A0A087XK93_POEFO Loading...

Myelin protein zero like 2

AlphaFold DB , UniProt , Accession A0A087XK93, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 204 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	50.1	Low	58.9	Low	231 Å²	231	114.3 Å²	114.3	100%	1.138	64%	0.641	S	S	*	*				0	-5.7	0	-67.4	167.7	75.2	0	0	114
2	C	56.1	Low	59.1	Low	116 Å²	116	113.8 Å²	113.8	78%	0.784	64%	0.635	S	S	*	*	H	α-helix	trans	-76.3	-26.6	-175.8	-68.1	0	0	0	0	116.9	L6	C2-L6 PolarHBondContact O-N 2.96Å
3	V	55.1	Low	59.3	Low	113 Å²	113	116.9 Å²	116.9	69%	0.685	64%	0.638	S	S	*	*	H	α-helix	trans	-75.5	-32.2	-171.7	-174.4	0	0	0	0	112.5	N7	V3-N7 PolarHBondContact O-N 3.2Å
4	K	53	Low	59.4	Low	174 Å²	174	111.4 Å²	111.4	76%	0.757	62%	0.622	S	S	*	*	H	α-helix	trans	-69.8	-35.7	178.5	-75.2	179.1	173.9	178.9	0	112.6	I8	K4-I8 WeakPolarHBondContact O-CG1 3.09Å; K4-I8 PolarHBondContact O-N 3.14Å
5	G	56.1	Low	59.4	Low	35 Å²	35	111.8 Å²	111.8	36%	0.361	62%	0.621	S	S	.	*	H	α-helix	trans	-69.4	-36.5	177.1	0	0	0	0	0	113	I8 I9	G5-I8 PolarHBondContact O-N 3.3Å; G5-I9 VanDerWaalsContact O-CG1 3.3Å; G5-I9 WeakPolarHBondContact O-CG1 3.44Å; G5-I9 PolarHBondContact O-N 3.2Å; G5-I9 VanDerWaalsContact O-N 3.09Å
6	L	58.4	Low	59.5	Low	124 Å²	124	110.1 Å²	110.1	65%	0.649	63%	0.627	S	S	*	*	H	α-helix	trans	-66.4	-39.6	179	-157.9	75.5	0	0	0	112.2	C2 I9 A10	C2-L6 PolarHBondContact O-N 2.96Å; L6-I9 PolarHBondContact O-N 2.9Å; L6-A10 WeakPolarHBondContact O-CB 3.34Å; L6-A10 PolarHBondContact O-N 3.47Å
7	N	59.1	Low	59.4	Low	106 Å²	106	108.4 Å²	108.4	57%	0.567	63%	0.629	S	S	*	*	H	α-helix	trans	-66.5	-37.7	175.6	-82.9	-13	0	0	0	112.6	V3 A10 V11	V3-N7 PolarHBondContact O-N 3.2Å; N7-A10 PolarHBondContact O-N 3.13Å; N7-V11 WeakPolarHBondContact O-CB 3.44Å; N7-V11 WeakPolarHBondContact O-CG2 3.37Å; N7-V11 PolarHBondContact O-N 3.43Å
8	I	62	Low	59.2	Low	106 Å²	106	106.8 Å²	106.8	54%	0.544	63%	0.625	S	S	.	*	H	α-helix	trans	-66.9	-42.1	177.5	-66.3	167.7	0	0	0	110.5	K4 G5 V11 L12	K4-I8 WeakPolarHBondContact O-CG1 3.09Å; K4-I8 PolarHBondContact O-N 3.14Å; G5-I8 PolarHBondContact O-N 3.3Å; I8-V11 PolarHBondContact O-N 3.09Å; I8-L12 HydrophobicContact CG2-CD1 3.89Å; I8-L12 WeakPolarHBondContact O-CB 3.47Å; I8-L12 WeakPolarHBondContact O-CG 3.39Å; I8-L12 PolarHBondContact O-N 3.4Å
9	I	65.1	Low	59	Low	99 Å²	99	103.9 Å²	103.9	51%	0.508	62%	0.62	S	S	.	*	H	α-helix	trans	-65.3	-40.7	176.8	-64.7	166.1	0	0	0	110.7	G5 L6 L12 F13	G5-I9 VanDerWaalsContact O-CG1 3.3Å; G5-I9 WeakPolarHBondContact O-CG1 3.44Å; G5-I9 PolarHBondContact O-N 3.2Å; G5-I9 VanDerWaalsContact O-N 3.09Å; L6-I9 PolarHBondContact O-N 2.9Å; I9-L12 PolarHBondContact O-N 3.14Å; I9-F13 HydrophobicContact CG2-CD2 4.17Å; I9-F13 WeakPolarHBondContact O-CB 3.24Å; I9-F13 PolarHBondContact O-N 3.4Å
10	A	66.3	Low	58.8	Low	60 Å²	60	105.7 Å²	105.7	50%	0.496	63%	0.631	S	S	.	*	H	α-helix	trans	-65.3	-38.8	176.3	0	0	0	0	0	112.6	L6 N7 G14	L6-A10 WeakPolarHBondContact O-CB 3.34Å; L6-A10 PolarHBondContact O-N 3.47Å; N7-A10 PolarHBondContact O-N 3.13Å; A10-G14 PolarHBondContact O-N 3.49Å
11	V	66.8	Low	58.5	Low	93 Å²	93	107.9 Å²	107.9	56%	0.564	64%	0.639	S	S	*	*	H	α-helix	trans	-67.4	-40.8	174.6	170.3	0	0	0	0	111.2	N7 I8 G14 L15	N7-V11 WeakPolarHBondContact O-CB 3.44Å; N7-V11 WeakPolarHBondContact O-CG2 3.37Å; N7-V11 PolarHBondContact O-N 3.43Å; I8-V11 PolarHBondContact O-N 3.09Å; V11-G14 PolarHBondContact O-N 3.4Å; V11-L15 HydrophobicContact CG1-CD1 3.99Å; V11-L15 WeakPolarHBondContact O-CB 3.35Å; V11-L15 PolarHBondContact O-N 3.21Å
12	L	61.4	Low	58.4	Low	109 Å²	109	105.9 Å²	105.9	57%	0.571	63%	0.627	S	S	*	*	H	α-helix	trans	-66.6	-40.4	175.9	-75.7	166.2	0	0	0	112.3	I8 I9 L15 A16	I8-L12 HydrophobicContact CG2-CD1 3.89Å; I8-L12 WeakPolarHBondContact O-CB 3.47Å; I8-L12 WeakPolarHBondContact O-CG 3.39Å; I8-L12 PolarHBondContact O-N 3.4Å; I9-L12 PolarHBondContact O-N 3.14Å; L12-L15 PolarHBondContact O-N 2.89Å; L12-A16 WeakPolarHBondContact O-CB 3.42Å; L12-A16 PolarHBondContact O-N 3.49Å
13	F	61.6	Low	58.4	Low	154 Å²	154	107 Å²	107	68%	0.675	63%	0.629	S	S	*	*	H	α-helix	trans	-66.7	-36.9	172.2	-107.1	-87.9	0	0	0	112	I9 A16 A17	I9-F13 HydrophobicContact CG2-CD2 4.17Å; I9-F13 WeakPolarHBondContact O-CB 3.24Å; I9-F13 PolarHBondContact O-N 3.4Å; F13-A16 PolarHBondContact O-N 2.87Å; F13-A17 WeakPolarHBondContact O-CB 3.4Å; F13-A17 PolarHBondContact O-N 3.45Å
14	G	60.7	Low	58.5	Low	40 Å²	40	104.6 Å²	104.6	41%	0.412	62%	0.618	S	S	.	*	H	α-helix	trans	-64.3	-41.5	174.7	0	0	0	0	0	113	A10 V11 A17 S18	A10-G14 PolarHBondContact O-N 3.49Å; V11-G14 PolarHBondContact O-N 3.4Å; G14-A17 PolarHBondContact O-N 3.15Å; G14-S18 WeakPolarHBondContact O-CB 3.39Å; G14-S18 PolarHBondContact O-N 3.5Å; G14-S18 PolarHBondContact O-OG 3.04Å
15	L	59.6	Low	59.4	Low	117 Å²	117	98 Å²	98	61%	0.613	60%	0.599	S	S	*	*	H	α-helix	trans	-70.1	-33.6	174.6	-85.9	155.5	0	0	0	113	V11 L12 S18	V11-L15 HydrophobicContact CG1-CD1 3.99Å; V11-L15 WeakPolarHBondContact O-CB 3.35Å; V11-L15 PolarHBondContact O-N 3.21Å; L12-L15 PolarHBondContact O-N 2.89Å; L15-S18 WeakPolarHBondContact CA-OG 3.4Å; L15-S18 PolarHBondContact O-OG 3.37Å
16	A	60.2	Low	60.8	Low	85 Å²	85	97.1 Å²	97.1	70%	0.702	59%	0.586	S	S	*	*	H	α-helix	trans	-72.9	-29.9	172.4	0	0	0	0	0	112.6	L12 F13	L12-A16 WeakPolarHBondContact O-CB 3.42Å; L12-A16 PolarHBondContact O-N 3.49Å; F13-A16 PolarHBondContact O-N 2.87Å
17	A	57.4	Low	62.4	Low	80 Å²	80	98.2 Å²	98.2	66%	0.661	58%	0.581	S	S	*	*	H	α-helix	trans	-87.1	-17.9	179.3	0	0	0	0	0	113.5	F13 G14 G19	F13-A17 WeakPolarHBondContact O-CB 3.4Å; F13-A17 PolarHBondContact O-N 3.45Å; G14-A17 PolarHBondContact O-N 3.15Å; A17-G19 PolarHBondContact O-N 3.42Å
18	S	56.8	Low	64	Low	81 Å²	81	94.4 Å²	94.4	57%	0.566	56%	0.562	S	S	*	*	S	Bend	trans	-71.2	73.3	169.4	55.2	0	0	0	0	110.8	G14 L15	G14-S18 WeakPolarHBondContact O-CB 3.39Å; G14-S18 PolarHBondContact O-N 3.5Å; G14-S18 PolarHBondContact O-OG 3.04Å; L15-S18 WeakPolarHBondContact CA-OG 3.4Å; L15-S18 PolarHBondContact O-OG 3.37Å
19	G	55.2	Low	65.6	Low	51 Å²	51	94.9 Å²	94.9	53%	0.526	56%	0.558	S	S	.	*			trans	59.2	85.3	141	0	0	0	0	0	116.1	A17 L21	A17-G19 PolarHBondContact O-N 3.42Å; G19-L21 PolarHBondContact O-N 2.85Å
20	V	54.7	Low	67.1	Low	140 Å²	140	92.4 Å²	92.4	85%	0.848	55%	0.547	S	S	*	.			trans	-64.6	83.8	138.8	-171.5	0	0	0	0	105.9	Q22	V20-Q22 PolarHBondContact O-N 3.43Å
21	L	53.9	Low	68.4	Low	151 Å²	151	92.6 Å²	92.6	79%	0.791	55%	0.545	S	S	*	.			trans	-55.7	110.3	163.4	-87	153.7	0	0	0	105.1	G19 V23	G19-L21 PolarHBondContact O-N 2.85Å; L21-V23 PolarHBondContact O-N 3Å
22	Q	47.1	Very low	69.7	Low	190 Å²	190	89.5 Å²	89.5	89%	0.888	53%	0.532	S	S	*	.			trans	-56.9	108.8	169.1	-80.6	-156.4	-45	0	0	106.5	V20 S24	V20-Q22 PolarHBondContact O-N 3.43Å; Q22-S24 PolarHBondContact O-N 3.27Å
