.94Å; G386-N494 WeakPolarHBondContact CA-OD1 3.5Å
387	R	57	Low	54.5	Low	96 Å²	96	46.7 Å²	46.7	36%	0.362	21%	0.212	S	C	.	.			trans	-123.6	29.9	-169.9	-140	-179.8	172.6	-77.8	-14.1	114.7	E390 N494	R387-E390 WeakPolarHBondContact CG-O 3.4Å; R387-E390 IonicContact CZ-OE1 2.81Å; R387-E390 IonicContact NH1-OE1 2.62Å; R387-E390 PolarHBondContact NH1-OE1 2.98Å; R387-E390 IonicContact NH2-OE1 3.05Å; R387-E390 PolarHBondContact NH2-OE1 3.03Å; R387-E390 WeakPolarHBondContact O-CA 3.02Å; R387-E390 PolarHBondContact O-N 2.85Å; R387-N494 PolarHBondContact N-OD1 3.05Å
388	K	49.5	Very low	54	Low	191 Å²	191	50 Å²	50	83%	0.83	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	129.9	175.5	-91.4	-168.2	170.8	-173.3	0	111.8	E390 F392	K388-E390 PolarHBondContact O-N 3.32Å; K388-F392 WeakPolarHBondContact O-CD2 3.3Å
389	R	52.3	Low	53.6	Low	233 Å²	233	49.9 Å²	49.9	88%	0.879	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.3	34.9	-151.4	-68	-171.4	-175.9	171.6	1.3	110.7	N391 F392	R389-N391 VanDerWaalsContact C-N 3.28Å; R389-N391 PolarHBondContact O-N 2.8Å; R389-F392 HydrophobicContact CB-CD2 4.4Å; R389-F392 HydrophobicContact CB-CE2 3.86Å; R389-F392 WeakPolarHBondContact O-CE2 3.41Å
390	E	50.2	Low	52.8	Low	106 Å²	106	50.7 Å²	50.7	50%	0.495	23%	0.229	S	C	.	.	S	Bend	trans	63.2	-35.8	173.3	-54	-169.2	75.3	0	0	120	R387 K388	R387-E390 WeakPolarHBondContact CG-O 3.4Å; R387-E390 IonicContact CZ-OE1 2.81Å; R387-E390 IonicContact NH1-OE1 2.62Å; R387-E390 PolarHBondContact NH1-OE1 2.98Å; R387-E390 IonicContact NH2-OE1 3.05Å; R387-E390 PolarHBondContact NH2-OE1 3.03Å; R387-E390 WeakPolarHBondContact O-CA 3.02Å; R387-E390 PolarHBondContact O-N 2.85Å; K388-E390 PolarHBondContact O-N 3.32Å
391	N	51.1	Low	52.1	Low	43 Å²	43	50 Å²	50	23%	0.23	23%	0.226	C	C	.	.			trans	-127.6	41	-154.2	-86.1	-25.3	0	0	0	116.6	R389 L443 P444 Y445	R389-N391 VanDerWaalsContact C-N 3.28Å; R389-N391 PolarHBondContact O-N 2.8Å; N391-L443 CarbonylContact C-O 3.55Å; N391-L443 CarbonylContact O-C 3.33Å; N391-L443 VanDerWaalsContact O-C 3.25Å; N391-P444 HydrophobicContact CB-CB 4.49Å; N391-Y445 WeakPolarHBondContact OD1-CB 3.16Å; N391-Y445 PolarHBondContact OD1-N 3.48Å
392	F	47.6	Very low	51	Low	95 Å²	95	51.8 Å²	51.8	42%	0.417	24%	0.236	S	C	.	.			trans	-145.7	119.9	-172.5	-47.9	-68.4	0	0	0	115.4	K388 R389 N442	K388-F392 WeakPolarHBondContact O-CD2 3.3Å; R389-F392 HydrophobicContact CB-CD2 4.4Å; R389-F392 HydrophobicContact CB-CE2 3.86Å; R389-F392 WeakPolarHBondContact O-CE2 3.41Å; F392-N442 HydrophobicContact CD1-CB 3.6Å; F392-N442 HydrophobicContact CE1-CB 4.2Å
393	A	48.1	Very low	50	Low	5 Å²	5	50.9 Å²	50.9	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	163.9	-166.2	0	0	0	0	0	116.5	F395 R440 F441	A393-F395 VanDerWaalsContact C-CE2 3.45Å; A393-F395 HydrophobicContact CB-CE2 3.72Å; A393-F395 HydrophobicContact CB-CZ 3.5Å; A393-F395 VanDerWaalsContact CB-CZ 3.5Å; A393-R440 WeakPolarHBondContact O-CA 3.17Å; A393-F441 PolarHBondContact N-O 3.17Å; A393-F441 PolarHBondContact O-N 3.23Å
394	Q	51.1	Low	48.7	Very low	60 Å²	60	54.3 Å²	54.3	28%	0.28	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	129.9	-154.6	-178.2	164.7	-118.1	0	0	114.3	N384 L438 R440	N384-Q394 CarbonylContact C-O 3.6Å; N384-Q394 WeakPolarHBondContact CA-O 3.3Å; N384-Q394 WeakPolarHBondContact CB-O 3.43Å; N384-Q394 PolarHBondContact N-O 2.9Å; N384-Q394 PolarHBondContact O-N 3.46Å; Q394-L438 HydrophobicContact CG-CD1 3.62Å; Q394-L438 HydrophobicContact CG-CD2 4Å; Q394-L438 HydrophobicContact CG-CG 4.06Å; Q394-R440 HydrophobicContact CG-CG 4.28Å
395	F	51.8	Low	47.7	Very low	10 Å²	10	53.5 Å²	53.5	4%	0.044	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.3	-159.6	-48.2	-85.2	0	0	0	114.9	I382 L383 A393 L438 F439 F441	I382-F395 WeakPolarHBondContact O-CA 3.42Å; L383-F395 HydrophobicContact CB-CD1 4.18Å; L383-F395 HydrophobicContact CB-CE1 4.4Å; L383-F395 HydrophobicContact CD2-CD1 3.47Å; L383-F395 VanDerWaalsContact CD2-CD1 3.47Å; L383-F395 HydrophobicContact CD2-CE1 3.94Å; L383-F395 HydrophobicContact CG-CD1 4.44Å; A393-F395 VanDerWaalsContact C-CE2 3.45Å; A393-F395 HydrophobicContact CB-CE2 3.72Å; A393-F395 HydrophobicContact CB-CZ 3.5Å; A393-F395 VanDerWaalsContact CB-CZ 3.5Å; F395-L438 CarbonylContact O-C 3.53Å; F395-L438 WeakPolarHBondContact O-CA 3.04Å; F395-F439 PolarHBondContact N-O 2.52Å; F395-F439 PolarHBondContact O-N 2.83Å; F395-F441 AromaticContact CD2-CD2 3.6Å; F395-F441 HydrophobicContact CD2-CD2 3.6Å; F395-F441 HydrophobicContact CD2-CE2 4.26Å; F395-F441 HydrophobicContact CE2-CB 4.11Å; F395-F441 AromaticContact CE2-CD2 3.7Å; F395-F441 HydrophobicContact CE2-CD2 3.7Å; F395-F441 HydrophobicContact CE2-CG 4.41Å
396	V	44	Very low	46.9	Very low	31 Å²	31	54 Å²	54	19%	0.188	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.5	-180	-172.1	0	0	0	0	112.4	I382 L438	I382-V396 WeakPolarHBondContact CA-O 3.44Å; I382-V396 HydrophobicContact CB-CB 4.02Å; I382-V396 VanDerWaalsContact CB-O 3.3Å; I382-V396 WeakPolarHBondContact CB-O 3.04Å; I382-V396 HydrophobicContact CD1-CB 4.2Å; I382-V396 HydrophobicContact CD1-CG1 4.4Å; I382-V396 HydrophobicContact CG1-CB 4.49Å; I382-V396 HydrophobicContact CG2-CB 4.46Å; I382-V396 PolarHBondContact N-O 2.67Å; I382-V396 PolarHBondContact O-N 2.87Å; V396-L438 HydrophobicContact CG2-CB 4.3Å; V396-L438 HydrophobicContact CG2-CD1 3.26Å; V396-L438 HydrophobicContact CG2-CG 4.38Å
397	L	45.4	Very low	47.1	Very low	2 Å²	2	53.4 Å²	53.4	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	138.3	-167.1	-53.6	164.8	0	0	0	112.4	F379 V381 L409 L411 F439 V455	F379-L397 HydrophobicContact CE1-CD2 4.24Å; F379-L397 HydrophobicContact CZ-CB 4.46Å; F379-L397 HydrophobicContact CZ-CD2 4.05Å; V381-L397 HydrophobicContact CB-CD2 4.17Å; V381-L397 HydrophobicContact CG1-CD2 3.79Å; V381-L397 HydrophobicContact CG2-CD2 3.92Å; L397-L409 HydrophobicContact CB-CD1 4.08Å; L397-L409 HydrophobicContact CD1-CD1 3.63Å; L397-L409 HydrophobicContact CD1-CD2 3.37Å; L397-L409 HydrophobicContact CD1-CG 4.14Å; L397-L409 HydrophobicContact CG-CD1 4.36Å; L397-L411 HydrophobicContact CD1-CD1 4.03Å; L397-L411 HydrophobicContact CD1-CD2 4.12Å; L397-L411 HydrophobicContact CD1-CG 4.41Å; L397-F439 HydrophobicContact CD1-CD2 4.05Å; L397-F439 HydrophobicContact CD1-CE2 4.08Å; L397-V455 HydrophobicContact CD1-CG1 4.34Å
398	Q	42.2	Very low	47	Very low	74 Å²	74	49.4 Å²	49.4	35%	0.346	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	138.3	-177.2	-174.8	-174.3	109.6	0	0	112	N380 V434 N436	N380-Q398 WeakPolarHBondContact CA-O 3.22Å; N380-Q398 WeakPolarHBondContact CB-O 3.15Å; N380-Q398 PolarHBondContact N-O 3.21Å; N380-Q398 PolarHBondContact O-N 2.57Å; N380-Q398 VanDerWaalsContact O-N 3.14Å; Q398-V434 HydrophobicContact CG-CG1 4.47Å; Q398-N436 PolarHBondContact NE2-OD1 3.05Å
399	Y	45.6	Very low	47.4	Very low	9 Å²	9	40.3 Å²	40.3	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	159.2	-169.8	49.9	-80.8	0	0	0	117.5	F379 I401 L409 P433 F435 V457	F379-Y399 AromaticContact CD2-CD1 3.5Å; F379-Y399 HydrophobicContact CD2-CD1 3.5Å; F379-Y399 VanDerWaalsContact CD2-CD1 3.5Å; F379-Y399 AromaticContact CD2-CD2 3.92Å; F379-Y399 HydrophobicContact CD2-CD2 3.92Å; F379-Y399 HydrophobicContact CD2-CE1 4.02Å; F379-Y399 HydrophobicContact CD2-CE2 4.37Å; F379-Y399 AromaticContact CD2-CG 3.46Å; F379-Y399 HydrophobicContact CD2-CG 3.46Å; F379-Y399 VanDerWaalsContact CD2-CG 3.46Å; F379-Y399 AromaticContact CE2-CD1 3.28Å; F379-Y399 HydrophobicContact CE2-CD1 3.28Å; F379-Y399 HydrophobicContact CE2-CD2 4.27Å; F379-Y399 AromaticContact CE2-CE1 3.42Å; F379-Y399 HydrophobicContact CE2-CE1 3.42Å; F379-Y399 VanDerWaalsContact CE2-CE1 3.42Å; F379-Y399 HydrophobicContact CE2-CE2 4.35Å; F379-Y399 AromaticContact CE2-CG 3.77Å; F379-Y399 HydrophobicContact CE2-CG 3.77Å; F379-Y399 AromaticContact CE2-CZ 3.95Å; F379-Y399 HydrophobicContact CZ-CD1 4.36Å; F379-Y399 HydrophobicContact CZ-CE1 4.43Å; Y399-I401 HydrophobicContact CD2-CD1 3.8Å; Y399-I401 HydrophobicContact CD2-CG1 3.6Å; Y399-I401 HydrophobicContact CE2-CD1 3.51Å; Y399-I401 HydrophobicContact CE2-CG1 3.88Å; Y399-L409 HydrophobicContact CE1-CD1 3.76Å; Y399-P433 HydrophobicContact CD2-CG 4.23Å; Y399-P433 HydrophobicContact CE2-CG 4.08Å; Y399-F435 HydrophobicContact CD1-CD2 4.28Å; Y399-F435 HydrophobicContact CD1-CE2 4.06Å; Y399-F435 AromaticContact CE1-CD2 3.62Å; Y399-F435 HydrophobicContact CE1-CD2 3.62Å; Y399-F435 AromaticContact CE1-CE2 3.22Å; Y399-F435 HydrophobicContact CE1-CE2 3.22Å; Y399-F435 HydrophobicContact CE1-CZ 4.23Å; Y399-F435 HydrophobicContact CE2-CE2 4.18Å; Y399-F435 AromaticContact CZ-CE2 3.31Å; Y399-F435 AromaticContact CZ-CZ 3.95Å; Y399-F435 VanDerWaalsContact OH-CE2 3.29Å; Y399-F435 WeakPolarHBondContact OH-CE2 3.06Å; Y399-F435 WeakPolarHBondContact OH-CZ 3.27Å; Y399-V457 HydrophobicContact CE2-CB 4.3Å; Y399-V457 HydrophobicContact CE2-CG1 3.57Å; Y399-V457 HydrophobicContact CE2-CG2 3.67Å
