A0A3B3VU25_9TELE Loading...

Leucine rich repeat containing 3B

AlphaFold DB , UniProt , Accession A0A3B3VU25, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 260 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	54.6	Low	57.7	Low	220 Å²	220	124.7 Å²	124.7	100%	1.084	62%	0.622	S	S	*	*				0	116.2	0	-68.4	162.5	81.5	0	0	106.5
2	T	63.2	Low	59.1	Low	84 Å²	84	121.7 Å²	121.7	52%	0.515	61%	0.608	S	S	.	*			trans	-79.5	154	-168.9	65.7	0	0	0	0	110.5	L4 D5 L6	T2-L4 PolarHBondContact O-N 3.28Å; T2-L4 VanDerWaalsContact O-N 3.09Å; T2-D5 PolarHBondContact N-OD2 3.43Å; T2-D5 PolarHBondContact O-N 3.31Å; T2-D5 VanDerWaalsContact OG1-CG 3.29Å; T2-D5 PolarHBondContact OG1-OD2 3.44Å; T2-L6 PolarHBondContact O-N 3.33Å
3	L	58.2	Low	60.5	Low	159 Å²	159	116.9 Å²	116.9	83%	0.832	59%	0.591	S	S	*	*	H	α-helix	trans	-54.8	-26.3	175	-85.2	157.3	0	0	0	112.4	W7	L3-W7 WeakPolarHBondContact O-CB 3.26Å; L3-W7 PolarHBondContact O-N 3.05Å; L3-W7 VanDerWaalsContact O-N 3.15Å
4	L	57	Low	61.6	Low	122 Å²	122	118 Å²	118	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-66.1	-42.4	175.5	-151.4	83.9	0	0	0	112	T2 L6 W7 L8	T2-L4 PolarHBondContact O-N 3.28Å; T2-L4 VanDerWaalsContact O-N 3.09Å; L4-L6 PolarHBondContact O-N 2.99Å; L4-W7 PolarHBondContact O-N 3.3Å; L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 HydrophobicContact CG-CD1 3.93Å; L4-L8 WeakPolarHBondContact O-CD1 3.44Å; L4-L8 PolarHBondContact O-N 3.16Å
5	D	55.5	Low	62.6	Low	89 Å²	89	114.8 Å²	114.8	48%	0.476	59%	0.587	S	S	.	*	H	α-helix	trans	-67.5	-37.3	-179.7	-58	-47.9	0	0	0	111.6	T2 S9	T2-D5 PolarHBondContact N-OD2 3.43Å; T2-D5 PolarHBondContact O-N 3.31Å; T2-D5 VanDerWaalsContact OG1-CG 3.29Å; T2-D5 PolarHBondContact OG1-OD2 3.44Å; D5-S9 VanDerWaalsContact O-CB 3.29Å; D5-S9 WeakPolarHBondContact O-CB 3.3Å; D5-S9 PolarHBondContact O-N 2.99Å; D5-S9 PolarHBondContact O-OG 2.9Å
6	L	57	Low	63.6	Low	101 Å²	101	114.1 Å²	114.1	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-69.3	-37.2	176.8	-138.7	81.8	0	0	0	111.3	T2 L4 S9 R10	T2-L6 PolarHBondContact O-N 3.33Å; L4-L6 PolarHBondContact O-N 2.99Å; L6-S9 PolarHBondContact O-OG 3.29Å; L6-R10 PolarHBondContact O-N 3.48Å
7	W	53.1	Low	64.6	Low	194 Å²	194	113.7 Å²	113.7	74%	0.735	58%	0.583	S	S	*	*	H	α-helix	trans	-72.9	-39.1	177.8	-147.5	84.6	0	0	0	112.2	L3 L4 S11	L3-W7 WeakPolarHBondContact O-CB 3.26Å; L3-W7 PolarHBondContact O-N 3.05Å; L3-W7 VanDerWaalsContact O-N 3.15Å; L4-W7 PolarHBondContact O-N 3.3Å; W7-S11 WeakPolarHBondContact O-CB 3.48Å; W7-S11 PolarHBondContact O-N 3.24Å; W7-S11 VanDerWaalsContact O-N 3.14Å; W7-S11 PolarHBondContact O-OG 3.19Å
8	L	53.4	Low	65.3	Low	87 Å²	87	113.2 Å²	113.2	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-64.8	-45.7	171.1	-94.2	89.5	0	0	0	111.3	L4 R10 S11 I12	L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 HydrophobicContact CG-CD1 3.93Å; L4-L8 WeakPolarHBondContact O-CD1 3.44Å; L4-L8 PolarHBondContact O-N 3.16Å; L8-R10 PolarHBondContact O-N 3.47Å; L8-S11 PolarHBondContact O-N 3.14Å; L8-I12 HydrophobicContact CB-CD1 4.09Å; L8-I12 HydrophobicContact CD2-CD1 4.32Å; L8-I12 WeakPolarHBondContact O-CB 3.48Å; L8-I12 VanDerWaalsContact O-CD1 3.3Å; L8-I12 WeakPolarHBondContact O-CD1 3.14Å; L8-I12 WeakPolarHBondContact O-CG1 3.28Å; L8-I12 PolarHBondContact O-N 2.89Å
9	S	58	Low	66	Low	71 Å²	71	112.9 Å²	112.9	50%	0.497	58%	0.577	S	S	.	*	H	α-helix	trans	-63.1	-25.3	-178	77.8	0	0	0	0	114.1	D5 L6 P13	D5-S9 VanDerWaalsContact O-CB 3.29Å; D5-S9 WeakPolarHBondContact O-CB 3.3Å; D5-S9 PolarHBondContact O-N 2.99Å; D5-S9 PolarHBondContact O-OG 2.9Å; L6-S9 PolarHBondContact O-OG 3.29Å; S9-P13 WeakPolarHBondContact O-CD 3.29Å; S9-P13 WeakPolarHBondContact O-CG 3.06Å
10	R	59.6	Low	66.7	Low	197 Å²	197	110 Å²	110	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-89.3	-33.4	176.9	-80.9	-175.9	159.5	-165.9	-4.7	113.2	L6 L8 P13	L6-R10 PolarHBondContact O-N 3.48Å; L8-R10 PolarHBondContact O-N 3.47Å; R10-P13 WeakPolarHBondContact O-CD 3.24Å; R10-P13 WeakPolarHBondContact O-CG 3.29Å
11	S	65.6	Low	67.1	Low	48 Å²	48	110.3 Å²	110.3	34%	0.336	57%	0.569	S	S	.	*	H	α-helix	trans	-81.5	-34.3	-176.9	-58.3	0	0	0	0	113.1	W7 L8 M14 C15	W7-S11 WeakPolarHBondContact O-CB 3.48Å; W7-S11 PolarHBondContact O-N 3.24Å; W7-S11 VanDerWaalsContact O-N 3.14Å; W7-S11 PolarHBondContact O-OG 3.19Å; L8-S11 PolarHBondContact O-N 3.14Å; S11-M14 PolarHBondContact O-N 2.94Å; S11-C15 WeakPolarHBondContact O-CB 3.26Å; S11-C15 PolarHBondContact O-N 3.46Å
12	I	73.8	Confident	68.1	Low	88 Å²	88	103.5 Å²	103.5	45%	0.451	54%	0.54	S	S	.	.	H	α-helix	trans	-62.4	-49.8	177.9	-64.1	162.9	0	0	0	113.1	L8 M14 C15 L16	L8-I12 HydrophobicContact CB-CD1 4.09Å; L8-I12 HydrophobicContact CD2-CD1 4.32Å; L8-I12 WeakPolarHBondContact O-CB 3.48Å; L8-I12 VanDerWaalsContact O-CD1 3.3Å; L8-I12 WeakPolarHBondContact O-CD1 3.14Å; L8-I12 WeakPolarHBondContact O-CG1 3.28Å; L8-I12 PolarHBondContact O-N 2.89Å; I12-M14 VanDerWaalsContact C-N 3.3Å; I12-M14 PolarHBondContact O-N 3.44Å; I12-C15 PolarHBondContact O-N 2.69Å; I12-L16 HydrophobicContact CG2-CD1 3.85Å; I12-L16 HydrophobicContact CG2-CG 4.34Å; I12-L16 WeakPolarHBondContact O-CG 3.28Å; I12-L16 PolarHBondContact O-N 3.44Å
13	P	77.6	Confident	68.4	Low	60 Å²	60	105.2 Å²	105.2	39%	0.39	55%	0.545	S	S	.	.	H	α-helix	trans	-66.8	-32.9	180	26.2	-34.6	0	0	0	112	S9 R10 L17	S9-P13 WeakPolarHBondContact O-CD 3.29Å; S9-P13 WeakPolarHBondContact O-CG 3.06Å; R10-P13 WeakPolarHBondContact O-CD 3.24Å; R10-P13 WeakPolarHBondContact O-CG 3.29Å; P13-L17 WeakPolarHBondContact O-CB 3.45Å; P13-L17 WeakPolarHBondContact O-CD1 3.43Å; P13-L17 VanDerWaalsContact O-CG 3.31Å; P13-L17 WeakPolarHBondContact O-CG 3.17Å; P13-L17 PolarHBondContact O-N 3.33Å
14	M	75.3	Confident	68.8	Low	132 Å²	132	102.6 Å²	102.6	65%	0.65	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-41.5	174.3	-163.8	-167.8	-133.7	0	0	111.3	S11 I12 L17 L18	S11-M14 PolarHBondContact O-N 2.94Å; I12-M14 VanDerWaalsContact C-N 3.3Å; I12-M14 PolarHBondContact O-N 3.44Å; M14-L17 PolarHBondContact O-N 3.45Å; M14-L18 WeakPolarHBondContact O-CB 3.37Å; M14-L18 PolarHBondContact O-N 2.89Å
15	C	76.6	Confident	69.2	Low	70 Å²	70	100.1 Å²	100.1	47%	0.473	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-41.9	176.7	-161.3	0	0	0	0	111.9	S11 I12 L18 Q19	S11-C15 WeakPolarHBondContact O-CB 3.26Å; S11-C15 PolarHBondContact O-N 3.46Å; I12-C15 PolarHBondContact O-N 2.69Å; C15-L18 PolarHBondContact O-N 2.91Å; C15-Q19 WeakPolarHBondContact O-CB 3.43Å; C15-Q19 WeakPolarHBondContact O-CG 3.38Å; C15-Q19 PolarHBondContact O-N 3.41Å
16	L	78.9	Confident	69.6	Low	103 Å²	103	102.3 Å²	102.3	54%	0.539	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-38.6	175	-70.4	171	0	0	0	112.2	I12 Q19 S20	I12-L16 HydrophobicContact CG2-CD1 3.85Å; I12-L16 HydrophobicContact CG2-CG 4.34Å; I12-L16 WeakPolarHBondContact O-CG 3.28Å; I12-L16 PolarHBondContact O-N 3.44Å; L16-Q19 PolarHBondContact O-N 3.31Å; L16-S20 WeakPolarHBondContact O-CB 3.22Å; L16-S20 PolarHBondContact O-N 3.48Å; L16-S20 PolarHBondContact O-OG 3.49Å
17	L	80.1	Confident	69.6	Low	108 Å²	108	102.2 Å²	102.2	57%	0.565	55%	0.545	S	S	*	.	H	α-helix	trans	-63.3	-45.1	172.9	-82.1	163.2	0	0	0	111.3	P13 M14 S20 L21	P13-L17 WeakPolarHBondContact O-CB 3.45Å; P13-L17 WeakPolarHBondContact O-CD1 3.43Å; P13-L17 VanDerWaalsContact O-CG 3.31Å; P13-L17 WeakPolarHBondContact O-CG 3.17Å; P13-L17 PolarHBondContact O-N 3.33Å; M14-L17 PolarHBondContact O-N 3.45Å; L17-S20 WeakPolarHBondContact CA-OG 3.41Å; L17-S20 PolarHBondContact O-N 3.43Å; L17-S20 PolarHBondContact O-OG 3.48Å; L17-L21 WeakPolarHBondContact O-CB 3.33Å; L17-L21 WeakPolarHBondContact O-CG 3.48Å; L17-L21 PolarHBondContact O-N 3.25Å
18	L	77.9	Confident	69.5	Low	105 Å²	105	99.7 Å²	99.7	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.9	-111.6	125.2	0	0	0	112.1	M14 C15 S20 L21 V22	M14-L18 WeakPolarHBondContact O-CB 3.37Å; M14-L18 PolarHBondContact O-N 2.89Å; C15-L18 PolarHBondContact O-N 2.91Å; L18-S20 VanDerWaalsContact C-N 3.34Å; L18-S20 PolarHBondContact O-N 2.94Å; L18-L21 PolarHBondContact O-N 2.99Å; L18-V22 WeakPolarHBondContact O-CB 3.5Å; L18-V22 VanDerWaalsContact O-CG2 3.23Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.29Å
19	Q	79.3	Confident	69.6	Low	107 Å²	107	100.7 Å²	100.7	50%	0.5	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-41.6	174.8	-76	178.9	-19.9	0	0	111.4	C15 L16 V22 L23	C15-Q19 WeakPolarHBondContact O-CB 3.43Å; C15-Q19 WeakPolarHBondContact O-CG 3.38Å; C15-Q19 PolarHBondContact O-N 3.41Å; L16-Q19 PolarHBondContact O-N 3.31Å; Q19-V22 PolarHBondContact O-N 3.19Å; Q19-L23 WeakPolarHBondContact O-CB 2.96Å; Q19-L23 WeakPolarHBondContact O-CD1 3.4Å; Q19-L23 PolarHBondContact O-N 3.01Å
20	S	78.8	Confident	69.1	Low	54 Å²	54	102.9 Å²	102.9	38%	0.378	57%	0.566	S	S	.	*	H	α-helix	trans	-65.9	-38.1	176.1	75	0	0	0	0	112.6	L16 L17 L18 L23 M24	L16-S20 WeakPolarHBondContact O-CB 3.22Å; L16-S20 PolarHBondContact O-N 3.48Å; L16-S20 PolarHBondContact O-OG 3.49Å; L17-S20 WeakPolarHBondContact CA-OG 3.41Å; L17-S20 PolarHBondContact O-N 3.43Å; L17-S20 PolarHBondContact O-OG 3.48Å; L18-S20 VanDerWaalsContact C-N 3.34Å; L18-S20 PolarHBondContact O-N 2.94Å; S20-L23 PolarHBondContact O-N 2.88Å; S20-M24 WeakPolarHBondContact O-CB 3.48Å; S20-M24 WeakPolarHBondContact O-CG 2.94Å; S20-M24 PolarHBondContact O-N 3.18Å
21	L	75.4	Confident	68.7	Low	117 Å²	117	97.7 Å²	97.7	61%	0.613	57%	0.565	S	S	*	*	H	α-helix	trans	-68.1	-39.6	175.2	-80	161.3	0	0	0	111.8	L17 L18 M24 A25	L17-L21 WeakPolarHBondContact O-CB 3.33Å; L17-L21 WeakPolarHBondContact O-CG 3.48Å; L17-L21 PolarHBondContact O-N 3.25Å; L18-L21 PolarHBondContact O-N 2.99Å; L21-M24 PolarHBondContact O-N 3.46Å; L21-A25 WeakPolarHBondContact O-CB 3.01Å; L21-A25 PolarHBondContact O-N 3.06Å
22	V	75.5	Confident	68.5	Low	78 Å²	78	99.7 Å²	99.7	47%	0.473	58%	0.579	S	S	.	*	H	α-helix	trans	-68	-42.6	174.8	171.3	0	0	0	0	110.7	L18 Q19 A25 L26	L18-V22 WeakPolarHBondContact O-CB 3.5Å; L18-V22 VanDerWaalsContact O-CG2 3.23Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.29Å; Q19-V22 PolarHBondContact O-N 3.19Å; V22-A25 PolarHBondContact O-N 3.44Å; V22-L26 HydrophobicContact CG1-CD1 3.79Å; V22-L26 HydrophobicContact CG1-CG 4.45Å; V22-L26 WeakPolarHBondContact O-CB 3.35Å; V22-L26 WeakPolarHBondContact O-CD1 3.37Å; V22-L26 VanDerWaalsContact O-CG 3.24Å; V22-L26 WeakPolarHBondContact O-CG 3.36Å; V22-L26 PolarHBondContact O-N 3.33Å
23	L	70.3	Confident	68.4	Low	119 Å²	119	102.3 Å²	102.3	62%	0.623	59%	0.591	S	S	*	*	H	α-helix	trans	-60.9	-43	172.5	-96.9	139.9	0	0	0	111.6	Q19 S20 L26 C27	Q19-L23 WeakPolarHBondContact O-CB 2.96Å; Q19-L23 WeakPolarHBondContact O-CD1 3.4Å; Q19-L23 PolarHBondContact O-N 3.01Å; S20-L23 PolarHBondContact O-N 2.88Å; L23-L26 PolarHBondContact O-N 3.06Å; L23-C27 VanDerWaalsContact O-CB 3.23Å; L23-C27 WeakPolarHBondContact O-CB 3.48Å; L23-C27 PolarHBondContact O-N 3Å
24	M	66.3	Low	68.9	Low	105 Å²	105	101.3 Å²	101.3	52%	0.517	59%	0.585	S	S	.	*	H	α-helix	trans	-64	-42.7	174.4	-73.7	-66.1	-70.3	0	0	111.7	S20 L21 L26 C27 F28	S20-M24 WeakPolarHBondContact O-CB 3.48Å; S20-M24 WeakPolarHBondContact O-CG 2.94Å; S20-M24 PolarHBondContact O-N 3.18Å; L21-M24 PolarHBondContact O-N 3.46Å; M24-L26 VanDerWaalsContact C-N 3.32Å; M24-L26 PolarHBondContact O-N 3.23Å; M24-C27 CarbonylContact O-C 3.52Å; M24-C27 PolarHBondContact O-N 3.4Å; M24-C27 VanDerWaalsContact O-N 3.09Å; M24-F28 HydrophobicContact CB-CE2 4.38Å; M24-F28 HydrophobicContact CE-CE2 3.88Å; M24-F28 HydrophobicContact CE-CZ 3.98Å; M24-F28 WeakPolarHBondContact O-CD2 3.47Å; M24-F28 PolarHBondContact O-N 3.38Å
25	A	65.1	Low	69.5	Low	69 Å²	69	95.8 Å²	95.8	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-65.1	-33	176.3	0	0	0	0	0	113.1	L21 V22 C27	L21-A25 WeakPolarHBondContact O-CB 3.01Å; L21-A25 PolarHBondContact O-N 3.06Å; V22-A25 PolarHBondContact O-N 3.44Å; A25-C27 VanDerWaalsContact C-N 3.34Å
26	L	63.6	Low	70.1	Confident	136 Å²	136	102 Å²	102	71%	0.712	58%	0.579	S	S	*	*	H	α-helix	trans	-75.5	-23.6	172.2	-71.2	162.7	0	0	0	112.5	V22 L23 M24	V22-L26 HydrophobicContact CG1-CD1 3.79Å; V22-L26 HydrophobicContact CG1-CG 4.45Å; V22-L26 WeakPolarHBondContact O-CB 3.35Å; V22-L26 WeakPolarHBondContact O-CD1 3.37Å; V22-L26 VanDerWaalsContact O-CG 3.24Å; V22-L26 WeakPolarHBondContact O-CG 3.36Å; V22-L26 PolarHBondContact O-N 3.33Å; L23-L26 PolarHBondContact O-N 3.06Å; M24-L26 VanDerWaalsContact C-N 3.32Å; M24-L26 PolarHBondContact O-N 3.23Å
27	C	58	Low	70.4	Confident	99 Å²	99	99.5 Å²	99.5	67%	0.669	58%	0.577	S	S	*	*	H	α-helix	trans	-91.5	-8	179.4	-142.7	0	0	0	0	113.4	L23 M24 A25 P29	L23-C27 VanDerWaalsContact O-CB 3.23Å; L23-C27 WeakPolarHBondContact O-CB 3.48Å; L23-C27 PolarHBondContact O-N 3Å; M24-C27 CarbonylContact O-C 3.52Å; M24-C27 PolarHBondContact O-N 3.4Å; M24-C27 VanDerWaalsContact O-N 3.09Å; A25-C27 VanDerWaalsContact C-N 3.34Å; C27-P29 VanDerWaalsContact C-CD 3.4Å; C27-P29 WeakPolarHBondContact O-CD 3.23Å
28	F	51	Low	71	Confident	140 Å²	140	95.2 Å²	95.2	61%	0.614	56%	0.556	S	S	*	*	S	Bend	trans	-90.7	89.2	161.8	-69.6	-70.2	0	0	0	108	M24 S30	M24-F28 HydrophobicContact CB-CE2 4.38Å; M24-F28 HydrophobicContact CE-CE2 3.88Å; M24-F28 HydrophobicContact CE-CZ 3.98Å; M24-F28 WeakPolarHBondContact O-CD2 3.47Å; M24-F28 PolarHBondContact O-N 3.38Å; F28-S30 PolarHBondContact O-N 3.43Å; F28-S30 VanDerWaalsContact O-N 3.12Å
29	P	54.1	Low	71.7	Confident	108 Å²	108	93.7 Å²	93.7	70%	0.701	55%	0.554	S	S	*	*			trans	-52.9	128.6	158	25.7	-30.7	0	0	0	105.5	C27 A31	C27-P29 VanDerWaalsContact C-CD 3.4Å; C27-P29 WeakPolarHBondContact O-CD 3.23Å; P29-A31 PolarHBondContact O-N 2.67Å
30	S	48.8	Very low	72.4	Confident	117 Å²	117	89.9 Å²	89.9	82%	0.818	54%	0.539	S	S	*	.			trans	-39.8	113.8	173.8	-43.2	0	0	0	0	106.4	F28 S32	F28-S30 PolarHBondContact O-N 3.43Å; F28-S30 VanDerWaalsContact O-N 3.12Å; S30-S32 VanDerWaalsContact C-N 3.31Å; S30-S32 PolarHBondContact O-N 3.08Å
31	A	51.1	Low	72.9	Confident	88 Å²	88	92.5 Å²	92.5	73%	0.727	55%	0.548	S	S	*	.			trans	-50.9	104.6	-173.3	0	0	0	0	0	106.6	P29 M33	P29-A31 PolarHBondContact O-N 2.67Å; A31-M33 VanDerWaalsContact C-N 3.32Å; A31-M33 PolarHBondContact O-N 3.14Å
32	S	60.4	Low	73.6	Confident	90 Å²	90	96 Å²	96	63%	0.629	55%	0.553	S	S	*	*			trans	-61.2	107.5	176.5	47.1	0	0	0	0	103.1	S30 C34	S30-S32 VanDerWaalsContact C-N 3.31Å; S30-S32 PolarHBondContact O-N 3.08Å; S32-C34 PolarHBondContact O-N 3.33Å
33	M	71.6	Confident	73.8	Confident	144 Å²	144	94.9 Å²	94.9	71%	0.709	55%	0.545	S	S	*	.			trans	-66.5	74.9	-179	-88	150.3	55.3	0	0	107.5	A31	A31-M33 VanDerWaalsContact C-N 3.32Å; A31-M33 PolarHBondContact O-N 3.14Å
34	C	88	Confident	74.3	Confident	39 Å²	39	94.9 Å²	94.9	26%	0.264	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-83.7	131.2	173.7	-162.2	0	0	0	0	106.8	S32 C38 C40	S32-C34 PolarHBondContact O-N 3.33Å; C34-C38 PolarHBondContact SG-O 3.42Å; C34-C40 VanDerWaalsContact CA-SG 3.51Å; C34-C40 HydrophobicContact CB-CB 3.75Å; C34-C40 WeakPolarHBondContact CB-SG 3.43Å; C34-C40 WeakPolarHBondContact SG-CB 3.45Å; C34-C40 PolarHBondContact SG-N 3.1Å; C34-C40 CovalentContact SG-SG 2.03Å; C34-C40 PolarHBondContact SG-SG 3.08Å
35	P	89.8	Confident	75	Confident	16 Å²	16	98.1 Å²	98.1	10%	0.104	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-58.3	151.5	177.7	-18.7	26.9	0	0	0	111.9	G37 C38 P62 L65	P35-G37 PolarHBondContact O-N 3.3Å; P35-C38 HydrophobicContact CB-CB 4.24Å; P35-C38 HydrophobicContact CG-CB 4.4Å; P35-C38 WeakPolarHBondContact O-CB 3.28Å; P35-C38 PolarHBondContact O-N 3.49Å; P35-P62 HydrophobicContact CB-CB 3.64Å; P35-P62 HydrophobicContact CB-CG 4.09Å; P35-P62 HydrophobicContact CG-CB 3.81Å; P35-P62 HydrophobicContact CG-CG 4.39Å; P35-L65 HydrophobicContact CG-CD2 4.02Å
36	K	87.9	Confident	75.4	Confident	201 Å²	201	96.6 Å²	96.6	87%	0.874	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	131.4	174.9	-67.5	-176.4	179	178.8	0	109.5	C38	K36-C38 VanDerWaalsContact C-N 3.31Å
37	G	85.5	Confident	76.4	Confident	50 Å²	50	98.5 Å²	98.5	52%	0.515	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	81	8.6	-175.8	0	0	0	0	0	113.9	P35 S56	P35-G37 PolarHBondContact O-N 3.3Å; G37-S56 WeakPolarHBondContact O-CB 3.31Å; G37-S56 PolarHBondContact O-OG 3.45Å
38	C	93	Very high	77.9	Confident	17 Å²	17	94.3 Å²	94.3	12%	0.115	53%	0.526	C	S	.	.			trans	-114.2	150.2	173	-59.3	0	0	0	0	111	C34 P35 K36 V51 T52 C53	C34-C38 PolarHBondContact SG-O 3.42Å; P35-C38 HydrophobicContact CB-CB 4.24Å; P35-C38 HydrophobicContact CG-CB 4.4Å; P35-C38 WeakPolarHBondContact O-CB 3.28Å; P35-C38 PolarHBondContact O-N 3.49Å; K36-C38 VanDerWaalsContact C-N 3.31Å; C38-V51 HydrophobicContact CB-CG1 4.33Å; C38-T52 CarbonylContact C-O 3.55Å; C38-T52 WeakPolarHBondContact CA-O 3.31Å; C38-C53 HydrophobicContact CB-CB 4.09Å; C38-C53 WeakPolarHBondContact CB-SG 3.18Å; C38-C53 WeakPolarHBondContact SG-CB 3.46Å; C38-C53 CovalentContact SG-SG 2.03Å; C38-C53 PolarHBondContact SG-SG 2.94Å
39	S	93.2	Very high	79.8	Confident	74 Å²	74	88.1 Å²	88.1	52%	0.517	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.8	169.7	-63	0	0	0	0	108.6	T52	S39-T52 PolarHBondContact N-O 2.85Å; S39-T52 PolarHBondContact O-N 3.29Å
