A0A060Y2Y3_ONCMY Loading...

cAMP-dependent protein kinase type I-alpha regulatory subunit

AlphaFold DB (A0A1S3SLC2), UniProt , Accession A0A060Y2Y3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 379 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	46.2	Very low	57	Low	247 Å²	247	110.7 Å²	110.7	100%	1.217	65%	0.652	S	S	*	*				0	74.2	0	-67	-176.7	-171.4	0	0	109.1
2	A	48.6	Very low	58.4	Low	95 Å²	95	116.2 Å²	116.2	79%	0.785	65%	0.653	S	S	*	*			trans	-145.8	25.4	-178.1	0	0	0	0	0	112.4
3	S	49.7	Very low	59.7	Low	102 Å²	102	112.2 Å²	112.2	71%	0.713	64%	0.638	S	S	*	*	S	Bend	trans	-120	5.4	-175.3	65.5	0	0	0	0	114.2
4	S	52	Low	61.1	Low	104 Å²	104	111.9 Å²	111.9	73%	0.727	63%	0.633	S	S	*	*	S	Bend	trans	-106.4	-3.3	-176.7	92.1	0	0	0	0	114.9
5	S	54.3	Low	62.3	Low	77 Å²	77	115.4 Å²	115.4	54%	0.538	63%	0.632	S	S	.	*	S	Bend	trans	-89.4	-31.7	-179.4	58.3	0	0	0	0	113.3	S8	S5-S8 PolarHBondContact O-OG 2.98Å; S5-S8 VanDerWaalsContact O-OG 3.11Å
6	T	54	Low	63.6	Low	84 Å²	84	114.9 Å²	114.9	52%	0.515	62%	0.624	S	S	.	*	H	α-helix	trans	-71.7	-37	178.6	39.5	0	0	0	0	112.8	S8 E9 E10	T6-S8 VanDerWaalsContact C-N 3.29Å; T6-S8 PolarHBondContact O-N 2.98Å; T6-E9 PolarHBondContact O-N 3.3Å; T6-E10 PolarHBondContact O-N 3.36Å
7	S	56.7	Low	64.6	Low	59 Å²	59	112.8 Å²	112.8	41%	0.413	62%	0.618	S	S	.	*	H	α-helix	trans	-63.3	-30.9	178.7	-174.7	0	0	0	0	113.5	E11	S7-E11 WeakPolarHBondContact O-CG 3.4Å; S7-E11 PolarHBondContact O-N 3.05Å
8	S	61.2	Low	65.6	Low	71 Å²	71	113.2 Å²	113.2	50%	0.497	62%	0.615	S	S	.	*	H	α-helix	trans	-79.6	-26	-178.1	67.3	0	0	0	0	113.6	S5 T6 R12	S5-S8 PolarHBondContact O-OG 2.98Å; S5-S8 VanDerWaalsContact O-OG 3.11Å; T6-S8 VanDerWaalsContact C-N 3.29Å; T6-S8 PolarHBondContact O-N 2.98Å; S8-R12 WeakPolarHBondContact O-CB 3.49Å; S8-R12 PolarHBondContact O-N 3.3Å
9	E	65.6	Low	66.5	Low	140 Å²	140	113.1 Å²	113.1	65%	0.654	61%	0.614	S	S	*	*	H	α-helix	trans	-77.4	-41.5	176.3	-71.3	-177.9	162.1	0	0	110.6	T6 R12 S13	T6-E9 PolarHBondContact O-N 3.3Å; E9-R12 WeakPolarHBondContact O-CB 3.23Å; E9-R12 PolarHBondContact O-N 2.77Å; E9-S13 PolarHBondContact O-N 2.79Å; E9-S13 PolarHBondContact O-OG 3.31Å
10	E	67.8	Low	67.4	Low	132 Å²	132	114.3 Å²	114.3	62%	0.617	61%	0.61	S	S	*	*	H	α-helix	trans	-63.1	-43.1	176	-71.3	178.1	172.1	0	0	112.6	T6 R12 S13 L14	T6-E10 PolarHBondContact O-N 3.36Å; E10-R12 VanDerWaalsContact C-N 3.27Å; E10-R12 PolarHBondContact O-N 2.87Å; E10-S13 PolarHBondContact O-N 3.11Å; E10-L14 WeakPolarHBondContact O-CB 3.49Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 2.86Å
11	E	71.3	Confident	68.2	Low	107 Å²	107	111.1 Å²	111.1	50%	0.5	59%	0.594	S	S	.	*	H	α-helix	trans	-63.7	-33.1	175.5	-79.5	-175.3	177.5	0	0	112.7	S7 R15	S7-E11 WeakPolarHBondContact O-CG 3.4Å; S7-E11 PolarHBondContact O-N 3.05Å; E11-R15 WeakPolarHBondContact O-CG 3.36Å; E11-R15 PolarHBondContact O-N 2.98Å
12	R	73.4	Confident	69.9	Low	176 Å²	176	105.7 Å²	105.7	66%	0.664	57%	0.566	S	S	*	*	H	α-helix	trans	-71.6	-44.4	176.8	-168.9	178	-177.3	166.5	4.7	111	S8 E9 E10 L14 R15 E16	S8-R12 WeakPolarHBondContact O-CB 3.49Å; S8-R12 PolarHBondContact O-N 3.3Å; E9-R12 WeakPolarHBondContact O-CB 3.23Å; E9-R12 PolarHBondContact O-N 2.77Å; E10-R12 VanDerWaalsContact C-N 3.27Å; E10-R12 PolarHBondContact O-N 2.87Å; R12-L14 VanDerWaalsContact C-N 3.33Å; R12-L14 PolarHBondContact O-N 3.38Å; R12-R15 PolarHBondContact O-N 2.96Å; R12-E16 IonicContact NE-OE1 2.88Å; R12-E16 WeakPolarHBondContact O-CG 3.48Å; R12-E16 PolarHBondContact O-N 3.13Å
13	S	75.9	Confident	71.7	Confident	65 Å²	65	109 Å²	109	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-61.6	-39.6	175	-65	0	0	0	0	112.4	E9 E10 E16 C17	E9-S13 PolarHBondContact O-N 2.79Å; E9-S13 PolarHBondContact O-OG 3.31Å; E10-S13 PolarHBondContact O-N 3.11Å; S13-E16 PolarHBondContact O-N 3.33Å; S13-C17 PolarHBondContact O-N 3.41Å; S13-C17 PolarHBondContact O-SG 2.89Å; S13-C17 VanDerWaalsContact O-SG 3.35Å
14	L	78.8	Confident	73.3	Confident	108 Å²	108	108.4 Å²	108.4	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-62	-44.7	175.6	-80.6	159.7	0	0	0	112.2	E10 R12 E16 C17 E18	E10-L14 WeakPolarHBondContact O-CB 3.49Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 2.86Å; R12-L14 VanDerWaalsContact C-N 3.33Å; R12-L14 PolarHBondContact O-N 3.38Å; L14-E16 VanDerWaalsContact C-N 3.33Å; L14-E16 PolarHBondContact O-N 2.84Å; L14-C17 PolarHBondContact O-N 2.81Å; L14-E18 WeakPolarHBondContact O-CG 3.23Å; L14-E18 PolarHBondContact O-N 3.5Å
15	R	79.6	Confident	74.9	Confident	164 Å²	164	108.8 Å²	108.8	62%	0.619	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-38.1	175.9	-74.3	179	-174.1	165.1	8.1	112.4	E11 R12 E18 L19	E11-R15 WeakPolarHBondContact O-CG 3.36Å; E11-R15 PolarHBondContact O-N 2.98Å; R12-R15 PolarHBondContact O-N 2.96Å; R15-E18 PolarHBondContact O-N 2.9Å; R15-L19 WeakPolarHBondContact O-CB 3.42Å; R15-L19 VanDerWaalsContact O-CG 3.25Å; R15-L19 WeakPolarHBondContact O-CG 3.45Å; R15-L19 PolarHBondContact O-N 3.21Å
16	E	82.5	Confident	76.4	Confident	107 Å²	107	107.5 Å²	107.5	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-39.6	175.6	-73.5	173.7	-172.1	0	0	111.7	R12 S13 L14 L19 Y20	R12-E16 IonicContact NE-OE1 2.88Å; R12-E16 WeakPolarHBondContact O-CG 3.48Å; R12-E16 PolarHBondContact O-N 3.13Å; S13-E16 PolarHBondContact O-N 3.33Å; L14-E16 VanDerWaalsContact C-N 3.33Å; L14-E16 PolarHBondContact O-N 2.84Å; E16-L19 PolarHBondContact O-N 2.82Å; E16-Y20 PolarHBondContact O-N 3.15Å
17	C	80.8	Confident	78	Confident	79 Å²	79	110.9 Å²	110.9	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-45	172.9	-70.4	0	0	0	0	112.5	S13 L14 L19 Y20 V21	S13-C17 PolarHBondContact O-N 3.41Å; S13-C17 PolarHBondContact O-SG 2.89Å; S13-C17 VanDerWaalsContact O-SG 3.35Å; L14-C17 PolarHBondContact O-N 2.81Å; C17-L19 VanDerWaalsContact C-N 3.32Å; C17-L19 PolarHBondContact O-N 2.83Å; C17-Y20 PolarHBondContact O-N 2.81Å; C17-V21 WeakPolarHBondContact O-CG2 3.35Å; C17-V21 PolarHBondContact O-N 2.96Å
18	E	82.3	Confident	79.4	Confident	121 Å²	121	112.5 Å²	112.5	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-60.8	-42.3	177.2	-75.3	179.7	172.2	0	0	111.8	L14 R15 Y20 V21 Q22	L14-E18 WeakPolarHBondContact O-CG 3.23Å; L14-E18 PolarHBondContact O-N 3.5Å; R15-E18 PolarHBondContact O-N 2.9Å; E18-Y20 VanDerWaalsContact C-N 3.34Å; E18-Y20 PolarHBondContact O-N 2.86Å; E18-V21 PolarHBondContact O-N 3.22Å; E18-Q22 WeakPolarHBondContact O-CB 3.42Å; E18-Q22 WeakPolarHBondContact O-CG 3.35Å; E18-Q22 PolarHBondContact O-N 2.97Å
19	L	83.6	Confident	80.6	Confident	111 Å²	111	112.3 Å²	112.3	58%	0.581	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-38.7	175.2	-73	170.9	0	0	0	112.1	R15 E16 C17 K23	R15-L19 WeakPolarHBondContact O-CB 3.42Å; R15-L19 VanDerWaalsContact O-CG 3.25Å; R15-L19 WeakPolarHBondContact O-CG 3.45Å; R15-L19 PolarHBondContact O-N 3.21Å; E16-L19 PolarHBondContact O-N 2.82Å; C17-L19 VanDerWaalsContact C-N 3.32Å; C17-L19 PolarHBondContact O-N 2.83Å; L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 PolarHBondContact O-N 3Å
20	Y	84.4	Confident	81.7	Confident	137 Å²	137	109.9 Å²	109.9	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-44.8	176.1	-172.2	-93.7	0	0	0	111.8	E16 C17 E18 Q22 K23 H24 I26	E16-Y20 PolarHBondContact O-N 3.15Å; C17-Y20 PolarHBondContact O-N 2.81Å; E18-Y20 VanDerWaalsContact C-N 3.34Å; E18-Y20 PolarHBondContact O-N 2.86Å; Y20-Q22 VanDerWaalsContact C-N 3.33Å; Y20-Q22 PolarHBondContact O-N 3.27Å; Y20-K23 PolarHBondContact O-N 3.32Å; Y20-H24 AromaticContact CD2-CD2 3.68Å; Y20-H24 AromaticContact CD2-NE2 3.96Å; Y20-H24 AromaticContact CE1-CD2 4Å; Y20-H24 AromaticContact CE2-CD2 3.42Å; Y20-H24 VanDerWaalsContact CE2-CD2 3.42Å; Y20-H24 WeakPolarHBondContact CE2-CD2 3.47Å; Y20-H24 AromaticContact CE2-NE2 3.45Å; Y20-H24 WeakPolarHBondContact CE2-NE2 3.5Å; Y20-H24 AromaticContact CZ-CD2 3.59Å; Y20-H24 AromaticContact CZ-NE2 3.89Å; Y20-H24 PolarHBondContact O-CD2 3.25Å; Y20-H24 PolarHBondContact O-N 3.26Å; Y20-I26 HydrophobicContact CD1-CD1 3.69Å; Y20-I26 HydrophobicContact CE1-CD1 3.62Å
21	V	83.3	Confident	82.7	Confident	47 Å²	47	109.7 Å²	109.7	29%	0.285	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-42.5	177.5	169.6	0	0	0	0	111.5	C17 E18 N25 I26 Q27	C17-V21 WeakPolarHBondContact O-CG2 3.35Å; C17-V21 PolarHBondContact O-N 2.96Å; E18-V21 PolarHBondContact O-N 3.22Å; V21-N25 PolarHBondContact O-N 3.21Å; V21-N25 VanDerWaalsContact O-N 3.12Å; V21-I26 HydrophobicContact CG1-CB 4.37Å; V21-I26 HydrophobicContact CG2-CD1 4.35Å; V21-I26 PolarHBondContact O-N 2.81Å; V21-I26 VanDerWaalsContact O-N 3.09Å; V21-Q27 HydrophobicContact CG1-CG 3.84Å
22	Q	82.8	Confident	83.5	Confident	134 Å²	134	107.6 Å²	107.6	63%	0.626	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-46.1	176.1	-72.9	-179.9	5.7	0	0	112	E18 Y20 H24 N25	E18-Q22 WeakPolarHBondContact O-CB 3.42Å; E18-Q22 WeakPolarHBondContact O-CG 3.35Å; E18-Q22 PolarHBondContact O-N 2.97Å; Y20-Q22 VanDerWaalsContact C-N 3.33Å; Y20-Q22 PolarHBondContact O-N 3.27Å; Q22-H24 VanDerWaalsContact C-N 3.28Å; Q22-H24 PolarHBondContact O-N 3.13Å; Q22-N25 PolarHBondContact O-N 2.75Å; Q22-N25 PolarHBondContact O-OD1 3.49Å
23	K	86.3	Confident	84.3	Confident	163 Å²	163	99.6 Å²	99.6	71%	0.709	49%	0.485	S	S	*	.	H	α-helix	trans	-58.9	-39.8	-179	-178.8	-179.9	177.4	-175.3	0	112.5	L19 Y20	L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 PolarHBondContact O-N 3Å; Y20-K23 PolarHBondContact O-N 3.32Å
24	H	82.8	Confident	84.9	Confident	90 Å²	90	101.4 Å²	101.4	42%	0.417	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	7.9	-178.4	-68.9	-80	0	0	0	113.5	Y20 Q22 I26	Y20-H24 AromaticContact CD2-CD2 3.68Å; Y20-H24 AromaticContact CD2-NE2 3.96Å; Y20-H24 AromaticContact CE1-CD2 4Å; Y20-H24 AromaticContact CE2-CD2 3.42Å; Y20-H24 VanDerWaalsContact CE2-CD2 3.42Å; Y20-H24 WeakPolarHBondContact CE2-CD2 3.47Å; Y20-H24 AromaticContact CE2-NE2 3.45Å; Y20-H24 WeakPolarHBondContact CE2-NE2 3.5Å; Y20-H24 AromaticContact CZ-CD2 3.59Å; Y20-H24 AromaticContact CZ-NE2 3.89Å; Y20-H24 PolarHBondContact O-CD2 3.25Å; Y20-H24 PolarHBondContact O-N 3.26Å; Q22-H24 VanDerWaalsContact C-N 3.28Å; Q22-H24 PolarHBondContact O-N 3.13Å; H24-I26 HydrophobicContact CB-CD1 4.15Å; H24-I26 HydrophobicContact CB-CG1 3.73Å; H24-I26 PolarHBondContact O-N 2.97Å
25	N	86.4	Confident	85.4	Confident	113 Å²	113	99.6 Å²	99.6	60%	0.604	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	37.1	-179.2	-73.2	-38	0	0	0	113.9	V21 Q22 Q27 Q28 L29	V21-N25 PolarHBondContact O-N 3.21Å; V21-N25 VanDerWaalsContact O-N 3.12Å; Q22-N25 PolarHBondContact O-N 2.75Å; Q22-N25 PolarHBondContact O-OD1 3.49Å; N25-Q27 PolarHBondContact O-N 3.13Å; N25-Q28 PolarHBondContact O-N 3.47Å; N25-L29 PolarHBondContact O-N 2.87Å; N25-L29 VanDerWaalsContact O-N 3.11Å
26	I	85.6	Confident	85.8	Confident	49 Å²	49	95.4 Å²	95.4	25%	0.251	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-36.8	-168.9	-60	179.6	0	0	0	111.3	Y20 V21 H24 Q28 L29 L30	Y20-I26 HydrophobicContact CD1-CD1 3.69Å; Y20-I26 HydrophobicContact CE1-CD1 3.62Å; V21-I26 HydrophobicContact CG1-CB 4.37Å; V21-I26 HydrophobicContact CG2-CD1 4.35Å; V21-I26 PolarHBondContact O-N 2.81Å; V21-I26 VanDerWaalsContact O-N 3.09Å; H24-I26 HydrophobicContact CB-CD1 4.15Å; H24-I26 HydrophobicContact CB-CG1 3.73Å; H24-I26 PolarHBondContact O-N 2.97Å; I26-Q28 PolarHBondContact O-N 3.46Å; I26-L29 PolarHBondContact O-N 3.04Å; I26-L30 HydrophobicContact CG2-CD1 4.02Å; I26-L30 HydrophobicContact CG2-CG 4.38Å; I26-L30 WeakPolarHBondContact O-CG 3.21Å; I26-L30 PolarHBondContact O-N 2.86Å
27	Q	86.4	Confident	86.1	Confident	155 Å²	155	92.2 Å²	92.2	72%	0.724	46%	0.455	S	S	*	.	H	α-helix	trans	-61.3	-42.2	177.4	-73.4	-178.5	-16.4	0	0	112.5	V21 N25 K31	V21-Q27 HydrophobicContact CG1-CG 3.84Å; N25-Q27 PolarHBondContact O-N 3.13Å; Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.39Å; Q27-K31 PolarHBondContact O-N 2.84Å; Q27-K31 VanDerWaalsContact O-N 3.08Å
28	Q	86.1	Confident	86.5	Confident	93 Å²	93	92.6 Å²	92.6	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-70.6	-43.1	-179.8	-174.2	57.6	38.1	0	0	110.8	N25 I26 L30 K31 D32	N25-Q28 PolarHBondContact O-N 3.47Å; I26-Q28 PolarHBondContact O-N 3.46Å; Q28-L30 PolarHBondContact O-N 2.89Å; Q28-K31 PolarHBondContact O-N 3.43Å; Q28-D32 PolarHBondContact NE2-OD1 2.8Å; Q28-D32 PolarHBondContact NE2-OD2 2.9Å; Q28-D32 PolarHBondContact O-N 2.98Å
29	L	87.3	Confident	86.8	Confident	67 Å²	67	91.8 Å²	91.8	35%	0.351	46%	0.461	S	S	.	.	H	α-helix	trans	-56.4	-48.3	176.8	178.8	66.6	0	0	0	112.3	N25 I26 C33 F53 L56	N25-L29 PolarHBondContact O-N 2.87Å; N25-L29 VanDerWaalsContact O-N 3.11Å; I26-L29 PolarHBondContact O-N 3.04Å; L29-C33 VanDerWaalsContact O-CB 3.3Å; L29-C33 WeakPolarHBondContact O-CB 3.39Å; L29-C33 PolarHBondContact O-N 3.25Å; L29-C33 VanDerWaalsContact O-N 3.09Å; L29-F53 HydrophobicContact CD1-CE1 4.08Å; L29-F53 HydrophobicContact CD2-CE1 4.18Å; L29-F53 HydrophobicContact CG-CE1 4.01Å; L29-L56 HydrophobicContact CD1-CD1 3.53Å
30	L	88.8	Confident	87	Confident	89 Å²	89	89 Å²	89	47%	0.466	45%	0.451	S	S	.	.	H	α-helix	trans	-68.7	-35.8	178.8	-69.2	176.8	0	0	0	112.1	I26 Q28 C33 I34	I26-L30 HydrophobicContact CG2-CD1 4.02Å; I26-L30 HydrophobicContact CG2-CG 4.38Å; I26-L30 WeakPolarHBondContact O-CG 3.21Å; I26-L30 PolarHBondContact O-N 2.86Å; Q28-L30 PolarHBondContact O-N 2.89Å; L30-C33 WeakPolarHBondContact O-CB 3.2Å; L30-C33 PolarHBondContact O-N 3.34Å; L30-I34 WeakPolarHBondContact O-CD1 3.28Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 3.31Å
31	K	89.5	Confident	87.2	Confident	128 Å²	128	92.4 Å²	92.4	56%	0.557	46%	0.463	S	S	*	.	H	α-helix	trans	-63.6	-46.2	175.9	-173.6	-179.7	179	-176.2	0	111.6	Q27 Q28 C33 I34 V35	Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.39Å; Q27-K31 PolarHBondContact O-N 2.84Å; Q27-K31 VanDerWaalsContact O-N 3.08Å; Q28-K31 PolarHBondContact O-N 3.43Å; K31-C33 VanDerWaalsContact C-N 3.32Å; K31-C33 PolarHBondContact O-N 3.23Å; K31-I34 PolarHBondContact O-N 2.94Å; K31-V35 WeakPolarHBondContact O-CG2 3.41Å; K31-V35 PolarHBondContact O-N 3.38Å
32	D	87.5	Confident	87.4	Confident	63 Å²	63	91.9 Å²	91.9	34%	0.337	46%	0.46	S	S	.	.	H	α-helix	trans	-66.2	-37.8	-179.9	-69	-25.4	0	0	0	111.7	Q28 I34 V35 Q36	Q28-D32 PolarHBondContact NE2-OD1 2.8Å; Q28-D32 PolarHBondContact NE2-OD2 2.9Å; Q28-D32 PolarHBondContact O-N 2.98Å; D32-I34 PolarHBondContact O-N 2.87Å; D32-V35 PolarHBondContact O-N 3.18Å; D32-Q36 VanDerWaalsContact O-CG 3.29Å; D32-Q36 WeakPolarHBondContact O-CG 3.35Å; D32-Q36 PolarHBondContact O-N 3.33Å
33	C	89.3	Confident	87.6	Confident	9 Å²	9	93.6 Å²	93.6	6%	0.061	47%	0.474	C	S	.	.	H	α-helix	trans	-55.8	-48.4	170.5	167.7	0	0	0	0	112.3	L29 L30 K31 Q36 L37 L49 Y52 F53	L29-C33 VanDerWaalsContact O-CB 3.3Å; L29-C33 WeakPolarHBondContact O-CB 3.39Å; L29-C33 PolarHBondContact O-N 3.25Å; L29-C33 VanDerWaalsContact O-N 3.09Å; L30-C33 WeakPolarHBondContact O-CB 3.2Å; L30-C33 PolarHBondContact O-N 3.34Å; K31-C33 VanDerWaalsContact C-N 3.32Å; K31-C33 PolarHBondContact O-N 3.23Å; C33-Q36 PolarHBondContact O-N 3.35Å; C33-L37 PolarHBondContact O-N 2.97Å; C33-L49 WeakPolarHBondContact SG-CD2 3.36Å; C33-Y52 HydrophobicContact CB-CD1 4.36Å; C33-Y52 HydrophobicContact CB-CE1 3.88Å; C33-F53 HydrophobicContact CB-CZ 4.07Å
34	I	88.4	Confident	87.8	Confident	102 Å²	102	95.3 Å²	95.3	52%	0.523	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-43.5	177.2	-67.1	163.6	0	0	0	111.1	L30 K31 D32 Q36 L37 C38	L30-I34 WeakPolarHBondContact O-CD1 3.28Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 3.31Å; K31-I34 PolarHBondContact O-N 2.94Å; D32-I34 PolarHBondContact O-N 2.87Å; I34-Q36 VanDerWaalsContact C-N 3.29Å; I34-Q36 PolarHBondContact O-N 3.46Å; I34-L37 PolarHBondContact O-N 3.37Å; I34-C38 PolarHBondContact O-N 3.42Å; I34-C38 PolarHBondContact O-SG 3.43Å; I34-C38 VanDerWaalsContact O-SG 3.4Å
35	V	90.3	Very high	88.1	Confident	70 Å²	70	94.2 Å²	94.2	42%	0.424	48%	0.476	S	S	.	.	H	α-helix	trans	-58.6	-43.3	177.2	170.8	0	0	0	0	110.9	K31 D32 C38 T39	K31-V35 WeakPolarHBondContact O-CG2 3.41Å; K31-V35 PolarHBondContact O-N 3.38Å; D32-V35 PolarHBondContact O-N 3.18Å; V35-C38 PolarHBondContact O-N 2.95Å; V35-T39 WeakPolarHBondContact O-CB 3.17Å; V35-T39 PolarHBondContact O-N 3.02Å; V35-T39 PolarHBondContact O-OG1 2.8Å
36	Q	88.1	Confident	88	Confident	77 Å²	77	96.1 Å²	96.1	36%	0.36	48%	0.484	S	S	.	.	H	α-helix	trans	-67.6	-38.5	179.7	-71.2	-65.3	-27.6	0	0	112.8	D32 C33 I34 T39 S40 F48 Y52	D32-Q36 VanDerWaalsContact O-CG 3.29Å; D32-Q36 WeakPolarHBondContact O-CG 3.35Å; D32-Q36 PolarHBondContact O-N 3.33Å; C33-Q36 PolarHBondContact O-N 3.35Å; I34-Q36 VanDerWaalsContact C-N 3.29Å; I34-Q36 PolarHBondContact O-N 3.46Å; Q36-T39 PolarHBondContact O-N 2.86Å; Q36-S40 WeakPolarHBondContact O-CB 3.46Å; Q36-S40 PolarHBondContact O-N 3.38Å; Q36-S40 PolarHBondContact O-OG 3.43Å; Q36-F48 HydrophobicContact CB-CE1 4.19Å; Q36-F48 HydrophobicContact CB-CZ 4.32Å; Q36-Y52 HydrophobicContact CB-CE2 4.24Å; Q36-Y52 HydrophobicContact CG-CD2 4.48Å; Q36-Y52 HydrophobicContact CG-CE2 3.78Å
37	L	89	Confident	88.1	Confident	39 Å²	39	95.4 Å²	95.4	20%	0.204	49%	0.485	C	S	.	.	H	α-helix	trans	-61.4	-47.7	172.1	-86.5	174.5	0	0	0	112.1	C33 I34 T39 R41 P42 P45 F48 L49	C33-L37 PolarHBondContact O-N 2.97Å; I34-L37 PolarHBondContact O-N 3.37Å; L37-T39 VanDerWaalsContact C-N 3.29Å; L37-T39 PolarHBondContact O-N 3.01Å; L37-R41 PolarHBondContact O-N 3.3Å; L37-P42 HydrophobicContact CD2-CG 4Å; L37-P45 HydrophobicContact CD2-CB 3.96Å; L37-F48 HydrophobicContact CD2-CD1 3.7Å; L37-F48 HydrophobicContact CD2-CE1 4.29Å; L37-F48 HydrophobicContact CG-CD1 4.26Å; L37-F48 HydrophobicContact CG-CE1 4.46Å; L37-L49 HydrophobicContact CD1-CD1 3.97Å; L37-L49 HydrophobicContact CD1-CD2 3.55Å; L37-L49 HydrophobicContact CD1-CG 3.9Å; L37-L49 HydrophobicContact CD2-CD2 4.18Å; L37-L49 HydrophobicContact CD2-CG 4.26Å; L37-L49 HydrophobicContact CG-CD2 3.73Å; L37-L49 HydrophobicContact CG-CG 4.27Å
38	C	87.9	Confident	88.2	Confident	87 Å²	87	90.5 Å²	90.5	59%	0.588	46%	0.461	S	S	*	.	H	α-helix	trans	-67	-31	-178.8	-71	0	0	0	0	112.8	I34 V35 R41	I34-C38 PolarHBondContact O-N 3.42Å; I34-C38 PolarHBondContact O-SG 3.43Å; I34-C38 VanDerWaalsContact O-SG 3.4Å; V35-C38 PolarHBondContact O-N 2.95Å; C38-R41 WeakPolarHBondContact O-CG 3.5Å
39	T	89.8	Confident	88.3	Confident	104 Å²	104	87.6 Å²	87.6	64%	0.638	45%	0.449	S	S	*	.	H	α-helix	trans	-78.5	-46.4	179.2	-53.6	0	0	0	0	111.8	V35 Q36 L37	V35-T39 WeakPolarHBondContact O-CB 3.17Å; V35-T39 PolarHBondContact O-N 3.02Å; V35-T39 PolarHBondContact O-OG1 2.8Å; Q36-T39 PolarHBondContact O-N 2.86Å; L37-T39 VanDerWaalsContact C-N 3.29Å; L37-T39 PolarHBondContact O-N 3.01Å
40	S	87	Confident	88.4	Confident	54 Å²	54	91.7 Å²	91.7	38%	0.378	46%	0.46	S	S	.	.	H	α-helix	trans	-83.7	-21.3	-174	60.5	0	0	0	0	114	Q36 P42 F48	Q36-S40 WeakPolarHBondContact O-CB 3.46Å; Q36-S40 PolarHBondContact O-N 3.38Å; Q36-S40 PolarHBondContact O-OG 3.43Å; S40-P42 WeakPolarHBondContact OG-CD 3.43Å; S40-F48 VanDerWaalsContact OG-CZ 3.29Å; S40-F48 WeakPolarHBondContact OG-CZ 3.18Å
41	R	88.5	Confident	88.3	Confident	208 Å²	208	93.3 Å²	93.3	79%	0.785	47%	0.465	S	S	*	.			trans	42.2	56.6	179.5	-59.9	-173.8	178.1	-171.6	-1	113.5	L37 C38	L37-R41 PolarHBondContact O-N 3.3Å; C38-R41 WeakPolarHBondContact O-CG 3.5Å
42	P	88.5	Confident	88.3	Confident	36 Å²	36	88.1 Å²	88.1	23%	0.234	44%	0.442	C	S	.	.			trans	-74.7	142.6	-176	32	-33.9	0	0	0	111.1	L37 S40 R44 F48	L37-P42 HydrophobicContact CD2-CG 4Å; S40-P42 WeakPolarHBondContact OG-CD 3.43Å; P42-R44 PolarHBondContact O-N 2.89Å; P42-R44 VanDerWaalsContact O-N 3.09Å; P42-F48 HydrophobicContact CB-CB 4.13Å; P42-F48 HydrophobicContact CB-CD2 4.29Å; P42-F48 HydrophobicContact CB-CG 4.3Å; P42-F48 HydrophobicContact CG-CB 3.77Å; P42-F48 HydrophobicContact CG-CD1 4.22Å; P42-F48 HydrophobicContact CG-CD2 4.17Å; P42-F48 HydrophobicContact CG-CG 3.8Å
43	D	87.1	Confident	88.4	Confident	169 Å²	169	88.2 Å²	88.2	90%	0.904	44%	0.439	S	S	*	.	S	Bend	trans	-61.3	-20.7	176.4	-60.8	-39.7	0	0	0	113.2
44	R	90.6	Very high	88.4	Confident	200 Å²	200	91.5 Å²	91.5	76%	0.755	45%	0.454	S	S	*	.			trans	-126.4	81.5	178.2	-69.8	-175.2	165.9	161.9	-2.6	111.7	P42 M46 A47 F48	P42-R44 PolarHBondContact O-N 2.89Å; P42-R44 VanDerWaalsContact O-N 3.09Å; R44-M46 PolarHBondContact O-N 3.19Å; R44-A47 HydrophobicContact CB-CB 4.14Å; R44-A47 PolarHBondContact O-N 3.09Å; R44-F48 PolarHBondContact O-N 2.98Å
45	P	87.7	Confident	88.4	Confident	66 Å²	66	92.5 Å²	92.5	43%	0.429	45%	0.451	S	S	.	.	H	α-helix	trans	-55.5	-43.5	-176.2	-27.9	35.5	0	0	0	114.3	L37 A47 F48 L49	L37-P45 HydrophobicContact CD2-CB 3.96Å; P45-A47 PolarHBondContact O-N 3.17Å; P45-F48 PolarHBondContact O-N 3.34Å; P45-L49 WeakPolarHBondContact O-CG 3.45Å; P45-L49 PolarHBondContact O-N 2.86Å
46	M	85.9	Confident	88.2	Confident	153 Å²	153	91.4 Å²	91.4	75%	0.754	44%	0.442	S	S	*	.	H	α-helix	trans	-66.7	-37	-177.7	-68.4	-59.6	-75.3	0	0	113.4	R44 L49 R50	R44-M46 PolarHBondContact O-N 3.19Å; M46-L49 HydrophobicContact SD-CD1 4.5Å; M46-R50 PolarHBondContact O-N 2.87Å
47	A	85.9	Confident	88.2	Confident	34 Å²	34	94 Å²	94	28%	0.281	45%	0.454	S	S	.	.	H	α-helix	trans	-69	-41.4	177	0	0	0	0	0	111	R44 P45 R50 E51	R44-A47 HydrophobicContact CB-CB 4.14Å; R44-A47 PolarHBondContact O-N 3.09Å; P45-A47 PolarHBondContact O-N 3.17Å; A47-R50 PolarHBondContact O-N 3.13Å; A47-E51 PolarHBondContact O-N 2.94Å; A47-E51 VanDerWaalsContact O-N 3.13Å
48	F	89.8	Confident	88	Confident	52 Å²	52	97.7 Å²	97.7	23%	0.228	47%	0.469	C	S	.	.	H	α-helix	trans	-60.9	-44.2	175.2	178	-91.6	0	0	0	112	Q36 L37 S40 P42 R44 P45 R50 E51 Y52	Q36-F48 HydrophobicContact CB-CE1 4.19Å; Q36-F48 HydrophobicContact CB-CZ 4.32Å; L37-F48 HydrophobicContact CD2-CD1 3.7Å; L37-F48 HydrophobicContact CD2-CE1 4.29Å; L37-F48 HydrophobicContact CG-CD1 4.26Å; L37-F48 HydrophobicContact CG-CE1 4.46Å; S40-F48 VanDerWaalsContact OG-CZ 3.29Å; S40-F48 WeakPolarHBondContact OG-CZ 3.18Å; P42-F48 HydrophobicContact CB-CB 4.13Å; P42-F48 HydrophobicContact CB-CD2 4.29Å; P42-F48 HydrophobicContact CB-CG 4.3Å; P42-F48 HydrophobicContact CG-CB 3.77Å; P42-F48 HydrophobicContact CG-CD1 4.22Å; P42-F48 HydrophobicContact CG-CD2 4.17Å; P42-F48 HydrophobicContact CG-CG 3.8Å; R44-F48 PolarHBondContact O-N 2.98Å; P45-F48 PolarHBondContact O-N 3.34Å; F48-R50 PolarHBondContact O-N 2.82Å; F48-E51 PolarHBondContact O-N 3.48Å; F48-Y52 VanDerWaalsContact O-CB 3.3Å; F48-Y52 WeakPolarHBondContact O-CB 3.42Å; F48-Y52 PolarHBondContact O-N 3.34Å
49	L	88	Confident	87.7	Confident	33 Å²	33	97.8 Å²	97.8	17%	0.173	46%	0.461	C	S	.	.	H	α-helix	trans	-60.9	-44.5	177.5	-74.8	-174.2	0	0	0	112.6	C33 L37 P45 M46 E51 Y52 F53	C33-L49 WeakPolarHBondContact SG-CD2 3.36Å; L37-L49 HydrophobicContact CD1-CD1 3.97Å; L37-L49 HydrophobicContact CD1-CD2 3.55Å; L37-L49 HydrophobicContact CD1-CG 3.9Å; L37-L49 HydrophobicContact CD2-CD2 4.18Å; L37-L49 HydrophobicContact CD2-CG 4.26Å; L37-L49 HydrophobicContact CG-CD2 3.73Å; L37-L49 HydrophobicContact CG-CG 4.27Å; P45-L49 WeakPolarHBondContact O-CG 3.45Å; P45-L49 PolarHBondContact O-N 2.86Å; M46-L49 HydrophobicContact SD-CD1 4.5Å; L49-E51 VanDerWaalsContact C-N 3.34Å; L49-E51 PolarHBondContact O-N 3.01Å; L49-Y52 WeakPolarHBondContact O-CB 3.06Å; L49-Y52 PolarHBondContact O-N 2.96Å; L49-F53 HydrophobicContact CD2-CE2 4.5Å; L49-F53 WeakPolarHBondContact O-CD2 3.3Å; L49-F53 PolarHBondContact O-N 2.88Å
50	R	88.6	Confident	87.3	Confident	153 Å²	153	98.6 Å²	98.6	58%	0.577	46%	0.457	S	S	*	.	H	α-helix	trans	-58.1	-48.1	176.6	-175	-176.8	63.4	-165.2	-2.7	111.1	M46 A47 F48 Y52 F53 E54	M46-R50 PolarHBondContact O-N 2.87Å; A47-R50 PolarHBondContact O-N 3.13Å; F48-R50 PolarHBondContact O-N 2.82Å; R50-Y52 VanDerWaalsContact C-N 3.32Å; R50-Y52 PolarHBondContact O-N 3.25Å; R50-F53 PolarHBondContact O-N 3.45Å; R50-E54 WeakPolarHBondContact O-CB 3.33Å; R50-E54 WeakPolarHBondContact O-CG 3.49Å; R50-E54 PolarHBondContact O-N 3.49Å
51	E	87.8	Confident	87	Confident	122 Å²	122	98.9 Å²	98.9	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-65.1	-36.2	177.7	-71.6	178.5	-170.1	0	0	112.6	A47 F48 L49 R55	A47-E51 PolarHBondContact O-N 2.94Å; A47-E51 VanDerWaalsContact O-N 3.13Å; F48-E51 PolarHBondContact O-N 3.48Å; L49-E51 VanDerWaalsContact C-N 3.34Å; L49-E51 PolarHBondContact O-N 3.01Å; E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 PolarHBondContact O-N 3.09Å
52	Y	88.6	Confident	86.6	Confident	20 Å²	20	95.9 Å²	95.9	8%	0.078	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-48.6	177.3	177.4	-99.6	0	0	0	111.7	C33 Q36 F48 L49 R50 R55 L56	C33-Y52 HydrophobicContact CB-CD1 4.36Å; C33-Y52 HydrophobicContact CB-CE1 3.88Å; Q36-Y52 HydrophobicContact CB-CE2 4.24Å; Q36-Y52 HydrophobicContact CG-CD2 4.48Å; Q36-Y52 HydrophobicContact CG-CE2 3.78Å; F48-Y52 VanDerWaalsContact O-CB 3.3Å; F48-Y52 WeakPolarHBondContact O-CB 3.42Å; F48-Y52 PolarHBondContact O-N 3.34Å; L49-Y52 WeakPolarHBondContact O-CB 3.06Å; L49-Y52 PolarHBondContact O-N 2.96Å; R50-Y52 VanDerWaalsContact C-N 3.32Å; R50-Y52 PolarHBondContact O-N 3.25Å; Y52-R55 PolarHBondContact O-N 3.46Å; Y52-L56 HydrophobicContact CD1-CD1 4.02Å; Y52-L56 HydrophobicContact CE1-CD1 3.42Å; Y52-L56 VanDerWaalsContact CE1-CD1 3.42Å; Y52-L56 HydrophobicContact CE1-CG 4.32Å; Y52-L56 PolarHBondContact O-N 3.27Å; Y52-L56 VanDerWaalsContact O-N 3.12Å
53	F	90.3	Very high	86.1	Confident	65 Å²	65	100.2 Å²	100.2	29%	0.285	47%	0.473	S	S	.	.	H	α-helix	trans	-68.2	-41	177.5	-73.4	-64.7	0	0	0	112.4	L29 C33 L49 R50 R55 L56 E57	L29-F53 HydrophobicContact CD1-CE1 4.08Å; L29-F53 HydrophobicContact CD2-CE1 4.18Å; L29-F53 HydrophobicContact CG-CE1 4.01Å; C33-F53 HydrophobicContact CB-CZ 4.07Å; L49-F53 HydrophobicContact CD2-CE2 4.5Å; L49-F53 WeakPolarHBondContact O-CD2 3.3Å; L49-F53 PolarHBondContact O-N 2.88Å; R50-F53 PolarHBondContact O-N 3.45Å; F53-R55 PolarHBondContact O-N 3.2Å; F53-L56 HydrophobicContact CD1-CD1 4.34Å; F53-L56 PolarHBondContact O-N 3.3Å; F53-L56 VanDerWaalsContact O-N 3.13Å; F53-E57 PolarHBondContact O-N 3.19Å
54	E	89.1	Confident	85.6	Confident	77 Å²	77	96.1 Å²	96.1	36%	0.36	45%	0.45	S	S	.	.	H	α-helix	trans	-58.5	-33.7	173.6	-79.1	178.7	-160.3	0	0	112.6	R50 K58	R50-E54 WeakPolarHBondContact O-CB 3.33Å; R50-E54 WeakPolarHBondContact O-CG 3.49Å; R50-E54 PolarHBondContact O-N 3.49Å; E54-K58 WeakPolarHBondContact O-CG 3.42Å; E54-K58 PolarHBondContact O-N 3.45Å
55	R	88.3	Confident	84.9	Confident	124 Å²	124	90.9 Å²	90.9	47%	0.468	44%	0.437	S	S	.	.	H	α-helix	trans	-71.8	-42.4	176.4	-175.1	177.7	61.5	124.9	-0.3	111.7	E51 Y52 F53 K58 E59	E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 PolarHBondContact O-N 3.09Å; Y52-R55 PolarHBondContact O-N 3.46Å; F53-R55 PolarHBondContact O-N 3.2Å; R55-K58 PolarHBondContact O-N 3.19Å; R55-E59 PolarHBondContact O-N 3.26Å
56	L	86.9	Confident	84.2	Confident	46 Å²	46	93 Å²	93	24%	0.241	44%	0.444	C	S	.	.	H	α-helix	trans	-61.8	-43.6	176.2	-72.9	176.8	0	0	0	111.5	L29 Y52 F53 K58 E59 E60	L29-L56 HydrophobicContact CD1-CD1 3.53Å; Y52-L56 HydrophobicContact CD1-CD1 4.02Å; Y52-L56 HydrophobicContact CE1-CD1 3.42Å; Y52-L56 VanDerWaalsContact CE1-CD1 3.42Å; Y52-L56 HydrophobicContact CE1-CG 4.32Å; Y52-L56 PolarHBondContact O-N 3.27Å; Y52-L56 VanDerWaalsContact O-N 3.12Å; F53-L56 HydrophobicContact CD1-CD1 4.34Å; F53-L56 PolarHBondContact O-N 3.3Å; F53-L56 VanDerWaalsContact O-N 3.13Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.46Å; L56-E59 PolarHBondContact O-N 3Å; L56-E59 VanDerWaalsContact O-N 3.15Å; L56-E60 PolarHBondContact O-N 2.96Å