400	E	40.4	Very low	47.6	Very low	18 Å²	18	32.7 Å²	32.7	8%	0.084	17%	0.167	C	C	.	.			trans	-100.4	135.1	172.1	-159.8	-165.5	178.9	0	0	109.4	L17 H24 N377 P378 V402 N432	L17-E400 VanDerWaalsContact CD1-OE2 3.27Å; L17-E400 WeakPolarHBondContact CD1-OE2 3.5Å; H24-E400 IonicContact CE1-OE1 3.81Å; H24-E400 IonicContact CG-OE1 2.82Å; H24-E400 IonicContact ND1-OE1 2.83Å; H24-E400 PolarHBondContact ND1-OE1 2.99Å; N377-E400 WeakPolarHBondContact CB-O 3.08Å; P378-E400 HydrophobicContact CG-CB 4.46Å; P378-E400 PolarHBondContact O-N 3.17Å; E400-V402 HydrophobicContact CG-CG2 4.04Å; E400-N432 WeakPolarHBondContact CG-OD1 3.47Å
401	I	45.7	Very low	48	Very low	5 Å²	5	27.8 Å²	27.8	3%	0.026	14%	0.144	C	C	.	.			trans	-121.3	-25.3	-178.6	-46.5	179.8	0	0	0	113.1	F373 N377 Y399 G403 P407 L431 P433 V457 I469	F373-I401 HydrophobicContact CD1-CG2 3.59Å; F373-I401 HydrophobicContact CE1-CG2 3.62Å; N377-I401 VanDerWaalsContact CG-O 3.32Å; N377-I401 WeakPolarHBondContact ND2-CA 3.3Å; N377-I401 PolarHBondContact ND2-O 3.02Å; N377-I401 PolarHBondContact OD1-O 3.06Å; N377-I401 VanDerWaalsContact OD1-O 3.11Å; Y399-I401 HydrophobicContact CD2-CD1 3.8Å; Y399-I401 HydrophobicContact CD2-CG1 3.6Å; Y399-I401 HydrophobicContact CE2-CD1 3.51Å; Y399-I401 HydrophobicContact CE2-CG1 3.88Å; I401-G403 PolarHBondContact O-N 3.06Å; I401-P407 HydrophobicContact CD1-CB 3.34Å; I401-P407 HydrophobicContact CD1-CG 3.58Å; I401-L431 CarbonylContact C-O 3.49Å; I401-L431 WeakPolarHBondContact CA-O 3.4Å; I401-L431 VanDerWaalsContact CB-O 3.29Å; I401-L431 WeakPolarHBondContact CB-O 3.41Å; I401-L431 PolarHBondContact N-O 3.29Å; I401-P433 HydrophobicContact CD1-CG 3.79Å; I401-P433 HydrophobicContact CG1-CG 4.32Å; I401-V457 HydrophobicContact CD1-CG1 4.28Å; I401-I469 HydrophobicContact CG2-CD1 4.48Å; I401-I469 HydrophobicContact CG2-CG2 4.19Å
402	V	40.3	Very low	48.1	Very low	37 Å²	37	27.6 Å²	27.6	22%	0.224	14%	0.143	C	C	.	.			trans	65.9	-8.7	175.9	-170.3	0	0	0	0	114.8	H24 E400 L431	H24-V402 HydrophobicContact CB-CG1 3.77Å; H24-V402 HydrophobicContact CB-CG2 4.41Å; E400-V402 HydrophobicContact CG-CG2 4.04Å; V402-L431 PolarHBondContact N-O 3.06Å; V402-L431 VanDerWaalsContact N-O 3.11Å
403	G	42.3	Very low	48.4	Very low	11 Å²	11	24.3 Å²	24.3	11%	0.113	13%	0.128	C	C	.	.	S	Bend	trans	-120.8	169.4	-173.8	0	0	0	0	0	115.6	I401 L431	I401-G403 PolarHBondContact O-N 3.06Å; G403-L431 WeakPolarHBondContact O-CD2 3.22Å
404	P	37.7	Very low	48.6	Very low	73 Å²	73	24.7 Å²	24.7	47%	0.474	13%	0.131	S	C	.	.	S	Bend	trans	-68.9	153.6	-173.1	28.8	-36.1	0	0	0	113.5	V369	V369-P404 HydrophobicContact CG1-CG 4.47Å
405	G	43.4	Very low	48.4	Very low	6 Å²	6	29.7 Å²	29.7	6%	0.062	15%	0.154	C	C	.	.	S	Bend	trans	110.6	165	166.3	0	0	0	0	0	116.2	P407 D459	G405-P407 WeakPolarHBondContact O-CD 3.42Å; G405-D459 WeakPolarHBondContact CA-OD1 3.45Å; G405-D459 WeakPolarHBondContact CA-OD2 3.46Å
406	P	45.3	Very low	48.5	Very low	14 Å²	14	32.3 Å²	32.3	9%	0.091	17%	0.171	C	C	.	.			trans	-79.5	99.3	171.4	-15.8	33.3	0	0	0	114	F408 V426 K427 K428 D459 K460	P406-F408 PolarHBondContact O-N 3.29Å; P406-V426 HydrophobicContact CB-CG1 3.29Å; P406-V426 HydrophobicContact CG-CG1 4.38Å; P406-K427 WeakPolarHBondContact CA-O 3.43Å; P406-K428 HydrophobicContact CB-CB 4.41Å; P406-K428 HydrophobicContact CB-CG 4.18Å; P406-K428 HydrophobicContact CG-CB 4.35Å; P406-K428 HydrophobicContact CG-CG 4.22Å; P406-D459 WeakPolarHBondContact CD-OD1 3.28Å; P406-K460 HydrophobicContact CB-CB 4.39Å; P406-K460 WeakPolarHBondContact CD-O 3.24Å; P406-K460 WeakPolarHBondContact CG-O 3.43Å; P406-K460 PolarHBondContact O-N 2.84Å
407	P	57.5	Low	48.8	Very low	2 Å²	2	38.9 Å²	38.9	1%	0.013	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	138.4	175	28.7	-37.3	0	0	0	111.2	I401 G405 K427 T430 P433 F435 V457 W458	I401-P407 HydrophobicContact CD1-CB 3.34Å; I401-P407 HydrophobicContact CD1-CG 3.58Å; G405-P407 WeakPolarHBondContact O-CD 3.42Å; P407-K427 WeakPolarHBondContact CD-O 3.47Å; P407-K427 PolarHBondContact O-N 3.42Å; P407-T430 WeakPolarHBondContact CD-O 3.45Å; P407-P433 HydrophobicContact CB-CB 4.5Å; P407-P433 HydrophobicContact CB-CG 4.02Å; P407-P433 HydrophobicContact CG-CB 3.46Å; P407-P433 VanDerWaalsContact CG-CB 3.46Å; P407-P433 HydrophobicContact CG-CG 3.28Å; P407-F435 HydrophobicContact CB-CZ 4.23Å; P407-F435 HydrophobicContact CG-CZ 4.25Å; P407-F435 WeakPolarHBondContact O-CE1 3.37Å; P407-F435 WeakPolarHBondContact O-CZ 3.14Å; P407-V457 HydrophobicContact CB-CG1 4.36Å; P407-W458 CarbonylContact C-O 3.6Å; P407-W458 VanDerWaalsContact CA-O 3.26Å; P407-W458 WeakPolarHBondContact CA-O 3.35Å
408	F	56.3	Low	49.4	Very low	12 Å²	12	46.7 Å²	46.7	5%	0.053	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	158.9	160.1	73.2	-82.9	0	0	0	110	P406 V426 W458 K460 D466	P406-F408 PolarHBondContact O-N 3.29Å; F408-V426 HydrophobicContact CB-CG2 3.88Å; F408-V426 HydrophobicContact CD1-CG2 4.38Å; F408-V426 HydrophobicContact CG-CG2 4.29Å; F408-W458 HydrophobicContact CD1-CB 3.74Å; F408-W458 WeakPolarHBondContact CD1-O 3Å; F408-W458 HydrophobicContact CD2-CB 4.28Å; F408-W458 HydrophobicContact CE1-CB 3.24Å; F408-W458 HydrophobicContact CE1-CG 4.19Å; F408-W458 HydrophobicContact CE2-CB 3.81Å; F408-W458 HydrophobicContact CE2-CG 4.01Å; F408-W458 HydrophobicContact CG-CB 4.26Å; F408-W458 HydrophobicContact CZ-CB 3.28Å; F408-W458 HydrophobicContact CZ-CD2 4.43Å; F408-W458 AromaticContact CZ-CG 3.73Å; F408-W458 HydrophobicContact CZ-CG 3.73Å; F408-W458 PolarHBondContact N-O 2.91Å; F408-W458 PolarHBondContact O-N 3.44Å; F408-K460 HydrophobicContact CD1-CB 3.7Å; F408-K460 HydrophobicContact CE1-CB 3.8Å; F408-K460 HydrophobicContact CE1-CG 4.4Å; F408-D466 HydrophobicContact CE1-CB 4.2Å; F408-D466 WeakPolarHBondContact CE1-OD2 3.18Å; F408-D466 HydrophobicContact CZ-CB 4.38Å; F408-D466 VanDerWaalsContact CZ-OD2 3.32Å; F408-D466 WeakPolarHBondContact CZ-OD2 3.44Å
409	L	56.7	Low	50.3	Low	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.8	-175.7	-176.6	143.6	0	0	0	109.5	F379 L397 Y399 L411 K423 T424 F439 V455 Q456	F379-L409 HydrophobicContact CE2-CD1 3.74Å; F379-L409 HydrophobicContact CZ-CD1 3.65Å; L397-L409 HydrophobicContact CB-CD1 4.08Å; L397-L409 HydrophobicContact CD1-CD1 3.63Å; L397-L409 HydrophobicContact CD1-CD2 3.37Å; L397-L409 HydrophobicContact CD1-CG 4.14Å; L397-L409 HydrophobicContact CG-CD1 4.36Å; Y399-L409 HydrophobicContact CE1-CD1 3.76Å; L409-L411 HydrophobicContact CD2-CD1 3.49Å; L409-L411 VanDerWaalsContact CD2-CD1 3.49Å; L409-L411 HydrophobicContact CD2-CD2 4.33Å; L409-L411 HydrophobicContact CD2-CG 3.55Å; L409-K423 WeakPolarHBondContact O-CA 3.09Å; L409-T424 HydrophobicContact CB-CG2 3.72Å; L409-T424 HydrophobicContact CD2-CG2 4.23Å; L409-T424 PolarHBondContact N-OG1 2.87Å; L409-T424 PolarHBondContact O-N 3.34Å; L409-F439 HydrophobicContact CD2-CE2 4.25Å; L409-V455 HydrophobicContact CD1-CG1 3.46Å; L409-V455 VanDerWaalsContact CD1-CG1 3.46Å; L409-V455 HydrophobicContact CD2-CG1 3.9Å; L409-V455 HydrophobicContact CG-CG1 3.69Å; L409-Q456 CarbonylContact C-O 3.42Å; L409-Q456 VanDerWaalsContact CA-O 3.25Å; L409-Q456 WeakPolarHBondContact CA-O 3.5Å
410	R	57.1	Low	51.3	Low	74 Å²	74	51.9 Å²	51.9	28%	0.279	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.5	174.2	-170.6	178.9	-170.2	178	-1.3	108.7	L412 K423 Q456	R410-L412 HydrophobicContact CG-CD2 4.28Å; R410-K423 HydrophobicContact CB-CG 4.47Å; R410-K423 HydrophobicContact CG-CG 4.19Å; R410-Q456 HydrophobicContact CB-CB 4.35Å; R410-Q456 PolarHBondContact N-O 3.34Å; R410-Q456 WeakPolarHBondContact O-CB 3.49Å; R410-Q456 PolarHBondContact O-N 2.67Å
411	L	58.5	Low	52.7	Low	2 Å²	2	55.6 Å²	55.6	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.5	172.6	-71.2	135.9	0	0	0	109.4	L397 L409 Q421 A422 F439 F441 L453 C454 V455	L397-L411 HydrophobicContact CD1-CD1 4.03Å; L397-L411 HydrophobicContact CD1-CD2 4.12Å; L397-L411 HydrophobicContact CD1-CG 4.41Å; L409-L411 HydrophobicContact CD2-CD1 3.49Å; L409-L411 VanDerWaalsContact CD2-CD1 3.49Å; L409-L411 HydrophobicContact CD2-CD2 4.33Å; L409-L411 HydrophobicContact CD2-CG 3.55Å; L411-Q421 WeakPolarHBondContact O-CA 3.18Å; L411-A422 HydrophobicContact CB-CB 4.34Å; L411-A422 HydrophobicContact CD1-CB 4.03Å; L411-A422 PolarHBondContact N-O 3.36Å; L411-A422 PolarHBondContact O-N 2.91Å; L411-F439 HydrophobicContact CD1-CB 4.18Å; L411-F439 HydrophobicContact CD1-CD1 3.94Å; L411-F439 HydrophobicContact CD1-CD2 3.28Å; L411-F439 HydrophobicContact CD1-CE1 4.12Å; L411-F439 HydrophobicContact CD1-CE2 3.5Å; L411-F439 VanDerWaalsContact CD1-CE2 3.5Å; L411-F439 HydrophobicContact CD1-CG 3.5Å; L411-F439 VanDerWaalsContact CD1-CG 3.5Å; L411-F439 HydrophobicContact CD1-CZ 3.91Å; L411-F441 HydrophobicContact CB-CZ 3.98Å; L411-F441 HydrophobicContact CD1-CE2 4.47Å; L411-F441 HydrophobicContact CD1-CZ 4.26Å; L411-F441 HydrophobicContact CD2-CE2 4.37Å; L411-F441 HydrophobicContact CG-CZ 4.49Å; L411-L453 HydrophobicContact CD2-CD1 3.58Å; L411-L453 HydrophobicContact CD2-CG 4.22Å; L411-C454 CarbonylContact C-O 3.53Å; L411-C454 WeakPolarHBondContact CA-O 3.43Å; L411-V455 HydrophobicContact CD2-CG1 4.45Å; L411-V455 HydrophobicContact CD2-CG2 3.87Å