40	C	92.4	Very high	81.7	Confident	26 Å²	26	84.5 Å²	84.5	18%	0.176	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.4	-179.7	-64.8	0	0	0	0	108.8	C34 L49	C34-C40 VanDerWaalsContact CA-SG 3.51Å; C34-C40 HydrophobicContact CB-CB 3.75Å; C34-C40 WeakPolarHBondContact CB-SG 3.43Å; C34-C40 WeakPolarHBondContact SG-CB 3.45Å; C34-C40 PolarHBondContact SG-N 3.1Å; C34-C40 CovalentContact SG-SG 2.03Å; C34-C40 PolarHBondContact SG-SG 3.08Å; C40-L49 HydrophobicContact CB-CD1 4.24Å; C40-L49 HydrophobicContact CB-CD2 3.97Å; C40-L49 HydrophobicContact CB-CG 4.3Å
41	L	91	Very high	83.9	Confident	110 Å²	110	79 Å²	79	58%	0.576	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.1	-177.5	-67.2	168.9	0	0	0	109.4	L49 N50	L41-L49 WeakPolarHBondContact O-CD1 3.46Å; L41-N50 PolarHBondContact N-O 3.41Å; L41-N50 PolarHBondContact O-N 3.25Å
42	R	89.3	Confident	86	Confident	190 Å²	190	76.9 Å²	76.9	72%	0.717	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.3	171.2	-177.2	167.8	-78.8	160.7	-3.5	108.2	L49 D68	R42-L49 HydrophobicContact CB-CD1 4.26Å; R42-D68 IonicContact NH2-OD2 3.29Å; R42-D68 PolarHBondContact NH2-OD2 3.09Å
43	D	80.4	Confident	87.7	Confident	55 Å²	55	72.6 Å²	72.6	29%	0.294	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.6	178.8	-176.5	-26.8	0	0	0	108.7	H45 L46	D43-H45 VanDerWaalsContact C-N 3.27Å; D43-H45 PolarHBondContact O-N 3.34Å; D43-H45 WeakPolarHBondContact OD1-CB 3.16Å; D43-H45 IonicContact OD1-CD2 3.28Å; D43-H45 PolarHBondContact OD1-N 2.79Å; D43-L46 HydrophobicContact CB-CB 3.63Å; D43-L46 PolarHBondContact O-N 3.41Å; D43-L46 PolarHBondContact OD1-N 3.22Å
44	P	79.6	Confident	88.9	Confident	119 Å²	119	67.4 Å²	67.4	77%	0.773	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.5	177.8	-19.8	31.8	0	0	0	114.4
45	H	81.5	Confident	89.2	Confident	172 Å²	172	72.5 Å²	72.5	80%	0.796	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-22.9	-178.7	-63.2	-70	0	0	0	112.3	D43	D43-H45 VanDerWaalsContact C-N 3.27Å; D43-H45 PolarHBondContact O-N 3.34Å; D43-H45 WeakPolarHBondContact OD1-CB 3.16Å; D43-H45 IonicContact OD1-CD2 3.28Å; D43-H45 PolarHBondContact OD1-N 2.79Å
46	L	74.1	Confident	89.5	Confident	37 Å²	37	73.7 Å²	73.7	19%	0.194	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	123.7	174.1	-142.9	78.6	0	0	0	108.3	D43 G48 V70 L71	D43-L46 HydrophobicContact CB-CB 3.63Å; D43-L46 PolarHBondContact O-N 3.41Å; D43-L46 PolarHBondContact OD1-N 3.22Å; L46-G48 PolarHBondContact O-N 3.08Å; L46-V70 HydrophobicContact CD1-CG1 4.38Å; L46-V70 HydrophobicContact CD2-CB 3.61Å; L46-V70 HydrophobicContact CD2-CG1 3.57Å; L46-V70 HydrophobicContact CD2-CG2 4.38Å; L46-V70 HydrophobicContact CG-CB 4.26Å; L46-V70 HydrophobicContact CG-CG1 3.91Å; L46-L71 HydrophobicContact CD2-CD1 3.72Å; L46-L71 HydrophobicContact CD2-CD2 4.44Å; L46-L71 HydrophobicContact CD2-CG 3.68Å
47	H	84.4	Confident	89.8	Confident	177 Å²	177	73.7 Å²	73.7	82%	0.819	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	59.4	173.9	-66.8	-72.4	0	0	0	111.8
48	G	87.9	Confident	90.2	Very high	10 Å²	10	72.7 Å²	72.7	10%	0.103	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-157.5	-179.7	0	0	0	0	0	113.8	L46 D68	L46-G48 PolarHBondContact O-N 3.08Å; G48-D68 CarbonylContact C-O 3.58Å; G48-D68 WeakPolarHBondContact CA-O 3.31Å
49	L	91.8	Very high	90.4	Very high	10 Å²	10	79 Å²	79	5%	0.052	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.6	-170.2	-165.8	74.3	0	0	0	111.4	C40 L41 R42 V51 P66 D68 T69 V70 L71	C40-L49 HydrophobicContact CB-CD1 4.24Å; C40-L49 HydrophobicContact CB-CD2 3.97Å; C40-L49 HydrophobicContact CB-CG 4.3Å; L41-L49 WeakPolarHBondContact O-CD1 3.46Å; R42-L49 HydrophobicContact CB-CD1 4.26Å; L49-V51 HydrophobicContact CD2-CG2 3.65Å; L49-V51 HydrophobicContact CG-CG2 3.97Å; L49-P66 HydrophobicContact CD2-CB 3.49Å; L49-P66 VanDerWaalsContact CD2-CB 3.49Å; L49-P66 HydrophobicContact CD2-CG 3.5Å; L49-P66 VanDerWaalsContact CD2-CG 3.5Å; L49-D68 PolarHBondContact N-O 2.83Å; L49-T69 WeakPolarHBondContact O-CA 3.36Å; L49-V70 PolarHBondContact O-N 3.39Å; L49-L71 PolarHBondContact O-N 3.32Å
50	N	94.4	Very high	90.5	Very high	33 Å²	33	82.9 Å²	82.9	18%	0.176	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.3	167.5	-179.4	-5	0	0	0	108.7	L41 T52 L71	L41-N50 PolarHBondContact N-O 3.41Å; L41-N50 PolarHBondContact O-N 3.25Å; N50-T52 PolarHBondContact OD1-OG1 3.39Å; N50-L71 HydrophobicContact CB-CB 4.45Å; N50-L71 HydrophobicContact CB-CD1 4.38Å
51	V	94.9	Very high	90.6	Very high	0 Å²	0	82.7 Å²	82.7	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.9	-179.9	-178.8	0	0	0	0	108.7	C38 L49 L65 P66 T69 L71 L72 R73	C38-V51 HydrophobicContact CB-CG1 4.33Å; L49-V51 HydrophobicContact CD2-CG2 3.65Å; L49-V51 HydrophobicContact CG-CG2 3.97Å; V51-L65 HydrophobicContact CG1-CD2 4.05Å; V51-P66 HydrophobicContact CG2-CG 4.39Å; V51-T69 HydrophobicContact CB-CG2 4.04Å; V51-T69 HydrophobicContact CG2-CG2 3.74Å; V51-T69 WeakPolarHBondContact CG2-OG1 3.48Å; V51-L71 PolarHBondContact N-O 3.04Å; V51-L72 HydrophobicContact CB-CD1 4Å; V51-L72 HydrophobicContact CG1-CD1 3.87Å; V51-L72 WeakPolarHBondContact O-CA 3.34Å; V51-R73 PolarHBondContact O-N 3.5Å
52	T	95.9	Very high	90.6	Very high	44 Å²	44	78.1 Å²	78.1	27%	0.27	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.1	179.2	-59.4	0	0	0	0	110.5	C38 S39 N50 R73	C38-T52 CarbonylContact C-O 3.55Å; C38-T52 WeakPolarHBondContact CA-O 3.31Å; S39-T52 PolarHBondContact N-O 2.85Å; S39-T52 PolarHBondContact O-N 3.29Å; N50-T52 PolarHBondContact OD1-OG1 3.39Å; T52-R73 HydrophobicContact CG2-CB 4.27Å
53	C	95.8	Very high	90.5	Very high	1 Å²	1	75 Å²	75	1%	0.007	38%	0.381	C	S	.	.			trans	-125.1	23.9	-178.4	-54.4	0	0	0	0	111.7	C38 S56 L58 R73 L74 N77	C38-C53 HydrophobicContact CB-CB 4.09Å; C38-C53 WeakPolarHBondContact CB-SG 3.18Å; C38-C53 WeakPolarHBondContact SG-CB 3.46Å; C38-C53 CovalentContact SG-SG 2.03Å; C38-C53 PolarHBondContact SG-SG 2.94Å; C53-S56 WeakPolarHBondContact O-CB 3.47Å; C53-S56 PolarHBondContact O-OG 3.08Å; C53-L58 HydrophobicContact CB-CD1 3.84Å; C53-R73 WeakPolarHBondContact CA-O 3.34Å; C53-R73 WeakPolarHBondContact CB-O 3.49Å; C53-R73 PolarHBondContact N-O 2.01Å; C53-L74 HydrophobicContact CB-CD2 3.74Å; C53-N77 PolarHBondContact O-ND2 2.87Å
54	S	95.8	Very high	90.8	Very high	34 Å²	34	77.7 Å²	77.7	24%	0.238	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	140.6	-173.6	-42.7	0	0	0	0	111.5	S56 D75	S54-S56 PolarHBondContact O-N 2.8Å; S54-D75 VanDerWaalsContact CA-O 3.25Å; S54-D75 WeakPolarHBondContact CA-O 3.38Å; S54-D75 WeakPolarHBondContact CB-OD1 3.46Å; S54-D75 PolarHBondContact OG-OD1 3.47Å; S54-D75 PolarHBondContact OG-OD2 2.91Å
55	Q	95.2	Very high	91.4	Very high	146 Å²	146	73 Å²	73	68%	0.682	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	22.7	178.5	-55	178.8	23.6	0	0	115.7	R57 D75 H76	Q55-R57 VanDerWaalsContact C-N 3.3Å; Q55-R57 PolarHBondContact O-N 3.25Å; Q55-D75 PolarHBondContact N-O 2.61Å; Q55-H76 VanDerWaalsContact CA-O 3.3Å; Q55-H76 WeakPolarHBondContact CA-O 3.48Å; Q55-H76 HydrophobicContact CG-CB 3.64Å; Q55-H76 PolarHBondContact N-O 3.44Å
56	S	94.5	Very high	91.9	Very high	41 Å²	41	65.8 Å²	65.8	29%	0.287	33%	0.332	S	S	.	.	S	Bend	trans	-89.6	9.3	-177.3	-63.3	0	0	0	0	114.3	G37 C53 S54 L58 N77	G37-S56 WeakPolarHBondContact O-CB 3.31Å; G37-S56 PolarHBondContact O-OG 3.45Å; C53-S56 WeakPolarHBondContact O-CB 3.47Å; C53-S56 PolarHBondContact O-OG 3.08Å; S54-S56 PolarHBondContact O-N 2.8Å; S56-L58 PolarHBondContact O-N 2.99Å; S56-N77 PolarHBondContact N-OD1 3.23Å
57	R	95.3	Very high	92.7	Very high	202 Å²	202	69 Å²	69	76%	0.762	35%	0.353	S	S	*	.			trans	54.3	33.4	-178.8	-54	178.6	-176.9	-178.8	-0	112.5	Q55 K59 N77	Q55-R57 VanDerWaalsContact C-N 3.3Å; Q55-R57 PolarHBondContact O-N 3.25Å; R57-K59 PolarHBondContact O-N 3.22Å; R57-N77 PolarHBondContact N-OD1 2.95Å
58	L	94.8	Very high	93	Very high	28 Å²	28	62.9 Å²	62.9	15%	0.147	33%	0.326	C	S	.	.			trans	-69.2	131.4	179.7	-61.5	175.8	0	0	0	109.7	C53 S56 P62 L74 N77 Q78 I79	C53-L58 HydrophobicContact CB-CD1 3.84Å; S56-L58 PolarHBondContact O-N 2.99Å; L58-P62 HydrophobicContact CD1-CG 3.99Å; L58-L74 HydrophobicContact CD1-CD2 3.82Å; L58-N77 HydrophobicContact CB-CB 4.12Å; L58-N77 PolarHBondContact N-OD1 2.88Å; L58-Q78 CarbonylContact O-C 3.54Å; L58-Q78 VanDerWaalsContact O-CA 3.27Å; L58-Q78 WeakPolarHBondContact O-CA 3.08Å; L58-Q78 PolarHBondContact O-N 2.95Å; L58-I79 HydrophobicContact CB-CG1 4.4Å; L58-I79 PolarHBondContact O-N 3.18Å
59	K	95.3	Very high	93.3	Very high	151 Å²	151	62.4 Å²	62.4	66%	0.657	32%	0.321	S	S	*	.	S	Bend	trans	-92.4	-18.8	173.6	-65	-173.9	177.6	-174.8	0	113	R57 I79	R57-K59 PolarHBondContact O-N 3.22Å; K59-I79 WeakPolarHBondContact O-CA 3.28Å
60	E	95.2	Very high	93.5	Very high	154 Å²	154	62.2 Å²	62.2	72%	0.72	32%	0.32	S	S	*	.	S	Bend	trans	-145.2	158.6	-175.1	-65	177.3	-159.1	0	0	109.1
61	I	95.1	Very high	93.6	Very high	22 Å²	22	62.1 Å²	62.1	11%	0.113	32%	0.32	C	S	.	.			trans	-70	128.2	175.6	-61.6	163.4	0	0	0	108.5	L65 L74 I79 V82 A86 F87	I61-L65 HydrophobicContact CG2-CD1 3.95Å; I61-L74 HydrophobicContact CG1-CD1 4.32Å; I61-L74 HydrophobicContact CG2-CD1 4.21Å; I61-I79 HydrophobicContact CG1-CD1 4.2Å; I61-I79 HydrophobicContact CG1-CG2 4.26Å; I61-V82 HydrophobicContact CD1-CB 4.42Å; I61-V82 HydrophobicContact CD1-CG1 3.92Å; I61-V82 HydrophobicContact CD1-CG2 4.26Å; I61-A86 HydrophobicContact CD1-CB 3.82Å; I61-F87 HydrophobicContact CD1-CE1 3.97Å; I61-F87 HydrophobicContact CD1-CE2 4.25Å; I61-F87 HydrophobicContact CD1-CZ 3.5Å; I61-F87 VanDerWaalsContact CD1-CZ 3.5Å; I61-F87 HydrophobicContact CG1-CZ 4.45Å; I61-F87 HydrophobicContact CG2-CE1 4.04Å
62	P	92	Very high	93.6	Very high	15 Å²	15	62.1 Å²	62.1	10%	0.097	32%	0.32	C	S	.	.			trans	-60.8	131.1	179.9	-22.5	32.3	0	0	0	111.9	P35 L58 N64 L65	P35-P62 HydrophobicContact CB-CB 3.64Å; P35-P62 HydrophobicContact CB-CG 4.09Å; P35-P62 HydrophobicContact CG-CB 3.81Å; P35-P62 HydrophobicContact CG-CG 4.39Å; L58-P62 HydrophobicContact CD1-CG 3.99Å; P62-N64 VanDerWaalsContact C-N 3.3Å; P62-N64 PolarHBondContact O-N 3.42Å; P62-L65 WeakPolarHBondContact O-CG 2.98Å
63	P	86.5	Confident	93.7	Very high	125 Å²	125	65 Å²	65	81%	0.812	33%	0.326	S	S	*	.	S	Bend	trans	-73.2	-22	-175.2	27.4	-35.3	0	0	0	113.5	L65	P63-L65 PolarHBondContact O-N 3.08Å
64	N	86.1	Confident	93.8	Very high	110 Å²	110	65 Å²	65	59%	0.588	33%	0.325	S	S	*	.			trans	-102	53.8	-173.6	-62.3	-33.3	0	0	0	111.5	P62	P62-N64 VanDerWaalsContact C-N 3.3Å; P62-N64 PolarHBondContact O-N 3.42Å
65	L	92.4	Very high	93.9	Very high	21 Å²	21	64.3 Å²	64.3	11%	0.11	32%	0.319	C	S	.	.			trans	-78.6	135.3	175.6	-72.1	165.1	0	0	0	110.6	P35 V51 I61 P62 P63 L72 L90	P35-L65 HydrophobicContact CG-CD2 4.02Å; V51-L65 HydrophobicContact CG1-CD2 4.05Å; I61-L65 HydrophobicContact CG2-CD1 3.95Å; P62-L65 WeakPolarHBondContact O-CG 2.98Å; P63-L65 PolarHBondContact O-N 3.08Å; L65-L72 HydrophobicContact CD1-CD1 4.49Å; L65-L72 HydrophobicContact CD1-CD2 3.71Å; L65-L72 HydrophobicContact CD2-CD1 3.82Å; L65-L72 HydrophobicContact CD2-CD2 4.48Å; L65-L90 HydrophobicContact CB-CD1 4.25Å; L65-L90 HydrophobicContact CB-CD2 4.04Å; L65-L90 HydrophobicContact CD1-CD1 4.06Å
66	P	91.8	Very high	94	Very high	21 Å²	21	61.2 Å²	61.2	14%	0.136	31%	0.305	C	S	.	.			trans	-61.4	135.9	178.7	-24.3	35	0	0	0	112.5	L49 V51 D68 T69 L90	L49-P66 HydrophobicContact CD2-CB 3.49Å; L49-P66 VanDerWaalsContact CD2-CB 3.49Å; L49-P66 HydrophobicContact CD2-CG 3.5Å; L49-P66 VanDerWaalsContact CD2-CG 3.5Å; V51-P66 HydrophobicContact CG2-CG 4.39Å; P66-D68 VanDerWaalsContact CB-OD1 3.25Å; P66-D68 WeakPolarHBondContact CB-OD1 3.35Å; P66-D68 PolarHBondContact O-N 3.02Å; P66-T69 VanDerWaalsContact O-CB 3.26Å; P66-T69 WeakPolarHBondContact O-CB 3.25Å; P66-T69 PolarHBondContact O-N 3.4Å; P66-T69 VanDerWaalsContact O-N 3.08Å; P66-T69 PolarHBondContact O-OG1 3.32Å; P66-L90 WeakPolarHBondContact O-CD2 3.38Å
67	V	91.8	Very high	94.2	Very high	104 Å²	104	59.9 Å²	59.9	63%	0.63	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.5	-176.7	-179.2	0	0	0	0	112.5	T69 G89	V67-T69 PolarHBondContact O-N 3.29Å; V67-G89 WeakPolarHBondContact CG1-O 3.1Å
68	D	91.4	Very high	94.3	Very high	49 Å²	49	55.3 Å²	55.3	26%	0.262	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	9.8	176.4	62.2	-25.7	0	0	0	113.7	R42 G48 L49 P66 V70	R42-D68 IonicContact NH2-OD2 3.29Å; R42-D68 PolarHBondContact NH2-OD2 3.09Å; G48-D68 CarbonylContact C-O 3.58Å; G48-D68 WeakPolarHBondContact CA-O 3.31Å; L49-D68 PolarHBondContact N-O 2.83Å; P66-D68 VanDerWaalsContact CB-OD1 3.25Å; P66-D68 WeakPolarHBondContact CB-OD1 3.35Å; P66-D68 PolarHBondContact O-N 3.02Å; D68-V70 PolarHBondContact O-N 3.46Å
69	T	93.8	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	125	177.7	-56.9	0	0	0	0	111.6	L49 V51 P66 V67 L71 L72 L92 L93	L49-T69 WeakPolarHBondContact O-CA 3.36Å; V51-T69 HydrophobicContact CB-CG2 4.04Å; V51-T69 HydrophobicContact CG2-CG2 3.74Å; V51-T69 WeakPolarHBondContact CG2-OG1 3.48Å; P66-T69 VanDerWaalsContact O-CB 3.26Å; P66-T69 WeakPolarHBondContact O-CB 3.25Å; P66-T69 PolarHBondContact O-N 3.4Å; P66-T69 VanDerWaalsContact O-N 3.08Å; P66-T69 PolarHBondContact O-OG1 3.32Å; V67-T69 PolarHBondContact O-N 3.29Å; T69-L71 WeakPolarHBondContact CG2-O 3.38Å; T69-L72 HydrophobicContact CG2-CB 4.07Å; T69-L92 CarbonylContact O-C 3.51Å; T69-L93 HydrophobicContact CG2-CD1 3.99Å; T69-L93 PolarHBondContact O-N 3.49Å
70	V	95.3	Very high	94.5	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.03	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-36.9	176.5	177.3	0	0	0	0	111.3	L46 L49 D68 L92 R94 E95	L46-V70 HydrophobicContact CD1-CG1 4.38Å; L46-V70 HydrophobicContact CD2-CB 3.61Å; L46-V70 HydrophobicContact CD2-CG1 3.57Å; L46-V70 HydrophobicContact CD2-CG2 4.38Å; L46-V70 HydrophobicContact CG-CB 4.26Å; L46-V70 HydrophobicContact CG-CG1 3.91Å; L49-V70 PolarHBondContact O-N 3.39Å; D68-V70 PolarHBondContact O-N 3.46Å; V70-L92 HydrophobicContact CG2-CB 4.01Å; V70-R94 HydrophobicContact CG1-CB 4.07Å; V70-R94 HydrophobicContact CG1-CG 3.92Å; V70-R94 PolarHBondContact O-N 2.85Å; V70-E95 PolarHBondContact O-N 3.36Å
71	L	95.9	Very high	94.6	Very high	32 Å²	32	42.8 Å²	42.8	17%	0.168	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.2	175.6	-50.2	173.4	0	0	0	108.2	L46 L49 N50 V51 T69 E95	L46-L71 HydrophobicContact CD2-CD1 3.72Å; L46-L71 HydrophobicContact CD2-CD2 4.44Å; L46-L71 HydrophobicContact CD2-CG 3.68Å; L49-L71 PolarHBondContact O-N 3.32Å; N50-L71 HydrophobicContact CB-CB 4.45Å; N50-L71 HydrophobicContact CB-CD1 4.38Å; V51-L71 PolarHBondContact N-O 3.04Å; T69-L71 WeakPolarHBondContact CG2-O 3.38Å; L71-E95 HydrophobicContact CD2-CB 3.51Å
72	L	96.7	Very high	94.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113.2	177.1	-179.2	55.2	0	0	0	109.9	V51 L65 T69 L74 F87 L90 L93 E95 L96 N97	V51-L72 HydrophobicContact CB-CD1 4Å; V51-L72 HydrophobicContact CG1-CD1 3.87Å; V51-L72 WeakPolarHBondContact O-CA 3.34Å; L65-L72 HydrophobicContact CD1-CD1 4.49Å; L65-L72 HydrophobicContact CD1-CD2 3.71Å; L65-L72 HydrophobicContact CD2-CD1 3.82Å; L65-L72 HydrophobicContact CD2-CD2 4.48Å; T69-L72 HydrophobicContact CG2-CB 4.07Å; L72-L74 HydrophobicContact CD1-CD1 4.2Å; L72-L74 HydrophobicContact CD1-CG 4.03Å; L72-L74 HydrophobicContact CD2-CD1 3.85Å; L72-L74 HydrophobicContact CG-CD1 3.88Å; L72-L74 HydrophobicContact CG-CG 4.05Å; L72-F87 HydrophobicContact CD2-CD1 3.98Å; L72-F87 HydrophobicContact CD2-CE1 3.86Å; L72-L90 HydrophobicContact CD2-CD1 4.18Å; L72-L93 HydrophobicContact CB-CD1 3.65Å; L72-E95 PolarHBondContact N-O 3.44Å; L72-L96 HydrophobicContact CB-CD1 4.12Å; L72-L96 HydrophobicContact CD2-CD1 3.89Å; L72-L96 HydrophobicContact CG-CD1 3.98Å; L72-N97 PolarHBondContact O-N 3.41Å
73	R	97.5	Very high	94.8	Very high	104 Å²	104	44.8 Å²	44.8	39%	0.392	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	111.3	176.3	-67.4	-166.7	159.5	175	-4.9	110.4	V51 T52 C53 E95 N97	V51-R73 PolarHBondContact O-N 3.5Å; T52-R73 HydrophobicContact CG2-CB 4.27Å; C53-R73 WeakPolarHBondContact CA-O 3.34Å; C53-R73 WeakPolarHBondContact CB-O 3.49Å; C53-R73 PolarHBondContact N-O 2.01Å; R73-E95 IonicContact CZ-OE1 3.07Å; R73-E95 IonicContact NE-OE1 3.98Å; R73-E95 IonicContact NH2-OE1 3.72Å; R73-E95 PolarHBondContact NH2-OE1 3.24Å; R73-N97 HydrophobicContact CG-CB 4.38Å
74	L	97.3	Very high	95.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.			trans	-119.5	18.2	177.9	-71.9	164.8	0	0	0	110.8	C53 L58 I61 L72 N77 I79 F87 L96 N97 L98 N101	C53-L74 HydrophobicContact CB-CD2 3.74Å; L58-L74 HydrophobicContact CD1-CD2 3.82Å; I61-L74 HydrophobicContact CG1-CD1 4.32Å; I61-L74 HydrophobicContact CG2-CD1 4.21Å; L72-L74 HydrophobicContact CD1-CD1 4.2Å; L72-L74 HydrophobicContact CD1-CG 4.03Å; L72-L74 HydrophobicContact CD2-CD1 3.85Å; L72-L74 HydrophobicContact CG-CD1 3.88Å; L72-L74 HydrophobicContact CG-CG 4.05Å; L74-N77 PolarHBondContact O-ND2 2.92Å; L74-I79 HydrophobicContact CB-CD1 4.09Å; L74-I79 HydrophobicContact CD1-CD1 4.5Å; L74-I79 HydrophobicContact CD2-CD1 4.34Å; L74-F87 HydrophobicContact CD1-CE1 4.36Å; L74-L96 HydrophobicContact CD1-CD1 4.45Å; L74-N97 CarbonylContact C-O 3.45Å; L74-N97 WeakPolarHBondContact CA-O 3.24Å; L74-N97 PolarHBondContact N-O 2.95Å; L74-L98 HydrophobicContact CB-CD2 3.78Å; L74-L98 HydrophobicContact CD1-CD2 3.9Å; L74-N101 PolarHBondContact O-ND2 3.37Å