23	V	56.1	Low	71.4	Confident	138 Å²	138	90.4 Å²	90.4	84%	0.836	54%	0.537	S	S	*	.			trans	-65.3	108.6	174.7	178.3	0	0	0	0	106	L21 G25	L21-V23 PolarHBondContact O-N 3Å; V23-G25 PolarHBondContact O-N 2.95Å
24	S	56.9	Low	73	Confident	63 Å²	63	84 Å²	84	44%	0.441	51%	0.511	S	S	.	.			trans	-55.4	118	168.9	-170.9	0	0	0	0	107.2	Q22 S51 D130	Q22-S24 PolarHBondContact O-N 3.27Å; S24-S51 WeakPolarHBondContact CA-OG 3.48Å; S24-S51 WeakPolarHBondContact CB-OG 3.4Å; S24-S51 PolarHBondContact OG-OG 3.19Å; S24-D130 PolarHBondContact OG-OD1 2.81Å
25	G	72.4	Confident	74.6	Confident	35 Å²	35	86.7 Å²	86.7	36%	0.361	51%	0.512	S	S	.	.			trans	-124.9	118.5	-170.1	0	0	0	0	0	110.9	V23 S51	V23-G25 PolarHBondContact O-N 2.95Å; G25-S51 PolarHBondContact N-OG 3.37Å; G25-S51 VanDerWaalsContact N-OG 3.15Å
26	M	86.1	Confident	76.3	Confident	17 Å²	17	81.4 Å²	81.4	8%	0.084	49%	0.486	C	S	.	.			trans	-74	138.1	166.8	179.3	68.4	73.5	0	0	109.6	F48 D49 N127 P134	M26-F48 HydrophobicContact CE-CD2 4.24Å; M26-F48 HydrophobicContact SD-CB 3.99Å; M26-F48 HydrophobicContact SD-CD2 3.77Å; M26-F48 HydrophobicContact SD-CG 4.3Å; M26-D49 CarbonylContact C-O 3.3Å; M26-D49 WeakPolarHBondContact CA-O 3.45Å; M26-D49 VanDerWaalsContact SD-O 3.4Å; M26-N127 HydrophobicContact CE-CB 3.38Å; M26-P134 WeakPolarHBondContact O-CD 3.2Å; M26-P134 VanDerWaalsContact O-CG 3.27Å; M26-P134 WeakPolarHBondContact O-CG 3.36Å
27	R	90	Very high	78	Confident	148 Å²	148	79 Å²	79	56%	0.558	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.3	171.1	-70.3	-174.9	-103.8	-121	-3.7	110.2	Y29 F48 D49	R27-Y29 HydrophobicContact CB-CE2 4.12Å; R27-F48 CarbonylContact O-C 3.39Å; R27-F48 WeakPolarHBondContact O-CA 3.45Å; R27-F48 WeakPolarHBondContact O-CB 3.32Å; R27-D49 HydrophobicContact CB-CB 4.38Å; R27-D49 PolarHBondContact N-O 3.27Å; R27-D49 PolarHBondContact O-N 3.34Å
28	V	93.5	Very high	79.8	Confident	25 Å²	25	78.5 Å²	78.5	15%	0.152	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.1	176.9	178.6	0	0	0	0	108.4	T30 T47 F48 P134	V28-T30 HydrophobicContact CG1-CG2 4.24Å; V28-T47 CarbonylContact C-O 3.5Å; V28-F48 HydrophobicContact CG2-CB 4.28Å; V28-P134 HydrophobicContact CB-CG 4.44Å; V28-P134 HydrophobicContact CG2-CG 4.23Å; V28-P134 VanDerWaalsContact CG2-O 3.25Å; V28-P134 WeakPolarHBondContact CG2-O 3.41Å
29	Y	95.2	Very high	81.7	Confident	117 Å²	117	76.9 Å²	76.9	46%	0.459	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.1	-179.3	-53.7	-83.7	0	0	0	109.5	R27 C46 T47 D49	R27-Y29 HydrophobicContact CB-CE2 4.12Å; Y29-C46 WeakPolarHBondContact O-CA 3.32Å; Y29-T47 PolarHBondContact N-O 3.49Å; Y29-T47 PolarHBondContact O-N 3.47Å; Y29-D49 HydrophobicContact CE2-CB 3.91Å
30	T	96.8	Very high	83.7	Confident	47 Å²	47	77.4 Å²	77.4	29%	0.288	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	166.9	177.7	67.3	0	0	0	0	111.1	V28 G32 K45 E137 I138	V28-T30 HydrophobicContact CG1-CG2 4.24Å; T30-G32 VanDerWaalsContact C-N 3.25Å; T30-G32 PolarHBondContact O-N 2.77Å; T30-K45 WeakPolarHBondContact CA-O 3.42Å; T30-E137 PolarHBondContact OG1-O 2.95Å; T30-I138 HydrophobicContact CG2-CD1 4.2Å; T30-I138 HydrophobicContact CG2-CG1 4.02Å
31	S	93.3	Very high	85.7	Confident	64 Å²	64	75 Å²	75	45%	0.448	42%	0.42	S	S	.	.			trans	-73.4	-10.4	175.5	-68.6	0	0	0	0	114.4	D33	S31-D33 PolarHBondContact O-N 3.37Å
32	G	95.2	Very high	87.8	Confident	28 Å²	28	68.6 Å²	68.6	29%	0.289	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.7	-108.4	-174.8	0	0	0	0	0	111.6	T30 I138 R139	T30-G32 VanDerWaalsContact C-N 3.25Å; T30-G32 PolarHBondContact O-N 2.77Å; G32-I138 CarbonylContact O-C 3.6Å; G32-I138 WeakPolarHBondContact O-CA 3.39Å; G32-I138 WeakPolarHBondContact O-CG2 3.3Å; G32-R139 PolarHBondContact O-N 3.37Å
33	D	95.8	Very high	90.2	Very high	127 Å²	127	65.3 Å²	65.3	68%	0.679	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.2	177.6	-67.1	-61.2	0	0	0	111.3	S31 R139	S31-D33 PolarHBondContact O-N 3.37Å; D33-R139 VanDerWaalsContact OD1-CB 3.3Å; D33-R139 WeakPolarHBondContact OD1-CB 3.4Å; D33-R139 WeakPolarHBondContact OD1-CD 3.49Å
34	V	95.8	Very high	92.2	Very high	20 Å²	20	58.7 Å²	58.7	12%	0.121	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.9	179.1	179.7	0	0	0	0	109.3	V42 I138 R139 L140 R141	V34-V42 HydrophobicContact CG1-CG2 3.57Å; V34-I138 HydrophobicContact CB-CG2 4.33Å; V34-I138 HydrophobicContact CG2-CG2 3.77Å; V34-R139 PolarHBondContact N-O 2.88Å; V34-L140 HydrophobicContact CB-CD1 4.16Å; V34-L140 HydrophobicContact CG1-CD1 3.93Å; V34-L140 CarbonylContact O-C 3.57Å; V34-L140 WeakPolarHBondContact O-CA 3.43Å; V34-R141 PolarHBondContact O-N 3.41Å
35	E	95.1	Very high	94.1	Very high	96 Å²	96	60.3 Å²	60.3	45%	0.449	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.7	170.3	-65.4	-162.1	130.5	0	0	111	R141 S147	E35-R141 CarbonylContact C-O 3.5Å; E35-R141 VanDerWaalsContact CA-O 3.26Å; E35-R141 WeakPolarHBondContact CA-O 3.05Å; E35-R141 HydrophobicContact CG-CB 4.33Å; E35-R141 WeakPolarHBondContact OE1-CD 3.01Å; E35-S147 WeakPolarHBondContact OE2-CB 3.36Å; E35-S147 PolarHBondContact OE2-OG 3.22Å
36	A	95.4	Very high	95.3	Very high	7 Å²	7	58.7 Å²	58.7	6%	0.058	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	146	176.6	0	0	0	0	0	110.9	V42 V113 L140 R141 V142 V143	A36-V42 HydrophobicContact CB-CB 3.86Å; A36-V42 HydrophobicContact CB-CG1 4.26Å; A36-V42 HydrophobicContact CB-CG2 4Å; A36-V113 HydrophobicContact CB-CG2 3.87Å; A36-L140 HydrophobicContact CB-CD1 4.07Å; A36-R141 PolarHBondContact N-O 2.92Å; A36-V142 CarbonylContact O-C 3.59Å; A36-V142 WeakPolarHBondContact O-CA 3.32Å; A36-V143 WeakPolarHBondContact O-CG2 3.44Å; A36-V143 PolarHBondContact O-N 2.84Å
37	V	95.1	Very high	95.8	Very high	35 Å²	35	59.3 Å²	59.3	21%	0.212	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	138.9	178.5	-178.7	0	0	0	0	109.2	G39 T40 V113 V143 A146	V37-G39 PolarHBondContact O-N 3.27Å; V37-T40 HydrophobicContact CB-CG2 3.91Å; V37-T40 HydrophobicContact CG1-CG2 4.44Å; V37-T40 PolarHBondContact N-OG1 2.81Å; V37-T40 PolarHBondContact O-N 3.41Å; V37-T40 PolarHBondContact O-OG1 3.16Å; V37-V113 WeakPolarHBondContact O-CG2 3.18Å; V37-V143 WeakPolarHBondContact CA-O 3.37Å; V37-V143 HydrophobicContact CG2-CG2 4.18Å; V37-A146 HydrophobicContact CG2-CB 3.92Å
38	N	96.4	Very high	96	Very high	68 Å²	68	52.7 Å²	52.7	36%	0.364	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	127.8	176.3	-176.3	14.2	0	0	0	111	V113 F115 V142 V143	N38-V113 CarbonylContact C-O 3.54Å; N38-V113 WeakPolarHBondContact CA-O 3.19Å; N38-V113 PolarHBondContact OD1-O 2.92Å; N38-F115 HydrophobicContact CB-CE1 4.12Å; N38-F115 HydrophobicContact CB-CE2 4.18Å; N38-F115 HydrophobicContact CB-CZ 3.77Å; N38-F115 WeakPolarHBondContact ND2-CE2 3.37Å; N38-V142 HydrophobicContact CB-CG1 3.99Å; N38-V143 PolarHBondContact N-O 2.9Å