412	L	52.8	Low	53.9	Low	39 Å²	39	56.2 Å²	56.2	20%	0.204	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.5	175.6	-59.5	172.6	0	0	0	109.6	R410 Q421 C454 Q456	R410-L412 HydrophobicContact CG-CD2 4.28Å; L412-Q421 HydrophobicContact CD2-CB 4.45Å; L412-Q421 HydrophobicContact CD2-CG 3.63Å; L412-C454 HydrophobicContact CB-CB 4.16Å; L412-C454 PolarHBondContact N-O 2.85Å; L412-C454 WeakPolarHBondContact O-CB 3.19Å; L412-C454 PolarHBondContact O-N 3.17Å; L412-Q456 VanDerWaalsContact CD1-CD 3.49Å; L412-Q456 HydrophobicContact CD1-CG 4.41Å; L412-Q456 VanDerWaalsContact CD1-NE2 3.28Å
413	K	54.9	Low	55.7	Low	26 Å²	26	59.8 Å²	59.8	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	134.3	-177	173.1	-163.2	156.8	-67.9	0	114.1	T416 K418 R420	K413-T416 PolarHBondContact NZ-O 3.44Å; K413-T416 PolarHBondContact NZ-OG1 3Å; K413-K418 VanDerWaalsContact CD-O 3.27Å; K413-K418 WeakPolarHBondContact CD-O 3.34Å; K413-K418 WeakPolarHBondContact CE-O 3.14Å; K413-K418 PolarHBondContact NZ-O 3.34Å; K413-R420 HydrophobicContact CB-CB 4.1Å; K413-R420 WeakPolarHBondContact CB-O 3.36Å; K413-R420 HydrophobicContact CD-CB 4.2Å; K413-R420 HydrophobicContact CD-CG 4.08Å; K413-R420 PolarHBondContact N-O 3.26Å
414	S	51.1	Low	57.1	Low	13 Å²	13	59.9 Å²	59.9	9%	0.091	30%	0.299	C	S	.	.			trans	27.8	137	136.3	135	0	0	0	0	123.4	T416 V451 T452	S414-T416 PolarHBondContact O-N 3.33Å; S414-T416 PolarHBondContact OG-N 3.08Å; S414-T416 PolarHBondContact OG-OG1 2.9Å; S414-V451 WeakPolarHBondContact OG-CG2 3.45Å; S414-T452 PolarHBondContact N-O 2.72Å
415	E	48.4	Very low	58.8	Low	166 Å²	166	62.2 Å²	62.2	78%	0.776	30%	0.304	S	S	*	.	S	Bend	trans	-55.8	-12.5	179.9	-92.3	174.6	133.9	0	0	117.2	N417	E415-N417 PolarHBondContact O-N 3.23Å
416	T	52.3	Low	60.2	Low	65 Å²	65	63.8 Å²	63.8	40%	0.399	31%	0.312	S	S	.	.	S	Bend	trans	-79.1	75.1	175.3	58.3	0	0	0	0	110.6	K413 S414 K418	K413-T416 PolarHBondContact NZ-O 3.44Å; K413-T416 PolarHBondContact NZ-OG1 3Å; S414-T416 PolarHBondContact O-N 3.33Å; S414-T416 PolarHBondContact OG-N 3.08Å; S414-T416 PolarHBondContact OG-OG1 2.9Å; T416-K418 PolarHBondContact O-N 2.73Å
417	N	50.5	Low	61.1	Low	168 Å²	168	65.9 Å²	65.9	90%	0.898	32%	0.32	S	S	*	.	S	Bend	trans	40.2	0.7	165.5	-82.7	-25.3	0	0	0	121.2	E415	E415-N417 PolarHBondContact O-N 3.23Å
418	K	57.8	Low	61.2	Low	166 Å²	166	73.3 Å²	73.3	72%	0.722	35%	0.352	S	S	*	.			trans	-138.5	99.5	179.2	-69.8	-174.3	-179.8	177.1	0	108.2	K413 T416 R420	K413-K418 VanDerWaalsContact CD-O 3.27Å; K413-K418 WeakPolarHBondContact CD-O 3.34Å; K413-K418 WeakPolarHBondContact CE-O 3.14Å; K413-K418 PolarHBondContact NZ-O 3.34Å; T416-K418 PolarHBondContact O-N 2.73Å; K418-R420 PolarHBondContact O-N 3.12Å; K418-R420 VanDerWaalsContact O-N 3.16Å
419	V	61.2	Low	61	Low	91 Å²	91	82 Å²	82	55%	0.552	38%	0.384	S	S	*	.			trans	-72.1	103.3	171.4	-177.7	0	0	0	0	107.8	Q421	V419-Q421 HydrophobicContact CG1-CG 3.8Å
420	R	66.2	Low	60.6	Low	102 Å²	102	84 Å²	84	39%	0.385	40%	0.397	S	S	.	.			trans	-75.1	143.2	159.2	-62.1	-171.4	-173	122.6	-9.2	108.6	K413 K418 F441 N442	K413-R420 HydrophobicContact CB-CB 4.1Å; K413-R420 WeakPolarHBondContact CB-O 3.36Å; K413-R420 HydrophobicContact CD-CB 4.2Å; K413-R420 HydrophobicContact CD-CG 4.08Å; K413-R420 PolarHBondContact N-O 3.26Å; K418-R420 PolarHBondContact O-N 3.12Å; K418-R420 VanDerWaalsContact O-N 3.16Å; R420-F441 HydrophobicContact CB-CD1 4.13Å; R420-F441 HydrophobicContact CB-CE1 4.18Å; R420-N442 PolarHBondContact NH1-O 2.75Å; R420-N442 PolarHBondContact NH2-O 3.26Å
421	Q	70.4	Confident	60.2	Low	95 Å²	95	83.2 Å²	83.2	44%	0.444	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.4	173.2	-53.9	-170.3	8.9	0	0	109.7	L411 L412 V419	L411-Q421 WeakPolarHBondContact O-CA 3.18Å; L412-Q421 HydrophobicContact CD2-CB 4.45Å; L412-Q421 HydrophobicContact CD2-CG 3.63Å; V419-Q421 HydrophobicContact CG1-CG 3.8Å
422	A	72.1	Confident	59.9	Low	19 Å²	19	86.4 Å²	86.4	16%	0.157	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	147.7	170.2	0	0	0	0	0	109.6	L411 F439 F441	L411-A422 HydrophobicContact CB-CB 4.34Å; L411-A422 HydrophobicContact CD1-CB 4.03Å; L411-A422 PolarHBondContact N-O 3.36Å; L411-A422 PolarHBondContact O-N 2.91Å; A422-F439 HydrophobicContact CB-CD1 3.3Å; A422-F439 HydrophobicContact CB-CE1 3.51Å; A422-F439 HydrophobicContact CB-CG 4.18Å; A422-F441 HydrophobicContact CB-CE1 4.25Å; A422-F441 HydrophobicContact CB-CZ 3.96Å
423	K	76.2	Confident	60.2	Low	111 Å²	111	84.6 Å²	84.6	48%	0.483	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144	178.5	-66.2	-176.2	-177.7	-177.9	0	110.2	L409 R410	L409-K423 WeakPolarHBondContact O-CA 3.09Å; R410-K423 HydrophobicContact CB-CG 4.47Å; R410-K423 HydrophobicContact CG-CG 4.19Å
424	T	73.2	Confident	60.4	Low	13 Å²	13	87 Å²	87	8%	0.08	42%	0.422	C	S	.	.			trans	-79.4	168.4	170.4	61.2	0	0	0	0	111.6	L409 F435 F439	L409-T424 HydrophobicContact CB-CG2 3.72Å; L409-T424 HydrophobicContact CD2-CG2 4.23Å; L409-T424 PolarHBondContact N-OG1 2.87Å; L409-T424 PolarHBondContact O-N 3.34Å; T424-F435 HydrophobicContact CG2-CB 4.33Å; T424-F435 HydrophobicContact CG2-CD1 3.84Å; T424-F435 HydrophobicContact CG2-CE1 4.41Å; T424-F435 HydrophobicContact CG2-CG 4.11Å; T424-F435 WeakPolarHBondContact OG1-CD1 3.31Å; T424-F435 VanDerWaalsContact OG1-CE1 3.31Å; T424-F435 WeakPolarHBondContact OG1-CE1 3.27Å; T424-F439 HydrophobicContact CG2-CE2 3.68Å; T424-F439 HydrophobicContact CG2-CZ 3.48Å; T424-F439 VanDerWaalsContact CG2-CZ 3.48Å
425	E	73.5	Confident	61	Low	122 Å²	122	87.2 Å²	87.2	57%	0.57	42%	0.421	S	S	*	.			trans	-57.7	152.3	155.5	-66.4	-180	173.9	0	0	111.3	K427 F435	E425-K427 IonicContact OE2-NZ 3.04Å; E425-K427 PolarHBondContact OE2-NZ 2.98Å; E425-F435 VanDerWaalsContact O-CE1 3.29Å; E425-F435 WeakPolarHBondContact O-CE1 3.47Å
426	V	72.2	Confident	61.7	Low	39 Å²	39	84.1 Å²	84.1	24%	0.236	41%	0.41	C	S	.	.			trans	-86.8	113.5	175.8	175.7	0	0	0	0	108.1	P406 F408 K428 K460	P406-V426 HydrophobicContact CB-CG1 3.29Å; P406-V426 HydrophobicContact CG-CG1 4.38Å; F408-V426 HydrophobicContact CB-CG2 3.88Å; F408-V426 HydrophobicContact CD1-CG2 4.38Å; F408-V426 HydrophobicContact CG-CG2 4.29Å; V426-K428 HydrophobicContact CG1-CG 4.19Å; V426-K428 PolarHBondContact O-N 3.14Å; V426-K460 HydrophobicContact CB-CD 4.24Å; V426-K460 HydrophobicContact CG1-CB 3.87Å; V426-K460 HydrophobicContact CG1-CD 3.98Å; V426-K460 HydrophobicContact CG1-CG 4.48Å; V426-K460 HydrophobicContact CG2-CB 4.3Å; V426-K460 HydrophobicContact CG2-CD 3.39Å; V426-K460 HydrophobicContact CG2-CG 4.47Å
427	K	64.1	Low	62.2	Low	59 Å²	59	84 Å²	84	26%	0.257	41%	0.405	S	S	.	.			trans	-85.6	96.7	176.2	-65	-56	-173.9	-162.9	0	108.9	P406 P407 E425 T430 P433 V434 F435	P406-K427 WeakPolarHBondContact CA-O 3.43Å; P407-K427 WeakPolarHBondContact CD-O 3.47Å; P407-K427 PolarHBondContact O-N 3.42Å; E425-K427 IonicContact OE2-NZ 3.04Å; E425-K427 PolarHBondContact OE2-NZ 2.98Å; K427-T430 HydrophobicContact CB-CG2 3.71Å; K427-P433 HydrophobicContact CB-CB 3.96Å; K427-P433 HydrophobicContact CG-CB 4.19Å; K427-V434 WeakPolarHBondContact CE-O 3.33Å; K427-F435 HydrophobicContact CB-CE1 4.32Å; K427-F435 HydrophobicContact CG-CD1 3.86Å; K427-F435 HydrophobicContact CG-CE1 3.7Å; K427-F435 HydrophobicContact CG-CZ 4.35Å
428	K	60.7	Low	62.9	Low	158 Å²	158	79.2 Å²	79.2	69%	0.687	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	141.5	-177.9	-62.3	-178.3	-178	177.9	0	112.1	P406 V426 T430	P406-K428 HydrophobicContact CB-CB 4.41Å; P406-K428 HydrophobicContact CB-CG 4.18Å; P406-K428 HydrophobicContact CG-CB 4.35Å; P406-K428 HydrophobicContact CG-CG 4.22Å; V426-K428 HydrophobicContact CG1-CG 4.19Å; V426-K428 PolarHBondContact O-N 3.14Å; K428-T430 PolarHBondContact O-N 2.88Å
429	R	52	Low	63.4	Low	194 Å²	194	72 Å²	72	73%	0.732	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	39.7	167.3	-52.3	176.7	178.6	162.5	-1.1	113.7	Y121	Y121-R429 HydrophobicContact CE1-CG 4.12Å
430	T	46.5	Very low	63.6	Low	42 Å²	42	75.7 Å²	75.7	26%	0.258	35%	0.352	S	S	.	.			trans	-139.1	130.9	177.5	-178.8	0	0	0	0	113.3	P407 K427 K428 N432 P433	P407-T430 WeakPolarHBondContact CD-O 3.45Å; K427-T430 HydrophobicContact CB-CG2 3.71Å; K428-T430 PolarHBondContact O-N 2.88Å; T430-N432 PolarHBondContact OG1-N 2.72Å; T430-N432 VanDerWaalsContact OG1-N 3.14Å; T430-N432 PolarHBondContact OG1-O 2.71Å; T430-P433 HydrophobicContact CG2-CB 3.97Å
431	L	50.4	Low	63.7	Low	57 Å²	57	72 Å²	72	30%	0.298	34%	0.339	S	S	.	.	S	Bend	trans	-77.4	-14.1	174.4	-32.4	176.3	0	0	0	111.8	H24 I401 V402 G403	H24-L431 WeakPolarHBondContact NE2-CD1 3.23Å; I401-L431 CarbonylContact C-O 3.49Å; I401-L431 WeakPolarHBondContact CA-O 3.4Å; I401-L431 VanDerWaalsContact CB-O 3.29Å; I401-L431 WeakPolarHBondContact CB-O 3.41Å; I401-L431 PolarHBondContact N-O 3.29Å; V402-L431 PolarHBondContact N-O 3.06Å; V402-L431 VanDerWaalsContact N-O 3.11Å; G403-L431 WeakPolarHBondContact O-CD2 3.22Å
432	N	51.4	Low	63.6	Low	69 Å²	69	71.6 Å²	71.6	37%	0.369	34%	0.34	S	S	.	.	S	Bend	trans	-138	68.4	-170.8	-61.7	-35.8	0	0	0	109.2	E400 T430 V434	E400-N432 WeakPolarHBondContact CG-OD1 3.47Å; T430-N432 PolarHBondContact OG1-N 2.72Å; T430-N432 VanDerWaalsContact OG1-N 3.14Å; T430-N432 PolarHBondContact OG1-O 2.71Å; N432-V434 PolarHBondContact O-N 3.1Å