57	E	86.6	Confident	83.2	Confident	131 Å²	131	92.4 Å²	92.4	61%	0.612	44%	0.439	S	S	*	.	H	α-helix	trans	-59.5	-40.6	175.2	-74.1	-179.4	175.5	0	0	112.2	F53 E60 A61	F53-E57 PolarHBondContact O-N 3.19Å; E57-E60 PolarHBondContact O-N 2.94Å; E57-A61 WeakPolarHBondContact O-CB 3.49Å; E57-A61 PolarHBondContact O-N 3.4Å
58	K	84.4	Confident	82.2	Confident	118 Å²	118	96.2 Å²	96.2	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-67.1	-35.2	176.4	-76.3	171.7	-176	164	0	112.8	E54 R55 L56 K62	E54-K58 WeakPolarHBondContact O-CG 3.42Å; E54-K58 PolarHBondContact O-N 3.45Å; R55-K58 PolarHBondContact O-N 3.19Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.46Å; K58-K62 WeakPolarHBondContact O-CB 3.27Å; K58-K62 WeakPolarHBondContact O-CG 3.34Å; K58-K62 PolarHBondContact O-N 3.22Å; K58-K62 VanDerWaalsContact O-N 3.13Å
59	E	82.4	Confident	80.7	Confident	89 Å²	89	100.6 Å²	100.6	42%	0.416	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-42.3	175.9	-76.1	176.3	-174.2	0	0	111	R55 L56 K62 Q63	R55-E59 PolarHBondContact O-N 3.26Å; L56-E59 PolarHBondContact O-N 3Å; L56-E59 VanDerWaalsContact O-N 3.15Å; E59-K62 PolarHBondContact O-N 3.46Å; E59-Q63 WeakPolarHBondContact O-CG 3.33Å; E59-Q63 PolarHBondContact O-N 3.49Å
60	E	80.7	Confident	79.1	Confident	121 Å²	121	103 Å²	103	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-62.2	-47.1	175.1	-169.2	173.7	-164.9	0	0	111.4	L56 E57 K62 Q63 I64	L56-E60 PolarHBondContact O-N 2.96Å; E57-E60 PolarHBondContact O-N 2.94Å; E60-K62 VanDerWaalsContact C-N 3.3Å; E60-K62 PolarHBondContact O-N 3.12Å; E60-Q63 PolarHBondContact O-N 2.95Å; E60-Q63 VanDerWaalsContact O-N 3.1Å; E60-I64 HydrophobicContact CG-CD1 4.24Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 2.82Å
61	A	80.8	Confident	77.5	Confident	60 Å²	60	100.2 Å²	100.2	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-59.7	-38.1	176.1	0	0	0	0	0	112.7	E57 L65	E57-A61 WeakPolarHBondContact O-CB 3.49Å; E57-A61 PolarHBondContact O-N 3.4Å; A61-L65 WeakPolarHBondContact O-CB 3.36Å; A61-L65 PolarHBondContact O-N 2.81Å
62	K	81	Confident	75.6	Confident	145 Å²	145	98.4 Å²	98.4	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-67.5	-38.3	174.7	-81.4	178.7	178.9	179.5	0	112.6	K58 E59 E60 L65 N66	K58-K62 WeakPolarHBondContact O-CB 3.27Å; K58-K62 WeakPolarHBondContact O-CG 3.34Å; K58-K62 PolarHBondContact O-N 3.22Å; K58-K62 VanDerWaalsContact O-N 3.13Å; E59-K62 PolarHBondContact O-N 3.46Å; E60-K62 VanDerWaalsContact C-N 3.3Å; E60-K62 PolarHBondContact O-N 3.12Å; K62-L65 PolarHBondContact O-N 2.68Å; K62-N66 WeakPolarHBondContact O-CB 3.38Å; K62-N66 PolarHBondContact O-N 3.39Å
63	Q	77.1	Confident	73.7	Confident	127 Å²	127	109.1 Å²	109.1	59%	0.593	54%	0.54	S	S	*	.	H	α-helix	trans	-65.7	-42.4	177.1	-73.5	178.2	9.6	0	0	111.3	E59 E60 N66 Q67	E59-Q63 WeakPolarHBondContact O-CG 3.33Å; E59-Q63 PolarHBondContact O-N 3.49Å; E60-Q63 PolarHBondContact O-N 2.95Å; E60-Q63 VanDerWaalsContact O-N 3.1Å; Q63-N66 PolarHBondContact O-N 3.41Å; Q63-Q67 WeakPolarHBondContact O-CG 3.3Å; Q63-Q67 PolarHBondContact O-N 3.43Å
64	I	77.3	Confident	71.4	Confident	82 Å²	82	110.9 Å²	110.9	42%	0.421	56%	0.561	S	S	.	*	H	α-helix	trans	-62.2	-45.6	175.5	-65.4	167.2	0	0	0	110.8	E60 N66 Q67 Q68	E60-I64 HydrophobicContact CG-CD1 4.24Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 2.82Å; I64-N66 VanDerWaalsContact C-N 3.33Å; I64-N66 PolarHBondContact O-N 3.1Å; I64-Q67 PolarHBondContact O-N 2.86Å; I64-Q68 WeakPolarHBondContact O-CG 3.43Å; I64-Q68 PolarHBondContact O-N 2.96Å
65	L	74.8	Confident	69	Low	91 Å²	91	114.8 Å²	114.8	48%	0.476	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-37.8	178.6	-169.8	70.9	0	0	0	112.5	A61 K62 Q68 K69	A61-L65 WeakPolarHBondContact O-CB 3.36Å; A61-L65 PolarHBondContact O-N 2.81Å; K62-L65 PolarHBondContact O-N 2.68Å; L65-Q68 PolarHBondContact O-N 3.02Å; L65-K69 PolarHBondContact O-N 3.22Å
66	N	73.1	Confident	66.7	Low	109 Å²	109	114.3 Å²	114.3	58%	0.583	60%	0.6	S	S	*	*	H	α-helix	trans	-69.8	-34.8	176.2	-80.6	-12.6	0	0	0	112.4	K62 Q63 I64 A70	K62-N66 WeakPolarHBondContact O-CB 3.38Å; K62-N66 PolarHBondContact O-N 3.39Å; Q63-N66 PolarHBondContact O-N 3.41Å; I64-N66 VanDerWaalsContact C-N 3.33Å; I64-N66 PolarHBondContact O-N 3.1Å; N66-A70 PolarHBondContact O-N 2.72Å
67	Q	66.8	Low	64.7	Low	141 Å²	141	123 Å²	123	66%	0.659	63%	0.629	S	S	*	*	H	α-helix	trans	-67.2	-39.6	173.1	-75.8	178.1	4	0	0	111.8	Q63 I64 A70 S71	Q63-Q67 WeakPolarHBondContact O-CG 3.3Å; Q63-Q67 PolarHBondContact O-N 3.43Å; I64-Q67 PolarHBondContact O-N 2.86Å; Q67-A70 PolarHBondContact O-N 2.93Å; Q67-S71 PolarHBondContact O-N 3.01Å; Q67-S71 PolarHBondContact O-OG 3.04Å
68	Q	62.8	Low	62.5	Low	115 Å²	115	124 Å²	124	54%	0.537	64%	0.639	S	S	.	*	H	α-helix	trans	-66.3	-40.3	175.9	-72.7	178.4	-4.4	0	0	112.5	I64 L65 A70 S71 S72	I64-Q68 WeakPolarHBondContact O-CG 3.43Å; I64-Q68 PolarHBondContact O-N 2.96Å; L65-Q68 PolarHBondContact O-N 3.02Å; Q68-A70 VanDerWaalsContact C-N 3.28Å; Q68-A70 PolarHBondContact O-N 3.15Å; Q68-S71 WeakPolarHBondContact CA-OG 3.49Å; Q68-S71 PolarHBondContact O-N 3.33Å; Q68-S71 VanDerWaalsContact O-N 3.17Å; Q68-S71 PolarHBondContact O-OG 3.39Å; Q68-S72 PolarHBondContact O-N 3.13Å; Q68-S72 PolarHBondContact O-OG 3.42Å
69	K	59.3	Low	60.4	Low	143 Å²	143	126.8 Å²	126.8	62%	0.622	65%	0.654	S	S	*	*	H	α-helix	trans	-64.6	-27.8	173.8	-85.3	-176.8	175.6	179.4	0	113.8	L65	L65-K69 PolarHBondContact O-N 3.22Å
70	A	54.9	Low	58.4	Low	83 Å²	83	132 Å²	132	69%	0.686	68%	0.678	S	S	*	*	H	α-helix	trans	-74.6	-28.2	175	0	0	0	0	0	112.3	N66 Q67 Q68	N66-A70 PolarHBondContact O-N 2.72Å; Q67-A70 PolarHBondContact O-N 2.93Å; Q68-A70 VanDerWaalsContact C-N 3.28Å; Q68-A70 PolarHBondContact O-N 3.15Å
71	S	53.8	Low	56.7	Low	95 Å²	95	132 Å²	132	66%	0.664	69%	0.686	S	S	*	*	H	α-helix	trans	-85.2	-15.1	179.2	54.9	0	0	0	0	115.5	Q67 Q68	Q67-S71 PolarHBondContact O-N 3.01Å; Q67-S71 PolarHBondContact O-OG 3.04Å; Q68-S71 WeakPolarHBondContact CA-OG 3.49Å; Q68-S71 PolarHBondContact O-N 3.33Å; Q68-S71 VanDerWaalsContact O-N 3.17Å; Q68-S71 PolarHBondContact O-OG 3.39Å
72	S	48.8	Very low	54.9	Low	84 Å²	84	134.1 Å²	134.1	59%	0.587	70%	0.697	S	S	*	*			trans	-110	48.5	-174.5	70.1	0	0	0	0	113.7	Q68 S74	Q68-S72 PolarHBondContact O-N 3.13Å; Q68-S72 PolarHBondContact O-OG 3.42Å; S72-S74 VanDerWaalsContact C-N 3.3Å; S72-S74 PolarHBondContact O-N 3.23Å
73	R	48.5	Very low	53.2	Low	245 Å²	245	132.6 Å²	132.6	93%	0.925	70%	0.702	S	S	*	*			trans	-90.5	62.9	162.1	-89.7	-173.3	174.6	175.8	-0.8	110.3
74	S	41.3	Very low	51.8	Low	103 Å²	103	132.2 Å²	132.2	72%	0.72	71%	0.71	S	S	*	*	S	Bend	trans	-161.3	105.2	159	60.1	0	0	0	0	110.9	S72	S72-S74 VanDerWaalsContact C-N 3.3Å; S72-S74 PolarHBondContact O-N 3.23Å
75	D	40	Very low	50.2	Low	159 Å²	159	137.2 Å²	137.2	85%	0.85	74%	0.735	S	S	*	*			trans	63.2	142.1	147.7	-139.3	1.1	0	0	0	122.8
76	S	38.5	Very low	48.8	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	75%	0.749	S	S	*	*			trans	88.9	133.4	165.6	76.6	0	0	0	0	120.9
77	R	45.3	Very low	47.4	Very low	229 Å²	229	139.9 Å²	139.9	86%	0.864	76%	0.755	S	S	*	*			trans	-79.2	142.6	179.6	-63.1	169.8	175	172.5	-3.1	110.4
78	D	41.7	Very low	46.6	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	76%	0.763	S	S	*	*				148.1	147.4	125	-79	-30.4	0	0	0	114.3
79	E	40.4	Very low	46.1	Very low	175 Å²	175	139.2 Å²	139.2	82%	0.818	77%	0.768	S	S	*	*			trans	79.6	89.8	168.2	-55.3	-145.4	156.7	0	0	119.7	V81	E79-V81 PolarHBondContact O-N 2.78Å
80	E	39.6	Very low	45.7	Very low	199 Å²	199	141.2 Å²	141.2	93%	0.93	78%	0.777	S	S	*	*			trans	-71.6	96.4	158.8	-80	-169.8	151.4	0	0	110.8
81	V	45.7	Very low	45.7	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-78.6	118	159.4	176.4	0	0	0	0	108	E79	E79-V81 PolarHBondContact O-N 2.78Å
82	S	41.9	Very low	46.2	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-62.1	125.7	176	-67.8	0	0	0	0	110.6
83	P	46.5	Very low	47.5	Very low	113 Å²	113	153.3 Å²	153.3	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.4	149.2	177.8	25.9	-31.4	0	0	0	111.1
84	P	47.7	Very low	49.2	Very low	118 Å²	118	153.3 Å²	153.3	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.5	141.3	179.8	24.2	-31.7	0	0	0	110.8	N86	P84-N86 PolarHBondContact O-N 2.89Å
85	M	43	Very low	51.3	Low	188 Å²	188	160 Å²	160	93%	0.926	80%	0.801	S	S	*	*			trans	-53.7	113	176.9	-80.1	163.8	60.9	0	0	110.1
86	N	44.9	Very low	53.5	Low	145 Å²	145	155.9 Å²	155.9	78%	0.775	80%	0.795	S	S	*	*			trans	-55.4	139.4	168.2	-79.3	-33.7	0	0	0	109.4	P84 V88	P84-N86 PolarHBondContact O-N 2.89Å; N86-V88 PolarHBondContact O-N 3.36Å
87	P	43.8	Very low	56	Low	111 Å²	111	155.6 Å²	155.6	72%	0.721	80%	0.8	S	S	*	*			trans	-56.3	133.9	172.9	23.4	-31	0	0	0	108.5	V89	P87-V89 VanDerWaalsContact C-N 3.3Å; P87-V89 PolarHBondContact O-N 3.34Å
88	V	49.6	Very low	58.2	Low	135 Å²	135	150.2 Å²	150.2	82%	0.818	79%	0.787	S	S	*	*			trans	-58.7	95	179.6	-179.1	0	0	0	0	108.2	N86 K90	N86-V88 PolarHBondContact O-N 3.36Å; V88-K90 PolarHBondContact O-N 3.04Å
89	V	52	Low	60.5	Low	106 Å²	106	148 Å²	148	64%	0.642	78%	0.784	S	S	*	*			trans	-53.7	116.6	164.6	-180	0	0	0	0	104.7	P87 G91	P87-V89 VanDerWaalsContact C-N 3.3Å; P87-V89 PolarHBondContact O-N 3.34Å; V89-G91 PolarHBondContact O-N 3.13Å
90	K	51.8	Low	62.9	Low	185 Å²	185	140.8 Å²	140.8	80%	0.804	75%	0.754	S	S	*	*			trans	-67.4	71.6	171.9	-74.2	-176.9	-178.6	174.9	0	108	V88	V88-K90 PolarHBondContact O-N 3.04Å
91	G	55.8	Low	65.3	Low	46 Å²	46	135.3 Å²	135.3	47%	0.474	73%	0.729	S	S	.	*			trans	-56.6	155.1	166.4	0	0	0	0	0	108.9	V89 R93	V89-G91 PolarHBondContact O-N 3.13Å; G91-R93 PolarHBondContact O-N 3.38Å
92	R	64.2	Low	67.6	Low	256 Å²	256	135.7 Å²	135.7	97%	0.966	73%	0.731	S	S	*	*			trans	-44.3	116	172.1	-88.3	179.2	164.8	178.2	-4	108.8
93	R	76.4	Confident	70	Confident	214 Å²	214	132.4 Å²	132.4	81%	0.808	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-59.1	146.6	179.8	-68.7	-179.4	174.5	-178.6	-4	109	G91 R95	G91-R93 PolarHBondContact O-N 3.38Å; R93-R95 PolarHBondContact O-N 2.99Å
94	R	83.1	Confident	72.2	Confident	245 Å²	245	129.9 Å²	129.9	93%	0.925	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.1	174.1	-64.3	179.4	71.6	-166.8	1.8	108.5
95	R	86.3	Confident	74.2	Confident	245 Å²	245	131 Å²	131	93%	0.925	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-79.5	120.9	173.7	-66.7	177.8	-69.1	179.3	0.8	108.1	R93	R93-R95 PolarHBondContact O-N 2.99Å
96	G	86.3	Confident	76.4	Confident	71 Å²	71	128.8 Å²	128.8	73%	0.732	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-74.6	158.8	171.7	0	0	0	0	0	111.5
97	A	90.8	Very high	78.6	Confident	109 Å²	109	124 Å²	124	90%	0.901	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-83	152.8	169.5	0	0	0	0	0	110.2
98	I	91.4	Very high	80.8	Confident	115 Å²	115	119.1 Å²	119.1	59%	0.59	61%	0.611	S	S	*	*			trans	-128.5	142.1	176.1	49.9	165.3	0	0	0	107.9	Y205	I98-Y205 HydrophobicContact CB-CD2 3.81Å; I98-Y205 HydrophobicContact CB-CE2 3.62Å; I98-Y205 HydrophobicContact CB-CG 4.43Å; I98-Y205 HydrophobicContact CD1-CD1 3.99Å; I98-Y205 HydrophobicContact CD1-CD2 4.27Å; I98-Y205 HydrophobicContact CD1-CE1 3.42Å; I98-Y205 VanDerWaalsContact CD1-CE1 3.42Å; I98-Y205 HydrophobicContact CD1-CE2 3.64Å; I98-Y205 HydrophobicContact CD1-CG 4.43Å; I98-Y205 WeakPolarHBondContact CD1-OH 3.35Å; I98-Y205 HydrophobicContact CG1-CE2 4.22Å; I98-Y205 HydrophobicContact CG2-CD2 4.03Å; I98-Y205 HydrophobicContact CG2-CE2 3.46Å; I98-Y205 VanDerWaalsContact CG2-CE2 3.46Å
99	S	90.1	Very high	82.6	Confident	105 Å²	105	116.9 Å²	116.9	73%	0.734	61%	0.607	S	S	*	*			trans	-147.8	144.7	174.8	-172.8	0	0	0	0	108.7
100	A	90.7	Very high	84.5	Confident	25 Å²	25	115.5 Å²	115.5	21%	0.207	60%	0.602	C	S	.	*			trans	-94.1	-179.9	168.6	0	0	0	0	0	110.3	I204	A100-I204 VanDerWaalsContact CB-O 3.23Å; A100-I204 WeakPolarHBondContact CB-O 3.36Å
101	E	90.1	Very high	86.4	Confident	84 Å²	84	108.6 Å²	108.6	39%	0.393	57%	0.571	S	S	.	*			trans	-63.8	148.2	174.2	-50.5	76.2	-165.3	0	0	110.3	Y103 R226 R230	E101-Y103 HydrophobicContact CB-CE2 4.15Å; E101-R226 IonicContact OE1-CZ 3.22Å; E101-R226 IonicContact OE1-NH1 2.92Å; E101-R226 PolarHBondContact OE1-NH1 2.91Å; E101-R226 WeakPolarHBondContact OE2-CD 3.23Å; E101-R226 IonicContact OE2-NH1 2.74Å; E101-R230 PolarHBondContact O-NH1 3.42Å; E101-R230 PolarHBondContact O-NH2 2.76Å; E101-R230 IonicContact OE2-NH1 3Å
102	V	93.3	Very high	88.2	Confident	130 Å²	130	112.1 Å²	112.1	79%	0.788	58%	0.583	S	S	*	*			trans	-84.2	129.2	175.2	-177.8	0	0	0	0	108.1
103	Y	91.6	Very high	89.4	Confident	35 Å²	35	104.6 Å²	104.6	14%	0.137	56%	0.555	C	S	.	*			trans	-114	133.1	174.8	-73.5	-84.1	0	0	0	109.4	E101 D107 D227 R230 R231	E101-Y103 HydrophobicContact CB-CE2 4.15Å; Y103-D107 WeakPolarHBondContact CA-OD2 3.41Å; Y103-D107 HydrophobicContact CD1-CB 3.95Å; Y103-D227 WeakPolarHBondContact CE1-OD1 3.48Å; Y103-D227 WeakPolarHBondContact OH-CA 3.47Å; Y103-D227 PolarHBondContact OH-OD1 2.86Å; Y103-R230 HydrophobicContact CD2-CB 4.47Å; Y103-R230 VanDerWaalsContact CD2-CZ 3.47Å; Y103-R230 HydrophobicContact CE2-CB 4.1Å; Y103-R231 HydrophobicContact CD1-CG 4.05Å; Y103-R231 HydrophobicContact CE1-CG 3.84Å
104	T	92.9	Very high	90.2	Very high	59 Å²	59	99 Å²	99	36%	0.362	54%	0.536	S	S	.	.			trans	-94.9	164.4	174.5	75	0	0	0	0	111.4	E106 D107 A108 M234	T104-E106 PolarHBondContact O-N 3.4Å; T104-E106 VanDerWaalsContact O-N 3.14Å; T104-E106 PolarHBondContact OG1-N 3.46Å; T104-E106 PolarHBondContact OG1-OE2 3.32Å; T104-D107 PolarHBondContact N-OD2 2.99Å; T104-D107 WeakPolarHBondContact O-CB 3.42Å; T104-D107 PolarHBondContact O-N 3.48Å; T104-D107 PolarHBondContact OG1-N 3.22Å; T104-D107 PolarHBondContact OG1-OD2 3.46Å; T104-A108 PolarHBondContact O-N 3.47Å; T104-M234 WeakPolarHBondContact O-CE 3.42Å
105	E	89.9	Confident	90.7	Very high	141 Å²	141	91.5 Å²	91.5	66%	0.659	52%	0.518	S	S	*	.	H	α-helix	trans	-55.8	-31.4	175.1	-64.4	-174.7	-177.2	0	0	112.4	A108 A109 L238	E105-A108 PolarHBondContact O-N 3.4Å; E105-A109 WeakPolarHBondContact O-CB 3.46Å; E105-A109 PolarHBondContact O-N 3.29Å; E105-L238 HydrophobicContact CB-CD1 4.29Å; E105-L238 HydrophobicContact CG-CD1 4.16Å; E105-L238 HydrophobicContact CG-CD2 4.22Å
106	E	90.4	Very high	91.1	Very high	142 Å²	142	82.3 Å²	82.3	66%	0.664	49%	0.486	S	S	*	.	H	α-helix	trans	-68.1	-34.5	176.6	-56.4	127.2	169.2	0	0	112	T104 A108 A109 S110	T104-E106 PolarHBondContact O-N 3.4Å; T104-E106 VanDerWaalsContact O-N 3.14Å; T104-E106 PolarHBondContact OG1-N 3.46Å; T104-E106 PolarHBondContact OG1-OE2 3.32Å; E106-A108 VanDerWaalsContact C-N 3.33Å; E106-A108 PolarHBondContact O-N 2.99Å; E106-A109 PolarHBondContact O-N 3.38Å; E106-S110 VanDerWaalsContact O-CB 3.26Å; E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.06Å; E106-S110 PolarHBondContact O-OG 3.32Å
107	D	90.1	Very high	91.5	Very high	46 Å²	46	84.6 Å²	84.6	25%	0.246	49%	0.489	C	S	.	.	H	α-helix	trans	-65	-36.8	177	-69.2	-46.1	0	0	0	112.4	Y103 T104 S110 Y111 R231	Y103-D107 WeakPolarHBondContact CA-OD2 3.41Å; Y103-D107 HydrophobicContact CD1-CB 3.95Å; T104-D107 PolarHBondContact N-OD2 2.99Å; T104-D107 WeakPolarHBondContact O-CB 3.42Å; T104-D107 PolarHBondContact O-N 3.48Å; T104-D107 PolarHBondContact OG1-N 3.22Å; T104-D107 PolarHBondContact OG1-OD2 3.46Å; D107-S110 PolarHBondContact O-OG 2.96Å; D107-Y111 PolarHBondContact O-N 3.21Å; D107-R231 PolarHBondContact O-NH1 2.84Å; D107-R231 IonicContact OD1-NH1 3.88Å
108	A	89.3	Confident	91.6	Very high	7 Å²	7	81 Å²	81	6%	0.058	45%	0.452	C	S	.	.	H	α-helix	trans	-73.2	-41.1	173.3	0	0	0	0	0	111.8	T104 E105 E106 Y111 M234 L238	T104-A108 PolarHBondContact O-N 3.47Å; E105-A108 PolarHBondContact O-N 3.4Å; E106-A108 VanDerWaalsContact C-N 3.33Å; E106-A108 PolarHBondContact O-N 2.99Å; A108-Y111 WeakPolarHBondContact O-CB 3.38Å; A108-Y111 PolarHBondContact O-N 3.38Å; A108-M234 HydrophobicContact CB-CB 4.24Å; A108-M234 HydrophobicContact CB-CE 3.35Å; A108-M234 HydrophobicContact CB-CG 4.12Å; A108-L238 HydrophobicContact CB-CD1 3.96Å
109	A	88.4	Confident	91.7	Very high	89 Å²	89	79.8 Å²	79.8	74%	0.736	45%	0.447	S	S	*	.	H	α-helix	trans	-69.2	-34.1	-177.8	0	0	0	0	0	112.8	E105 E106 Y111	E105-A109 WeakPolarHBondContact O-CB 3.46Å; E105-A109 PolarHBondContact O-N 3.29Å; E106-A109 PolarHBondContact O-N 3.38Å; A109-Y111 VanDerWaalsContact C-N 3.32Å
110	S	91.9	Very high	91.8	Very high	77 Å²	77	84.5 Å²	84.5	54%	0.538	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-7.6	177.9	60.1	0	0	0	0	113.8	E106 D107 V112	E106-S110 VanDerWaalsContact O-CB 3.26Å; E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.06Å; E106-S110 PolarHBondContact O-OG 3.32Å; D107-S110 PolarHBondContact O-OG 2.96Å; S110-V112 PolarHBondContact O-N 3.05Å
111	Y	91.9	Very high	91.9	Very high	39 Å²	39	91.1 Å²	91.1	15%	0.153	48%	0.475	C	S	.	.			trans	-65.3	118.2	178.9	-179.5	-105.5	0	0	0	111.2	D107 A108 A109 R113 S228 R231 I232	D107-Y111 PolarHBondContact O-N 3.21Å; A108-Y111 WeakPolarHBondContact O-CB 3.38Å; A108-Y111 PolarHBondContact O-N 3.38Å; A109-Y111 VanDerWaalsContact C-N 3.32Å; Y111-R113 PolarHBondContact O-N 3.2Å; Y111-S228 VanDerWaalsContact OH-CB 3.31Å; Y111-S228 WeakPolarHBondContact OH-CB 3.37Å; Y111-S228 PolarHBondContact OH-OG 2.89Å; Y111-R231 HydrophobicContact CD1-CB 4.42Å; Y111-R231 HydrophobicContact CD2-CB 3.83Å; Y111-R231 VanDerWaalsContact CD2-CD 3.42Å; Y111-R231 HydrophobicContact CD2-CG 4.3Å; Y111-R231 HydrophobicContact CE2-CB 4.39Å; Y111-R231 HydrophobicContact CG-CB 3.83Å; Y111-I232 HydrophobicContact CD1-CG1 4.26Å; Y111-I232 HydrophobicContact CE1-CD1 4.14Å; Y111-I232 HydrophobicContact CE1-CG1 3.52Å
112	V	92.5	Very high	92	Very high	121 Å²	121	87.7 Å²	87.7	73%	0.733	46%	0.459	S	S	*	.			trans	-86.3	111.8	172.9	-177.2	0	0	0	0	108.5	S110 K114	S110-V112 PolarHBondContact O-N 3.05Å; V112-K114 PolarHBondContact O-N 3.42Å
113	R	89.4	Confident	92	Very high	98 Å²	98	83.5 Å²	83.5	37%	0.37	43%	0.432	S	S	.	.			trans	-54.6	112.6	177.3	-175.4	-174.7	-172.4	-98.4	4.6	110.4	Y111 V115 D146 D149	Y111-R113 PolarHBondContact O-N 3.2Å; R113-V115 HydrophobicContact CG-CG2 4.23Å; R113-D146 IonicContact CZ-OD1 2.7Å; R113-D146 IonicContact NE-OD1 2.72Å; R113-D146 PolarHBondContact NE-OD1 3.22Å; R113-D146 IonicContact NH2-OD1 2.81Å; R113-D146 PolarHBondContact NH2-OD1 3.49Å; R113-D149 IonicContact CZ-OD2 3.89Å; R113-D149 IonicContact NH1-OD2 3.74Å; R113-D149 PolarHBondContact NH1-OD2 3.08Å; R113-D149 IonicContact NH2-OD2 2.96Å; R113-D149 PolarHBondContact NH2-OD2 3.12Å
114	K	92.9	Very high	92	Very high	96 Å²	96	84 Å²	84	42%	0.417	44%	0.443	S	S	.	.			trans	-75.2	129.7	173	-61.2	174.5	-170.8	160.6	0	108.4	V112 D149 A150 D225 S228	V112-K114 PolarHBondContact O-N 3.42Å; K114-D149 CarbonylContact O-C 3.55Å; K114-D149 VanDerWaalsContact O-C 3.25Å; K114-A150 HydrophobicContact CB-CB 4.42Å; K114-A150 WeakPolarHBondContact O-CA 3.41Å; K114-A150 PolarHBondContact O-N 3.05Å; K114-D225 IonicContact NZ-OD1 3.96Å; K114-S228 PolarHBondContact NZ-OG 3.19Å
115	V	94.8	Very high	91.9	Very high	88 Å²	88	83.6 Å²	83.6	53%	0.533	45%	0.445	S	S	.	.			trans	-122.6	102.7	177.9	-172.8	0	0	0	0	108.7	R113 D149	R113-V115 HydrophobicContact CG-CG2 4.23Å; V115-D149 HydrophobicContact CG1-CB 4.26Å; V115-D149 HydrophobicContact CG2-CB 4.49Å
116	I	95.1	Very high	92.1	Very high	51 Å²	51	77 Å²	77	26%	0.262	41%	0.414	S	S	.	.			trans	-101.7	117.4	178.9	-62.4	173.8	0	0	0	107.6	K118 D149 M151 F152 W222	I116-K118 PolarHBondContact O-N 3.05Å; I116-K118 PolarHBondContact O-NZ 3.46Å; I116-D149 WeakPolarHBondContact CB-O 3.34Å; I116-D149 PolarHBondContact N-O 3.43Å; I116-M151 WeakPolarHBondContact CD1-O 3.46Å; I116-F152 HydrophobicContact CD1-CB 3.61Å; I116-W222 HydrophobicContact CG2-CH2 4.38Å; I116-W222 HydrophobicContact CG2-CZ3 4.01Å
117	P	93.5	Very high	92.2	Very high	120 Å²	120	72 Å²	72	78%	0.779	40%	0.397	S	S	*	.			trans	-63.6	132.8	-173.5	26.6	-34.4	0	0	0	111
118	K	93.6	Very high	92.2	Very high	33 Å²	33	77.7 Å²	77.7	14%	0.143	42%	0.42	C	S	.	.			trans	-134.6	144	177.6	-64.6	169.1	-172.8	72.7	0	108.4	I116 T122 M123 L126 F148 D149 M151 W222	I116-K118 PolarHBondContact O-N 3.05Å; I116-K118 PolarHBondContact O-NZ 3.46Å; K118-T122 HydrophobicContact CB-CG2 4.45Å; K118-T122 HydrophobicContact CD-CG2 4.49Å; K118-T122 HydrophobicContact CG-CG2 4.48Å; K118-M123 HydrophobicContact CB-CE 4.01Å; K118-M123 HydrophobicContact CB-CG 3.9Å; K118-M123 HydrophobicContact CB-SD 3.88Å; K118-M123 HydrophobicContact CD-CE 4.03Å; K118-M123 HydrophobicContact CD-SD 3.64Å; K118-M123 HydrophobicContact CG-SD 4.39Å; K118-L126 HydrophobicContact CD-CD1 4Å; K118-F148 WeakPolarHBondContact CE-O 3.34Å; K118-F148 PolarHBondContact NZ-O 3.14Å; K118-D149 PolarHBondContact NZ-O 3.09Å; K118-M151 WeakPolarHBondContact CE-O 3.27Å; K118-M151 PolarHBondContact NZ-O 2.74Å; K118-W222 HydrophobicContact CD-CE3 4.46Å; K118-W222 HydrophobicContact CD-CH2 4.15Å; K118-W222 HydrophobicContact CD-CZ2 4.37Å; K118-W222 HydrophobicContact CD-CZ3 4.22Å; K118-W222 VanDerWaalsContact CE-CE3 3.43Å; K118-W222 HydrophobicContact CG-CH2 3.63Å; K118-W222 HydrophobicContact CG-CZ2 3.93Å; K118-W222 HydrophobicContact CG-CZ3 4.13Å
119	D	93.3	Very high	92.3	Very high	90 Å²	90	78.3 Å²	78.3	48%	0.481	43%	0.425	S	S	.	.			trans	-75.8	161.6	172.8	69.5	-31.2	0	0	0	110.6	K121 T122 M123	D119-K121 PolarHBondContact O-N 2.94Å; D119-K121 WeakPolarHBondContact OD2-CB 3.5Å; D119-T122 PolarHBondContact O-N 3.35Å; D119-T122 WeakPolarHBondContact OD1-CB 3.36Å; D119-T122 PolarHBondContact OD1-N 3.45Å; D119-T122 VanDerWaalsContact OD1-N 3.13Å; D119-T122 PolarHBondContact OD1-OG1 2.97Å; D119-M123 WeakPolarHBondContact O-CG 3.43Å; D119-M123 PolarHBondContact O-N 2.97Å
120	Y	92.4	Very high	92.5	Very high	203 Å²	203	74.3 Å²	74.3	80%	0.796	39%	0.392	S	S	*	.	H	α-helix	trans	-57.9	-34.6	-179.5	-179.9	-98.4	0	0	0	112.4	M123 A124	Y120-M123 PolarHBondContact O-N 3.12Å; Y120-A124 WeakPolarHBondContact O-CB 3.42Å; Y120-A124 PolarHBondContact O-N 3.37Å
121	K	92.4	Very high	92.4	Very high	165 Å²	165	77.1 Å²	77.1	72%	0.717	40%	0.396	S	S	*	.	H	α-helix	trans	-65.3	-47.3	179.5	-171.7	-176.2	175.5	-173.2	0	111.5	D119 A124 A125	D119-K121 PolarHBondContact O-N 2.94Å; D119-K121 WeakPolarHBondContact OD2-CB 3.5Å; K121-A124 PolarHBondContact O-N 3.45Å; K121-A125 WeakPolarHBondContact O-CB 3.42Å; K121-A125 PolarHBondContact O-N 3.04Å
122	T	92.7	Very high	92.2	Very high	12 Å²	12	84.7 Å²	84.7	7%	0.074	43%	0.43	C	S	.	.	H	α-helix	trans	-65.1	-42.3	175.4	-72.6	0	0	0	0	111.4	K118 D119 A124 A125 L126 W222	K118-T122 HydrophobicContact CB-CG2 4.45Å; K118-T122 HydrophobicContact CD-CG2 4.49Å; K118-T122 HydrophobicContact CG-CG2 4.48Å; D119-T122 PolarHBondContact O-N 3.35Å; D119-T122 WeakPolarHBondContact OD1-CB 3.36Å; D119-T122 PolarHBondContact OD1-N 3.45Å; D119-T122 VanDerWaalsContact OD1-N 3.13Å; D119-T122 PolarHBondContact OD1-OG1 2.97Å; T122-A124 VanDerWaalsContact C-N 3.33Å; T122-A124 PolarHBondContact O-N 2.85Å; T122-A125 PolarHBondContact O-N 3.32Å; T122-L126 HydrophobicContact CG2-CD1 3.94Å; T122-L126 HydrophobicContact CG2-CG 4.22Å; T122-L126 WeakPolarHBondContact O-CG 3.3Å; T122-L126 PolarHBondContact O-N 2.65Å; T122-W222 HydrophobicContact CG2-CZ2 3.86Å
123	M	92.7	Very high	92.1	Very high	42 Å²	42	79.6 Å²	79.6	21%	0.207	40%	0.398	C	S	.	.	H	α-helix	trans	-58	-44.4	176.9	-71.6	-62.8	-146.9	0	0	112.2	K118 D119 Y120 L126 A127 F148 D149	K118-M123 HydrophobicContact CB-CE 4.01Å; K118-M123 HydrophobicContact CB-CG 3.9Å; K118-M123 HydrophobicContact CB-SD 3.88Å; K118-M123 HydrophobicContact CD-CE 4.03Å; K118-M123 HydrophobicContact CD-SD 3.64Å; K118-M123 HydrophobicContact CG-SD 4.39Å; D119-M123 WeakPolarHBondContact O-CG 3.43Å; D119-M123 PolarHBondContact O-N 2.97Å; Y120-M123 PolarHBondContact O-N 3.12Å; M123-L126 PolarHBondContact O-N 2.96Å; M123-A127 WeakPolarHBondContact O-CB 3.26Å; M123-A127 PolarHBondContact O-N 3.48Å; M123-F148 HydrophobicContact CE-CB 4.22Å; M123-F148 HydrophobicContact SD-CB 3.85Å; M123-F148 HydrophobicContact SD-CG 4.41Å; M123-D149 VanDerWaalsContact CE-OD1 3.28Å; M123-D149 WeakPolarHBondContact CE-OD1 3.27Å
124	A	91.8	Very high	92.2	Very high	46 Å²	46	79.7 Å²	79.7	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-37.9	177.2	0	0	0	0	0	112.6	Y120 K121 T122 K128	Y120-A124 WeakPolarHBondContact O-CB 3.42Å; Y120-A124 PolarHBondContact O-N 3.37Å; K121-A124 PolarHBondContact O-N 3.45Å; T122-A124 VanDerWaalsContact C-N 3.33Å; T122-A124 PolarHBondContact O-N 2.85Å; A124-K128 WeakPolarHBondContact O-CB 3.47Å; A124-K128 PolarHBondContact O-N 2.81Å; A124-K128 VanDerWaalsContact O-N 3.09Å
125	A	91.5	Very high	92.2	Very high	49 Å²	49	76.5 Å²	76.5	41%	0.405	40%	0.397	S	S	.	.	H	α-helix	trans	-65.6	-43.2	175.9	0	0	0	0	0	111.8	K121 T122 K128 A129	K121-A125 WeakPolarHBondContact O-CB 3.42Å; K121-A125 PolarHBondContact O-N 3.04Å; T122-A125 PolarHBondContact O-N 3.32Å; A125-K128 PolarHBondContact O-N 3.33Å; A125-A129 WeakPolarHBondContact O-CB 3.45Å; A125-A129 PolarHBondContact O-N 2.75Å
126	L	93.3	Very high	92.1	Very high	2 Å²	2	72.7 Å²	72.7	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-47.3	175.2	-71.3	174.4	0	0	0	111.5	K118 T122 M123 K128 A129 I130 F148 M151 V174 W222	K118-L126 HydrophobicContact CD-CD1 4Å; T122-L126 HydrophobicContact CG2-CD1 3.94Å; T122-L126 HydrophobicContact CG2-CG 4.22Å; T122-L126 WeakPolarHBondContact O-CG 3.3Å; T122-L126 PolarHBondContact O-N 2.65Å; M123-L126 PolarHBondContact O-N 2.96Å; L126-K128 VanDerWaalsContact C-N 3.29Å; L126-K128 PolarHBondContact O-N 3.48Å; L126-A129 PolarHBondContact O-N 3.21Å; L126-A129 VanDerWaalsContact O-N 3.13Å; L126-I130 WeakPolarHBondContact O-CG1 3.47Å; L126-I130 PolarHBondContact O-N 3.1Å; L126-F148 HydrophobicContact CB-CD1 4.16Å; L126-F148 HydrophobicContact CB-CE1 3.81Å; L126-F148 HydrophobicContact CB-CZ 4.25Å; L126-F148 HydrophobicContact CD1-CD1 4.42Å; L126-M151 HydrophobicContact CD1-SD 3.96Å; L126-M151 HydrophobicContact CD2-CE 4.13Å; L126-M151 HydrophobicContact CD2-SD 4.16Å; L126-V174 HydrophobicContact CD2-CB 3.98Å; L126-V174 HydrophobicContact CD2-CG1 3.86Å; L126-V174 HydrophobicContact CD2-CG2 4.47Å; L126-W222 HydrophobicContact CD1-CG 4.16Å; L126-W222 HydrophobicContact CD2-CB 3.84Å; L126-W222 HydrophobicContact CD2-CG 3.98Å
127	A	92.5	Very high	91.8	Very high	37 Å²	37	73 Å²	73	31%	0.306	38%	0.38	S	S	.	.	H	α-helix	trans	-54.6	-45.2	175.9	0	0	0	0	0	112.5	M123 E131 F148	M123-A127 WeakPolarHBondContact O-CB 3.26Å; M123-A127 PolarHBondContact O-N 3.48Å; A127-E131 PolarHBondContact O-N 3.39Å; A127-F148 HydrophobicContact CB-CE2 4.03Å; A127-F148 HydrophobicContact CB-CZ 4.1Å
128	K	91.1	Very high	91.6	Very high	167 Å²	167	75.1 Å²	75.1	73%	0.726	38%	0.379	S	S	*	.	H	α-helix	trans	-68.1	-36.8	177.7	-171.7	176.6	-179.7	-178.4	0	113	A124 A125 L126	A124-K128 WeakPolarHBondContact O-CB 3.47Å; A124-K128 PolarHBondContact O-N 2.81Å; A124-K128 VanDerWaalsContact O-N 3.09Å; A125-K128 PolarHBondContact O-N 3.33Å; L126-K128 VanDerWaalsContact C-N 3.29Å; L126-K128 PolarHBondContact O-N 3.48Å
129	A	91.7	Very high	91.4	Very high	20 Å²	20	74.4 Å²	74.4	17%	0.165	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-36.6	-178.8	0	0	0	0	0	112.6	A125 L126 V174 G195	A125-A129 WeakPolarHBondContact O-CB 3.45Å; A125-A129 PolarHBondContact O-N 2.75Å; L126-A129 PolarHBondContact O-N 3.21Å; L126-A129 VanDerWaalsContact O-N 3.13Å; A129-V174 HydrophobicContact CB-CG1 3.52Å; A129-G195 VanDerWaalsContact CB-O 3.26Å; A129-G195 WeakPolarHBondContact CB-O 3.4Å