39	G	95.6	Very high	95.9	Very high	47 Å²	47	54.9 Å²	54.9	49%	0.485	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-7.9	-177.4	0	0	0	0	0	115.2	V37 V113	V37-G39 PolarHBondContact O-N 3.27Å; G39-V113 PolarHBondContact N-O 2.85Å
40	T	96.4	Very high	95.6	Very high	62 Å²	62	50.1 Å²	50.1	38%	0.38	28%	0.284	S	S	.	.	S	Bend	trans	-91.3	167	176.1	68	0	0	0	0	112.2	V37 E112 V113	V37-T40 HydrophobicContact CB-CG2 3.91Å; V37-T40 HydrophobicContact CG1-CG2 4.44Å; V37-T40 PolarHBondContact N-OG1 2.81Å; V37-T40 PolarHBondContact O-N 3.41Å; V37-T40 PolarHBondContact O-OG1 3.16Å; T40-E112 PolarHBondContact O-N 3.01Å; T40-V113 WeakPolarHBondContact O-CG2 3.24Å; T40-V113 PolarHBondContact O-N 3.04Å
41	D	97.4	Very high	95	Very high	90 Å²	90	51.7 Å²	51.7	48%	0.481	30%	0.296	S	S	.	.			trans	-89	145	170.6	-66.5	-1.1	0	0	0	109.9	I109 L110 R111 E112	D41-I109 HydrophobicContact CB-CG2 4.32Å; D41-L110 CarbonylContact C-O 3.58Å; D41-L110 WeakPolarHBondContact CA-O 3.5Å; D41-R111 WeakPolarHBondContact OD1-CA 3.46Å; D41-E112 PolarHBondContact OD1-N 3.46Å
42	V	97.1	Very high	94.7	Very high	16 Å²	16	49.4 Å²	49.4	10%	0.097	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.9	175.5	68.8	0	0	0	0	110.6	V34 A36 L44 I109 L110 V113 L140	V34-V42 HydrophobicContact CG1-CG2 3.57Å; A36-V42 HydrophobicContact CB-CB 3.86Å; A36-V42 HydrophobicContact CB-CG1 4.26Å; A36-V42 HydrophobicContact CB-CG2 4Å; V42-L44 HydrophobicContact CG1-CD2 4.37Å; V42-I109 CarbonylContact O-C 3.57Å; V42-I109 WeakPolarHBondContact O-CA 3.45Å; V42-L110 HydrophobicContact CG1-CB 3.86Å; V42-L110 HydrophobicContact CG1-CD1 4.36Å; V42-L110 PolarHBondContact N-O 3.24Å; V42-L110 PolarHBondContact O-N 3.48Å; V42-V113 HydrophobicContact CB-CG1 4.38Å; V42-V113 HydrophobicContact CG1-CG1 3.54Å; V42-L140 HydrophobicContact CG1-CD1 4.19Å; V42-L140 HydrophobicContact CG1-CD2 4.44Å; V42-L140 HydrophobicContact CG2-CD1 4.35Å
43	R	97.8	Very high	94.5	Very high	121 Å²	121	57.4 Å²	57.4	46%	0.457	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.7	173.2	-170.9	177.4	-168.9	-154.1	-2.3	109.3	K45 A98 D105 I109	R43-K45 PolarHBondContact O-N 2.89Å; R43-A98 PolarHBondContact NH2-O 2.89Å; R43-D105 IonicContact CZ-OD2 3.75Å; R43-D105 IonicContact NH2-OD1 3.77Å; R43-D105 IonicContact NH2-OD2 2.7Å; R43-D105 PolarHBondContact NH2-OD2 3.29Å; R43-I109 HydrophobicContact CB-CG1 4.23Å; R43-I109 HydrophobicContact CG-CG1 4.18Å
44	L	98.1	Very high	94.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	100.4	171	-58.3	-173.3	0	0	0	108.3	V42 C46 W63 S107 I108 L110 Y121 I138 L140	V42-L44 HydrophobicContact CG1-CD2 4.37Å; L44-C46 PolarHBondContact O-N 3.34Å; L44-W63 HydrophobicContact CB-CH2 3.69Å; L44-W63 HydrophobicContact CB-CZ2 4.48Å; L44-W63 HydrophobicContact CB-CZ3 4.03Å; L44-W63 HydrophobicContact CD1-CZ3 4.11Å; L44-S107 WeakPolarHBondContact O-CA 3.35Å; L44-S107 WeakPolarHBondContact O-CB 3.38Å; L44-I108 HydrophobicContact CB-CG1 4.02Å; L44-I108 HydrophobicContact CD1-CD1 4.2Å; L44-I108 HydrophobicContact CD1-CG1 4.3Å; L44-I108 HydrophobicContact CG-CG1 4.48Å; L44-I108 PolarHBondContact N-O 2.88Å; L44-I108 PolarHBondContact O-N 3.01Å; L44-L110 HydrophobicContact CD1-CD1 3.63Å; L44-L110 HydrophobicContact CD1-CG 4.2Å; L44-L110 HydrophobicContact CG-CD1 4.16Å; L44-Y121 HydrophobicContact CD1-CD1 3.49Å; L44-Y121 VanDerWaalsContact CD1-CD1 3.49Å; L44-Y121 HydrophobicContact CD1-CD2 4.11Å; L44-Y121 HydrophobicContact CD1-CE1 4.04Å; L44-Y121 HydrophobicContact CD1-CG 3.53Å; L44-I138 HydrophobicContact CB-CD1 4Å; L44-I138 HydrophobicContact CD2-CG2 4.03Å; L44-L140 HydrophobicContact CD2-CD1 4.36Å
45	K	97.9	Very high	94	Very high	97 Å²	97	55.1 Å²	55.1	42%	0.422	30%	0.295	S	S	.	.			trans	-74	123.3	-176.1	-172.9	177.9	177.5	-178.8	0	110.8	T30 R43 T47 S107 I138	T30-K45 WeakPolarHBondContact CA-O 3.42Å; R43-K45 PolarHBondContact O-N 2.89Å; K45-T47 HydrophobicContact CG-CG2 4.41Å; K45-S107 WeakPolarHBondContact CA-OG 3.22Å; K45-I138 WeakPolarHBondContact O-CD1 3.33Å
46	C	97.3	Very high	93.7	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	112.6	169.7	-179.3	0	0	0	0	108.1	Y29 L44 W63 A106 S107 C123	Y29-C46 WeakPolarHBondContact O-CA 3.32Å; L44-C46 PolarHBondContact O-N 3.34Å; C46-W63 HydrophobicContact CB-CH2 3.86Å; C46-W63 HydrophobicContact CB-CZ2 3.42Å; C46-W63 VanDerWaalsContact CB-CZ2 3.42Å; C46-A106 HydrophobicContact CB-CB 4.32Å; C46-A106 CarbonylContact O-C 3.53Å; C46-A106 WeakPolarHBondContact O-CA 3.34Å; C46-A106 PolarHBondContact O-N 3.37Å; C46-S107 PolarHBondContact N-OG 2.92Å; C46-S107 PolarHBondContact O-N 2.98Å; C46-S107 PolarHBondContact O-OG 3.34Å; C46-C123 HydrophobicContact CB-CB 3.67Å; C46-C123 WeakPolarHBondContact CB-SG 3.41Å; C46-C123 WeakPolarHBondContact SG-CB 3.17Å; C46-C123 CovalentContact SG-SG 2.04Å; C46-C123 PolarHBondContact SG-SG 3.43Å
47	T	96.7	Very high	93.4	Very high	31 Å²	31	56.6 Å²	56.6	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	150	174.8	52.9	0	0	0	0	108.9	V28 Y29 K45 S104 D105	V28-T47 CarbonylContact C-O 3.5Å; Y29-T47 PolarHBondContact N-O 3.49Å; Y29-T47 PolarHBondContact O-N 3.47Å; K45-T47 HydrophobicContact CG-CG2 4.41Å; T47-S104 CarbonylContact C-O 3.47Å; T47-S104 VanDerWaalsContact CA-O 3.25Å; T47-S104 WeakPolarHBondContact CA-O 3.28Å; T47-S104 WeakPolarHBondContact CB-O 3.5Å; T47-D105 HydrophobicContact CG2-CB 4.32Å
48	F	93.7	Very high	93.2	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.035	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	161.7	-178.4	65.4	-85.1	0	0	0	111.9	M26 R27 V28 I54 S104 A106 V125	M26-F48 HydrophobicContact CE-CD2 4.24Å; M26-F48 HydrophobicContact SD-CB 3.99Å; M26-F48 HydrophobicContact SD-CD2 3.77Å; M26-F48 HydrophobicContact SD-CG 4.3Å; R27-F48 CarbonylContact O-C 3.39Å; R27-F48 WeakPolarHBondContact O-CA 3.45Å; R27-F48 WeakPolarHBondContact O-CB 3.32Å; V28-F48 HydrophobicContact CG2-CB 4.28Å; F48-I54 HydrophobicContact CE2-CD1 3.7Å; F48-I54 HydrophobicContact CE2-CG1 4.2Å; F48-I54 HydrophobicContact CZ-CD1 4.12Å; F48-S104 WeakPolarHBondContact CD1-O 3.09Å; F48-S104 PolarHBondContact N-O 2.86Å; F48-S104 WeakPolarHBondContact O-CB 3.37Å; F48-A106 HydrophobicContact CD1-CB 4.19Å; F48-A106 HydrophobicContact CE1-CB 4.38Å; F48-V125 HydrophobicContact CB-CB 4.46Å; F48-V125 HydrophobicContact CB-CG1 4.41Å; F48-V125 HydrophobicContact CB-CG2 4.36Å; F48-V125 HydrophobicContact CD1-CB 4.43Å; F48-V125 HydrophobicContact CD1-CG1 3.83Å; F48-V125 HydrophobicContact CD1-CG2 4.04Å; F48-V125 HydrophobicContact CD2-CG1 4.02Å; F48-V125 HydrophobicContact CE1-CG1 4.02Å; F48-V125 HydrophobicContact CE2-CG1 4.2Å; F48-V125 HydrophobicContact CG-CB 4.37Å; F48-V125 HydrophobicContact CG-CG1 3.83Å; F48-V125 HydrophobicContact CG-CG2 4.34Å; F48-V125 HydrophobicContact CZ-CG1 4.2Å