433	P	58.3	Low	63.4	Low	1 Å²	1	71.4 Å²	71.4	1%	0.006	34%	0.336	C	S	.	.			trans	-69.2	132.2	-177	34.5	-41.9	0	0	0	111.6	Y399 I401 P407 K427 T430 F435	Y399-P433 HydrophobicContact CD2-CG 4.23Å; Y399-P433 HydrophobicContact CE2-CG 4.08Å; I401-P433 HydrophobicContact CD1-CG 3.79Å; I401-P433 HydrophobicContact CG1-CG 4.32Å; P407-P433 HydrophobicContact CB-CB 4.5Å; P407-P433 HydrophobicContact CB-CG 4.02Å; P407-P433 HydrophobicContact CG-CB 3.46Å; P407-P433 VanDerWaalsContact CG-CB 3.46Å; P407-P433 HydrophobicContact CG-CG 3.28Å; K427-P433 HydrophobicContact CB-CB 3.96Å; K427-P433 HydrophobicContact CG-CB 4.19Å; T430-P433 HydrophobicContact CG2-CB 3.97Å; P433-F435 HydrophobicContact CB-CD2 4.17Å; P433-F435 HydrophobicContact CB-CE1 4.33Å; P433-F435 HydrophobicContact CB-CE2 3.4Å; P433-F435 VanDerWaalsContact CB-CE2 3.4Å; P433-F435 HydrophobicContact CB-CZ 3.52Å; P433-F435 HydrophobicContact CG-CD2 4.39Å; P433-F435 HydrophobicContact CG-CE2 3.42Å; P433-F435 VanDerWaalsContact CG-CE2 3.42Å; P433-F435 HydrophobicContact CG-CZ 3.8Å
434	V	60	Low	63.1	Low	78 Å²	78	68.4 Å²	68.4	47%	0.473	33%	0.328	S	S	.	.			trans	-107.7	106.3	167.7	-178.9	0	0	0	0	107.1	Q398 K427 N432 N436	Q398-V434 HydrophobicContact CG-CG1 4.47Å; K427-V434 WeakPolarHBondContact CE-O 3.33Å; N432-V434 PolarHBondContact O-N 3.1Å; V434-N436 VanDerWaalsContact CG1-CG 3.48Å; V434-N436 VanDerWaalsContact CG1-ND2 3.34Å; V434-N436 WeakPolarHBondContact CG1-ND2 3.23Å; V434-N436 WeakPolarHBondContact CG1-OD1 3.34Å
435	F	63.3	Low	62.9	Low	16 Å²	16	71.4 Å²	71.4	7%	0.07	34%	0.338	C	S	.	.			trans	-84.8	-47.6	178.1	-59.1	-85.4	0	0	0	111	Y399 P407 T424 E425 K427 P433 Q437	Y399-F435 HydrophobicContact CD1-CD2 4.28Å; Y399-F435 HydrophobicContact CD1-CE2 4.06Å; Y399-F435 AromaticContact CE1-CD2 3.62Å; Y399-F435 HydrophobicContact CE1-CD2 3.62Å; Y399-F435 AromaticContact CE1-CE2 3.22Å; Y399-F435 HydrophobicContact CE1-CE2 3.22Å; Y399-F435 HydrophobicContact CE1-CZ 4.23Å; Y399-F435 HydrophobicContact CE2-CE2 4.18Å; Y399-F435 AromaticContact CZ-CE2 3.31Å; Y399-F435 AromaticContact CZ-CZ 3.95Å; Y399-F435 VanDerWaalsContact OH-CE2 3.29Å; Y399-F435 WeakPolarHBondContact OH-CE2 3.06Å; Y399-F435 WeakPolarHBondContact OH-CZ 3.27Å; P407-F435 HydrophobicContact CB-CZ 4.23Å; P407-F435 HydrophobicContact CG-CZ 4.25Å; P407-F435 WeakPolarHBondContact O-CE1 3.37Å; P407-F435 WeakPolarHBondContact O-CZ 3.14Å; T424-F435 HydrophobicContact CG2-CB 4.33Å; T424-F435 HydrophobicContact CG2-CD1 3.84Å; T424-F435 HydrophobicContact CG2-CE1 4.41Å; T424-F435 HydrophobicContact CG2-CG 4.11Å; T424-F435 WeakPolarHBondContact OG1-CD1 3.31Å; T424-F435 VanDerWaalsContact OG1-CE1 3.31Å; T424-F435 WeakPolarHBondContact OG1-CE1 3.27Å; E425-F435 VanDerWaalsContact O-CE1 3.29Å; E425-F435 WeakPolarHBondContact O-CE1 3.47Å; K427-F435 HydrophobicContact CB-CE1 4.32Å; K427-F435 HydrophobicContact CG-CD1 3.86Å; K427-F435 HydrophobicContact CG-CE1 3.7Å; K427-F435 HydrophobicContact CG-CZ 4.35Å; P433-F435 HydrophobicContact CB-CD2 4.17Å; P433-F435 HydrophobicContact CB-CE1 4.33Å; P433-F435 HydrophobicContact CB-CE2 3.4Å; P433-F435 VanDerWaalsContact CB-CE2 3.4Å; P433-F435 HydrophobicContact CB-CZ 3.52Å; P433-F435 HydrophobicContact CG-CD2 4.39Å; P433-F435 HydrophobicContact CG-CE2 3.42Å; P433-F435 VanDerWaalsContact CG-CE2 3.42Å; P433-F435 HydrophobicContact CG-CZ 3.8Å; F435-Q437 HydrophobicContact CB-CB 4.38Å; F435-Q437 PolarHBondContact O-N 3.33Å
436	N	62.5	Low	62.8	Low	101 Å²	101	73.5 Å²	73.5	54%	0.54	35%	0.348	S	S	.	.			trans	47.6	30.3	-172.4	-65.6	-14.5	0	0	0	113	Q398 V434	Q398-N436 PolarHBondContact NE2-OD1 3.05Å; V434-N436 VanDerWaalsContact CG1-CG 3.48Å; V434-N436 VanDerWaalsContact CG1-ND2 3.34Å; V434-N436 WeakPolarHBondContact CG1-ND2 3.23Å; V434-N436 WeakPolarHBondContact CG1-OD1 3.34Å
437	Q	63.5	Low	63	Low	62 Å²	62	74.7 Å²	74.7	29%	0.29	35%	0.353	S	S	.	.			trans	-93.7	135.2	-176.7	-171.5	171.1	-7.4	0	0	110.2	F435 F439	F435-Q437 HydrophobicContact CB-CB 4.38Å; F435-Q437 PolarHBondContact O-N 3.33Å; Q437-F439 HydrophobicContact CB-CE2 4.44Å; Q437-F439 HydrophobicContact CG-CE1 4.44Å; Q437-F439 HydrophobicContact CG-CE2 4.35Å; Q437-F439 HydrophobicContact CG-CZ 4.08Å
438	L	65	Low	63.5	Low	68 Å²	68	72 Å²	72	36%	0.356	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125	-179.9	-173.3	78.7	0	0	0	110.3	Q394 F395 V396 R440	Q394-L438 HydrophobicContact CG-CD1 3.62Å; Q394-L438 HydrophobicContact CG-CD2 4Å; Q394-L438 HydrophobicContact CG-CG 4.06Å; F395-L438 CarbonylContact O-C 3.53Å; F395-L438 WeakPolarHBondContact O-CA 3.04Å; V396-L438 HydrophobicContact CG2-CB 4.3Å; V396-L438 HydrophobicContact CG2-CD1 3.26Å; V396-L438 HydrophobicContact CG2-CG 4.38Å; L438-R440 HydrophobicContact CD2-CG 4.41Å; L438-R440 VanDerWaalsContact CD2-CZ 3.44Å
439	F	67.8	Low	64.3	Low	15 Å²	15	67.2 Å²	67.2	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.8	171.3	-63.4	-73.4	0	0	0	110	F395 L397 L409 L411 A422 T424 Q437 F441	F395-F439 PolarHBondContact N-O 2.52Å; F395-F439 PolarHBondContact O-N 2.83Å; L397-F439 HydrophobicContact CD1-CD2 4.05Å; L397-F439 HydrophobicContact CD1-CE2 4.08Å; L409-F439 HydrophobicContact CD2-CE2 4.25Å; L411-F439 HydrophobicContact CD1-CB 4.18Å; L411-F439 HydrophobicContact CD1-CD1 3.94Å; L411-F439 HydrophobicContact CD1-CD2 3.28Å; L411-F439 HydrophobicContact CD1-CE1 4.12Å; L411-F439 HydrophobicContact CD1-CE2 3.5Å; L411-F439 VanDerWaalsContact CD1-CE2 3.5Å; L411-F439 HydrophobicContact CD1-CG 3.5Å; L411-F439 VanDerWaalsContact CD1-CG 3.5Å; L411-F439 HydrophobicContact CD1-CZ 3.91Å; A422-F439 HydrophobicContact CB-CD1 3.3Å; A422-F439 HydrophobicContact CB-CE1 3.51Å; A422-F439 HydrophobicContact CB-CG 4.18Å; T424-F439 HydrophobicContact CG2-CE2 3.68Å; T424-F439 HydrophobicContact CG2-CZ 3.48Å; T424-F439 VanDerWaalsContact CG2-CZ 3.48Å; Q437-F439 HydrophobicContact CB-CE2 4.44Å; Q437-F439 HydrophobicContact CG-CE1 4.44Å; Q437-F439 HydrophobicContact CG-CE2 4.35Å; Q437-F439 HydrophobicContact CG-CZ 4.08Å; F439-F441 HydrophobicContact CB-CE2 3.9Å; F439-F441 HydrophobicContact CB-CZ 4.27Å
440	R	65.5	Low	65.5	Low	169 Å²	169	60 Å²	60	64%	0.638	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.3	176.7	-65.4	-171.4	-178.8	102.5	-3.8	109	A393 Q394 L438	A393-R440 WeakPolarHBondContact O-CA 3.17Å; Q394-R440 HydrophobicContact CG-CG 4.28Å; L438-R440 HydrophobicContact CD2-CG 4.41Å; L438-R440 VanDerWaalsContact CD2-CZ 3.44Å
441	F	69.5	Low	66.9	Low	25 Å²	25	58.3 Å²	58.3	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.4	174.1	-60.8	-72.7	0	0	0	108.2	A393 F395 L411 R420 A422 F439 L443 L453	A393-F441 PolarHBondContact N-O 3.17Å; A393-F441 PolarHBondContact O-N 3.23Å; F395-F441 AromaticContact CD2-CD2 3.6Å; F395-F441 HydrophobicContact CD2-CD2 3.6Å; F395-F441 HydrophobicContact CD2-CE2 4.26Å; F395-F441 HydrophobicContact CE2-CB 4.11Å; F395-F441 AromaticContact CE2-CD2 3.7Å; F395-F441 HydrophobicContact CE2-CD2 3.7Å; F395-F441 HydrophobicContact CE2-CG 4.41Å; L411-F441 HydrophobicContact CB-CZ 3.98Å; L411-F441 HydrophobicContact CD1-CE2 4.47Å; L411-F441 HydrophobicContact CD1-CZ 4.26Å; L411-F441 HydrophobicContact CD2-CE2 4.37Å; L411-F441 HydrophobicContact CG-CZ 4.49Å; R420-F441 HydrophobicContact CB-CD1 4.13Å; R420-F441 HydrophobicContact CB-CE1 4.18Å; A422-F441 HydrophobicContact CB-CE1 4.25Å; A422-F441 HydrophobicContact CB-CZ 3.96Å; F439-F441 HydrophobicContact CB-CE2 3.9Å; F439-F441 HydrophobicContact CB-CZ 4.27Å; F441-L443 PolarHBondContact O-N 3.09Å; F441-L443 VanDerWaalsContact O-N 3.08Å; F441-L453 HydrophobicContact CE2-CD1 4.27Å
442	N	67.3	Low	68.3	Low	86 Å²	86	56.8 Å²	56.8	46%	0.46	30%	0.3	S	S	.	.			trans	-76.4	93.9	177.4	-73	-10.8	0	0	0	109.5	F392 R420	F392-N442 HydrophobicContact CD1-CB 3.6Å; F392-N442 HydrophobicContact CE1-CB 4.2Å; R420-N442 PolarHBondContact NH1-O 2.75Å; R420-N442 PolarHBondContact NH2-O 3.26Å
443	L	68.7	Low	69.6	Low	15 Å²	15	54 Å²	54	8%	0.079	29%	0.285	C	S	.	.			trans	-127.4	124.6	-175.6	-176.5	69.5	0	0	0	109.3	N391 F441 D447 M448 V451	N391-L443 CarbonylContact C-O 3.55Å; N391-L443 CarbonylContact O-C 3.33Å; N391-L443 VanDerWaalsContact O-C 3.25Å; F441-L443 PolarHBondContact O-N 3.09Å; F441-L443 VanDerWaalsContact O-N 3.08Å; L443-D447 HydrophobicContact CD1-CB 3.8Å; L443-D447 HydrophobicContact CG-CB 4.21Å; L443-M448 HydrophobicContact CD2-CG 4.21Å; L443-M448 HydrophobicContact CD2-SD 3.49Å; L443-M448 WeakPolarHBondContact CD2-SD 3.22Å; L443-M448 HydrophobicContact CG-SD 4.27Å; L443-V451 HydrophobicContact CD1-CG2 3.79Å; L443-V451 HydrophobicContact CD2-CB 3.85Å; L443-V451 HydrophobicContact CD2-CG1 3.78Å; L443-V451 HydrophobicContact CD2-CG2 3.5Å; L443-V451 VanDerWaalsContact CD2-CG2 3.5Å; L443-V451 HydrophobicContact CG-CG2 4.25Å
444	P	68.9	Low	70.7	Confident	48 Å²	48	54.7 Å²	54.7	31%	0.312	29%	0.29	S	S	.	.			trans	-53.1	138.9	171.1	-24.6	34.8	0	0	0	111.3	N391 E446 D447 M448	N391-P444 HydrophobicContact CB-CB 4.49Å; P444-E446 PolarHBondContact O-N 3.27Å; P444-D447 HydrophobicContact CB-CB 4.49Å; P444-D447 WeakPolarHBondContact CD-OD2 3.34Å; P444-D447 WeakPolarHBondContact CG-OD2 3.41Å; P444-D447 PolarHBondContact O-N 3.02Å; P444-M448 PolarHBondContact O-N 3.05Å