130	I	91.1	Very high	91.1	Very high	5 Å²	5	72.4 Å²	72.4	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-99.8	-2.9	-175.5	69.8	171.1	0	0	0	114.5	L126 K132 N133 F136 F148 F172 V174	L126-I130 WeakPolarHBondContact O-CG1 3.47Å; L126-I130 PolarHBondContact O-N 3.1Å; I130-K132 PolarHBondContact O-N 2.9Å; I130-K132 VanDerWaalsContact O-N 3.15Å; I130-N133 HydrophobicContact CB-CB 4.45Å; I130-N133 VanDerWaalsContact O-CB 3.31Å; I130-N133 WeakPolarHBondContact O-CB 3.21Å; I130-N133 PolarHBondContact O-N 3.25Å; I130-F136 HydrophobicContact CB-CB 4.05Å; I130-F136 HydrophobicContact CB-CD2 4.02Å; I130-F136 HydrophobicContact CB-CG 4.01Å; I130-F136 HydrophobicContact CD1-CB 3.71Å; I130-F136 HydrophobicContact CD1-CD1 3.52Å; I130-F136 HydrophobicContact CD1-CD2 4.35Å; I130-F136 HydrophobicContact CD1-CE1 4.17Å; I130-F136 HydrophobicContact CD1-CG 3.61Å; I130-F136 HydrophobicContact CG1-CB 4.04Å; I130-F136 HydrophobicContact CG1-CG 4.23Å; I130-F136 HydrophobicContact CG2-CD2 4.36Å; I130-F136 HydrophobicContact CG2-CE2 4.49Å; I130-F148 HydrophobicContact CD1-CD1 4.45Å; I130-F148 HydrophobicContact CD1-CE1 3.27Å; I130-F148 HydrophobicContact CD1-CZ 3.4Å; I130-F148 HydrophobicContact CG1-CE1 4.12Å; I130-F148 HydrophobicContact CG1-CZ 4Å; I130-F172 HydrophobicContact CG2-CE1 4.01Å; I130-F172 HydrophobicContact CG2-CZ 4.16Å; I130-V174 HydrophobicContact CG2-CG2 3.93Å
131	E	89.4	Confident	90.8	Very high	135 Å²	135	67.7 Å²	67.7	63%	0.631	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-40.2	-176.8	-174.7	-176.9	-171.7	0	0	112.9	A127	A127-E131 PolarHBondContact O-N 3.39Å
132	K	88.5	Confident	90.6	Very high	199 Å²	199	65.4 Å²	65.4	87%	0.865	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	0.2	-179.4	-64.2	-176.7	179.6	178.8	0	113.9	I130	I130-K132 PolarHBondContact O-N 2.9Å; I130-K132 VanDerWaalsContact O-N 3.15Å
133	N	90.9	Very high	90.6	Very high	13 Å²	13	65.5 Å²	65.5	7%	0.07	35%	0.35	C	S	.	.			trans	-81.6	129.1	-177.9	-171.5	-54.8	0	0	0	109.9	I130 L135 F136 S137 E200	I130-N133 HydrophobicContact CB-CB 4.45Å; I130-N133 VanDerWaalsContact O-CB 3.31Å; I130-N133 WeakPolarHBondContact O-CB 3.21Å; I130-N133 PolarHBondContact O-N 3.25Å; N133-L135 PolarHBondContact O-N 2.97Å; N133-L135 VanDerWaalsContact O-N 3.14Å; N133-L135 PolarHBondContact OD1-N 3.28Å; N133-F136 HydrophobicContact CB-CD2 3.79Å; N133-F136 PolarHBondContact O-N 2.97Å; N133-S137 WeakPolarHBondContact O-CB 3.46Å; N133-S137 PolarHBondContact O-N 2.92Å; N133-S137 PolarHBondContact O-OG 3.38Å; N133-E200 PolarHBondContact ND2-OE2 2.85Å
134	V	91.2	Very high	90.6	Very high	101 Å²	101	67.1 Å²	67.1	61%	0.612	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.8	-175.8	67.7	0	0	0	0	113	F136 S137	V134-F136 VanDerWaalsContact C-N 3.3Å; V134-F136 PolarHBondContact O-N 3.46Å; V134-S137 PolarHBondContact O-OG 2.98Å
135	L	91.9	Very high	90.7	Very high	29 Å²	29	67.5 Å²	67.5	15%	0.152	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.9	-179.5	-64.1	-172.8	0	0	0	112.9	N133 E200 L203 I204 Y229	N133-L135 PolarHBondContact O-N 2.97Å; N133-L135 VanDerWaalsContact O-N 3.14Å; N133-L135 PolarHBondContact OD1-N 3.28Å; L135-E200 HydrophobicContact CD1-CB 4.13Å; L135-E200 WeakPolarHBondContact CD1-O 3.37Å; L135-L203 HydrophobicContact CD1-CB 3.94Å; L135-L203 HydrophobicContact CD1-CD1 4.19Å; L135-I204 HydrophobicContact CD1-CD1 4.41Å; L135-I204 HydrophobicContact CD1-CG1 4Å; L135-I204 HydrophobicContact CD2-CD1 3.76Å; L135-I204 HydrophobicContact CD2-CG1 3.89Å; L135-Y229 PolarHBondContact O-OH 2.7Å
136	F	92.6	Very high	90.8	Very high	7 Å²	7	66.5 Å²	66.5	3%	0.031	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-19.6	-173.4	-57.9	-87	0	0	0	113.9	I130 N133 V134 H138 L139 I147 F172 L203 Y229	I130-F136 HydrophobicContact CB-CB 4.05Å; I130-F136 HydrophobicContact CB-CD2 4.02Å; I130-F136 HydrophobicContact CB-CG 4.01Å; I130-F136 HydrophobicContact CD1-CB 3.71Å; I130-F136 HydrophobicContact CD1-CD1 3.52Å; I130-F136 HydrophobicContact CD1-CD2 4.35Å; I130-F136 HydrophobicContact CD1-CE1 4.17Å; I130-F136 HydrophobicContact CD1-CG 3.61Å; I130-F136 HydrophobicContact CG1-CB 4.04Å; I130-F136 HydrophobicContact CG1-CG 4.23Å; I130-F136 HydrophobicContact CG2-CD2 4.36Å; I130-F136 HydrophobicContact CG2-CE2 4.49Å; N133-F136 HydrophobicContact CB-CD2 3.79Å; N133-F136 PolarHBondContact O-N 2.97Å; V134-F136 VanDerWaalsContact C-N 3.3Å; V134-F136 PolarHBondContact O-N 3.46Å; F136-H138 PolarHBondContact O-N 3.01Å; F136-L139 HydrophobicContact CB-CD1 4.26Å; F136-L139 HydrophobicContact CD1-CD1 3.74Å; F136-L139 HydrophobicContact CG-CD1 4.37Å; F136-L139 PolarHBondContact O-N 3.47Å; F136-I147 HydrophobicContact CE1-CG2 4.01Å; F136-F172 AromaticContact CE2-CD1 3.92Å; F136-F172 HydrophobicContact CE2-CD1 3.92Å; F136-F172 AromaticContact CE2-CE1 3.48Å; F136-F172 HydrophobicContact CE2-CE1 3.48Å; F136-F172 VanDerWaalsContact CE2-CE1 3.48Å; F136-F172 AromaticContact CE2-CZ 3.91Å; F136-F172 HydrophobicContact CE2-CZ 3.91Å; F136-F172 AromaticContact CZ-CD1 3.67Å; F136-F172 HydrophobicContact CZ-CD1 3.67Å; F136-F172 AromaticContact CZ-CE1 3.57Å; F136-F172 HydrophobicContact CZ-CE1 3.57Å; F136-F172 HydrophobicContact CZ-CZ 4.44Å; F136-L203 HydrophobicContact CE2-CD1 4.16Å; F136-L203 HydrophobicContact CZ-CD1 3.63Å; F136-Y229 HydrophobicContact CD1-CE2 4.2Å; F136-Y229 HydrophobicContact CE1-CD2 4.15Å; F136-Y229 AromaticContact CE1-CE2 3.63Å; F136-Y229 HydrophobicContact CE1-CE2 3.63Å; F136-Y229 HydrophobicContact CZ-CD2 4.49Å; F136-Y229 HydrophobicContact CZ-CE2 4.05Å
137	S	89.8	Confident	90.9	Very high	57 Å²	57	66.5 Å²	66.5	40%	0.399	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.5	-176.9	61.9	0	0	0	0	115.2	N133 V134	N133-S137 WeakPolarHBondContact O-CB 3.46Å; N133-S137 PolarHBondContact O-N 2.92Å; N133-S137 PolarHBondContact O-OG 3.38Å; V134-S137 PolarHBondContact O-OG 2.98Å
138	H	89.1	Confident	91	Very high	166 Å²	166	65.4 Å²	65.4	77%	0.769	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	6.7	-178.4	-63.4	-56.2	0	0	0	113.7	F136	F136-H138 PolarHBondContact O-N 3.01Å
139	L	90.1	Very high	91.2	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.094	30%	0.301	C	S	.	.			trans	-81.7	136	179.6	-57.1	-175.8	0	0	0	110.5	F136 E143 R144 I147 L233	F136-L139 HydrophobicContact CB-CD1 4.26Å; F136-L139 HydrophobicContact CD1-CD1 3.74Å; F136-L139 HydrophobicContact CG-CD1 4.37Å; F136-L139 PolarHBondContact O-N 3.47Å; L139-E143 HydrophobicContact CB-CB 4.13Å; L139-R144 PolarHBondContact O-NH2 3.17Å; L139-I147 HydrophobicContact CD1-CD1 3.46Å; L139-I147 VanDerWaalsContact CD1-CD1 3.46Å; L139-L233 HydrophobicContact CD1-CD2 4.37Å; L139-L233 HydrophobicContact CD2-CD1 4.35Å; L139-L233 HydrophobicContact CD2-CD2 3.35Å; L139-L233 HydrophobicContact CD2-CG 4.5Å; L139-L233 HydrophobicContact CG-CD2 4.47Å
140	D	86.6	Confident	91.4	Very high	47 Å²	47	57.6 Å²	57.6	25%	0.251	29%	0.293	S	S	.	.			trans	-70.1	170.7	171.2	79.3	17.3	0	0	0	111.6	N142 E143 R144 K240	D140-N142 VanDerWaalsContact C-N 3.26Å; D140-N142 PolarHBondContact O-N 2.86Å; D140-N142 WeakPolarHBondContact OD1-CA 3.37Å; D140-N142 WeakPolarHBondContact OD1-CB 3.34Å; D140-N142 PolarHBondContact OD1-N 3.49Å; D140-E143 PolarHBondContact N-OE2 3.42Å; D140-E143 PolarHBondContact O-N 2.75Å; D140-E143 WeakPolarHBondContact OD1-CB 3.32Å; D140-E143 WeakPolarHBondContact OD1-CG 3.39Å; D140-E143 PolarHBondContact OD1-N 3.29Å; D140-R144 VanDerWaalsContact O-CB 3.28Å; D140-R144 WeakPolarHBondContact O-CB 3.47Å; D140-R144 PolarHBondContact O-N 2.93Å; D140-K240 WeakPolarHBondContact OD2-CE 3.32Å; D140-K240 IonicContact OD2-NZ 2.95Å; D140-K240 PolarHBondContact OD2-NZ 2.84Å
141	D	86.9	Confident	91.6	Very high	104 Å²	104	57.6 Å²	57.6	56%	0.556	29%	0.293	S	S	*	.	H	α-helix	trans	-65.8	-29.3	-175	-61.8	-35.8	0	0	0	112.8	R144 S145	D141-R144 IonicContact OD1-CZ 2.65Å; D141-R144 IonicContact OD1-NH1 2.75Å; D141-R144 PolarHBondContact OD1-NH1 3.28Å; D141-R144 IonicContact OD1-NH2 3.06Å; D141-R144 PolarHBondContact OD1-NH2 2.71Å; D141-S145 VanDerWaalsContact O-CB 3.29Å; D141-S145 WeakPolarHBondContact O-CB 3.25Å; D141-S145 PolarHBondContact O-N 2.94Å
142	N	88.2	Confident	92	Very high	118 Å²	118	53.9 Å²	53.9	63%	0.631	28%	0.275	S	S	*	.	H	α-helix	trans	-72.2	-47.1	177.4	-64.1	-42.9	0	0	0	110.8	D140 R144 S145 D146	D140-N142 VanDerWaalsContact C-N 3.26Å; D140-N142 PolarHBondContact O-N 2.86Å; D140-N142 WeakPolarHBondContact OD1-CA 3.37Å; D140-N142 WeakPolarHBondContact OD1-CB 3.34Å; D140-N142 PolarHBondContact OD1-N 3.49Å; N142-R144 VanDerWaalsContact C-N 3.32Å; N142-R144 PolarHBondContact O-N 2.77Å; N142-S145 PolarHBondContact O-N 3.32Å; N142-D146 WeakPolarHBondContact O-CB 3.49Å; N142-D146 VanDerWaalsContact O-CG 3.29Å; N142-D146 PolarHBondContact O-N 3.18Å
143	E	92.4	Very high	92.3	Very high	13 Å²	13	47 Å²	47	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-44.8	175.9	-74.5	163.9	171.3	0	0	110.9	L139 D140 D146 I147 L233 S236 K240	L139-E143 HydrophobicContact CB-CB 4.13Å; D140-E143 PolarHBondContact N-OE2 3.42Å; D140-E143 PolarHBondContact O-N 2.75Å; D140-E143 WeakPolarHBondContact OD1-CB 3.32Å; D140-E143 WeakPolarHBondContact OD1-CG 3.39Å; D140-E143 PolarHBondContact OD1-N 3.29Å; E143-D146 PolarHBondContact O-N 2.89Å; E143-I147 WeakPolarHBondContact O-CB 3.34Å; E143-I147 WeakPolarHBondContact O-CD1 3.45Å; E143-I147 WeakPolarHBondContact O-CG1 3.28Å; E143-I147 PolarHBondContact O-N 3.47Å; E143-L233 HydrophobicContact CB-CD2 4.29Å; E143-L233 HydrophobicContact CG-CD2 4.27Å; E143-S236 WeakPolarHBondContact CG-OG 3.42Å; E143-S236 WeakPolarHBondContact OE1-CB 3.41Å; E143-S236 PolarHBondContact OE1-OG 3.22Å; E143-K240 IonicContact OE1-NZ 3.45Å; E143-K240 PolarHBondContact OE1-NZ 2.86Å; E143-K240 IonicContact OE2-NZ 3.96Å; E143-K240 PolarHBondContact OE2-NZ 2.92Å
144	R	92.8	Very high	92.6	Very high	76 Å²	76	48 Å²	48	29%	0.287	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-44.9	177.6	-158.5	-173.7	-50.5	126.2	17.8	111.2	L139 D140 D141 N142 I147 F148	L139-R144 PolarHBondContact O-NH2 3.17Å; D140-R144 VanDerWaalsContact O-CB 3.28Å; D140-R144 WeakPolarHBondContact O-CB 3.47Å; D140-R144 PolarHBondContact O-N 2.93Å; D141-R144 IonicContact OD1-CZ 2.65Å; D141-R144 IonicContact OD1-NH1 2.75Å; D141-R144 PolarHBondContact OD1-NH1 3.28Å; D141-R144 IonicContact OD1-NH2 3.06Å; D141-R144 PolarHBondContact OD1-NH2 2.71Å; N142-R144 VanDerWaalsContact C-N 3.32Å; N142-R144 PolarHBondContact O-N 2.77Å; R144-I147 PolarHBondContact O-N 2.71Å; R144-F148 HydrophobicContact CG-CD2 4.18Å; R144-F148 HydrophobicContact CG-CE2 3.53Å; R144-F148 HydrophobicContact CG-CZ 3.76Å; R144-F148 VanDerWaalsContact O-CD2 3.29Å; R144-F148 WeakPolarHBondContact O-CD2 3.06Å; R144-F148 VanDerWaalsContact O-CG 3.27Å; R144-F148 WeakPolarHBondContact O-CG 3.18Å; R144-F148 PolarHBondContact O-N 2.97Å
145	S	92.1	Very high	92.9	Very high	54 Å²	54	48 Å²	48	38%	0.378	26%	0.259	S	S	.	.	H	α-helix	trans	-63.7	-43.1	176.6	-169.6	0	0	0	0	112.3	D141 N142 I147 F148 D149	D141-S145 VanDerWaalsContact O-CB 3.29Å; D141-S145 WeakPolarHBondContact O-CB 3.25Å; D141-S145 PolarHBondContact O-N 2.94Å; N142-S145 PolarHBondContact O-N 3.32Å; S145-I147 VanDerWaalsContact C-N 3.33Å; S145-I147 PolarHBondContact O-N 3.05Å; S145-F148 PolarHBondContact O-N 3.31Å; S145-D149 WeakPolarHBondContact O-CB 3.31Å; S145-D149 PolarHBondContact O-N 2.95Å
146	D	94	Very high	93.2	Very high	29 Å²	29	49 Å²	49	16%	0.155	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-40.6	179	-76.9	-10.3	0	0	0	111.8	R113 N142 E143 A150 I232	R113-D146 IonicContact CZ-OD1 2.7Å; R113-D146 IonicContact NE-OD1 2.72Å; R113-D146 PolarHBondContact NE-OD1 3.22Å; R113-D146 IonicContact NH2-OD1 2.81Å; R113-D146 PolarHBondContact NH2-OD1 3.49Å; N142-D146 WeakPolarHBondContact O-CB 3.49Å; N142-D146 VanDerWaalsContact O-CG 3.29Å; N142-D146 PolarHBondContact O-N 3.18Å; E143-D146 PolarHBondContact O-N 2.89Å; D146-A150 PolarHBondContact O-N 3.14Å; D146-I232 HydrophobicContact CB-CG2 3.62Å
147	I	95.5	Very high	93.4	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-45.9	175.2	-73.6	163.9	0	0	0	111	F136 L139 E143 R144 S145 D149 A150 M151 Y229 I232 L233	F136-I147 HydrophobicContact CE1-CG2 4.01Å; L139-I147 HydrophobicContact CD1-CD1 3.46Å; L139-I147 VanDerWaalsContact CD1-CD1 3.46Å; E143-I147 WeakPolarHBondContact O-CB 3.34Å; E143-I147 WeakPolarHBondContact O-CD1 3.45Å; E143-I147 WeakPolarHBondContact O-CG1 3.28Å; E143-I147 PolarHBondContact O-N 3.47Å; R144-I147 PolarHBondContact O-N 2.71Å; S145-I147 VanDerWaalsContact C-N 3.33Å; S145-I147 PolarHBondContact O-N 3.05Å; I147-D149 VanDerWaalsContact C-N 3.29Å; I147-D149 PolarHBondContact O-N 3.11Å; I147-A150 PolarHBondContact O-N 3.09Å; I147-A150 VanDerWaalsContact O-N 3.1Å; I147-M151 WeakPolarHBondContact O-CG 3.44Å; I147-M151 PolarHBondContact O-N 3.37Å; I147-M151 VanDerWaalsContact O-N 3.12Å; I147-Y229 HydrophobicContact CD1-CD2 3.87Å; I147-Y229 HydrophobicContact CD1-CE2 3.79Å; I147-Y229 HydrophobicContact CG1-CD2 4.32Å; I147-I232 HydrophobicContact CG1-CB 4.42Å; I147-I232 HydrophobicContact CG1-CD1 4.2Å; I147-I232 HydrophobicContact CG1-CG2 3.94Å; I147-L233 HydrophobicContact CD1-CD2 4.13Å; I147-L233 HydrophobicContact CD1-CG 4.49Å
148	F	94.8	Very high	93.8	Very high	15 Å²	15	53.3 Å²	53.3	7%	0.066	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-39.5	178.2	-71.1	-31.5	0	0	0	112.4	K118 M123 L126 A127 I130 R144 S145 A150 M151	K118-F148 WeakPolarHBondContact CE-O 3.34Å; K118-F148 PolarHBondContact NZ-O 3.14Å; M123-F148 HydrophobicContact CE-CB 4.22Å; M123-F148 HydrophobicContact SD-CB 3.85Å; M123-F148 HydrophobicContact SD-CG 4.41Å; L126-F148 HydrophobicContact CB-CD1 4.16Å; L126-F148 HydrophobicContact CB-CE1 3.81Å; L126-F148 HydrophobicContact CB-CZ 4.25Å; L126-F148 HydrophobicContact CD1-CD1 4.42Å; A127-F148 HydrophobicContact CB-CE2 4.03Å; A127-F148 HydrophobicContact CB-CZ 4.1Å; I130-F148 HydrophobicContact CD1-CD1 4.45Å; I130-F148 HydrophobicContact CD1-CE1 3.27Å; I130-F148 HydrophobicContact CD1-CZ 3.4Å; I130-F148 HydrophobicContact CG1-CE1 4.12Å; I130-F148 HydrophobicContact CG1-CZ 4Å; R144-F148 HydrophobicContact CG-CD2 4.18Å; R144-F148 HydrophobicContact CG-CE2 3.53Å; R144-F148 HydrophobicContact CG-CZ 3.76Å; R144-F148 VanDerWaalsContact O-CD2 3.29Å; R144-F148 WeakPolarHBondContact O-CD2 3.06Å; R144-F148 VanDerWaalsContact O-CG 3.27Å; R144-F148 WeakPolarHBondContact O-CG 3.18Å; R144-F148 PolarHBondContact O-N 2.97Å; S145-F148 PolarHBondContact O-N 3.31Å; F148-A150 VanDerWaalsContact C-N 3.27Å; F148-A150 PolarHBondContact O-N 3.46Å; F148-M151 HydrophobicContact CD1-SD 3.79Å; F148-M151 HydrophobicContact CE1-SD 4.37Å; F148-M151 PolarHBondContact O-N 2.95Å
149	D	95.1	Very high	94.1	Very high	22 Å²	22	48 Å²	48	12%	0.118	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-37.5	175.5	-79.3	-2.1	0	0	0	111.7	R113 K114 V115 I116 K118 M123 S145 I147 M151	R113-D149 IonicContact CZ-OD2 3.89Å; R113-D149 IonicContact NH1-OD2 3.74Å; R113-D149 PolarHBondContact NH1-OD2 3.08Å; R113-D149 IonicContact NH2-OD2 2.96Å; R113-D149 PolarHBondContact NH2-OD2 3.12Å; K114-D149 CarbonylContact O-C 3.55Å; K114-D149 VanDerWaalsContact O-C 3.25Å; V115-D149 HydrophobicContact CG1-CB 4.26Å; V115-D149 HydrophobicContact CG2-CB 4.49Å; I116-D149 WeakPolarHBondContact CB-O 3.34Å; I116-D149 PolarHBondContact N-O 3.43Å; K118-D149 PolarHBondContact NZ-O 3.09Å; M123-D149 VanDerWaalsContact CE-OD1 3.28Å; M123-D149 WeakPolarHBondContact CE-OD1 3.27Å; S145-D149 WeakPolarHBondContact O-CB 3.31Å; S145-D149 PolarHBondContact O-N 2.95Å; I147-D149 VanDerWaalsContact C-N 3.29Å; I147-D149 PolarHBondContact O-N 3.11Å; D149-M151 VanDerWaalsContact C-N 3.34Å; D149-M151 PolarHBondContact O-N 2.68Å
150	A	96.1	Very high	94.4	Very high	1 Å²	1	51 Å²	51	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-75.8	-16.1	178.7	0	0	0	0	0	114.5	K114 D146 I147 F148 F152 I224 I232	K114-A150 HydrophobicContact CB-CB 4.42Å; K114-A150 WeakPolarHBondContact O-CA 3.41Å; K114-A150 PolarHBondContact O-N 3.05Å; D146-A150 PolarHBondContact O-N 3.14Å; I147-A150 PolarHBondContact O-N 3.09Å; I147-A150 VanDerWaalsContact O-N 3.1Å; F148-A150 VanDerWaalsContact C-N 3.27Å; F148-A150 PolarHBondContact O-N 3.46Å; A150-F152 PolarHBondContact O-N 3.3Å; A150-I224 HydrophobicContact CB-CD1 3.8Å; A150-I232 HydrophobicContact CB-CD1 3.72Å
151	M	96.6	Very high	94.9	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.02	30%	0.296	C	S	.	.			trans	-64.6	131.3	179.6	-68.9	-175.4	89.2	0	0	111.9	I116 K118 L126 I147 F148 D149 V174 W222 G223 I224	I116-M151 WeakPolarHBondContact CD1-O 3.46Å; K118-M151 WeakPolarHBondContact CE-O 3.27Å; K118-M151 PolarHBondContact NZ-O 2.74Å; L126-M151 HydrophobicContact CD1-SD 3.96Å; L126-M151 HydrophobicContact CD2-CE 4.13Å; L126-M151 HydrophobicContact CD2-SD 4.16Å; I147-M151 WeakPolarHBondContact O-CG 3.44Å; I147-M151 PolarHBondContact O-N 3.37Å; I147-M151 VanDerWaalsContact O-N 3.12Å; F148-M151 HydrophobicContact CD1-SD 3.79Å; F148-M151 HydrophobicContact CE1-SD 4.37Å; F148-M151 PolarHBondContact O-N 2.95Å; D149-M151 VanDerWaalsContact C-N 3.34Å; D149-M151 PolarHBondContact O-N 2.68Å; M151-V174 HydrophobicContact CE-CB 4.4Å; M151-V174 HydrophobicContact CE-CG2 3.99Å; M151-W222 HydrophobicContact CB-CB 4.46Å; M151-W222 HydrophobicContact CB-CE3 4.2Å; M151-W222 HydrophobicContact CE-CB 3.58Å; M151-W222 WeakPolarHBondContact CE-O 3.35Å; M151-W222 WeakPolarHBondContact O-CZ3 3.34Å; M151-W222 HydrophobicContact SD-CB 4.36Å; M151-G223 CarbonylContact C-O 3.56Å; M151-G223 WeakPolarHBondContact CA-O 3.29Å; M151-I224 HydrophobicContact CG-CB 4.11Å
152	F	96.1	Very high	95.4	Very high	57 Å²	57	47.3 Å²	47.3	25%	0.25	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.4	179.6	58.2	-92.6	0	0	0	112.2	I116 A150 V154 Y173 W222 G223 D225	I116-F152 HydrophobicContact CD1-CB 3.61Å; A150-F152 PolarHBondContact O-N 3.3Å; F152-V154 HydrophobicContact CD2-CG2 3.53Å; F152-V154 HydrophobicContact CE2-CG2 3.49Å; F152-V154 VanDerWaalsContact CE2-CG2 3.49Å; F152-Y173 HydrophobicContact CE2-CE1 4.46Å; F152-W222 VanDerWaalsContact C-CE3 3.4Å; F152-W222 CarbonylContact O-C 3.48Å; F152-W222 WeakPolarHBondContact O-CA 3.2Å; F152-G223 VanDerWaalsContact CD1-O 3.31Å; F152-G223 WeakPolarHBondContact CD1-O 3.37Å; F152-G223 PolarHBondContact N-O 3.03Å; F152-G223 PolarHBondContact O-N 2.96Å; F152-D225 HydrophobicContact CE1-CB 4.49Å
153	S	96.4	Very high	95.7	Very high	56 Å²	56	42.7 Å²	42.7	39%	0.392	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	137.4	179.4	-173.3	0	0	0	0	110.3	L221	S153-L221 CarbonylContact C-O 3.59Å; S153-L221 WeakPolarHBondContact CA-O 3.34Å
154	V	96.3	Very high	95.9	Very high	33 Å²	33	46.6 Å²	46.6	20%	0.2	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.2	171	-165.5	0	0	0	0	109.1	F152 Y156 Y173 L221	F152-V154 HydrophobicContact CD2-CG2 3.53Å; F152-V154 HydrophobicContact CE2-CG2 3.49Å; F152-V154 VanDerWaalsContact CE2-CG2 3.49Å; V154-Y156 HydrophobicContact CB-CE2 4.1Å; V154-Y156 HydrophobicContact CG1-CD2 4.1Å; V154-Y156 HydrophobicContact CG1-CE2 3.33Å; V154-Y173 HydrophobicContact CG2-CE1 4.33Å; V154-L221 PolarHBondContact N-O 3.47Å; V154-L221 PolarHBondContact O-N 2.66Å
155	T	97.5	Very high	96	Very high	101 Å²	101	45.7 Å²	45.7	62%	0.62	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.9	179.3	52.1	0	0	0	0	110.2	V219 K220	T155-V219 WeakPolarHBondContact CA-O 3.29Å; T155-K220 HydrophobicContact CG2-CB 4.25Å; T155-K220 HydrophobicContact CG2-CG 4.04Å
156	Y	97.6	Very high	96.1	Very high	51 Å²	51	45.3 Å²	45.3	20%	0.2	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147	175.2	-64.2	-89.1	0	0	0	110	V154 E160 I162 N218 V219 L221	V154-Y156 HydrophobicContact CB-CE2 4.1Å; V154-Y156 HydrophobicContact CG1-CD2 4.1Å; V154-Y156 HydrophobicContact CG1-CE2 3.33Å; Y156-E160 WeakPolarHBondContact CA-OE2 3.38Å; Y156-E160 WeakPolarHBondContact CB-OE2 3.48Å; Y156-E160 HydrophobicContact CD1-CB 4.15Å; Y156-E160 WeakPolarHBondContact CD1-OE2 3.5Å; Y156-I162 HydrophobicContact CD1-CG1 4.41Å; Y156-I162 HydrophobicContact CD2-CG1 3.76Å; Y156-I162 HydrophobicContact CD2-CG2 4.33Å; Y156-I162 HydrophobicContact CE2-CB 4.31Å; Y156-I162 HydrophobicContact CE2-CG1 4.04Å; Y156-I162 HydrophobicContact CE2-CG2 3.79Å; Y156-I162 HydrophobicContact CG-CG1 3.95Å; Y156-N218 WeakPolarHBondContact O-CA 3.48Å; Y156-V219 HydrophobicContact CD2-CG2 4.35Å; Y156-V219 PolarHBondContact N-O 2.97Å; Y156-V219 PolarHBondContact O-N 2.74Å; Y156-L221 HydrophobicContact CD2-CD1 4.02Å; Y156-L221 HydrophobicContact CE2-CD1 4.05Å
157	I	97.9	Very high	96	Very high	99 Å²	99	47.8 Å²	47.8	51%	0.508	28%	0.284	S	S	.	.			trans	-86.5	159.3	173.3	58.9	165.5	0	0	0	110.8	G159 E160 A215 N218	I157-G159 PolarHBondContact O-N 3.04Å; I157-E160 HydrophobicContact CD1-CG 4.46Å; I157-E160 HydrophobicContact CG1-CG 3.68Å; I157-E160 WeakPolarHBondContact CG1-OE1 3.25Å; I157-E160 PolarHBondContact N-OE2 2.71Å; I157-E160 WeakPolarHBondContact O-CB 3.42Å; I157-E160 PolarHBondContact O-N 3.32Å; I157-E160 VanDerWaalsContact O-N 3.13Å; I157-A215 WeakPolarHBondContact O-CB 3.45Å; I157-N218 WeakPolarHBondContact CA-OD1 3.32Å
158	A	97.8	Very high	95.7	Very high	54 Å²	54	54 Å²	54	45%	0.446	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	131.9	178.1	0	0	0	0	0	111.8	T217 N218	A158-T217 WeakPolarHBondContact CA-O 3.31Å; A158-N218 PolarHBondContact N-OD1 3.2Å
159	G	94.9	Very high	95.2	Very high	56 Å²	56	53.2 Å²	53.2	58%	0.577	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	93	-15.6	-178	0	0	0	0	0	115.1	I157 A215	I157-G159 PolarHBondContact O-N 3.04Å; G159-A215 WeakPolarHBondContact CA-O 3.43Å; G159-A215 PolarHBondContact N-O 3.23Å
160	E	97.4	Very high	94.9	Very high	81 Å²	81	55.9 Å²	55.9	38%	0.379	32%	0.324	S	S	.	.			trans	-70.7	146.8	179.6	-78.4	-179.2	161.3	0	0	112.7	Y156 I157 R214 A215	Y156-E160 WeakPolarHBondContact CA-OE2 3.38Å; Y156-E160 WeakPolarHBondContact CB-OE2 3.48Å; Y156-E160 HydrophobicContact CD1-CB 4.15Å; Y156-E160 WeakPolarHBondContact CD1-OE2 3.5Å; I157-E160 HydrophobicContact CD1-CG 4.46Å; I157-E160 HydrophobicContact CG1-CG 3.68Å; I157-E160 WeakPolarHBondContact CG1-OE1 3.25Å; I157-E160 PolarHBondContact N-OE2 2.71Å; I157-E160 WeakPolarHBondContact O-CB 3.42Å; I157-E160 PolarHBondContact O-N 3.32Å; I157-E160 VanDerWaalsContact O-N 3.13Å; E160-R214 CarbonylContact O-C 3.25Å; E160-R214 VanDerWaalsContact O-CA 3.28Å; E160-R214 WeakPolarHBondContact O-CA 3.48Å; E160-A215 PolarHBondContact O-N 3.32Å
161	T	97	Very high	94.8	Very high	60 Å²	60	57.4 Å²	57.4	37%	0.368	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.4	175.1	-59.7	0	0	0	0	109.5	I163 M164 T212 R214	T161-I163 WeakPolarHBondContact CG2-O 3.16Å; T161-M164 HydrophobicContact CG2-CB 4.36Å; T161-T212 HydrophobicContact CG2-CG2 3.74Å; T161-R214 HydrophobicContact CG2-CG 4.44Å; T161-R214 PolarHBondContact OG1-NE 2.95Å
162	I	96	Very high	94.8	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.067	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-47.1	-178.5	-60	154.7	0	0	0	110.1	Y156 Y173 T180 F198 V213 A215 V219 L221	Y156-I162 HydrophobicContact CD1-CG1 4.41Å; Y156-I162 HydrophobicContact CD2-CG1 3.76Å; Y156-I162 HydrophobicContact CD2-CG2 4.33Å; Y156-I162 HydrophobicContact CE2-CB 4.31Å; Y156-I162 HydrophobicContact CE2-CG1 4.04Å; Y156-I162 HydrophobicContact CE2-CG2 3.79Å; Y156-I162 HydrophobicContact CG-CG1 3.95Å; I162-Y173 HydrophobicContact CG2-CE2 4.49Å; I162-T180 HydrophobicContact CD1-CG2 3.51Å; I162-F198 HydrophobicContact CD1-CZ 4.36Å; I162-F198 HydrophobicContact CG2-CE2 4.11Å; I162-F198 HydrophobicContact CG2-CZ 3.99Å; I162-V213 HydrophobicContact CD1-CG1 4.08Å; I162-V213 PolarHBondContact N-O 3.03Å; I162-A215 HydrophobicContact CD1-CB 4.33Å; I162-V219 HydrophobicContact CD1-CG2 4.14Å; I162-L221 HydrophobicContact CD1-CD1 4.03Å; I162-L221 HydrophobicContact CG1-CD1 4.28Å; I162-L221 HydrophobicContact CG2-CD1 3.71Å
163	I	95.6	Very high	94.8	Very high	20 Å²	20	55.2 Å²	55.2	10%	0.103	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146.3	172.8	54.1	164.9	0	0	0	109.3	T161 Y173 F198 R209 T212 V213	T161-I163 WeakPolarHBondContact CG2-O 3.16Å; I163-Y173 HydrophobicContact CG2-CD2 4.47Å; I163-Y173 HydrophobicContact CG2-CE2 3.92Å; I163-F198 HydrophobicContact CD1-CD2 3.85Å; I163-F198 HydrophobicContact CD1-CE2 4.09Å; I163-F198 HydrophobicContact CG1-CD2 4.42Å; I163-F198 HydrophobicContact CG1-CE2 4.19Å; I163-R209 HydrophobicContact CB-CG 4.33Å; I163-R209 HydrophobicContact CD1-CG 4.24Å; I163-T212 CarbonylContact O-C 3.57Å; I163-T212 VanDerWaalsContact O-CA 3.3Å; I163-T212 WeakPolarHBondContact O-CA 3.3Å; I163-T212 WeakPolarHBondContact O-CG2 3.34Å; I163-V213 HydrophobicContact CD1-CB 4.29Å; I163-V213 HydrophobicContact CD1-CG2 3.7Å; I163-V213 HydrophobicContact CG1-CB 3.67Å; I163-V213 HydrophobicContact CG1-CG2 3.64Å; I163-V213 PolarHBondContact N-O 2.93Å; I163-V213 PolarHBondContact O-N 2.95Å
164	M	95.8	Very high	94.8	Very high	96 Å²	96	52.7 Å²	52.7	47%	0.473	30%	0.304	S	S	.	.			trans	-111.2	138	179.9	-171.1	171.3	64.1	0	0	110.7	T161 G166 D167 R209	T161-M164 HydrophobicContact CG2-CB 4.36Å; M164-G166 PolarHBondContact O-N 3.31Å; M164-D167 WeakPolarHBondContact CB-OD2 3.3Å; M164-D167 WeakPolarHBondContact CE-OD1 3.16Å; M164-D167 WeakPolarHBondContact CE-OD2 3.44Å; M164-D167 WeakPolarHBondContact O-CB 3.4Å; M164-D167 PolarHBondContact O-N 3.5Å; M164-R209 WeakPolarHBondContact O-CB 3.44Å
165	Q	95.5	Very high	94.8	Very high	56 Å²	56	51.2 Å²	51.2	26%	0.262	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	133.3	176.7	-174.4	178.9	-8.4	0	0	110.6	D167 N185 R209 A210 T212	Q165-D167 VanDerWaalsContact C-N 3.34Å; Q165-N185 PolarHBondContact NE2-OD1 3.12Å; Q165-R209 WeakPolarHBondContact CA-O 3.49Å; Q165-R209 WeakPolarHBondContact CG-O 3.28Å; Q165-A210 PolarHBondContact NE2-O 2.83Å; Q165-T212 WeakPolarHBondContact CB-OG1 3.43Å; Q165-T212 PolarHBondContact N-OG1 3.15Å
166	G	93.2	Very high	94.7	Very high	47 Å²	47	48.1 Å²	48.1	49%	0.485	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-21.9	-178.3	0	0	0	0	0	114.3	M164 R209	M164-G166 PolarHBondContact O-N 3.31Å; G166-R209 PolarHBondContact N-O 3.24Å
167	D	92.3	Very high	94.5	Very high	80 Å²	80	51.3 Å²	51.3	43%	0.428	29%	0.292	S	S	.	.	S	Bend	trans	-69.3	148.8	176.5	-72.2	-2.8	0	0	0	111	M164 Q165 G169 P208 R209	M164-D167 WeakPolarHBondContact CB-OD2 3.3Å; M164-D167 WeakPolarHBondContact CE-OD1 3.16Å; M164-D167 WeakPolarHBondContact CE-OD2 3.44Å; M164-D167 WeakPolarHBondContact O-CB 3.4Å; M164-D167 PolarHBondContact O-N 3.5Å; Q165-D167 VanDerWaalsContact C-N 3.34Å; D167-G169 PolarHBondContact O-N 3.37Å; D167-P208 CarbonylContact O-C 3.53Å; D167-P208 VanDerWaalsContact O-CA 3.25Å; D167-P208 WeakPolarHBondContact O-CA 3.4Å; D167-R209 WeakPolarHBondContact O-CG 3.31Å; D167-R209 PolarHBondContact O-N 2.9Å
168	E	89.3	Confident	94.4	Very high	131 Å²	131	47 Å²	47	61%	0.612	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	124.8	173.1	-167	164.8	-170	0	0	110.1
169	G	84.5	Confident	94.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.2	-176.8	0	0	0	0	0	112.4	D167 A202 T207 R226	D167-G169 PolarHBondContact O-N 3.37Å; G169-A202 WeakPolarHBondContact O-CB 3.29Å; G169-T207 PolarHBondContact N-O 3.27Å; G169-R226 PolarHBondContact O-NH2 2.68Å