75	D	98.1	Very high	95.4	Very high	20 Å²	20	42.4 Å²	42.4	11%	0.107	23%	0.231	C	C	.	.			trans	-67.2	158.4	-177.2	62.7	-73.8	0	0	0	113.4	S54 Q55 N77 N97 S99	S54-D75 VanDerWaalsContact CA-O 3.25Å; S54-D75 WeakPolarHBondContact CA-O 3.38Å; S54-D75 WeakPolarHBondContact CB-OD1 3.46Å; S54-D75 PolarHBondContact OG-OD1 3.47Å; S54-D75 PolarHBondContact OG-OD2 2.91Å; Q55-D75 PolarHBondContact N-O 2.61Å; D75-N77 VanDerWaalsContact C-N 3.3Å; D75-N77 PolarHBondContact O-N 2.92Å; D75-N77 PolarHBondContact O-ND2 3.4Å; D75-N97 PolarHBondContact N-O 3.1Å; D75-S99 WeakPolarHBondContact CA-O 3.47Å; D75-S99 WeakPolarHBondContact CB-O 3.14Å
76	H	97.9	Very high	95.4	Very high	82 Å²	82	42.8 Å²	42.8	38%	0.38	24%	0.237	S	C	.	.	S	Bend	trans	56.1	41.9	179.1	-60.6	84.5	0	0	0	113.4	Q55 S99 Y100	Q55-H76 VanDerWaalsContact CA-O 3.3Å; Q55-H76 WeakPolarHBondContact CA-O 3.48Å; Q55-H76 HydrophobicContact CG-CB 3.64Å; Q55-H76 PolarHBondContact N-O 3.44Å; H76-S99 PolarHBondContact N-O 2.97Å; H76-S99 VanDerWaalsContact N-O 3.11Å; H76-Y100 WeakPolarHBondContact CA-O 3.42Å; H76-Y100 AromaticContact CD2-CG 3.99Å; H76-Y100 AromaticContact CE1-CD2 3.76Å; H76-Y100 AromaticContact CE1-CG 3.93Å; H76-Y100 PolarHBondContact N-O 2.71Å; H76-Y100 AromaticContact NE2-CD1 3.98Å; H76-Y100 AromaticContact NE2-CD2 3.87Å; H76-Y100 AromaticContact NE2-CG 3.66Å
77	N	97.7	Very high	95.5	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.064	23%	0.231	C	C	.	.	S	Bend	trans	-114.8	-164.3	175.9	-80.3	-60.4	0	0	0	110.5	C53 S56 R57 L58 L74 D75 I79 Y100 N101	C53-N77 PolarHBondContact O-ND2 2.87Å; S56-N77 PolarHBondContact N-OD1 3.23Å; R57-N77 PolarHBondContact N-OD1 2.95Å; L58-N77 HydrophobicContact CB-CB 4.12Å; L58-N77 PolarHBondContact N-OD1 2.88Å; L74-N77 PolarHBondContact O-ND2 2.92Å; D75-N77 VanDerWaalsContact C-N 3.3Å; D75-N77 PolarHBondContact O-N 2.92Å; D75-N77 PolarHBondContact O-ND2 3.4Å; N77-I79 HydrophobicContact CB-CD1 4.35Å; N77-I79 HydrophobicContact CB-CG1 4.18Å; N77-Y100 PolarHBondContact N-O 2.76Å; N77-N101 VanDerWaalsContact CA-OD1 3.26Å; N77-N101 WeakPolarHBondContact CA-OD1 3.47Å; N77-N101 WeakPolarHBondContact CB-OD1 3.37Å; N77-N101 PolarHBondContact N-OD1 3.05Å; N77-N101 PolarHBondContact O-OD1 3.47Å
78	Q	97.4	Very high	95.5	Very high	106 Å²	106	45.2 Å²	45.2	50%	0.495	23%	0.232	S	C	.	.			trans	-123.9	31	-178.2	-61.6	175.7	-2.3	0	0	110.5	L58 G80 N101	L58-Q78 CarbonylContact O-C 3.54Å; L58-Q78 VanDerWaalsContact O-CA 3.27Å; L58-Q78 WeakPolarHBondContact O-CA 3.08Å; L58-Q78 PolarHBondContact O-N 2.95Å; Q78-G80 PolarHBondContact O-N 3.44Å; Q78-N101 PolarHBondContact N-OD1 3.42Å
79	I	97.7	Very high	95.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.234	C	C	.	.			trans	-69.3	121.2	-176.8	-59.9	170.2	0	0	0	108.4	L58 K59 I61 L74 N77 A81 L98 N101 A102 V103	L58-I79 HydrophobicContact CB-CG1 4.4Å; L58-I79 PolarHBondContact O-N 3.18Å; K59-I79 WeakPolarHBondContact O-CA 3.28Å; I61-I79 HydrophobicContact CG1-CD1 4.2Å; I61-I79 HydrophobicContact CG1-CG2 4.26Å; L74-I79 HydrophobicContact CB-CD1 4.09Å; L74-I79 HydrophobicContact CD1-CD1 4.5Å; L74-I79 HydrophobicContact CD2-CD1 4.34Å; N77-I79 HydrophobicContact CB-CD1 4.35Å; N77-I79 HydrophobicContact CB-CG1 4.18Å; I79-A81 WeakPolarHBondContact CG2-O 3.5Å; I79-L98 HydrophobicContact CD1-CD2 4Å; I79-N101 HydrophobicContact CB-CB 4.4Å; I79-N101 WeakPolarHBondContact CB-OD1 3.22Å; I79-N101 WeakPolarHBondContact CG1-OD1 3.31Å; I79-N101 PolarHBondContact N-OD1 3.17Å; I79-A102 CarbonylContact O-C 3.53Å; I79-A102 WeakPolarHBondContact O-CA 3.49Å; I79-A102 PolarHBondContact O-N 3.5Å; I79-A102 VanDerWaalsContact O-N 3.09Å; I79-V103 HydrophobicContact CB-CG2 4.47Å; I79-V103 HydrophobicContact CG2-CG2 4.27Å; I79-V103 WeakPolarHBondContact O-CA 3.5Å; I79-V103 WeakPolarHBondContact O-CG2 3.42Å; I79-V103 PolarHBondContact O-N 3.07Å
80	G	96.7	Very high	95.4	Very high	29 Å²	29	44.5 Å²	44.5	30%	0.299	24%	0.235	S	C	.	.			trans	-92.9	-26.2	-175.1	0	0	0	0	0	114.9	Q78 A102 V103 E104	Q78-G80 PolarHBondContact O-N 3.44Å; G80-A102 WeakPolarHBondContact CA-O 3.26Å; G80-V103 WeakPolarHBondContact O-CA 3.17Å; G80-E104 PolarHBondContact O-N 2.83Å
81	A	96.7	Very high	95.3	Very high	42 Å²	42	53.2 Å²	53.2	35%	0.347	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	149.1	-177.3	0	0	0	0	0	110.8	I79 T105	I79-A81 WeakPolarHBondContact CG2-O 3.5Å; A81-T105 WeakPolarHBondContact CA-O 3.03Å; A81-T105 VanDerWaalsContact CB-OG1 3.3Å; A81-T105 WeakPolarHBondContact CB-OG1 3.34Å
82	V	96.8	Very high	95.1	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	105.9	166.9	-174.5	0	0	0	0	107.1	I61 A86 F87 L98 V103 T105 L106 G107 S110	I61-V82 HydrophobicContact CD1-CB 4.42Å; I61-V82 HydrophobicContact CD1-CG1 3.92Å; I61-V82 HydrophobicContact CD1-CG2 4.26Å; V82-A86 HydrophobicContact CG1-CB 3.98Å; V82-F87 HydrophobicContact CG1-CE2 3.75Å; V82-F87 HydrophobicContact CG1-CZ 4.27Å; V82-L98 HydrophobicContact CG2-CD1 4.11Å; V82-V103 HydrophobicContact CG2-CG1 4.1Å; V82-V103 HydrophobicContact CG2-CG2 4.35Å; V82-T105 PolarHBondContact N-O 2.9Å; V82-L106 HydrophobicContact CB-CD2 3.61Å; V82-L106 HydrophobicContact CG2-CD2 3.55Å; V82-G107 PolarHBondContact O-N 3.39Å; V82-S110 PolarHBondContact O-OG 2.81Å; V82-S110 VanDerWaalsContact O-OG 3.05Å
83	P	95	Very high	95.1	Very high	77 Å²	77	55.9 Å²	55.9	50%	0.5	28%	0.281	S	S	.	.			trans	-72.4	163.3	179.8	29.3	-33.3	0	0	0	111.2	Q85 A86	P83-Q85 PolarHBondContact O-N 2.91Å; P83-A86 HydrophobicContact CG-CB 4.04Å; P83-A86 VanDerWaalsContact O-CB 3.32Å; P83-A86 WeakPolarHBondContact O-CB 3.4Å; P83-A86 PolarHBondContact O-N 3.23Å
84	D	93.1	Very high	95	Very high	91 Å²	91	56.4 Å²	56.4	49%	0.487	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	139.9	172.7	-68.7	-26.4	0	0	0	111.1	A86 G107 E108 G109	D84-A86 PolarHBondContact O-N 2.99Å; D84-A86 VanDerWaalsContact O-N 3.13Å; D84-G107 WeakPolarHBondContact OD1-CA 3.34Å; D84-E108 PolarHBondContact OD1-N 2.75Å; D84-G109 WeakPolarHBondContact OD1-CA 3.3Å; D84-G109 PolarHBondContact OD1-N 3.22Å
85	Q	91.7	Very high	95	Very high	93 Å²	93	58.9 Å²	58.9	44%	0.435	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	20.3	176.9	-55.4	-179.9	11.5	0	0	114.2	P83 F87 R88 G109	P83-Q85 PolarHBondContact O-N 2.91Å; Q85-F87 PolarHBondContact O-N 3.42Å; Q85-R88 HydrophobicContact CB-CB 3.9Å; Q85-R88 WeakPolarHBondContact O-CB 3.43Å; Q85-R88 PolarHBondContact O-N 2.89Å; Q85-R88 VanDerWaalsContact OE1-CD 3.28Å; Q85-G109 PolarHBondContact N-O 2.83Å
86	A	93.4	Very high	94.9	Very high	29 Å²	29	57.9 Å²	57.9	24%	0.24	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-31.3	-179.8	0	0	0	0	0	113.8	I61 V82 P83 D84	I61-A86 HydrophobicContact CD1-CB 3.82Å; V82-A86 HydrophobicContact CG1-CB 3.98Å; P83-A86 HydrophobicContact CG-CB 4.04Å; P83-A86 VanDerWaalsContact O-CB 3.32Å; P83-A86 WeakPolarHBondContact O-CB 3.4Å; P83-A86 PolarHBondContact O-N 3.23Å; D84-A86 PolarHBondContact O-N 2.99Å; D84-A86 VanDerWaalsContact O-N 3.13Å
87	F	94.6	Very high	95	Very high	1 Å²	1	55 Å²	55	0%	0.004	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	15.3	-178.7	-52	-68.8	0	0	0	113	I61 L72 L74 V82 Q85 G89 L90 L96 L98 F111 I114	I61-F87 HydrophobicContact CD1-CE1 3.97Å; I61-F87 HydrophobicContact CD1-CE2 4.25Å; I61-F87 HydrophobicContact CD1-CZ 3.5Å; I61-F87 VanDerWaalsContact CD1-CZ 3.5Å; I61-F87 HydrophobicContact CG1-CZ 4.45Å; I61-F87 HydrophobicContact CG2-CE1 4.04Å; L72-F87 HydrophobicContact CD2-CD1 3.98Å; L72-F87 HydrophobicContact CD2-CE1 3.86Å; L74-F87 HydrophobicContact CD1-CE1 4.36Å; V82-F87 HydrophobicContact CG1-CE2 3.75Å; V82-F87 HydrophobicContact CG1-CZ 4.27Å; Q85-F87 PolarHBondContact O-N 3.42Å; F87-G89 PolarHBondContact O-N 2.84Å; F87-L90 HydrophobicContact CB-CD1 4.19Å; F87-L90 HydrophobicContact CD1-CD1 4.14Å; F87-L90 WeakPolarHBondContact O-CB 3.03Å; F87-L90 PolarHBondContact O-N 3.33Å; F87-L90 VanDerWaalsContact O-N 3.11Å; F87-L96 HydrophobicContact CD1-CD2 4.34Å; F87-L96 HydrophobicContact CD2-CD2 3.89Å; F87-L96 HydrophobicContact CE1-CD1 3.88Å; F87-L96 HydrophobicContact CE1-CD2 3.96Å; F87-L96 HydrophobicContact CE2-CD2 3.46Å; F87-L96 VanDerWaalsContact CE2-CD2 3.46Å; F87-L96 HydrophobicContact CG-CD2 4.31Å; F87-L96 HydrophobicContact CZ-CD1 4Å; F87-L96 HydrophobicContact CZ-CD2 3.5Å; F87-L96 HydrophobicContact CZ-CG 4.39Å; F87-L98 HydrophobicContact CZ-CD1 4.06Å; F87-F111 HydrophobicContact CD2-CD1 4.16Å; F87-F111 HydrophobicContact CE2-CD1 4.17Å; F87-F111 HydrophobicContact CE2-CE1 4.09Å; F87-I114 HydrophobicContact CB-CD1 3.84Å; F87-I114 HydrophobicContact CB-CG1 4.43Å; F87-I114 HydrophobicContact CB-CG2 4.07Å; F87-I114 HydrophobicContact CD2-CD1 4.07Å; F87-I114 HydrophobicContact CG-CD1 4.14Å
88	R	90.7	Very high	95	Very high	175 Å²	175	54.4 Å²	54.4	66%	0.66	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	129.3	-176.8	-177	175.6	-178.3	-164.7	-1.9	110.3	Q85	Q85-R88 HydrophobicContact CB-CB 3.9Å; Q85-R88 WeakPolarHBondContact O-CB 3.43Å; Q85-R88 PolarHBondContact O-N 2.89Å; Q85-R88 VanDerWaalsContact OE1-CD 3.28Å
89	G	88.8	Confident	95	Very high	28 Å²	28	49.7 Å²	49.7	29%	0.289	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-17	-179	0	0	0	0	0	113.8	V67 F87 R91	V67-G89 WeakPolarHBondContact CG1-O 3.1Å; F87-G89 PolarHBondContact O-N 2.84Å; G89-R91 PolarHBondContact O-N 3.44Å
90	L	94.4	Very high	95	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.031	27%	0.273	C	S	.	.			trans	-78.1	58	174.4	-52.9	-176.3	0	0	0	111.3	L65 P66 L72 F87 L92 L93 I114	L65-L90 HydrophobicContact CB-CD1 4.25Å; L65-L90 HydrophobicContact CB-CD2 4.04Å; L65-L90 HydrophobicContact CD1-CD1 4.06Å; P66-L90 WeakPolarHBondContact O-CD2 3.38Å; L72-L90 HydrophobicContact CD2-CD1 4.18Å; F87-L90 HydrophobicContact CB-CD1 4.19Å; F87-L90 HydrophobicContact CD1-CD1 4.14Å; F87-L90 WeakPolarHBondContact O-CB 3.03Å; F87-L90 PolarHBondContact O-N 3.33Å; F87-L90 VanDerWaalsContact O-N 3.11Å; L90-L92 PolarHBondContact O-N 3.2Å; L90-L93 HydrophobicContact CB-CB 4.03Å; L90-L93 HydrophobicContact CB-CD2 4.46Å; L90-L93 HydrophobicContact CD1-CD2 4.33Å; L90-L93 WeakPolarHBondContact O-CB 3.31Å; L90-L93 PolarHBondContact O-N 2.89Å; L90-I114 HydrophobicContact CB-CG2 4.29Å; L90-I114 WeakPolarHBondContact O-CG2 3.49Å
91	R	92.4	Very high	95.1	Very high	189 Å²	189	54.1 Å²	54.1	71%	0.713	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.6	-171.3	-62	-177.1	-177	-177.5	1.3	114.3	G89 T117	G89-R91 PolarHBondContact O-N 3.44Å; R91-T117 WeakPolarHBondContact O-CG2 3.43Å
92	L	93.6	Very high	95.1	Very high	87 Å²	87	53.5 Å²	53.5	46%	0.455	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-0.4	177.3	-59.7	-180	0	0	0	112.4	T69 V70 L90 R94	T69-L92 CarbonylContact O-C 3.51Å; V70-L92 HydrophobicContact CG2-CB 4.01Å; L90-L92 PolarHBondContact O-N 3.2Å; L92-R94 PolarHBondContact O-N 3.27Å
93	L	95.8	Very high	95.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.256	C	S	.	.			trans	-64.4	125.5	-176.1	-168.3	69	0	0	0	110.6	T69 L72 L90 L96 I114 T117 L118	T69-L93 HydrophobicContact CG2-CD1 3.99Å; T69-L93 PolarHBondContact O-N 3.49Å; L72-L93 HydrophobicContact CB-CD1 3.65Å; L90-L93 HydrophobicContact CB-CB 4.03Å; L90-L93 HydrophobicContact CB-CD2 4.46Å; L90-L93 HydrophobicContact CD1-CD2 4.33Å; L90-L93 WeakPolarHBondContact O-CB 3.31Å; L90-L93 PolarHBondContact O-N 2.89Å; L93-L96 HydrophobicContact CD2-CB 4.27Å; L93-I114 HydrophobicContact CB-CG2 4.33Å; L93-I114 HydrophobicContact CD2-CD1 3.86Å; L93-I114 HydrophobicContact CD2-CG2 4.38Å; L93-T117 CarbonylContact O-C 3.48Å; L93-T117 WeakPolarHBondContact O-CB 3.32Å; L93-T117 PolarHBondContact O-OG1 3.24Å; L93-L118 HydrophobicContact CD2-CD1 4.25Å; L93-L118 HydrophobicContact CG-CD1 4.18Å; L93-L118 PolarHBondContact O-N 2.88Å
94	R	95.7	Very high	95.3	Very high	115 Å²	115	54.9 Å²	54.9	43%	0.434	26%	0.257	S	S	.	.			trans	-115.4	-38.6	179.9	-68	-179.1	-175.6	-174.6	-0.9	112.2	V70 L92 Q119 V120	V70-R94 HydrophobicContact CG1-CB 4.07Å; V70-R94 HydrophobicContact CG1-CG 3.92Å; V70-R94 PolarHBondContact O-N 2.85Å; L92-R94 PolarHBondContact O-N 3.27Å; R94-Q119 HydrophobicContact CB-CG 4.21Å; R94-Q119 HydrophobicContact CG-CG 4.37Å; R94-Q119 WeakPolarHBondContact O-CA 3.35Å; R94-Q119 WeakPolarHBondContact O-CB 3.39Å; R94-Q119 PolarHBondContact O-N 2.99Å; R94-V120 PolarHBondContact O-N 2.04Å
95	E	96.4	Very high	95.3	Very high	52 Å²	52	54.7 Å²	54.7	24%	0.243	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	125.9	178.6	-173.3	176	139.7	0	0	109.7	V70 L71 L72 R73 V120	V70-E95 PolarHBondContact O-N 3.36Å; L71-E95 HydrophobicContact CD2-CB 3.51Å; L72-E95 PolarHBondContact N-O 3.44Å; R73-E95 IonicContact CZ-OE1 3.07Å; R73-E95 IonicContact NE-OE1 3.98Å; R73-E95 IonicContact NH2-OE1 3.72Å; R73-E95 PolarHBondContact NH2-OE1 3.24Å; E95-V120 WeakPolarHBondContact CA-O 3.49Å; E95-V120 HydrophobicContact CG-CB 4.23Å; E95-V120 HydrophobicContact CG-CG1 4.48Å
96	L	97.7	Very high	95.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.3	172.1	176	55.8	0	0	0	109	L72 L74 F87 L93 L98 F111 I114 L118 V120 L121 D122	L72-L96 HydrophobicContact CB-CD1 4.12Å; L72-L96 HydrophobicContact CD2-CD1 3.89Å; L72-L96 HydrophobicContact CG-CD1 3.98Å; L74-L96 HydrophobicContact CD1-CD1 4.45Å; F87-L96 HydrophobicContact CD1-CD2 4.34Å; F87-L96 HydrophobicContact CD2-CD2 3.89Å; F87-L96 HydrophobicContact CE1-CD1 3.88Å; F87-L96 HydrophobicContact CE1-CD2 3.96Å; F87-L96 HydrophobicContact CE2-CD2 3.46Å; F87-L96 VanDerWaalsContact CE2-CD2 3.46Å; F87-L96 HydrophobicContact CG-CD2 4.31Å; F87-L96 HydrophobicContact CZ-CD1 4Å; F87-L96 HydrophobicContact CZ-CD2 3.5Å; F87-L96 HydrophobicContact CZ-CG 4.39Å; L93-L96 HydrophobicContact CD2-CB 4.27Å; L96-L98 HydrophobicContact CD1-CD1 4.26Å; L96-L98 HydrophobicContact CD1-CG 4.11Å; L96-L98 HydrophobicContact CD2-CD1 4.01Å; L96-L98 HydrophobicContact CG-CD1 4.09Å; L96-L98 HydrophobicContact CG-CG 4.27Å; L96-F111 HydrophobicContact CD2-CD1 4.29Å; L96-F111 HydrophobicContact CD2-CE1 4.03Å; L96-I114 HydrophobicContact CD2-CD1 4.49Å; L96-L118 HydrophobicContact CB-CD1 3.9Å; L96-V120 PolarHBondContact N-O 2.88Å; L96-L121 HydrophobicContact CB-CD1 4.14Å; L96-L121 HydrophobicContact CD2-CD1 3.8Å; L96-L121 HydrophobicContact CG-CD1 3.94Å; L96-L121 WeakPolarHBondContact O-CA 3.4Å; L96-D122 PolarHBondContact O-N 3.36Å
97	N	98.1	Very high	95.4	Very high	21 Å²	21	51 Å²	51	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.6	175.1	-169.8	-15	0	0	0	110.3	L72 R73 L74 D75 S99	L72-N97 PolarHBondContact O-N 3.41Å; R73-N97 HydrophobicContact CG-CB 4.38Å; L74-N97 CarbonylContact C-O 3.45Å; L74-N97 WeakPolarHBondContact CA-O 3.24Å; L74-N97 PolarHBondContact N-O 2.95Å; D75-N97 PolarHBondContact N-O 3.1Å; N97-S99 VanDerWaalsContact OD1-CB 3.28Å; N97-S99 WeakPolarHBondContact OD1-CB 3.15Å; N97-S99 PolarHBondContact OD1-N 3.38Å; N97-S99 PolarHBondContact OD1-OG 3.41Å
98	L	98	Very high	95.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.273	C	S	.	.			trans	-118.4	16.1	175	-76.6	162.8	0	0	0	111.3	L74 I79 V82 F87 L96 N101 D122 L123 N126	L74-L98 HydrophobicContact CB-CD2 3.78Å; L74-L98 HydrophobicContact CD1-CD2 3.9Å; I79-L98 HydrophobicContact CD1-CD2 4Å; V82-L98 HydrophobicContact CG2-CD1 4.11Å; F87-L98 HydrophobicContact CZ-CD1 4.06Å; L96-L98 HydrophobicContact CD1-CD1 4.26Å; L96-L98 HydrophobicContact CD1-CG 4.11Å; L96-L98 HydrophobicContact CD2-CD1 4.01Å; L96-L98 HydrophobicContact CG-CD1 4.09Å; L96-L98 HydrophobicContact CG-CG 4.27Å; L98-N101 WeakPolarHBondContact O-CB 3.41Å; L98-N101 PolarHBondContact O-ND2 3.12Å; L98-D122 CarbonylContact C-O 3.58Å; L98-D122 WeakPolarHBondContact CA-O 3.47Å; L98-D122 WeakPolarHBondContact CB-O 3.42Å; L98-D122 PolarHBondContact N-O 2.79Å; L98-L123 HydrophobicContact CB-CD2 3.94Å; L98-L123 HydrophobicContact CD1-CD2 3.86Å; L98-N126 PolarHBondContact O-ND2 2.91Å
99	S	98	Very high	95.2	Very high	6 Å²	6	50 Å²	50	4%	0.042	25%	0.252	C	S	.	.			trans	-61.9	157.9	-179.5	63.4	0	0	0	0	112.6	D75 H76 N97 N101 D122 S124	D75-S99 WeakPolarHBondContact CA-O 3.47Å; D75-S99 WeakPolarHBondContact CB-O 3.14Å; H76-S99 PolarHBondContact N-O 2.97Å; H76-S99 VanDerWaalsContact N-O 3.11Å; N97-S99 VanDerWaalsContact OD1-CB 3.28Å; N97-S99 WeakPolarHBondContact OD1-CB 3.15Å; N97-S99 PolarHBondContact OD1-N 3.38Å; N97-S99 PolarHBondContact OD1-OG 3.41Å; S99-N101 VanDerWaalsContact C-N 3.3Å; S99-N101 PolarHBondContact O-N 3.01Å; S99-N101 PolarHBondContact O-ND2 3.01Å; S99-D122 PolarHBondContact N-O 3.09Å; S99-S124 CarbonylContact C-O 3.15Å; S99-S124 WeakPolarHBondContact CA-O 3.17Å; S99-S124 WeakPolarHBondContact CB-O 3.3Å; S99-S124 WeakPolarHBondContact CB-OG 3.27Å
100	Y	98.1	Very high	95.5	Very high	110 Å²	110	48.7 Å²	48.7	43%	0.431	24%	0.239	S	C	.	.	S	Bend	trans	54.1	46.2	178.5	-64.6	-92.7	0	0	0	112.7	H76 N77 S124 H125	H76-Y100 WeakPolarHBondContact CA-O 3.42Å; H76-Y100 AromaticContact CD2-CG 3.99Å; H76-Y100 AromaticContact CE1-CD2 3.76Å; H76-Y100 AromaticContact CE1-CG 3.93Å; H76-Y100 PolarHBondContact N-O 2.71Å; H76-Y100 AromaticContact NE2-CD1 3.98Å; H76-Y100 AromaticContact NE2-CD2 3.87Å; H76-Y100 AromaticContact NE2-CG 3.66Å; N77-Y100 PolarHBondContact N-O 2.76Å; Y100-S124 PolarHBondContact N-O 3.43Å; Y100-S124 VanDerWaalsContact N-O 3.08Å; Y100-H125 VanDerWaalsContact CA-O 3.3Å; Y100-H125 WeakPolarHBondContact CA-O 3.44Å; Y100-H125 HydrophobicContact CD1-CB 3.87Å; Y100-H125 HydrophobicContact CD2-CB 4.17Å; Y100-H125 HydrophobicContact CE1-CB 4Å; Y100-H125 AromaticContact CE1-CD2 3.88Å; Y100-H125 AromaticContact CE1-CG 3.72Å; Y100-H125 HydrophobicContact CE2-CB 4.26Å; Y100-H125 AromaticContact CE2-CD2 3.31Å; Y100-H125 WeakPolarHBondContact CE2-CD2 3.25Å; Y100-H125 AromaticContact CE2-CG 3.9Å; Y100-H125 AromaticContact CE2-NE2 3.93Å; Y100-H125 HydrophobicContact CG-CB 3.96Å; Y100-H125 AromaticContact CZ-CD2 3.24Å; Y100-H125 AromaticContact CZ-CG 3.59Å; Y100-H125 AromaticContact CZ-NE2 3.52Å; Y100-H125 PolarHBondContact N-O 3.05Å; Y100-H125 PolarHBondContact OH-CD2 3.39Å; Y100-H125 PolarHBondContact OH-NE2 3.05Å