445	Y	69.9	Low	71.5	Confident	76 Å²	76	51 Å²	51	30%	0.298	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-60.5	-34.7	-178.1	-175.2	-93.7	0	0	0	111.7	N391 D447 M448 I490 P493	N391-Y445 WeakPolarHBondContact OD1-CB 3.16Å; N391-Y445 PolarHBondContact OD1-N 3.48Å; Y445-D447 PolarHBondContact O-N 3.31Å; Y445-M448 VanDerWaalsContact O-CB 3.26Å; Y445-M448 WeakPolarHBondContact O-CB 3.39Å; Y445-M448 WeakPolarHBondContact O-CG 3.47Å; Y445-M448 PolarHBondContact O-N 3.41Å; Y445-M448 VanDerWaalsContact O-N 3.15Å; Y445-I490 HydrophobicContact CE2-CG2 4.35Å; Y445-I490 PolarHBondContact OH-O 2.95Å; Y445-P493 HydrophobicContact CE2-CB 4.49Å
446	E	71.5	Confident	72.1	Confident	165 Å²	165	51.8 Å²	51.8	77%	0.771	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-59.6	-34.4	175.7	-63.6	167.8	-150.5	0	0	112.4	P444 M448	P444-E446 PolarHBondContact O-N 3.27Å; E446-M448 VanDerWaalsContact C-N 3.34Å
447	D	76	Confident	72.7	Confident	65 Å²	65	47 Å²	47	35%	0.348	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-80.5	-14.6	-179.9	-66.2	-23.9	0	0	0	112.9	L443 P444 Y445 A449 G450 V451	L443-D447 HydrophobicContact CD1-CB 3.8Å; L443-D447 HydrophobicContact CG-CB 4.21Å; P444-D447 HydrophobicContact CB-CB 4.49Å; P444-D447 WeakPolarHBondContact CD-OD2 3.34Å; P444-D447 WeakPolarHBondContact CG-OD2 3.41Å; P444-D447 PolarHBondContact O-N 3.02Å; Y445-D447 PolarHBondContact O-N 3.31Å; D447-A449 PolarHBondContact O-N 3.18Å; D447-A449 VanDerWaalsContact O-N 3.14Å; D447-G450 PolarHBondContact O-N 3.46Å; D447-V451 WeakPolarHBondContact O-CG2 3.43Å; D447-V451 PolarHBondContact O-N 3.16Å
448	M	74.3	Confident	73.1	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.015	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-58.3	-31.6	-173.8	-71.4	-78.7	-67.4	0	0	112.9	A385 L443 P444 Y445 E446 G450 V451 W486 I490	A385-M448 HydrophobicContact CB-CE 4.07Å; L443-M448 HydrophobicContact CD2-CG 4.21Å; L443-M448 HydrophobicContact CD2-SD 3.49Å; L443-M448 WeakPolarHBondContact CD2-SD 3.22Å; L443-M448 HydrophobicContact CG-SD 4.27Å; P444-M448 PolarHBondContact O-N 3.05Å; Y445-M448 VanDerWaalsContact O-CB 3.26Å; Y445-M448 WeakPolarHBondContact O-CB 3.39Å; Y445-M448 WeakPolarHBondContact O-CG 3.47Å; Y445-M448 PolarHBondContact O-N 3.41Å; Y445-M448 VanDerWaalsContact O-N 3.15Å; E446-M448 VanDerWaalsContact C-N 3.34Å; M448-G450 VanDerWaalsContact C-N 3.34Å; M448-V451 PolarHBondContact O-N 3.47Å; M448-W486 HydrophobicContact CE-CZ2 4.34Å; M448-W486 PolarHBondContact O-NE1 3.26Å; M448-I490 HydrophobicContact CB-CD1 4.11Å; M448-I490 HydrophobicContact CB-CG1 4.15Å; M448-I490 HydrophobicContact CE-CG1 4.04Å
449	A	77.6	Confident	73.2	Confident	56 Å²	56	44.2 Å²	44.2	46%	0.463	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-70.6	-30.3	178.1	0	0	0	0	0	112.6	D447 V451 T476	D447-A449 PolarHBondContact O-N 3.18Å; D447-A449 VanDerWaalsContact O-N 3.14Å; A449-V451 VanDerWaalsContact C-N 3.34Å; A449-T476 HydrophobicContact CB-CG2 4.45Å; A449-T476 VanDerWaalsContact O-CG2 3.32Å; A449-T476 WeakPolarHBondContact O-CG2 3.04Å; A449-T476 PolarHBondContact O-OG1 3.38Å
450	G	77.1	Confident	73.2	Confident	43 Å²	43	48.2 Å²	48.2	44%	0.443	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-93.3	11.8	177.1	0	0	0	0	0	113.6	D447 M448	D447-G450 PolarHBondContact O-N 3.46Å; M448-G450 VanDerWaalsContact C-N 3.34Å
451	V	76.2	Confident	73.1	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.042	22%	0.221	C	C	.	.			trans	-111.2	131	-175.3	164.1	0	0	0	0	112.4	S414 L443 D447 M448 A449 W486	S414-V451 WeakPolarHBondContact OG-CG2 3.45Å; L443-V451 HydrophobicContact CD1-CG2 3.79Å; L443-V451 HydrophobicContact CD2-CB 3.85Å; L443-V451 HydrophobicContact CD2-CG1 3.78Å; L443-V451 HydrophobicContact CD2-CG2 3.5Å; L443-V451 VanDerWaalsContact CD2-CG2 3.5Å; L443-V451 HydrophobicContact CG-CG2 4.25Å; D447-V451 WeakPolarHBondContact O-CG2 3.43Å; D447-V451 PolarHBondContact O-N 3.16Å; M448-V451 PolarHBondContact O-N 3.47Å; A449-V451 VanDerWaalsContact C-N 3.34Å; V451-W486 HydrophobicContact CB-CZ2 4.3Å; V451-W486 HydrophobicContact CG1-CH2 4.2Å; V451-W486 HydrophobicContact CG1-CZ2 3.88Å; V451-W486 WeakPolarHBondContact O-CZ2 3.25Å; V451-W486 PolarHBondContact O-NE1 3.16Å
452	T	80.1	Confident	72.1	Confident	24 Å²	24	46.2 Å²	46.2	15%	0.147	25%	0.254	C	S	.	.			trans	-108	129.3	165.9	-54	0	0	0	0	110.3	S414 E473 L474 T478	S414-T452 PolarHBondContact N-O 2.72Å; T452-E473 HydrophobicContact CG2-CB 4.05Å; T452-L474 CarbonylContact C-O 3.25Å; T452-L474 WeakPolarHBondContact CA-O 3.39Å; T452-T478 HydrophobicContact CG2-CG2 4.44Å
453	L	79.8	Confident	71	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.063	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	108.2	169.8	179.3	66.6	0	0	0	109	L383 L411 F441 V455 E473 L474 W486	L383-L453 HydrophobicContact CD2-CD2 3.88Å; L411-L453 HydrophobicContact CD2-CD1 3.58Å; L411-L453 HydrophobicContact CD2-CG 4.22Å; F441-L453 HydrophobicContact CE2-CD1 4.27Å; L453-V455 HydrophobicContact CD2-CG2 4.4Å; L453-V455 HydrophobicContact CG-CG2 4.12Å; L453-E473 WeakPolarHBondContact O-CA 3.5Å; L453-L474 HydrophobicContact CB-CB 4.29Å; L453-L474 HydrophobicContact CD2-CD1 4.17Å; L453-L474 PolarHBondContact N-O 2.99Å; L453-L474 PolarHBondContact O-N 3.25Å; L453-W486 HydrophobicContact CB-CE3 4.49Å; L453-W486 HydrophobicContact CB-CH2 3.77Å; L453-W486 HydrophobicContact CB-CZ3 3.57Å; L453-W486 HydrophobicContact CD2-CZ3 3.93Å; L453-W486 HydrophobicContact CG-CZ3 4.39Å
454	C	80.1	Confident	70.4	Confident	15 Å²	15	51.9 Å²	51.9	10%	0.101	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.2	173.2	-178.2	0	0	0	0	109.7	L411 L412 L472 E473	L411-C454 CarbonylContact C-O 3.53Å; L411-C454 WeakPolarHBondContact CA-O 3.43Å; L412-C454 HydrophobicContact CB-CB 4.16Å; L412-C454 PolarHBondContact N-O 2.85Å; L412-C454 WeakPolarHBondContact O-CB 3.19Å; L412-C454 PolarHBondContact O-N 3.17Å; C454-L472 CarbonylContact C-O 3.5Å; C454-L472 WeakPolarHBondContact CA-O 3.45Å; C454-E473 HydrophobicContact CB-CG 4.21Å
455	V	77.6	Confident	70.1	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116.3	-179	-168.7	0	0	0	0	108.4	F379 L397 L409 L411 L453 S471 L472	F379-V455 HydrophobicContact CE1-CB 4.28Å; F379-V455 HydrophobicContact CE1-CG1 3.85Å; F379-V455 HydrophobicContact CE2-CG1 4.3Å; F379-V455 HydrophobicContact CZ-CB 4.29Å; F379-V455 HydrophobicContact CZ-CG1 3.4Å; L397-V455 HydrophobicContact CD1-CG1 4.34Å; L409-V455 HydrophobicContact CD1-CG1 3.46Å; L409-V455 VanDerWaalsContact CD1-CG1 3.46Å; L409-V455 HydrophobicContact CD2-CG1 3.9Å; L409-V455 HydrophobicContact CG-CG1 3.69Å; L411-V455 HydrophobicContact CD2-CG1 4.45Å; L411-V455 HydrophobicContact CD2-CG2 3.87Å; L453-V455 HydrophobicContact CD2-CG2 4.4Å; L453-V455 HydrophobicContact CG-CG2 4.12Å; V455-S471 CarbonylContact O-C 3.59Å; V455-S471 WeakPolarHBondContact O-CA 3.06Å; V455-L472 HydrophobicContact CB-CB 4.37Å; V455-L472 PolarHBondContact N-O 2.84Å; V455-L472 PolarHBondContact O-N 3.32Å
456	Q	75.4	Confident	70	Confident	33 Å²	33	57.2 Å²	57.2	15%	0.154	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.7	-178.7	-59.4	-179.1	-22.4	0	0	110.4	L409 R410 L412 W458 F468	L409-Q456 CarbonylContact C-O 3.42Å; L409-Q456 VanDerWaalsContact CA-O 3.25Å; L409-Q456 WeakPolarHBondContact CA-O 3.5Å; R410-Q456 HydrophobicContact CB-CB 4.35Å; R410-Q456 PolarHBondContact N-O 3.34Å; R410-Q456 WeakPolarHBondContact O-CB 3.49Å; R410-Q456 PolarHBondContact O-N 2.67Å; L412-Q456 VanDerWaalsContact CD1-CD 3.49Å; L412-Q456 HydrophobicContact CD1-CG 4.41Å; L412-Q456 VanDerWaalsContact CD1-NE2 3.28Å; Q456-W458 VanDerWaalsContact CB-NE1 3.29Å; Q456-W458 VanDerWaalsContact OE1-NE1 3.11Å; Q456-F468 HydrophobicContact CB-CE2 4.13Å; Q456-F468 HydrophobicContact CG-CE2 4.29Å
457	V	74.4	Confident	69.6	Low	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.7	174.8	-178.8	0	0	0	0	108.4	F379 Y399 I401 P407 I469 G470 L503	F379-V457 HydrophobicContact CD2-CG2 4.33Å; F379-V457 HydrophobicContact CE2-CG2 4.02Å; Y399-V457 HydrophobicContact CE2-CB 4.3Å; Y399-V457 HydrophobicContact CE2-CG1 3.57Å; Y399-V457 HydrophobicContact CE2-CG2 3.67Å; I401-V457 HydrophobicContact CD1-CG1 4.28Å; P407-V457 HydrophobicContact CB-CG1 4.36Å; V457-I469 HydrophobicContact CB-CB 4.21Å; V457-I469 HydrophobicContact CG1-CB 3.92Å; V457-I469 HydrophobicContact CG1-CD1 3.79Å; V457-I469 HydrophobicContact CG1-CG1 4.4Å; V457-I469 HydrophobicContact CG1-CG2 4.14Å; V457-I469 WeakPolarHBondContact O-CB 3.39Å; V457-I469 PolarHBondContact O-N 2.91Å; V457-G470 PolarHBondContact N-O 2.71Å; V457-G470 PolarHBondContact O-N 2.86Å; V457-L503 HydrophobicContact CB-CD1 4.01Å; V457-L503 HydrophobicContact CG2-CD1 3.68Å; V457-L503 HydrophobicContact CG2-CD2 4.15Å