170	D	88.9	Confident	94.6	Very high	77 Å²	77	45.1 Å²	45.1	41%	0.412	24%	0.239	S	C	.	.			trans	-109.7	-14.9	179.6	-60.4	-29.9	0	0	0	114.6	R226	D170-R226 PolarHBondContact O-N 3.32Å; D170-R226 IonicContact OD1-CZ 2.61Å; D170-R226 IonicContact OD1-NH2 3.67Å; D170-R226 PolarHBondContact OD1-NH2 3.47Å; D170-R226 VanDerWaalsContact OD1-NH2 3.17Å
171	N	94.4	Very high	94.6	Very high	34 Å²	34	42.4 Å²	42.4	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	148	-174.4	-59.2	-26	0	0	0	112.2	Y173 R209 I224 D225	N171-Y173 HydrophobicContact CB-CD2 4.49Å; N171-Y173 HydrophobicContact CB-CE1 4.12Å; N171-Y173 HydrophobicContact CB-CE2 3.78Å; N171-Y173 PolarHBondContact ND2-OH 3.43Å; N171-R209 PolarHBondContact O-NH1 2.96Å; N171-R209 PolarHBondContact O-NH2 3.06Å; N171-I224 VanDerWaalsContact CA-O 3.31Å; N171-I224 WeakPolarHBondContact CA-O 3.48Å; N171-D225 WeakPolarHBondContact OD1-CA 3.32Å; N171-D225 WeakPolarHBondContact OD1-CB 3.37Å
172	F	95.9	Very high	94.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.7	164.1	166.3	-114.3	0	0	0	109.4	I130 F136 V174 S197 F198 E200 L203 G223 I224	I130-F172 HydrophobicContact CG2-CE1 4.01Å; I130-F172 HydrophobicContact CG2-CZ 4.16Å; F136-F172 AromaticContact CE2-CD1 3.92Å; F136-F172 HydrophobicContact CE2-CD1 3.92Å; F136-F172 AromaticContact CE2-CE1 3.48Å; F136-F172 HydrophobicContact CE2-CE1 3.48Å; F136-F172 VanDerWaalsContact CE2-CE1 3.48Å; F136-F172 AromaticContact CE2-CZ 3.91Å; F136-F172 HydrophobicContact CE2-CZ 3.91Å; F136-F172 AromaticContact CZ-CD1 3.67Å; F136-F172 HydrophobicContact CZ-CD1 3.67Å; F136-F172 AromaticContact CZ-CE1 3.57Å; F136-F172 HydrophobicContact CZ-CE1 3.57Å; F136-F172 HydrophobicContact CZ-CZ 4.44Å; F172-V174 HydrophobicContact CD1-CG2 4.38Å; F172-V174 HydrophobicContact CE1-CG2 3.54Å; F172-V174 HydrophobicContact CZ-CG2 3.76Å; F172-S197 VanDerWaalsContact CZ-CB 3.46Å; F172-F198 VanDerWaalsContact CD2-O 3.29Å; F172-F198 WeakPolarHBondContact CD2-O 3.5Å; F172-E200 VanDerWaalsContact CD2-CA 3.49Å; F172-E200 HydrophobicContact CD2-CB 3.87Å; F172-E200 HydrophobicContact CE2-CB 3.93Å; F172-L203 HydrophobicContact CB-CD1 3.6Å; F172-L203 HydrophobicContact CB-CD2 3.79Å; F172-L203 HydrophobicContact CB-CG 3.62Å; F172-L203 HydrophobicContact CD1-CD1 4.06Å; F172-L203 HydrophobicContact CG-CD1 3.97Å; F172-L203 HydrophobicContact CG-CG 4.46Å; F172-G223 CarbonylContact O-C 3.56Å; F172-G223 WeakPolarHBondContact O-CA 3.38Å; F172-I224 HydrophobicContact CB-CG2 4.04Å; F172-I224 HydrophobicContact CD1-CG2 3.83Å; F172-I224 HydrophobicContact CG-CG2 4.44Å; F172-I224 PolarHBondContact N-O 3.26Å; F172-I224 PolarHBondContact O-N 2.86Å
173	Y	96.4	Very high	94.6	Very high	15 Å²	15	42.2 Å²	42.2	6%	0.059	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.3	-178	-61.1	-75	0	0	0	112.2	F152 V154 I162 I163 N171 S197 F198 L221 W222	F152-Y173 HydrophobicContact CE2-CE1 4.46Å; V154-Y173 HydrophobicContact CG2-CE1 4.33Å; I162-Y173 HydrophobicContact CG2-CE2 4.49Å; I163-Y173 HydrophobicContact CG2-CD2 4.47Å; I163-Y173 HydrophobicContact CG2-CE2 3.92Å; N171-Y173 HydrophobicContact CB-CD2 4.49Å; N171-Y173 HydrophobicContact CB-CE1 4.12Å; N171-Y173 HydrophobicContact CB-CE2 3.78Å; N171-Y173 PolarHBondContact ND2-OH 3.43Å; Y173-S197 CarbonylContact O-C 3.58Å; Y173-S197 VanDerWaalsContact O-CA 3.27Å; Y173-S197 WeakPolarHBondContact O-CA 3.16Å; Y173-S197 WeakPolarHBondContact O-CB 3.44Å; Y173-F198 HydrophobicContact CD2-CD2 4.34Å; Y173-F198 AromaticContact CD2-CE2 3.65Å; Y173-F198 HydrophobicContact CD2-CE2 3.65Å; Y173-F198 HydrophobicContact CD2-CZ 4.24Å; Y173-F198 HydrophobicContact CG-CE2 4.12Å; Y173-F198 HydrophobicContact CG-CZ 4.29Å; Y173-F198 PolarHBondContact N-O 3.13Å; Y173-F198 VanDerWaalsContact N-O 3.1Å; Y173-F198 PolarHBondContact O-N 2.92Å; Y173-L221 HydrophobicContact CD1-CB 4.42Å; Y173-L221 HydrophobicContact CD1-CD1 4.46Å; Y173-L221 HydrophobicContact CG-CD1 4.49Å; Y173-W222 CarbonylContact C-O 3.58Å; Y173-W222 WeakPolarHBondContact CA-O 3.16Å
174	V	96.7	Very high	94.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.1	171.1	-177.5	0	0	0	0	108.9	L126 A129 I130 M151 F172 D176 L221 W222	L126-V174 HydrophobicContact CD2-CB 3.98Å; L126-V174 HydrophobicContact CD2-CG1 3.86Å; L126-V174 HydrophobicContact CD2-CG2 4.47Å; A129-V174 HydrophobicContact CB-CG1 3.52Å; I130-V174 HydrophobicContact CG2-CG2 3.93Å; M151-V174 HydrophobicContact CE-CB 4.4Å; M151-V174 HydrophobicContact CE-CG2 3.99Å; F172-V174 HydrophobicContact CD1-CG2 4.38Å; F172-V174 HydrophobicContact CE1-CG2 3.54Å; F172-V174 HydrophobicContact CZ-CG2 3.76Å; V174-D176 PolarHBondContact O-N 2.91Å; V174-L221 CarbonylContact O-C 3.54Å; V174-L221 VanDerWaalsContact O-CA 3.27Å; V174-L221 WeakPolarHBondContact O-CA 3.28Å; V174-W222 PolarHBondContact N-O 3.42Å; V174-W222 PolarHBondContact O-N 3.49Å
175	I	96.2	Very high	94.6	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	112.1	-178.4	-53.4	177	0	0	0	109.6	G178 T180 I192 G195 G196 F198 L221	I175-G178 WeakPolarHBondContact CG2-O 3.46Å; I175-T180 HydrophobicContact CD1-CG2 3.96Å; I175-T180 WeakPolarHBondContact CD1-OG1 3.42Å; I175-I192 HydrophobicContact CD1-CB 3.91Å; I175-I192 HydrophobicContact CD1-CG2 3.63Å; I175-I192 WeakPolarHBondContact CD1-O 3.29Å; I175-G195 PolarHBondContact O-N 3.08Å; I175-G196 PolarHBondContact N-O 2.97Å; I175-F198 HydrophobicContact CD1-CD1 4.44Å; I175-F198 HydrophobicContact CD1-CE1 4.13Å; I175-F198 HydrophobicContact CG1-CD1 4.48Å; I175-F198 HydrophobicContact CG1-CE1 3.98Å; I175-L221 HydrophobicContact CB-CD2 4Å; I175-L221 HydrophobicContact CG1-CD2 3.64Å; I175-L221 HydrophobicContact CG2-CD2 4.13Å
176	D	94.5	Very high	94.4	Very high	36 Å²	36	48.9 Å²	48.9	19%	0.193	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-41	175.3	-167.5	44.7	0	0	0	111	V174 K220 W222	V174-D176 PolarHBondContact O-N 2.91Å; D176-K220 WeakPolarHBondContact CA-O 3.5Å; D176-K220 HydrophobicContact CB-CB 4.4Å; D176-K220 HydrophobicContact CB-CG 4.28Å; D176-K220 WeakPolarHBondContact CB-O 3.47Å; D176-K220 PolarHBondContact N-O 3.47Å; D176-K220 WeakPolarHBondContact OD2-CD 3.32Å; D176-K220 VanDerWaalsContact OD2-CE 3.3Å; D176-K220 WeakPolarHBondContact OD2-CE 3.43Å; D176-K220 IonicContact OD2-NZ 2.75Å; D176-K220 PolarHBondContact OD2-NZ 3.36Å; D176-W222 PolarHBondContact OD2-NE1 3.09Å
177	Q	95.2	Very high	94.5	Very high	119 Å²	119	53.6 Å²	53.6	56%	0.556	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.1	-179.4	-170.3	-179.7	1	0	0	111.2	E194 V219 K220	Q177-E194 WeakPolarHBondContact CA-OE1 3.21Å; Q177-V219 VanDerWaalsContact O-CA 3.23Å; Q177-V219 WeakPolarHBondContact O-CA 3.12Å; Q177-K220 HydrophobicContact CB-CB 4.11Å; Q177-K220 PolarHBondContact N-O 2.93Å; Q177-K220 VanDerWaalsContact N-O 3.13Å; Q177-K220 PolarHBondContact O-N 2.92Å
178	G	95.8	Very high	94.7	Very high	9 Å²	9	56.7 Å²	56.7	9%	0.093	28%	0.277	C	S	.	.	S	Bend	trans	91	-173	174.6	0	0	0	0	0	115.1	I175 E194 T217	I175-G178 WeakPolarHBondContact CG2-O 3.46Å; G178-E194 PolarHBondContact N-OE1 3.29Å; G178-E194 PolarHBondContact O-N 2.97Å; G178-T217 VanDerWaalsContact CA-OG1 3.23Å; G178-T217 WeakPolarHBondContact CA-OG1 3.16Å
179	E	97.3	Very high	95	Very high	70 Å²	70	54.4 Å²	54.4	33%	0.327	27%	0.272	S	S	.	.			trans	-124.7	150.1	-178.4	-65.3	-172.8	176.5	0	0	112.2	K216 T217 V219	E179-K216 HydrophobicContact CB-CB 4.21Å; E179-K216 HydrophobicContact CB-CD 4.19Å; E179-K216 WeakPolarHBondContact O-CB 3.46Å; E179-K216 PolarHBondContact O-N 3.3Å; E179-K216 WeakPolarHBondContact OE2-CD 3.44Å; E179-K216 IonicContact OE2-NZ 2.79Å; E179-K216 PolarHBondContact OE2-NZ 3.03Å; E179-T217 PolarHBondContact N-OG1 3.1Å; E179-T217 PolarHBondContact O-N 2.99Å; E179-V219 WeakPolarHBondContact O-CG1 3.35Å
180	T	97.9	Very high	95.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.2	175.8	61.2	0	0	0	0	111.2	I162 I175 N191 I192 V213 R214 V219	I162-T180 HydrophobicContact CD1-CG2 3.51Å; I175-T180 HydrophobicContact CD1-CG2 3.96Å; I175-T180 WeakPolarHBondContact CD1-OG1 3.42Å; T180-N191 CarbonylContact O-C 3.52Å; T180-N191 WeakPolarHBondContact O-CA 3.31Å; T180-N191 WeakPolarHBondContact O-CB 3.08Å; T180-I192 PolarHBondContact N-O 3.11Å; T180-I192 PolarHBondContact O-N 2.95Å; T180-I192 PolarHBondContact OG1-O 3.39Å; T180-V213 HydrophobicContact CG2-CG1 4.21Å; T180-R214 CarbonylContact C-O 3.47Å; T180-R214 WeakPolarHBondContact CA-O 3.28Å; T180-R214 WeakPolarHBondContact CB-O 3.17Å; T180-V219 HydrophobicContact CG2-CG1 3.97Å
181	D	97.9	Very high	96	Very high	23 Å²	23	56.8 Å²	56.8	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137.8	173	-77.9	-44.4	0	0	0	110.3	Y183 W188 N191 V213 R214 K216	D181-Y183 HydrophobicContact CB-CD2 4.48Å; D181-Y183 HydrophobicContact CB-CE2 3.59Å; D181-W188 PolarHBondContact OD1-NE1 3.29Å; D181-N191 WeakPolarHBondContact OD1-CB 3.41Å; D181-V213 WeakPolarHBondContact O-CA 3.18Å; D181-R214 PolarHBondContact N-O 3.13Å; D181-R214 PolarHBondContact O-N 3.04Å; D181-K216 WeakPolarHBondContact OD2-CG 3.43Å
182	V	97.7	Very high	96.1	Very high	15 Å²	15	56.9 Å²	56.9	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.1	-177.9	-174	0	0	0	0	109.7	V189 T190 I192 A211 V213	V182-V189 PolarHBondContact O-N 3.31Å; V182-T190 HydrophobicContact CB-CG2 3.98Å; V182-T190 WeakPolarHBondContact CB-O 3.16Å; V182-T190 HydrophobicContact CG2-CG2 4.05Å; V182-T190 PolarHBondContact N-O 3.19Å; V182-I192 HydrophobicContact CG2-CD1 3.68Å; V182-I192 HydrophobicContact CG2-CG1 3.84Å; V182-A211 HydrophobicContact CG1-CB 3.62Å; V182-V213 HydrophobicContact CG1-CG2 4.5Å; V182-V213 HydrophobicContact CG2-CG2 4.29Å
183	Y	96.6	Very high	96	Very high	55 Å²	55	58 Å²	58	22%	0.216	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.1	-179.3	-58.1	-97.1	0	0	0	110.8	D181 E187 W188 A211 T212 R214	D181-Y183 HydrophobicContact CB-CD2 4.48Å; D181-Y183 HydrophobicContact CB-CE2 3.59Å; Y183-E187 CarbonylContact C-O 3.47Å; Y183-E187 WeakPolarHBondContact CA-O 3.42Å; Y183-W188 HydrophobicContact CD1-CB 3.93Å; Y183-W188 HydrophobicContact CE1-CB 3.76Å; Y183-W188 AromaticContact CE1-CD1 3.97Å; Y183-W188 HydrophobicContact CE1-CG 4.3Å; Y183-W188 AromaticContact CZ-CD1 4Å; Y183-A211 CarbonylContact O-C 3.5Å; Y183-A211 VanDerWaalsContact O-CA 3.3Å; Y183-A211 WeakPolarHBondContact O-CA 3.28Å; Y183-A211 WeakPolarHBondContact O-CB 3.41Å; Y183-T212 PolarHBondContact N-O 3.34Å; Y183-T212 PolarHBondContact O-N 2.8Å; Y183-R214 HydrophobicContact CD2-CG 4.28Å; Y183-R214 HydrophobicContact CE2-CB 4.09Å; Y183-R214 HydrophobicContact CE2-CG 4.06Å
184	V	95.8	Very high	95.8	Very high	48 Å²	48	63.4 Å²	63.4	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.1	174.6	179.8	0	0	0	0	108.2	N186 E187 V189 A211	V184-N186 PolarHBondContact O-N 3.31Å; V184-E187 PolarHBondContact N-O 2.75Å; V184-E187 PolarHBondContact O-N 3.07Å; V184-V189 HydrophobicContact CB-CG2 3.75Å; V184-V189 HydrophobicContact CG2-CG2 3.69Å; V184-A211 HydrophobicContact CG2-CB 3.75Å
185	N	93.7	Very high	95.6	Very high	119 Å²	119	65.2 Å²	65.2	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	39.2	-173.6	-51.5	-39.7	0	0	0	112.2	Q165 E187	Q165-N185 PolarHBondContact NE2-OD1 3.12Å; N185-E187 PolarHBondContact O-N 3.46Å
186	N	91.4	Very high	95.5	Very high	145 Å²	145	66 Å²	66	78%	0.775	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	7.8	-176.1	-60	11.3	0	0	0	115.6	V184	V184-N186 PolarHBondContact O-N 3.31Å
187	E	95.4	Very high	95.5	Very high	146 Å²	146	65.8 Å²	65.8	68%	0.682	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	135.4	171.6	-63.9	-174	161.8	0	0	110.1	Y183 V184 N185 V189	Y183-E187 CarbonylContact C-O 3.47Å; Y183-E187 WeakPolarHBondContact CA-O 3.42Å; V184-E187 PolarHBondContact N-O 2.75Å; V184-E187 PolarHBondContact O-N 3.07Å; N185-E187 PolarHBondContact O-N 3.46Å; E187-V189 PolarHBondContact O-N 2.74Å
188	W	96.8	Very high	95.5	Very high	145 Å²	145	60.8 Å²	60.8	55%	0.549	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.7	175	179.2	90	0	0	0	109.8	D181 Y183	D181-W188 PolarHBondContact OD1-NE1 3.29Å; Y183-W188 HydrophobicContact CD1-CB 3.93Å; Y183-W188 HydrophobicContact CE1-CB 3.76Å; Y183-W188 AromaticContact CE1-CD1 3.97Å; Y183-W188 HydrophobicContact CE1-CG 4.3Å; Y183-W188 AromaticContact CZ-CD1 4Å
189	V	96.2	Very high	95.3	Very high	83 Å²	83	61.5 Å²	61.5	50%	0.503	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-49.4	-176.8	179.5	0	0	0	0	111.7	V182 V184 E187	V182-V189 PolarHBondContact O-N 3.31Å; V184-V189 HydrophobicContact CB-CG2 3.75Å; V184-V189 HydrophobicContact CG2-CG2 3.69Å; E187-V189 PolarHBondContact O-N 2.74Å
190	T	96.9	Very high	95	Very high	63 Å²	63	62 Å²	62	39%	0.387	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	166	-176.2	-169.5	0	0	0	0	110.5	V182	V182-T190 HydrophobicContact CB-CG2 3.98Å; V182-T190 WeakPolarHBondContact CB-O 3.16Å; V182-T190 HydrophobicContact CG2-CG2 4.05Å; V182-T190 PolarHBondContact N-O 3.19Å
191	N	96.6	Very high	94.6	Very high	63 Å²	63	65.6 Å²	65.6	34%	0.337	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	156.9	163.5	79.4	-50	0	0	0	111.4	T180 D181	T180-N191 CarbonylContact O-C 3.52Å; T180-N191 WeakPolarHBondContact O-CA 3.31Å; T180-N191 WeakPolarHBondContact O-CB 3.08Å; D181-N191 WeakPolarHBondContact OD1-CB 3.41Å
192	I	96.4	Very high	94.2	Very high	37 Å²	37	64.5 Å²	64.5	19%	0.19	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.6	173.2	-50.2	175.5	0	0	0	107.7	I175 T180 V182 F198	I175-I192 HydrophobicContact CD1-CB 3.91Å; I175-I192 HydrophobicContact CD1-CG2 3.63Å; I175-I192 WeakPolarHBondContact CD1-O 3.29Å; T180-I192 PolarHBondContact N-O 3.11Å; T180-I192 PolarHBondContact O-N 2.95Å; T180-I192 PolarHBondContact OG1-O 3.39Å; V182-I192 HydrophobicContact CG2-CD1 3.68Å; V182-I192 HydrophobicContact CG2-CG1 3.84Å; I192-F198 HydrophobicContact CD1-CB 4.11Å; I192-F198 HydrophobicContact CD1-CD1 4.24Å
193	G	94.6	Very high	94	Very high	24 Å²	24	63.9 Å²	63.9	25%	0.247	35%	0.349	C	S	.	.			trans	-99.4	-169	179.1	0	0	0	0	0	113.9	G196	G193-G196 PolarHBondContact O-N 2.96Å
194	E	93.3	Very high	93.7	Very high	128 Å²	128	64.9 Å²	64.9	60%	0.598	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	136.2	-179.5	-61.1	-174	168.4	0	0	112.8	Q177 G178 G196	Q177-E194 WeakPolarHBondContact CA-OE1 3.21Å; G178-E194 PolarHBondContact N-OE1 3.29Å; G178-E194 PolarHBondContact O-N 2.97Å; E194-G196 PolarHBondContact O-N 2.74Å
195	G	91	Very high	93.3	Very high	39 Å²	39	64.6 Å²	64.6	40%	0.402	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-4.2	-174.6	0	0	0	0	0	114.6	A129 I175	A129-G195 VanDerWaalsContact CB-O 3.26Å; A129-G195 WeakPolarHBondContact CB-O 3.4Å; I175-G195 PolarHBondContact O-N 3.08Å
196	G	93.9	Very high	92.8	Very high	20 Å²	20	60.2 Å²	60.2	21%	0.206	33%	0.334	C	S	.	.			trans	-78.1	161.4	169.9	0	0	0	0	0	112.6	I175 G193 E194	I175-G196 PolarHBondContact N-O 2.97Å; G193-G196 PolarHBondContact O-N 2.96Å; E194-G196 PolarHBondContact O-N 2.74Å
197	S	94.9	Very high	92.4	Very high	30 Å²	30	54.4 Å²	54.4	21%	0.21	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	155.5	-179.6	66.7	0	0	0	0	112	F172 Y173	F172-S197 VanDerWaalsContact CZ-CB 3.46Å; Y173-S197 CarbonylContact O-C 3.58Å; Y173-S197 VanDerWaalsContact O-CA 3.27Å; Y173-S197 WeakPolarHBondContact O-CA 3.16Å; Y173-S197 WeakPolarHBondContact O-CB 3.44Å
198	F	94.6	Very high	92.2	Very high	15 Å²	15	51.8 Å²	51.8	7%	0.066	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155	176.8	56.3	-91.5	0	0	0	112.5	I162 I163 F172 Y173 I175 I192 V213 L221	I162-F198 HydrophobicContact CD1-CZ 4.36Å; I162-F198 HydrophobicContact CG2-CE2 4.11Å; I162-F198 HydrophobicContact CG2-CZ 3.99Å; I163-F198 HydrophobicContact CD1-CD2 3.85Å; I163-F198 HydrophobicContact CD1-CE2 4.09Å; I163-F198 HydrophobicContact CG1-CD2 4.42Å; I163-F198 HydrophobicContact CG1-CE2 4.19Å; F172-F198 VanDerWaalsContact CD2-O 3.29Å; F172-F198 WeakPolarHBondContact CD2-O 3.5Å; Y173-F198 HydrophobicContact CD2-CD2 4.34Å; Y173-F198 AromaticContact CD2-CE2 3.65Å; Y173-F198 HydrophobicContact CD2-CE2 3.65Å; Y173-F198 HydrophobicContact CD2-CZ 4.24Å; Y173-F198 HydrophobicContact CG-CE2 4.12Å; Y173-F198 HydrophobicContact CG-CZ 4.29Å; Y173-F198 PolarHBondContact N-O 3.13Å; Y173-F198 VanDerWaalsContact N-O 3.1Å; Y173-F198 PolarHBondContact O-N 2.92Å; I175-F198 HydrophobicContact CD1-CD1 4.44Å; I175-F198 HydrophobicContact CD1-CE1 4.13Å; I175-F198 HydrophobicContact CG1-CD1 4.48Å; I175-F198 HydrophobicContact CG1-CE1 3.98Å; I192-F198 HydrophobicContact CD1-CB 4.11Å; I192-F198 HydrophobicContact CD1-CD1 4.24Å; F198-V213 HydrophobicContact CD2-CG2 4.09Å; F198-V213 HydrophobicContact CE1-CG1 4.18Å; F198-V213 HydrophobicContact CE2-CB 4.3Å; F198-V213 HydrophobicContact CE2-CG1 4.2Å; F198-V213 HydrophobicContact CE2-CG2 4.32Å; F198-V213 HydrophobicContact CG-CG2 4.43Å; F198-V213 HydrophobicContact CZ-CG1 4Å; F198-L221 HydrophobicContact CZ-CD1 4.12Å
199	G	91.8	Very high	92.1	Very high	24 Å²	24	45.9 Å²	45.9	25%	0.247	28%	0.277	C	S	.	.			trans	83.8	20.9	174.7	0	0	0	0	0	115.1	L201 A202 R209	G199-L201 VanDerWaalsContact C-N 3.26Å; G199-L201 PolarHBondContact O-N 3.31Å; G199-A202 WeakPolarHBondContact O-CB 3.36Å; G199-A202 PolarHBondContact O-N 2.76Å; G199-A202 VanDerWaalsContact O-N 3.13Å; G199-R209 VanDerWaalsContact CA-NH1 3.33Å; G199-R209 PolarHBondContact O-NH1 2.69Å
200	E	91.6	Very high	91.9	Very high	79 Å²	79	45.9 Å²	45.9	37%	0.369	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-56.9	-34.4	-176.8	62	-131.9	-156	0	0	114.3	N133 L135 F172 A202 L203	N133-E200 PolarHBondContact ND2-OE2 2.85Å; L135-E200 HydrophobicContact CD1-CB 4.13Å; L135-E200 WeakPolarHBondContact CD1-O 3.37Å; F172-E200 VanDerWaalsContact CD2-CA 3.49Å; F172-E200 HydrophobicContact CD2-CB 3.87Å; F172-E200 HydrophobicContact CE2-CB 3.93Å; E200-A202 PolarHBondContact O-N 3.38Å; E200-A202 VanDerWaalsContact O-N 3.11Å; E200-L203 WeakPolarHBondContact O-CB 3.29Å; E200-L203 PolarHBondContact O-N 2.94Å
201	L	88.9	Confident	91.8	Very high	76 Å²	76	43.7 Å²	43.7	40%	0.398	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-60.9	-26.2	-178.9	-167.6	62.2	0	0	0	112.5	G199 L203 I204 Y205 T207	G199-L201 VanDerWaalsContact C-N 3.26Å; G199-L201 PolarHBondContact O-N 3.31Å; L201-L203 PolarHBondContact O-N 3.46Å; L201-L203 VanDerWaalsContact O-N 3.14Å; L201-I204 HydrophobicContact CD1-CD1 4.01Å; L201-I204 PolarHBondContact O-N 3.17Å; L201-I204 VanDerWaalsContact O-N 3.09Å; L201-Y205 HydrophobicContact CD1-CE1 3.74Å; L201-Y205 HydrophobicContact CG-CE1 4.25Å; L201-T207 HydrophobicContact CD2-CG2 3.98Å; L201-T207 HydrophobicContact CG-CG2 4.23Å
202	A	90.9	Very high	91.8	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.008	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-60.9	-18.1	174.5	0	0	0	0	0	113.4	G169 G199 E200 R226	G169-A202 WeakPolarHBondContact O-CB 3.29Å; G199-A202 WeakPolarHBondContact O-CB 3.36Å; G199-A202 PolarHBondContact O-N 2.76Å; G199-A202 VanDerWaalsContact O-N 3.13Å; E200-A202 PolarHBondContact O-N 3.38Å; E200-A202 VanDerWaalsContact O-N 3.11Å; A202-R226 WeakPolarHBondContact O-CB 3.39Å; A202-R226 PolarHBondContact O-NE 3.46Å; A202-R226 PolarHBondContact O-NH2 3.4Å
203	L	93	Very high	91.9	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-82.5	-15.3	177.2	-60.8	-178.3	0	0	0	113.6	L135 F136 F172 E200 L201 I224 Y229	L135-L203 HydrophobicContact CD1-CB 3.94Å; L135-L203 HydrophobicContact CD1-CD1 4.19Å; F136-L203 HydrophobicContact CE2-CD1 4.16Å; F136-L203 HydrophobicContact CZ-CD1 3.63Å; F172-L203 HydrophobicContact CB-CD1 3.6Å; F172-L203 HydrophobicContact CB-CD2 3.79Å; F172-L203 HydrophobicContact CB-CG 3.62Å; F172-L203 HydrophobicContact CD1-CD1 4.06Å; F172-L203 HydrophobicContact CG-CD1 3.97Å; F172-L203 HydrophobicContact CG-CG 4.46Å; E200-L203 WeakPolarHBondContact O-CB 3.29Å; E200-L203 PolarHBondContact O-N 2.94Å; L201-L203 PolarHBondContact O-N 3.46Å; L201-L203 VanDerWaalsContact O-N 3.14Å; L203-I224 HydrophobicContact CD1-CG2 4.12Å; L203-I224 HydrophobicContact CD2-CG2 4.03Å; L203-Y229 HydrophobicContact CB-CD1 3.87Å; L203-Y229 HydrophobicContact CB-CE1 4.15Å; L203-Y229 HydrophobicContact CB-CG 4.2Å; L203-Y229 HydrophobicContact CD1-CD1 4.43Å; L203-Y229 HydrophobicContact CD1-CD2 3.91Å; L203-Y229 HydrophobicContact CD1-CE2 4.09Å; L203-Y229 HydrophobicContact CD1-CG 4.09Å; L203-Y229 HydrophobicContact CD2-CG 4.3Å; L203-Y229 HydrophobicContact CG-CG 4.43Å
204	I	89.4	Confident	92	Very high	77 Å²	77	43.7 Å²	43.7	40%	0.395	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-51.1	-178.6	-44.4	-179.2	0	0	0	110.3	A100 L135 L201	A100-I204 VanDerWaalsContact CB-O 3.23Å; A100-I204 WeakPolarHBondContact CB-O 3.36Å; L135-I204 HydrophobicContact CD1-CD1 4.41Å; L135-I204 HydrophobicContact CD1-CG1 4Å; L135-I204 HydrophobicContact CD2-CD1 3.76Å; L135-I204 HydrophobicContact CD2-CG1 3.89Å; L201-I204 HydrophobicContact CD1-CD1 4.01Å; L201-I204 PolarHBondContact O-N 3.17Å; L201-I204 VanDerWaalsContact O-N 3.09Å
205	Y	88.1	Confident	92.2	Very high	42 Å²	42	37.7 Å²	37.7	17%	0.165	23%	0.233	C	C	.	.	S	Bend	trans	-158.6	167.1	-177.7	59.8	-83.6	0	0	0	111.8	I98 L201 T207 R226	I98-Y205 HydrophobicContact CB-CD2 3.81Å; I98-Y205 HydrophobicContact CB-CE2 3.62Å; I98-Y205 HydrophobicContact CB-CG 4.43Å; I98-Y205 HydrophobicContact CD1-CD1 3.99Å; I98-Y205 HydrophobicContact CD1-CD2 4.27Å; I98-Y205 HydrophobicContact CD1-CE1 3.42Å; I98-Y205 VanDerWaalsContact CD1-CE1 3.42Å; I98-Y205 HydrophobicContact CD1-CE2 3.64Å; I98-Y205 HydrophobicContact CD1-CG 4.43Å; I98-Y205 WeakPolarHBondContact CD1-OH 3.35Å; I98-Y205 HydrophobicContact CG1-CE2 4.22Å; I98-Y205 HydrophobicContact CG2-CD2 4.03Å; I98-Y205 HydrophobicContact CG2-CE2 3.46Å; I98-Y205 VanDerWaalsContact CG2-CE2 3.46Å; L201-Y205 HydrophobicContact CD1-CE1 3.74Å; L201-Y205 HydrophobicContact CG-CE1 4.25Å; Y205-T207 HydrophobicContact CD2-CG2 3.4Å; Y205-T207 HydrophobicContact CE2-CG2 2.92Å; Y205-T207 HydrophobicContact CG-CG2 4.37Å; Y205-T207 PolarHBondContact O-N 3.47Å; Y205-T207 VanDerWaalsContact O-N 3.12Å; Y205-R226 PolarHBondContact O-NH2 3.45Å
206	G	84.3	Confident	92.5	Very high	27 Å²	27	40.7 Å²	40.7	28%	0.278	24%	0.235	S	C	.	.			trans	-64.5	106.5	178.7	0	0	0	0	0	111	R226	G206-R226 VanDerWaalsContact CA-CZ 3.47Å; G206-R226 VanDerWaalsContact CA-NH2 3.29Å
207	T	82.4	Confident	92.7	Very high	22 Å²	22	42.3 Å²	42.3	14%	0.135	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.8	173.3	55.4	0	0	0	0	111.5	G169 L201 Y205 R209	G169-T207 PolarHBondContact N-O 3.27Å; L201-T207 HydrophobicContact CD2-CG2 3.98Å; L201-T207 HydrophobicContact CG-CG2 4.23Å; Y205-T207 HydrophobicContact CD2-CG2 3.4Å; Y205-T207 HydrophobicContact CE2-CG2 2.92Å; Y205-T207 HydrophobicContact CG-CG2 4.37Å; Y205-T207 PolarHBondContact O-N 3.47Å; Y205-T207 VanDerWaalsContact O-N 3.12Å; T207-R209 PolarHBondContact O-N 3.38Å
208	P	91	Very high	92.8	Very high	91 Å²	91	46 Å²	46	59%	0.591	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.1	134.4	162.1	-27.2	36.6	0	0	0	110.9	D167 A210	D167-P208 CarbonylContact O-C 3.53Å; D167-P208 VanDerWaalsContact O-CA 3.25Å; D167-P208 WeakPolarHBondContact O-CA 3.4Å; P208-A210 PolarHBondContact O-N 3.45Å
209	R	93.6	Very high	93	Very high	22 Å²	22	45.6 Å²	45.6	8%	0.083	26%	0.257	C	S	.	.			trans	-59.9	131.4	176	-63.5	-60.4	-170.6	177.8	-0.7	109.8	I163 M164 Q165 G166 D167 N171 G199 T207 A211	I163-R209 HydrophobicContact CB-CG 4.33Å; I163-R209 HydrophobicContact CD1-CG 4.24Å; M164-R209 WeakPolarHBondContact O-CB 3.44Å; Q165-R209 WeakPolarHBondContact CA-O 3.49Å; Q165-R209 WeakPolarHBondContact CG-O 3.28Å; G166-R209 PolarHBondContact N-O 3.24Å; D167-R209 WeakPolarHBondContact O-CG 3.31Å; D167-R209 PolarHBondContact O-N 2.9Å; N171-R209 PolarHBondContact O-NH1 2.96Å; N171-R209 PolarHBondContact O-NH2 3.06Å; G199-R209 VanDerWaalsContact CA-NH1 3.33Å; G199-R209 PolarHBondContact O-NH1 2.69Å; T207-R209 PolarHBondContact O-N 3.38Å; R209-A211 VanDerWaalsContact C-N 3.29Å; R209-A211 PolarHBondContact O-N 2.9Å
210	A	92.6	Very high	93.2	Very high	82 Å²	82	47.3 Å²	47.3	68%	0.678	26%	0.258	S	S	*	.	S	Bend	trans	-76.7	-17.2	178.9	0	0	0	0	0	113.5	Q165 P208	Q165-A210 PolarHBondContact NE2-O 2.83Å; P208-A210 PolarHBondContact O-N 3.45Å
211	A	95.2	Very high	93.5	Very high	17 Å²	17	43.5 Å²	43.5	14%	0.14	24%	0.24	C	C	.	.	S	Bend	trans	-147.5	154.1	-176.2	0	0	0	0	0	110.8	V182 Y183 V184 R209	V182-A211 HydrophobicContact CG1-CB 3.62Å; Y183-A211 CarbonylContact O-C 3.5Å; Y183-A211 VanDerWaalsContact O-CA 3.3Å; Y183-A211 WeakPolarHBondContact O-CA 3.28Å; Y183-A211 WeakPolarHBondContact O-CB 3.41Å; V184-A211 HydrophobicContact CG2-CB 3.75Å; R209-A211 VanDerWaalsContact C-N 3.29Å; R209-A211 PolarHBondContact O-N 2.9Å
212	T	96.8	Very high	93.9	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.2	168.6	-62.8	0	0	0	0	108.1	T161 I163 Q165 Y183 R214	T161-T212 HydrophobicContact CG2-CG2 3.74Å; I163-T212 CarbonylContact O-C 3.57Å; I163-T212 VanDerWaalsContact O-CA 3.3Å; I163-T212 WeakPolarHBondContact O-CA 3.3Å; I163-T212 WeakPolarHBondContact O-CG2 3.34Å; Q165-T212 WeakPolarHBondContact CB-OG1 3.43Å; Q165-T212 PolarHBondContact N-OG1 3.15Å; Y183-T212 PolarHBondContact N-O 3.34Å; Y183-T212 PolarHBondContact O-N 2.8Å; T212-R214 HydrophobicContact CG2-CG 4.17Å
213	V	97.3	Very high	94.1	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.6	176.7	-175.4	0	0	0	0	108.7	I162 I163 T180 D181 V182 F198	I162-V213 HydrophobicContact CD1-CG1 4.08Å; I162-V213 PolarHBondContact N-O 3.03Å; I163-V213 HydrophobicContact CD1-CB 4.29Å; I163-V213 HydrophobicContact CD1-CG2 3.7Å; I163-V213 HydrophobicContact CG1-CB 3.67Å; I163-V213 HydrophobicContact CG1-CG2 3.64Å; I163-V213 PolarHBondContact N-O 2.93Å; I163-V213 PolarHBondContact O-N 2.95Å; T180-V213 HydrophobicContact CG2-CG1 4.21Å; D181-V213 WeakPolarHBondContact O-CA 3.18Å; V182-V213 HydrophobicContact CG1-CG2 4.5Å; V182-V213 HydrophobicContact CG2-CG2 4.29Å; F198-V213 HydrophobicContact CD2-CG2 4.09Å; F198-V213 HydrophobicContact CE1-CG1 4.18Å; F198-V213 HydrophobicContact CE2-CB 4.3Å; F198-V213 HydrophobicContact CE2-CG1 4.2Å; F198-V213 HydrophobicContact CE2-CG2 4.32Å; F198-V213 HydrophobicContact CG-CG2 4.43Å; F198-V213 HydrophobicContact CZ-CG1 4Å
214	R	97.6	Very high	94.3	Very high	111 Å²	111	40.4 Å²	40.4	42%	0.419	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145	179	-61.7	-172	171.5	160.9	0.7	110.9	E160 T161 T180 D181 Y183 T212 K216	E160-R214 CarbonylContact O-C 3.25Å; E160-R214 VanDerWaalsContact O-CA 3.28Å; E160-R214 WeakPolarHBondContact O-CA 3.48Å; T161-R214 HydrophobicContact CG2-CG 4.44Å; T161-R214 PolarHBondContact OG1-NE 2.95Å; T180-R214 CarbonylContact C-O 3.47Å; T180-R214 WeakPolarHBondContact CA-O 3.28Å; T180-R214 WeakPolarHBondContact CB-O 3.17Å; D181-R214 PolarHBondContact N-O 3.13Å; D181-R214 PolarHBondContact O-N 3.04Å; Y183-R214 HydrophobicContact CD2-CG 4.28Å; Y183-R214 HydrophobicContact CE2-CB 4.09Å; Y183-R214 HydrophobicContact CE2-CG 4.06Å; T212-R214 HydrophobicContact CG2-CG 4.17Å; R214-K216 PolarHBondContact O-N 2.99Å