101	N	98.4	Very high	95.4	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.07	24%	0.239	C	C	.	.	S	Bend	trans	-114.8	-167.5	172.3	-87.7	-81.4	0	0	0	110	L74 N77 Q78 I79 L98 S99 V103 H125 N126	L74-N101 PolarHBondContact O-ND2 3.37Å; N77-N101 VanDerWaalsContact CA-OD1 3.26Å; N77-N101 WeakPolarHBondContact CA-OD1 3.47Å; N77-N101 WeakPolarHBondContact CB-OD1 3.37Å; N77-N101 PolarHBondContact N-OD1 3.05Å; N77-N101 PolarHBondContact O-OD1 3.47Å; Q78-N101 PolarHBondContact N-OD1 3.42Å; I79-N101 HydrophobicContact CB-CB 4.4Å; I79-N101 WeakPolarHBondContact CB-OD1 3.22Å; I79-N101 WeakPolarHBondContact CG1-OD1 3.31Å; I79-N101 PolarHBondContact N-OD1 3.17Å; L98-N101 WeakPolarHBondContact O-CB 3.41Å; L98-N101 PolarHBondContact O-ND2 3.12Å; S99-N101 VanDerWaalsContact C-N 3.3Å; S99-N101 PolarHBondContact O-N 3.01Å; S99-N101 PolarHBondContact O-ND2 3.01Å; N101-V103 HydrophobicContact CB-CG2 4.04Å; N101-H125 PolarHBondContact N-O 3.34Å; N101-N126 VanDerWaalsContact CA-OD1 3.27Å; N101-N126 WeakPolarHBondContact CA-OD1 3.42Å; N101-N126 WeakPolarHBondContact CB-OD1 3.49Å; N101-N126 PolarHBondContact N-OD1 3.06Å; N101-N126 PolarHBondContact O-OD1 3.18Å
102	A	97.6	Very high	95.4	Very high	28 Å²	28	41.8 Å²	41.8	23%	0.231	22%	0.218	C	C	.	.			trans	-116.3	32.1	176.1	0	0	0	0	0	111	I79 G80 E104 N126	I79-A102 CarbonylContact O-C 3.53Å; I79-A102 WeakPolarHBondContact O-CA 3.49Å; I79-A102 PolarHBondContact O-N 3.5Å; I79-A102 VanDerWaalsContact O-N 3.09Å; G80-A102 WeakPolarHBondContact CA-O 3.26Å; A102-E104 PolarHBondContact O-N 3.28Å; A102-E104 VanDerWaalsContact O-N 3.16Å; A102-N126 PolarHBondContact N-OD1 3.48Å
103	V	98.1	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.			trans	-66.8	118.8	-173.3	-179.7	0	0	0	0	109	I79 G80 V82 N101 L106 N126 R127 I128	I79-V103 HydrophobicContact CB-CG2 4.47Å; I79-V103 HydrophobicContact CG2-CG2 4.27Å; I79-V103 WeakPolarHBondContact O-CA 3.5Å; I79-V103 WeakPolarHBondContact O-CG2 3.42Å; I79-V103 PolarHBondContact O-N 3.07Å; G80-V103 WeakPolarHBondContact O-CA 3.17Å; V82-V103 HydrophobicContact CG2-CG1 4.1Å; V82-V103 HydrophobicContact CG2-CG2 4.35Å; N101-V103 HydrophobicContact CB-CG2 4.04Å; V103-L106 HydrophobicContact CG1-CD2 3.72Å; V103-L106 HydrophobicContact CG1-CG 4.42Å; V103-N126 HydrophobicContact CB-CB 4.23Å; V103-N126 WeakPolarHBondContact CB-OD1 3.42Å; V103-N126 WeakPolarHBondContact CG2-OD1 3.47Å; V103-N126 PolarHBondContact N-OD1 2.98Å; V103-R127 CarbonylContact O-C 3.59Å; V103-R127 VanDerWaalsContact O-CA 3.31Å; V103-R127 WeakPolarHBondContact O-CA 3.36Å; V103-R127 PolarHBondContact O-N 2.92Å; V103-I128 HydrophobicContact CB-CG1 4.35Å; V103-I128 HydrophobicContact CG1-CD1 4.35Å; V103-I128 HydrophobicContact CG1-CG1 4.13Å; V103-I128 VanDerWaalsContact O-CG1 3.26Å; V103-I128 WeakPolarHBondContact O-CG1 3.27Å; V103-I128 PolarHBondContact O-N 2.9Å
104	E	96.1	Very high	95.2	Very high	109 Å²	109	39.5 Å²	39.5	51%	0.509	22%	0.216	S	C	.	.			trans	-104.5	-34.3	177	-70.4	177.3	-173.9	0	0	111.2	G80 A102 R127	G80-E104 PolarHBondContact O-N 2.83Å; A102-E104 PolarHBondContact O-N 3.28Å; A102-E104 VanDerWaalsContact O-N 3.16Å; E104-R127 HydrophobicContact CG-CB 3.74Å
105	T	94.1	Very high	95	Very high	86 Å²	86	35.2 Å²	35.2	53%	0.528	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.7	-174.3	54.3	0	0	0	0	111.9	A81 V82	A81-T105 WeakPolarHBondContact CA-O 3.03Å; A81-T105 VanDerWaalsContact CB-OG1 3.3Å; A81-T105 WeakPolarHBondContact CB-OG1 3.34Å; V82-T105 PolarHBondContact N-O 2.9Å
106	L	95.3	Very high	94.7	Very high	22 Å²	22	36.3 Å²	36.3	12%	0.115	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.3	169.6	-62.1	-178.5	0	0	0	108	V82 V103 F111 L123 I128 V131 F136	V82-L106 HydrophobicContact CB-CD2 3.61Å; V82-L106 HydrophobicContact CG2-CD2 3.55Å; V103-L106 HydrophobicContact CG1-CD2 3.72Å; V103-L106 HydrophobicContact CG1-CG 4.42Å; L106-F111 HydrophobicContact CD1-CE2 4.47Å; L106-L123 HydrophobicContact CD1-CD1 3.98Å; L106-L123 HydrophobicContact CD2-CD2 4.5Å; L106-I128 HydrophobicContact CD1-CD1 4.07Å; L106-I128 HydrophobicContact CG-CD1 4.37Å; L106-V131 HydrophobicContact CD1-CG1 3.87Å; L106-F136 HydrophobicContact CD1-CZ 4.36Å
107	G	92.7	Very high	94.5	Very high	24 Å²	24	38.8 Å²	38.8	25%	0.247	24%	0.241	C	C	.	.			trans	-62.3	151	169.2	0	0	0	0	0	112	V82 D84 G109 S110	V82-G107 PolarHBondContact O-N 3.39Å; D84-G107 WeakPolarHBondContact OD1-CA 3.34Å; G107-G109 PolarHBondContact O-N 2.88Å; G107-S110 WeakPolarHBondContact CA-OG 3.01Å; G107-S110 PolarHBondContact N-OG 3Å; G107-S110 WeakPolarHBondContact O-CB 3.31Å; G107-S110 PolarHBondContact O-N 3.31Å; G107-S110 VanDerWaalsContact O-N 3.07Å; G107-S110 PolarHBondContact O-OG 3.28Å
108	E	90.4	Very high	94.4	Very high	132 Å²	132	38 Å²	38	62%	0.617	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.8	-179.1	-175.4	-179.9	179.9	0	0	112.4	D84 H132	D84-E108 PolarHBondContact OD1-N 2.75Å; E108-H132 IonicContact OE1-CE1 3.91Å; E108-H132 IonicContact OE1-ND1 3.51Å
109	G	90.6	Very high	94.1	Very high	22 Å²	22	43.4 Å²	43.4	23%	0.227	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	22.1	179.2	0	0	0	0	0	114	D84 Q85 G107 F111 S112	D84-G109 WeakPolarHBondContact OD1-CA 3.3Å; D84-G109 PolarHBondContact OD1-N 3.22Å; Q85-G109 PolarHBondContact N-O 2.83Å; G107-G109 PolarHBondContact O-N 2.88Å; G109-F111 PolarHBondContact O-N 3.02Å; G109-F111 VanDerWaalsContact O-N 3.15Å; G109-S112 WeakPolarHBondContact O-CB 3.19Å; G109-S112 PolarHBondContact O-N 3.35Å
110	S	93.8	Very high	93.9	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-41.6	-176.6	-68.2	0	0	0	0	113.6	V82 G107	V82-S110 PolarHBondContact O-OG 2.81Å; V82-S110 VanDerWaalsContact O-OG 3.05Å; G107-S110 WeakPolarHBondContact CA-OG 3.01Å; G107-S110 PolarHBondContact N-OG 3Å; G107-S110 WeakPolarHBondContact O-CB 3.31Å; G107-S110 PolarHBondContact O-N 3.31Å; G107-S110 VanDerWaalsContact O-N 3.07Å; G107-S110 PolarHBondContact O-OG 3.28Å
111	F	93.4	Very high	93.8	Very high	9 Å²	9	39.2 Å²	39.2	4%	0.039	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	17.2	-177.5	-50.3	-66.6	0	0	0	112.9	F87 L96 L106 G109 G113 I114 E115 L121 L123 F136 L139	F87-F111 HydrophobicContact CD2-CD1 4.16Å; F87-F111 HydrophobicContact CE2-CD1 4.17Å; F87-F111 HydrophobicContact CE2-CE1 4.09Å; L96-F111 HydrophobicContact CD2-CD1 4.29Å; L96-F111 HydrophobicContact CD2-CE1 4.03Å; L106-F111 HydrophobicContact CD1-CE2 4.47Å; G109-F111 PolarHBondContact O-N 3.02Å; G109-F111 VanDerWaalsContact O-N 3.15Å; F111-G113 PolarHBondContact O-N 2.87Å; F111-I114 HydrophobicContact CB-CD1 4.3Å; F111-I114 HydrophobicContact CB-CG1 4.17Å; F111-I114 HydrophobicContact CD1-CD1 4.23Å; F111-I114 WeakPolarHBondContact O-CG1 3.22Å; F111-I114 PolarHBondContact O-N 3.44Å; F111-E115 WeakPolarHBondContact O-CG 3.26Å; F111-L121 HydrophobicContact CD1-CD2 4.34Å; F111-L121 HydrophobicContact CD2-CD2 4.37Å; F111-L121 HydrophobicContact CE1-CD1 3.77Å; F111-L121 HydrophobicContact CE1-CD2 3.85Å; F111-L121 HydrophobicContact CE1-CG 4.5Å; F111-L121 HydrophobicContact CE2-CD2 3.89Å; F111-L121 HydrophobicContact CZ-CD1 4.13Å; F111-L121 HydrophobicContact CZ-CD2 3.61Å; F111-L123 HydrophobicContact CZ-CD1 4.1Å; F111-F136 HydrophobicContact CE2-CE1 4.16Å; F111-L139 HydrophobicContact CB-CD1 4.32Å; F111-L139 HydrophobicContact CB-CD2 3.89Å; F111-L139 HydrophobicContact CD2-CD1 3.89Å; F111-L139 HydrophobicContact CG-CD1 4.14Å
112	S	92.3	Very high	93.6	Very high	40 Å²	40	39.9 Å²	39.9	28%	0.28	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	128.9	-179.7	-168.5	0	0	0	0	112.1	G109 E115	G109-S112 WeakPolarHBondContact O-CB 3.19Å; G109-S112 PolarHBondContact O-N 3.35Å; S112-E115 WeakPolarHBondContact CA-OE1 3.44Å
113	G	90.4	Very high	93.5	Very high	38 Å²	38	38.5 Å²	38.5	39%	0.392	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	-6	-178.5	0	0	0	0	0	114.8	F111 E115	F111-G113 PolarHBondContact O-N 2.87Å; G113-E115 WeakPolarHBondContact CA-OE2 3.42Å; G113-E115 PolarHBondContact N-OE2 2.93Å
114	I	94.4	Very high	93.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	2.6	176.4	62.2	167.1	0	0	0	112.8	F87 L90 L93 L96 F111 G116 T117 L118	F87-I114 HydrophobicContact CB-CD1 3.84Å; F87-I114 HydrophobicContact CB-CG1 4.43Å; F87-I114 HydrophobicContact CB-CG2 4.07Å; F87-I114 HydrophobicContact CD2-CD1 4.07Å; F87-I114 HydrophobicContact CG-CD1 4.14Å; L90-I114 HydrophobicContact CB-CG2 4.29Å; L90-I114 WeakPolarHBondContact O-CG2 3.49Å; L93-I114 HydrophobicContact CB-CG2 4.33Å; L93-I114 HydrophobicContact CD2-CD1 3.86Å; L93-I114 HydrophobicContact CD2-CG2 4.38Å; L96-I114 HydrophobicContact CD2-CD1 4.49Å; F111-I114 HydrophobicContact CB-CD1 4.3Å; F111-I114 HydrophobicContact CB-CG1 4.17Å; F111-I114 HydrophobicContact CD1-CD1 4.23Å; F111-I114 WeakPolarHBondContact O-CG1 3.22Å; F111-I114 PolarHBondContact O-N 3.44Å; I114-G116 PolarHBondContact O-N 3.37Å; I114-G116 VanDerWaalsContact O-N 3.16Å; I114-T117 PolarHBondContact O-N 3.2Å; I114-T117 VanDerWaalsContact O-N 3.16Å; I114-T117 PolarHBondContact O-OG1 3.3Å; I114-L118 HydrophobicContact CD1-CD1 4.32Å; I114-L118 HydrophobicContact CD1-CD2 4.08Å; I114-L118 VanDerWaalsContact O-CB 3.32Å; I114-L118 WeakPolarHBondContact O-CB 3.28Å; I114-L118 PolarHBondContact O-N 3.25Å
115	E	91.4	Very high	93.4	Very high	26 Å²	26	36.8 Å²	36.8	12%	0.121	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.7	-170.6	-50.9	94.9	139	0	0	113.4	F111 S112 G113 R138 L139	F111-E115 WeakPolarHBondContact O-CG 3.26Å; S112-E115 WeakPolarHBondContact CA-OE1 3.44Å; G113-E115 WeakPolarHBondContact CA-OE2 3.42Å; G113-E115 PolarHBondContact N-OE2 2.93Å; E115-R138 HydrophobicContact CB-CB 4.38Å; E115-R138 HydrophobicContact CG-CB 4.14Å; E115-R138 IonicContact OE1-CZ 3.33Å; E115-R138 IonicContact OE1-NH1 2.73Å; E115-R138 PolarHBondContact OE1-NH1 3.12Å; E115-R138 IonicContact OE1-NH2 3.54Å; E115-L139 HydrophobicContact CB-CD2 3.93Å; E115-L139 HydrophobicContact CG-CD2 3.97Å
116	G	90.4	Very high	93.6	Very high	75 Å²	75	33.2 Å²	33.2	77%	0.773	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-16.3	-178.6	0	0	0	0	0	115	I114	I114-G116 PolarHBondContact O-N 3.37Å; I114-G116 VanDerWaalsContact O-N 3.16Å
117	T	93.8	Very high	93.7	Very high	51 Å²	51	39.3 Å²	39.3	31%	0.313	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-24.9	-174.7	60.7	0	0	0	0	113.3	R91 L93 I114 Q119	R91-T117 WeakPolarHBondContact O-CG2 3.43Å; L93-T117 CarbonylContact O-C 3.48Å; L93-T117 WeakPolarHBondContact O-CB 3.32Å; L93-T117 PolarHBondContact O-OG1 3.24Å; I114-T117 PolarHBondContact O-N 3.2Å; I114-T117 VanDerWaalsContact O-N 3.16Å; I114-T117 PolarHBondContact O-OG1 3.3Å; T117-Q119 PolarHBondContact O-N 3.48Å
118	L	94.4	Very high	93.8	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	22%	0.22	C	C	.	.			trans	-64.6	130.1	179.6	-162.8	68.4	0	0	0	110.4	L93 L96 I114 L121 L139 A141	L93-L118 HydrophobicContact CD2-CD1 4.25Å; L93-L118 HydrophobicContact CG-CD1 4.18Å; L93-L118 PolarHBondContact O-N 2.88Å; L96-L118 HydrophobicContact CB-CD1 3.9Å; I114-L118 HydrophobicContact CD1-CD1 4.32Å; I114-L118 HydrophobicContact CD1-CD2 4.08Å; I114-L118 VanDerWaalsContact O-CB 3.32Å; I114-L118 WeakPolarHBondContact O-CB 3.28Å; I114-L118 PolarHBondContact O-N 3.25Å; L118-L121 HydrophobicContact CD2-CB 3.95Å; L118-L139 HydrophobicContact CD2-CD2 4.43Å; L118-A141 HydrophobicContact CB-CB 4.25Å; L118-A141 HydrophobicContact CD2-CB 4.24Å; L118-A141 HydrophobicContact CG-CB 4.03Å; L118-A141 WeakPolarHBondContact O-CB 3.41Å
119	Q	93.4	Very high	94	Very high	112 Å²	112	35 Å²	35	52%	0.523	21%	0.21	S	C	.	.			trans	-111.1	-34.2	-179.7	-61.1	-178.5	-15.2	0	0	111.3	R94 T117 A141 R142	R94-Q119 HydrophobicContact CB-CG 4.21Å; R94-Q119 HydrophobicContact CG-CG 4.37Å; R94-Q119 WeakPolarHBondContact O-CA 3.35Å; R94-Q119 WeakPolarHBondContact O-CB 3.39Å; R94-Q119 PolarHBondContact O-N 2.99Å; T117-Q119 PolarHBondContact O-N 3.48Å; Q119-A141 CarbonylContact O-C 3.02Å; Q119-A141 WeakPolarHBondContact O-CA 3.49Å; Q119-R142 PolarHBondContact O-N 3.1Å
120	V	93.3	Very high	94	Very high	29 Å²	29	36.8 Å²	36.8	18%	0.176	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.8	178.8	-178.8	0	0	0	0	109.6	R94 E95 L96 R142	R94-V120 PolarHBondContact O-N 2.04Å; E95-V120 WeakPolarHBondContact CA-O 3.49Å; E95-V120 HydrophobicContact CG-CB 4.23Å; E95-V120 HydrophobicContact CG-CG1 4.48Å; L96-V120 PolarHBondContact N-O 2.88Å; V120-R142 CarbonylContact C-O 3.55Å; V120-R142 WeakPolarHBondContact CA-O 3.41Å
121	L	94.6	Very high	94	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120	171.2	174.6	58.8	0	0	0	108.4	L96 F111 L118 L123 F136 L139 R142 I143 I144	L96-L121 HydrophobicContact CB-CD1 4.14Å; L96-L121 HydrophobicContact CD2-CD1 3.8Å; L96-L121 HydrophobicContact CG-CD1 3.94Å; L96-L121 WeakPolarHBondContact O-CA 3.4Å; F111-L121 HydrophobicContact CD1-CD2 4.34Å; F111-L121 HydrophobicContact CD2-CD2 4.37Å; F111-L121 HydrophobicContact CE1-CD1 3.77Å; F111-L121 HydrophobicContact CE1-CD2 3.85Å; F111-L121 HydrophobicContact CE1-CG 4.5Å; F111-L121 HydrophobicContact CE2-CD2 3.89Å; F111-L121 HydrophobicContact CZ-CD1 4.13Å; F111-L121 HydrophobicContact CZ-CD2 3.61Å; L118-L121 HydrophobicContact CD2-CB 3.95Å; L121-L123 HydrophobicContact CD1-CD1 4.39Å; L121-L123 HydrophobicContact CD1-CG 4.08Å; L121-L123 HydrophobicContact CD2-CD1 3.91Å; L121-L123 HydrophobicContact CD2-CG 4.45Å; L121-L123 HydrophobicContact CG-CD1 4.11Å; L121-L123 HydrophobicContact CG-CG 4.12Å; L121-F136 HydrophobicContact CD2-CE1 4.38Å; L121-L139 HydrophobicContact CD2-CD1 3.87Å; L121-R142 PolarHBondContact N-O 3.48Å; L121-I143 HydrophobicContact CB-CG1 4.33Å; L121-I143 HydrophobicContact CD2-CG1 4.41Å; L121-I143 HydrophobicContact CD2-CG2 4.34Å; L121-I143 CarbonylContact O-C 3.07Å; L121-I143 WeakPolarHBondContact O-CA 3.37Å; L121-I144 PolarHBondContact O-N 3.2Å
122	D	95.6	Very high	93.9	Very high	26 Å²	26	39.4 Å²	39.4	14%	0.139	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114	175.1	-165.9	-14.4	0	0	0	110.5	L96 L98 S99 S124 I144	L96-D122 PolarHBondContact O-N 3.36Å; L98-D122 CarbonylContact C-O 3.58Å; L98-D122 WeakPolarHBondContact CA-O 3.47Å; L98-D122 WeakPolarHBondContact CB-O 3.42Å; L98-D122 PolarHBondContact N-O 2.79Å; S99-D122 PolarHBondContact N-O 3.09Å; D122-S124 VanDerWaalsContact OD1-CB 3.24Å; D122-S124 WeakPolarHBondContact OD1-CB 3.49Å; D122-S124 PolarHBondContact OD1-N 3.37Å; D122-S124 PolarHBondContact OD1-OG 3.22Å; D122-I144 HydrophobicContact CB-CB 4.46Å; D122-I144 HydrophobicContact CB-CD1 4.21Å
123	L	95.7	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.			trans	-117.4	14.7	175.8	-70.3	166	0	0	0	111.1	L98 L106 F111 L121 N126 I128 F136 I144 V145 N148	L98-L123 HydrophobicContact CB-CD2 3.94Å; L98-L123 HydrophobicContact CD1-CD2 3.86Å; L106-L123 HydrophobicContact CD1-CD1 3.98Å; L106-L123 HydrophobicContact CD2-CD2 4.5Å; F111-L123 HydrophobicContact CZ-CD1 4.1Å; L121-L123 HydrophobicContact CD1-CD1 4.39Å; L121-L123 HydrophobicContact CD1-CG 4.08Å; L121-L123 HydrophobicContact CD2-CD1 3.91Å; L121-L123 HydrophobicContact CD2-CG 4.45Å; L121-L123 HydrophobicContact CG-CD1 4.11Å; L121-L123 HydrophobicContact CG-CG 4.12Å; L123-N126 PolarHBondContact O-ND2 2.95Å; L123-I128 HydrophobicContact CB-CD1 4.21Å; L123-I128 HydrophobicContact CD1-CD1 4.44Å; L123-I128 HydrophobicContact CD2-CD1 4.43Å; L123-F136 HydrophobicContact CD1-CE1 4.1Å; L123-F136 HydrophobicContact CD1-CZ 4.28Å; L123-I144 WeakPolarHBondContact CA-O 3.37Å; L123-I144 PolarHBondContact N-O 3.31Å; L123-V145 HydrophobicContact CB-CG1 4.19Å; L123-V145 HydrophobicContact CD1-CG1 4.27Å; L123-N148 PolarHBondContact O-ND2 2.85Å
124	S	95.4	Very high	93.7	Very high	10 Å²	10	45.3 Å²	45.3	7%	0.07	24%	0.242	C	C	.	.			trans	-63.4	156.6	-177.7	61.4	0	0	0	0	113	S99 Y100 D122 N126 I144 D146	S99-S124 CarbonylContact C-O 3.15Å; S99-S124 WeakPolarHBondContact CA-O 3.17Å; S99-S124 WeakPolarHBondContact CB-O 3.3Å; S99-S124 WeakPolarHBondContact CB-OG 3.27Å; Y100-S124 PolarHBondContact N-O 3.43Å; Y100-S124 VanDerWaalsContact N-O 3.08Å; D122-S124 VanDerWaalsContact OD1-CB 3.24Å; D122-S124 WeakPolarHBondContact OD1-CB 3.49Å; D122-S124 PolarHBondContact OD1-N 3.37Å; D122-S124 PolarHBondContact OD1-OG 3.22Å; S124-N126 PolarHBondContact O-N 3.46Å; S124-N126 PolarHBondContact O-ND2 3.36Å; S124-I144 PolarHBondContact N-O 3.28Å; S124-D146 CarbonylContact C-O 3.57Å; S124-D146 WeakPolarHBondContact CA-O 3.38Å