49	D	91.4	Very high	93	Very high	72 Å²	72	56 Å²	56	39%	0.385	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.2	175.5	177.5	26.3	0	0	0	107.6	M26 R27 Y29	M26-D49 CarbonylContact C-O 3.3Å; M26-D49 WeakPolarHBondContact CA-O 3.45Å; M26-D49 VanDerWaalsContact SD-O 3.4Å; R27-D49 HydrophobicContact CB-CB 4.38Å; R27-D49 PolarHBondContact N-O 3.27Å; R27-D49 PolarHBondContact O-N 3.34Å; Y29-D49 HydrophobicContact CE2-CB 3.91Å
50	S	88.8	Confident	92.9	Very high	17 Å²	17	56.3 Å²	56.3	12%	0.119	29%	0.289	C	S	.	.			trans	-130.8	133.9	-172	174.9	0	0	0	0	108.6	A52 N127 D130	S50-A52 VanDerWaalsContact C-N 3.25Å; S50-A52 PolarHBondContact OG-N 2.87Å; S50-A52 PolarHBondContact OG-O 3.34Å; S50-N127 PolarHBondContact OG-ND2 3.33Å; S50-D130 PolarHBondContact OG-OD2 3.49Å
51	S	85.4	Confident	92.9	Very high	79 Å²	79	53.3 Å²	53.3	55%	0.552	27%	0.271	S	S	*	.	S	Bend	trans	-73.7	-19.2	172	31.4	0	0	0	0	112.7	S24 G25	S24-S51 WeakPolarHBondContact CA-OG 3.48Å; S24-S51 WeakPolarHBondContact CB-OG 3.4Å; S24-S51 PolarHBondContact OG-OG 3.19Å; G25-S51 PolarHBondContact N-OG 3.37Å; G25-S51 VanDerWaalsContact N-OG 3.15Å
52	A	86.9	Confident	92.8	Very high	17 Å²	17	50.4 Å²	50.4	14%	0.14	26%	0.257	C	S	.	.	S	Bend	trans	-82.8	150	173.1	0	0	0	0	0	111.6	S50 I54 N127	S50-A52 VanDerWaalsContact C-N 3.25Å; S50-A52 PolarHBondContact OG-N 2.87Å; S50-A52 PolarHBondContact OG-O 3.34Å; A52-I54 PolarHBondContact O-N 2.92Å; A52-N127 PolarHBondContact O-ND2 3.18Å
53	K	89.4	Confident	92.8	Very high	195 Å²	195	49.7 Å²	49.7	85%	0.848	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-62.3	128.9	173.6	-174	177.7	-178.8	-179.5	0	109.7	N55	K53-N55 PolarHBondContact O-N 3.28Å
54	I	91.1	Very high	92.7	Very high	31 Å²	31	45.7 Å²	45.7	16%	0.159	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-73.1	123.7	177.8	-62.2	174.9	0	0	0	109.4	F48 A52 V59 I101 M102 S104	F48-I54 HydrophobicContact CE2-CD1 3.7Å; F48-I54 HydrophobicContact CE2-CG1 4.2Å; F48-I54 HydrophobicContact CZ-CD1 4.12Å; A52-I54 PolarHBondContact O-N 2.92Å; I54-V59 HydrophobicContact CG2-CG2 4.02Å; I54-I101 HydrophobicContact CG2-CG2 3.89Å; I54-M102 HydrophobicContact CG2-SD 4.47Å; I54-S104 VanDerWaalsContact CD1-OG 3.24Å; I54-S104 WeakPolarHBondContact CD1-OG 3.38Å
55	N	90.6	Very high	92.7	Very high	69 Å²	69	45.8 Å²	45.8	37%	0.369	24%	0.242	S	C	.	.			trans	-116.1	108.1	167.1	-177.8	-4.8	0	0	0	109	K53 E57 L58 V59	K53-N55 PolarHBondContact O-N 3.28Å; N55-E57 PolarHBondContact O-N 2.9Å; N55-E57 WeakPolarHBondContact OD1-CB 3.42Å; N55-E57 PolarHBondContact OD1-N 3.35Å; N55-L58 HydrophobicContact CB-CB 4.31Å; N55-L58 HydrophobicContact CB-CD1 4.14Å; N55-L58 HydrophobicContact CB-CG 4.24Å; N55-L58 WeakPolarHBondContact ND2-CD1 3.36Å; N55-L58 PolarHBondContact O-N 3.39Å; N55-V59 WeakPolarHBondContact O-CG2 3.28Å; N55-V59 PolarHBondContact O-N 2.97Å; N55-V59 VanDerWaalsContact O-N 3.07Å
56	P	88.5	Confident	92.6	Very high	31 Å²	31	46 Å²	46	20%	0.201	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-25.9	-177.9	-27.7	35.8	0	0	0	114.9	L58 I101 M102	P56-L58 VanDerWaalsContact C-N 3.3Å; P56-I101 HydrophobicContact CB-CG2 4.23Å; P56-I101 HydrophobicContact CG-CG2 4.38Å; P56-M102 HydrophobicContact CG-CG 3.78Å; P56-M102 HydrophobicContact CG-SD 3.26Å; P56-M102 WeakPolarHBondContact CG-SD 3.39Å
57	E	90.1	Very high	92.5	Very high	102 Å²	102	47.6 Å²	47.6	48%	0.477	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-23	178.4	-62	-61.2	147.8	0	0	113.2	N55 Q81	N55-E57 PolarHBondContact O-N 2.9Å; N55-E57 WeakPolarHBondContact OD1-CB 3.42Å; N55-E57 PolarHBondContact OD1-N 3.35Å; E57-Q81 VanDerWaalsContact OE2-CD 3.27Å; E57-Q81 VanDerWaalsContact OE2-CG 3.25Å; E57-Q81 WeakPolarHBondContact OE2-CG 3.43Å; E57-Q81 PolarHBondContact OE2-NE2 3.27Å
58	L	91.1	Very high	92.3	Very high	90 Å²	90	52.2 Å²	52.2	47%	0.471	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-21.5	-176.8	-60.3	179.2	0	0	0	112.9	N55 P56 I60 P128	N55-L58 HydrophobicContact CB-CB 4.31Å; N55-L58 HydrophobicContact CB-CD1 4.14Å; N55-L58 HydrophobicContact CB-CG 4.24Å; N55-L58 WeakPolarHBondContact ND2-CD1 3.36Å; N55-L58 PolarHBondContact O-N 3.39Å; P56-L58 VanDerWaalsContact C-N 3.3Å; L58-I60 PolarHBondContact O-N 3.21Å; L58-P128 HydrophobicContact CB-CG 4.49Å; L58-P128 WeakPolarHBondContact O-CD 3.36Å
59	V	92.6	Very high	92	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.313	C	S	.	.			trans	-67.1	131.1	179.8	172.6	0	0	0	0	110.3	I54 N55 V61 I101 V125 T126 N127	I54-V59 HydrophobicContact CG2-CG2 4.02Å; N55-V59 WeakPolarHBondContact O-CG2 3.28Å; N55-V59 PolarHBondContact O-N 2.97Å; N55-V59 VanDerWaalsContact O-N 3.07Å; V59-V61 HydrophobicContact CG1-CG2 4.19Å; V59-I101 HydrophobicContact CB-CG2 3.92Å; V59-I101 HydrophobicContact CG1-CD1 4.17Å; V59-I101 HydrophobicContact CG1-CG2 3.96Å; V59-I101 HydrophobicContact CG2-CG2 4Å; V59-V125 HydrophobicContact CG1-CG1 4.26Å; V59-T126 WeakPolarHBondContact CA-O 2.97Å; V59-N127 HydrophobicContact CG2-CB 4.18Å; V59-N127 WeakPolarHBondContact CG2-OD1 3.37Å
60	I	93.6	Very high	91.7	Very high	54 Å²	54	55.6 Å²	55.6	28%	0.277	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.2	174.8	-60.7	168.8	0	0	0	108.3	L58 H78 Y79 Q80 V125 T126	L58-I60 PolarHBondContact O-N 3.21Å; I60-H78 WeakPolarHBondContact CG2-NE2 3.43Å; I60-Y79 WeakPolarHBondContact CA-O 3.11Å; I60-Q80 HydrophobicContact CG1-CG 4.42Å; I60-V125 WeakPolarHBondContact O-CA 3.39Å; I60-T126 PolarHBondContact N-O 3.33Å; I60-T126 PolarHBondContact O-N 3.08Å
61	V	95.1	Very high	91.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.8	170.4	-176.8	0	0	0	0	108.1	V59 H78 Y79 I101 A106 Q124 V125	V59-V61 HydrophobicContact CG1-CG2 4.19Å; V61-H78 CarbonylContact O-C 3.46Å; V61-H78 WeakPolarHBondContact O-CA 3.21Å; V61-H78 PolarHBondContact O-CD2 3.41Å; V61-Y79 PolarHBondContact N-O 3.44Å; V61-Y79 PolarHBondContact O-N 2.93Å; V61-I101 HydrophobicContact CG2-CD1 3.84Å; V61-A106 HydrophobicContact CG1-CB 3.85Å; V61-A106 HydrophobicContact CG2-CB 3.98Å; V61-Q124 WeakPolarHBondContact CA-O 3.41Å; V61-V125 HydrophobicContact CG1-CG2 4.42Å; V61-V125 HydrophobicContact CG2-CG1 4.4Å; V61-V125 HydrophobicContact CG2-CG2 4.32Å
62	S	95.3	Very high	91.9	Very high	29 Å²	29	64.2 Å²	64.2	20%	0.203	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.7	171.7	66.1	0	0	0	0	110.5	Q124	S62-Q124 PolarHBondContact N-O 3.49Å; S62-Q124 PolarHBondContact O-N 3.47Å