215	A	98.1	Very high	94.6	Very high	3 Å²	3	38 Å²	38	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	120.4	173.7	0	0	0	0	0	109.5	I157 G159 E160 I162 T217 V219	I157-A215 WeakPolarHBondContact O-CB 3.45Å; G159-A215 WeakPolarHBondContact CA-O 3.43Å; G159-A215 PolarHBondContact N-O 3.23Å; E160-A215 PolarHBondContact O-N 3.32Å; I162-A215 HydrophobicContact CD1-CB 4.33Å; A215-T217 WeakPolarHBondContact CB-O 3.38Å; A215-V219 HydrophobicContact CB-CG1 4.29Å; A215-V219 HydrophobicContact CB-CG2 3.75Å
216	K	97.2	Very high	94.9	Very high	101 Å²	101	36.3 Å²	36.3	44%	0.439	20%	0.204	S	C	.	.	S	Bend	trans	-84.1	-38.8	175.5	-177.3	-178.4	171.7	-163.9	0	110.7	E179 D181 R214	E179-K216 HydrophobicContact CB-CB 4.21Å; E179-K216 HydrophobicContact CB-CD 4.19Å; E179-K216 WeakPolarHBondContact O-CB 3.46Å; E179-K216 PolarHBondContact O-N 3.3Å; E179-K216 WeakPolarHBondContact OE2-CD 3.44Å; E179-K216 IonicContact OE2-NZ 2.79Å; E179-K216 PolarHBondContact OE2-NZ 3.03Å; D181-K216 WeakPolarHBondContact OD2-CG 3.43Å; R214-K216 PolarHBondContact O-N 2.99Å
217	T	97.8	Very high	95.3	Very high	55 Å²	55	37.4 Å²	37.4	34%	0.337	20%	0.204	S	C	.	.	S	Bend	trans	-114.7	-178.6	169.3	64.9	0	0	0	0	109.7	A158 G178 E179 A215 V219	A158-T217 WeakPolarHBondContact CA-O 3.31Å; G178-T217 VanDerWaalsContact CA-OG1 3.23Å; G178-T217 WeakPolarHBondContact CA-OG1 3.16Å; E179-T217 PolarHBondContact N-OG1 3.1Å; E179-T217 PolarHBondContact O-N 2.99Å; A215-T217 WeakPolarHBondContact CB-O 3.38Å; T217-V219 PolarHBondContact O-N 3.41Å
218	N	97.6	Very high	95.9	Very high	108 Å²	108	36.4 Å²	36.4	58%	0.578	20%	0.197	S	C	*	.			trans	-61.4	128.7	160.6	-67.4	-2	0	0	0	107.7	Y156 I157 A158	Y156-N218 WeakPolarHBondContact O-CA 3.48Å; I157-N218 WeakPolarHBondContact CA-OD1 3.32Å; A158-N218 PolarHBondContact N-OD1 3.2Å
219	V	97.6	Very high	96.1	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.03	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.5	-176.3	-63.4	0	0	0	0	111.3	T155 Y156 I162 Q177 E179 T180 A215 T217 L221	T155-V219 WeakPolarHBondContact CA-O 3.29Å; Y156-V219 HydrophobicContact CD2-CG2 4.35Å; Y156-V219 PolarHBondContact N-O 2.97Å; Y156-V219 PolarHBondContact O-N 2.74Å; I162-V219 HydrophobicContact CD1-CG2 4.14Å; Q177-V219 VanDerWaalsContact O-CA 3.23Å; Q177-V219 WeakPolarHBondContact O-CA 3.12Å; E179-V219 WeakPolarHBondContact O-CG1 3.35Å; T180-V219 HydrophobicContact CG2-CG1 3.97Å; A215-V219 HydrophobicContact CB-CG1 4.29Å; A215-V219 HydrophobicContact CB-CG2 3.75Å; T217-V219 PolarHBondContact O-N 3.41Å; V219-L221 HydrophobicContact CB-CD2 4.39Å; V219-L221 HydrophobicContact CG2-CD2 4.48Å; V219-L221 HydrophobicContact CG2-CG 4.35Å
220	K	96.7	Very high	96.1	Very high	60 Å²	60	35 Å²	35	26%	0.261	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.9	168	-176.2	-178.5	170.2	-143.2	0	108.1	T155 D176 Q177	T155-K220 HydrophobicContact CG2-CB 4.25Å; T155-K220 HydrophobicContact CG2-CG 4.04Å; D176-K220 WeakPolarHBondContact CA-O 3.5Å; D176-K220 HydrophobicContact CB-CB 4.4Å; D176-K220 HydrophobicContact CB-CG 4.28Å; D176-K220 WeakPolarHBondContact CB-O 3.47Å; D176-K220 PolarHBondContact N-O 3.47Å; D176-K220 WeakPolarHBondContact OD2-CD 3.32Å; D176-K220 VanDerWaalsContact OD2-CE 3.3Å; D176-K220 WeakPolarHBondContact OD2-CE 3.43Å; D176-K220 IonicContact OD2-NZ 2.75Å; D176-K220 PolarHBondContact OD2-NZ 3.36Å; Q177-K220 HydrophobicContact CB-CB 4.11Å; Q177-K220 PolarHBondContact N-O 2.93Å; Q177-K220 VanDerWaalsContact N-O 3.13Å; Q177-K220 PolarHBondContact O-N 2.92Å
221	L	96.9	Very high	96.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.8	-174.8	-53.4	178.5	0	0	0	110	S153 V154 Y156 I162 Y173 V174 I175 F198 V219	S153-L221 CarbonylContact C-O 3.59Å; S153-L221 WeakPolarHBondContact CA-O 3.34Å; V154-L221 PolarHBondContact N-O 3.47Å; V154-L221 PolarHBondContact O-N 2.66Å; Y156-L221 HydrophobicContact CD2-CD1 4.02Å; Y156-L221 HydrophobicContact CE2-CD1 4.05Å; I162-L221 HydrophobicContact CD1-CD1 4.03Å; I162-L221 HydrophobicContact CG1-CD1 4.28Å; I162-L221 HydrophobicContact CG2-CD1 3.71Å; Y173-L221 HydrophobicContact CD1-CB 4.42Å; Y173-L221 HydrophobicContact CD1-CD1 4.46Å; Y173-L221 HydrophobicContact CG-CD1 4.49Å; V174-L221 CarbonylContact O-C 3.54Å; V174-L221 VanDerWaalsContact O-CA 3.27Å; V174-L221 WeakPolarHBondContact O-CA 3.28Å; I175-L221 HydrophobicContact CB-CD2 4Å; I175-L221 HydrophobicContact CG1-CD2 3.64Å; I175-L221 HydrophobicContact CG2-CD2 4.13Å; F198-L221 HydrophobicContact CZ-CD1 4.12Å; V219-L221 HydrophobicContact CB-CD2 4.39Å; V219-L221 HydrophobicContact CG2-CD2 4.48Å; V219-L221 HydrophobicContact CG2-CG 4.35Å
222	W	97.6	Very high	96.1	Very high	13 Å²	13	32.9 Å²	32.9	5%	0.049	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.2	163.9	-70.4	101.5	0	0	0	109.4	I116 K118 T122 L126 M151 F152 Y173 V174 D176	I116-W222 HydrophobicContact CG2-CH2 4.38Å; I116-W222 HydrophobicContact CG2-CZ3 4.01Å; K118-W222 HydrophobicContact CD-CE3 4.46Å; K118-W222 HydrophobicContact CD-CH2 4.15Å; K118-W222 HydrophobicContact CD-CZ2 4.37Å; K118-W222 HydrophobicContact CD-CZ3 4.22Å; K118-W222 VanDerWaalsContact CE-CE3 3.43Å; K118-W222 HydrophobicContact CG-CH2 3.63Å; K118-W222 HydrophobicContact CG-CZ2 3.93Å; K118-W222 HydrophobicContact CG-CZ3 4.13Å; T122-W222 HydrophobicContact CG2-CZ2 3.86Å; L126-W222 HydrophobicContact CD1-CG 4.16Å; L126-W222 HydrophobicContact CD2-CB 3.84Å; L126-W222 HydrophobicContact CD2-CG 3.98Å; M151-W222 HydrophobicContact CB-CB 4.46Å; M151-W222 HydrophobicContact CB-CE3 4.2Å; M151-W222 HydrophobicContact CE-CB 3.58Å; M151-W222 WeakPolarHBondContact CE-O 3.35Å; M151-W222 WeakPolarHBondContact O-CZ3 3.34Å; M151-W222 HydrophobicContact SD-CB 4.36Å; F152-W222 VanDerWaalsContact C-CE3 3.4Å; F152-W222 CarbonylContact O-C 3.48Å; F152-W222 WeakPolarHBondContact O-CA 3.2Å; Y173-W222 CarbonylContact C-O 3.58Å; Y173-W222 WeakPolarHBondContact CA-O 3.16Å; V174-W222 PolarHBondContact N-O 3.42Å; V174-W222 PolarHBondContact O-N 3.49Å; D176-W222 PolarHBondContact OD2-NE1 3.09Å
223	G	96.6	Very high	96	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	148.8	179.5	0	0	0	0	0	112.4	M151 F152 F172	M151-G223 CarbonylContact C-O 3.56Å; M151-G223 WeakPolarHBondContact CA-O 3.29Å; F152-G223 VanDerWaalsContact CD1-O 3.31Å; F152-G223 WeakPolarHBondContact CD1-O 3.37Å; F152-G223 PolarHBondContact N-O 3.03Å; F152-G223 PolarHBondContact O-N 2.96Å; F172-G223 CarbonylContact O-C 3.56Å; F172-G223 WeakPolarHBondContact O-CA 3.38Å
224	I	96.9	Very high	95.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.8	163.8	-177	64	0	0	0	109.1	A150 M151 N171 F172 L203	A150-I224 HydrophobicContact CB-CD1 3.8Å; M151-I224 HydrophobicContact CG-CB 4.11Å; N171-I224 VanDerWaalsContact CA-O 3.31Å; N171-I224 WeakPolarHBondContact CA-O 3.48Å; F172-I224 HydrophobicContact CB-CG2 4.04Å; F172-I224 HydrophobicContact CD1-CG2 3.83Å; F172-I224 HydrophobicContact CG-CG2 4.44Å; F172-I224 PolarHBondContact N-O 3.26Å; F172-I224 PolarHBondContact O-N 2.86Å; L203-I224 HydrophobicContact CD1-CG2 4.12Å; L203-I224 HydrophobicContact CD2-CG2 4.03Å
225	D	94.9	Very high	95.5	Very high	25 Å²	25	31 Å²	31	13%	0.134	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	149.2	177	60.7	-87.4	0	0	0	112	K114 F152 N171 D227 S228 Y229	K114-D225 IonicContact NZ-OD1 3.96Å; F152-D225 HydrophobicContact CE1-CB 4.49Å; N171-D225 WeakPolarHBondContact OD1-CA 3.32Å; N171-D225 WeakPolarHBondContact OD1-CB 3.37Å; D225-D227 PolarHBondContact O-N 2.88Å; D225-D227 PolarHBondContact OD2-N 2.86Å; D225-S228 PolarHBondContact O-N 2.96Å; D225-S228 WeakPolarHBondContact OD1-CB 3.43Å; D225-S228 PolarHBondContact OD1-OG 2.86Å; D225-S228 WeakPolarHBondContact OD2-CB 3.44Å; D225-S228 PolarHBondContact OD2-N 2.89Å; D225-S228 PolarHBondContact OD2-OG 2.81Å; D225-Y229 WeakPolarHBondContact O-CB 3.36Å; D225-Y229 PolarHBondContact O-N 3.33Å
226	R	94.1	Very high	95.1	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-52.2	-43.9	177.6	-175.3	-173.1	-55.6	143.8	22	112.1	E101 G169 D170 A202 Y205 G206 Y229 R230	E101-R226 IonicContact OE1-CZ 3.22Å; E101-R226 IonicContact OE1-NH1 2.92Å; E101-R226 PolarHBondContact OE1-NH1 2.91Å; E101-R226 WeakPolarHBondContact OE2-CD 3.23Å; E101-R226 IonicContact OE2-NH1 2.74Å; G169-R226 PolarHBondContact O-NH2 2.68Å; D170-R226 PolarHBondContact O-N 3.32Å; D170-R226 IonicContact OD1-CZ 2.61Å; D170-R226 IonicContact OD1-NH2 3.67Å; D170-R226 PolarHBondContact OD1-NH2 3.47Å; D170-R226 VanDerWaalsContact OD1-NH2 3.17Å; A202-R226 WeakPolarHBondContact O-CB 3.39Å; A202-R226 PolarHBondContact O-NE 3.46Å; A202-R226 PolarHBondContact O-NH2 3.4Å; Y205-R226 PolarHBondContact O-NH2 3.45Å; G206-R226 VanDerWaalsContact CA-CZ 3.47Å; G206-R226 VanDerWaalsContact CA-NH2 3.29Å; R226-Y229 PolarHBondContact O-N 2.88Å; R226-R230 HydrophobicContact CG-CG 4.26Å; R226-R230 WeakPolarHBondContact O-CB 3.39Å; R226-R230 WeakPolarHBondContact O-CG 3.34Å; R226-R230 PolarHBondContact O-N 2.79Å
227	D	93.5	Very high	94.7	Very high	51 Å²	51	29.2 Å²	29.2	27%	0.273	15%	0.147	S	C	.	.	H	α-helix	trans	-63.2	-51.7	-174.7	-179.4	78.5	0	0	0	111.5	Y103 D225 Y229 R230 R231	Y103-D227 WeakPolarHBondContact CE1-OD1 3.48Å; Y103-D227 WeakPolarHBondContact OH-CA 3.47Å; Y103-D227 PolarHBondContact OH-OD1 2.86Å; D225-D227 PolarHBondContact O-N 2.88Å; D225-D227 PolarHBondContact OD2-N 2.86Å; D227-Y229 PolarHBondContact O-N 2.87Å; D227-R230 PolarHBondContact O-N 2.9Å; D227-R231 WeakPolarHBondContact O-CB 3.34Å; D227-R231 VanDerWaalsContact O-CG 3.28Å; D227-R231 WeakPolarHBondContact O-CG 3.36Å; D227-R231 PolarHBondContact O-N 3.41Å; D227-R231 IonicContact OD1-CZ 2.77Å; D227-R231 IonicContact OD1-NE 3.17Å; D227-R231 PolarHBondContact OD1-NE 2.72Å; D227-R231 IonicContact OD1-NH2 3.17Å; D227-R231 PolarHBondContact OD1-NH2 2.66Å; D227-R231 WeakPolarHBondContact OD2-CD 3.38Å; D227-R231 IonicContact OD2-CZ 2.66Å; D227-R231 IonicContact OD2-NE 3.32Å; D227-R231 PolarHBondContact OD2-NE 3.5Å; D227-R231 IonicContact OD2-NH2 3.79Å
228	S	94.9	Very high	94.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-46	176	-62	0	0	0	0	111	Y111 K114 D225 R230 R231 I232	Y111-S228 VanDerWaalsContact OH-CB 3.31Å; Y111-S228 WeakPolarHBondContact OH-CB 3.37Å; Y111-S228 PolarHBondContact OH-OG 2.89Å; K114-S228 PolarHBondContact NZ-OG 3.19Å; D225-S228 PolarHBondContact O-N 2.96Å; D225-S228 WeakPolarHBondContact OD1-CB 3.43Å; D225-S228 PolarHBondContact OD1-OG 2.86Å; D225-S228 WeakPolarHBondContact OD2-CB 3.44Å; D225-S228 PolarHBondContact OD2-N 2.89Å; D225-S228 PolarHBondContact OD2-OG 2.81Å; S228-R230 PolarHBondContact O-N 2.9Å; S228-R231 PolarHBondContact O-N 3.49Å; S228-I232 WeakPolarHBondContact O-CB 3.34Å; S228-I232 VanDerWaalsContact O-CD1 3.32Å; S228-I232 WeakPolarHBondContact O-CD1 3.43Å; S228-I232 WeakPolarHBondContact O-CG1 3.43Å; S228-I232 PolarHBondContact O-N 3.17Å
229	Y	94.9	Very high	93.8	Very high	16 Å²	16	30.9 Å²	30.9	6%	0.063	14%	0.143	C	C	.	.	H	α-helix	trans	-57.6	-50.8	178	179.7	-95.4	0	0	0	112	L135 F136 I147 L203 D225 R226 D227 L233	L135-Y229 PolarHBondContact O-OH 2.7Å; F136-Y229 HydrophobicContact CD1-CE2 4.2Å; F136-Y229 HydrophobicContact CE1-CD2 4.15Å; F136-Y229 AromaticContact CE1-CE2 3.63Å; F136-Y229 HydrophobicContact CE1-CE2 3.63Å; F136-Y229 HydrophobicContact CZ-CD2 4.49Å; F136-Y229 HydrophobicContact CZ-CE2 4.05Å; I147-Y229 HydrophobicContact CD1-CD2 3.87Å; I147-Y229 HydrophobicContact CD1-CE2 3.79Å; I147-Y229 HydrophobicContact CG1-CD2 4.32Å; L203-Y229 HydrophobicContact CB-CD1 3.87Å; L203-Y229 HydrophobicContact CB-CE1 4.15Å; L203-Y229 HydrophobicContact CB-CG 4.2Å; L203-Y229 HydrophobicContact CD1-CD1 4.43Å; L203-Y229 HydrophobicContact CD1-CD2 3.91Å; L203-Y229 HydrophobicContact CD1-CE2 4.09Å; L203-Y229 HydrophobicContact CD1-CG 4.09Å; L203-Y229 HydrophobicContact CD2-CG 4.3Å; L203-Y229 HydrophobicContact CG-CG 4.43Å; D225-Y229 WeakPolarHBondContact O-CB 3.36Å; D225-Y229 PolarHBondContact O-N 3.33Å; R226-Y229 PolarHBondContact O-N 2.88Å; D227-Y229 PolarHBondContact O-N 2.87Å; Y229-L233 HydrophobicContact CD1-CD1 4.03Å; Y229-L233 HydrophobicContact CE1-CD1 3.38Å; Y229-L233 HydrophobicContact CE1-CG 4.49Å; Y229-L233 HydrophobicContact CE2-CD1 4.04Å; Y229-L233 WeakPolarHBondContact O-CG 3.42Å; Y229-L233 PolarHBondContact O-N 2.61Å; Y229-L233 WeakPolarHBondContact OH-CD1 3.4Å
230	R	93.9	Very high	93.3	Very high	69 Å²	69	33.3 Å²	33.3	26%	0.26	15%	0.153	S	C	.	.	H	α-helix	trans	-67.4	-42	-178.8	-69.9	-170.5	70.3	-158.8	-2.5	112.3	E101 Y103 R226 D227 S228 L233 M234	E101-R230 PolarHBondContact O-NH1 3.42Å; E101-R230 PolarHBondContact O-NH2 2.76Å; E101-R230 IonicContact OE2-NH1 3Å; Y103-R230 HydrophobicContact CD2-CB 4.47Å; Y103-R230 VanDerWaalsContact CD2-CZ 3.47Å; Y103-R230 HydrophobicContact CE2-CB 4.1Å; R226-R230 HydrophobicContact CG-CG 4.26Å; R226-R230 WeakPolarHBondContact O-CB 3.39Å; R226-R230 WeakPolarHBondContact O-CG 3.34Å; R226-R230 PolarHBondContact O-N 2.79Å; D227-R230 PolarHBondContact O-N 2.9Å; S228-R230 PolarHBondContact O-N 2.9Å; R230-L233 PolarHBondContact O-N 3Å; R230-M234 VanDerWaalsContact O-CB 3.22Å; R230-M234 WeakPolarHBondContact O-CB 3.22Å; R230-M234 PolarHBondContact O-N 3.35Å
231	R	94.1	Very high	92.8	Very high	47 Å²	47	35.5 Å²	35.5	18%	0.177	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-39.3	178.3	-71.4	179.8	-169.7	-115.8	1.9	112.4	Y103 D107 Y111 D227 S228 G235	Y103-R231 HydrophobicContact CD1-CG 4.05Å; Y103-R231 HydrophobicContact CE1-CG 3.84Å; D107-R231 PolarHBondContact O-NH1 2.84Å; D107-R231 IonicContact OD1-NH1 3.88Å; Y111-R231 HydrophobicContact CD1-CB 4.42Å; Y111-R231 HydrophobicContact CD2-CB 3.83Å; Y111-R231 VanDerWaalsContact CD2-CD 3.42Å; Y111-R231 HydrophobicContact CD2-CG 4.3Å; Y111-R231 HydrophobicContact CE2-CB 4.39Å; Y111-R231 HydrophobicContact CG-CB 3.83Å; D227-R231 WeakPolarHBondContact O-CB 3.34Å; D227-R231 VanDerWaalsContact O-CG 3.28Å; D227-R231 WeakPolarHBondContact O-CG 3.36Å; D227-R231 PolarHBondContact O-N 3.41Å; D227-R231 IonicContact OD1-CZ 2.77Å; D227-R231 IonicContact OD1-NE 3.17Å; D227-R231 PolarHBondContact OD1-NE 2.72Å; D227-R231 IonicContact OD1-NH2 3.17Å; D227-R231 PolarHBondContact OD1-NH2 2.66Å; D227-R231 WeakPolarHBondContact OD2-CD 3.38Å; D227-R231 IonicContact OD2-CZ 2.66Å; D227-R231 IonicContact OD2-NE 3.32Å; D227-R231 PolarHBondContact OD2-NE 3.5Å; D227-R231 IonicContact OD2-NH2 3.79Å; S228-R231 PolarHBondContact O-N 3.49Å; R231-G235 PolarHBondContact O-N 3.47Å
232	I	93.9	Very high	92.4	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.036	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-51.1	176.1	-69.9	163.5	0	0	0	110.4	Y111 D146 I147 A150 S228 M234 G235 S236	Y111-I232 HydrophobicContact CD1-CG1 4.26Å; Y111-I232 HydrophobicContact CE1-CD1 4.14Å; Y111-I232 HydrophobicContact CE1-CG1 3.52Å; D146-I232 HydrophobicContact CB-CG2 3.62Å; I147-I232 HydrophobicContact CG1-CB 4.42Å; I147-I232 HydrophobicContact CG1-CD1 4.2Å; I147-I232 HydrophobicContact CG1-CG2 3.94Å; A150-I232 HydrophobicContact CB-CD1 3.72Å; S228-I232 WeakPolarHBondContact O-CB 3.34Å; S228-I232 VanDerWaalsContact O-CD1 3.32Å; S228-I232 WeakPolarHBondContact O-CD1 3.43Å; S228-I232 WeakPolarHBondContact O-CG1 3.43Å; S228-I232 PolarHBondContact O-N 3.17Å; I232-M234 PolarHBondContact O-N 3Å; I232-G235 PolarHBondContact O-N 3.41Å; I232-S236 WeakPolarHBondContact O-CB 3.46Å; I232-S236 PolarHBondContact O-N 3.03Å
233	L	93.6	Very high	91.8	Very high	32 Å²	32	45.1 Å²	45.1	17%	0.168	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-42.7	179.8	-69.1	-178.2	0	0	0	112.6	L139 E143 I147 Y229 R230 S236 T237	L139-L233 HydrophobicContact CD1-CD2 4.37Å; L139-L233 HydrophobicContact CD2-CD1 4.35Å; L139-L233 HydrophobicContact CD2-CD2 3.35Å; L139-L233 HydrophobicContact CD2-CG 4.5Å; L139-L233 HydrophobicContact CG-CD2 4.47Å; E143-L233 HydrophobicContact CB-CD2 4.29Å; E143-L233 HydrophobicContact CG-CD2 4.27Å; I147-L233 HydrophobicContact CD1-CD2 4.13Å; I147-L233 HydrophobicContact CD1-CG 4.49Å; Y229-L233 HydrophobicContact CD1-CD1 4.03Å; Y229-L233 HydrophobicContact CE1-CD1 3.38Å; Y229-L233 HydrophobicContact CE1-CG 4.49Å; Y229-L233 HydrophobicContact CE2-CD1 4.04Å; Y229-L233 WeakPolarHBondContact O-CG 3.42Å; Y229-L233 PolarHBondContact O-N 2.61Å; Y229-L233 WeakPolarHBondContact OH-CD1 3.4Å; R230-L233 PolarHBondContact O-N 3Å; L233-S236 PolarHBondContact O-N 3.45Å; L233-T237 WeakPolarHBondContact O-CB 3.4Å; L233-T237 PolarHBondContact O-N 3Å; L233-T237 PolarHBondContact O-OG1 2.91Å
234	M	92.6	Very high	91.4	Very high	48 Å²	48	46.4 Å²	46.4	24%	0.236	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-46.8	178	-169.8	166.7	84.4	0	0	110.9	T104 A108 R230 I232 S236 T237 L238	T104-M234 WeakPolarHBondContact O-CE 3.42Å; A108-M234 HydrophobicContact CB-CB 4.24Å; A108-M234 HydrophobicContact CB-CE 3.35Å; A108-M234 HydrophobicContact CB-CG 4.12Å; R230-M234 VanDerWaalsContact O-CB 3.22Å; R230-M234 WeakPolarHBondContact O-CB 3.22Å; R230-M234 PolarHBondContact O-N 3.35Å; I232-M234 PolarHBondContact O-N 3Å; M234-S236 PolarHBondContact O-N 2.99Å; M234-T237 PolarHBondContact O-N 2.74Å; M234-L238 HydrophobicContact CG-CD1 4.05Å; M234-L238 HydrophobicContact CG-CG 4.4Å; M234-L238 WeakPolarHBondContact O-CB 3.32Å; M234-L238 VanDerWaalsContact O-CG 3.25Å; M234-L238 WeakPolarHBondContact O-CG 3.47Å; M234-L238 PolarHBondContact O-N 2.88Å
235	G	92.1	Very high	90.9	Very high	5 Å²	5	48.7 Å²	48.7	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-42.7	176.9	0	0	0	0	0	112.9	R231 I232 R239	R231-G235 PolarHBondContact O-N 3.47Å; I232-G235 PolarHBondContact O-N 3.41Å; G235-R239 WeakPolarHBondContact O-CG 3.5Å; G235-R239 PolarHBondContact O-N 3.02Å; G235-R239 PolarHBondContact O-NH1 2.98Å
236	S	90	Very high	90.5	Very high	8 Å²	8	52.2 Å²	52.2	6%	0.056	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-49.9	174.6	176.8	0	0	0	0	111.5	E143 I232 L233 M234 L238 R239 K240	E143-S236 WeakPolarHBondContact CG-OG 3.42Å; E143-S236 WeakPolarHBondContact OE1-CB 3.41Å; E143-S236 PolarHBondContact OE1-OG 3.22Å; I232-S236 WeakPolarHBondContact O-CB 3.46Å; I232-S236 PolarHBondContact O-N 3.03Å; L233-S236 PolarHBondContact O-N 3.45Å; M234-S236 PolarHBondContact O-N 2.99Å; S236-L238 PolarHBondContact O-N 2.71Å; S236-R239 PolarHBondContact O-N 3.47Å; S236-K240 WeakPolarHBondContact O-CG 3.26Å; S236-K240 PolarHBondContact O-N 3.48Å
237	T	89	Confident	90	Very high	57 Å²	57	52.8 Å²	52.8	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-41.8	-179	-55.8	0	0	0	0	111.7	L233 M234 K240 R241	L233-T237 WeakPolarHBondContact O-CB 3.4Å; L233-T237 PolarHBondContact O-N 3Å; L233-T237 PolarHBondContact O-OG1 2.91Å; M234-T237 PolarHBondContact O-N 2.74Å; T237-K240 PolarHBondContact O-N 2.8Å; T237-R241 HydrophobicContact CG2-CG 4.5Å; T237-R241 WeakPolarHBondContact O-CB 2.92Å; T237-R241 WeakPolarHBondContact O-CG 3.35Å; T237-R241 PolarHBondContact O-N 3.33Å
238	L	89.4	Confident	89.7	Confident	53 Å²	53	50.3 Å²	50.3	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-62.1	-44.3	175.8	-74.1	172.6	0	0	0	111.6	E105 A108 M234 S236 R241 K242	E105-L238 HydrophobicContact CB-CD1 4.29Å; E105-L238 HydrophobicContact CG-CD1 4.16Å; E105-L238 HydrophobicContact CG-CD2 4.22Å; A108-L238 HydrophobicContact CB-CD1 3.96Å; M234-L238 HydrophobicContact CG-CD1 4.05Å; M234-L238 HydrophobicContact CG-CG 4.4Å; M234-L238 WeakPolarHBondContact O-CB 3.32Å; M234-L238 VanDerWaalsContact O-CG 3.25Å; M234-L238 WeakPolarHBondContact O-CG 3.47Å; M234-L238 PolarHBondContact O-N 2.88Å; S236-L238 PolarHBondContact O-N 2.71Å; L238-R241 PolarHBondContact O-N 2.87Å; L238-K242 WeakPolarHBondContact O-CB 3.43Å; L238-K242 PolarHBondContact O-N 3.31Å
239	R	87.4	Confident	89.3	Confident	146 Å²	146	52.8 Å²	52.8	55%	0.551	24%	0.242	S	C	*	.	H	α-helix	trans	-61.3	-46.3	175.9	-74.8	-174.8	-64.2	-93.1	7.3	111.6	G235 S236 K242 M243	G235-R239 WeakPolarHBondContact O-CG 3.5Å; G235-R239 PolarHBondContact O-N 3.02Å; G235-R239 PolarHBondContact O-NH1 2.98Å; S236-R239 PolarHBondContact O-N 3.47Å; R239-K242 PolarHBondContact O-N 3.41Å; R239-M243 VanDerWaalsContact O-CB 3.24Å; R239-M243 WeakPolarHBondContact O-CB 3.43Å; R239-M243 PolarHBondContact O-N 3.41Å
240	K	86.1	Confident	88.8	Confident	56 Å²	56	58.8 Å²	58.8	24%	0.243	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-48.7	176.8	-72	175.4	-173	171.6	0	111.9	D140 E143 S236 T237 K242 M243 Y244	D140-K240 WeakPolarHBondContact OD2-CE 3.32Å; D140-K240 IonicContact OD2-NZ 2.95Å; D140-K240 PolarHBondContact OD2-NZ 2.84Å; E143-K240 IonicContact OE1-NZ 3.45Å; E143-K240 PolarHBondContact OE1-NZ 2.86Å; E143-K240 IonicContact OE2-NZ 3.96Å; E143-K240 PolarHBondContact OE2-NZ 2.92Å; S236-K240 WeakPolarHBondContact O-CG 3.26Å; S236-K240 PolarHBondContact O-N 3.48Å; T237-K240 PolarHBondContact O-N 2.8Å; K240-K242 PolarHBondContact O-N 2.8Å; K240-M243 PolarHBondContact O-N 3.04Å; K240-Y244 WeakPolarHBondContact O-CB 3.49Å; K240-Y244 PolarHBondContact O-N 3.18Å
241	R	86.9	Confident	88.2	Confident	106 Å²	106	55.5 Å²	55.5	40%	0.4	26%	0.256	S	S	.	.	H	α-helix	trans	-60.5	-46.6	179	-81.5	-178	163.4	172.2	-5.5	112.1	T237 L238 Y244 E245 D267	T237-R241 HydrophobicContact CG2-CG 4.5Å; T237-R241 WeakPolarHBondContact O-CB 2.92Å; T237-R241 WeakPolarHBondContact O-CG 3.35Å; T237-R241 PolarHBondContact O-N 3.33Å; L238-R241 PolarHBondContact O-N 2.87Å; R241-Y244 PolarHBondContact O-N 3.38Å; R241-E245 WeakPolarHBondContact O-CB 3.34Å; R241-E245 PolarHBondContact O-N 2.93Å; R241-D267 IonicContact CZ-OD1 3.1Å; R241-D267 IonicContact CZ-OD2 2.77Å; R241-D267 IonicContact NE-OD1 3.26Å; R241-D267 PolarHBondContact NE-OD1 3.5Å; R241-D267 IonicContact NE-OD2 3.53Å; R241-D267 VanDerWaalsContact NH2-CG 3.3Å; R241-D267 IonicContact NH2-OD1 3.8Å; R241-D267 PolarHBondContact NH2-OD1 2.86Å; R241-D267 VanDerWaalsContact NH2-OD1 3.1Å; R241-D267 IonicContact NH2-OD2 3.37Å; R241-D267 PolarHBondContact NH2-OD2 2.76Å
242	K	87.8	Confident	87.5	Confident	129 Å²	129	55.5 Å²	55.5	56%	0.561	26%	0.263	S	S	*	.	H	α-helix	trans	-61.7	-45.9	177	-177.9	175.8	175.5	178.3	0	111.6	L238 R239 K240 Y244 E245 E246	L238-K242 WeakPolarHBondContact O-CB 3.43Å; L238-K242 PolarHBondContact O-N 3.31Å; R239-K242 PolarHBondContact O-N 3.41Å; K240-K242 PolarHBondContact O-N 2.8Å; K242-Y244 PolarHBondContact O-N 3.22Å; K242-E245 PolarHBondContact O-N 2.92Å; K242-E246 WeakPolarHBondContact CE-OE1 3.27Å; K242-E246 WeakPolarHBondContact O-CB 3.43Å; K242-E246 WeakPolarHBondContact O-CG 3.31Å; K242-E246 PolarHBondContact O-N 3.49Å
243	M	86.1	Confident	86.7	Confident	86 Å²	86	55.2 Å²	55.2	42%	0.424	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-47.6	176.7	-177.7	-174.8	75.7	0	0	111.3	R239 K240 F247 L294	R239-M243 VanDerWaalsContact O-CB 3.24Å; R239-M243 WeakPolarHBondContact O-CB 3.43Å; R239-M243 PolarHBondContact O-N 3.41Å; K240-M243 PolarHBondContact O-N 3.04Å; M243-F247 WeakPolarHBondContact O-CB 3.46Å; M243-F247 PolarHBondContact O-N 2.94Å; M243-L294 HydrophobicContact CE-CD1 4.44Å
244	Y	87.8	Confident	86.1	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-66.7	-38.9	177.7	-69.6	-17.2	0	0	0	112.8	K240 R241 K242 F247 L248 A266 L269 L294 V346	K240-Y244 WeakPolarHBondContact O-CB 3.49Å; K240-Y244 PolarHBondContact O-N 3.18Å; R241-Y244 PolarHBondContact O-N 3.38Å; K242-Y244 PolarHBondContact O-N 3.22Å; Y244-F247 PolarHBondContact O-N 2.85Å; Y244-L248 VanDerWaalsContact O-CB 3.24Å; Y244-L248 WeakPolarHBondContact O-CB 3.34Å; Y244-L248 WeakPolarHBondContact O-CG 3.5Å; Y244-L248 PolarHBondContact O-N 3.05Å; Y244-A266 HydrophobicContact CD2-CB 4.45Å; Y244-L269 HydrophobicContact CD1-CD1 4.47Å; Y244-L269 HydrophobicContact CD2-CD1 4.08Å; Y244-L269 HydrophobicContact CE2-CB 4.43Å; Y244-L269 HydrophobicContact CE2-CD1 4.46Å; Y244-L269 HydrophobicContact CG-CD1 4.09Å; Y244-L294 HydrophobicContact CD1-CD2 4.34Å; Y244-L294 HydrophobicContact CE1-CD1 3.93Å; Y244-L294 HydrophobicContact CE1-CD2 4.12Å; Y244-V346 HydrophobicContact CE1-CG1 3.82Å; Y244-V346 WeakPolarHBondContact OH-CG1 3.49Å
245	E	86.3	Confident	85.7	Confident	48 Å²	48	57.3 Å²	57.3	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-50.9	175.5	-175.5	-174.1	-179	0	0	111.4	R241 K242 F247 L248 S249 K259 L263	R241-E245 WeakPolarHBondContact O-CB 3.34Å; R241-E245 PolarHBondContact O-N 2.93Å; K242-E245 PolarHBondContact O-N 2.92Å; E245-F247 PolarHBondContact O-N 3.45Å; E245-L248 PolarHBondContact O-N 3.45Å; E245-S249 WeakPolarHBondContact O-CB 3.47Å; E245-S249 PolarHBondContact O-N 3.43Å; E245-K259 VanDerWaalsContact OE1-CE 3.22Å; E245-K259 WeakPolarHBondContact OE1-CE 3.46Å; E245-L263 HydrophobicContact CG-CD1 4.22Å
246	E	86.1	Confident	85.4	Confident	100 Å²	100	58.2 Å²	58.2	47%	0.467	28%	0.276	S	S	.	.	H	α-helix	trans	-59.2	-38.8	177.9	-73.9	177	-170.1	0	0	111.4	K242 S249	K242-E246 WeakPolarHBondContact CE-OE1 3.27Å; K242-E246 WeakPolarHBondContact O-CB 3.43Å; K242-E246 WeakPolarHBondContact O-CG 3.31Å; K242-E246 PolarHBondContact O-N 3.49Å; E246-S249 PolarHBondContact O-OG 2.88Å
247	F	84	Confident	85.3	Confident	18 Å²	18	58.2 Å²	58.2	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-73.4	-48.7	-179.2	-176.1	-99.5	0	0	0	112.6	M243 Y244 E245 S249 K250 I292 I293 L294 S319	M243-F247 WeakPolarHBondContact O-CB 3.46Å; M243-F247 PolarHBondContact O-N 2.94Å; Y244-F247 PolarHBondContact O-N 2.85Å; E245-F247 PolarHBondContact O-N 3.45Å; F247-S249 PolarHBondContact O-N 2.95Å; F247-K250 WeakPolarHBondContact O-CB 3.38Å; F247-K250 PolarHBondContact O-N 3.37Å; F247-I292 HydrophobicContact CD1-CG2 4.19Å; F247-I292 HydrophobicContact CE1-CB 3.67Å; F247-I292 HydrophobicContact CE1-CD1 4.45Å; F247-I292 HydrophobicContact CE1-CG2 3.1Å; F247-I292 HydrophobicContact CZ-CB 4.21Å; F247-I292 HydrophobicContact CZ-CG2 3.45Å; F247-I292 VanDerWaalsContact CZ-CG2 3.45Å; F247-I293 VanDerWaalsContact CE2-O 3.24Å; F247-I293 WeakPolarHBondContact CE2-O 3.33Å; F247-I293 WeakPolarHBondContact CZ-O 2.93Å; F247-L294 HydrophobicContact CD1-CD2 3.91Å; F247-L294 HydrophobicContact CD2-CD2 4.33Å; F247-L294 HydrophobicContact CE1-CD2 3.73Å; F247-L294 HydrophobicContact CE2-CD2 4.21Å; F247-L294 HydrophobicContact CG-CD2 4.19Å; F247-L294 HydrophobicContact CZ-CD2 3.96Å; F247-S319 WeakPolarHBondContact CD2-OG 3.24Å; F247-S319 VanDerWaalsContact CE2-N 3.27Å; F247-S319 VanDerWaalsContact CE2-OG 3.28Å; F247-S319 WeakPolarHBondContact CE2-OG 3.32Å
248	L	86.4	Confident	85.4	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-27.9	175	-71.1	173	0	0	0	112.2	Y244 E245 K250 V251 L254 R262 V265 A266 L269 I292	Y244-L248 VanDerWaalsContact O-CB 3.24Å; Y244-L248 WeakPolarHBondContact O-CB 3.34Å; Y244-L248 WeakPolarHBondContact O-CG 3.5Å; Y244-L248 PolarHBondContact O-N 3.05Å; E245-L248 PolarHBondContact O-N 3.45Å; L248-K250 PolarHBondContact O-N 2.88Å; L248-V251 PolarHBondContact O-N 2.93Å; L248-L254 HydrophobicContact CD2-CD1 3.61Å; L248-R262 WeakPolarHBondContact CD1-O 3.25Å; L248-V265 HydrophobicContact CD1-CB 4.21Å; L248-V265 HydrophobicContact CD1-CG1 4.05Å; L248-V265 HydrophobicContact CD2-CG1 4.26Å; L248-A266 HydrophobicContact CD1-CB 3.82Å; L248-L269 HydrophobicContact CD1-CD1 4.24Å; L248-L269 HydrophobicContact CD2-CD1 4.33Å; L248-L269 HydrophobicContact CG-CD1 4.48Å; L248-I292 HydrophobicContact CD2-CD1 3.63Å
249	S	86.3	Confident	85.3	Confident	51 Å²	51	62.1 Å²	62.1	36%	0.357	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-23	175.2	81.9	0	0	0	0	114.1	E245 E246 F247 R262	E245-S249 WeakPolarHBondContact O-CB 3.47Å; E245-S249 PolarHBondContact O-N 3.43Å; E246-S249 PolarHBondContact O-OG 2.88Å; F247-S249 PolarHBondContact O-N 2.95Å; S249-R262 VanDerWaalsContact CB-NH1 3.28Å