125	H	96.4	Very high	93.4	Very high	63 Å²	63	45.9 Å²	45.9	29%	0.292	25%	0.247	S	C	.	.	S	Bend	trans	53.9	50.8	178.9	-57.2	-79.3	0	0	0	113	Y100 N101 D146 D147	Y100-H125 VanDerWaalsContact CA-O 3.3Å; Y100-H125 WeakPolarHBondContact CA-O 3.44Å; Y100-H125 HydrophobicContact CD1-CB 3.87Å; Y100-H125 HydrophobicContact CD2-CB 4.17Å; Y100-H125 HydrophobicContact CE1-CB 4Å; Y100-H125 AromaticContact CE1-CD2 3.88Å; Y100-H125 AromaticContact CE1-CG 3.72Å; Y100-H125 HydrophobicContact CE2-CB 4.26Å; Y100-H125 AromaticContact CE2-CD2 3.31Å; Y100-H125 WeakPolarHBondContact CE2-CD2 3.25Å; Y100-H125 AromaticContact CE2-CG 3.9Å; Y100-H125 AromaticContact CE2-NE2 3.93Å; Y100-H125 HydrophobicContact CG-CB 3.96Å; Y100-H125 AromaticContact CZ-CD2 3.24Å; Y100-H125 AromaticContact CZ-CG 3.59Å; Y100-H125 AromaticContact CZ-NE2 3.52Å; Y100-H125 PolarHBondContact N-O 3.05Å; Y100-H125 PolarHBondContact OH-CD2 3.39Å; Y100-H125 PolarHBondContact OH-NE2 3.05Å; N101-H125 PolarHBondContact N-O 3.34Å; H125-D146 PolarHBondContact N-O 2.87Å; H125-D147 WeakPolarHBondContact CA-O 3.26Å; H125-D147 VanDerWaalsContact CE1-CG 3.46Å; H125-D147 IonicContact CE1-OD2 3.17Å; H125-D147 PolarHBondContact CE1-OD2 3.43Å; H125-D147 PolarHBondContact N-O 3.23Å; H125-D147 WeakPolarHBondContact ND1-CB 3.11Å; H125-D147 IonicContact ND1-OD2 3.41Å; H125-D147 IonicContact NE2-OD2 3.51Å
126	N	97.7	Very high	93.3	Very high	10 Å²	10	44.7 Å²	44.7	5%	0.053	24%	0.241	C	C	.	.	S	Bend	trans	-119.4	-164.8	174.8	-87.2	-75.5	0	0	0	110.2	L98 N101 A102 V103 L123 S124 I128 N148	L98-N126 PolarHBondContact O-ND2 2.91Å; N101-N126 VanDerWaalsContact CA-OD1 3.27Å; N101-N126 WeakPolarHBondContact CA-OD1 3.42Å; N101-N126 WeakPolarHBondContact CB-OD1 3.49Å; N101-N126 PolarHBondContact N-OD1 3.06Å; N101-N126 PolarHBondContact O-OD1 3.18Å; A102-N126 PolarHBondContact N-OD1 3.48Å; V103-N126 HydrophobicContact CB-CB 4.23Å; V103-N126 WeakPolarHBondContact CB-OD1 3.42Å; V103-N126 WeakPolarHBondContact CG2-OD1 3.47Å; V103-N126 PolarHBondContact N-OD1 2.98Å; L123-N126 PolarHBondContact O-ND2 2.95Å; S124-N126 PolarHBondContact O-N 3.46Å; S124-N126 PolarHBondContact O-ND2 3.36Å; N126-I128 HydrophobicContact CB-CD1 4.3Å; N126-I128 HydrophobicContact CB-CG1 4.15Å; N126-N148 WeakPolarHBondContact CA-OD1 3.37Å; N126-N148 WeakPolarHBondContact CB-OD1 3.03Å; N126-N148 PolarHBondContact N-OD1 3.31Å; N126-N148 PolarHBondContact O-OD1 2.62Å
127	R	96.9	Very high	93.1	Very high	150 Å²	150	43.5 Å²	43.5	57%	0.566	22%	0.224	S	C	*	.			trans	-119.8	26.6	-178.1	-62.3	-176.8	-179.1	-138.8	-2.6	111.9	V103 E104 T129 N148	V103-R127 CarbonylContact O-C 3.59Å; V103-R127 VanDerWaalsContact O-CA 3.31Å; V103-R127 WeakPolarHBondContact O-CA 3.36Å; V103-R127 PolarHBondContact O-N 2.92Å; E104-R127 HydrophobicContact CG-CB 3.74Å; R127-T129 PolarHBondContact O-N 3.39Å; R127-N148 PolarHBondContact N-OD1 2.96Å
128	I	95.8	Very high	92.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.			trans	-72.7	122.9	-175.8	-53.3	168.4	0	0	0	108.4	V103 L106 L123 N126 V131 N148 P149 W150	V103-I128 HydrophobicContact CB-CG1 4.35Å; V103-I128 HydrophobicContact CG1-CD1 4.35Å; V103-I128 HydrophobicContact CG1-CG1 4.13Å; V103-I128 VanDerWaalsContact O-CG1 3.26Å; V103-I128 WeakPolarHBondContact O-CG1 3.27Å; V103-I128 PolarHBondContact O-N 2.9Å; L106-I128 HydrophobicContact CD1-CD1 4.07Å; L106-I128 HydrophobicContact CG-CD1 4.37Å; L123-I128 HydrophobicContact CB-CD1 4.21Å; L123-I128 HydrophobicContact CD1-CD1 4.44Å; L123-I128 HydrophobicContact CD2-CD1 4.43Å; N126-I128 HydrophobicContact CB-CD1 4.3Å; N126-I128 HydrophobicContact CB-CG1 4.15Å; I128-V131 HydrophobicContact CG2-CG1 3.81Å; I128-N148 HydrophobicContact CB-CB 4.4Å; I128-N148 WeakPolarHBondContact CB-OD1 3.47Å; I128-N148 WeakPolarHBondContact CG1-OD1 3.45Å; I128-N148 PolarHBondContact N-OD1 3.44Å; I128-P149 CarbonylContact O-C 3.16Å; I128-P149 WeakPolarHBondContact O-CD 3.32Å; I128-W150 HydrophobicContact CB-CH2 3.89Å; I128-W150 HydrophobicContact CB-CZ2 4.28Å; I128-W150 HydrophobicContact CB-CZ3 4.24Å; I128-W150 HydrophobicContact CD1-CH2 4.43Å; I128-W150 HydrophobicContact CG2-CE3 4.41Å; I128-W150 HydrophobicContact CG2-CH2 3.45Å; I128-W150 VanDerWaalsContact CG2-CH2 3.45Å; I128-W150 HydrophobicContact CG2-CZ2 4.32Å; I128-W150 HydrophobicContact CG2-CZ3 3.52Å
129	T	93.5	Very high	92.4	Very high	67 Å²	67	49.5 Å²	49.5	41%	0.411	24%	0.242	S	C	.	.			trans	-97.7	-44.9	177.4	52.8	0	0	0	0	111.1	R127 P149 H151	R127-T129 PolarHBondContact O-N 3.39Å; T129-P149 WeakPolarHBondContact CA-O 3.42Å; T129-P149 HydrophobicContact CG2-CG 4.08Å; T129-H151 WeakPolarHBondContact O-CB 3.42Å; T129-H151 PolarHBondContact O-N 3.31Å
130	S	91.6	Very high	92.2	Very high	59 Å²	59	51.9 Å²	51.9	41%	0.413	25%	0.25	S	S	.	.			trans	-141.8	159.3	179.1	62.4	0	0	0	0	111.3
131	V	92.9	Very high	92	Very high	10 Å²	10	50.7 Å²	50.7	6%	0.061	24%	0.244	C	C	.	.			trans	-135.1	156.4	176.7	-72	0	0	0	0	109.8	L106 I128 A135 F136 W150 L156 A159	L106-V131 HydrophobicContact CD1-CG1 3.87Å; I128-V131 HydrophobicContact CG2-CG1 3.81Å; V131-A135 HydrophobicContact CB-CB 4.15Å; V131-F136 HydrophobicContact CG1-CE2 4.36Å; V131-F136 HydrophobicContact CG1-CZ 4.24Å; V131-F136 HydrophobicContact CG2-CE2 4.04Å; V131-W150 HydrophobicContact CG1-CH2 3.98Å; V131-W150 HydrophobicContact CG1-CZ3 3.84Å; V131-W150 HydrophobicContact CG2-CZ3 4.13Å; V131-L156 HydrophobicContact CG2-CD1 3.98Å; V131-A159 HydrophobicContact CG2-CB 3.6Å
132	H	92.5	Very high	91.7	Very high	54 Å²	54	56 Å²	56	25%	0.25	26%	0.264	C	S	.	.			trans	-62.7	143.1	170.6	-167.2	-101.1	0	0	0	110.3	E108 D134 A135	E108-H132 IonicContact OE1-CE1 3.91Å; E108-H132 IonicContact OE1-ND1 3.51Å; H132-D134 IonicContact CE1-OD2 3.89Å; H132-D134 PolarHBondContact CE1-OD2 2.85Å; H132-D134 PolarHBondContact ND1-N 2.81Å; H132-D134 IonicContact ND1-OD2 3.99Å; H132-D134 PolarHBondContact O-N 2.81Å; H132-A135 HydrophobicContact CB-CB 4.37Å; H132-A135 WeakPolarHBondContact O-CB 3.39Å; H132-A135 PolarHBondContact O-N 2.78Å
133	R	89.4	Confident	91.5	Very high	122 Å²	122	54.9 Å²	54.9	46%	0.46	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-29.2	179.6	53	168.7	173.6	-88.5	-10.2	114.2	Q158 A159	R133-Q158 HydrophobicContact CB-CB 3.77Å; R133-A159 VanDerWaalsContact O-CA 3.26Å; R133-A159 WeakPolarHBondContact O-CA 3.05Å; R133-A159 PolarHBondContact O-N 2.81Å
134	D	88.9	Confident	91.3	Very high	80 Å²	80	56 Å²	56	43%	0.428	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	3.3	-176.9	-59.2	-52.2	0	0	0	113.2	H132 F136 A137	H132-D134 IonicContact CE1-OD2 3.89Å; H132-D134 PolarHBondContact CE1-OD2 2.85Å; H132-D134 PolarHBondContact ND1-N 2.81Å; H132-D134 IonicContact ND1-OD2 3.99Å; H132-D134 PolarHBondContact O-N 2.81Å; D134-F136 PolarHBondContact O-N 3.38Å; D134-F136 VanDerWaalsContact O-N 3.08Å; D134-A137 HydrophobicContact CB-CB 4.4Å; D134-A137 PolarHBondContact O-N 3.31Å
135	A	88.6	Confident	91.1	Very high	13 Å²	13	55.6 Å²	55.6	11%	0.107	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.2	-173.4	0	0	0	0	0	113.1	V131 H132	V131-A135 HydrophobicContact CB-CB 4.15Å; H132-A135 HydrophobicContact CB-CB 4.37Å; H132-A135 WeakPolarHBondContact O-CB 3.39Å; H132-A135 PolarHBondContact O-N 2.78Å
136	F	88.9	Confident	90.8	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-9.4	-179.3	-54.9	-48.1	0	0	0	113.7	L106 F111 L121 L123 V131 D134 R138 L139 I143 V145 A159 M163	L106-F136 HydrophobicContact CD1-CZ 4.36Å; F111-F136 HydrophobicContact CE2-CE1 4.16Å; L121-F136 HydrophobicContact CD2-CE1 4.38Å; L123-F136 HydrophobicContact CD1-CE1 4.1Å; L123-F136 HydrophobicContact CD1-CZ 4.28Å; V131-F136 HydrophobicContact CG1-CE2 4.36Å; V131-F136 HydrophobicContact CG1-CZ 4.24Å; V131-F136 HydrophobicContact CG2-CE2 4.04Å; D134-F136 PolarHBondContact O-N 3.38Å; D134-F136 VanDerWaalsContact O-N 3.08Å; F136-R138 PolarHBondContact O-N 3.35Å; F136-R138 VanDerWaalsContact O-N 3.12Å; F136-L139 HydrophobicContact CD1-CD1 4.09Å; F136-L139 PolarHBondContact O-N 2.97Å; F136-I143 HydrophobicContact CB-CD1 3.75Å; F136-I143 HydrophobicContact CD1-CD1 4Å; F136-I143 HydrophobicContact CD1-CG2 4.32Å; F136-I143 HydrophobicContact CE1-CG2 4.27Å; F136-I143 HydrophobicContact CG-CD1 4Å; F136-V145 HydrophobicContact CE2-CG1 4.44Å; F136-V145 HydrophobicContact CZ-CG1 4.08Å; F136-A159 HydrophobicContact CD2-CB 4.14Å; F136-M163 HydrophobicContact CB-CG 3.95Å; F136-M163 HydrophobicContact CD2-CG 4.21Å; F136-M163 HydrophobicContact CD2-SD 4Å; F136-M163 HydrophobicContact CE2-SD 4.49Å; F136-M163 HydrophobicContact CG-CG 4.3Å; F136-M163 HydrophobicContact CG-SD 4.34Å
137	A	85.3	Confident	90.5	Very high	50 Å²	50	57.5 Å²	57.5	41%	0.413	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-29.4	-170.1	0	0	0	0	0	113.8	D134	D134-A137 HydrophobicContact CB-CB 4.4Å; D134-A137 PolarHBondContact O-N 3.31Å
138	R	87.1	Confident	90.4	Very high	170 Å²	170	50.9 Å²	50.9	64%	0.642	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.7	-179.6	-62.1	-176	67.4	-139.4	-9	113.4	E115 F136	E115-R138 HydrophobicContact CB-CB 4.38Å; E115-R138 HydrophobicContact CG-CB 4.14Å; E115-R138 IonicContact OE1-CZ 3.33Å; E115-R138 IonicContact OE1-NH1 2.73Å; E115-R138 PolarHBondContact OE1-NH1 3.12Å; E115-R138 IonicContact OE1-NH2 3.54Å; F136-R138 PolarHBondContact O-N 3.35Å; F136-R138 VanDerWaalsContact O-N 3.12Å
139	L	88	Confident	90.3	Very high	13 Å²	13	53 Å²	53	7%	0.068	26%	0.263	C	S	.	.			trans	-83.8	131.6	-178	-61.3	-178.3	0	0	0	110.2	F111 E115 L118 L121 F136 I143	F111-L139 HydrophobicContact CB-CD1 4.32Å; F111-L139 HydrophobicContact CB-CD2 3.89Å; F111-L139 HydrophobicContact CD2-CD1 3.89Å; F111-L139 HydrophobicContact CG-CD1 4.14Å; E115-L139 HydrophobicContact CB-CD2 3.93Å; E115-L139 HydrophobicContact CG-CD2 3.97Å; L118-L139 HydrophobicContact CD2-CD2 4.43Å; L121-L139 HydrophobicContact CD2-CD1 3.87Å; F136-L139 HydrophobicContact CD1-CD1 4.09Å; F136-L139 PolarHBondContact O-N 2.97Å; L139-I143 HydrophobicContact CB-CD1 4.1Å; L139-I143 HydrophobicContact CD1-CD1 4.13Å
140	K	87.4	Confident	90.2	Very high	162 Å²	162	49.9 Å²	49.9	70%	0.704	24%	0.244	S	C	*	.			trans	-97.4	6.4	171.1	-61.8	-177.7	-179.3	-179.7	0	112.8
141	A	88.9	Confident	90.1	Very high	5 Å²	5	49.6 Å²	49.6	4%	0.041	24%	0.236	C	C	.	.	S	Bend	trans	-75.4	160.6	-176.2	0	0	0	0	0	112	L118 Q119 I143	L118-A141 HydrophobicContact CB-CB 4.25Å; L118-A141 HydrophobicContact CD2-CB 4.24Å; L118-A141 HydrophobicContact CG-CB 4.03Å; L118-A141 WeakPolarHBondContact O-CB 3.41Å; Q119-A141 CarbonylContact O-C 3.02Å; Q119-A141 WeakPolarHBondContact O-CA 3.49Å; A141-I143 PolarHBondContact O-N 3.11Å
142	R	90.3	Very high	89.8	Confident	110 Å²	110	49.2 Å²	49.2	42%	0.415	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	111.7	160.1	-173.4	175.2	66.5	82.8	5.4	109.5	Q119 V120 L121 N166	Q119-R142 PolarHBondContact O-N 3.1Å; V120-R142 CarbonylContact C-O 3.55Å; V120-R142 WeakPolarHBondContact CA-O 3.41Å; L121-R142 PolarHBondContact N-O 3.48Å; R142-N166 WeakPolarHBondContact CA-ND2 3.3Å
143	I	90.8	Very high	89.5	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.5	-175.9	-59.6	160.8	0	0	0	108.1	L121 F136 L139 A141 V145 M163 A169	L121-I143 HydrophobicContact CB-CG1 4.33Å; L121-I143 HydrophobicContact CD2-CG1 4.41Å; L121-I143 HydrophobicContact CD2-CG2 4.34Å; L121-I143 CarbonylContact O-C 3.07Å; L121-I143 WeakPolarHBondContact O-CA 3.37Å; F136-I143 HydrophobicContact CB-CD1 3.75Å; F136-I143 HydrophobicContact CD1-CD1 4Å; F136-I143 HydrophobicContact CD1-CG2 4.32Å; F136-I143 HydrophobicContact CE1-CG2 4.27Å; F136-I143 HydrophobicContact CG-CD1 4Å; L139-I143 HydrophobicContact CB-CD1 4.1Å; L139-I143 HydrophobicContact CD1-CD1 4.13Å; A141-I143 PolarHBondContact O-N 3.11Å; I143-V145 HydrophobicContact CG2-CG1 3.75Å; I143-M163 HydrophobicContact CB-SD 3.74Å; I143-M163 HydrophobicContact CD1-CG 3.85Å; I143-M163 HydrophobicContact CD1-SD 3.99Å; I143-M163 HydrophobicContact CG2-SD 3.61Å; I143-A169 WeakPolarHBondContact O-CB 3.19Å
144	I	91.4	Very high	89.3	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.118	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.7	177	-46.4	174	0	0	0	106.9	L121 D122 L123 S124 D146	L121-I144 PolarHBondContact O-N 3.2Å; D122-I144 HydrophobicContact CB-CB 4.46Å; D122-I144 HydrophobicContact CB-CD1 4.21Å; L123-I144 WeakPolarHBondContact CA-O 3.37Å; L123-I144 PolarHBondContact N-O 3.31Å; S124-I144 PolarHBondContact N-O 3.28Å; I144-D146 HydrophobicContact CG2-CB 4.47Å; I144-D146 VanDerWaalsContact CG2-OD2 3.25Å; I144-D146 WeakPolarHBondContact CG2-OD2 3.35Å
145	V	91.3	Very high	89.3	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	21%	0.21	C	C	.	.			trans	-131.1	20.2	-172.8	-81.4	0	0	0	0	111.8	L123 F136 I143 N148 W150 M163 V173	L123-V145 HydrophobicContact CB-CG1 4.19Å; L123-V145 HydrophobicContact CD1-CG1 4.27Å; F136-V145 HydrophobicContact CE2-CG1 4.44Å; F136-V145 HydrophobicContact CZ-CG1 4.08Å; I143-V145 HydrophobicContact CG2-CG1 3.75Å; V145-N148 PolarHBondContact O-ND2 3.45Å; V145-W150 HydrophobicContact CB-CZ2 3.7Å; V145-W150 HydrophobicContact CG1-CH2 4.5Å; V145-W150 HydrophobicContact CG1-CZ2 4.06Å; V145-W150 PolarHBondContact O-NE1 3.34Å; V145-M163 HydrophobicContact CG2-CE 3.94Å; V145-M163 HydrophobicContact CG2-SD 4.29Å; V145-V173 HydrophobicContact CG2-CG2 3.83Å
146	D	89.4	Confident	89.3	Confident	18 Å²	18	41.1 Å²	41.1	10%	0.096	21%	0.206	C	C	.	.			trans	-63	157.9	-177.1	-54.8	-31.9	0	0	0	111.1	S124 H125 I144 N148 R172	S124-D146 CarbonylContact C-O 3.57Å; S124-D146 WeakPolarHBondContact CA-O 3.38Å; H125-D146 PolarHBondContact N-O 2.87Å; I144-D146 HydrophobicContact CG2-CB 4.47Å; I144-D146 VanDerWaalsContact CG2-OD2 3.25Å; I144-D146 WeakPolarHBondContact CG2-OD2 3.35Å; D146-N148 PolarHBondContact O-N 3.43Å; D146-N148 PolarHBondContact O-ND2 3.34Å; D146-R172 WeakPolarHBondContact OD1-CB 3.38Å; D146-R172 IonicContact OD2-NH1 3.74Å
147	D	92.2	Very high	89.1	Confident	95 Å²	95	43.4 Å²	43.4	51%	0.508	22%	0.216	S	C	.	.	S	Bend	trans	53.5	47.6	173.1	-65.9	-63	0	0	0	114.7	H125	H125-D147 WeakPolarHBondContact CA-O 3.26Å; H125-D147 VanDerWaalsContact CE1-CG 3.46Å; H125-D147 IonicContact CE1-OD2 3.17Å; H125-D147 PolarHBondContact CE1-OD2 3.43Å; H125-D147 PolarHBondContact N-O 3.23Å; H125-D147 WeakPolarHBondContact ND1-CB 3.11Å; H125-D147 IonicContact ND1-OD2 3.41Å; H125-D147 IonicContact NE2-OD2 3.51Å
148	N	94.3	Very high	89.1	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.064	22%	0.216	C	C	.	.			trans	-121.3	149.2	170.6	-83.8	-88.1	0	0	0	109.7	L123 N126 R127 I128 V145 D146 W150	L123-N148 PolarHBondContact O-ND2 2.85Å; N126-N148 WeakPolarHBondContact CA-OD1 3.37Å; N126-N148 WeakPolarHBondContact CB-OD1 3.03Å; N126-N148 PolarHBondContact N-OD1 3.31Å; N126-N148 PolarHBondContact O-OD1 2.62Å; R127-N148 PolarHBondContact N-OD1 2.96Å; I128-N148 HydrophobicContact CB-CB 4.4Å; I128-N148 WeakPolarHBondContact CB-OD1 3.47Å; I128-N148 WeakPolarHBondContact CG1-OD1 3.45Å; I128-N148 PolarHBondContact N-OD1 3.44Å; V145-N148 PolarHBondContact O-ND2 3.45Å; D146-N148 PolarHBondContact O-N 3.43Å; D146-N148 PolarHBondContact O-ND2 3.34Å; N148-W150 HydrophobicContact CB-CD2 4.22Å; N148-W150 HydrophobicContact CB-CG 4.35Å; N148-W150 HydrophobicContact CB-CZ2 3.83Å; N148-W150 VanDerWaalsContact CB-NE1 3.33Å; N148-W150 VanDerWaalsContact O-CD1 3.23Å; N148-W150 PolarHBondContact O-N 2.95Å
149	P	93.6	Very high	89.1	Confident	44 Å²	44	37 Å²	37	29%	0.286	19%	0.186	S	C	.	.			trans	-76.2	58.8	-179.6	34.2	-37.7	0	0	0	112.2	I128 T129 H151 R176	I128-P149 CarbonylContact O-C 3.16Å; I128-P149 WeakPolarHBondContact O-CD 3.32Å; T129-P149 WeakPolarHBondContact CA-O 3.42Å; T129-P149 HydrophobicContact CG2-CG 4.08Å; P149-H151 PolarHBondContact O-N 3.08Å; P149-R176 HydrophobicContact CB-CB 4.2Å; P149-R176 HydrophobicContact CB-CG 4.13Å
150	W	91.4	Very high	88.9	Confident	2 Å²	2	37 Å²	37	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	130.6	-173.8	-67.3	108.3	0	0	0	112.9	I128 V131 V145 N148 L156 V173 R176 S177	I128-W150 HydrophobicContact CB-CH2 3.89Å; I128-W150 HydrophobicContact CB-CZ2 4.28Å; I128-W150 HydrophobicContact CB-CZ3 4.24Å; I128-W150 HydrophobicContact CD1-CH2 4.43Å; I128-W150 HydrophobicContact CG2-CE3 4.41Å; I128-W150 HydrophobicContact CG2-CH2 3.45Å; I128-W150 VanDerWaalsContact CG2-CH2 3.45Å; I128-W150 HydrophobicContact CG2-CZ2 4.32Å; I128-W150 HydrophobicContact CG2-CZ3 3.52Å; V131-W150 HydrophobicContact CG1-CH2 3.98Å; V131-W150 HydrophobicContact CG1-CZ3 3.84Å; V131-W150 HydrophobicContact CG2-CZ3 4.13Å; V145-W150 HydrophobicContact CB-CZ2 3.7Å; V145-W150 HydrophobicContact CG1-CH2 4.5Å; V145-W150 HydrophobicContact CG1-CZ2 4.06Å; V145-W150 PolarHBondContact O-NE1 3.34Å; N148-W150 HydrophobicContact CB-CD2 4.22Å; N148-W150 HydrophobicContact CB-CG 4.35Å; N148-W150 HydrophobicContact CB-CZ2 3.83Å; N148-W150 VanDerWaalsContact CB-NE1 3.33Å; N148-W150 VanDerWaalsContact O-CD1 3.23Å; N148-W150 PolarHBondContact O-N 2.95Å; W150-L156 HydrophobicContact CB-CD2 3.96Å; W150-L156 HydrophobicContact CD2-CD1 4.22Å; W150-L156 HydrophobicContact CD2-CD2 4.36Å; W150-L156 HydrophobicContact CE3-CD1 3.51Å; W150-L156 HydrophobicContact CE3-CD2 4.09Å; W150-L156 HydrophobicContact CE3-CG 4.46Å; W150-L156 HydrophobicContact CG-CD2 4.35Å; W150-L156 HydrophobicContact CZ3-CD1 3.73Å; W150-V173 HydrophobicContact CB-CG1 4.32Å; W150-V173 HydrophobicContact CD2-CG1 4.43Å; W150-V173 HydrophobicContact CG-CG1 3.85Å; W150-R176 PolarHBondContact O-N 2.93Å; W150-S177 PolarHBondContact O-N 3.35Å