458	W	73.4	Confident	69.3	Low	55 Å²	55	53.7 Å²	53.7	21%	0.208	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.7	-175.9	-66.4	82.6	0	0	0	109.5	P407 F408 Q456 D466 D467 F468	P407-W458 CarbonylContact C-O 3.6Å; P407-W458 VanDerWaalsContact CA-O 3.26Å; P407-W458 WeakPolarHBondContact CA-O 3.35Å; F408-W458 HydrophobicContact CD1-CB 3.74Å; F408-W458 WeakPolarHBondContact CD1-O 3Å; F408-W458 HydrophobicContact CD2-CB 4.28Å; F408-W458 HydrophobicContact CE1-CB 3.24Å; F408-W458 HydrophobicContact CE1-CG 4.19Å; F408-W458 HydrophobicContact CE2-CB 3.81Å; F408-W458 HydrophobicContact CE2-CG 4.01Å; F408-W458 HydrophobicContact CG-CB 4.26Å; F408-W458 HydrophobicContact CZ-CB 3.28Å; F408-W458 HydrophobicContact CZ-CD2 4.43Å; F408-W458 AromaticContact CZ-CG 3.73Å; F408-W458 HydrophobicContact CZ-CG 3.73Å; F408-W458 PolarHBondContact N-O 2.91Å; F408-W458 PolarHBondContact O-N 3.44Å; Q456-W458 VanDerWaalsContact CB-NE1 3.29Å; Q456-W458 VanDerWaalsContact OE1-NE1 3.11Å; W458-D466 HydrophobicContact CE3-CB 3.99Å; W458-D467 CarbonylContact C-O 3.56Å; W458-D467 WeakPolarHBondContact CA-O 3.36Å; W458-F468 HydrophobicContact CD2-CD2 4.14Å; W458-F468 AromaticContact CE2-CD2 3.81Å; W458-F468 HydrophobicContact CE3-CB 4.02Å; W458-F468 HydrophobicContact CE3-CD2 4.46Å; W458-F468 HydrophobicContact CH2-CB 4.11Å; W458-F468 HydrophobicContact CH2-CD2 4.18Å; W458-F468 AromaticContact CZ2-CD2 3.84Å; W458-F468 HydrophobicContact CZ2-CD2 3.84Å; W458-F468 HydrophobicContact CZ3-CB 3.81Å; W458-F468 HydrophobicContact CZ3-CD2 4.48Å
459	D	66.8	Low	68.9	Low	16 Å²	16	54.1 Å²	54.1	9%	0.086	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.7	168.1	-169.3	9.8	0	0	0	109.2	G405 P406 D461 D466 D467 I469	G405-D459 WeakPolarHBondContact CA-OD1 3.45Å; G405-D459 WeakPolarHBondContact CA-OD2 3.46Å; P406-D459 WeakPolarHBondContact CD-OD1 3.28Å; D459-D461 PolarHBondContact O-N 3.09Å; D459-D466 CarbonylContact O-C 3.4Å; D459-D466 VanDerWaalsContact O-CA 3.28Å; D459-D466 WeakPolarHBondContact O-CA 3.21Å; D459-D466 WeakPolarHBondContact O-CB 3.45Å; D459-D467 HydrophobicContact CB-CB 4.1Å; D459-D467 PolarHBondContact N-O 3.03Å; D459-D467 PolarHBondContact O-N 3.06Å; D459-I469 HydrophobicContact CB-CD1 3.86Å; D459-I469 HydrophobicContact CB-CG1 4.11Å
460	K	67.5	Low	68.6	Low	100 Å²	100	51.4 Å²	51.4	44%	0.435	29%	0.286	S	S	.	.			trans	-83.3	104.9	179.4	-170.8	170.9	-174.4	175.3	0	110.8	P406 F408 V426 D466	P406-K460 HydrophobicContact CB-CB 4.39Å; P406-K460 WeakPolarHBondContact CD-O 3.24Å; P406-K460 WeakPolarHBondContact CG-O 3.43Å; P406-K460 PolarHBondContact O-N 2.84Å; F408-K460 HydrophobicContact CD1-CB 3.7Å; F408-K460 HydrophobicContact CE1-CB 3.8Å; F408-K460 HydrophobicContact CE1-CG 4.4Å; V426-K460 HydrophobicContact CB-CD 4.24Å; V426-K460 HydrophobicContact CG1-CB 3.87Å; V426-K460 HydrophobicContact CG1-CD 3.98Å; V426-K460 HydrophobicContact CG1-CG 4.48Å; V426-K460 HydrophobicContact CG2-CB 4.3Å; V426-K460 HydrophobicContact CG2-CD 3.39Å; V426-K460 HydrophobicContact CG2-CG 4.47Å; K460-D466 WeakPolarHBondContact CA-OD1 3.33Å
461	D	62.5	Low	68.7	Low	19 Å²	19	50.2 Å²	50.2	10%	0.102	27%	0.271	C	S	.	.			trans	-86	145.3	175.6	-79.5	-33.6	0	0	0	112.5	F120 D459 K464 D466	F120-D461 WeakPolarHBondContact CE2-OD1 3.23Å; F120-D461 VanDerWaalsContact CZ-OD1 3.23Å; F120-D461 WeakPolarHBondContact CZ-OD1 3.46Å; D459-D461 PolarHBondContact O-N 3.09Å; D461-K464 HydrophobicContact CB-CB 4.07Å; D461-D466 PolarHBondContact N-OD1 3.49Å
462	V	48.9	Very low	68.9	Low	133 Å²	133	50 Å²	50	81%	0.806	27%	0.269	S	S	*	.	S	Bend	trans	-89.8	113.7	173.7	-178.4	0	0	0	0	108.6
463	G	45.7	Very low	69.2	Low	83 Å²	83	53.8 Å²	53.8	86%	0.856	29%	0.285	S	S	*	.	S	Bend	trans	80.7	12.4	174.6	0	0	0	0	0	115.2
464	K	56.1	Low	69.4	Low	136 Å²	136	53.2 Å²	53.2	59%	0.591	28%	0.282	S	S	*	.	S	Bend	trans	-133.9	170.2	170.4	-66.2	-177.2	-179.8	178.6	0	109.5	D461	D461-K464 HydrophobicContact CB-CB 4.07Å
465	H	60.5	Low	69.6	Low	177 Å²	177	52.5 Å²	52.5	82%	0.819	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-64	141.7	169.1	-71.1	-72.4	0	0	0	109.9	D467	H465-D467 PolarHBondContact O-N 2.84Å
466	D	67.8	Low	70	Confident	59 Å²	59	55 Å²	55	32%	0.316	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-61.3	131.2	176.4	-62.7	-24.1	0	0	0	110.2	F408 W458 D459 K460 D461	F408-D466 HydrophobicContact CE1-CB 4.2Å; F408-D466 WeakPolarHBondContact CE1-OD2 3.18Å; F408-D466 HydrophobicContact CZ-CB 4.38Å; F408-D466 VanDerWaalsContact CZ-OD2 3.32Å; F408-D466 WeakPolarHBondContact CZ-OD2 3.44Å; W458-D466 HydrophobicContact CE3-CB 3.99Å; D459-D466 CarbonylContact O-C 3.4Å; D459-D466 VanDerWaalsContact O-CA 3.28Å; D459-D466 WeakPolarHBondContact O-CA 3.21Å; D459-D466 WeakPolarHBondContact O-CB 3.45Å; K460-D466 WeakPolarHBondContact CA-OD1 3.33Å; D461-D466 PolarHBondContact N-OD1 3.49Å
467	D	64.1	Low	70.4	Confident	87 Å²	87	58.4 Å²	58.4	47%	0.465	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124	179.4	-87.2	-18.5	0	0	0	109.9	W458 D459 H465 I469	W458-D467 CarbonylContact C-O 3.56Å; W458-D467 WeakPolarHBondContact CA-O 3.36Å; D459-D467 HydrophobicContact CB-CB 4.1Å; D459-D467 PolarHBondContact N-O 3.03Å; D459-D467 PolarHBondContact O-N 3.06Å; H465-D467 PolarHBondContact O-N 2.84Å; D467-I469 PolarHBondContact O-N 2.84Å
468	F	70.7	Confident	71	Confident	70 Å²	70	59.2 Å²	59.2	31%	0.307	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.2	175.5	176.9	-110.4	0	0	0	110.5	Q456 W458 G470 V505	Q456-F468 HydrophobicContact CB-CE2 4.13Å; Q456-F468 HydrophobicContact CG-CE2 4.29Å; W458-F468 HydrophobicContact CD2-CD2 4.14Å; W458-F468 AromaticContact CE2-CD2 3.81Å; W458-F468 HydrophobicContact CE3-CB 4.02Å; W458-F468 HydrophobicContact CE3-CD2 4.46Å; W458-F468 HydrophobicContact CH2-CB 4.11Å; W458-F468 HydrophobicContact CH2-CD2 4.18Å; W458-F468 AromaticContact CZ2-CD2 3.84Å; W458-F468 HydrophobicContact CZ2-CD2 3.84Å; W458-F468 HydrophobicContact CZ3-CB 3.81Å; W458-F468 HydrophobicContact CZ3-CD2 4.48Å; F468-G470 VanDerWaalsContact CE2-C 3.47Å; F468-G470 WeakPolarHBondContact CE2-O 3.5Å; F468-G470 VanDerWaalsContact CZ-CA 3.41Å; F468-V505 HydrophobicContact CE1-CG1 4.41Å
469	I	65.7	Low	71.6	Confident	11 Å²	11	67.3 Å²	67.3	6%	0.056	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-41.3	179.9	-65.3	169.8	0	0	0	110.9	F373 I401 V457 D459 D467 V505	F373-I469 HydrophobicContact CB-CG2 4.15Å; F373-I469 HydrophobicContact CD1-CG2 3.78Å; F373-I469 HydrophobicContact CE1-CG2 4.48Å; F373-I469 HydrophobicContact CG-CG2 4.18Å; I401-I469 HydrophobicContact CG2-CD1 4.48Å; I401-I469 HydrophobicContact CG2-CG2 4.19Å; V457-I469 HydrophobicContact CB-CB 4.21Å; V457-I469 HydrophobicContact CG1-CB 3.92Å; V457-I469 HydrophobicContact CG1-CD1 3.79Å; V457-I469 HydrophobicContact CG1-CG1 4.4Å; V457-I469 HydrophobicContact CG1-CG2 4.14Å; V457-I469 WeakPolarHBondContact O-CB 3.39Å; V457-I469 PolarHBondContact O-N 2.91Å; D459-I469 HydrophobicContact CB-CD1 3.86Å; D459-I469 HydrophobicContact CB-CG1 4.11Å; D467-I469 PolarHBondContact O-N 2.84Å; I469-V505 WeakPolarHBondContact O-CG2 3.23Å
470	G	70.7	Confident	72.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	167.7	-179.1	0	0	0	0	0	113.2	V457 F468 T504	V457-G470 PolarHBondContact N-O 2.71Å; V457-G470 PolarHBondContact O-N 2.86Å; F468-G470 VanDerWaalsContact CE2-C 3.47Å; F468-G470 WeakPolarHBondContact CE2-O 3.5Å; F468-G470 VanDerWaalsContact CZ-CA 3.41Å; G470-T504 CarbonylContact C-O 3.45Å; G470-T504 VanDerWaalsContact CA-O 3.28Å; G470-T504 WeakPolarHBondContact CA-O 3.49Å
471	S	78.8	Confident	73.5	Confident	18 Å²	18	68.3 Å²	68.3	13%	0.126	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	165.1	-179.7	62.2	0	0	0	0	112.8	V455 L503 T504	V455-S471 CarbonylContact O-C 3.59Å; V455-S471 WeakPolarHBondContact O-CA 3.06Å; S471-L503 WeakPolarHBondContact O-CA 3.04Å; S471-T504 PolarHBondContact N-O 3.43Å; S471-T504 PolarHBondContact O-N 3.13Å; S471-T504 PolarHBondContact O-OG1 3.12Å
472	L	80.8	Confident	74.7	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.7	171.3	173.3	69.8	0	0	0	108.2	F379 V381 C454 V455 L474 C482 H501 L503	F379-L472 HydrophobicContact CD1-CD2 3.53Å; F379-L472 HydrophobicContact CE1-CD2 3.72Å; V381-L472 HydrophobicContact CG2-CD2 3.63Å; C454-L472 CarbonylContact C-O 3.5Å; C454-L472 WeakPolarHBondContact CA-O 3.45Å; V455-L472 HydrophobicContact CB-CB 4.37Å; V455-L472 PolarHBondContact N-O 2.84Å; V455-L472 PolarHBondContact O-N 3.32Å; L472-L474 HydrophobicContact CD2-CD1 4.17Å; L472-L474 HydrophobicContact CD2-CD2 4.36Å; L472-L474 HydrophobicContact CD2-CG 4.19Å; L472-L474 HydrophobicContact CG-CG 4.25Å; L472-C482 WeakPolarHBondContact CD1-SG 3.29Å; L472-H501 HydrophobicContact CD1-CB 3.73Å; L472-H501 HydrophobicContact CD2-CB 3.63Å; L472-H501 HydrophobicContact CG-CB 4.34Å; L472-L503 HydrophobicContact CB-CD2 4.11Å
473	E	85.2	Confident	76.6	Confident	102 Å²	102	65.4 Å²	65.4	48%	0.477	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.6	172	-64.9	-176.5	173.4	0	0	110.1	T452 L453 C454 T478 C482	T452-E473 HydrophobicContact CG2-CB 4.05Å; L453-E473 WeakPolarHBondContact O-CA 3.5Å; C454-E473 HydrophobicContact CB-CG 4.21Å; E473-T478 HydrophobicContact CB-CG2 3.91Å; E473-C482 VanDerWaalsContact O-CB 3.27Å; E473-C482 WeakPolarHBondContact O-CB 3.14Å
474	L	84	Confident	78.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120	176.2	-62.5	163.1	0	0	0	108.4	V381 L383 T452 L453 L472 C482 H485 W486	V381-L474 HydrophobicContact CB-CD1 4.26Å; V381-L474 HydrophobicContact CG1-CD1 3.7Å; V381-L474 HydrophobicContact CG2-CD1 4.16Å; L383-L474 HydrophobicContact CD1-CD1 4.38Å; L383-L474 HydrophobicContact CD2-CD1 4.22Å; T452-L474 CarbonylContact C-O 3.25Å; T452-L474 WeakPolarHBondContact CA-O 3.39Å; L453-L474 HydrophobicContact CB-CB 4.29Å; L453-L474 HydrophobicContact CD2-CD1 4.17Å; L453-L474 PolarHBondContact N-O 2.99Å; L453-L474 PolarHBondContact O-N 3.25Å; L472-L474 HydrophobicContact CD2-CD1 4.17Å; L472-L474 HydrophobicContact CD2-CD2 4.36Å; L472-L474 HydrophobicContact CD2-CG 4.19Å; L472-L474 HydrophobicContact CG-CG 4.25Å; L474-C482 HydrophobicContact CD2-CB 3.89Å; L474-C482 WeakPolarHBondContact CD2-O 3.44Å; L474-H485 HydrophobicContact CD2-CB 4.23Å; L474-W486 HydrophobicContact CB-CD2 4.34Å; L474-W486 HydrophobicContact CB-CE3 3.61Å; L474-W486 HydrophobicContact CB-CZ3 4.15Å