250	K	84.6	Confident	85.4	Confident	142 Å²	142	64.1 Å²	64.1	62%	0.617	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-13.2	178.8	-61.7	175.3	-176	174.3	0	112.8	F247 L248 S252	F247-K250 WeakPolarHBondContact O-CB 3.38Å; F247-K250 PolarHBondContact O-N 3.37Å; L248-K250 PolarHBondContact O-N 2.88Å; K250-S252 PolarHBondContact O-N 2.77Å
251	V	82.3	Confident	85.6	Confident	1 Å²	1	63 Å²	63	1%	0.006	29%	0.292	C	S	.	.			trans	-77.4	109.1	-177.6	177.8	0	0	0	0	108.5	L248 I253 L254 E255 F290 I292 Y321	L248-V251 PolarHBondContact O-N 2.93Å; V251-I253 VanDerWaalsContact C-N 3.34Å; V251-I253 HydrophobicContact CG1-CG2 3.76Å; V251-I253 PolarHBondContact O-N 2.88Å; V251-L254 HydrophobicContact CB-CB 4.32Å; V251-L254 HydrophobicContact CB-CD1 4.42Å; V251-L254 HydrophobicContact CB-CG 4.44Å; V251-L254 HydrophobicContact CG1-CB 4.21Å; V251-L254 HydrophobicContact CG1-CD1 4.07Å; V251-L254 HydrophobicContact CG1-CG 3.9Å; V251-L254 CarbonylContact O-C 3.45Å; V251-L254 PolarHBondContact O-N 3.16Å; V251-E255 PolarHBondContact O-N 2.78Å; V251-F290 HydrophobicContact CG1-CZ 4.41Å; V251-I292 HydrophobicContact CG2-CD1 4.43Å; V251-I292 HydrophobicContact CG2-CG2 3.9Å; V251-Y321 HydrophobicContact CG1-CD1 3.66Å; V251-Y321 HydrophobicContact CG1-CE1 3.91Å; V251-Y321 HydrophobicContact CG1-CG 4.28Å
252	S	79.1	Confident	85.8	Confident	46 Å²	46	60.3 Å²	60.3	32%	0.322	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-58.1	-42.2	-173.5	58.5	0	0	0	0	112.9	K250 L254 E255 Y321 Q370	K250-S252 PolarHBondContact O-N 2.77Å; S252-L254 PolarHBondContact O-N 2.94Å; S252-L254 VanDerWaalsContact O-N 3.09Å; S252-E255 WeakPolarHBondContact O-CB 2.95Å; S252-E255 PolarHBondContact O-N 2.95Å; S252-Y321 WeakPolarHBondContact OG-CE1 3.16Å; S252-Y321 PolarHBondContact OG-OH 3.4Å; S252-Q370 VanDerWaalsContact C-NE2 3.31Å; S252-Q370 PolarHBondContact O-NE2 2.81Å
253	I	77.9	Confident	85.9	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-61.5	-22.1	178	-162.9	172.5	0	0	0	113.5	V251 F290 Y321 E324 L364 F374	V251-I253 VanDerWaalsContact C-N 3.34Å; V251-I253 HydrophobicContact CG1-CG2 3.76Å; V251-I253 PolarHBondContact O-N 2.88Å; I253-F290 HydrophobicContact CG2-CE2 4.46Å; I253-F290 HydrophobicContact CG2-CZ 4.3Å; I253-Y321 HydrophobicContact CB-CE2 4.21Å; I253-Y321 HydrophobicContact CG2-CD2 4.37Å; I253-Y321 HydrophobicContact CG2-CE1 4.31Å; I253-Y321 HydrophobicContact CG2-CE2 3.92Å; I253-E324 HydrophobicContact CD1-CB 3.55Å; I253-E324 HydrophobicContact CD1-CG 3.95Å; I253-L364 HydrophobicContact CD1-CD1 4.19Å; I253-L364 HydrophobicContact CD1-CD2 4.27Å; I253-L364 HydrophobicContact CG1-CD1 4.25Å; I253-L364 HydrophobicContact CG1-CD2 3.45Å; I253-L364 VanDerWaalsContact CG1-CD2 3.45Å; I253-L364 HydrophobicContact CG1-CG 4.34Å; I253-L364 WeakPolarHBondContact O-CD2 3.37Å; I253-F374 HydrophobicContact CB-CE2 4.21Å; I253-F374 HydrophobicContact CB-CZ 3.92Å; I253-F374 HydrophobicContact CG1-CE2 4.09Å; I253-F374 HydrophobicContact CG1-CZ 4.19Å
254	L	80.6	Confident	86.1	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-104.9	7.6	179.4	-56.6	-177.8	0	0	0	112.9	L248 V251 S252 S256 L257 F290 F353	L248-L254 HydrophobicContact CD2-CD1 3.61Å; V251-L254 HydrophobicContact CB-CB 4.32Å; V251-L254 HydrophobicContact CB-CD1 4.42Å; V251-L254 HydrophobicContact CB-CG 4.44Å; V251-L254 HydrophobicContact CG1-CB 4.21Å; V251-L254 HydrophobicContact CG1-CD1 4.07Å; V251-L254 HydrophobicContact CG1-CG 3.9Å; V251-L254 CarbonylContact O-C 3.45Å; V251-L254 PolarHBondContact O-N 3.16Å; S252-L254 PolarHBondContact O-N 2.94Å; S252-L254 VanDerWaalsContact O-N 3.09Å; L254-S256 PolarHBondContact O-N 2.94Å; L254-L257 HydrophobicContact CB-CD1 4.07Å; L254-L257 HydrophobicContact CB-CG 4.45Å; L254-L257 HydrophobicContact CD2-CD1 4.03Å; L254-L257 HydrophobicContact CG-CD1 4.46Å; L254-L257 WeakPolarHBondContact O-CB 3.46Å; L254-L257 PolarHBondContact O-N 3.22Å; L254-F290 HydrophobicContact CD1-CE1 4.46Å; L254-F353 HydrophobicContact CD2-CE2 4.27Å
255	E	83.8	Confident	86.2	Confident	123 Å²	123	53.7 Å²	53.7	58%	0.575	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29	-178.2	-173.2	176.5	-174.9	0	0	112.6	V251 S252 L257	V251-E255 PolarHBondContact O-N 2.78Å; S252-E255 WeakPolarHBondContact O-CB 2.95Å; S252-E255 PolarHBondContact O-N 2.95Å; E255-L257 PolarHBondContact O-N 3.37Å
256	S	86.1	Confident	86.3	Confident	25 Å²	25	51.6 Å²	51.6	18%	0.175	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-0.7	178.4	-61.7	0	0	0	0	114.3	L254 R366 N367	L254-S256 PolarHBondContact O-N 2.94Å; S256-R366 PolarHBondContact O-NH1 3.2Å; S256-N367 WeakPolarHBondContact OG-CB 3.49Å
257	L	87.6	Confident	86.5	Confident	8 Å²	8	50.8 Å²	50.8	4%	0.042	25%	0.249	C	C	.	.			trans	-82.7	138.2	175.2	-66.9	-175.7	0	0	0	111.2	L254 E255 E261 R262 V265 L357 I363	L254-L257 HydrophobicContact CB-CD1 4.07Å; L254-L257 HydrophobicContact CB-CG 4.45Å; L254-L257 HydrophobicContact CD2-CD1 4.03Å; L254-L257 HydrophobicContact CG-CD1 4.46Å; L254-L257 WeakPolarHBondContact O-CB 3.46Å; L254-L257 PolarHBondContact O-N 3.22Å; E255-L257 PolarHBondContact O-N 3.37Å; L257-E261 WeakPolarHBondContact CA-OE2 3.32Å; L257-E261 HydrophobicContact CB-CB 4.13Å; L257-E261 HydrophobicContact CD2-CB 3.98Å; L257-E261 HydrophobicContact CG-CB 4.49Å; L257-R262 HydrophobicContact CB-CG 3.57Å; L257-R262 HydrophobicContact CD1-CG 4.16Å; L257-V265 HydrophobicContact CD1-CG2 3.93Å; L257-L357 HydrophobicContact CD1-CD1 3.99Å; L257-L357 HydrophobicContact CD2-CD1 3.95Å; L257-I363 HydrophobicContact CD2-CB 4.46Å; L257-I363 HydrophobicContact CD2-CD1 3.75Å; L257-I363 HydrophobicContact CD2-CG1 4.26Å; L257-I363 HydrophobicContact CD2-CG2 3.44Å; L257-I363 VanDerWaalsContact CD2-CG2 3.44Å; L257-I363 HydrophobicContact CG-CG2 4.15Å
258	D	90	Very high	86.8	Confident	81 Å²	81	50.6 Å²	50.6	43%	0.433	25%	0.249	S	C	.	.			trans	-72.2	175.6	170.9	80.9	29.5	0	0	0	111.8	W260 E261 R262	D258-W260 PolarHBondContact O-N 3.36Å; D258-W260 WeakPolarHBondContact OD1-CA 3.38Å; D258-W260 PolarHBondContact OD1-N 2.86Å; D258-E261 PolarHBondContact N-OE2 3.17Å; D258-E261 WeakPolarHBondContact OD1-CG 3.28Å; D258-E261 PolarHBondContact OD1-N 2.74Å; D258-R262 WeakPolarHBondContact O-CB 3.41Å; D258-R262 VanDerWaalsContact O-CG 3.32Å; D258-R262 WeakPolarHBondContact O-CG 3.47Å; D258-R262 PolarHBondContact O-N 3.29Å
259	K	88.6	Confident	86.9	Confident	111 Å²	111	51.2 Å²	51.2	48%	0.483	25%	0.253	S	S	.	.	H	α-helix	trans	-57.5	-49.4	179.2	-177.5	176.1	178.2	179.4	0	112.2	E245 R262 L263	E245-K259 VanDerWaalsContact OE1-CE 3.22Å; E245-K259 WeakPolarHBondContact OE1-CE 3.46Å; K259-R262 PolarHBondContact O-N 3Å; K259-L263 HydrophobicContact CG-CD1 3.76Å; K259-L263 WeakPolarHBondContact O-CD1 3.4Å; K259-L263 PolarHBondContact O-N 3.17Å
260	W	89.6	Confident	87.1	Confident	187 Å²	187	52.3 Å²	52.3	71%	0.708	25%	0.252	S	S	*	.	H	α-helix	trans	-69.6	-39.2	-175.2	-62.2	111	0	0	0	111.9	D258 L263 T264	D258-W260 PolarHBondContact O-N 3.36Å; D258-W260 WeakPolarHBondContact OD1-CA 3.38Å; D258-W260 PolarHBondContact OD1-N 2.86Å; W260-L263 PolarHBondContact O-N 3.42Å; W260-T264 PolarHBondContact O-N 3.17Å; W260-T264 PolarHBondContact O-OG1 3.18Å
261	E	90.8	Very high	87.4	Confident	32 Å²	32	50.1 Å²	50.1	15%	0.15	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-45.1	173.3	-67.3	175.6	139.4	0	0	110.9	L257 D258 L263 T264 V265 L357 R366	L257-E261 WeakPolarHBondContact CA-OE2 3.32Å; L257-E261 HydrophobicContact CB-CB 4.13Å; L257-E261 HydrophobicContact CD2-CB 3.98Å; L257-E261 HydrophobicContact CG-CB 4.49Å; D258-E261 PolarHBondContact N-OE2 3.17Å; D258-E261 WeakPolarHBondContact OD1-CG 3.28Å; D258-E261 PolarHBondContact OD1-N 2.74Å; E261-L263 PolarHBondContact O-N 3.3Å; E261-T264 WeakPolarHBondContact O-CB 3.2Å; E261-T264 PolarHBondContact O-N 3.27Å; E261-T264 VanDerWaalsContact O-N 3.09Å; E261-V265 WeakPolarHBondContact O-CG2 3.34Å; E261-V265 PolarHBondContact O-N 3.46Å; E261-L357 HydrophobicContact CB-CD2 3.91Å; E261-L357 HydrophobicContact CG-CD2 4.04Å; E261-R366 VanDerWaalsContact CD-NH1 3.28Å; E261-R366 IonicContact OE1-CZ 2.72Å; E261-R366 VanDerWaalsContact OE1-CZ 3.31Å; E261-R366 IonicContact OE1-NH1 2.81Å; E261-R366 PolarHBondContact OE1-NH1 3.39Å; E261-R366 IonicContact OE1-NH2 2.99Å; E261-R366 PolarHBondContact OE1-NH2 2.92Å; E261-R366 IonicContact OE2-CZ 3.95Å; E261-R366 IonicContact OE2-NH1 3.31Å; E261-R366 PolarHBondContact OE2-NH1 3.45Å; E261-R366 IonicContact OE2-NH2 2.75Å
262	R	90.1	Very high	88	Confident	50 Å²	50	51.5 Å²	51.5	19%	0.189	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-41.3	175.5	-72.7	-174.3	-55.8	-165.5	7.9	112.7	L248 S249 L257 D258 K259 T264 V265 A266	L248-R262 WeakPolarHBondContact CD1-O 3.25Å; S249-R262 VanDerWaalsContact CB-NH1 3.28Å; L257-R262 HydrophobicContact CB-CG 3.57Å; L257-R262 HydrophobicContact CD1-CG 4.16Å; D258-R262 WeakPolarHBondContact O-CB 3.41Å; D258-R262 VanDerWaalsContact O-CG 3.32Å; D258-R262 WeakPolarHBondContact O-CG 3.47Å; D258-R262 PolarHBondContact O-N 3.29Å; K259-R262 PolarHBondContact O-N 3Å; R262-T264 PolarHBondContact O-N 3.37Å; R262-V265 PolarHBondContact O-N 3.32Å; R262-A266 WeakPolarHBondContact O-CB 3.23Å; R262-A266 PolarHBondContact O-N 2.79Å
263	L	89.6	Confident	88.7	Confident	41 Å²	41	56 Å²	56	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-37.1	173.6	-90.3	87.7	0	0	0	111.5	E245 K259 W260 E261 V265 A266 D267	E245-L263 HydrophobicContact CG-CD1 4.22Å; K259-L263 HydrophobicContact CG-CD1 3.76Å; K259-L263 WeakPolarHBondContact O-CD1 3.4Å; K259-L263 PolarHBondContact O-N 3.17Å; W260-L263 PolarHBondContact O-N 3.42Å; E261-L263 PolarHBondContact O-N 3.3Å; L263-V265 VanDerWaalsContact C-N 3.35Å; L263-A266 WeakPolarHBondContact O-CB 3.29Å; L263-A266 PolarHBondContact O-N 3.14Å; L263-D267 PolarHBondContact O-N 3.38Å
264	T	90.6	Very high	89.5	Confident	58 Å²	58	57.2 Å²	57.2	36%	0.356	28%	0.282	S	S	.	.	H	α-helix	trans	-69.7	-35	179.9	-42.6	0	0	0	0	111.7	W260 E261 R262 S268 V356	W260-T264 PolarHBondContact O-N 3.17Å; W260-T264 PolarHBondContact O-OG1 3.18Å; E261-T264 WeakPolarHBondContact O-CB 3.2Å; E261-T264 PolarHBondContact O-N 3.27Å; E261-T264 VanDerWaalsContact O-N 3.09Å; R262-T264 PolarHBondContact O-N 3.37Å; T264-S268 PolarHBondContact O-N 3.5Å; T264-S268 PolarHBondContact O-OG 3.36Å; T264-V356 HydrophobicContact CG2-CG1 3.11Å
265	V	89.4	Confident	90.3	Very high	3 Å²	3	63 Å²	63	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-47.3	168.6	176.2	0	0	0	0	110.8	L248 L257 E261 R262 L263 D267 S268 L269 L348 F353 L357	L248-V265 HydrophobicContact CD1-CB 4.21Å; L248-V265 HydrophobicContact CD1-CG1 4.05Å; L248-V265 HydrophobicContact CD2-CG1 4.26Å; L257-V265 HydrophobicContact CD1-CG2 3.93Å; E261-V265 WeakPolarHBondContact O-CG2 3.34Å; E261-V265 PolarHBondContact O-N 3.46Å; R262-V265 PolarHBondContact O-N 3.32Å; L263-V265 VanDerWaalsContact C-N 3.35Å; V265-D267 VanDerWaalsContact C-N 3.26Å; V265-D267 PolarHBondContact O-N 2.83Å; V265-S268 CarbonylContact O-C 3.53Å; V265-S268 WeakPolarHBondContact O-CA 3.4Å; V265-S268 WeakPolarHBondContact O-CB 3.47Å; V265-S268 PolarHBondContact O-N 3.01Å; V265-L269 HydrophobicContact CG1-CD2 4.34Å; V265-L269 WeakPolarHBondContact O-CG 3.17Å; V265-L269 PolarHBondContact O-N 2.98Å; V265-L348 HydrophobicContact CG1-CD2 3.81Å; V265-F353 HydrophobicContact CG2-CE2 4.38Å; V265-L357 HydrophobicContact CG2-CD1 3.24Å; V265-L357 HydrophobicContact CG2-CG 4.16Å
266	A	89.9	Confident	91	Very high	5 Å²	5	62.4 Å²	62.4	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-55.2	-42.1	-179.4	0	0	0	0	0	112.2	Y244 L248 R262 L263 S268 L269	Y244-A266 HydrophobicContact CD2-CB 4.45Å; L248-A266 HydrophobicContact CD1-CB 3.82Å; R262-A266 WeakPolarHBondContact O-CB 3.23Å; R262-A266 PolarHBondContact O-N 2.79Å; L263-A266 WeakPolarHBondContact O-CB 3.29Å; L263-A266 PolarHBondContact O-N 3.14Å; A266-S268 PolarHBondContact O-N 3.42Å; A266-L269 PolarHBondContact O-N 2.97Å
267	D	88.4	Confident	91.4	Very high	83 Å²	83	63.2 Å²	63.2	44%	0.444	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-14.9	176.1	-76.1	-13.3	0	0	0	113.4	R241 L263 V265	R241-D267 IonicContact CZ-OD1 3.1Å; R241-D267 IonicContact CZ-OD2 2.77Å; R241-D267 IonicContact NE-OD1 3.26Å; R241-D267 PolarHBondContact NE-OD1 3.5Å; R241-D267 IonicContact NE-OD2 3.53Å; R241-D267 VanDerWaalsContact NH2-CG 3.3Å; R241-D267 IonicContact NH2-OD1 3.8Å; R241-D267 PolarHBondContact NH2-OD1 2.86Å; R241-D267 VanDerWaalsContact NH2-OD1 3.1Å; R241-D267 IonicContact NH2-OD2 3.37Å; R241-D267 PolarHBondContact NH2-OD2 2.76Å; L263-D267 PolarHBondContact O-N 3.38Å; V265-D267 VanDerWaalsContact C-N 3.26Å; V265-D267 PolarHBondContact O-N 2.83Å
268	S	90.2	Very high	91.9	Very high	13 Å²	13	66.8 Å²	66.8	9%	0.091	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.3	179.8	-61.7	0	0	0	0	113.9	T264 V265 A266 R352	T264-S268 PolarHBondContact O-N 3.5Å; T264-S268 PolarHBondContact O-OG 3.36Å; V265-S268 CarbonylContact O-C 3.53Å; V265-S268 WeakPolarHBondContact O-CA 3.4Å; V265-S268 WeakPolarHBondContact O-CB 3.47Å; V265-S268 PolarHBondContact O-N 3.01Å; A266-S268 PolarHBondContact O-N 3.42Å; S268-R352 WeakPolarHBondContact O-CD 3.47Å; S268-R352 PolarHBondContact O-NE 2.94Å; S268-R352 PolarHBondContact O-NH2 3.49Å
269	L	90.3	Very high	92.2	Very high	14 Å²	14	68.6 Å²	68.6	7%	0.073	35%	0.346	C	S	.	.			trans	-72.1	140.2	-178.8	-68	174.2	0	0	0	112	Y244 L248 V265 A266 I292 V346 L348	Y244-L269 HydrophobicContact CD1-CD1 4.47Å; Y244-L269 HydrophobicContact CD2-CD1 4.08Å; Y244-L269 HydrophobicContact CE2-CB 4.43Å; Y244-L269 HydrophobicContact CE2-CD1 4.46Å; Y244-L269 HydrophobicContact CG-CD1 4.09Å; L248-L269 HydrophobicContact CD1-CD1 4.24Å; L248-L269 HydrophobicContact CD2-CD1 4.33Å; L248-L269 HydrophobicContact CG-CD1 4.48Å; V265-L269 HydrophobicContact CG1-CD2 4.34Å; V265-L269 WeakPolarHBondContact O-CG 3.17Å; V265-L269 PolarHBondContact O-N 2.98Å; A266-L269 PolarHBondContact O-N 2.97Å; L269-I292 HydrophobicContact CD2-CD1 4.49Å; L269-V346 HydrophobicContact CB-CB 4.13Å; L269-V346 HydrophobicContact CB-CG1 4.24Å; L269-V346 HydrophobicContact CD1-CB 4.33Å; L269-V346 HydrophobicContact CD1-CG2 4.07Å; L269-V346 HydrophobicContact CD2-CB 4.3Å; L269-V346 HydrophobicContact CD2-CG2 4.28Å; L269-V346 HydrophobicContact CG-CB 4.48Å; L269-L348 HydrophobicContact CD2-CB 4.13Å; L269-L348 HydrophobicContact CD2-CD2 4.33Å
270	E	90.8	Very high	92.6	Very high	74 Å²	74	64.3 Å²	64.3	35%	0.346	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.2	174.2	-64.1	-173.3	167.6	0	0	110.8	V346 K347 R352	E270-V346 CarbonylContact O-C 3.55Å; E270-V346 VanDerWaalsContact O-CA 3.28Å; E270-V346 WeakPolarHBondContact O-CA 3Å; E270-K347 HydrophobicContact CB-CG 3.94Å; E270-K347 PolarHBondContact N-O 3.25Å; E270-K347 PolarHBondContact O-N 3.1Å; E270-K347 VanDerWaalsContact OE2-CE 3.32Å; E270-K347 WeakPolarHBondContact OE2-CE 3.49Å; E270-R352 IonicContact OE1-CZ 3.63Å; E270-R352 IonicContact OE1-NH1 2.8Å; E270-R352 PolarHBondContact OE1-NH1 3.34Å
271	P	90.5	Very high	92.8	Very high	96 Å²	96	55.9 Å²	55.9	62%	0.623	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	136.6	176.9	29.8	-33.2	0	0	0	111
272	V	93.4	Very high	93	Very high	29 Å²	29	56.1 Å²	56.1	18%	0.176	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	146.5	176	-69.5	0	0	0	0	110.3	F274 F291 C345 K347	V272-F274 HydrophobicContact CB-CE2 4.12Å; V272-F274 HydrophobicContact CB-CZ 4.18Å; V272-F274 HydrophobicContact CG2-CE2 3.65Å; V272-F274 HydrophobicContact CG2-CZ 3.94Å; V272-F291 HydrophobicContact CG2-CD1 4.28Å; V272-F291 HydrophobicContact CG2-CE1 4.19Å; V272-C345 HydrophobicContact CG2-CB 3.93Å; V272-C345 PolarHBondContact N-O 3.27Å; V272-C345 PolarHBondContact O-N 3.36Å; V272-K347 HydrophobicContact CG1-CD 3.77Å; V272-K347 HydrophobicContact CG1-CG 4.01Å; V272-K347 HydrophobicContact CG2-CB 4.38Å; V272-K347 HydrophobicContact CG2-CG 4.36Å
273	Q	94.3	Very high	93.1	Very high	140 Å²	140	55.5 Å²	55.5	65%	0.654	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.6	-177.5	-54.9	-176.4	14.5	0	0	109.7	L343 K344	Q273-L343 WeakPolarHBondContact CA-O 3.48Å; Q273-K344 HydrophobicContact CG-CG 4.19Å
274	F	96.1	Very high	93.1	Very high	27 Å²	27	56 Å²	56	12%	0.118	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	141.4	-178.1	-54.6	-86.1	0	0	0	110.7	V272 Q278 I280 F291 A339 L343 C345	V272-F274 HydrophobicContact CB-CE2 4.12Å; V272-F274 HydrophobicContact CB-CZ 4.18Å; V272-F274 HydrophobicContact CG2-CE2 3.65Å; V272-F274 HydrophobicContact CG2-CZ 3.94Å; F274-Q278 HydrophobicContact CB-CB 4.35Å; F274-Q278 HydrophobicContact CD1-CG 4.23Å; F274-I280 HydrophobicContact CB-CG1 4.49Å; F274-I280 HydrophobicContact CD1-CG1 3.88Å; F274-I280 HydrophobicContact CD2-CG1 3.8Å; F274-I280 HydrophobicContact CE1-CB 4.29Å; F274-I280 HydrophobicContact CE1-CG1 3.98Å; F274-I280 HydrophobicContact CE1-CG2 3.97Å; F274-I280 HydrophobicContact CE2-CG1 3.9Å; F274-I280 HydrophobicContact CE2-CG2 3.87Å; F274-I280 HydrophobicContact CG-CG1 3.79Å; F274-I280 HydrophobicContact CZ-CB 4.25Å; F274-I280 HydrophobicContact CZ-CG1 4.01Å; F274-I280 HydrophobicContact CZ-CG2 3.51Å; F274-F291 HydrophobicContact CZ-CE1 4.22Å; F274-A339 HydrophobicContact CB-CB 4.13Å; F274-L343 HydrophobicContact CB-CB 4.32Å; F274-L343 HydrophobicContact CD2-CD2 4.22Å; F274-L343 PolarHBondContact N-O 2.84Å; F274-L343 PolarHBondContact O-N 2.85Å; F274-C345 HydrophobicContact CE2-CB 4.29Å
275	D	97.1	Very high	93.1	Very high	122 Å²	122	58.2 Å²	58.2	65%	0.652	32%	0.322	S	S	*	.			trans	-83.9	163.9	174.6	-69.1	-43.7	0	0	0	111.6	G277 Q278 A339	D275-G277 PolarHBondContact O-N 2.84Å; D275-Q278 WeakPolarHBondContact O-CB 3.36Å; D275-Q278 PolarHBondContact O-N 2.86Å; D275-Q278 VanDerWaalsContact O-N 3.08Å; D275-A339 VanDerWaalsContact O-CB 3.28Å; D275-A339 WeakPolarHBondContact O-CB 3.45Å
276	D	97.6	Very high	93.1	Very high	112 Å²	112	62.8 Å²	62.8	60%	0.599	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	133.7	179.1	-176.4	43	0	0	0	112.2	Q278 R340 G341	D276-Q278 PolarHBondContact O-N 2.97Å; D276-R340 WeakPolarHBondContact OD1-CA 3.32Å; D276-G341 PolarHBondContact OD1-N 2.9Å
277	G	95.6	Very high	92.7	Very high	41 Å²	41	62.6 Å²	62.6	42%	0.423	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-4.1	-179.1	0	0	0	0	0	115.1	D275 V338 A339	D275-G277 PolarHBondContact O-N 2.84Å; G277-V338 WeakPolarHBondContact O-CG1 3.41Å; G277-A339 PolarHBondContact N-O 2.79Å
278	Q	97.6	Very high	92.6	Very high	83 Å²	83	63 Å²	63	39%	0.388	35%	0.352	S	S	.	.			trans	-69.1	135.1	176.4	-168.1	175.5	-5.1	0	0	110.8	F274 D275 D276 V338 A339	F274-Q278 HydrophobicContact CB-CB 4.35Å; F274-Q278 HydrophobicContact CD1-CG 4.23Å; D275-Q278 WeakPolarHBondContact O-CB 3.36Å; D275-Q278 PolarHBondContact O-N 2.86Å; D275-Q278 VanDerWaalsContact O-N 3.08Å; D276-Q278 PolarHBondContact O-N 2.97Å; Q278-V338 WeakPolarHBondContact O-CA 3.5Å; Q278-A339 PolarHBondContact O-N 2.68Å
279	K	96.6	Very high	92.6	Very high	119 Å²	119	64.7 Å²	64.7	52%	0.517	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.7	175	-60.6	-179.6	179.7	176.8	0	109.1	V282 T336 V337 V338	K279-V282 HydrophobicContact CB-CG2 4.29Å; K279-V282 HydrophobicContact CD-CG2 4.15Å; K279-T336 HydrophobicContact CD-CG2 4.11Å; K279-T336 HydrophobicContact CG-CG2 4.21Å; K279-V337 CarbonylContact C-O 3.59Å; K279-V337 WeakPolarHBondContact CA-O 3.26Å; K279-V338 HydrophobicContact CG-CG2 4.13Å
280	I	95.8	Very high	92.5	Very high	21 Å²	21	64.1 Å²	64.1	11%	0.108	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-45.6	178.8	-57.1	86.8	0	0	0	110.2	F274 F291 F322 V337 A339 L343	F274-I280 HydrophobicContact CB-CG1 4.49Å; F274-I280 HydrophobicContact CD1-CG1 3.88Å; F274-I280 HydrophobicContact CD2-CG1 3.8Å; F274-I280 HydrophobicContact CE1-CB 4.29Å; F274-I280 HydrophobicContact CE1-CG1 3.98Å; F274-I280 HydrophobicContact CE1-CG2 3.97Å; F274-I280 HydrophobicContact CE2-CG1 3.9Å; F274-I280 HydrophobicContact CE2-CG2 3.87Å; F274-I280 HydrophobicContact CG-CG1 3.79Å; F274-I280 HydrophobicContact CZ-CB 4.25Å; F274-I280 HydrophobicContact CZ-CG1 4.01Å; F274-I280 HydrophobicContact CZ-CG2 3.51Å; I280-F291 HydrophobicContact CG2-CD1 4.08Å; I280-F291 HydrophobicContact CG2-CE1 3.87Å; I280-F291 HydrophobicContact CG2-CE2 4.31Å; I280-F291 HydrophobicContact CG2-CG 4.39Å; I280-F291 HydrophobicContact CG2-CZ 3.99Å; I280-F322 HydrophobicContact CB-CE2 4.44Å; I280-F322 HydrophobicContact CB-CZ 4.22Å; I280-F322 HydrophobicContact CG2-CE2 3.93Å; I280-F322 HydrophobicContact CG2-CZ 3.74Å; I280-V337 HydrophobicContact CD1-CG1 4.17Å; I280-V337 WeakPolarHBondContact CD1-O 3.27Å; I280-V337 PolarHBondContact N-O 3Å; I280-A339 HydrophobicContact CD1-CB 4.08Å; I280-A339 VanDerWaalsContact CD1-N 3.27Å; I280-L343 HydrophobicContact CD1-CD2 3.8Å; I280-L343 HydrophobicContact CG1-CD2 4.08Å
281	V	94.6	Very high	92.6	Very high	11 Å²	11	60.8 Å²	60.8	7%	0.067	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.1	172.6	-63.8	0	0	0	0	108.9	F291 F322 R333 T336 V337	V281-F291 HydrophobicContact CG1-CD2 4.35Å; V281-F291 HydrophobicContact CG1-CE2 3.79Å; V281-F322 HydrophobicContact CG1-CE2 4.23Å; V281-F322 HydrophobicContact CG2-CD2 4.27Å; V281-F322 HydrophobicContact CG2-CE2 4.14Å; V281-R333 HydrophobicContact CB-CG 4.17Å; V281-T336 CarbonylContact O-C 3.48Å; V281-T336 VanDerWaalsContact O-CA 3.23Å; V281-T336 WeakPolarHBondContact O-CA 3.48Å; V281-T336 WeakPolarHBondContact O-CG2 3.49Å; V281-V337 HydrophobicContact CG2-CB 3.83Å; V281-V337 HydrophobicContact CG2-CG2 3.6Å; V281-V337 PolarHBondContact O-N 3.02Å
282	V	93.8	Very high	92.6	Very high	37 Å²	37	56.3 Å²	56.3	22%	0.224	31%	0.311	C	S	.	.			trans	-114.5	134.5	180	-173.4	0	0	0	0	110.4	K279 G284 E285 R333	K279-V282 HydrophobicContact CB-CG2 4.29Å; K279-V282 HydrophobicContact CD-CG2 4.15Å; V282-G284 PolarHBondContact O-N 3.33Å; V282-E285 HydrophobicContact CB-CG 4.02Å; V282-E285 WeakPolarHBondContact O-CB 3.45Å; V282-E285 PolarHBondContact O-N 2.8Å; V282-R333 VanDerWaalsContact O-CB 3.32Å; V282-R333 WeakPolarHBondContact O-CB 3.08Å
283	Q	92.2	Very high	92.6	Very high	36 Å²	36	54.9 Å²	54.9	17%	0.168	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	131.2	176.9	-175.7	177	-3.6	0	0	111.2	E285 R303 F310 R333 A334 T336	Q283-E285 VanDerWaalsContact C-N 3.34Å; Q283-R303 PolarHBondContact NE2-O 2.79Å; Q283-F310 HydrophobicContact CB-CE1 4.3Å; Q283-R333 WeakPolarHBondContact CA-O 3.41Å; Q283-A334 WeakPolarHBondContact CG-O 3.41Å; Q283-A334 PolarHBondContact NE2-O 2.96Å; Q283-T336 PolarHBondContact N-OG1 3.3Å
284	G	89.9	Confident	92.3	Very high	53 Å²	53	49.8 Å²	49.8	55%	0.546	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-14.7	179.6	0	0	0	0	0	114.8	V282 R333	V282-G284 PolarHBondContact O-N 3.33Å; G284-R333 PolarHBondContact N-O 2.85Å
285	E	91.1	Very high	92.1	Very high	103 Å²	103	53.4 Å²	53.4	48%	0.481	30%	0.297	S	S	.	.	S	Bend	trans	-73.3	150.2	172	-69	-176.1	167.5	0	0	110.8	V282 Q283 G287 P332 R333	V282-E285 HydrophobicContact CB-CG 4.02Å; V282-E285 WeakPolarHBondContact O-CB 3.45Å; V282-E285 PolarHBondContact O-N 2.8Å; Q283-E285 VanDerWaalsContact C-N 3.34Å; E285-G287 PolarHBondContact O-N 3.5Å; E285-P332 CarbonylContact O-C 3.47Å; E285-P332 VanDerWaalsContact O-CA 3.25Å; E285-P332 WeakPolarHBondContact O-CA 3.36Å; E285-R333 WeakPolarHBondContact O-CG 3.31Å; E285-R333 PolarHBondContact O-N 3.3Å
286	P	89.4	Confident	92	Very high	99 Å²	99	49 Å²	49	64%	0.643	28%	0.28	S	S	*	.	B	Isolated β-bridge	trans	-59.3	136.1	173.1	26.3	-34	0	0	0	110.4
287	G	82.6	Confident	91.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	26%	0.258	C	S	.	.			trans	-110.9	116.9	178.2	0	0	0	0	0	112.4	E285 A326 R331	E285-G287 PolarHBondContact O-N 3.5Å; G287-A326 VanDerWaalsContact O-CB 3.31Å; G287-A326 WeakPolarHBondContact O-CB 3.47Å; G287-R331 PolarHBondContact N-O 2.99Å
288	D	85.3	Confident	92	Very high	91 Å²	91	42.6 Å²	42.6	49%	0.487	24%	0.238	S	C	.	.			trans	-122.9	-10.1	177.9	60.8	-25.8	0	0	0	113.8	R350	D288-R350 PolarHBondContact O-N 3.01Å
289	E	89.6	Confident	92	Very high	50 Å²	50	38.7 Å²	38.7	23%	0.234	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	142.1	-179.8	-62.1	178.3	137.1	0	0	112.4	F291 R333 K347	E289-F291 HydrophobicContact CB-CD2 4.38Å; E289-F291 HydrophobicContact CB-CE2 3.61Å; E289-F291 HydrophobicContact CB-CZ 3.94Å; E289-F291 VanDerWaalsContact OE2-CZ 3.29Å; E289-F291 WeakPolarHBondContact OE2-CZ 3.25Å; E289-R333 VanDerWaalsContact O-CZ 3.25Å; E289-R333 PolarHBondContact O-NH1 2.97Å; E289-R333 PolarHBondContact O-NH2 3.41Å; E289-K347 WeakPolarHBondContact OE1-CD 3.45Å; E289-K347 IonicContact OE1-NZ 3.67Å; E289-K347 PolarHBondContact OE1-NZ 2.94Å
290	F	88.9	Confident	91.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.009	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.5	170.1	162.8	-113.4	0	0	0	109.6	V251 I253 L254 I292 Y321 E324 L327 K347 L348	V251-F290 HydrophobicContact CG1-CZ 4.41Å; I253-F290 HydrophobicContact CG2-CE2 4.46Å; I253-F290 HydrophobicContact CG2-CZ 4.3Å; L254-F290 HydrophobicContact CD1-CE1 4.46Å; F290-I292 HydrophobicContact CD1-CD1 4.5Å; F290-I292 HydrophobicContact CD1-CG1 4.21Å; F290-I292 HydrophobicContact CE1-CD1 3.52Å; F290-I292 HydrophobicContact CE1-CG1 3.47Å; F290-I292 VanDerWaalsContact CE1-CG1 3.47Å; F290-I292 HydrophobicContact CE2-CG1 4.47Å; F290-I292 HydrophobicContact CZ-CD1 3.89Å; F290-I292 HydrophobicContact CZ-CG1 3.63Å; F290-Y321 AromaticContact CE2-CD2 3.67Å; F290-Y321 HydrophobicContact CE2-CD2 3.67Å; F290-Y321 AromaticContact CE2-CG 3.9Å; F290-Y321 HydrophobicContact CE2-CG 3.9Å; F290-Y321 HydrophobicContact CZ-CD2 4.41Å; F290-Y321 HydrophobicContact CZ-CG 4.28Å; F290-E324 HydrophobicContact CD2-CB 4.18Å; F290-E324 HydrophobicContact CE2-CB 4.17Å; F290-L327 HydrophobicContact CB-CD1 3.88Å; F290-L327 HydrophobicContact CB-CD2 3.93Å; F290-L327 HydrophobicContact CB-CG 3.73Å; F290-L327 HydrophobicContact CD1-CD1 3.85Å; F290-L327 HydrophobicContact CD2-CD1 4.34Å; F290-L327 HydrophobicContact CE1-CD1 4.42Å; F290-L327 HydrophobicContact CG-CD1 3.78Å; F290-L327 HydrophobicContact CG-CG 4.19Å; F290-K347 CarbonylContact O-C 3.59Å; F290-K347 WeakPolarHBondContact O-CA 3.48Å; F290-L348 HydrophobicContact CD1-CB 4.31Å; F290-L348 PolarHBondContact N-O 2.88Å; F290-L348 PolarHBondContact O-N 3.28Å