151	H	89.9	Confident	88.5	Confident	53 Å²	53	31.7 Å²	31.7	25%	0.245	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	109.4	165	-174.2	71.9	0	0	0	108.3	T129 P149 D153 S177	T129-H151 WeakPolarHBondContact O-CB 3.42Å; T129-H151 PolarHBondContact O-N 3.31Å; P149-H151 PolarHBondContact O-N 3.08Å; H151-D153 IonicContact CD2-OD2 3.7Å; H151-D153 PolarHBondContact O-N 2.94Å; H151-S177 CarbonylContact C-O 3.5Å; H151-S177 WeakPolarHBondContact CA-O 3.07Å; H151-S177 PolarHBondContact ND1-OG 3Å
152	C	87.1	Confident	87.7	Confident	2 Å²	2	33 Å²	33	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	102.4	-175.8	-69.6	0	0	0	0	111	L156 C175 S177 S178 F188	C152-L156 HydrophobicContact CB-CD2 4.45Å; C152-C175 HydrophobicContact CB-CB 3.83Å; C152-C175 WeakPolarHBondContact CB-SG 3.44Å; C152-C175 WeakPolarHBondContact SG-CA 3.43Å; C152-C175 WeakPolarHBondContact SG-CB 3.2Å; C152-C175 CovalentContact SG-SG 2.01Å; C152-C175 PolarHBondContact SG-SG 3.44Å; C152-S177 PolarHBondContact N-O 3.01Å; C152-S178 WeakPolarHBondContact O-CB 3.39Å; C152-S178 PolarHBondContact O-OG 2.89Å; C152-F188 HydrophobicContact CB-CD2 4.32Å; C152-F188 HydrophobicContact CB-CE2 4.34Å
153	D	85.7	Confident	86.9	Confident	30 Å²	30	28.3 Å²	28.3	16%	0.16	17%	0.173	C	C	.	.	S	Bend	trans	-130.1	-174	177	66.5	9.2	0	0	0	111	H151 A155 L156 Q157	H151-D153 IonicContact CD2-OD2 3.7Å; H151-D153 PolarHBondContact O-N 2.94Å; D153-A155 VanDerWaalsContact C-N 3.32Å; D153-A155 PolarHBondContact O-N 3.34Å; D153-A155 WeakPolarHBondContact OD1-CB 3.17Å; D153-A155 PolarHBondContact OD1-N 3.26Å; D153-L156 WeakPolarHBondContact OD1-CB 3.44Å; D153-L156 PolarHBondContact OD1-N 3.06Å; D153-Q157 PolarHBondContact O-N 3.16Å
154	C	85.6	Confident	85.2	Confident	34 Å²	34	31.1 Å²	31.1	23%	0.23	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-31.3	176.4	173.4	0	0	0	0	113.3	Q157 Q158 C196	C154-Q157 WeakPolarHBondContact O-CB 3.34Å; C154-Q157 PolarHBondContact O-N 3.28Å; C154-Q158 WeakPolarHBondContact O-CG 3.36Å; C154-Q158 PolarHBondContact O-N 2.92Å; C154-Q158 VanDerWaalsContact O-N 3.12Å; C154-Q158 PolarHBondContact SG-NE2 2.98Å; C154-Q158 VanDerWaalsContact SG-NE2 3.36Å; C154-C196 VanDerWaalsContact CA-SG 3.53Å; C154-C196 HydrophobicContact CB-CB 3.97Å; C154-C196 WeakPolarHBondContact CB-SG 3.41Å; C154-C196 WeakPolarHBondContact SG-CA 3.44Å; C154-C196 WeakPolarHBondContact SG-CB 3.38Å; C154-C196 CovalentContact SG-SG 2.04Å; C154-C196 PolarHBondContact SG-SG 3.09Å
155	A	88.3	Confident	83.6	Confident	32 Å²	32	37.4 Å²	37.4	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-67.9	-43.4	-179.2	0	0	0	0	0	110.9	D153 Q157 Q158 A159	D153-A155 VanDerWaalsContact C-N 3.32Å; D153-A155 PolarHBondContact O-N 3.34Å; D153-A155 WeakPolarHBondContact OD1-CB 3.17Å; D153-A155 PolarHBondContact OD1-N 3.26Å; A155-Q157 VanDerWaalsContact C-N 3.35Å; A155-Q158 PolarHBondContact O-N 3.37Å; A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 2.91Å
156	L	87.8	Confident	82	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-41.2	174.2	-174.5	63.1	0	0	0	111.4	V131 W150 C152 D153 Q158 A159 I160 V173 F188	V131-L156 HydrophobicContact CG2-CD1 3.98Å; W150-L156 HydrophobicContact CB-CD2 3.96Å; W150-L156 HydrophobicContact CD2-CD1 4.22Å; W150-L156 HydrophobicContact CD2-CD2 4.36Å; W150-L156 HydrophobicContact CE3-CD1 3.51Å; W150-L156 HydrophobicContact CE3-CD2 4.09Å; W150-L156 HydrophobicContact CE3-CG 4.46Å; W150-L156 HydrophobicContact CG-CD2 4.35Å; W150-L156 HydrophobicContact CZ3-CD1 3.73Å; C152-L156 HydrophobicContact CB-CD2 4.45Å; D153-L156 WeakPolarHBondContact OD1-CB 3.44Å; D153-L156 PolarHBondContact OD1-N 3.06Å; L156-Q158 VanDerWaalsContact C-N 3.29Å; L156-Q158 PolarHBondContact O-N 2.92Å; L156-A159 PolarHBondContact O-N 2.86Å; L156-I160 HydrophobicContact CD1-CD1 3.85Å; L156-I160 HydrophobicContact CD1-CG1 4.01Å; L156-I160 HydrophobicContact CD2-CD1 4.17Å; L156-I160 HydrophobicContact CG-CD1 3.64Å; L156-I160 HydrophobicContact CG-CG1 4.19Å; L156-I160 WeakPolarHBondContact O-CB 3.48Å; L156-I160 VanDerWaalsContact O-CG1 3.28Å; L156-I160 WeakPolarHBondContact O-CG1 3.39Å; L156-I160 PolarHBondContact O-N 3.08Å; L156-V173 HydrophobicContact CD2-CG1 4.47Å; L156-F188 HydrophobicContact CD2-CD2 4.44Å; L156-F188 HydrophobicContact CD2-CE2 4.47Å
157	Q	84.4	Confident	80.4	Confident	49 Å²	49	45.9 Å²	45.9	23%	0.229	27%	0.265	C	S	.	.	H	α-helix	trans	-56.1	-43.9	175.3	-168.8	179.1	-47.5	0	0	112.3	D153 C154 A155 G161 F188 D194 L195	D153-Q157 PolarHBondContact O-N 3.16Å; C154-Q157 WeakPolarHBondContact O-CB 3.34Å; C154-Q157 PolarHBondContact O-N 3.28Å; A155-Q157 VanDerWaalsContact C-N 3.35Å; Q157-G161 PolarHBondContact O-N 2.66Å; Q157-F188 VanDerWaalsContact CA-CZ 3.43Å; Q157-F188 HydrophobicContact CB-CE1 4.36Å; Q157-F188 HydrophobicContact CB-CZ 3.62Å; Q157-F188 HydrophobicContact CG-CE1 4.18Å; Q157-F188 HydrophobicContact CG-CZ 3.79Å; Q157-D194 PolarHBondContact NE2-OD1 3.19Å; Q157-L195 VanDerWaalsContact OE1-CB 3.31Å
158	Q	86.2	Confident	79.1	Confident	87 Å²	87	48.4 Å²	48.4	41%	0.407	27%	0.274	S	S	.	.	H	α-helix	trans	-69	-43.8	178.3	-68.9	174.4	7.7	0	0	111.8	R133 C154 A155 L156 I160 G161 G162	R133-Q158 HydrophobicContact CB-CB 3.77Å; C154-Q158 WeakPolarHBondContact O-CG 3.36Å; C154-Q158 PolarHBondContact O-N 2.92Å; C154-Q158 VanDerWaalsContact O-N 3.12Å; C154-Q158 PolarHBondContact SG-NE2 2.98Å; C154-Q158 VanDerWaalsContact SG-NE2 3.36Å; A155-Q158 PolarHBondContact O-N 3.37Å; L156-Q158 VanDerWaalsContact C-N 3.29Å; L156-Q158 PolarHBondContact O-N 2.92Å; Q158-I160 VanDerWaalsContact C-N 3.34Å; Q158-I160 PolarHBondContact O-N 2.95Å; Q158-G161 PolarHBondContact O-N 3.43Å; Q158-G162 PolarHBondContact O-N 3.12Å; Q158-G162 VanDerWaalsContact O-N 3.1Å
159	A	87.6	Confident	77.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-42.9	178.1	0	0	0	0	0	112	V131 R133 F136 A155 L156 G162	V131-A159 HydrophobicContact CG2-CB 3.6Å; R133-A159 VanDerWaalsContact O-CA 3.26Å; R133-A159 WeakPolarHBondContact O-CA 3.05Å; R133-A159 PolarHBondContact O-N 2.81Å; F136-A159 HydrophobicContact CD2-CB 4.14Å; A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 2.91Å; L156-A159 PolarHBondContact O-N 2.86Å; A159-G162 PolarHBondContact O-N 2.97Å
160	I	83.4	Confident	76.3	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-69.5	-38	176	-64.7	173.1	0	0	0	111.4	L156 Q158 G162 M163 A170 V173 F188	L156-I160 HydrophobicContact CD1-CD1 3.85Å; L156-I160 HydrophobicContact CD1-CG1 4.01Å; L156-I160 HydrophobicContact CD2-CD1 4.17Å; L156-I160 HydrophobicContact CG-CD1 3.64Å; L156-I160 HydrophobicContact CG-CG1 4.19Å; L156-I160 WeakPolarHBondContact O-CB 3.48Å; L156-I160 VanDerWaalsContact O-CG1 3.28Å; L156-I160 WeakPolarHBondContact O-CG1 3.39Å; L156-I160 PolarHBondContact O-N 3.08Å; Q158-I160 VanDerWaalsContact C-N 3.34Å; Q158-I160 PolarHBondContact O-N 2.95Å; I160-G162 PolarHBondContact O-N 3.01Å; I160-M163 HydrophobicContact CB-CE 3.84Å; I160-M163 HydrophobicContact CG1-CE 3.54Å; I160-M163 HydrophobicContact CG2-CE 3.88Å; I160-M163 WeakPolarHBondContact O-CA 3.5Å; I160-M163 VanDerWaalsContact O-CB 3.31Å; I160-M163 WeakPolarHBondContact O-CB 3.32Å; I160-M163 PolarHBondContact O-N 3.33Å; I160-A170 HydrophobicContact CG2-CB 3.5Å; I160-A170 VanDerWaalsContact CG2-CB 3.5Å; I160-V173 HydrophobicContact CD1-CB 4.25Å; I160-V173 HydrophobicContact CD1-CG1 3.92Å; I160-V173 HydrophobicContact CD1-CG2 4.13Å; I160-F188 HydrophobicContact CB-CE1 4.35Å; I160-F188 HydrophobicContact CD1-CB 4.43Å; I160-F188 HydrophobicContact CD1-CD1 3.56Å; I160-F188 HydrophobicContact CD1-CD2 4.19Å; I160-F188 HydrophobicContact CD1-CE1 3.84Å; I160-F188 HydrophobicContact CD1-CE2 4.43Å; I160-F188 HydrophobicContact CD1-CG 3.77Å; I160-F188 HydrophobicContact CD1-CZ 4.29Å; I160-F188 HydrophobicContact CG2-CD1 4.21Å; I160-F188 HydrophobicContact CG2-CE1 4.35Å
161	G	78.3	Confident	75.1	Confident	51 Å²	51	48.8 Å²	48.8	53%	0.526	28%	0.283	S	S	.	.	H	α-helix	trans	-56.6	-32.8	173	0	0	0	0	0	112.8	Q157 Q158 M163	Q157-G161 PolarHBondContact O-N 2.66Å; Q158-G161 PolarHBondContact O-N 3.43Å; G161-M163 PolarHBondContact O-N 3.02Å
162	G	73	Confident	74.4	Confident	31 Å²	31	53.2 Å²	53.2	32%	0.32	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.8	172	0	0	0	0	0	114.8	Q158 A159 I160 A164	Q158-G162 PolarHBondContact O-N 3.12Å; Q158-G162 VanDerWaalsContact O-N 3.1Å; A159-G162 PolarHBondContact O-N 2.97Å; I160-G162 PolarHBondContact O-N 3.01Å; G162-A164 PolarHBondContact O-N 3.17Å
163	M	73.8	Confident	74.3	Confident	13 Å²	13	53.1 Å²	53.1	6%	0.064	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	13.7	-179.7	-56.3	-163.5	-81.1	0	0	113.9	F136 I143 V145 I160 G161 H165 N166	F136-M163 HydrophobicContact CB-CG 3.95Å; F136-M163 HydrophobicContact CD2-CG 4.21Å; F136-M163 HydrophobicContact CD2-SD 4Å; F136-M163 HydrophobicContact CE2-SD 4.49Å; F136-M163 HydrophobicContact CG-CG 4.3Å; F136-M163 HydrophobicContact CG-SD 4.34Å; I143-M163 HydrophobicContact CB-SD 3.74Å; I143-M163 HydrophobicContact CD1-CG 3.85Å; I143-M163 HydrophobicContact CD1-SD 3.99Å; I143-M163 HydrophobicContact CG2-SD 3.61Å; V145-M163 HydrophobicContact CG2-CE 3.94Å; V145-M163 HydrophobicContact CG2-SD 4.29Å; I160-M163 HydrophobicContact CB-CE 3.84Å; I160-M163 HydrophobicContact CG1-CE 3.54Å; I160-M163 HydrophobicContact CG2-CE 3.88Å; I160-M163 WeakPolarHBondContact O-CA 3.5Å; I160-M163 VanDerWaalsContact O-CB 3.31Å; I160-M163 WeakPolarHBondContact O-CB 3.32Å; I160-M163 PolarHBondContact O-N 3.33Å; G161-M163 PolarHBondContact O-N 3.02Å; M163-H165 PolarHBondContact O-N 3.41Å; M163-N166 PolarHBondContact O-N 3.43Å
164	A	55.3	Low	74.3	Confident	61 Å²	61	56 Å²	56	50%	0.504	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-16.3	-170.6	0	0	0	0	0	116.6	G162 N166	G162-A164 PolarHBondContact O-N 3.17Å; A164-N166 PolarHBondContact O-N 3.28Å
165	H	56.6	Low	74.3	Confident	155 Å²	155	54.4 Å²	54.4	72%	0.718	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-8.8	172.6	-88.3	-51.9	0	0	0	114.6	M163	M163-H165 PolarHBondContact O-N 3.41Å
166	N	57.7	Low	74.2	Confident	49 Å²	49	61.5 Å²	61.5	26%	0.262	32%	0.321	S	S	.	.			trans	-138.8	76.8	174.5	-70.6	-75.5	0	0	0	111.5	R142 M163 A164 E168 A169	R142-N166 WeakPolarHBondContact CA-ND2 3.3Å; M163-N166 PolarHBondContact O-N 3.43Å; A164-N166 PolarHBondContact O-N 3.28Å; N166-E168 PolarHBondContact O-N 2.8Å; N166-A169 HydrophobicContact CB-CB 4.28Å; N166-A169 PolarHBondContact O-N 3.32Å
167	H	56.3	Low	74	Confident	149 Å²	149	63.3 Å²	63.3	69%	0.69	33%	0.334	S	S	*	.	H	α-helix	trans	-50.9	-26.4	176.2	-87.4	-37.8	0	0	0	114.1
168	E	64.4	Low	73.8	Confident	149 Å²	149	61.9 Å²	61.9	70%	0.696	33%	0.33	S	S	*	.	H	α-helix	trans	-71.6	-31.7	178.1	-68.4	-174.2	170.7	0	0	114.4	N166 A171	N166-E168 PolarHBondContact O-N 2.8Å; E168-A171 PolarHBondContact O-N 3.29Å
169	A	64.6	Low	72.8	Confident	11 Å²	11	64.4 Å²	64.4	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-75.3	-36.7	-176.6	0	0	0	0	0	112.1	I143 N166 A171 R172	I143-A169 WeakPolarHBondContact O-CB 3.19Å; N166-A169 HydrophobicContact CB-CB 4.28Å; N166-A169 PolarHBondContact O-N 3.32Å; A169-A171 PolarHBondContact O-N 3.42Å; A169-R172 PolarHBondContact O-N 2.61Å
170	A	65.3	Low	71.8	Confident	8 Å²	8	66.4 Å²	66.4	7%	0.066	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-30.5	174.8	0	0	0	0	0	112.3	I160 R172 V173 L189	I160-A170 HydrophobicContact CG2-CB 3.5Å; I160-A170 VanDerWaalsContact CG2-CB 3.5Å; A170-R172 PolarHBondContact O-N 3.34Å; A170-V173 PolarHBondContact O-N 3.31Å; A170-L189 VanDerWaalsContact C-CD1 3.42Å; A170-L189 HydrophobicContact CB-CD1 3.53Å
171	A	65.4	Low	70.6	Confident	47 Å²	47	73.9 Å²	73.9	39%	0.388	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19	-175.1	0	0	0	0	0	113.7	E168 A169 L189	E168-A171 PolarHBondContact O-N 3.29Å; A169-A171 PolarHBondContact O-N 3.42Å; A171-L189 VanDerWaalsContact CA-CD1 3.46Å; A171-L189 HydrophobicContact CB-CD1 3.88Å; A171-L189 VanDerWaalsContact N-CD1 3.3Å
172	R	75.8	Confident	69.9	Low	145 Å²	145	77.4 Å²	77.4	55%	0.547	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-2.1	-177.5	-68.2	-177.5	-171.5	151.2	7	113.6	D146 A169 A170 L174	D146-R172 WeakPolarHBondContact OD1-CB 3.38Å; D146-R172 IonicContact OD2-NH1 3.74Å; A169-R172 PolarHBondContact O-N 2.61Å; A170-R172 PolarHBondContact O-N 3.34Å; R172-L174 PolarHBondContact O-N 3.47Å
173	V	84.6	Confident	69.5	Low	1 Å²	1	77 Å²	77	1%	0.006	39%	0.388	C	S	.	.			trans	-69.9	113.7	171.4	178.4	0	0	0	0	108.8	V145 W150 L156 I160 A170 P187 F188	V145-V173 HydrophobicContact CG2-CG2 3.83Å; W150-V173 HydrophobicContact CB-CG1 4.32Å; W150-V173 HydrophobicContact CD2-CG1 4.43Å; W150-V173 HydrophobicContact CG-CG1 3.85Å; L156-V173 HydrophobicContact CD2-CG1 4.47Å; I160-V173 HydrophobicContact CD1-CB 4.25Å; I160-V173 HydrophobicContact CD1-CG1 3.92Å; I160-V173 HydrophobicContact CD1-CG2 4.13Å; A170-V173 PolarHBondContact O-N 3.31Å; V173-P187 WeakPolarHBondContact O-CA 3.02Å; V173-F188 HydrophobicContact CB-CB 4.04Å; V173-F188 HydrophobicContact CG1-CB 4.07Å; V173-F188 PolarHBondContact O-N 2.82Å
174	L	85.3	Confident	69.2	Low	89 Å²	89	82.7 Å²	82.7	47%	0.466	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-101.3	128.6	175.9	-67.6	167.7	0	0	0	109.8	R172 R176 P187	R172-L174 PolarHBondContact O-N 3.47Å; L174-R176 PolarHBondContact O-N 2.85Å; L174-P187 HydrophobicContact CD2-CB 4.3Å
175	C	85.8	Confident	69.8	Low	2 Å²	2	82.8 Å²	82.8	1%	0.014	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	121.2	176.1	-63	0	0	0	0	110.3	C152 Q183 G185 R186	C152-C175 HydrophobicContact CB-CB 3.83Å; C152-C175 WeakPolarHBondContact CB-SG 3.44Å; C152-C175 WeakPolarHBondContact SG-CA 3.43Å; C152-C175 WeakPolarHBondContact SG-CB 3.2Å; C152-C175 CovalentContact SG-SG 2.01Å; C152-C175 PolarHBondContact SG-SG 3.44Å; C175-Q183 VanDerWaalsContact CB-O 3.26Å; C175-Q183 WeakPolarHBondContact CB-O 3.4Å; C175-G185 PolarHBondContact O-N 2.66Å; C175-R186 PolarHBondContact N-O 2.97Å; C175-R186 VanDerWaalsContact N-O 3.08Å
176	R	87.4	Confident	70.5	Confident	181 Å²	181	82 Å²	82	68%	0.683	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	-36.2	171.9	-177.4	60.2	178.9	-163.9	3.6	111.9	P149 W150 L174	P149-R176 HydrophobicContact CB-CB 4.2Å; P149-R176 HydrophobicContact CB-CG 4.13Å; W150-R176 PolarHBondContact O-N 2.93Å; L174-R176 PolarHBondContact O-N 2.85Å
177	S	82.8	Confident	71.1	Confident	40 Å²	40	82.1 Å²	82.1	28%	0.28	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.3	175.3	59.3	0	0	0	0	109.2	W150 H151 C152	W150-S177 PolarHBondContact O-N 3.35Å; H151-S177 CarbonylContact C-O 3.5Å; H151-S177 WeakPolarHBondContact CA-O 3.07Å; H151-S177 PolarHBondContact ND1-OG 3Å; C152-S177 PolarHBondContact N-O 3.01Å
178	S	80	Confident	71.7	Confident	19 Å²	19	75.9 Å²	75.9	13%	0.133	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	158.8	175.2	-176.6	0	0	0	0	109.7	C152 L180	C152-S178 WeakPolarHBondContact O-CB 3.39Å; C152-S178 PolarHBondContact O-OG 2.89Å; S178-L180 PolarHBondContact O-N 2.81Å; S178-L180 PolarHBondContact OG-N 3.01Å
179	E	66.8	Low	71.6	Confident	139 Å²	139	73.7 Å²	73.7	65%	0.65	38%	0.378	S	S	*	.	S	Bend	trans	-63.8	-19.2	167.2	-64.1	-171.7	155.3	0	0	112.3
180	L	66.3	Low	71.3	Confident	42 Å²	42	76.5 Å²	76.5	22%	0.22	40%	0.402	C	S	.	.	S	Bend	trans	-97.7	123.3	172.3	-69.1	89.6	0	0	0	111.2	S178 D182 Q183 L195 L198	S178-L180 PolarHBondContact O-N 2.81Å; S178-L180 PolarHBondContact OG-N 3.01Å; L180-D182 PolarHBondContact O-N 2.91Å; L180-Q183 HydrophobicContact CB-CG 3.81Å; L180-Q183 PolarHBondContact O-N 2.93Å; L180-L195 HydrophobicContact CD1-CD2 3.96Å; L180-L195 HydrophobicContact CD1-CG 4.48Å; L180-L198 HydrophobicContact CD1-CD2 3.69Å; L180-L198 HydrophobicContact CD2-CD2 3.48Å; L180-L198 VanDerWaalsContact CD2-CD2 3.48Å; L180-L198 HydrophobicContact CG-CD2 3.69Å
181	L	58.5	Low	71.1	Confident	169 Å²	169	77.3 Å²	77.3	89%	0.885	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-21.3	-178	-113.4	87.3	0	0	0	115.3
182	D	63.2	Low	70.6	Confident	125 Å²	125	83.1 Å²	83.1	67%	0.668	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	7.5	-172.2	-74.5	-26.9	0	0	0	115	L180 R186	L180-D182 PolarHBondContact O-N 2.91Å; D182-R186 PolarHBondContact O-NE 3.24Å
183	Q	63.2	Low	70	Confident	23 Å²	23	79.8 Å²	79.8	11%	0.107	43%	0.426	C	S	.	.			trans	-107.7	-0.4	-170.1	-57.3	-60.8	-15.1	0	0	115.2	C175 L180 G185 R186	C175-Q183 VanDerWaalsContact CB-O 3.26Å; C175-Q183 WeakPolarHBondContact CB-O 3.4Å; L180-Q183 HydrophobicContact CB-CG 3.81Å; L180-Q183 PolarHBondContact O-N 2.93Å; Q183-G185 PolarHBondContact O-N 2.88Å; Q183-R186 PolarHBondContact O-N 3.05Å
184	E	68.1	Low	69.4	Low	133 Å²	133	83.1 Å²	83.1	62%	0.621	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	128.9	177.4	-62	-171.5	173.2	0	0	111.7	R186	E184-R186 VanDerWaalsContact C-N 3.3Å; E184-R186 PolarHBondContact O-N 2.96Å
185	G	68.9	Low	68.9	Low	62 Å²	62	79.4 Å²	79.4	64%	0.639	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	3	178.3	0	0	0	0	0	115.3	C175 Q183	C175-G185 PolarHBondContact O-N 2.66Å; Q183-G185 PolarHBondContact O-N 2.88Å