475	G	86	Confident	80.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	S	Bend	trans	-177.2	167.2	-175.5	0	0	0	0	0	110.6	T477 T478	G475-T477 PolarHBondContact O-N 3.26Å; G475-T478 PolarHBondContact N-OG1 3.5Å; G475-T478 PolarHBondContact O-N 3.09Å; G475-T478 PolarHBondContact O-OG1 3.43Å
476	T	84.9	Confident	81.5	Confident	53 Å²	53	51.6 Å²	51.6	33%	0.325	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.9	175.1	53.6	0	0	0	0	112.5	A449 I490	A449-T476 HydrophobicContact CB-CG2 4.45Å; A449-T476 VanDerWaalsContact O-CG2 3.32Å; A449-T476 WeakPolarHBondContact O-CG2 3.04Å; A449-T476 PolarHBondContact O-OG1 3.38Å; T476-I490 HydrophobicContact CG2-CD1 4.48Å
477	T	84.1	Confident	82.4	Confident	104 Å²	104	51.6 Å²	51.6	64%	0.638	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-6.2	177.9	57.2	0	0	0	0	114	G475	G475-T477 PolarHBondContact O-N 3.26Å
478	T	86.7	Confident	83.5	Confident	17 Å²	17	50.5 Å²	50.5	10%	0.104	25%	0.254	C	S	.	.	S	Bend	trans	-80.3	173.6	-179.8	67.8	0	0	0	0	111.6	T452 E473 G475 M483	T452-T478 HydrophobicContact CG2-CG2 4.44Å; E473-T478 HydrophobicContact CB-CG2 3.91Å; G475-T478 PolarHBondContact N-OG1 3.5Å; G475-T478 PolarHBondContact O-N 3.09Å; G475-T478 PolarHBondContact O-OG1 3.43Å; T478-M483 WeakPolarHBondContact O-CB 3.44Å; T478-M483 VanDerWaalsContact OG1-CA 3.32Å; T478-M483 WeakPolarHBondContact OG1-CA 3.31Å; T478-M483 PolarHBondContact OG1-N 2.78Å; T478-M483 VanDerWaalsContact OG1-N 3.12Å
479	R	85.7	Confident	84.1	Confident	226 Å²	226	47.2 Å²	47.2	85%	0.853	24%	0.239	S	C	*	.			trans	-114.8	157.8	-178.7	-64.7	-176.8	-179.6	179.1	0.2	112.3
480	G	88.8	Confident	84.9	Confident	42 Å²	42	48 Å²	48	43%	0.433	24%	0.244	S	C	.	.	H	α-helix	trans	62.6	-134.5	168.7	0	0	0	0	0	114	C482 M483 K484	G480-C482 VanDerWaalsContact C-N 3.29Å; G480-C482 PolarHBondContact O-N 3.4Å; G480-M483 PolarHBondContact O-N 3.13Å; G480-K484 WeakPolarHBondContact O-CG 3.32Å; G480-K484 PolarHBondContact O-N 2.97Å
481	E	86.1	Confident	85.5	Confident	94 Å²	94	54.6 Å²	54.6	44%	0.439	27%	0.274	S	S	.	.	H	α-helix	trans	-67	-28	-174.5	-68.3	-56	124.5	0	0	113.6	K484 H485 R499	E481-K484 WeakPolarHBondContact OE1-CD 3.41Å; E481-K484 IonicContact OE1-NZ 3.71Å; E481-K484 PolarHBondContact OE1-NZ 2.87Å; E481-H485 WeakPolarHBondContact O-CB 3.42Å; E481-H485 PolarHBondContact O-N 3.38Å; E481-R499 IonicContact OE2-NH1 3.81Å; E481-R499 PolarHBondContact OE2-NH1 2.97Å
482	C	87.1	Confident	85.6	Confident	26 Å²	26	55.7 Å²	55.7	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-48.9	176.4	-60.2	0	0	0	0	111.8	L472 E473 L474 G480 H485 W486	L472-C482 WeakPolarHBondContact CD1-SG 3.29Å; E473-C482 VanDerWaalsContact O-CB 3.27Å; E473-C482 WeakPolarHBondContact O-CB 3.14Å; L474-C482 HydrophobicContact CD2-CB 3.89Å; L474-C482 WeakPolarHBondContact CD2-O 3.44Å; G480-C482 VanDerWaalsContact C-N 3.29Å; G480-C482 PolarHBondContact O-N 3.4Å; C482-H485 WeakPolarHBondContact O-CB 3.41Å; C482-H485 PolarHBondContact O-N 2.85Å; C482-W486 PolarHBondContact O-N 2.76Å
483	M	89.4	Confident	85.4	Confident	65 Å²	65	57.7 Å²	57.7	32%	0.32	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-47.2	178.5	-175.6	-176.8	65.1	0	0	111.1	T478 G480 H485 W486 I487	T478-M483 WeakPolarHBondContact O-CB 3.44Å; T478-M483 VanDerWaalsContact OG1-CA 3.32Å; T478-M483 WeakPolarHBondContact OG1-CA 3.31Å; T478-M483 PolarHBondContact OG1-N 2.78Å; T478-M483 VanDerWaalsContact OG1-N 3.12Å; G480-M483 PolarHBondContact O-N 3.13Å; M483-H485 VanDerWaalsContact C-N 3.26Å; M483-H485 PolarHBondContact O-N 2.84Å; M483-W486 PolarHBondContact O-N 3.38Å; M483-I487 HydrophobicContact CG-CD1 3.73Å; M483-I487 HydrophobicContact CG-CG1 4.39Å; M483-I487 WeakPolarHBondContact O-CB 3.31Å; M483-I487 WeakPolarHBondContact O-CG1 3.3Å; M483-I487 PolarHBondContact O-N 3.38Å; M483-I487 HydrophobicContact SD-CD1 4.4Å
484	K	89.8	Confident	84.7	Confident	104 Å²	104	57.6 Å²	57.6	45%	0.452	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-38.9	177.1	-67.1	177.7	-169.5	169.5	0	111.9	G480 E481 E488	G480-K484 WeakPolarHBondContact O-CG 3.32Å; G480-K484 PolarHBondContact O-N 2.97Å; E481-K484 WeakPolarHBondContact OE1-CD 3.41Å; E481-K484 IonicContact OE1-NZ 3.71Å; E481-K484 PolarHBondContact OE1-NZ 2.87Å; K484-E488 VanDerWaalsContact O-CB 3.3Å; K484-E488 WeakPolarHBondContact O-CB 3.35Å; K484-E488 PolarHBondContact O-N 2.78Å
485	H	87.7	Confident	84.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-43	177.3	-166.1	-155.7	0	0	0	112.2	V381 L474 E481 C482 M483 C489 V497 R499 H501	V381-H485 PolarHBondContact O-CE1 3.3Å; L474-H485 HydrophobicContact CD2-CB 4.23Å; E481-H485 WeakPolarHBondContact O-CB 3.42Å; E481-H485 PolarHBondContact O-N 3.38Å; C482-H485 WeakPolarHBondContact O-CB 3.41Å; C482-H485 PolarHBondContact O-N 2.85Å; M483-H485 VanDerWaalsContact C-N 3.26Å; M483-H485 PolarHBondContact O-N 2.84Å; H485-C489 PolarHBondContact O-N 3.31Å; H485-C489 VanDerWaalsContact O-N 3.16Å; H485-V497 VanDerWaalsContact CD2-CG1 3.47Å; H485-V497 WeakPolarHBondContact CD2-CG1 3.3Å; H485-V497 PolarHBondContact NE2-O 3.18Å; H485-R499 HydrophobicContact CB-CB 4.49Å; H485-R499 HydrophobicContact CB-CG 4.44Å; H485-R499 VanDerWaalsContact CD2-CG 3.44Å; H485-R499 WeakPolarHBondContact CD2-CG 3.13Å; H485-R499 PolarHBondContact NE2-N 3.42Å; H485-H501 AromaticContact CE1-NE2 3.81Å; H485-H501 AromaticContact CG-NE2 3.58Å; H485-H501 AromaticContact ND1-CD2 3.94Å; H485-H501 AromaticContact ND1-CE1 3.83Å; H485-H501 AromaticContact ND1-NE2 2.97Å; H485-H501 PolarHBondContact ND1-NE2 3.46Å
486	W	86.7	Confident	83.8	Confident	3 Å²	3	68.4 Å²	68.4	1%	0.011	35%	0.345	C	S	.	.	H	α-helix	trans	-65.1	-48.1	178.2	-166.2	-105.3	0	0	0	111.7	L383 M448 V451 L453 L474 C482 M483 E488 C489 I490	L383-W486 HydrophobicContact CD1-CE3 3.86Å; L383-W486 HydrophobicContact CD1-CZ3 4.31Å; L383-W486 HydrophobicContact CD2-CZ3 4.38Å; M448-W486 HydrophobicContact CE-CZ2 4.34Å; M448-W486 PolarHBondContact O-NE1 3.26Å; V451-W486 HydrophobicContact CB-CZ2 4.3Å; V451-W486 HydrophobicContact CG1-CH2 4.2Å; V451-W486 HydrophobicContact CG1-CZ2 3.88Å; V451-W486 WeakPolarHBondContact O-CZ2 3.25Å; V451-W486 PolarHBondContact O-NE1 3.16Å; L453-W486 HydrophobicContact CB-CE3 4.49Å; L453-W486 HydrophobicContact CB-CH2 3.77Å; L453-W486 HydrophobicContact CB-CZ3 3.57Å; L453-W486 HydrophobicContact CD2-CZ3 3.93Å; L453-W486 HydrophobicContact CG-CZ3 4.39Å; L474-W486 HydrophobicContact CB-CD2 4.34Å; L474-W486 HydrophobicContact CB-CE3 3.61Å; L474-W486 HydrophobicContact CB-CZ3 4.15Å; C482-W486 PolarHBondContact O-N 2.76Å; M483-W486 PolarHBondContact O-N 3.38Å; W486-E488 PolarHBondContact O-N 3.31Å; W486-C489 WeakPolarHBondContact O-CB 3.5Å; W486-C489 PolarHBondContact O-N 2.96Å; W486-I490 PolarHBondContact O-N 3.4Å
487	I	87.3	Confident	83.4	Confident	59 Å²	59	66.2 Å²	66.2	30%	0.303	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-45.2	177.6	-68.4	171.8	0	0	0	110.9	M483 C489 I490 Q491	M483-I487 HydrophobicContact CG-CD1 3.73Å; M483-I487 HydrophobicContact CG-CG1 4.39Å; M483-I487 WeakPolarHBondContact O-CB 3.31Å; M483-I487 WeakPolarHBondContact O-CG1 3.3Å; M483-I487 PolarHBondContact O-N 3.38Å; M483-I487 HydrophobicContact SD-CD1 4.4Å; I487-C489 VanDerWaalsContact C-N 3.28Å; I487-C489 PolarHBondContact O-N 3.17Å; I487-I490 PolarHBondContact O-N 2.81Å; I487-I490 VanDerWaalsContact O-N 3.15Å; I487-Q491 VanDerWaalsContact CG2-CD 3.46Å; I487-Q491 HydrophobicContact CG2-CG 4.05Å; I487-Q491 WeakPolarHBondContact O-CB 3.43Å; I487-Q491 VanDerWaalsContact O-CG 3.32Å; I487-Q491 WeakPolarHBondContact O-CG 3.47Å; I487-Q491 PolarHBondContact O-N 2.64Å
488	E	86.8	Confident	83.1	Confident	64 Å²	64	67.7 Å²	67.7	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-38.9	178.2	-173.4	-176.5	180	0	0	111.9	K484 W486 N492 V497 R499	K484-E488 VanDerWaalsContact O-CB 3.3Å; K484-E488 WeakPolarHBondContact O-CB 3.35Å; K484-E488 PolarHBondContact O-N 2.78Å; W486-E488 PolarHBondContact O-N 3.31Å; E488-N492 WeakPolarHBondContact O-CB 3.32Å; E488-N492 PolarHBondContact O-N 3.34Å; E488-N492 PolarHBondContact O-ND2 2.99Å; E488-V497 HydrophobicContact CB-CG1 4.18Å; E488-V497 HydrophobicContact CG-CG1 3.79Å; E488-V497 HydrophobicContact CG-CG2 3.99Å; E488-V497 VanDerWaalsContact OE2-CG1 3.26Å; E488-V497 WeakPolarHBondContact OE2-CG1 3.45Å; E488-R499 IonicContact OE2-CZ 3.15Å; E488-R499 IonicContact OE2-NE 2.74Å; E488-R499 PolarHBondContact OE2-NE 3.37Å; E488-R499 IonicContact OE2-NH2 3.62Å; E488-R499 PolarHBondContact OE2-NH2 2.83Å