291	F	92.4	Very high	91.9	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.2	-176.7	-65.2	-94.6	0	0	0	111.5	V272 F274 I280 V281 E289 Y321 F322 V346 K347	V272-F291 HydrophobicContact CG2-CD1 4.28Å; V272-F291 HydrophobicContact CG2-CE1 4.19Å; F274-F291 HydrophobicContact CZ-CE1 4.22Å; I280-F291 HydrophobicContact CG2-CD1 4.08Å; I280-F291 HydrophobicContact CG2-CE1 3.87Å; I280-F291 HydrophobicContact CG2-CE2 4.31Å; I280-F291 HydrophobicContact CG2-CG 4.39Å; I280-F291 HydrophobicContact CG2-CZ 3.99Å; V281-F291 HydrophobicContact CG1-CD2 4.35Å; V281-F291 HydrophobicContact CG1-CE2 3.79Å; E289-F291 HydrophobicContact CB-CD2 4.38Å; E289-F291 HydrophobicContact CB-CE2 3.61Å; E289-F291 HydrophobicContact CB-CZ 3.94Å; E289-F291 VanDerWaalsContact OE2-CZ 3.29Å; E289-F291 WeakPolarHBondContact OE2-CZ 3.25Å; F291-Y321 VanDerWaalsContact O-CA 3.28Å; F291-Y321 WeakPolarHBondContact O-CA 3.42Å; F291-Y321 WeakPolarHBondContact O-CB 3.45Å; F291-F322 HydrophobicContact CB-CD1 4.13Å; F291-F322 HydrophobicContact CB-CD2 4.09Å; F291-F322 HydrophobicContact CB-CE1 3.63Å; F291-F322 HydrophobicContact CB-CE2 3.58Å; F291-F322 HydrophobicContact CB-CG 4.35Å; F291-F322 HydrophobicContact CB-CZ 3.33Å; F291-F322 HydrophobicContact CD1-CZ 4.35Å; F291-F322 HydrophobicContact CD2-CD2 4.12Å; F291-F322 AromaticContact CD2-CE2 3.49Å; F291-F322 HydrophobicContact CD2-CE2 3.49Å; F291-F322 VanDerWaalsContact CD2-CE2 3.49Å; F291-F322 HydrophobicContact CD2-CZ 4.02Å; F291-F322 HydrophobicContact CE2-CE2 4.32Å; F291-F322 HydrophobicContact CG-CD2 4.44Å; F291-F322 HydrophobicContact CG-CE1 4.44Å; F291-F322 AromaticContact CG-CE2 3.66Å; F291-F322 HydrophobicContact CG-CE2 3.66Å; F291-F322 AromaticContact CG-CZ 3.67Å; F291-F322 HydrophobicContact CG-CZ 3.67Å; F291-F322 PolarHBondContact N-O 3.31Å; F291-F322 PolarHBondContact O-N 3Å; F291-V346 CarbonylContact C-O 3.53Å; F291-V346 WeakPolarHBondContact CA-O 3.22Å; F291-K347 HydrophobicContact CD1-CB 3.65Å; F291-K347 HydrophobicContact CE1-CB 3.61Å; F291-K347 HydrophobicContact CE1-CD 4.02Å; F291-K347 HydrophobicContact CE1-CG 4.42Å; F291-K347 HydrophobicContact CG-CB 4.35Å; F291-K347 HydrophobicContact CZ-CB 4.28Å; F291-K347 HydrophobicContact CZ-CD 4.39Å
292	I	91.1	Very high	91.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.4	174.6	-28.3	178.3	0	0	0	109.5	F247 L248 V251 L269 F290 C345 V346	F247-I292 HydrophobicContact CD1-CG2 4.19Å; F247-I292 HydrophobicContact CE1-CB 3.67Å; F247-I292 HydrophobicContact CE1-CD1 4.45Å; F247-I292 HydrophobicContact CE1-CG2 3.1Å; F247-I292 HydrophobicContact CZ-CB 4.21Å; F247-I292 HydrophobicContact CZ-CG2 3.45Å; F247-I292 VanDerWaalsContact CZ-CG2 3.45Å; L248-I292 HydrophobicContact CD2-CD1 3.63Å; V251-I292 HydrophobicContact CG2-CD1 4.43Å; V251-I292 HydrophobicContact CG2-CG2 3.9Å; L269-I292 HydrophobicContact CD2-CD1 4.49Å; F290-I292 HydrophobicContact CD1-CD1 4.5Å; F290-I292 HydrophobicContact CD1-CG1 4.21Å; F290-I292 HydrophobicContact CE1-CD1 3.52Å; F290-I292 HydrophobicContact CE1-CG1 3.47Å; F290-I292 VanDerWaalsContact CE1-CG1 3.47Å; F290-I292 HydrophobicContact CE2-CG1 4.47Å; F290-I292 HydrophobicContact CZ-CD1 3.89Å; F290-I292 HydrophobicContact CZ-CG1 3.63Å; I292-C345 CarbonylContact O-C 3.51Å; I292-C345 WeakPolarHBondContact O-CA 3.36Å; I292-C345 WeakPolarHBondContact O-CB 3.44Å; I292-V346 HydrophobicContact CB-CG2 3.85Å; I292-V346 HydrophobicContact CD1-CG2 4.23Å; I292-V346 HydrophobicContact CG1-CG2 4.09Å; I292-V346 PolarHBondContact N-O 2.84Å; I292-V346 PolarHBondContact O-N 2.9Å
293	I	92.5	Very high	91.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	114.5	-172.5	-59	177.9	0	0	0	111.1	F247 A298 L316 P318 S319 D320 F322 L343	F247-I293 VanDerWaalsContact CE2-O 3.24Å; F247-I293 WeakPolarHBondContact CE2-O 3.33Å; F247-I293 WeakPolarHBondContact CZ-O 2.93Å; I293-A298 HydrophobicContact CD1-CB 4.09Å; I293-L316 HydrophobicContact CD1-CB 3.37Å; I293-L316 HydrophobicContact CD1-CD1 4.19Å; I293-L316 HydrophobicContact CD1-CG 4.43Å; I293-P318 WeakPolarHBondContact O-CA 3.37Å; I293-S319 PolarHBondContact O-N 3.38Å; I293-D320 PolarHBondContact N-O 3.39Å; I293-F322 HydrophobicContact CD1-CE1 4.28Å; I293-F322 HydrophobicContact CG1-CE1 4.1Å; I293-L343 HydrophobicContact CD1-CD1 4.42Å; I293-L343 HydrophobicContact CG1-CD1 4.46Å; I293-L343 HydrophobicContact CG2-CD1 3.66Å
294	L	89.4	Confident	91.3	Very high	33 Å²	33	48.1 Å²	48.1	17%	0.173	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-48.1	177.5	-62	177.3	0	0	0	112.3	M243 Y244 F247 K344 V346	M243-L294 HydrophobicContact CE-CD1 4.44Å; Y244-L294 HydrophobicContact CD1-CD2 4.34Å; Y244-L294 HydrophobicContact CE1-CD1 3.93Å; Y244-L294 HydrophobicContact CE1-CD2 4.12Å; F247-L294 HydrophobicContact CD1-CD2 3.91Å; F247-L294 HydrophobicContact CD2-CD2 4.33Å; F247-L294 HydrophobicContact CE1-CD2 3.73Å; F247-L294 HydrophobicContact CE2-CD2 4.21Å; F247-L294 HydrophobicContact CG-CD2 4.19Å; F247-L294 HydrophobicContact CZ-CD2 3.96Å; L294-K344 HydrophobicContact CB-CB 4.46Å; L294-K344 WeakPolarHBondContact CB-O 3.48Å; L294-K344 PolarHBondContact N-O 3.31Å; L294-V346 HydrophobicContact CD1-CG1 3.79Å; L294-V346 HydrophobicContact CD2-CG2 4.26Å; L294-V346 HydrophobicContact CG-CG1 4.36Å; L294-V346 HydrophobicContact CG-CG2 4.36Å
295	E	91	Very high	91	Very high	102 Å²	102	48.8 Å²	48.8	48%	0.477	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.3	-177.1	-64.6	178.9	177.7	0	0	109.8	L343 K344	E295-L343 WeakPolarHBondContact O-CD1 3.43Å; E295-K344 HydrophobicContact CB-CB 4.19Å; E295-K344 HydrophobicContact CB-CG 4.45Å; E295-K344 PolarHBondContact N-O 2.91Å; E295-K344 PolarHBondContact O-N 2.98Å; E295-K344 IonicContact OE1-NZ 3.78Å; E295-K344 WeakPolarHBondContact OE2-CD 3.4Å; E295-K344 WeakPolarHBondContact OE2-CE 2.96Å; E295-K344 IonicContact OE2-NZ 3.93Å; E295-K344 PolarHBondContact OE2-NZ 3.5Å
296	G	94	Very high	90.5	Very high	30 Å²	30	51.2 Å²	51.2	31%	0.309	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.7	-168.7	-179.5	0	0	0	0	0	113.3	P318	G296-P318 WeakPolarHBondContact O-CD 3.45Å
297	S	96.6	Very high	90.2	Very high	19 Å²	19	54.4 Å²	54.4	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.6	179.5	-179.3	0	0	0	0	110.9	L316 Q317 R340	S297-L316 WeakPolarHBondContact CA-O 3.41Å; S297-L316 PolarHBondContact OG-O 3.28Å; S297-Q317 PolarHBondContact OG-NE2 3.01Å; S297-R340 PolarHBondContact O-N 3.12Å
298	A	97.4	Very high	90.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.2	174.3	0	0	0	0	0	111	I293 R315 L316 V337 V338 L343	I293-A298 HydrophobicContact CD1-CB 4.09Å; A298-R315 CarbonylContact O-C 3.54Å; A298-R315 VanDerWaalsContact O-CA 3.31Å; A298-R315 WeakPolarHBondContact O-CA 3.34Å; A298-L316 HydrophobicContact CB-CB 4.43Å; A298-L316 PolarHBondContact N-O 3.25Å; A298-L316 PolarHBondContact O-N 2.85Å; A298-V337 HydrophobicContact CB-CG1 3.68Å; A298-V338 CarbonylContact C-O 3.5Å; A298-V338 VanDerWaalsContact CA-O 3.27Å; A298-V338 WeakPolarHBondContact CA-O 3.26Å; A298-L343 HydrophobicContact CB-CD1 4.44Å; A298-L343 HydrophobicContact CB-CD2 4.03Å
299	A	96.8	Very high	90.7	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.4	171.3	0	0	0	0	0	110	L301 E312 V337 V338 R340	A299-L301 HydrophobicContact CB-CD2 4.42Å; A299-E312 HydrophobicContact CB-CG 4.24Å; A299-V337 WeakPolarHBondContact O-CA 3.47Å; A299-V338 PolarHBondContact N-O 2.77Å; A299-V338 PolarHBondContact O-N 3.35Å; A299-R340 HydrophobicContact CB-CG 3.84Å; A299-R340 VanDerWaalsContact CB-NE 3.34Å
300	V	96.5	Very high	90.8	Very high	25 Å²	25	64.2 Å²	64.2	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.3	175.1	-172.6	0	0	0	0	107.8	E312 V313 G314 L316 A335 V337	V300-E312 CarbonylContact O-C 3.51Å; V300-E312 WeakPolarHBondContact O-CA 3.09Å; V300-V313 HydrophobicContact CB-CG2 4.02Å; V300-V313 HydrophobicContact CG1-CG2 3.7Å; V300-V313 WeakPolarHBondContact O-CG2 3.38Å; V300-V313 PolarHBondContact O-N 2.89Å; V300-G314 PolarHBondContact N-O 3.31Å; V300-L316 HydrophobicContact CG2-CD1 3.83Å; V300-L316 HydrophobicContact CG2-CD2 4.22Å; V300-L316 HydrophobicContact CG2-CG 3.75Å; V300-A335 HydrophobicContact CG1-CB 3.55Å; V300-V337 HydrophobicContact CG2-CG2 4.47Å
301	L	94.4	Very high	91.1	Very high	29 Å²	29	68.4 Å²	68.4	15%	0.152	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.3	-179.1	-52.6	-176.5	0	0	0	109.9	A299 F310 V311 E312 A335 T336 V338	A299-L301 HydrophobicContact CB-CD2 4.42Å; L301-F310 HydrophobicContact CB-CB 4.16Å; L301-F310 HydrophobicContact CB-CD1 4.1Å; L301-F310 HydrophobicContact CB-CG 4.46Å; L301-F310 HydrophobicContact CD1-CB 4.44Å; L301-V311 CarbonylContact C-O 3.59Å; L301-V311 WeakPolarHBondContact CA-O 2.99Å; L301-E312 HydrophobicContact CD2-CB 3.68Å; L301-E312 HydrophobicContact CD2-CG 4.01Å; L301-A335 WeakPolarHBondContact O-CB 3.24Å; L301-T336 PolarHBondContact N-O 3.1Å; L301-T336 PolarHBondContact O-N 3.37Å; L301-V338 HydrophobicContact CD1-CG2 3.66Å; L301-V338 HydrophobicContact CG-CG2 4.16Å
302	Q	92.4	Very high	91.2	Very high	76 Å²	76	71.7 Å²	71.7	36%	0.355	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.5	178.9	-164	175.7	25.5	0	0	110.5	V311 V313 A334 A335	Q302-V311 PolarHBondContact N-O 3.24Å; Q302-V311 PolarHBondContact O-N 3.02Å; Q302-V313 HydrophobicContact CB-CG1 3.81Å; Q302-V313 HydrophobicContact CB-CG2 4.06Å; Q302-A334 PolarHBondContact NE2-O 3.37Å; Q302-A334 VanDerWaalsContact NE2-O 3.16Å; Q302-A335 HydrophobicContact CB-CB 4.31Å; Q302-A335 HydrophobicContact CG-CB 4.45Å
303	R	90.4	Very high	91.2	Very high	67 Å²	67	75.7 Å²	75.7	25%	0.253	38%	0.378	S	S	.	.			trans	-109.4	137.9	165.2	63.8	176.8	-178.7	166	2.8	109.2	Q283 E306 F310	Q283-R303 PolarHBondContact NE2-O 2.79Å; R303-E306 PolarHBondContact NH1-O 2.85Å; R303-E306 VanDerWaalsContact NH1-O 3.17Å; R303-E306 IonicContact NH2-OE1 3.99Å; R303-F310 HydrophobicContact CB-CD1 4.19Å; R303-F310 HydrophobicContact CB-CE1 4.27Å; R303-F310 HydrophobicContact CG-CD1 4.32Å; R303-F310 HydrophobicContact CG-CE1 3.89Å; R303-F310 HydrophobicContact CG-CZ 4.23Å
304	R	84.9	Confident	91.3	Very high	225 Å²	225	77.2 Å²	77.2	85%	0.849	39%	0.393	S	S	*	.	S	Bend	trans	-84.9	-23.2	179.7	-53.2	-179.5	170.7	-158.5	-3.1	112.3	E308	R304-E308 VanDerWaalsContact CB-OE2 3.24Å; R304-E308 WeakPolarHBondContact CB-OE2 3.28Å; R304-E308 PolarHBondContact N-OE2 2.86Å
305	S	84.4	Confident	91.5	Very high	67 Å²	67	82.9 Å²	82.9	47%	0.469	41%	0.413	S	S	.	.	S	Bend	trans	-142.2	159.5	177.2	-72	0	0	0	0	110.3	N307 E308	S305-N307 PolarHBondContact O-N 2.91Å; S305-E308 PolarHBondContact O-N 3.25Å; S305-E308 VanDerWaalsContact O-N 3.16Å
306	E	79.8	Confident	91.7	Very high	154 Å²	154	79.4 Å²	79.4	72%	0.72	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.1	-178.5	-76.2	-162.2	132	0	0	113.7	R303 E308	R303-E306 PolarHBondContact NH1-O 2.85Å; R303-E306 VanDerWaalsContact NH1-O 3.17Å; R303-E306 IonicContact NH2-OE1 3.99Å; E306-E308 VanDerWaalsContact C-N 3.35Å
307	N	83.9	Confident	91.7	Very high	167 Å²	167	82.4 Å²	82.4	89%	0.893	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1.4	-178.5	-65.5	-18.6	0	0	0	113.9	S305	S305-N307 PolarHBondContact O-N 2.91Å
308	E	89.1	Confident	91.4	Very high	94 Å²	94	84.4 Å²	84.4	44%	0.439	42%	0.415	S	S	.	.	S	Bend	trans	-98.1	150.7	177.5	-71.3	-178.4	179	0	0	111.6	R304 S305 E306	R304-E308 VanDerWaalsContact CB-OE2 3.24Å; R304-E308 WeakPolarHBondContact CB-OE2 3.28Å; R304-E308 PolarHBondContact N-OE2 2.86Å; S305-E308 PolarHBondContact O-N 3.25Å; S305-E308 VanDerWaalsContact O-N 3.16Å; E306-E308 VanDerWaalsContact C-N 3.35Å
309	E	89.9	Confident	90.8	Very high	173 Å²	173	85.9 Å²	85.9	81%	0.808	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-70.9	155	172.2	-65.7	-167.5	167.5	0	0	111.6	V311	E309-V311 PolarHBondContact O-N 3.04Å
310	F	91.8	Very high	90.5	Very high	80 Å²	80	89 Å²	89	35%	0.351	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-68.9	123.2	174	-79.6	-74.1	0	0	0	110.6	Q283 L301 R303 T336	Q283-F310 HydrophobicContact CB-CE1 4.3Å; L301-F310 HydrophobicContact CB-CB 4.16Å; L301-F310 HydrophobicContact CB-CD1 4.1Å; L301-F310 HydrophobicContact CB-CG 4.46Å; L301-F310 HydrophobicContact CD1-CB 4.44Å; R303-F310 HydrophobicContact CB-CD1 4.19Å; R303-F310 HydrophobicContact CB-CE1 4.27Å; R303-F310 HydrophobicContact CG-CD1 4.32Å; R303-F310 HydrophobicContact CG-CE1 3.89Å; R303-F310 HydrophobicContact CG-CZ 4.23Å; F310-T336 WeakPolarHBondContact CE1-OG1 3.48Å
311	V	93.5	Very high	90.1	Very high	91 Å²	91	89.7 Å²	89.7	55%	0.552	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.1	175.9	-176	0	0	0	0	109.5	L301 Q302 E309 V313	L301-V311 CarbonylContact C-O 3.59Å; L301-V311 WeakPolarHBondContact CA-O 2.99Å; Q302-V311 PolarHBondContact N-O 3.24Å; Q302-V311 PolarHBondContact O-N 3.02Å; E309-V311 PolarHBondContact O-N 3.04Å; V311-V313 PolarHBondContact O-N 3.16Å
312	E	94.5	Very high	89.9	Confident	73 Å²	73	89 Å²	89	34%	0.341	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	113.5	173.7	-170.3	169.1	126.4	0	0	109.6	A299 V300 L301 R315 R340	A299-E312 HydrophobicContact CB-CG 4.24Å; V300-E312 CarbonylContact O-C 3.51Å; V300-E312 WeakPolarHBondContact O-CA 3.09Å; L301-E312 HydrophobicContact CD2-CB 3.68Å; L301-E312 HydrophobicContact CD2-CG 4.01Å; E312-R315 IonicContact OE1-CZ 3.72Å; E312-R315 IonicContact OE1-NE 2.74Å; E312-R315 PolarHBondContact OE1-NE 2.96Å; E312-R315 IonicContact OE1-NH2 2.8Å; E312-R315 PolarHBondContact OE1-NH2 3.25Å; E312-R315 IonicContact OE2-NH2 3.97Å; E312-R340 IonicContact OE2-CZ 3.78Å; E312-R340 IonicContact OE2-NE 3.96Å; E312-R340 IonicContact OE2-NH2 2.75Å; E312-R340 PolarHBondContact OE2-NH2 3.28Å
313	V	92.8	Very high	89.4	Confident	85 Å²	85	86 Å²	86	52%	0.515	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-13.4	-177.7	-65.6	0	0	0	0	112.8	V300 Q302 V311	V300-V313 HydrophobicContact CB-CG2 4.02Å; V300-V313 HydrophobicContact CG1-CG2 3.7Å; V300-V313 WeakPolarHBondContact O-CG2 3.38Å; V300-V313 PolarHBondContact O-N 2.89Å; Q302-V313 HydrophobicContact CB-CG1 3.81Å; Q302-V313 HydrophobicContact CB-CG2 4.06Å; V311-V313 PolarHBondContact O-N 3.16Å
314	G	92.8	Very high	88.8	Confident	31 Å²	31	85.1 Å²	85.1	32%	0.32	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	172.8	178.5	0	0	0	0	0	113.2	V300	V300-G314 PolarHBondContact N-O 3.31Å
315	R	95.1	Very high	88.4	Confident	153 Å²	153	76.8 Å²	76.8	58%	0.577	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	143.1	172.9	-67.9	-174.2	-178.1	-154.7	-4.5	109.7	A298 E312	A298-R315 CarbonylContact O-C 3.54Å; A298-R315 VanDerWaalsContact O-CA 3.31Å; A298-R315 WeakPolarHBondContact O-CA 3.34Å; E312-R315 IonicContact OE1-CZ 3.72Å; E312-R315 IonicContact OE1-NE 2.74Å; E312-R315 PolarHBondContact OE1-NE 2.96Å; E312-R315 IonicContact OE1-NH2 2.8Å; E312-R315 PolarHBondContact OE1-NH2 3.25Å; E312-R315 IonicContact OE2-NH2 3.97Å
316	L	94.4	Very high	88	Confident	28 Å²	28	73.8 Å²	73.8	15%	0.147	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141	176.7	-53.5	176.9	0	0	0	109	I293 S297 A298 V300 D320 F322 V337	I293-L316 HydrophobicContact CD1-CB 3.37Å; I293-L316 HydrophobicContact CD1-CD1 4.19Å; I293-L316 HydrophobicContact CD1-CG 4.43Å; S297-L316 WeakPolarHBondContact CA-O 3.41Å; S297-L316 PolarHBondContact OG-O 3.28Å; A298-L316 HydrophobicContact CB-CB 4.43Å; A298-L316 PolarHBondContact N-O 3.25Å; A298-L316 PolarHBondContact O-N 2.85Å; V300-L316 HydrophobicContact CG2-CD1 3.83Å; V300-L316 HydrophobicContact CG2-CD2 4.22Å; V300-L316 HydrophobicContact CG2-CG 3.75Å; L316-D320 WeakPolarHBondContact CA-OD2 3.49Å; L316-D320 HydrophobicContact CB-CB 4.01Å; L316-D320 HydrophobicContact CD2-CB 4.14Å; L316-F322 HydrophobicContact CD1-CB 4Å; L316-F322 HydrophobicContact CD1-CD1 3.54Å; L316-F322 HydrophobicContact CD1-CE1 4.34Å; L316-F322 HydrophobicContact CD1-CG 4.05Å; L316-V337 HydrophobicContact CD1-CG1 4.41Å
317	Q	93.7	Very high	87.8	Confident	93 Å²	93	66.6 Å²	66.6	44%	0.435	34%	0.344	S	S	.	.			trans	-118.7	173.5	-177.9	-64.2	-57.4	-50.8	0	0	109.9	S297 S319 D320	S297-Q317 PolarHBondContact OG-NE2 3.01Å; Q317-S319 PolarHBondContact O-N 3.12Å; Q317-D320 PolarHBondContact N-OD2 3.43Å; Q317-D320 VanDerWaalsContact O-CB 3.26Å; Q317-D320 WeakPolarHBondContact O-CB 3.28Å; Q317-D320 PolarHBondContact O-N 3.49Å
318	P	90.5	Very high	87.5	Confident	61 Å²	61	60.5 Å²	60.5	40%	0.396	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	138.4	172.2	-28.1	38.8	0	0	0	111.9	I293 G296 D320	I293-P318 WeakPolarHBondContact O-CA 3.37Å; G296-P318 WeakPolarHBondContact O-CD 3.45Å; P318-D320 VanDerWaalsContact C-N 3.27Å; P318-D320 PolarHBondContact O-N 3.35Å
319	S	85.3	Confident	86.9	Confident	32 Å²	32	60.3 Å²	60.3	22%	0.224	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	-7.5	-171.7	-55.1	0	0	0	0	116.2	F247 I293 Q317	F247-S319 WeakPolarHBondContact CD2-OG 3.24Å; F247-S319 VanDerWaalsContact CE2-N 3.27Å; F247-S319 VanDerWaalsContact CE2-OG 3.28Å; F247-S319 WeakPolarHBondContact CE2-OG 3.32Å; I293-S319 PolarHBondContact O-N 3.38Å; Q317-S319 PolarHBondContact O-N 3.12Å
320	D	89.6	Confident	86.1	Confident	64 Å²	64	57.5 Å²	57.5	34%	0.342	30%	0.302	S	S	.	.			trans	-77.1	159	165.6	-64.2	-31.6	0	0	0	111.1	I293 L316 Q317 P318	I293-D320 PolarHBondContact N-O 3.39Å; L316-D320 WeakPolarHBondContact CA-OD2 3.49Å; L316-D320 HydrophobicContact CB-CB 4.01Å; L316-D320 HydrophobicContact CD2-CB 4.14Å; Q317-D320 PolarHBondContact N-OD2 3.43Å; Q317-D320 VanDerWaalsContact O-CB 3.26Å; Q317-D320 WeakPolarHBondContact O-CB 3.28Å; Q317-D320 PolarHBondContact O-N 3.49Å; P318-D320 VanDerWaalsContact C-N 3.27Å; P318-D320 PolarHBondContact O-N 3.35Å
321	Y	89.3	Confident	85.6	Confident	41 Å²	41	58.6 Å²	58.6	16%	0.161	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	162.4	-179.4	62.8	-94.4	0	0	0	111.1	V251 S252 I253 F290 F291 E324 F374	V251-Y321 HydrophobicContact CG1-CD1 3.66Å; V251-Y321 HydrophobicContact CG1-CE1 3.91Å; V251-Y321 HydrophobicContact CG1-CG 4.28Å; S252-Y321 WeakPolarHBondContact OG-CE1 3.16Å; S252-Y321 PolarHBondContact OG-OH 3.4Å; I253-Y321 HydrophobicContact CB-CE2 4.21Å; I253-Y321 HydrophobicContact CG2-CD2 4.37Å; I253-Y321 HydrophobicContact CG2-CE1 4.31Å; I253-Y321 HydrophobicContact CG2-CE2 3.92Å; F290-Y321 AromaticContact CE2-CD2 3.67Å; F290-Y321 HydrophobicContact CE2-CD2 3.67Å; F290-Y321 AromaticContact CE2-CG 3.9Å; F290-Y321 HydrophobicContact CE2-CG 3.9Å; F290-Y321 HydrophobicContact CZ-CD2 4.41Å; F290-Y321 HydrophobicContact CZ-CG 4.28Å; F291-Y321 VanDerWaalsContact O-CA 3.28Å; F291-Y321 WeakPolarHBondContact O-CA 3.42Å; F291-Y321 WeakPolarHBondContact O-CB 3.45Å; Y321-E324 HydrophobicContact CD2-CB 3.97Å; Y321-E324 HydrophobicContact CD2-CG 4.39Å; Y321-E324 HydrophobicContact CE2-CB 3.8Å; Y321-E324 HydrophobicContact CE2-CG 3.87Å; Y321-F374 VanDerWaalsContact OH-CE1 3.27Å; Y321-F374 WeakPolarHBondContact OH-CE1 3.24Å; Y321-F374 VanDerWaalsContact OH-CZ 3.32Å; Y321-F374 WeakPolarHBondContact OH-CZ 3.39Å
322	F	89.5	Confident	85.3	Confident	14 Å²	14	58.5 Å²	58.5	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	158.9	174.9	59.7	-86.8	0	0	0	111.4	I280 V281 F291 I293 L316 E324 V337	I280-F322 HydrophobicContact CB-CE2 4.44Å; I280-F322 HydrophobicContact CB-CZ 4.22Å; I280-F322 HydrophobicContact CG2-CE2 3.93Å; I280-F322 HydrophobicContact CG2-CZ 3.74Å; V281-F322 HydrophobicContact CG1-CE2 4.23Å; V281-F322 HydrophobicContact CG2-CD2 4.27Å; V281-F322 HydrophobicContact CG2-CE2 4.14Å; F291-F322 HydrophobicContact CB-CD1 4.13Å; F291-F322 HydrophobicContact CB-CD2 4.09Å; F291-F322 HydrophobicContact CB-CE1 3.63Å; F291-F322 HydrophobicContact CB-CE2 3.58Å; F291-F322 HydrophobicContact CB-CG 4.35Å; F291-F322 HydrophobicContact CB-CZ 3.33Å; F291-F322 HydrophobicContact CD1-CZ 4.35Å; F291-F322 HydrophobicContact CD2-CD2 4.12Å; F291-F322 AromaticContact CD2-CE2 3.49Å; F291-F322 HydrophobicContact CD2-CE2 3.49Å; F291-F322 VanDerWaalsContact CD2-CE2 3.49Å; F291-F322 HydrophobicContact CD2-CZ 4.02Å; F291-F322 HydrophobicContact CE2-CE2 4.32Å; F291-F322 HydrophobicContact CG-CD2 4.44Å; F291-F322 HydrophobicContact CG-CE1 4.44Å; F291-F322 AromaticContact CG-CE2 3.66Å; F291-F322 HydrophobicContact CG-CE2 3.66Å; F291-F322 AromaticContact CG-CZ 3.67Å; F291-F322 HydrophobicContact CG-CZ 3.67Å; F291-F322 PolarHBondContact N-O 3.31Å; F291-F322 PolarHBondContact O-N 3Å; I293-F322 HydrophobicContact CD1-CE1 4.28Å; I293-F322 HydrophobicContact CG1-CE1 4.1Å; L316-F322 HydrophobicContact CD1-CB 4Å; L316-F322 HydrophobicContact CD1-CD1 3.54Å; L316-F322 HydrophobicContact CD1-CE1 4.34Å; L316-F322 HydrophobicContact CD1-CG 4.05Å; F322-E324 VanDerWaalsContact C-N 3.3Å; F322-V337 HydrophobicContact CD1-CG1 4.49Å; F322-V337 HydrophobicContact CD2-CB 4.44Å; F322-V337 HydrophobicContact CD2-CG2 3.88Å; F322-V337 HydrophobicContact CE1-CG1 4.19Å; F322-V337 HydrophobicContact CE2-CB 4.2Å; F322-V337 HydrophobicContact CE2-CG1 4.29Å; F322-V337 HydrophobicContact CE2-CG2 4.14Å; F322-V337 HydrophobicContact CG-CG2 4.22Å; F322-V337 HydrophobicContact CZ-CB 4.45Å; F322-V337 HydrophobicContact CZ-CG1 4.07Å
323	G	83.1	Confident	85.1	Confident	14 Å²	14	56 Å²	56	14%	0.144	29%	0.293	C	S	.	.			trans	79.4	17.8	-178.8	0	0	0	0	0	112.9	I325 A326 R333	G323-I325 PolarHBondContact O-N 3.2Å; G323-A326 WeakPolarHBondContact O-CB 3.36Å; G323-A326 PolarHBondContact O-N 3.37Å; G323-R333 VanDerWaalsContact CA-NH1 3.27Å
324	E	77.9	Confident	84.8	Confident	48 Å²	48	55.1 Å²	55.1	22%	0.224	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.3	177.4	72.5	-74.5	175.4	0	0	113	I253 F290 Y321 F322 A326 L327	I253-E324 HydrophobicContact CD1-CB 3.55Å; I253-E324 HydrophobicContact CD1-CG 3.95Å; F290-E324 HydrophobicContact CD2-CB 4.18Å; F290-E324 HydrophobicContact CE2-CB 4.17Å; Y321-E324 HydrophobicContact CD2-CB 3.97Å; Y321-E324 HydrophobicContact CD2-CG 4.39Å; Y321-E324 HydrophobicContact CE2-CB 3.8Å; Y321-E324 HydrophobicContact CE2-CG 3.87Å; F322-E324 VanDerWaalsContact C-N 3.3Å; E324-A326 PolarHBondContact O-N 3.32Å; E324-L327 WeakPolarHBondContact O-CB 3.24Å; E324-L327 PolarHBondContact O-N 2.64Å; E324-L327 VanDerWaalsContact O-N 3.12Å
325	I	75.9	Confident	84.8	Confident	50 Å²	50	54.4 Å²	54.4	26%	0.256	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-30.3	174.1	-59.3	177.3	0	0	0	110.7	G323 L327 L328 M329 R331	G323-I325 PolarHBondContact O-N 3.2Å; I325-L327 PolarHBondContact O-N 2.99Å; I325-L328 PolarHBondContact O-N 3.46Å; I325-M329 PolarHBondContact O-N 3.27Å; I325-R331 HydrophobicContact CG2-CB 4.38Å
326	A	75.9	Confident	84.8	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-26.8	178.3	0	0	0	0	0	112.9	G287 G323 E324 L328 R350	G287-A326 VanDerWaalsContact O-CB 3.31Å; G287-A326 WeakPolarHBondContact O-CB 3.47Å; G323-A326 WeakPolarHBondContact O-CB 3.36Å; G323-A326 PolarHBondContact O-N 3.37Å; E324-A326 PolarHBondContact O-N 3.32Å; A326-L328 VanDerWaalsContact C-N 3.32Å; A326-R350 WeakPolarHBondContact O-CD 3.36Å
327	L	75.4	Confident	84.9	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-73.9	-24.6	173.2	-63.6	179.6	0	0	0	112.5	F290 E324 I325 R350 F353 C360	F290-L327 HydrophobicContact CB-CD1 3.88Å; F290-L327 HydrophobicContact CB-CD2 3.93Å; F290-L327 HydrophobicContact CB-CG 3.73Å; F290-L327 HydrophobicContact CD1-CD1 3.85Å; F290-L327 HydrophobicContact CD2-CD1 4.34Å; F290-L327 HydrophobicContact CE1-CD1 4.42Å; F290-L327 HydrophobicContact CG-CD1 3.78Å; F290-L327 HydrophobicContact CG-CG 4.19Å; E324-L327 WeakPolarHBondContact O-CB 3.24Å; E324-L327 PolarHBondContact O-N 2.64Å; E324-L327 VanDerWaalsContact O-N 3.12Å; I325-L327 PolarHBondContact O-N 2.99Å; L327-R350 HydrophobicContact CD2-CB 4.38Å; L327-F353 HydrophobicContact CD1-CD2 4.17Å; L327-F353 HydrophobicContact CD1-CE2 4.35Å; L327-F353 HydrophobicContact CD2-CB 4.07Å; L327-F353 HydrophobicContact CD2-CD2 4.33Å; L327-F353 HydrophobicContact CD2-CG 4.28Å; L327-C360 HydrophobicContact CB-CB 4.11Å
328	L	76.6	Confident	85	Confident	40 Å²	40	42.3 Å²	42.3	21%	0.209	24%	0.236	C	C	.	.	H	α-helix	trans	-96.1	-45.3	-176.5	-64.3	170.5	0	0	0	112.4	I325 A326 C360 L364	I325-L328 PolarHBondContact O-N 3.46Å; A326-L328 VanDerWaalsContact C-N 3.32Å; L328-C360 HydrophobicContact CD2-CB 4.01Å; L328-L364 HydrophobicContact CD1-CD1 3.67Å; L328-L364 HydrophobicContact CD2-CD1 3.54Å; L328-L364 HydrophobicContact CG-CD1 4.09Å
329	M	76.7	Confident	85.4	Confident	90 Å²	90	39.4 Å²	39.4	44%	0.443	22%	0.217	S	C	.	.			trans	-146.5	149.1	-173.5	-57.4	-162.8	-154.6	0	0	111.3	I325 R331	I325-M329 PolarHBondContact O-N 3.27Å; M329-R331 HydrophobicContact CB-CG 4.28Å; M329-R331 PolarHBondContact O-N 3.16Å
330	N	74.2	Confident	85.9	Confident	113 Å²	113	42.8 Å²	42.8	60%	0.604	23%	0.225	S	C	*	.			trans	-81	84	173.1	-168.4	7.3	0	0	0	109.8
331	R	80.6	Confident	86.2	Confident	104 Å²	104	40.6 Å²	40.6	39%	0.392	22%	0.218	S	C	.	.			trans	-114.9	149.4	176.5	-74	-166.9	176.8	-166	5.6	111	G287 I325 M329 S378	G287-R331 PolarHBondContact N-O 2.99Å; I325-R331 HydrophobicContact CG2-CB 4.38Å; M329-R331 HydrophobicContact CB-CG 4.28Å; M329-R331 PolarHBondContact O-N 3.16Å; R331-S378 PolarHBondContact NH1-O 3.49Å
332	P	87.6	Confident	86.5	Confident	88 Å²	88	43.8 Å²	43.8	57%	0.571	24%	0.243	S	C	*	.	B	Isolated β-bridge	trans	-58	148.1	169.2	-22.6	33.4	0	0	0	111.8	E285 A334	E285-P332 CarbonylContact O-C 3.47Å; E285-P332 VanDerWaalsContact O-CA 3.25Å; E285-P332 WeakPolarHBondContact O-CA 3.36Å; P332-A334 PolarHBondContact O-N 3.09Å
333	R	89.9	Confident	86.8	Confident	22 Å²	22	43.2 Å²	43.2	8%	0.083	24%	0.241	C	C	.	.			trans	-61.2	128.2	177	-61.7	-66.4	-173.1	-173.6	1.9	110.3	V281 V282 Q283 G284 E285 E289 G323 A335	V281-R333 HydrophobicContact CB-CG 4.17Å; V282-R333 VanDerWaalsContact O-CB 3.32Å; V282-R333 WeakPolarHBondContact O-CB 3.08Å; Q283-R333 WeakPolarHBondContact CA-O 3.41Å; G284-R333 PolarHBondContact N-O 2.85Å; E285-R333 WeakPolarHBondContact O-CG 3.31Å; E285-R333 PolarHBondContact O-N 3.3Å; E289-R333 VanDerWaalsContact O-CZ 3.25Å; E289-R333 PolarHBondContact O-NH1 2.97Å; E289-R333 PolarHBondContact O-NH2 3.41Å; G323-R333 VanDerWaalsContact CA-NH1 3.27Å; R333-A335 VanDerWaalsContact C-N 3.33Å; R333-A335 PolarHBondContact O-N 3.47Å
334	A	87.9	Confident	87.3	Confident	66 Å²	66	46.4 Å²	46.4	55%	0.545	25%	0.251	S	S	.	.	S	Bend	trans	-75.3	-21.7	-178.3	0	0	0	0	0	113.8	Q283 Q302 P332	Q283-A334 WeakPolarHBondContact CG-O 3.41Å; Q283-A334 PolarHBondContact NE2-O 2.96Å; Q302-A334 PolarHBondContact NE2-O 3.37Å; Q302-A334 VanDerWaalsContact NE2-O 3.16Å; P332-A334 PolarHBondContact O-N 3.09Å
335	A	91.4	Very high	88.1	Confident	16 Å²	16	44.2 Å²	44.2	13%	0.132	24%	0.241	C	C	.	.	S	Bend	trans	-148.8	162	-178.4	0	0	0	0	0	110.5	V300 L301 Q302 R333	V300-A335 HydrophobicContact CG1-CB 3.55Å; L301-A335 WeakPolarHBondContact O-CB 3.24Å; Q302-A335 HydrophobicContact CB-CB 4.31Å; Q302-A335 HydrophobicContact CG-CB 4.45Å; R333-A335 VanDerWaalsContact C-N 3.33Å; R333-A335 PolarHBondContact O-N 3.47Å
336	T	94.5	Very high	88.9	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	133	171.3	-59.9	0	0	0	0	108.4	K279 V281 Q283 L301 F310 V338	K279-T336 HydrophobicContact CD-CG2 4.11Å; K279-T336 HydrophobicContact CG-CG2 4.21Å; V281-T336 CarbonylContact O-C 3.48Å; V281-T336 VanDerWaalsContact O-CA 3.23Å; V281-T336 WeakPolarHBondContact O-CA 3.48Å; V281-T336 WeakPolarHBondContact O-CG2 3.49Å; Q283-T336 PolarHBondContact N-OG1 3.3Å; L301-T336 PolarHBondContact N-O 3.1Å; L301-T336 PolarHBondContact O-N 3.37Å; F310-T336 WeakPolarHBondContact CE1-OG1 3.48Å; T336-V338 HydrophobicContact CG2-CG2 3.9Å
337	V	96.6	Very high	89.7	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.4	175.1	-173.4	0	0	0	0	108.6	K279 I280 V281 A298 A299 V300 L316 F322	K279-V337 CarbonylContact C-O 3.59Å; K279-V337 WeakPolarHBondContact CA-O 3.26Å; I280-V337 HydrophobicContact CD1-CG1 4.17Å; I280-V337 WeakPolarHBondContact CD1-O 3.27Å; I280-V337 PolarHBondContact N-O 3Å; V281-V337 HydrophobicContact CG2-CB 3.83Å; V281-V337 HydrophobicContact CG2-CG2 3.6Å; V281-V337 PolarHBondContact O-N 3.02Å; A298-V337 HydrophobicContact CB-CG1 3.68Å; A299-V337 WeakPolarHBondContact O-CA 3.47Å; V300-V337 HydrophobicContact CG2-CG2 4.47Å; L316-V337 HydrophobicContact CD1-CG1 4.41Å; F322-V337 HydrophobicContact CD1-CG1 4.49Å; F322-V337 HydrophobicContact CD2-CB 4.44Å; F322-V337 HydrophobicContact CD2-CG2 3.88Å; F322-V337 HydrophobicContact CE1-CG1 4.19Å; F322-V337 HydrophobicContact CE2-CB 4.2Å; F322-V337 HydrophobicContact CE2-CG1 4.29Å; F322-V337 HydrophobicContact CE2-CG2 4.14Å; F322-V337 HydrophobicContact CG-CG2 4.22Å; F322-V337 HydrophobicContact CZ-CB 4.45Å; F322-V337 HydrophobicContact CZ-CG1 4.07Å