186	R	70.9	Confident	68.5	Low	138 Å²	138	80.7 Å²	80.7	52%	0.521	43%	0.433	S	S	.	.			trans	-91.9	147.7	176.9	-63.8	-170.9	-177	-156.7	3.1	111.7	C175 D182 Q183 E184	C175-R186 PolarHBondContact N-O 2.97Å; C175-R186 VanDerWaalsContact N-O 3.08Å; D182-R186 PolarHBondContact O-NE 3.24Å; Q183-R186 PolarHBondContact O-N 3.05Å; E184-R186 VanDerWaalsContact C-N 3.3Å; E184-R186 PolarHBondContact O-N 2.96Å
187	P	69.3	Low	67.8	Low	52 Å²	52	76.7 Å²	76.7	34%	0.338	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-67.9	138.7	170.5	27.8	-31.7	0	0	0	110.1	V173 L174 L189 A190	V173-P187 WeakPolarHBondContact O-CA 3.02Å; L174-P187 HydrophobicContact CD2-CB 4.3Å; P187-L189 VanDerWaalsContact C-N 3.28Å; P187-L189 PolarHBondContact O-N 2.75Å; P187-A190 HydrophobicContact CG-CB 3.9Å; P187-A190 WeakPolarHBondContact O-CB 3.03Å; P187-A190 PolarHBondContact O-N 3.32Å
188	F	69.8	Low	67	Low	19 Å²	19	78 Å²	78	8%	0.083	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-57.7	-38.1	-174.7	-172.2	-97.2	0	0	0	113.1	C152 L156 Q157 I160 V173 A190 V191 L195	C152-F188 HydrophobicContact CB-CD2 4.32Å; C152-F188 HydrophobicContact CB-CE2 4.34Å; L156-F188 HydrophobicContact CD2-CD2 4.44Å; L156-F188 HydrophobicContact CD2-CE2 4.47Å; Q157-F188 VanDerWaalsContact CA-CZ 3.43Å; Q157-F188 HydrophobicContact CB-CE1 4.36Å; Q157-F188 HydrophobicContact CB-CZ 3.62Å; Q157-F188 HydrophobicContact CG-CE1 4.18Å; Q157-F188 HydrophobicContact CG-CZ 3.79Å; I160-F188 HydrophobicContact CB-CE1 4.35Å; I160-F188 HydrophobicContact CD1-CB 4.43Å; I160-F188 HydrophobicContact CD1-CD1 3.56Å; I160-F188 HydrophobicContact CD1-CD2 4.19Å; I160-F188 HydrophobicContact CD1-CE1 3.84Å; I160-F188 HydrophobicContact CD1-CE2 4.43Å; I160-F188 HydrophobicContact CD1-CG 3.77Å; I160-F188 HydrophobicContact CD1-CZ 4.29Å; I160-F188 HydrophobicContact CG2-CD1 4.21Å; I160-F188 HydrophobicContact CG2-CE1 4.35Å; V173-F188 HydrophobicContact CB-CB 4.04Å; V173-F188 HydrophobicContact CG1-CB 4.07Å; V173-F188 PolarHBondContact O-N 2.82Å; F188-A190 VanDerWaalsContact C-N 3.26Å; F188-A190 PolarHBondContact O-N 2.95Å; F188-V191 VanDerWaalsContact O-CB 3.28Å; F188-V191 WeakPolarHBondContact O-CB 3Å; F188-V191 VanDerWaalsContact O-CG2 3.3Å; F188-V191 WeakPolarHBondContact O-CG2 3.41Å; F188-V191 PolarHBondContact O-N 3.31Å; F188-V191 VanDerWaalsContact O-N 3.14Å; F188-L195 HydrophobicContact CE2-CD1 4.12Å; F188-L195 HydrophobicContact CZ-CD1 4.21Å
189	L	62.4	Low	66.1	Low	103 Å²	103	78.7 Å²	78.7	54%	0.539	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-71.8	-12.1	179.2	-104.1	137.3	0	0	0	115	A170 A171 P187	A170-L189 VanDerWaalsContact C-CD1 3.42Å; A170-L189 HydrophobicContact CB-CD1 3.53Å; A171-L189 VanDerWaalsContact CA-CD1 3.46Å; A171-L189 HydrophobicContact CB-CD1 3.88Å; A171-L189 VanDerWaalsContact N-CD1 3.3Å; P187-L189 VanDerWaalsContact C-N 3.28Å; P187-L189 PolarHBondContact O-N 2.75Å
190	A	57.8	Low	65.9	Low	70 Å²	70	78.5 Å²	78.5	58%	0.579	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-81.6	-3.2	171.8	0	0	0	0	0	112.5	P187 F188 D192	P187-A190 HydrophobicContact CG-CB 3.9Å; P187-A190 WeakPolarHBondContact O-CB 3.03Å; P187-A190 PolarHBondContact O-N 3.32Å; F188-A190 VanDerWaalsContact C-N 3.26Å; F188-A190 PolarHBondContact O-N 2.95Å; A190-D192 PolarHBondContact O-N 3.4Å
191	V	60.2	Low	65.8	Low	25 Å²	25	84 Å²	84	15%	0.152	45%	0.45	C	S	.	.			trans	-84.6	89.1	177.7	-171.3	0	0	0	0	108.7	F188 T193 L195	F188-V191 VanDerWaalsContact O-CB 3.28Å; F188-V191 WeakPolarHBondContact O-CB 3Å; F188-V191 VanDerWaalsContact O-CG2 3.3Å; F188-V191 WeakPolarHBondContact O-CG2 3.41Å; F188-V191 PolarHBondContact O-N 3.31Å; F188-V191 VanDerWaalsContact O-N 3.14Å; V191-T193 WeakPolarHBondContact CG1-O 3.44Å; V191-T193 WeakPolarHBondContact CG1-OG1 3.38Å; V191-T193 PolarHBondContact O-N 3.34Å; V191-T193 VanDerWaalsContact O-N 3.16Å; V191-L195 HydrophobicContact CG1-CD1 3.87Å
192	D	55.8	Low	65.9	Low	169 Å²	169	79.9 Å²	79.9	90%	0.904	43%	0.432	S	S	*	.			trans	-71	0.4	174.9	-145.4	12.6	0	0	0	112.5	A190	A190-D192 PolarHBondContact O-N 3.4Å
193	T	63.3	Low	66.1	Low	74 Å²	74	77.9 Å²	77.9	45%	0.454	43%	0.425	S	S	.	.	S	Bend	trans	-101.2	120.5	178.7	43	0	0	0	0	111.3	V191 L195	V191-T193 WeakPolarHBondContact CG1-O 3.44Å; V191-T193 WeakPolarHBondContact CG1-OG1 3.38Å; V191-T193 PolarHBondContact O-N 3.34Å; V191-T193 VanDerWaalsContact O-N 3.16Å; T193-L195 PolarHBondContact O-N 3.15Å
194	D	72.9	Confident	66.5	Low	71 Å²	71	80.5 Å²	80.5	38%	0.38	44%	0.44	S	S	.	.			trans	-65.7	98.7	175.3	-165.6	-7.3	0	0	0	110.8	Q157 C196 N197 L198	Q157-D194 PolarHBondContact NE2-OD1 3.19Å; D194-C196 PolarHBondContact O-N 3Å; D194-N197 HydrophobicContact CB-CB 4.21Å; D194-N197 PolarHBondContact O-N 3.07Å; D194-N197 VanDerWaalsContact O-N 3.08Å; D194-N197 PolarHBondContact OD2-ND2 2.78Å; D194-L198 PolarHBondContact O-N 3.16Å
195	L	73.9	Confident	67	Low	12 Å²	12	80.7 Å²	80.7	6%	0.063	44%	0.436	C	S	.	.	H	α-helix	trans	-58.8	-34.4	-175.7	-71.6	102.9	0	0	0	111.2	Q157 L180 F188 V191 T193 N197 L198 A199	Q157-L195 VanDerWaalsContact OE1-CB 3.31Å; L180-L195 HydrophobicContact CD1-CD2 3.96Å; L180-L195 HydrophobicContact CD1-CG 4.48Å; F188-L195 HydrophobicContact CE2-CD1 4.12Å; F188-L195 HydrophobicContact CZ-CD1 4.21Å; V191-L195 HydrophobicContact CG1-CD1 3.87Å; T193-L195 PolarHBondContact O-N 3.15Å; L195-N197 VanDerWaalsContact C-N 3.32Å; L195-N197 PolarHBondContact O-N 3.02Å; L195-L198 PolarHBondContact O-N 3.16Å; L195-A199 PolarHBondContact O-N 2.73Å; L195-A199 VanDerWaalsContact O-N 3.08Å
196	C	76.8	Confident	67.4	Low	29 Å²	29	80.5 Å²	80.5	20%	0.196	43%	0.428	C	S	.	.	H	α-helix	trans	-64.2	-35.2	178.6	-67.3	0	0	0	0	113.1	C154 D194	C154-C196 VanDerWaalsContact CA-SG 3.53Å; C154-C196 HydrophobicContact CB-CB 3.97Å; C154-C196 WeakPolarHBondContact CB-SG 3.41Å; C154-C196 WeakPolarHBondContact SG-CA 3.44Å; C154-C196 WeakPolarHBondContact SG-CB 3.38Å; C154-C196 CovalentContact SG-SG 2.04Å; C154-C196 PolarHBondContact SG-SG 3.09Å; D194-C196 PolarHBondContact O-N 3Å
197	N	73.4	Confident	67.8	Low	97 Å²	97	79.9 Å²	79.9	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-79	-29.4	176.6	-83	-39.8	0	0	0	112.2	D194 L195 K200 R201	D194-N197 HydrophobicContact CB-CB 4.21Å; D194-N197 PolarHBondContact O-N 3.07Å; D194-N197 VanDerWaalsContact O-N 3.08Å; D194-N197 PolarHBondContact OD2-ND2 2.78Å; L195-N197 VanDerWaalsContact C-N 3.32Å; L195-N197 PolarHBondContact O-N 3.02Å; N197-K200 PolarHBondContact O-N 3.27Å; N197-R201 PolarHBondContact O-N 3Å; N197-R201 VanDerWaalsContact O-N 3.12Å
198	L	66.1	Low	68.6	Low	67 Å²	67	81.1 Å²	81.1	35%	0.351	44%	0.436	S	S	.	.	H	α-helix	trans	-69.1	-44.2	176.9	-168.3	71.5	0	0	0	112.2	L180 D194 L195 K200 R201 T202	L180-L198 HydrophobicContact CD1-CD2 3.69Å; L180-L198 HydrophobicContact CD2-CD2 3.48Å; L180-L198 VanDerWaalsContact CD2-CD2 3.48Å; L180-L198 HydrophobicContact CG-CD2 3.69Å; D194-L198 PolarHBondContact O-N 3.16Å; L195-L198 PolarHBondContact O-N 3.16Å; L198-K200 PolarHBondContact O-N 3Å; L198-R201 PolarHBondContact O-N 3.44Å; L198-T202 PolarHBondContact O-N 3.22Å; L198-T202 VanDerWaalsContact O-N 3.09Å; L198-T202 PolarHBondContact O-OG1 3.25Å
199	A	60.7	Low	69.6	Low	34 Å²	34	85.3 Å²	85.3	28%	0.281	46%	0.463	S	S	.	.	H	α-helix	trans	-57.7	-37.3	176.2	0	0	0	0	0	112	L195 T202 T203	L195-A199 PolarHBondContact O-N 2.73Å; L195-A199 VanDerWaalsContact O-N 3.08Å; A199-T202 PolarHBondContact O-OG1 2.78Å; A199-T203 PolarHBondContact O-N 2.57Å; A199-T203 PolarHBondContact O-OG1 3.3Å
200	K	63.3	Low	70.9	Confident	134 Å²	134	85 Å²	85	58%	0.583	47%	0.465	S	S	*	.	H	α-helix	trans	-68.9	-38	174.9	-169.7	176.7	-179.6	-178.7	0	112.6	N197 L198 T203 D204	N197-K200 PolarHBondContact O-N 3.27Å; L198-K200 PolarHBondContact O-N 3Å; K200-T203 PolarHBondContact O-OG1 3.3Å; K200-D204 PolarHBondContact O-N 3.01Å; K200-D204 VanDerWaalsContact O-N 3.17Å
201	R	62.4	Low	72.5	Confident	157 Å²	157	85.5 Å²	85.5	59%	0.592	46%	0.457	S	S	*	.	H	α-helix	trans	-68.6	-40.5	-177.6	-145.6	-176.9	-167.9	164	4.9	112	N197 L198 D204 Y205	N197-R201 PolarHBondContact O-N 3Å; N197-R201 VanDerWaalsContact O-N 3.12Å; L198-R201 PolarHBondContact O-N 3.44Å; R201-D204 PolarHBondContact O-N 3.42Å; R201-Y205 HydrophobicContact CG-CD2 4.42Å; R201-Y205 HydrophobicContact CG-CE2 3.85Å; R201-Y205 WeakPolarHBondContact O-CD2 3.21Å; R201-Y205 PolarHBondContact O-N 2.88Å
202	T	62.5	Low	74.2	Confident	83 Å²	83	90.8 Å²	90.8	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-37.5	178.5	53	0	0	0	0	112	L198 A199 Y205 A206	L198-T202 PolarHBondContact O-N 3.22Å; L198-T202 VanDerWaalsContact O-N 3.09Å; L198-T202 PolarHBondContact O-OG1 3.25Å; A199-T202 PolarHBondContact O-OG1 2.78Å; T202-Y205 PolarHBondContact O-N 2.88Å; T202-A206 PolarHBondContact O-N 3.5Å; T202-A206 VanDerWaalsContact O-N 3.1Å
203	T	65.7	Low	76.1	Confident	84 Å²	84	84.8 Å²	84.8	52%	0.515	46%	0.456	S	S	.	.	H	α-helix	trans	-65.9	-38.9	174.5	51.9	0	0	0	0	112.9	A199 K200 A206 M207	A199-T203 PolarHBondContact O-N 2.57Å; A199-T203 PolarHBondContact O-OG1 3.3Å; K200-T203 PolarHBondContact O-OG1 3.3Å; T203-A206 PolarHBondContact O-N 2.77Å; T203-M207 WeakPolarHBondContact O-CB 3.26Å; T203-M207 PolarHBondContact O-N 2.86Å
204	D	72	Confident	77.6	Confident	77 Å²	77	88.6 Å²	88.6	41%	0.412	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-43.2	178.1	-77.6	-16.9	0	0	0	111.5	K200 R201 M207 L208	K200-D204 PolarHBondContact O-N 3.01Å; K200-D204 VanDerWaalsContact O-N 3.17Å; R201-D204 PolarHBondContact O-N 3.42Å; D204-M207 PolarHBondContact O-N 3.27Å; D204-L208 WeakPolarHBondContact O-CB 3.16Å; D204-L208 WeakPolarHBondContact O-CG 3.23Å; D204-L208 PolarHBondContact O-N 3.13Å
205	Y	78.8	Confident	78.8	Confident	137 Å²	137	89.7 Å²	89.7	54%	0.537	46%	0.463	S	S	.	.	H	α-helix	trans	-64.9	-42.8	175.6	-73.2	-66.1	0	0	0	112.6	R201 T202 M207 L208 V209	R201-Y205 HydrophobicContact CG-CD2 4.42Å; R201-Y205 HydrophobicContact CG-CE2 3.85Å; R201-Y205 WeakPolarHBondContact O-CD2 3.21Å; R201-Y205 PolarHBondContact O-N 2.88Å; T202-Y205 PolarHBondContact O-N 2.88Å; Y205-M207 VanDerWaalsContact C-N 3.34Å; Y205-M207 PolarHBondContact O-N 2.85Å; Y205-L208 PolarHBondContact O-N 2.86Å; Y205-V209 VanDerWaalsContact O-CG2 3.29Å; Y205-V209 WeakPolarHBondContact O-CG2 3.4Å; Y205-V209 PolarHBondContact O-N 3.4Å
206	A	77.6	Confident	79.8	Confident	59 Å²	59	91.5 Å²	91.5	49%	0.488	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-41.4	177.6	0	0	0	0	0	111.8	T202 T203 V209 T210	T202-A206 PolarHBondContact O-N 3.5Å; T202-A206 VanDerWaalsContact O-N 3.1Å; T203-A206 PolarHBondContact O-N 2.77Å; A206-V209 PolarHBondContact O-N 3.46Å; A206-T210 WeakPolarHBondContact O-CG2 3.19Å; A206-T210 PolarHBondContact O-N 2.87Å; A206-T210 PolarHBondContact O-OG1 3.07Å
207	M	79.5	Confident	80.8	Confident	125 Å²	125	96.2 Å²	96.2	62%	0.616	50%	0.501	S	S	*	.	H	α-helix	trans	-66.2	-39.5	175.6	-163.6	-179.6	72.8	0	0	111.8	T203 D204 Y205 T210 M211	T203-M207 WeakPolarHBondContact O-CB 3.26Å; T203-M207 PolarHBondContact O-N 2.86Å; D204-M207 PolarHBondContact O-N 3.27Å; Y205-M207 VanDerWaalsContact C-N 3.34Å; Y205-M207 PolarHBondContact O-N 2.85Å; M207-T210 WeakPolarHBondContact CA-OG1 3.4Å; M207-T210 PolarHBondContact O-OG1 3.41Å; M207-M211 VanDerWaalsContact O-CB 3.28Å; M207-M211 WeakPolarHBondContact O-CB 3.47Å; M207-M211 PolarHBondContact O-N 3.38Å
208	L	85.6	Confident	81.9	Confident	78 Å²	78	94 Å²	94	41%	0.408	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-45.5	174.9	-73.7	170.6	0	0	0	112.1	D204 Y205 T210 M211 F212	D204-L208 WeakPolarHBondContact O-CB 3.16Å; D204-L208 WeakPolarHBondContact O-CG 3.23Å; D204-L208 PolarHBondContact O-N 3.13Å; Y205-L208 PolarHBondContact O-N 2.86Å; L208-T210 VanDerWaalsContact C-N 3.34Å; L208-T210 PolarHBondContact O-N 3.41Å; L208-M211 WeakPolarHBondContact O-CB 3.25Å; L208-M211 PolarHBondContact O-N 3.3Å; L208-F212 VanDerWaalsContact O-CD2 3.23Å; L208-F212 WeakPolarHBondContact O-CD2 2.92Å; L208-F212 PolarHBondContact O-N 2.99Å
209	V	90.7	Very high	83.4	Confident	107 Å²	107	95.8 Å²	95.8	65%	0.648	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-44.2	178.8	169.8	0	0	0	0	111	Y205 A206 F212 G213	Y205-V209 VanDerWaalsContact O-CG2 3.29Å; Y205-V209 WeakPolarHBondContact O-CG2 3.4Å; Y205-V209 PolarHBondContact O-N 3.4Å; A206-V209 PolarHBondContact O-N 3.46Å; V209-F212 PolarHBondContact O-N 3.03Å; V209-G213 PolarHBondContact O-N 2.71Å
210	T	90.2	Very high	85.1	Confident	95 Å²	95	97.8 Å²	97.8	58%	0.583	51%	0.511	S	S	*	.	H	α-helix	trans	-65.8	-38.4	176.5	50.8	0	0	0	0	112.3	A206 M207 L208 G213 W214	A206-T210 WeakPolarHBondContact O-CG2 3.19Å; A206-T210 PolarHBondContact O-N 2.87Å; A206-T210 PolarHBondContact O-OG1 3.07Å; M207-T210 WeakPolarHBondContact CA-OG1 3.4Å; M207-T210 PolarHBondContact O-OG1 3.41Å; L208-T210 VanDerWaalsContact C-N 3.34Å; L208-T210 PolarHBondContact O-N 3.41Å; T210-G213 PolarHBondContact O-N 3.49Å; T210-W214 WeakPolarHBondContact O-CB 3.47Å; T210-W214 PolarHBondContact O-N 2.82Å
211	M	90.7	Very high	86.7	Confident	81 Å²	81	98.5 Å²	98.5	40%	0.399	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-50.3	174.6	-164.6	-152.8	85	0	0	111.6	M207 L208 G213 W214 F215	M207-M211 VanDerWaalsContact O-CB 3.28Å; M207-M211 WeakPolarHBondContact O-CB 3.47Å; M207-M211 PolarHBondContact O-N 3.38Å; L208-M211 WeakPolarHBondContact O-CB 3.25Å; L208-M211 PolarHBondContact O-N 3.3Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 2.97Å; M211-W214 PolarHBondContact O-N 2.77Å; M211-F215 HydrophobicContact CE-CD2 3.53Å; M211-F215 HydrophobicContact CE-CE2 3.48Å; M211-F215 VanDerWaalsContact CE-CE2 3.48Å; M211-F215 HydrophobicContact CG-CD2 3.71Å; M211-F215 HydrophobicContact CG-CE2 3.47Å; M211-F215 VanDerWaalsContact CG-CE2 3.47Å; M211-F215 WeakPolarHBondContact O-CD2 3.37Å; M211-F215 PolarHBondContact O-N 3.32Å; M211-F215 HydrophobicContact SD-CD2 4.21Å; M211-F215 HydrophobicContact SD-CE2 3.71Å
212	F	95.3	Very high	88.3	Confident	137 Å²	137	94.6 Å²	94.6	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-61.8	-39	177	-84.8	-71.9	0	0	0	112	L208 V209 F215 A216	L208-F212 VanDerWaalsContact O-CD2 3.23Å; L208-F212 WeakPolarHBondContact O-CD2 2.92Å; L208-F212 PolarHBondContact O-N 2.99Å; V209-F212 PolarHBondContact O-N 3.03Å; F212-F215 PolarHBondContact O-N 3.28Å; F212-A216 VanDerWaalsContact O-CB 3.29Å; F212-A216 WeakPolarHBondContact O-CB 3.32Å; F212-A216 PolarHBondContact O-N 3.11Å
213	G	95.6	Very high	89.9	Confident	42 Å²	42	94.4 Å²	94.4	43%	0.433	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-43.9	174.2	0	0	0	0	0	112.5	V209 T210 M211 A216 M217	V209-G213 PolarHBondContact O-N 2.71Å; T210-G213 PolarHBondContact O-N 3.49Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 2.97Å; G213-A216 PolarHBondContact O-N 3.02Å; G213-M217 PolarHBondContact O-N 2.93Å
214	W	96.3	Very high	91.4	Very high	154 Å²	154	97.5 Å²	97.5	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-67	-44.9	177.3	-169.3	81.6	0	0	0	112.1	T210 M211 A216 M217 V218	T210-W214 WeakPolarHBondContact O-CB 3.47Å; T210-W214 PolarHBondContact O-N 2.82Å; M211-W214 PolarHBondContact O-N 2.77Å; W214-A216 VanDerWaalsContact C-N 3.34Å; W214-A216 PolarHBondContact O-N 3.35Å; W214-M217 WeakPolarHBondContact O-CB 3.45Å; W214-M217 PolarHBondContact O-N 2.03Å; W214-V218 HydrophobicContact CD2-CG2 3.85Å; W214-V218 HydrophobicContact CE3-CG2 3.96Å; W214-V218 HydrophobicContact CH2-CG2 3.87Å; W214-V218 HydrophobicContact CZ2-CG2 3.73Å; W214-V218 HydrophobicContact CZ3-CG2 3.97Å; W214-V218 WeakPolarHBondContact O-CG2 2.98Å; W214-V218 PolarHBondContact O-N 2.6Å
215	F	96.6	Very high	92.5	Very high	94 Å²	94	99.9 Å²	99.9	41%	0.412	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-42.9	175.3	-81.8	-64.6	0	0	0	112	M211 F212 M217 V218 I219	M211-F215 HydrophobicContact CE-CD2 3.53Å; M211-F215 HydrophobicContact CE-CE2 3.48Å; M211-F215 VanDerWaalsContact CE-CE2 3.48Å; M211-F215 HydrophobicContact CG-CD2 3.71Å; M211-F215 HydrophobicContact CG-CE2 3.47Å; M211-F215 VanDerWaalsContact CG-CE2 3.47Å; M211-F215 WeakPolarHBondContact O-CD2 3.37Å; M211-F215 PolarHBondContact O-N 3.32Å; M211-F215 HydrophobicContact SD-CD2 4.21Å; M211-F215 HydrophobicContact SD-CE2 3.71Å; F212-F215 PolarHBondContact O-N 3.28Å; F215-M217 VanDerWaalsContact C-N 3.32Å; F215-M217 PolarHBondContact O-N 3.36Å; F215-V218 PolarHBondContact O-N 3.08Å; F215-I219 VanDerWaalsContact O-CB 3.31Å; F215-I219 WeakPolarHBondContact O-CB 3.44Å; F215-I219 WeakPolarHBondContact O-CD1 3.32Å; F215-I219 WeakPolarHBondContact O-CG1 3.24Å; F215-I219 PolarHBondContact O-N 3.24Å
216	A	96.2	Very high	93.3	Very high	51 Å²	51	96.6 Å²	96.6	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-60.9	-41.4	175.5	0	0	0	0	0	111.8	F212 G213 W214 S220	F212-A216 VanDerWaalsContact O-CB 3.29Å; F212-A216 WeakPolarHBondContact O-CB 3.32Å; F212-A216 PolarHBondContact O-N 3.11Å; G213-A216 PolarHBondContact O-N 3.02Å; W214-A216 VanDerWaalsContact C-N 3.34Å; W214-A216 PolarHBondContact O-N 3.35Å; A216-S220 VanDerWaalsContact O-CB 3.24Å; A216-S220 WeakPolarHBondContact O-CB 3.41Å; A216-S220 PolarHBondContact O-N 2.03Å; A216-S220 PolarHBondContact O-OG 3.3Å
217	M	96.6	Very high	94	Very high	127 Å²	127	101.3 Å²	101.3	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-62	-49.4	174.9	-174.7	-150.3	172.4	0	0	111.6	G213 W214 F215 S220 Y221	G213-M217 PolarHBondContact O-N 2.93Å; W214-M217 WeakPolarHBondContact O-CB 3.45Å; W214-M217 PolarHBondContact O-N 2.03Å; F215-M217 VanDerWaalsContact C-N 3.32Å; F215-M217 PolarHBondContact O-N 3.36Å; M217-S220 PolarHBondContact O-N 2.96Å; M217-Y221 WeakPolarHBondContact O-CB 3.23Å; M217-Y221 PolarHBondContact O-N 3.42Å