63	W	97.4	Very high	92.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.2	172.8	-80.4	87.4	0	0	0	109.9	L44 C46 I76 F77 A106 I108 T122 C123 I138	L44-W63 HydrophobicContact CB-CH2 3.69Å; L44-W63 HydrophobicContact CB-CZ2 4.48Å; L44-W63 HydrophobicContact CB-CZ3 4.03Å; L44-W63 HydrophobicContact CD1-CZ3 4.11Å; C46-W63 HydrophobicContact CB-CH2 3.86Å; C46-W63 HydrophobicContact CB-CZ2 3.42Å; C46-W63 VanDerWaalsContact CB-CZ2 3.42Å; W63-I76 HydrophobicContact CB-CD1 4.32Å; W63-I76 HydrophobicContact CB-CG1 3.85Å; W63-I76 WeakPolarHBondContact O-CG1 3.45Å; W63-I76 PolarHBondContact O-N 3.32Å; W63-F77 HydrophobicContact CB-CB 4.03Å; W63-F77 AromaticContact CD1-CD1 3.77Å; W63-F77 PolarHBondContact N-O 3.06Å; W63-F77 PolarHBondContact O-N 3.49Å; W63-A106 PolarHBondContact NE1-O 2.97Å; W63-I108 HydrophobicContact CB-CD1 4.29Å; W63-I108 HydrophobicContact CD2-CD1 3.62Å; W63-I108 HydrophobicContact CD2-CG1 3.99Å; W63-I108 HydrophobicContact CE3-CD1 3.85Å; W63-I108 HydrophobicContact CE3-CG1 4.32Å; W63-I108 HydrophobicContact CG-CD1 3.85Å; W63-I108 HydrophobicContact CG-CG1 4.47Å; W63-I108 HydrophobicContact CG-CG2 4.37Å; W63-I108 HydrophobicContact CH2-CG1 4.27Å; W63-I108 HydrophobicContact CZ2-CD1 4.48Å; W63-I108 HydrophobicContact CZ2-CG1 3.95Å; W63-I108 HydrophobicContact CZ3-CD1 4.38Å; W63-I108 HydrophobicContact CZ3-CG1 4.46Å; W63-T122 CarbonylContact C-O 3.55Å; W63-T122 VanDerWaalsContact CA-O 3.25Å; W63-T122 WeakPolarHBondContact CA-O 3.07Å; W63-C123 HydrophobicContact CD2-CB 4.02Å; W63-C123 HydrophobicContact CE3-CB 4.07Å; W63-C123 HydrophobicContact CH2-CB 3.76Å; W63-C123 HydrophobicContact CZ2-CB 3.68Å; W63-C123 HydrophobicContact CZ3-CB 3.93Å; W63-I138 HydrophobicContact CH2-CD1 3.63Å; W63-I138 HydrophobicContact CZ3-CD1 3.93Å
64	T	96.4	Very high	92.4	Very high	37 Å²	37	61.8 Å²	61.8	23%	0.227	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	154.6	175	63	0	0	0	0	111.6	V73 D74 Y121 T122	T64-V73 HydrophobicContact CG2-CG1 4.14Å; T64-D74 CarbonylContact C-O 3.58Å; T64-D74 WeakPolarHBondContact CA-O 3.4Å; T64-D74 WeakPolarHBondContact CB-O 3.17Å; T64-Y121 CarbonylContact O-C 3.47Å; T64-Y121 WeakPolarHBondContact O-CA 3.28Å; T64-T122 PolarHBondContact N-O 3.39Å; T64-T122 PolarHBondContact O-N 2.88Å; T64-T122 WeakPolarHBondContact OG1-CB 3.3Å
65	F	96.9	Very high	92.6	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.009	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.3	178.2	169.1	-108.9	0	0	0	110.6	P67 V73 D74 I76 I90 F91 Y117 Y121	F65-P67 HydrophobicContact CD1-CG 4.36Å; F65-P67 HydrophobicContact CE1-CB 4.24Å; F65-P67 HydrophobicContact CE1-CG 3.69Å; F65-P67 HydrophobicContact CZ-CB 4.27Å; F65-P67 HydrophobicContact CZ-CG 4.21Å; F65-V73 WeakPolarHBondContact O-CA 3.47Å; F65-D74 PolarHBondContact N-O 2.98Å; F65-D74 PolarHBondContact O-N 3.47Å; F65-I76 HydrophobicContact CB-CD1 4.34Å; F65-I76 HydrophobicContact CB-CG2 3.58Å; F65-I90 HydrophobicContact CE1-CD1 4.45Å; F65-F91 HydrophobicContact CB-CE2 4.05Å; F65-F91 HydrophobicContact CB-CZ 4.19Å; F65-F91 AromaticContact CD1-CE2 3.42Å; F65-F91 HydrophobicContact CD1-CE2 3.42Å; F65-F91 VanDerWaalsContact CD1-CE2 3.42Å; F65-F91 AromaticContact CD1-CZ 3.74Å; F65-F91 HydrophobicContact CD1-CZ 3.74Å; F65-F91 HydrophobicContact CD2-CE2 4.43Å; F65-F91 AromaticContact CD2-CZ 3.94Å; F65-F91 HydrophobicContact CD2-CZ 3.94Å; F65-F91 AromaticContact CE1-CE2 3.86Å; F65-F91 HydrophobicContact CE1-CE2 3.86Å; F65-F91 AromaticContact CE1-CZ 3.98Å; F65-F91 HydrophobicContact CE1-CZ 3.98Å; F65-F91 HydrophobicContact CE2-CZ 4.2Å; F65-F91 AromaticContact CG-CE2 3.72Å; F65-F91 HydrophobicContact CG-CE2 3.72Å; F65-F91 AromaticContact CG-CZ 3.68Å; F65-F91 HydrophobicContact CG-CZ 3.68Å; F65-F91 HydrophobicContact CZ-CZ 4.21Å; F65-Y117 WeakPolarHBondContact CE2-O 3.24Å; F65-Y121 HydrophobicContact CB-CD1 4.41Å; F65-Y121 HydrophobicContact CB-CE1 4.24Å; F65-Y121 HydrophobicContact CD2-CD1 4.17Å; F65-Y121 HydrophobicContact CD2-CD2 4.18Å; F65-Y121 AromaticContact CD2-CE1 3.67Å; F65-Y121 HydrophobicContact CD2-CE1 3.67Å; F65-Y121 AromaticContact CD2-CE2 3.65Å; F65-Y121 HydrophobicContact CD2-CE2 3.65Å; F65-Y121 HydrophobicContact CD2-CG 4.4Å; F65-Y121 AromaticContact CD2-CZ 3.38Å; F65-Y121 HydrophobicContact CE2-CE1 4.43Å; F65-Y121 AromaticContact CE2-CE2 3.81Å; F65-Y121 HydrophobicContact CE2-CE2 3.81Å; F65-Y121 AromaticContact CE2-CZ 3.71Å; F65-Y121 HydrophobicContact CG-CE1 4.28Å
66	K	96.5	Very high	92.8	Very high	103 Å²	103	61.1 Å²	61.1	45%	0.448	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.9	171.1	-172.7	177.1	-179.3	178.6	0	109.6	V73 G119 T120	K66-V73 HydrophobicContact CB-CG2 4.35Å; K66-V73 HydrophobicContact CD-CG2 4.32Å; K66-V73 HydrophobicContact CG-CG2 4.33Å; K66-G119 CarbonylContact O-C 3.58Å; K66-G119 VanDerWaalsContact O-CA 3.24Å; K66-G119 WeakPolarHBondContact O-CA 3.5Å; K66-T120 PolarHBondContact N-O 3.12Å; K66-T120 PolarHBondContact O-N 2.73Å
67	P	95.3	Very high	93.2	Very high	32 Å²	32	59.8 Å²	59.8	21%	0.208	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	148.8	177.6	-20.8	29.2	0	0	0	113.1	F65 S69 G70 R72	F65-P67 HydrophobicContact CD1-CG 4.36Å; F65-P67 HydrophobicContact CE1-CB 4.24Å; F65-P67 HydrophobicContact CE1-CG 3.69Å; F65-P67 HydrophobicContact CZ-CB 4.27Å; F65-P67 HydrophobicContact CZ-CG 4.21Å; P67-S69 VanDerWaalsContact C-N 3.25Å; P67-S69 PolarHBondContact O-N 3.24Å; P67-G70 PolarHBondContact O-N 2.89Å; P67-G70 VanDerWaalsContact O-N 3.09Å; P67-R72 WeakPolarHBondContact CD-O 3.46Å
68	L	91.3	Very high	93.4	Very high	129 Å²	129	57.3 Å²	57.3	68%	0.675	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-32.3	176	-171.5	69.1	0	0	0	113	G70 N118	L68-G70 PolarHBondContact O-N 3.03Å; L68-G70 VanDerWaalsContact O-N 3.08Å; L68-N118 PolarHBondContact N-O 2.79Å
69	S	88.9	Confident	93.6	Very high	115 Å²	115	54.3 Å²	54.3	80%	0.804	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-4.9	176.1	54.9	0	0	0	0	113.9	P67	P67-S69 VanDerWaalsContact C-N 3.25Å; P67-S69 PolarHBondContact O-N 3.24Å
70	G	84.8	Confident	93.7	Very high	36 Å²	36	58.2 Å²	58.2	37%	0.371	33%	0.328	S	S	.	.			trans	75.5	167.6	-163	0	0	0	0	0	111.4	P67 L68	P67-G70 PolarHBondContact O-N 2.89Å; P67-G70 VanDerWaalsContact O-N 3.09Å; L68-G70 PolarHBondContact O-N 3.03Å; L68-G70 VanDerWaalsContact O-N 3.08Å
71	G	87.9	Confident	93.6	Very high	57 Å²	57	61 Å²	61	59%	0.588	34%	0.34	S	S	*	.			trans	139.4	-161.5	-178.1	0	0	0	0	0	113.4
72	R	90.6	Very high	93.5	Very high	219 Å²	219	66.7 Å²	66.7	83%	0.826	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-69.5	150.1	176.9	-66.9	-174.2	-179.6	-158.5	-0.2	110.7	P67	P67-R72 WeakPolarHBondContact CD-O 3.46Å
73	V	93.8	Very high	93.4	Very high	86 Å²	86	68.3 Å²	68.3	52%	0.521	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-91.1	122.2	171.5	178.2	0	0	0	0	107.4	T64 F65 K66	T64-V73 HydrophobicContact CG2-CG1 4.14Å; F65-V73 WeakPolarHBondContact O-CA 3.47Å; K66-V73 HydrophobicContact CB-CG2 4.35Å; K66-V73 HydrophobicContact CD-CG2 4.32Å; K66-V73 HydrophobicContact CG-CG2 4.33Å