338	V	97.4	Very high	90.4	Very high	10 Å²	10	43.7 Å²	43.7	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.4	-174.7	-171.1	0	0	0	0	110	G277 Q278 K279 A298 A299 L301 T336	G277-V338 WeakPolarHBondContact O-CG1 3.41Å; Q278-V338 WeakPolarHBondContact O-CA 3.5Å; K279-V338 HydrophobicContact CG-CG2 4.13Å; A298-V338 CarbonylContact C-O 3.5Å; A298-V338 VanDerWaalsContact CA-O 3.27Å; A298-V338 WeakPolarHBondContact CA-O 3.26Å; A299-V338 PolarHBondContact N-O 2.77Å; A299-V338 PolarHBondContact O-N 3.35Å; L301-V338 HydrophobicContact CD1-CG2 3.66Å; L301-V338 HydrophobicContact CG-CG2 4.16Å; T336-V338 HydrophobicContact CG2-CG2 3.9Å
339	A	98.1	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	139.6	175.9	0	0	0	0	0	111.1	F274 D275 G277 Q278 I280 L343	F274-A339 HydrophobicContact CB-CB 4.13Å; D275-A339 VanDerWaalsContact O-CB 3.28Å; D275-A339 WeakPolarHBondContact O-CB 3.45Å; G277-A339 PolarHBondContact N-O 2.79Å; Q278-A339 PolarHBondContact O-N 2.68Å; I280-A339 HydrophobicContact CD1-CB 4.08Å; I280-A339 VanDerWaalsContact CD1-N 3.27Å; A339-L343 HydrophobicContact CB-CB 3.89Å; A339-L343 HydrophobicContact CB-CD2 3.99Å
340	R	96.6	Very high	91.6	Very high	103 Å²	103	43 Å²	43	39%	0.389	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	94.3	173.1	-63.9	-61.1	-164.8	-168	1.8	107.9	D276 S297 A299 E312	D276-R340 WeakPolarHBondContact OD1-CA 3.32Å; S297-R340 PolarHBondContact O-N 3.12Å; A299-R340 HydrophobicContact CB-CG 3.84Å; A299-R340 VanDerWaalsContact CB-NE 3.34Å; E312-R340 IonicContact OE2-CZ 3.78Å; E312-R340 IonicContact OE2-NE 3.96Å; E312-R340 IonicContact OE2-NH2 2.75Å; E312-R340 PolarHBondContact OE2-NH2 3.28Å
341	G	95.5	Very high	92.3	Very high	19 Å²	19	40.6 Å²	40.6	20%	0.196	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.1	-172.3	-165.5	0	0	0	0	0	112.6	D276 L343	D276-G341 PolarHBondContact OD1-N 2.9Å; G341-L343 PolarHBondContact O-N 3.25Å
342	P	95.4	Very high	92.8	Very high	108 Å²	108	38.9 Å²	38.9	70%	0.701	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	125.9	174.9	27.1	-33.7	0	0	0	110
343	L	96.1	Very high	92.8	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.1	-176.4	-177.7	75.5	0	0	0	109.6	Q273 F274 I280 I293 E295 A298 A339 G341	Q273-L343 WeakPolarHBondContact CA-O 3.48Å; F274-L343 HydrophobicContact CB-CB 4.32Å; F274-L343 HydrophobicContact CD2-CD2 4.22Å; F274-L343 PolarHBondContact N-O 2.84Å; F274-L343 PolarHBondContact O-N 2.85Å; I280-L343 HydrophobicContact CD1-CD2 3.8Å; I280-L343 HydrophobicContact CG1-CD2 4.08Å; I293-L343 HydrophobicContact CD1-CD1 4.42Å; I293-L343 HydrophobicContact CG1-CD1 4.46Å; I293-L343 HydrophobicContact CG2-CD1 3.66Å; E295-L343 WeakPolarHBondContact O-CD1 3.43Å; A298-L343 HydrophobicContact CB-CD1 4.44Å; A298-L343 HydrophobicContact CB-CD2 4.03Å; A339-L343 HydrophobicContact CB-CB 3.89Å; A339-L343 HydrophobicContact CB-CD2 3.99Å; G341-L343 PolarHBondContact O-N 3.25Å
344	K	93.6	Very high	92.7	Very high	81 Å²	81	37.5 Å²	37.5	35%	0.352	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.1	171.8	-59.8	-172.9	-170.7	150.1	0	109.4	Q273 L294 E295	Q273-K344 HydrophobicContact CG-CG 4.19Å; L294-K344 HydrophobicContact CB-CB 4.46Å; L294-K344 WeakPolarHBondContact CB-O 3.48Å; L294-K344 PolarHBondContact N-O 3.31Å; E295-K344 HydrophobicContact CB-CB 4.19Å; E295-K344 HydrophobicContact CB-CG 4.45Å; E295-K344 PolarHBondContact N-O 2.91Å; E295-K344 PolarHBondContact O-N 2.98Å; E295-K344 IonicContact OE1-NZ 3.78Å; E295-K344 WeakPolarHBondContact OE2-CD 3.4Å; E295-K344 WeakPolarHBondContact OE2-CE 2.96Å; E295-K344 IonicContact OE2-NZ 3.93Å; E295-K344 PolarHBondContact OE2-NZ 3.5Å
345	C	93.9	Very high	92.8	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	166	177.2	-60.7	0	0	0	0	110.5	V272 F274 I292	V272-C345 HydrophobicContact CG2-CB 3.93Å; V272-C345 PolarHBondContact N-O 3.27Å; V272-C345 PolarHBondContact O-N 3.36Å; F274-C345 HydrophobicContact CE2-CB 4.29Å; I292-C345 CarbonylContact O-C 3.51Å; I292-C345 WeakPolarHBondContact O-CA 3.36Å; I292-C345 WeakPolarHBondContact O-CB 3.44Å
346	V	92.4	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.3	160.2	-78.9	0	0	0	0	108.7	Y244 L269 E270 F291 I292 L294	Y244-V346 HydrophobicContact CE1-CG1 3.82Å; Y244-V346 WeakPolarHBondContact OH-CG1 3.49Å; L269-V346 HydrophobicContact CB-CB 4.13Å; L269-V346 HydrophobicContact CB-CG1 4.24Å; L269-V346 HydrophobicContact CD1-CB 4.33Å; L269-V346 HydrophobicContact CD1-CG2 4.07Å; L269-V346 HydrophobicContact CD2-CB 4.3Å; L269-V346 HydrophobicContact CD2-CG2 4.28Å; L269-V346 HydrophobicContact CG-CB 4.48Å; E270-V346 CarbonylContact O-C 3.55Å; E270-V346 VanDerWaalsContact O-CA 3.28Å; E270-V346 WeakPolarHBondContact O-CA 3Å; F291-V346 CarbonylContact C-O 3.53Å; F291-V346 WeakPolarHBondContact CA-O 3.22Å; I292-V346 HydrophobicContact CB-CG2 3.85Å; I292-V346 HydrophobicContact CD1-CG2 4.23Å; I292-V346 HydrophobicContact CG1-CG2 4.09Å; I292-V346 PolarHBondContact N-O 2.84Å; I292-V346 PolarHBondContact O-N 2.9Å; L294-V346 HydrophobicContact CD1-CG1 3.79Å; L294-V346 HydrophobicContact CD2-CG2 4.26Å; L294-V346 HydrophobicContact CG-CG1 4.36Å; L294-V346 HydrophobicContact CG-CG2 4.36Å
347	K	93	Very high	92.4	Very high	42 Å²	42	46.6 Å²	46.6	18%	0.183	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	155	176.9	70.7	173.8	-174.6	166.3	0	112.4	E270 V272 E289 F290 F291	E270-K347 HydrophobicContact CB-CG 3.94Å; E270-K347 PolarHBondContact N-O 3.25Å; E270-K347 PolarHBondContact O-N 3.1Å; E270-K347 VanDerWaalsContact OE2-CE 3.32Å; E270-K347 WeakPolarHBondContact OE2-CE 3.49Å; V272-K347 HydrophobicContact CG1-CD 3.77Å; V272-K347 HydrophobicContact CG1-CG 4.01Å; V272-K347 HydrophobicContact CG2-CB 4.38Å; V272-K347 HydrophobicContact CG2-CG 4.36Å; E289-K347 WeakPolarHBondContact OE1-CD 3.45Å; E289-K347 IonicContact OE1-NZ 3.67Å; E289-K347 PolarHBondContact OE1-NZ 2.94Å; F290-K347 CarbonylContact O-C 3.59Å; F290-K347 WeakPolarHBondContact O-CA 3.48Å; F291-K347 HydrophobicContact CD1-CB 3.65Å; F291-K347 HydrophobicContact CE1-CB 3.61Å; F291-K347 HydrophobicContact CE1-CD 4.02Å; F291-K347 HydrophobicContact CE1-CG 4.42Å; F291-K347 HydrophobicContact CG-CB 4.35Å; F291-K347 HydrophobicContact CZ-CB 4.28Å; F291-K347 HydrophobicContact CZ-CD 4.39Å
348	L	90.9	Very high	92	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	127.2	176.4	-175.6	55.9	0	0	0	109.9	V265 L269 F290 R352 F353	V265-L348 HydrophobicContact CG1-CD2 3.81Å; L269-L348 HydrophobicContact CD2-CB 4.13Å; L269-L348 HydrophobicContact CD2-CD2 4.33Å; F290-L348 HydrophobicContact CD1-CB 4.31Å; F290-L348 PolarHBondContact N-O 2.88Å; F290-L348 PolarHBondContact O-N 3.28Å; L348-R352 HydrophobicContact CD1-CB 4.06Å; L348-R352 HydrophobicContact CD1-CG 3.91Å; L348-F353 HydrophobicContact CD2-CB 4.39Å; L348-F353 HydrophobicContact CD2-CD2 3.63Å; L348-F353 HydrophobicContact CD2-CE2 4.47Å; L348-F353 HydrophobicContact CG-CB 4.39Å; L348-F353 HydrophobicContact CG-CD2 4.44Å
349	D	90.3	Very high	91.6	Very high	36 Å²	36	49.7 Å²	49.7	19%	0.193	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	149.1	177.1	63.3	-62.8	0	0	0	111.6	P351 R352 F353	D349-P351 WeakPolarHBondContact OD2-CD 3.4Å; D349-R352 VanDerWaalsContact CG-CB 3.4Å; D349-R352 PolarHBondContact O-N 2.72Å; D349-R352 WeakPolarHBondContact OD1-CB 3.17Å; D349-R352 WeakPolarHBondContact OD1-CD 3.15Å; D349-R352 WeakPolarHBondContact OD2-CB 3.37Å; D349-R352 PolarHBondContact OD2-N 3.05Å; D349-F353 PolarHBondContact O-N 3.09Å
350	R	87.4	Confident	90.7	Very high	80 Å²	80	49.8 Å²	49.8	30%	0.302	25%	0.249	S	C	.	.	H	α-helix	trans	-56.2	-47.2	178.3	-179.1	-178.2	64.7	147.4	4.1	113.3	D288 A326 L327 R352 F353 E354	D288-R350 PolarHBondContact O-N 3.01Å; A326-R350 WeakPolarHBondContact O-CD 3.36Å; L327-R350 HydrophobicContact CD2-CB 4.38Å; R350-R352 VanDerWaalsContact C-N 3.28Å; R350-R352 PolarHBondContact O-N 2.97Å; R350-F353 WeakPolarHBondContact O-CB 3.42Å; R350-F353 PolarHBondContact O-N 3.29Å; R350-F353 VanDerWaalsContact O-N 3.16Å; R350-E354 HydrophobicContact CG-CG 4.13Å; R350-E354 WeakPolarHBondContact O-CG 3.13Å; R350-E354 PolarHBondContact O-N 3.19Å
351	P	89.6	Confident	90	Very high	63 Å²	63	46.7 Å²	46.7	41%	0.409	24%	0.244	S	C	.	.	H	α-helix	trans	-58.3	-38.8	178.8	-24.6	34.5	0	0	0	113.1	D349 R355	D349-P351 WeakPolarHBondContact OD2-CD 3.4Å; P351-R355 WeakPolarHBondContact O-CB 3.32Å; P351-R355 VanDerWaalsContact O-CG 3.27Å; P351-R355 WeakPolarHBondContact O-CG 3.27Å; P351-R355 PolarHBondContact O-N 2.69Å; P351-R355 VanDerWaalsContact O-N 3.12Å; P351-R355 PolarHBondContact O-NE 3.06Å
352	R	90.3	Very high	89.5	Confident	68 Å²	68	49.7 Å²	49.7	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-68.1	-43.1	174.5	-170.6	173.9	-168.3	150.9	-12.7	112.5	S268 E270 L348 D349 R350 E354 R355 V356	S268-R352 WeakPolarHBondContact O-CD 3.47Å; S268-R352 PolarHBondContact O-NE 2.94Å; S268-R352 PolarHBondContact O-NH2 3.49Å; E270-R352 IonicContact OE1-CZ 3.63Å; E270-R352 IonicContact OE1-NH1 2.8Å; E270-R352 PolarHBondContact OE1-NH1 3.34Å; L348-R352 HydrophobicContact CD1-CB 4.06Å; L348-R352 HydrophobicContact CD1-CG 3.91Å; D349-R352 VanDerWaalsContact CG-CB 3.4Å; D349-R352 PolarHBondContact O-N 2.72Å; D349-R352 WeakPolarHBondContact OD1-CB 3.17Å; D349-R352 WeakPolarHBondContact OD1-CD 3.15Å; D349-R352 WeakPolarHBondContact OD2-CB 3.37Å; D349-R352 PolarHBondContact OD2-N 3.05Å; R350-R352 VanDerWaalsContact C-N 3.28Å; R350-R352 PolarHBondContact O-N 2.97Å; R352-E354 PolarHBondContact O-N 3.21Å; R352-R355 PolarHBondContact O-N 3.02Å; R352-V356 VanDerWaalsContact O-CG2 3.26Å; R352-V356 WeakPolarHBondContact O-CG2 3.31Å; R352-V356 PolarHBondContact O-N 3.46Å
353	F	87.1	Confident	88.9	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-56.9	-51.2	174.9	-170.7	-78.6	0	0	0	111.3	L254 V265 L327 L348 D349 R350 R355 V356 L357 C360 I363	L254-F353 HydrophobicContact CD2-CE2 4.27Å; V265-F353 HydrophobicContact CG2-CE2 4.38Å; L327-F353 HydrophobicContact CD1-CD2 4.17Å; L327-F353 HydrophobicContact CD1-CE2 4.35Å; L327-F353 HydrophobicContact CD2-CB 4.07Å; L327-F353 HydrophobicContact CD2-CD2 4.33Å; L327-F353 HydrophobicContact CD2-CG 4.28Å; L348-F353 HydrophobicContact CD2-CB 4.39Å; L348-F353 HydrophobicContact CD2-CD2 3.63Å; L348-F353 HydrophobicContact CD2-CE2 4.47Å; L348-F353 HydrophobicContact CG-CB 4.39Å; L348-F353 HydrophobicContact CG-CD2 4.44Å; D349-F353 PolarHBondContact O-N 3.09Å; R350-F353 WeakPolarHBondContact O-CB 3.42Å; R350-F353 PolarHBondContact O-N 3.29Å; R350-F353 VanDerWaalsContact O-N 3.16Å; F353-R355 VanDerWaalsContact C-N 3.34Å; F353-R355 PolarHBondContact O-N 3.12Å; F353-V356 PolarHBondContact O-N 2.87Å; F353-V356 VanDerWaalsContact O-N 3.1Å; F353-L357 HydrophobicContact CD1-CB 4.49Å; F353-L357 HydrophobicContact CE1-CB 4.08Å; F353-L357 HydrophobicContact CE1-CD1 4.27Å; F353-L357 HydrophobicContact CE2-CD1 4.05Å; F353-L357 HydrophobicContact CZ-CB 4.41Å; F353-L357 HydrophobicContact CZ-CD1 3.77Å; F353-L357 PolarHBondContact O-N 2.76Å; F353-C360 HydrophobicContact CD1-CB 4Å; F353-C360 HydrophobicContact CE1-CB 3.6Å; F353-C360 HydrophobicContact CZ-CB 4.2Å; F353-I363 HydrophobicContact CE1-CD1 3.68Å; F353-I363 HydrophobicContact CZ-CD1 3.7Å
354	E	89.4	Confident	87.8	Confident	76 Å²	76	44.7 Å²	44.7	36%	0.355	22%	0.223	S	C	.	.	H	α-helix	trans	-65.6	-34.2	-176.5	-70.2	-175.9	173.5	0	0	113.3	R350 R352 V356 G358	R350-E354 HydrophobicContact CG-CG 4.13Å; R350-E354 WeakPolarHBondContact O-CG 3.13Å; R350-E354 PolarHBondContact O-N 3.19Å; R352-E354 PolarHBondContact O-N 3.21Å; E354-V356 PolarHBondContact O-N 2.77Å; E354-G358 WeakPolarHBondContact CA-O 3.43Å; E354-G358 WeakPolarHBondContact O-CA 3.33Å; E354-G358 PolarHBondContact O-N 3.16Å
355	R	90.3	Very high	87.2	Confident	185 Å²	185	45.5 Å²	45.5	70%	0.698	23%	0.226	S	C	*	.	H	α-helix	trans	-64.2	-30.7	174.7	-79.4	-175.9	-60.2	-133	-1.7	113	P351 R352 F353	P351-R355 WeakPolarHBondContact O-CB 3.32Å; P351-R355 VanDerWaalsContact O-CG 3.27Å; P351-R355 WeakPolarHBondContact O-CG 3.27Å; P351-R355 PolarHBondContact O-N 2.69Å; P351-R355 VanDerWaalsContact O-N 3.12Å; P351-R355 PolarHBondContact O-NE 3.06Å; R352-R355 PolarHBondContact O-N 3.02Å; F353-R355 VanDerWaalsContact C-N 3.34Å; F353-R355 PolarHBondContact O-N 3.12Å
356	V	89.3	Confident	86.7	Confident	56 Å²	56	51.8 Å²	51.8	34%	0.339	25%	0.25	S	C	.	.	H	α-helix	trans	-96.1	-41.2	-170.3	176.8	0	0	0	0	111.5	T264 R352 F353 E354	T264-V356 HydrophobicContact CG2-CG1 3.11Å; R352-V356 VanDerWaalsContact O-CG2 3.26Å; R352-V356 WeakPolarHBondContact O-CG2 3.31Å; R352-V356 PolarHBondContact O-N 3.46Å; F353-V356 PolarHBondContact O-N 2.87Å; F353-V356 VanDerWaalsContact O-N 3.1Å; E354-V356 PolarHBondContact O-N 2.77Å
357	L	87.4	Confident	85.9	Confident	34 Å²	34	54.6 Å²	54.6	18%	0.178	27%	0.265	C	S	.	.	H	α-helix	trans	-120.9	-3.6	-175.2	-67	-174.9	0	0	0	114.4	L257 E261 V265 F353 I363	L257-L357 HydrophobicContact CD1-CD1 3.99Å; L257-L357 HydrophobicContact CD2-CD1 3.95Å; E261-L357 HydrophobicContact CB-CD2 3.91Å; E261-L357 HydrophobicContact CG-CD2 4.04Å; V265-L357 HydrophobicContact CG2-CD1 3.24Å; V265-L357 HydrophobicContact CG2-CG 4.16Å; F353-L357 HydrophobicContact CD1-CB 4.49Å; F353-L357 HydrophobicContact CE1-CB 4.08Å; F353-L357 HydrophobicContact CE1-CD1 4.27Å; F353-L357 HydrophobicContact CE2-CD1 4.05Å; F353-L357 HydrophobicContact CZ-CB 4.41Å; F353-L357 HydrophobicContact CZ-CD1 3.77Å; F353-L357 PolarHBondContact O-N 2.76Å; L357-I363 HydrophobicContact CB-CD1 3.76Å; L357-I363 HydrophobicContact CD1-CD1 3.93Å; L357-I363 HydrophobicContact CG-CD1 4.48Å
358	G	88.6	Confident	84.7	Confident	23 Å²	23	58.2 Å²	58.2	24%	0.237	29%	0.285	C	S	.	.			trans	76.5	-172	-168.4	0	0	0	0	0	113	E354 C360	E354-G358 WeakPolarHBondContact CA-O 3.43Å; E354-G358 WeakPolarHBondContact O-CA 3.33Å; E354-G358 PolarHBondContact O-N 3.16Å; G358-C360 PolarHBondContact O-N 3.37Å
359	P	87.6	Confident	83.7	Confident	59 Å²	59	66 Å²	66	38%	0.383	32%	0.321	S	S	.	.			trans	-58.4	126.5	-176.3	-25	35.4	0	0	0	113	S361 D362	P359-S361 PolarHBondContact O-N 3.29Å; P359-S361 VanDerWaalsContact O-N 3.11Å; P359-D362 PolarHBondContact O-N 3.19Å
360	C	81	Confident	82.6	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.014	32%	0.318	C	S	.	.	H	α-helix	trans	-57.6	-29.4	178.5	-173.8	0	0	0	0	112.7	L327 L328 F353 G358 D362 I363 L364	L327-C360 HydrophobicContact CB-CB 4.11Å; L328-C360 HydrophobicContact CD2-CB 4.01Å; F353-C360 HydrophobicContact CD1-CB 4Å; F353-C360 HydrophobicContact CE1-CB 3.6Å; F353-C360 HydrophobicContact CZ-CB 4.2Å; G358-C360 PolarHBondContact O-N 3.37Å; C360-D362 VanDerWaalsContact C-N 3.25Å; C360-D362 PolarHBondContact O-N 2.73Å; C360-I363 PolarHBondContact O-N 3.41Å; C360-L364 PolarHBondContact O-N 3.05Å
361	S	80.3	Confident	81.6	Confident	39 Å²	39	64.9 Å²	64.9	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-32.5	177.4	64.1	0	0	0	0	113.1	P359 K365	P359-S361 PolarHBondContact O-N 3.29Å; P359-S361 VanDerWaalsContact O-N 3.11Å; S361-K365 WeakPolarHBondContact O-CG 3.32Å; S361-K365 PolarHBondContact O-N 2.72Å; S361-K365 VanDerWaalsContact O-N 3.12Å
362	D	85.8	Confident	80.6	Confident	82 Å²	82	66.2 Å²	66.2	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-77.3	-30.3	179.6	-65	-27.2	0	0	0	111.9	P359 C360 K365	P359-D362 PolarHBondContact O-N 3.19Å; C360-D362 VanDerWaalsContact C-N 3.25Å; C360-D362 PolarHBondContact O-N 2.73Å; D362-K365 IonicContact OD1-NZ 3.89Å; D362-K365 PolarHBondContact OD1-NZ 3.04Å
363	I	82.7	Confident	79.6	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-68.4	-45.4	173.5	-63.7	173.7	0	0	0	110.2	L257 F353 L357 C360 K365 R366	L257-I363 HydrophobicContact CD2-CB 4.46Å; L257-I363 HydrophobicContact CD2-CD1 3.75Å; L257-I363 HydrophobicContact CD2-CG1 4.26Å; L257-I363 HydrophobicContact CD2-CG2 3.44Å; L257-I363 VanDerWaalsContact CD2-CG2 3.44Å; L257-I363 HydrophobicContact CG-CG2 4.15Å; F353-I363 HydrophobicContact CE1-CD1 3.68Å; F353-I363 HydrophobicContact CZ-CD1 3.7Å; L357-I363 HydrophobicContact CB-CD1 3.76Å; L357-I363 HydrophobicContact CD1-CD1 3.93Å; L357-I363 HydrophobicContact CG-CD1 4.48Å; C360-I363 PolarHBondContact O-N 3.41Å; I363-K365 VanDerWaalsContact C-N 3.32Å; I363-K365 PolarHBondContact O-N 2.99Å; I363-R366 WeakPolarHBondContact O-CB 3.4Å; I363-R366 VanDerWaalsContact O-CG 3.27Å; I363-R366 WeakPolarHBondContact O-CG 3.44Å; I363-R366 PolarHBondContact O-N 3.11Å; I363-R366 VanDerWaalsContact O-N 3.16Å
364	L	74	Confident	78.6	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-66.8	-33.7	178	-69.8	173.8	0	0	0	113	I253 L328 C360 R366 N367 Y371 F374	I253-L364 HydrophobicContact CD1-CD1 4.19Å; I253-L364 HydrophobicContact CD1-CD2 4.27Å; I253-L364 HydrophobicContact CG1-CD1 4.25Å; I253-L364 HydrophobicContact CG1-CD2 3.45Å; I253-L364 VanDerWaalsContact CG1-CD2 3.45Å; I253-L364 HydrophobicContact CG1-CG 4.34Å; I253-L364 WeakPolarHBondContact O-CD2 3.37Å; L328-L364 HydrophobicContact CD1-CD1 3.67Å; L328-L364 HydrophobicContact CD2-CD1 3.54Å; L328-L364 HydrophobicContact CG-CD1 4.09Å; C360-L364 PolarHBondContact O-N 3.05Å; L364-R366 PolarHBondContact O-N 3.36Å; L364-R366 VanDerWaalsContact O-N 3.13Å; L364-N367 CarbonylContact O-C 3.4Å; L364-N367 PolarHBondContact O-N 2.75Å; L364-Y371 HydrophobicContact CB-CD2 3.81Å; L364-F374 HydrophobicContact CD2-CD2 4.19Å; L364-F374 HydrophobicContact CD2-CE2 4.31Å
365	K	79.7	Confident	77.4	Confident	97 Å²	97	65.4 Å²	65.4	42%	0.422	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18	174.9	-76.3	169.6	-156.4	158.2	0	113.3	S361 D362 I363 N367 I368 Y371	S361-K365 WeakPolarHBondContact O-CG 3.32Å; S361-K365 PolarHBondContact O-N 2.72Å; S361-K365 VanDerWaalsContact O-N 3.12Å; D362-K365 IonicContact OD1-NZ 3.89Å; D362-K365 PolarHBondContact OD1-NZ 3.04Å; I363-K365 VanDerWaalsContact C-N 3.32Å; I363-K365 PolarHBondContact O-N 2.99Å; K365-N367 PolarHBondContact O-N 2.98Å; K365-I368 WeakPolarHBondContact O-CG1 3.34Å; K365-Y371 HydrophobicContact CG-CD2 4.27Å; K365-Y371 HydrophobicContact CG-CE2 4.22Å
366	R	83.4	Confident	76.1	Confident	134 Å²	134	60.6 Å²	60.6	51%	0.506	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.1	173.3	-61.3	176.8	-177.8	-179.7	0.8	111.6	S256 E261 I363 L364	S256-R366 PolarHBondContact O-NH1 3.2Å; E261-R366 VanDerWaalsContact CD-NH1 3.28Å; E261-R366 IonicContact OE1-CZ 2.72Å; E261-R366 VanDerWaalsContact OE1-CZ 3.31Å; E261-R366 IonicContact OE1-NH1 2.81Å; E261-R366 PolarHBondContact OE1-NH1 3.39Å; E261-R366 IonicContact OE1-NH2 2.99Å; E261-R366 PolarHBondContact OE1-NH2 2.92Å; E261-R366 IonicContact OE2-CZ 3.95Å; E261-R366 IonicContact OE2-NH1 3.31Å; E261-R366 PolarHBondContact OE2-NH1 3.45Å; E261-R366 IonicContact OE2-NH2 2.75Å; I363-R366 WeakPolarHBondContact O-CB 3.4Å; I363-R366 VanDerWaalsContact O-CG 3.27Å; I363-R366 WeakPolarHBondContact O-CG 3.44Å; I363-R366 PolarHBondContact O-N 3.11Å; I363-R366 VanDerWaalsContact O-N 3.16Å; L364-R366 PolarHBondContact O-N 3.36Å; L364-R366 VanDerWaalsContact O-N 3.13Å
367	N	76.3	Confident	74.6	Confident	59 Å²	59	64.4 Å²	64.4	32%	0.316	34%	0.34	S	S	.	.	S	Bend	trans	-119.6	85	171.4	-169.6	-20.2	0	0	0	110.5	S256 L364 K365 Q369 Q370 Y371	S256-N367 WeakPolarHBondContact OG-CB 3.49Å; L364-N367 CarbonylContact O-C 3.4Å; L364-N367 PolarHBondContact O-N 2.75Å; K365-N367 PolarHBondContact O-N 2.98Å; N367-Q369 PolarHBondContact O-N 2.67Å; N367-Q369 VanDerWaalsContact O-N 3.16Å; N367-Q369 PolarHBondContact OD1-N 3.2Å; N367-Q370 HydrophobicContact CB-CB 3.98Å; N367-Q370 PolarHBondContact ND2-OE1 3.37Å; N367-Q370 WeakPolarHBondContact O-CB 3.39Å; N367-Q370 PolarHBondContact O-N 3.02Å; N367-Q370 PolarHBondContact OD1-N 3.13Å; N367-Y371 PolarHBondContact O-N 3.09Å
368	I	67.4	Low	73	Confident	117 Å²	117	63.6 Å²	63.6	60%	0.6	34%	0.337	S	S	*	.	H	α-helix	trans	-55.1	-36.2	-175.7	-65.9	169.5	0	0	0	112.6	K365 Y371 N372	K365-I368 WeakPolarHBondContact O-CG1 3.34Å; I368-Y371 PolarHBondContact O-N 3.46Å; I368-N372 VanDerWaalsContact O-CG 3.3Å; I368-N372 PolarHBondContact O-N 2.87Å; I368-N372 PolarHBondContact O-ND2 3.4Å
369	Q	68.9	Low	70.7	Confident	168 Å²	168	69.9 Å²	69.9	79%	0.785	37%	0.371	S	S	*	.	H	α-helix	trans	-68.8	-39.3	-179	-166.2	158.8	0.1	0	0	111.3	N367 S373	N367-Q369 PolarHBondContact O-N 2.67Å; N367-Q369 VanDerWaalsContact O-N 3.16Å; N367-Q369 PolarHBondContact OD1-N 3.2Å; Q369-S373 PolarHBondContact O-N 3.5Å
370	Q	68.2	Low	69.9	Low	26 Å²	26	70.5 Å²	70.5	12%	0.121	37%	0.37	C	S	.	.	H	α-helix	trans	-71.9	-40.5	175	-151.5	-174.6	4.8	0	0	111.9	S252 N367 N372 S373 F374	S252-Q370 VanDerWaalsContact C-NE2 3.31Å; S252-Q370 PolarHBondContact O-NE2 2.81Å; N367-Q370 HydrophobicContact CB-CB 3.98Å; N367-Q370 PolarHBondContact ND2-OE1 3.37Å; N367-Q370 WeakPolarHBondContact O-CB 3.39Å; N367-Q370 PolarHBondContact O-N 3.02Å; N367-Q370 PolarHBondContact OD1-N 3.13Å; Q370-N372 VanDerWaalsContact C-N 3.33Å; Q370-N372 PolarHBondContact O-N 3.32Å; Q370-S373 WeakPolarHBondContact O-CB 3.33Å; Q370-S373 PolarHBondContact O-N 3.36Å; Q370-S373 VanDerWaalsContact O-N 3.09Å; Q370-F374 HydrophobicContact CG-CD2 4.1Å; Q370-F374 HydrophobicContact CG-CE2 3.57Å; Q370-F374 HydrophobicContact CG-CZ 4.46Å; Q370-F374 WeakPolarHBondContact O-CD2 3.45Å; Q370-F374 PolarHBondContact O-N 2.83Å
371	Y	67.1	Low	69.3	Low	66 Å²	66	74.1 Å²	74.1	26%	0.259	39%	0.389	S	S	.	.	H	α-helix	trans	-55.3	-46.8	173.2	176.6	-97.1	0	0	0	111.9	L364 K365 N367 I368 S373 F374 V375	L364-Y371 HydrophobicContact CB-CD2 3.81Å; K365-Y371 HydrophobicContact CG-CD2 4.27Å; K365-Y371 HydrophobicContact CG-CE2 4.22Å; N367-Y371 PolarHBondContact O-N 3.09Å; I368-Y371 PolarHBondContact O-N 3.46Å; Y371-S373 VanDerWaalsContact C-N 3.28Å; Y371-S373 PolarHBondContact O-N 3.41Å; Y371-F374 PolarHBondContact O-N 3Å; Y371-V375 HydrophobicContact CD1-CG2 4.04Å; Y371-V375 HydrophobicContact CD2-CG2 4.09Å; Y371-V375 HydrophobicContact CE1-CG2 3.65Å; Y371-V375 HydrophobicContact CE2-CG2 3.72Å; Y371-V375 HydrophobicContact CG-CG2 4.25Å; Y371-V375 VanDerWaalsContact CZ-CG2 3.48Å; Y371-V375 WeakPolarHBondContact O-CB 3.41Å; Y371-V375 WeakPolarHBondContact O-CG2 3.34Å; Y371-V375 PolarHBondContact O-N 3.16Å
372	N	67.3	Low	68.7	Low	91 Å²	91	76 Å²	76	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-63.5	-34.9	177.7	-71.2	-26.2	0	0	0	112	I368 Q370 S376	I368-N372 VanDerWaalsContact O-CG 3.3Å; I368-N372 PolarHBondContact O-N 2.87Å; I368-N372 PolarHBondContact O-ND2 3.4Å; Q370-N372 VanDerWaalsContact C-N 3.33Å; Q370-N372 PolarHBondContact O-N 3.32Å; N372-S376 WeakPolarHBondContact O-CB 3.33Å; N372-S376 PolarHBondContact O-N 3.12Å; N372-S376 PolarHBondContact O-OG 3.43Å
373	S	69.6	Low	67.7	Low	61 Å²	61	75.6 Å²	75.6	43%	0.427	39%	0.393	S	S	.	.	H	α-helix	trans	-62.9	-47.2	173.8	-167.4	0	0	0	0	110.9	Q369 Q370 Y371 S376 L377	Q369-S373 PolarHBondContact O-N 3.5Å; Q370-S373 WeakPolarHBondContact O-CB 3.33Å; Q370-S373 PolarHBondContact O-N 3.36Å; Q370-S373 VanDerWaalsContact O-N 3.09Å; Y371-S373 VanDerWaalsContact C-N 3.28Å; Y371-S373 PolarHBondContact O-N 3.41Å; S373-S376 PolarHBondContact O-OG 3.05Å; S373-L377 WeakPolarHBondContact O-CB 3.48Å; S373-L377 VanDerWaalsContact O-CD1 3.31Å; S373-L377 WeakPolarHBondContact O-CD1 3.21Å; S373-L377 WeakPolarHBondContact O-CG 3.27Å; S373-L377 PolarHBondContact O-N 2.96Å; S373-L377 VanDerWaalsContact O-N 3.13Å
374	F	66.6	Low	66.8	Low	30 Å²	30	80.1 Å²	80.1	13%	0.132	42%	0.416	C	S	.	.	H	α-helix	trans	-69.4	-41.5	-179.9	-71.1	-60.6	0	0	0	113.3	I253 Y321 L364 Q370 Y371 L377 S378	I253-F374 HydrophobicContact CB-CE2 4.21Å; I253-F374 HydrophobicContact CB-CZ 3.92Å; I253-F374 HydrophobicContact CG1-CE2 4.09Å; I253-F374 HydrophobicContact CG1-CZ 4.19Å; Y321-F374 VanDerWaalsContact OH-CE1 3.27Å; Y321-F374 WeakPolarHBondContact OH-CE1 3.24Å; Y321-F374 VanDerWaalsContact OH-CZ 3.32Å; Y321-F374 WeakPolarHBondContact OH-CZ 3.39Å; L364-F374 HydrophobicContact CD2-CD2 4.19Å; L364-F374 HydrophobicContact CD2-CE2 4.31Å; Q370-F374 HydrophobicContact CG-CD2 4.1Å; Q370-F374 HydrophobicContact CG-CE2 3.57Å; Q370-F374 HydrophobicContact CG-CZ 4.46Å; Q370-F374 WeakPolarHBondContact O-CD2 3.45Å; Q370-F374 PolarHBondContact O-N 2.83Å; Y371-F374 PolarHBondContact O-N 3Å; F374-L377 PolarHBondContact O-N 3.13Å; F374-S378 WeakPolarHBondContact O-CB 3.18Å; F374-S378 PolarHBondContact O-N 3.33Å; F374-S378 VanDerWaalsContact O-N 3.12Å; F374-S378 PolarHBondContact O-OG 3.16Å
375	V	64.9	Low	66.3	Low	40 Å²	40	85.4 Å²	85.4	24%	0.242	44%	0.444	C	S	.	.	H	α-helix	trans	-66.5	-42.7	178	175.2	0	0	0	0	110.7	Y371 L377 S378 V379	Y371-V375 HydrophobicContact CD1-CG2 4.04Å; Y371-V375 HydrophobicContact CD2-CG2 4.09Å; Y371-V375 HydrophobicContact CE1-CG2 3.65Å; Y371-V375 HydrophobicContact CE2-CG2 3.72Å; Y371-V375 HydrophobicContact CG-CG2 4.25Å; Y371-V375 VanDerWaalsContact CZ-CG2 3.48Å; Y371-V375 WeakPolarHBondContact O-CB 3.41Å; Y371-V375 WeakPolarHBondContact O-CG2 3.34Å; Y371-V375 PolarHBondContact O-N 3.16Å; V375-L377 VanDerWaalsContact C-N 3.32Å; V375-L377 PolarHBondContact O-N 2.81Å; V375-S378 WeakPolarHBondContact CA-OG 3.41Å; V375-S378 PolarHBondContact O-N 3.06Å; V375-S378 PolarHBondContact O-OG 3.28Å; V375-V379 HydrophobicContact CG1-CG2 4.17Å; V375-V379 WeakPolarHBondContact O-CG2 3.21Å; V375-V379 PolarHBondContact O-N 3.29Å; V375-V379 VanDerWaalsContact O-N 3.16Å
376	S	61.4	Low	65.3	Low	83 Å²	83	84.6 Å²	84.6	58%	0.58	45%	0.445	S	S	*	.	H	α-helix	trans	-66.8	-29.7	177.9	57.6	0	0	0	0	113.8	N372 S373 S378	N372-S376 WeakPolarHBondContact O-CB 3.33Å; N372-S376 PolarHBondContact O-N 3.12Å; N372-S376 PolarHBondContact O-OG 3.43Å; S373-S376 PolarHBondContact O-OG 3.05Å; S376-S378 VanDerWaalsContact C-N 3.3Å
377	L	57.5	Low	63.9	Low	136 Å²	136	80.8 Å²	80.8	71%	0.712	44%	0.44	S	S	*	.	H	α-helix	trans	-73.4	-20.7	170.2	-78.1	158.5	0	0	0	113.2	S373 F374 V375	S373-L377 WeakPolarHBondContact O-CB 3.48Å; S373-L377 VanDerWaalsContact O-CD1 3.31Å; S373-L377 WeakPolarHBondContact O-CD1 3.21Å; S373-L377 WeakPolarHBondContact O-CG 3.27Å; S373-L377 PolarHBondContact O-N 2.96Å; S373-L377 VanDerWaalsContact O-N 3.13Å; F374-L377 PolarHBondContact O-N 3.13Å; V375-L377 VanDerWaalsContact C-N 3.32Å; V375-L377 PolarHBondContact O-N 2.81Å
378	S	53.9	Low	62.9	Low	18 Å²	18	82.6 Å²	82.6	13%	0.126	45%	0.451	C	S	.	.	H	α-helix	trans	-96.2	-12.3	-176.5	73.3	0	0	0	0	114.7	R331 F374 V375 S376	R331-S378 PolarHBondContact NH1-O 3.49Å; F374-S378 WeakPolarHBondContact O-CB 3.18Å; F374-S378 PolarHBondContact O-N 3.33Å; F374-S378 VanDerWaalsContact O-N 3.12Å; F374-S378 PolarHBondContact O-OG 3.16Å; V375-S378 WeakPolarHBondContact CA-OG 3.41Å; V375-S378 PolarHBondContact O-N 3.06Å; V375-S378 PolarHBondContact O-OG 3.28Å; S376-S378 VanDerWaalsContact C-N 3.3Å
379	V	42	Very low	62.5	Low	155 Å²	155	79.5 Å²	79.5	94%	0.939	44%	0.437	S	S	*	.			trans	-93.2	0	-177.2	173.8	0	0	0	0	111.7	V375	V375-V379 HydrophobicContact CG1-CG2 4.17Å; V375-V379 WeakPolarHBondContact O-CG2 3.21Å; V375-V379 PolarHBondContact O-N 3.29Å; V375-V379 VanDerWaalsContact O-N 3.16Å

Retrieved 379 of 379 residues in 1260.3 ms (Link to these results)

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