218	V	97.5	Very high	94.7	Very high	51 Å²	51	98.3 Å²	98.3	31%	0.309	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-45.8	-179	172.5	0	0	0	0	111.2	W214 F215 S220 Y221 V222	W214-V218 HydrophobicContact CD2-CG2 3.85Å; W214-V218 HydrophobicContact CE3-CG2 3.96Å; W214-V218 HydrophobicContact CH2-CG2 3.87Å; W214-V218 HydrophobicContact CZ2-CG2 3.73Å; W214-V218 HydrophobicContact CZ3-CG2 3.97Å; W214-V218 WeakPolarHBondContact O-CG2 2.98Å; W214-V218 PolarHBondContact O-N 2.6Å; F215-V218 PolarHBondContact O-N 3.08Å; V218-S220 VanDerWaalsContact C-N 3.31Å; V218-S220 PolarHBondContact O-N 2.65Å; V218-Y221 PolarHBondContact O-N 3.29Å; V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.34Å; V218-V222 PolarHBondContact O-N 2.7Å
219	I	96.9	Very high	94.9	Very high	104 Å²	104	97.8 Å²	97.8	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-60	-45.1	176.4	-68.5	165.6	0	0	0	109.8	F215 Y221 V222 V223	F215-I219 VanDerWaalsContact O-CB 3.31Å; F215-I219 WeakPolarHBondContact O-CB 3.44Å; F215-I219 WeakPolarHBondContact O-CD1 3.32Å; F215-I219 WeakPolarHBondContact O-CG1 3.24Å; F215-I219 PolarHBondContact O-N 3.24Å; I219-Y221 VanDerWaalsContact C-N 3.35Å; I219-Y221 PolarHBondContact O-N 2.82Å; I219-V222 PolarHBondContact O-N 3.38Å; I219-V223 HydrophobicContact CG2-CG2 4.3Å; I219-V223 WeakPolarHBondContact O-CB 3.4Å; I219-V223 VanDerWaalsContact O-CG2 3.28Å; I219-V223 WeakPolarHBondContact O-CG2 3.35Å; I219-V223 PolarHBondContact O-N 2.84Å
220	S	96.1	Very high	95	Very high	76 Å²	76	98.4 Å²	98.4	53%	0.531	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-43	177.3	-59.9	0	0	0	0	111.9	A216 M217 V218 Y224	A216-S220 VanDerWaalsContact O-CB 3.24Å; A216-S220 WeakPolarHBondContact O-CB 3.41Å; A216-S220 PolarHBondContact O-N 2.03Å; A216-S220 PolarHBondContact O-OG 3.3Å; M217-S220 PolarHBondContact O-N 2.96Å; V218-S220 VanDerWaalsContact C-N 3.31Å; V218-S220 PolarHBondContact O-N 2.65Å; S220-Y224 VanDerWaalsContact O-CB 3.26Å; S220-Y224 WeakPolarHBondContact O-CB 3.45Å; S220-Y224 PolarHBondContact O-N 2.83Å
221	Y	97.2	Very high	94.9	Very high	149 Å²	149	99 Å²	99	58%	0.584	48%	0.484	S	S	*	.	H	α-helix	trans	-63.2	-44.7	176.5	178.3	-97.7	0	0	0	112.3	M217 V218 I219 Y224 Y225	M217-Y221 WeakPolarHBondContact O-CB 3.23Å; M217-Y221 PolarHBondContact O-N 3.42Å; V218-Y221 PolarHBondContact O-N 3.29Å; I219-Y221 VanDerWaalsContact C-N 3.35Å; I219-Y221 PolarHBondContact O-N 2.82Å; Y221-Y224 PolarHBondContact O-N 2.92Å; Y221-Y225 VanDerWaalsContact O-CB 3.31Å; Y221-Y225 WeakPolarHBondContact O-CB 3.31Å; Y221-Y225 PolarHBondContact O-N 3Å
222	V	96.9	Very high	94.7	Very high	75 Å²	75	97.3 Å²	97.3	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-65.7	-44.7	178.3	172.3	0	0	0	0	111	V218 I219 Y224 Y225 V226	V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.34Å; V218-V222 PolarHBondContact O-N 2.7Å; I219-V222 PolarHBondContact O-N 3.38Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; V222-Y224 PolarHBondContact O-N 3.09Å; V222-Y225 PolarHBondContact O-N 2.84Å; V222-V226 HydrophobicContact CG1-CG2 4.33Å; V222-V226 WeakPolarHBondContact O-CB 3.33Å; V222-V226 VanDerWaalsContact O-CG2 3.31Å; V222-V226 WeakPolarHBondContact O-CG2 3.45Å; V222-V226 PolarHBondContact O-N 3.35Å
223	V	96.4	Very high	94.3	Very high	79 Å²	79	93.7 Å²	93.7	48%	0.479	47%	0.472	S	S	.	.	H	α-helix	trans	-60.6	-46	176.2	170.8	0	0	0	0	110.4	I219 V226 R227	I219-V223 HydrophobicContact CG2-CG2 4.3Å; I219-V223 WeakPolarHBondContact O-CB 3.4Å; I219-V223 VanDerWaalsContact O-CG2 3.28Å; I219-V223 WeakPolarHBondContact O-CG2 3.35Å; I219-V223 PolarHBondContact O-N 2.84Å; V223-V226 PolarHBondContact O-N 2.87Å; V223-R227 HydrophobicContact CG1-CG 4.3Å; V223-R227 WeakPolarHBondContact O-CB 3.42Å; V223-R227 WeakPolarHBondContact O-CG 3.35Å; V223-R227 PolarHBondContact O-N 3.12Å
224	Y	96.6	Very high	94	Very high	150 Å²	150	100.1 Å²	100.1	59%	0.588	48%	0.484	S	S	*	.	H	α-helix	trans	-56.9	-49.9	174.6	172.3	-96.4	0	0	0	111.6	S220 Y221 V222 V226 R227 Q228	S220-Y224 VanDerWaalsContact O-CB 3.26Å; S220-Y224 WeakPolarHBondContact O-CB 3.45Å; S220-Y224 PolarHBondContact O-N 2.83Å; Y221-Y224 PolarHBondContact O-N 2.92Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; V222-Y224 PolarHBondContact O-N 3.09Å; Y224-V226 PolarHBondContact O-N 2.85Å; Y224-R227 PolarHBondContact O-N 3.44Å; Y224-Q228 WeakPolarHBondContact O-CB 2.96Å; Y224-Q228 PolarHBondContact O-N 3.31Å
225	Y	95.5	Very high	93.4	Very high	126 Å²	126	99.5 Å²	99.5	49%	0.494	48%	0.481	S	S	.	.	H	α-helix	trans	-62.2	-41.8	-179.2	-176.7	-100.7	0	0	0	112.8	Y221 V222 N229	Y221-Y225 VanDerWaalsContact O-CB 3.31Å; Y221-Y225 WeakPolarHBondContact O-CB 3.31Å; Y221-Y225 PolarHBondContact O-N 3Å; V222-Y225 PolarHBondContact O-N 2.84Å; Y225-N229 WeakPolarHBondContact CD1-ND2 3.19Å; Y225-N229 WeakPolarHBondContact CE1-ND2 3.48Å; Y225-N229 WeakPolarHBondContact O-CB 3.33Å; Y225-N229 PolarHBondContact O-N 3.48Å; Y225-N229 PolarHBondContact O-ND2 3.43Å; Y225-N229 PolarHBondContact OH-ND2 3.49Å
226	V	95.6	Very high	92.9	Very high	68 Å²	68	101 Å²	101	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-44.8	176.6	171.7	0	0	0	0	110.9	V222 V223 Y224 Q228 N229 Q230	V222-V226 HydrophobicContact CG1-CG2 4.33Å; V222-V226 WeakPolarHBondContact O-CB 3.33Å; V222-V226 VanDerWaalsContact O-CG2 3.31Å; V222-V226 WeakPolarHBondContact O-CG2 3.45Å; V222-V226 PolarHBondContact O-N 3.35Å; V223-V226 PolarHBondContact O-N 2.87Å; Y224-V226 PolarHBondContact O-N 2.85Å; V226-Q228 VanDerWaalsContact C-N 3.34Å; V226-Q228 PolarHBondContact O-N 2.73Å; V226-N229 PolarHBondContact O-N 3.28Å; V226-Q230 HydrophobicContact CG1-CG 4.44Å; V226-Q230 WeakPolarHBondContact O-CB 3.49Å; V226-Q230 WeakPolarHBondContact O-CG 3.3Å; V226-Q230 PolarHBondContact O-N 3.28Å
227	R	92.8	Very high	92.3	Very high	159 Å²	159	103.2 Å²	103.2	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-59.2	-47	176.6	-72.6	-72.7	-173	158.9	2	111.1	V223 Y224 N229 Q230 E231	V223-R227 HydrophobicContact CG1-CG 4.3Å; V223-R227 WeakPolarHBondContact O-CB 3.42Å; V223-R227 WeakPolarHBondContact O-CG 3.35Å; V223-R227 PolarHBondContact O-N 3.12Å; Y224-R227 PolarHBondContact O-N 3.44Å; R227-N229 PolarHBondContact O-N 2.87Å; R227-Q230 PolarHBondContact O-N 2.83Å; R227-E231 WeakPolarHBondContact O-CG 3.49Å; R227-E231 PolarHBondContact O-N 2.86Å
228	Q	93.1	Very high	91.7	Very high	61 Å²	61	102.1 Å²	102.1	29%	0.285	49%	0.487	S	S	.	.	H	α-helix	trans	-57.5	-50.2	176.9	-175	66	28.2	0	0	111.8	Y224 V226 Q230 E231 D232	Y224-Q228 WeakPolarHBondContact O-CB 2.96Å; Y224-Q228 PolarHBondContact O-N 3.31Å; V226-Q228 VanDerWaalsContact C-N 3.34Å; V226-Q228 PolarHBondContact O-N 2.73Å; Q228-Q230 VanDerWaalsContact C-N 3.32Å; Q228-Q230 PolarHBondContact O-N 3.37Å; Q228-E231 PolarHBondContact O-N 2.85Å; Q228-D232 PolarHBondContact O-N 3.39Å
229	N	91.2	Very high	90.9	Very high	68 Å²	68	106.8 Å²	106.8	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-34.9	179.3	-80.2	-28	0	0	0	113	Y225 V226 R227 A233	Y225-N229 WeakPolarHBondContact CD1-ND2 3.19Å; Y225-N229 WeakPolarHBondContact CE1-ND2 3.48Å; Y225-N229 WeakPolarHBondContact O-CB 3.33Å; Y225-N229 PolarHBondContact O-N 3.48Å; Y225-N229 PolarHBondContact O-ND2 3.43Å; Y225-N229 PolarHBondContact OH-ND2 3.49Å; V226-N229 PolarHBondContact O-N 3.28Å; R227-N229 PolarHBondContact O-N 2.87Å; N229-A233 WeakPolarHBondContact O-CB 3.46Å; N229-A233 PolarHBondContact O-N 2.9Å
230	Q	90.8	Very high	90.1	Very high	119 Å²	119	107.3 Å²	107.3	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-66	-40.3	174.4	-76.1	-177.2	-20.1	0	0	111.8	V226 R227 Q228 R234	V226-Q230 HydrophobicContact CG1-CG 4.44Å; V226-Q230 WeakPolarHBondContact O-CB 3.49Å; V226-Q230 WeakPolarHBondContact O-CG 3.3Å; V226-Q230 PolarHBondContact O-N 3.28Å; R227-Q230 PolarHBondContact O-N 2.83Å; Q228-Q230 VanDerWaalsContact C-N 3.32Å; Q228-Q230 PolarHBondContact O-N 3.37Å; Q230-R234 WeakPolarHBondContact O-CB 3.14Å; Q230-R234 PolarHBondContact O-N 2.86Å
231	E	89.5	Confident	89.4	Confident	108 Å²	108	111.3 Å²	111.3	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-41.2	176.1	-72.6	177.6	-169.6	0	0	112.2	R227 Q228 R234 R235	R227-E231 WeakPolarHBondContact O-CG 3.49Å; R227-E231 PolarHBondContact O-N 2.86Å; Q228-E231 PolarHBondContact O-N 2.85Å; E231-R234 PolarHBondContact O-N 3.45Å; E231-R235 WeakPolarHBondContact O-CG 3.29Å; E231-R235 PolarHBondContact O-N 3.21Å
232	D	85.8	Confident	88.6	Confident	46 Å²	46	108.3 Å²	108.3	25%	0.246	51%	0.512	C	S	.	.	H	α-helix	trans	-63.2	-48.7	174.9	-76.2	-31.8	0	0	0	111.2	Q228 R234 R235 H236	Q228-D232 PolarHBondContact O-N 3.39Å; D232-R234 VanDerWaalsContact C-N 3.3Å; D232-R234 PolarHBondContact O-N 2.9Å; D232-R235 PolarHBondContact O-N 2.96Å; D232-R235 IonicContact OD1-CZ 3.97Å; D232-R235 IonicContact OD1-NE 3.83Å; D232-R235 IonicContact OD1-NH1 3.82Å; D232-R235 IonicContact OD1-NH2 2.61Å; D232-R235 PolarHBondContact OD1-NH2 2.98Å; D232-H236 PolarHBondContact O-CD2 3.31Å; D232-H236 PolarHBondContact O-N 2.87Å
233	A	87.4	Confident	87.8	Confident	61 Å²	61	109 Å²	109	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-59.7	-39.5	177.5	0	0	0	0	0	112.5	N229 H236 L237	N229-A233 WeakPolarHBondContact O-CB 3.46Å; N229-A233 PolarHBondContact O-N 2.9Å; A233-H236 PolarHBondContact O-N 3.43Å; A233-L237 PolarHBondContact O-N 3.45Å; A233-L237 VanDerWaalsContact O-N 3.1Å
234	R	88.8	Confident	86.7	Confident	177 Å²	177	111 Å²	111	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-62.4	-46.1	175.8	-175	178	178.8	162.4	3.4	111.6	Q230 E231 D232 H236 L237 E238	Q230-R234 WeakPolarHBondContact O-CB 3.14Å; Q230-R234 PolarHBondContact O-N 2.86Å; E231-R234 PolarHBondContact O-N 3.45Å; D232-R234 VanDerWaalsContact C-N 3.3Å; D232-R234 PolarHBondContact O-N 2.9Å; R234-H236 PolarHBondContact O-N 3.32Å; R234-L237 PolarHBondContact O-N 2.96Å; R234-E238 IonicContact NE-OE1 3.31Å; R234-E238 PolarHBondContact NE-OE1 3.49Å; R234-E238 PolarHBondContact O-N 3.39Å
235	R	84.4	Confident	85.2	Confident	141 Å²	141	109.3 Å²	109.3	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-43	176.7	-77.7	-173	-85.2	154.5	-10.3	112.1	E231 D232 L237 E238 Y239	E231-R235 WeakPolarHBondContact O-CG 3.29Å; E231-R235 PolarHBondContact O-N 3.21Å; D232-R235 PolarHBondContact O-N 2.96Å; D232-R235 IonicContact OD1-CZ 3.97Å; D232-R235 IonicContact OD1-NE 3.83Å; D232-R235 IonicContact OD1-NH1 3.82Å; D232-R235 IonicContact OD1-NH2 2.61Å; D232-R235 PolarHBondContact OD1-NH2 2.98Å; R235-L237 VanDerWaalsContact C-N 3.33Å; R235-L237 PolarHBondContact O-N 3.02Å; R235-E238 PolarHBondContact O-N 3.26Å; R235-Y239 PolarHBondContact O-N 2.84Å
236	H	84.9	Confident	83.5	Confident	125 Å²	125	113 Å²	113	58%	0.579	56%	0.556	S	S	*	*	H	α-helix	trans	-61.7	-39.2	176.3	-78.1	-70.9	0	0	0	112.9	D232 A233 R234 Y239 L240	D232-H236 PolarHBondContact O-CD2 3.31Å; D232-H236 PolarHBondContact O-N 2.87Å; A233-H236 PolarHBondContact O-N 3.43Å; R234-H236 PolarHBondContact O-N 3.32Å; H236-Y239 WeakPolarHBondContact O-CB 3.41Å; H236-Y239 PolarHBondContact O-N 3.14Å; H236-L240 WeakPolarHBondContact O-CG 3.14Å; H236-L240 PolarHBondContact O-N 2.92Å
237	L	84.3	Confident	81.4	Confident	97 Å²	97	115.8 Å²	115.8	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-71.4	-36	-179.8	-157.4	130.7	0	0	0	112.2	A233 R234 R235 L240 K241	A233-L237 PolarHBondContact O-N 3.45Å; A233-L237 VanDerWaalsContact O-N 3.1Å; R234-L237 PolarHBondContact O-N 2.96Å; R235-L237 VanDerWaalsContact C-N 3.33Å; R235-L237 PolarHBondContact O-N 3.02Å; L237-L240 PolarHBondContact O-N 2.73Å; L237-K241 HydrophobicContact CD2-CD 4.2Å; L237-K241 WeakPolarHBondContact O-CG 3.32Å; L237-K241 PolarHBondContact O-N 3.19Å; L237-K241 VanDerWaalsContact O-N 3.08Å
238	E	83.7	Confident	79.3	Confident	104 Å²	104	118.1 Å²	118.1	49%	0.486	59%	0.59	S	S	.	*	H	α-helix	trans	-65.3	-40.5	172.1	-72.5	174.1	-171.1	0	0	111.7	R234 R235 K241 S242	R234-E238 IonicContact NE-OE1 3.31Å; R234-E238 PolarHBondContact NE-OE1 3.49Å; R234-E238 PolarHBondContact O-N 3.39Å; R235-E238 PolarHBondContact O-N 3.26Å; E238-K241 PolarHBondContact O-N 2.87Å; E238-S242 PolarHBondContact O-N 3.49Å; E238-S242 VanDerWaalsContact O-N 3.14Å
239	Y	80.8	Confident	77	Confident	149 Å²	149	124.7 Å²	124.7	58%	0.584	62%	0.617	S	S	*	*	H	α-helix	trans	-59.1	-48	172.1	179.1	-96.2	0	0	0	111.9	R235 H236 K241 S242 L243	R235-Y239 PolarHBondContact O-N 2.84Å; H236-Y239 WeakPolarHBondContact O-CB 3.41Å; H236-Y239 PolarHBondContact O-N 3.14Å; Y239-K241 VanDerWaalsContact C-N 3.29Å; Y239-K241 PolarHBondContact O-N 3.04Å; Y239-S242 PolarHBondContact O-N 3.43Å; Y239-S242 VanDerWaalsContact O-N 3.08Å; Y239-S242 PolarHBondContact O-OG 3.02Å; Y239-L243 HydrophobicContact CE1-CD1 4.41Å
240	L	80.4	Confident	74.9	Confident	115 Å²	115	126.6 Å²	126.6	60%	0.602	63%	0.633	S	S	*	*	H	α-helix	trans	-61	-36	178.4	-72.3	172.6	0	0	0	112.9	H236 L237 S242 L243	H236-L240 WeakPolarHBondContact O-CG 3.14Å; H236-L240 PolarHBondContact O-N 2.92Å; L237-L240 PolarHBondContact O-N 2.73Å; L240-S242 VanDerWaalsContact C-N 3.32Å; L240-L243 HydrophobicContact CD2-CD1 3.96Å; L240-L243 PolarHBondContact O-N 3.09Å
241	K	80.6	Confident	72.9	Confident	160 Å²	160	127.9 Å²	127.9	70%	0.696	64%	0.644	S	S	*	*	H	α-helix	trans	-69.7	-27	175.5	-76.2	176.1	177.1	175.6	0	113.6	L237 E238 Y239 L243	L237-K241 HydrophobicContact CD2-CD 4.2Å; L237-K241 WeakPolarHBondContact O-CG 3.32Å; L237-K241 PolarHBondContact O-N 3.19Å; L237-K241 VanDerWaalsContact O-N 3.08Å; E238-K241 PolarHBondContact O-N 2.87Å; Y239-K241 VanDerWaalsContact C-N 3.29Å; Y239-K241 PolarHBondContact O-N 3.04Å; K241-L243 VanDerWaalsContact C-N 3.26Å; K241-L243 PolarHBondContact O-N 3.3Å
242	S	80.4	Confident	70.6	Confident	87 Å²	87	130.9 Å²	130.9	61%	0.608	66%	0.664	S	S	*	*	H	α-helix	trans	-76.7	-12.6	178.3	74.8	0	0	0	0	113.6	E238 Y239 L240	E238-S242 PolarHBondContact O-N 3.49Å; E238-S242 VanDerWaalsContact O-N 3.14Å; Y239-S242 PolarHBondContact O-N 3.43Å; Y239-S242 VanDerWaalsContact O-N 3.08Å; Y239-S242 PolarHBondContact O-OG 3.02Å; L240-S242 VanDerWaalsContact C-N 3.32Å
243	L	80.8	Confident	68.7	Low	89 Å²	89	132.9 Å²	132.9	47%	0.466	69%	0.687	S	S	.	*	S	Bend	trans	-70.5	134	177.5	-69.8	164.4	0	0	0	110.5	Y239 L240 K241 S245	Y239-L243 HydrophobicContact CE1-CD1 4.41Å; L240-L243 HydrophobicContact CD2-CD1 3.96Å; L240-L243 PolarHBondContact O-N 3.09Å; K241-L243 VanDerWaalsContact C-N 3.26Å; K241-L243 PolarHBondContact O-N 3.3Å; L243-S245 PolarHBondContact O-N 3.15Å
244	P	72.7	Confident	66.6	Low	122 Å²	122	137.8 Å²	137.8	79%	0.792	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-64.7	127.1	-179	23.7	-31.2	0	0	0	111.3
245	S	66.7	Low	64.5	Low	114 Å²	114	136.7 Å²	136.7	80%	0.797	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-70.4	133.6	175.2	59.8	0	0	0	0	111	L243	L243-S245 PolarHBondContact O-N 3.15Å
246	K	59.2	Low	62.8	Low	202 Å²	202	137.5 Å²	137.5	88%	0.878	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-58.8	138	173	-90.1	-178.6	175.1	177.1	0	111
247	P	50.9	Low	61	Low	127 Å²	127	136 Å²	136	83%	0.825	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-66.7	139.3	177.1	26.5	-32.1	0	0	0	111.4
248	K	49.5	Very low	59.4	Low	209 Å²	209	137.9 Å²	137.9	91%	0.909	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-72.3	123.3	175.2	-148.1	178.1	-175	-175.7	0	108.6
249	K	43.7	Very low	57.8	Low	198 Å²	198	138.5 Å²	138.5	86%	0.861	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-74.9	134.3	175.3	-124.7	-177.5	179.2	-170.6	0	109.4
250	P	48.3	Very low	56	Low	108 Å²	108	141.4 Å²	141.4	70%	0.701	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.4	141.7	175.4	31	-25.9	0	0	0	111.7
251	D	47.6	Very low	54.8	Low	147 Å²	147	142.8 Å²	142.8	79%	0.786	80%	0.797	S	S	*	*			trans	56.8	119.1	159.9	-52.9	-24.1	0	0	0	120.9
252	D	41.3	Very low	53.5	Low	170 Å²	170	141.8 Å²	141.8	91%	0.909	80%	0.803	S	S	*	*				-128.7	108.1	126.5	-78.8	-44.9	0	0	0	106.5
253	A	45.7	Very low	52	Low	89 Å²	89	144.9 Å²	144.9	74%	0.736	81%	0.813	S	S	*	*			trans	-82.9	128.7	161.8	0	0	0	0	0	107.2
254	D	44.3	Very low	50.3	Low	163 Å²	163	148.2 Å²	148.2	87%	0.872	83%	0.834	S	S	*	*			trans	-119.4	114	158.5	-92.3	-31.6	0	0	0	109
255	D	45.2	Very low	48.9	Very low	154 Å²	154	149.8 Å²	149.8	82%	0.824	84%	0.837	S	S	*	*			trans	-45.6	129.3	161.2	-90.5	-43.6	0	0	0	111.7
256	I	48.2	Very low	47.7	Very low	159 Å²	159	152.2 Å²	152.2	82%	0.815	84%	0.839	S	S	*	*			trans	-122.6	103.1	140.5	-76.5	-179.5	0	0	0	107.5
257	S	47.5	Very low	46.9	Very low	92 Å²	92	148.6 Å²	148.6	64%	0.643	84%	0.836	S	S	*	*			trans	-70.9	130.3	156.8	171.8	0	0	0	0	109.2
258	T	49.8	Very low	46.6	Very low	137 Å²	137	150.3 Å²	150.3	84%	0.84	84%	0.837	S	S	*	*			trans	-107.5	125	150.1	43.6	0	0	0	0	109.2
259	V	50.3	Low	46.3	Very low	117 Å²	117	145.4 Å²	145.4	71%	0.709	83%	0.831	S	S	*	*			trans	-77.2	144.5	-177.5	165.2	0	0	0	0	111.8
260	V	43.8	Very low	46.6	Very low	211 Å²	211	140.6 Å²	140.6	100%	1.279	83%	0.829	S	S	*	*			trans	61.2	0	154.7	178.4	0	0	0	0	119

Retrieved 260 of 260 residues in 237.3 ms (Link to these results)

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