74	D	92.9	Very high	93.3	Very high	76 Å²	76	72.8 Å²	72.8	41%	0.406	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	136	-178.4	-66.4	-33.7	0	0	0	110.3	T64 F65 I76	T64-D74 CarbonylContact C-O 3.58Å; T64-D74 WeakPolarHBondContact CA-O 3.4Å; T64-D74 WeakPolarHBondContact CB-O 3.17Å; F65-D74 PolarHBondContact N-O 2.98Å; F65-D74 PolarHBondContact O-N 3.47Å; D74-I76 PolarHBondContact O-N 3.02Å
75	S	94.5	Very high	93	Very high	83 Å²	83	75.3 Å²	75.3	58%	0.58	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.7	168.8	-176.6	0	0	0	0	109.3
76	I	96	Very high	92.7	Very high	2 Å²	2	76.1 Å²	76.1	1%	0.01	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-14.2	-173.6	63.3	162	0	0	0	113.2	W63 F65 D74 P86 F91 V95 I108 Y121	W63-I76 HydrophobicContact CB-CD1 4.32Å; W63-I76 HydrophobicContact CB-CG1 3.85Å; W63-I76 WeakPolarHBondContact O-CG1 3.45Å; W63-I76 PolarHBondContact O-N 3.32Å; F65-I76 HydrophobicContact CB-CD1 4.34Å; F65-I76 HydrophobicContact CB-CG2 3.58Å; D74-I76 PolarHBondContact O-N 3.02Å; I76-P86 WeakPolarHBondContact O-CD 3.38Å; I76-P86 VanDerWaalsContact O-CG 3.31Å; I76-P86 WeakPolarHBondContact O-CG 3.41Å; I76-F91 HydrophobicContact CB-CB 4.5Å; I76-F91 HydrophobicContact CB-CD2 4.32Å; I76-F91 HydrophobicContact CB-CG 4.28Å; I76-F91 HydrophobicContact CG2-CB 4.41Å; I76-F91 HydrophobicContact CG2-CD2 3.43Å; I76-F91 VanDerWaalsContact CG2-CD2 3.43Å; I76-F91 HydrophobicContact CG2-CE2 3.73Å; I76-F91 HydrophobicContact CG2-CG 3.87Å; I76-F91 HydrophobicContact CG2-CZ 4.38Å; I76-V95 HydrophobicContact CB-CG2 4.44Å; I76-V95 HydrophobicContact CD1-CG2 4.48Å; I76-I108 HydrophobicContact CD1-CD1 4.06Å; I76-Y121 HydrophobicContact CD1-CD1 3.52Å; I76-Y121 HydrophobicContact CD1-CE1 3.62Å
77	F	96.5	Very high	92.2	Very high	3 Å²	3	76.1 Å²	76.1	1%	0.013	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	148.3	175.6	174.6	-84.8	0	0	0	110.5	W63 P83 L85 V95 W97 I108	W63-F77 HydrophobicContact CB-CB 4.03Å; W63-F77 AromaticContact CD1-CD1 3.77Å; W63-F77 PolarHBondContact N-O 3.06Å; W63-F77 PolarHBondContact O-N 3.49Å; F77-P83 HydrophobicContact CE2-CB 3.67Å; F77-P83 HydrophobicContact CZ-CB 3.65Å; F77-L85 HydrophobicContact CD2-CD2 3.85Å; F77-L85 HydrophobicContact CE2-CD2 4.06Å; F77-V95 HydrophobicContact CB-CG1 3.92Å; F77-V95 HydrophobicContact CD2-CG1 4.08Å; F77-V95 HydrophobicContact CG-CG1 4.3Å; F77-W97 HydrophobicContact CE1-CD2 4.45Å; F77-W97 AromaticContact CE1-CE3 3.44Å; F77-W97 HydrophobicContact CE1-CE3 3.44Å; F77-W97 VanDerWaalsContact CE1-CE3 3.44Å; F77-W97 AromaticContact CE1-CZ3 3.7Å; F77-W97 HydrophobicContact CE1-CZ3 3.7Å; F77-W97 HydrophobicContact CE2-CB 4Å; F77-W97 HydrophobicContact CE2-CE3 4.24Å; F77-W97 HydrophobicContact CZ-CB 3.98Å; F77-W97 AromaticContact CZ-CD2 3.87Å; F77-W97 HydrophobicContact CZ-CD2 3.87Å; F77-W97 AromaticContact CZ-CE3 3.24Å; F77-W97 HydrophobicContact CZ-CE3 3.24Å; F77-W97 HydrophobicContact CZ-CG 4.21Å; F77-W97 AromaticContact CZ-CZ3 3.97Å; F77-W97 HydrophobicContact CZ-CZ3 3.97Å; F77-I108 HydrophobicContact CD1-CG2 4.02Å; F77-I108 HydrophobicContact CD2-CG2 4.46Å; F77-I108 HydrophobicContact CE1-CG2 4.28Å; F77-I108 HydrophobicContact CG-CG2 4.12Å
78	H	94.8	Very high	91.9	Very high	51 Å²	51	79.9 Å²	79.9	24%	0.236	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	140.2	174.8	170.9	-104.4	0	0	0	110.2	I60 V61 Q80 Y84	I60-H78 WeakPolarHBondContact CG2-NE2 3.43Å; V61-H78 CarbonylContact O-C 3.46Å; V61-H78 WeakPolarHBondContact O-CA 3.21Å; V61-H78 PolarHBondContact O-CD2 3.41Å; H78-Q80 WeakPolarHBondContact CE1-CB 3.41Å; H78-Y84 PolarHBondContact N-O 3.26Å; H78-Y84 VanDerWaalsContact N-O 3.15Å; H78-Y84 AromaticContact ND1-CD2 3.58Å; H78-Y84 WeakPolarHBondContact O-CA 3.48Å; H78-Y84 WeakPolarHBondContact O-CB 3.16Å; H78-Y84 PolarHBondContact O-N 2.94Å
79	Y	94.8	Very high	91.8	Very high	27 Å²	27	76.6 Å²	76.6	11%	0.106	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.5	171	178.9	-82.8	0	0	0	109.5	I60 V61 Q81 P83 W97 I101	I60-Y79 WeakPolarHBondContact CA-O 3.11Å; V61-Y79 PolarHBondContact N-O 3.44Å; V61-Y79 PolarHBondContact O-N 2.93Å; Y79-Q81 PolarHBondContact OH-O 2.99Å; Y79-P83 HydrophobicContact CD2-CB 4.4Å; Y79-W97 HydrophobicContact CD2-CZ2 4.34Å; Y79-I101 HydrophobicContact CD1-CD1 4.04Å; Y79-I101 HydrophobicContact CD1-CG1 4.1Å; Y79-I101 HydrophobicContact CE1-CD1 4.05Å; Y79-I101 HydrophobicContact CE1-CG1 3.59Å; Y79-I101 HydrophobicContact CE2-CG1 4.3Å; Y79-I101 HydrophobicContact CG-CD1 4.49Å
80	Q	93.5	Very high	92	Very high	82 Å²	82	74.9 Å²	74.9	38%	0.383	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	104.6	169.5	178.4	-179.7	28.1	0	0	107.6	I60 H78 K82 Y84	I60-Q80 HydrophobicContact CG1-CG 4.42Å; H78-Q80 WeakPolarHBondContact CE1-CB 3.41Å; Q80-K82 PolarHBondContact N-O 3.44Å; Q80-K82 VanDerWaalsContact N-O 3.07Å; Q80-K82 PolarHBondContact O-N 3.41Å; Q80-Y84 HydrophobicContact CB-CE2 4.29Å; Q80-Y84 WeakPolarHBondContact O-CE2 3.44Å
81	Q	91.8	Very high	92.4	Very high	113 Å²	113	73.5 Å²	73.5	53%	0.528	40%	0.4	S	S	.	.	S	Bend	trans	63.2	-37.1	-168.2	-46.9	179.7	-54.5	0	0	114	E57 Y79	E57-Q81 VanDerWaalsContact OE2-CD 3.27Å; E57-Q81 VanDerWaalsContact OE2-CG 3.25Å; E57-Q81 WeakPolarHBondContact OE2-CG 3.43Å; E57-Q81 PolarHBondContact OE2-NE2 3.27Å; Y79-Q81 PolarHBondContact OH-O 2.99Å
82	K	93.5	Very high	92.7	Very high	118 Å²	118	75.1 Å²	75.1	51%	0.513	39%	0.391	S	S	.	.	S	Bend	trans	-141.5	158.4	176.9	65.2	-178.6	177.5	-176.9	0	110.9	Q80 Y84	Q80-K82 PolarHBondContact N-O 3.44Å; Q80-K82 VanDerWaalsContact N-O 3.07Å; Q80-K82 PolarHBondContact O-N 3.41Å; K82-Y84 WeakPolarHBondContact CE-OH 3.37Å; K82-Y84 HydrophobicContact CG-CD2 4.42Å; K82-Y84 HydrophobicContact CG-CE1 4.43Å; K82-Y84 HydrophobicContact CG-CE2 3.74Å; K82-Y84 VanDerWaalsContact O-CD2 3.24Å; K82-Y84 WeakPolarHBondContact O-CD2 3.34Å; K82-Y84 WeakPolarHBondContact O-CE2 3.38Å
83	P	93.8	Very high	92.8	Very high	63 Å²	63	72.6 Å²	72.6	41%	0.409	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	134.7	174.6	29.2	-34.8	0	0	0	111.9	F77 Y79 W97	F77-P83 HydrophobicContact CE2-CB 3.67Å; F77-P83 HydrophobicContact CZ-CB 3.65Å; Y79-P83 HydrophobicContact CD2-CB 4.4Å; P83-W97 HydrophobicContact CB-CB 4.08Å; P83-W97 HydrophobicContact CB-CG 4.38Å
84	Y	93.9	Very high	92.8	Very high	95 Å²	95	71.3 Å²	71.3	37%	0.373	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.9	173.3	-64.3	-91	0	0	0	109.6	H78 Q80 K82	H78-Y84 PolarHBondContact N-O 3.26Å; H78-Y84 VanDerWaalsContact N-O 3.15Å; H78-Y84 AromaticContact ND1-CD2 3.58Å; H78-Y84 WeakPolarHBondContact O-CA 3.48Å; H78-Y84 WeakPolarHBondContact O-CB 3.16Å; H78-Y84 PolarHBondContact O-N 2.94Å; Q80-Y84 HydrophobicContact CB-CE2 4.29Å; Q80-Y84 WeakPolarHBondContact O-CE2 3.44Å; K82-Y84 WeakPolarHBondContact CE-OH 3.37Å; K82-Y84 HydrophobicContact CG-CD2 4.42Å; K82-Y84 HydrophobicContact CG-CE1 4.43Å; K82-Y84 HydrophobicContact CG-CE2 3.74Å; K82-Y84 VanDerWaalsContact O-CD2 3.24Å; K82-Y84 WeakPolarHBondContact O-CD2 3.34Å; K82-Y84 WeakPolarHBondContact O-CE2 3.38Å