489	C	83.4	Confident	82.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-65.5	-39.7	175.5	-177.2	0	0	0	0	112.6	L383 H485 W486 I487 V497	L383-C489 HydrophobicContact CB-CB 3.83Å; L383-C489 WeakPolarHBondContact CB-SG 3.5Å; L383-C489 HydrophobicContact CD1-CB 3.88Å; H485-C489 PolarHBondContact O-N 3.31Å; H485-C489 VanDerWaalsContact O-N 3.16Å; W486-C489 WeakPolarHBondContact O-CB 3.5Å; W486-C489 PolarHBondContact O-N 2.96Å; I487-C489 VanDerWaalsContact C-N 3.28Å; I487-C489 PolarHBondContact O-N 3.17Å; C489-V497 HydrophobicContact CB-CG2 4.46Å
490	I	82	Confident	81.9	Confident	28 Å²	28	63.6 Å²	63.6	14%	0.144	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-49.5	176.4	-65.7	171.3	0	0	0	109.6	Y445 M448 T476 W486 I487 N492	Y445-I490 HydrophobicContact CE2-CG2 4.35Å; Y445-I490 PolarHBondContact OH-O 2.95Å; M448-I490 HydrophobicContact CB-CD1 4.11Å; M448-I490 HydrophobicContact CB-CG1 4.15Å; M448-I490 HydrophobicContact CE-CG1 4.04Å; T476-I490 HydrophobicContact CG2-CD1 4.48Å; W486-I490 PolarHBondContact O-N 3.4Å; I487-I490 PolarHBondContact O-N 2.81Å; I487-I490 VanDerWaalsContact O-N 3.15Å; I490-N492 PolarHBondContact O-N 2.95Å
491	Q	84.8	Confident	81.1	Confident	138 Å²	138	62.1 Å²	62.1	65%	0.645	29%	0.294	S	S	*	.	H	α-helix	trans	-65.5	-22.6	-176.7	-71.9	177	-20.4	0	0	113.9	I487 P493	I487-Q491 VanDerWaalsContact CG2-CD 3.46Å; I487-Q491 HydrophobicContact CG2-CG 4.05Å; I487-Q491 WeakPolarHBondContact O-CB 3.43Å; I487-Q491 VanDerWaalsContact O-CG 3.32Å; I487-Q491 WeakPolarHBondContact O-CG 3.47Å; I487-Q491 PolarHBondContact O-N 2.64Å; Q491-P493 VanDerWaalsContact O-CD 3.25Å; Q491-P493 WeakPolarHBondContact O-CD 3.47Å
492	N	81.4	Confident	80.2	Confident	42 Å²	42	64.3 Å²	64.3	23%	0.225	30%	0.298	C	S	.	.	S	Bend	trans	-117.8	68.5	-179.3	-66.6	-88	0	0	0	111.4	E488 I490 K495	E488-N492 WeakPolarHBondContact O-CB 3.32Å; E488-N492 PolarHBondContact O-N 3.34Å; E488-N492 PolarHBondContact O-ND2 2.99Å; I490-N492 PolarHBondContact O-N 2.95Å; N492-K495 HydrophobicContact CB-CB 3.93Å; N492-K495 HydrophobicContact CB-CD 3.92Å; N492-K495 HydrophobicContact CB-CG 4.07Å; N492-K495 WeakPolarHBondContact O-CB 3.4Å; N492-K495 PolarHBondContact O-N 2.97Å; N492-K495 VanDerWaalsContact O-N 3.11Å; N492-K495 PolarHBondContact OD1-NZ 3.3Å
493	P	74.8	Confident	79.4	Confident	45 Å²	45	63.4 Å²	63.4	29%	0.292	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	145.5	177.4	27.2	-34.3	0	0	0	110.5	A385 Y445 Q491 K495	A385-P493 CarbonylContact O-C 3.54Å; A385-P493 WeakPolarHBondContact O-CA 3.14Å; Y445-P493 HydrophobicContact CE2-CB 4.49Å; Q491-P493 VanDerWaalsContact O-CD 3.25Å; Q491-P493 WeakPolarHBondContact O-CD 3.47Å; P493-K495 PolarHBondContact O-N 2.98Å; P493-K495 VanDerWaalsContact O-N 3.16Å
494	N	72	Confident	78.5	Confident	99 Å²	99	64.4 Å²	64.4	53%	0.529	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	6.7	-174	-51.6	-62	0	0	0	115.6	A385 G386 R387	A385-N494 PolarHBondContact O-N 3.23Å; G386-N494 WeakPolarHBondContact CA-OD1 3.5Å; R387-N494 PolarHBondContact N-OD1 3.05Å
495	K	78.4	Confident	77.4	Confident	125 Å²	125	65.5 Å²	65.5	54%	0.543	32%	0.317	S	S	.	.			trans	-100.3	142.7	169.3	-58.1	-165.2	-166.8	156.9	0	110.7	N492 P493	N492-K495 HydrophobicContact CB-CB 3.93Å; N492-K495 HydrophobicContact CB-CD 3.92Å; N492-K495 HydrophobicContact CB-CG 4.07Å; N492-K495 WeakPolarHBondContact O-CB 3.4Å; N492-K495 PolarHBondContact O-N 2.97Å; N492-K495 VanDerWaalsContact O-N 3.11Å; N492-K495 PolarHBondContact OD1-NZ 3.3Å; P493-K495 PolarHBondContact O-N 2.98Å; P493-K495 VanDerWaalsContact O-N 3.16Å
496	I	73	Confident	76.9	Confident	102 Å²	102	68.8 Å²	68.8	52%	0.523	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	112.9	173.3	-61.1	176.5	0	0	0	107.8	I382 N384 K498	I382-I496 HydrophobicContact CG2-CG2 3.26Å; N384-I496 HydrophobicContact CB-CG1 4.12Å; I496-K498 HydrophobicContact CG2-CG 4.07Å
497	V	76.5	Confident	76.4	Confident	7 Å²	7	72.2 Å²	72.2	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.8	175.1	-171.9	0	0	0	0	108.7	I382 L383 H485 E488 C489	I382-V497 CarbonylContact C-O 3.54Å; I382-V497 WeakPolarHBondContact CA-O 3.32Å; L383-V497 PolarHBondContact N-O 3.48Å; L383-V497 PolarHBondContact O-N 3.21Å; H485-V497 VanDerWaalsContact CD2-CG1 3.47Å; H485-V497 WeakPolarHBondContact CD2-CG1 3.3Å; H485-V497 PolarHBondContact NE2-O 3.18Å; E488-V497 HydrophobicContact CB-CG1 4.18Å; E488-V497 HydrophobicContact CG-CG1 3.79Å; E488-V497 HydrophobicContact CG-CG2 3.99Å; E488-V497 VanDerWaalsContact OE2-CG1 3.26Å; E488-V497 WeakPolarHBondContact OE2-CG1 3.45Å; C489-V497 HydrophobicContact CB-CG2 4.46Å
498	K	76.7	Confident	75.8	Confident	135 Å²	135	72.9 Å²	72.9	59%	0.587	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	126	-178.1	-52.7	-172.5	-177.7	174.9	0	110.1	V381 I382 I496	V381-K498 WeakPolarHBondContact O-CA 3.4Å; I382-K498 HydrophobicContact CB-CG 4.36Å; I382-K498 HydrophobicContact CD1-CD 4.01Å; I382-K498 HydrophobicContact CD1-CG 4.3Å; I382-K498 HydrophobicContact CG1-CB 4.37Å; I382-K498 HydrophobicContact CG1-CD 4.14Å; I382-K498 HydrophobicContact CG1-CG 3.89Å; I382-K498 HydrophobicContact CG2-CG 4.02Å; I496-K498 HydrophobicContact CG2-CG 4.07Å
499	R	74.6	Confident	75.1	Confident	61 Å²	61	73.5 Å²	73.5	23%	0.23	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	148	173.2	-66.5	-166.5	-171.1	-166.5	3.7	112.9	N380 V381 E481 H485 E488 H501	N380-R499 WeakPolarHBondContact CA-O 3.3Å; V381-R499 PolarHBondContact N-O 3.36Å; V381-R499 PolarHBondContact O-N 3.15Å; E481-R499 IonicContact OE2-NH1 3.81Å; E481-R499 PolarHBondContact OE2-NH1 2.97Å; H485-R499 HydrophobicContact CB-CB 4.49Å; H485-R499 HydrophobicContact CB-CG 4.44Å; H485-R499 VanDerWaalsContact CD2-CG 3.44Å; H485-R499 WeakPolarHBondContact CD2-CG 3.13Å; H485-R499 PolarHBondContact NE2-N 3.42Å; E488-R499 IonicContact OE2-CZ 3.15Å; E488-R499 IonicContact OE2-NE 2.74Å; E488-R499 PolarHBondContact OE2-NE 3.37Å; E488-R499 IonicContact OE2-NH2 3.62Å; E488-R499 PolarHBondContact OE2-NH2 2.83Å; R499-H501 PolarHBondContact O-CD2 3.39Å
500	W	72.5	Confident	74.6	Confident	97 Å²	97	78.1 Å²	78.1	37%	0.367	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	135.8	170.9	-67.4	93	0	0	0	110.4	P378 F379 N380	P378-W500 HydrophobicContact CB-CD2 4.41Å; P378-W500 HydrophobicContact CB-CE3 3.65Å; P378-W500 HydrophobicContact CB-CZ3 4.17Å; P378-W500 HydrophobicContact CG-CE3 4.26Å; P378-W500 HydrophobicContact CG-CZ3 4.31Å; P378-W500 WeakPolarHBondContact O-CZ3 3.49Å; F379-W500 CarbonylContact O-C 3.57Å; F379-W500 WeakPolarHBondContact O-CA 3.41Å; N380-W500 HydrophobicContact CB-CD2 3.78Å; N380-W500 HydrophobicContact CB-CE3 3.65Å; N380-W500 HydrophobicContact CB-CH2 3.88Å; N380-W500 HydrophobicContact CB-CZ2 3.98Å; N380-W500 HydrophobicContact CB-CZ3 3.72Å; N380-W500 VanDerWaalsContact ND2-CE2 3.32Å; N380-W500 WeakPolarHBondContact ND2-CZ2 3.16Å; N380-W500 PolarHBondContact ND2-NE1 3.23Å
501	H	72.6	Confident	74.1	Confident	10 Å²	10	81.4 Å²	81.4	5%	0.046	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	165.2	-179.7	-65.9	-75.2	0	0	0	110.2	P378 F379 L472 H485 R499	P378-H501 CarbonylContact C-O 3.58Å; P378-H501 WeakPolarHBondContact CA-O 3.14Å; F379-H501 PolarHBondContact N-O 3.15Å; F379-H501 PolarHBondContact O-N 3.46Å; L472-H501 HydrophobicContact CD1-CB 3.73Å; L472-H501 HydrophobicContact CD2-CB 3.63Å; L472-H501 HydrophobicContact CG-CB 4.34Å; H485-H501 AromaticContact CE1-NE2 3.81Å; H485-H501 AromaticContact CG-NE2 3.58Å; H485-H501 AromaticContact ND1-CD2 3.94Å; H485-H501 AromaticContact ND1-CE1 3.83Å; H485-H501 AromaticContact ND1-NE2 2.97Å; H485-H501 PolarHBondContact ND1-NE2 3.46Å; R499-H501 PolarHBondContact O-CD2 3.39Å
502	R	67.1	Low	73.4	Confident	141 Å²	141	77.4 Å²	77.4	53%	0.532	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133	171.9	-179.5	174.2	164.7	-155	-12	108.1	A374	A374-R502 PolarHBondContact O-NE 3Å; A374-R502 PolarHBondContact O-NH2 2.9Å
503	L	69.6	Low	72.7	Confident	6 Å²	6	80.1 Å²	80.1	3%	0.031	39%	0.386	C	S	.	.			trans	-69.3	139.2	174.6	-62.7	174.7	0	0	0	110	F379 V457 S471 L472	F379-L503 HydrophobicContact CB-CD2 4.15Å; F379-L503 HydrophobicContact CB-CG 4.2Å; F379-L503 HydrophobicContact CD1-CD2 4.36Å; F379-L503 HydrophobicContact CD2-CD2 4Å; F379-L503 HydrophobicContact CD2-CG 4.46Å; F379-L503 HydrophobicContact CG-CD2 3.93Å; F379-L503 HydrophobicContact CG-CG 4.43Å; V457-L503 HydrophobicContact CB-CD1 4.01Å; V457-L503 HydrophobicContact CG2-CD1 3.68Å; V457-L503 HydrophobicContact CG2-CD2 4.15Å; S471-L503 WeakPolarHBondContact O-CA 3.04Å; L472-L503 HydrophobicContact CB-CD2 4.11Å
504	T	70.9	Confident	72.6	Confident	87 Å²	87	83 Å²	83	53%	0.534	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-100.3	142	170	49.2	0	0	0	0	109.2	G470 S471	G470-T504 CarbonylContact C-O 3.45Å; G470-T504 VanDerWaalsContact CA-O 3.28Å; G470-T504 WeakPolarHBondContact CA-O 3.49Å; S471-T504 PolarHBondContact N-O 3.43Å; S471-T504 PolarHBondContact O-N 3.13Å; S471-T504 PolarHBondContact O-OG1 3.12Å
505	V	67.1	Low	72.6	Confident	126 Å²	126	81.5 Å²	81.5	76%	0.764	38%	0.382	S	S	*	.			trans	-94.8	0	172	179.1	0	0	0	0	109	A374 F468 I469	A374-V505 HydrophobicContact CB-CG2 3.68Å; F468-V505 HydrophobicContact CE1-CG1 4.41Å; I469-V505 WeakPolarHBondContact O-CG2 3.23Å

Retrieved 505 of 505 residues in 592.6 ms (Link to these results)

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