85	L	91.6	Very high	93	Very high	90 Å²	90	67.7 Å²	67.7	47%	0.471	35%	0.353	S	S	.	.			trans	-93.2	153.7	179.6	-61.8	-177.1	0	0	0	110.7	F77 V95	F77-L85 HydrophobicContact CD2-CD2 3.85Å; F77-L85 HydrophobicContact CE2-CD2 4.06Å; L85-V95 WeakPolarHBondContact CD2-O 3.39Å
86	P	89.1	Confident	93.1	Very high	18 Å²	18	66.2 Å²	66.2	12%	0.117	34%	0.336	C	S	.	.			trans	-66.4	129.5	178.2	26	-30	0	0	0	109	I76 D88 F91	I76-P86 WeakPolarHBondContact O-CD 3.38Å; I76-P86 VanDerWaalsContact O-CG 3.31Å; I76-P86 WeakPolarHBondContact O-CG 3.41Å; P86-D88 VanDerWaalsContact C-N 3.31Å; P86-D88 PolarHBondContact O-N 2.73Å; P86-F91 HydrophobicContact CG-CB 4.07Å
87	P	86.9	Confident	93.1	Very high	103 Å²	103	69.2 Å²	69.2	67%	0.669	35%	0.348	S	S	*	.	S	Bend	trans	-68.8	-33.7	-175.7	26.3	-33.5	0	0	0	111.8	K92	P87-K92 VanDerWaalsContact O-CD 3.28Å; P87-K92 WeakPolarHBondContact O-CD 3.5Å; P87-K92 WeakPolarHBondContact O-CE 3.42Å; P87-K92 PolarHBondContact O-NZ 2.67Å
88	D	89.1	Confident	93.1	Very high	111 Å²	111	70.3 Å²	70.3	59%	0.594	36%	0.357	S	S	*	.	S	Bend	trans	-143.8	179.7	-174.6	-66.7	-49.9	0	0	0	112.2	P86 K92	P86-D88 VanDerWaalsContact C-N 3.31Å; P86-D88 PolarHBondContact O-N 2.73Å; D88-K92 IonicContact OD1-NZ 2.73Å; D88-K92 PolarHBondContact OD1-NZ 3.05Å
89	G	90.1	Very high	93.1	Very high	60 Å²	60	68.6 Å²	68.6	62%	0.619	35%	0.353	S	S	*	.	S	Bend	trans	88.4	-174.6	180	0	0	0	0	0	114.1	F91 K92	G89-F91 PolarHBondContact O-N 2.9Å; G89-K92 WeakPolarHBondContact O-CB 3.36Å; G89-K92 PolarHBondContact O-N 3.46Å
90	I	92.3	Very high	93.2	Very high	79 Å²	79	71.7 Å²	71.7	41%	0.405	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.2	-171	66.9	176	0	0	0	113.8	F65 I116 Y117	F65-I90 HydrophobicContact CE1-CD1 4.45Å; I90-I116 HydrophobicContact CB-CD1 4.11Å; I90-I116 HydrophobicContact CD1-CD1 4.26Å; I90-I116 HydrophobicContact CG2-CD1 4.21Å; I90-Y117 HydrophobicContact CB-CE1 4.06Å; I90-Y117 HydrophobicContact CD1-CD1 4.04Å; I90-Y117 HydrophobicContact CD1-CE1 4.02Å; I90-Y117 HydrophobicContact CG1-CD1 4.42Å; I90-Y117 HydrophobicContact CG1-CE1 3.96Å; I90-Y117 WeakPolarHBondContact O-CE1 3.5Å; I90-Y117 PolarHBondContact O-OH 3.23Å
91	F	93.6	Very high	93.2	Very high	7 Å²	7	68.1 Å²	68.1	3%	0.031	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-3	-179.7	-69.5	-75.5	0	0	0	113.9	F65 I76 P86 G89 K93 R94 V95 L110 Y117 Y121	F65-F91 HydrophobicContact CB-CE2 4.05Å; F65-F91 HydrophobicContact CB-CZ 4.19Å; F65-F91 AromaticContact CD1-CE2 3.42Å; F65-F91 HydrophobicContact CD1-CE2 3.42Å; F65-F91 VanDerWaalsContact CD1-CE2 3.42Å; F65-F91 AromaticContact CD1-CZ 3.74Å; F65-F91 HydrophobicContact CD1-CZ 3.74Å; F65-F91 HydrophobicContact CD2-CE2 4.43Å; F65-F91 AromaticContact CD2-CZ 3.94Å; F65-F91 HydrophobicContact CD2-CZ 3.94Å; F65-F91 AromaticContact CE1-CE2 3.86Å; F65-F91 HydrophobicContact CE1-CE2 3.86Å; F65-F91 AromaticContact CE1-CZ 3.98Å; F65-F91 HydrophobicContact CE1-CZ 3.98Å; F65-F91 HydrophobicContact CE2-CZ 4.2Å; F65-F91 AromaticContact CG-CE2 3.72Å; F65-F91 HydrophobicContact CG-CE2 3.72Å; F65-F91 AromaticContact CG-CZ 3.68Å; F65-F91 HydrophobicContact CG-CZ 3.68Å; F65-F91 HydrophobicContact CZ-CZ 4.21Å; I76-F91 HydrophobicContact CB-CB 4.5Å; I76-F91 HydrophobicContact CB-CD2 4.32Å; I76-F91 HydrophobicContact CB-CG 4.28Å; I76-F91 HydrophobicContact CG2-CB 4.41Å; I76-F91 HydrophobicContact CG2-CD2 3.43Å; I76-F91 VanDerWaalsContact CG2-CD2 3.43Å; I76-F91 HydrophobicContact CG2-CE2 3.73Å; I76-F91 HydrophobicContact CG2-CG 3.87Å; I76-F91 HydrophobicContact CG2-CZ 4.38Å; P86-F91 HydrophobicContact CG-CB 4.07Å; G89-F91 PolarHBondContact O-N 2.9Å; F91-K93 PolarHBondContact O-N 3.2Å; F91-R94 PolarHBondContact O-N 3.26Å; F91-V95 HydrophobicContact CB-CG2 3.94Å; F91-V95 HydrophobicContact CD1-CG2 3.99Å; F91-V95 HydrophobicContact CG-CG2 4.32Å; F91-L110 HydrophobicContact CD1-CD2 3.87Å; F91-L110 HydrophobicContact CE1-CD2 3.96Å; F91-Y117 HydrophobicContact CD1-CD1 4.33Å; F91-Y117 HydrophobicContact CD1-CE1 4.23Å; F91-Y117 AromaticContact CE1-CD1 3.65Å; F91-Y117 HydrophobicContact CE1-CD1 3.65Å; F91-Y117 HydrophobicContact CE1-CE1 4.01Å; F91-Y117 AromaticContact CE1-CG 3.99Å; F91-Y117 HydrophobicContact CE1-CG 3.99Å; F91-Y117 AromaticContact CZ-CD1 3.78Å; F91-Y117 HydrophobicContact CZ-CD1 3.78Å; F91-Y117 HydrophobicContact CZ-CE1 4.32Å; F91-Y117 HydrophobicContact CZ-CG 4.37Å; F91-Y121 AromaticContact CE1-CE1 3.96Å; F91-Y121 HydrophobicContact CE1-CE1 3.96Å; F91-Y121 WeakPolarHBondContact CE1-OH 3.39Å; F91-Y121 HydrophobicContact CZ-CE1 4.06Å; F91-Y121 WeakPolarHBondContact CZ-OH 3.35Å
92	K	92.8	Very high	93.3	Very high	91 Å²	91	68.5 Å²	68.5	40%	0.396	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	123.3	177.8	-175.5	-178.7	-165.1	147.6	0	110.5	P87 D88 G89 R94	P87-K92 VanDerWaalsContact O-CD 3.28Å; P87-K92 WeakPolarHBondContact O-CD 3.5Å; P87-K92 WeakPolarHBondContact O-CE 3.42Å; P87-K92 PolarHBondContact O-NZ 2.67Å; D88-K92 IonicContact OD1-NZ 2.73Å; D88-K92 PolarHBondContact OD1-NZ 3.05Å; G89-K92 WeakPolarHBondContact O-CB 3.36Å; G89-K92 PolarHBondContact O-N 3.46Å; K92-R94 PolarHBondContact O-N 3.18Å
93	K	92.6	Very high	93.4	Very high	166 Å²	166	65.2 Å²	65.2	72%	0.722	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	16.7	-176.9	-57.8	174.2	177.1	-176.7	0	115.1	F91	F91-K93 PolarHBondContact O-N 3.2Å
94	R	95.8	Very high	93.4	Very high	59 Å²	59	63.7 Å²	63.7	22%	0.223	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-27.8	178.7	-58.1	-65.6	179.2	-178.6	-0.4	112.6	F91 K92 L110 R111 E112 Y117	F91-R94 PolarHBondContact O-N 3.26Å; K92-R94 PolarHBondContact O-N 3.18Å; R94-L110 WeakPolarHBondContact O-CA 3.15Å; R94-R111 PolarHBondContact O-N 3.15Å; R94-E112 IonicContact CZ-OE1 3.96Å; R94-E112 IonicContact NH1-OE1 2.73Å; R94-E112 PolarHBondContact NH1-OE1 2.87Å; R94-E112 IonicContact NH1-OE2 3.12Å; R94-E112 PolarHBondContact NH1-OE2 3.21Å; R94-E112 VanDerWaalsContact NH1-OE2 3.12Å; R94-Y117 WeakPolarHBondContact CG-OH 3.31Å
95	V	96.3	Very high	93.5	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.8	175.3	-174	0	0	0	0	109.8	I76 F77 L85 F91 I108 I109 L110	I76-V95 HydrophobicContact CB-CG2 4.44Å; I76-V95 HydrophobicContact CD1-CG2 4.48Å; F77-V95 HydrophobicContact CB-CG1 3.92Å; F77-V95 HydrophobicContact CD2-CG1 4.08Å; F77-V95 HydrophobicContact CG-CG1 4.3Å; L85-V95 WeakPolarHBondContact CD2-O 3.39Å; F91-V95 HydrophobicContact CB-CG2 3.94Å; F91-V95 HydrophobicContact CD1-CG2 3.99Å; F91-V95 HydrophobicContact CG-CG2 4.32Å; V95-I108 HydrophobicContact CG1-CB 4.11Å; V95-I108 HydrophobicContact CG1-CD1 3.86Å; V95-I108 HydrophobicContact CG1-CG2 4.28Å; V95-I109 CarbonylContact C-O 3.59Å; V95-I109 WeakPolarHBondContact CA-O 3.46Å; V95-L110 HydrophobicContact CB-CD2 4.45Å; V95-L110 HydrophobicContact CG2-CD2 3.6Å
96	H	95.8	Very high	93.8	Very high	52 Å²	52	56.1 Å²	56.1	24%	0.241	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.4	174.8	-70.5	-91.2	0	0	0	110.6	I108 I109 R111	H96-I108 CarbonylContact O-C 3.59Å; H96-I108 WeakPolarHBondContact O-CA 3.37Å; H96-I109 HydrophobicContact CB-CB 4.43Å; H96-I109 PolarHBondContact N-O 2.9Å; H96-I109 PolarHBondContact O-N 3.33Å; H96-R111 VanDerWaalsContact CD2-CD 3.43Å; H96-R111 WeakPolarHBondContact CD2-CD 3.26Å; H96-R111 PolarHBondContact CD2-NE 3.21Å; H96-R111 WeakPolarHBondContact NE2-CD 3.38Å; H96-R111 PolarHBondContact NE2-NE 2.95Å; H96-R111 PolarHBondContact NE2-NH1 3.43Å
97	W	96.4	Very high	94.2	Very high	65 Å²	65	55.3 Å²	55.3	25%	0.246	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.4	172	178.9	-112	0	0	0	110.4	F77 Y79 P83 G99 I101 I108	F77-W97 HydrophobicContact CE1-CD2 4.45Å; F77-W97 AromaticContact CE1-CE3 3.44Å; F77-W97 HydrophobicContact CE1-CE3 3.44Å; F77-W97 VanDerWaalsContact CE1-CE3 3.44Å; F77-W97 AromaticContact CE1-CZ3 3.7Å; F77-W97 HydrophobicContact CE1-CZ3 3.7Å; F77-W97 HydrophobicContact CE2-CB 4Å; F77-W97 HydrophobicContact CE2-CE3 4.24Å; F77-W97 HydrophobicContact CZ-CB 3.98Å; F77-W97 AromaticContact CZ-CD2 3.87Å; F77-W97 HydrophobicContact CZ-CD2 3.87Å; F77-W97 AromaticContact CZ-CE3 3.24Å; F77-W97 HydrophobicContact CZ-CE3 3.24Å; F77-W97 HydrophobicContact CZ-CG 4.21Å; F77-W97 AromaticContact CZ-CZ3 3.97Å; F77-W97 HydrophobicContact CZ-CZ3 3.97Å; Y79-W97 HydrophobicContact CD2-CZ2 4.34Å; P83-W97 HydrophobicContact CB-CB 4.08Å; P83-W97 HydrophobicContact CB-CG 4.38Å; W97-G99 VanDerWaalsContact CE2-O 3.31Å; W97-G99 VanDerWaalsContact CZ2-C 3.42Å; W97-G99 VanDerWaalsContact CZ2-CA 3.46Å; W97-G99 PolarHBondContact NE1-O 2.94Å; W97-I101 HydrophobicContact CH2-CD1 3.64Å; W97-I101 HydrophobicContact CH2-CG1 4.41Å; W97-I101 HydrophobicContact CZ2-CD1 3.79Å; W97-I101 HydrophobicContact CZ2-CG1 4.06Å; W97-I108 HydrophobicContact CE3-CG2 4.29Å
98	A	96.9	Very high	94.7	Very high	25 Å²	25	50.4 Å²	50.4	21%	0.207	28%	0.278	C	S	.	.			trans	-137.1	17.4	179	0	0	0	0	0	112.2	R43 S107 I109	R43-A98 PolarHBondContact NH2-O 2.89Å; A98-S107 CarbonylContact C-O 3.59Å; A98-S107 VanDerWaalsContact C-O 3.3Å; A98-S107 WeakPolarHBondContact CA-O 3.47Å; A98-S107 PolarHBondContact N-O 3.39Å; A98-I109 HydrophobicContact CB-CB 4.43Å; A98-I109 HydrophobicContact CB-CD1 3.57Å; A98-I109 HydrophobicContact CB-CG1 3.57Å
99	G	94.9	Very high	95.1	Very high	16 Å²	16	47.5 Å²	47.5	17%	0.165	26%	0.262	C	S	.	.			trans	-99.5	170.7	-179.3	0	0	0	0	0	112.7	W97 D105 S107	W97-G99 VanDerWaalsContact CE2-O 3.31Å; W97-G99 VanDerWaalsContact CZ2-C 3.42Å; W97-G99 VanDerWaalsContact CZ2-CA 3.46Å; W97-G99 PolarHBondContact NE1-O 2.94Å; G99-D105 CarbonylContact C-O 3.43Å; G99-D105 WeakPolarHBondContact CA-O 3.36Å; G99-S107 PolarHBondContact N-O 3.49Å
100	D	95.6	Very high	95.5	Very high	92 Å²	92	44.7 Å²	44.7	49%	0.492	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-139	106.7	171.7	173.3	13.2	0	0	0	107.1	M102 G103 S104 D105	D100-M102 PolarHBondContact O-N 2.89Å; D100-M102 PolarHBondContact OD1-N 3.41Å; D100-M102 VanDerWaalsContact OD1-N 3.12Å; D100-G103 CarbonylContact O-C 3.6Å; D100-G103 WeakPolarHBondContact O-CA 3.47Å; D100-G103 PolarHBondContact O-N 3.49Å; D100-G103 VanDerWaalsContact O-N 3.1Å; D100-G103 PolarHBondContact OD1-N 2.9Å; D100-G103 PolarHBondContact OD2-N 2.84Å; D100-S104 PolarHBondContact O-N 3.49Å; D100-S104 VanDerWaalsContact O-N 3.12Å; D100-D105 CarbonylContact C-O 3.56Å; D100-D105 VanDerWaalsContact C-O 3.29Å; D100-D105 PolarHBondContact N-O 2.83Å; D100-D105 PolarHBondContact O-N 3.39Å
101	I	94.6	Very high	95.7	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.036	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.7	-176.3	-60.6	-59.5	0	0	0	111.4	I54 P56 V59 V61 Y79 W97 G103 S104	I54-I101 HydrophobicContact CG2-CG2 3.89Å; P56-I101 HydrophobicContact CB-CG2 4.23Å; P56-I101 HydrophobicContact CG-CG2 4.38Å; V59-I101 HydrophobicContact CB-CG2 3.92Å; V59-I101 HydrophobicContact CG1-CD1 4.17Å; V59-I101 HydrophobicContact CG1-CG2 3.96Å; V59-I101 HydrophobicContact CG2-CG2 4Å; V61-I101 HydrophobicContact CG2-CD1 3.84Å; Y79-I101 HydrophobicContact CD1-CD1 4.04Å; Y79-I101 HydrophobicContact CD1-CG1 4.1Å; Y79-I101 HydrophobicContact CE1-CD1 4.05Å; Y79-I101 HydrophobicContact CE1-CG1 3.59Å; Y79-I101 HydrophobicContact CE2-CG1 4.3Å; Y79-I101 HydrophobicContact CG-CD1 4.49Å; W97-I101 HydrophobicContact CH2-CD1 3.64Å; W97-I101 HydrophobicContact CH2-CG1 4.41Å; W97-I101 HydrophobicContact CZ2-CD1 3.79Å; W97-I101 HydrophobicContact CZ2-CG1 4.06Å; I101-G103 VanDerWaalsContact C-N 3.31Å; I101-S104 PolarHBondContact O-N 2.84Å; I101-S104 VanDerWaalsContact O-N 3.14Å
102	M	93.6	Very high	95.9	Very high	121 Å²	121	50.5 Å²	50.5	60%	0.596	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-30.2	178.8	-72.7	-59.4	-58.7	0	0	112	I54 P56 D100 S104	I54-M102 HydrophobicContact CG2-SD 4.47Å; P56-M102 HydrophobicContact CG-CG 3.78Å; P56-M102 HydrophobicContact CG-SD 3.26Å; P56-M102 WeakPolarHBondContact CG-SD 3.39Å; D100-M102 PolarHBondContact O-N 2.89Å; D100-M102 PolarHBondContact OD1-N 3.41Å; D100-M102 VanDerWaalsContact OD1-N 3.12Å; M102-S104 VanDerWaalsContact C-N 3.26Å
103	G	95.1	Very high	96	Very high	48 Å²	48	46.2 Å²	46.2	50%	0.495	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	11.3	170.7	0	0	0	0	0	114.4	D100 I101 D105	D100-G103 CarbonylContact O-C 3.6Å; D100-G103 WeakPolarHBondContact O-CA 3.47Å; D100-G103 PolarHBondContact O-N 3.49Å; D100-G103 VanDerWaalsContact O-N 3.1Å; D100-G103 PolarHBondContact OD1-N 2.9Å; D100-G103 PolarHBondContact OD2-N 2.84Å; I101-G103 VanDerWaalsContact C-N 3.31Å; G103-D105 PolarHBondContact O-N 3.43Å
104	S	94.6	Very high	96.2	Very high	31 Å²	31	42.5 Å²	42.5	22%	0.217	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	33.4	-176.5	-43.5	0	0	0	0	114.8	T47 F48 I54 D100 I101 M102	T47-S104 CarbonylContact C-O 3.47Å; T47-S104 VanDerWaalsContact CA-O 3.25Å; T47-S104 WeakPolarHBondContact CA-O 3.28Å; T47-S104 WeakPolarHBondContact CB-O 3.5Å; F48-S104 WeakPolarHBondContact CD1-O 3.09Å; F48-S104 PolarHBondContact N-O 2.86Å; F48-S104 WeakPolarHBondContact O-CB 3.37Å; I54-S104 VanDerWaalsContact CD1-OG 3.24Å; I54-S104 WeakPolarHBondContact CD1-OG 3.38Å; D100-S104 PolarHBondContact O-N 3.49Å; D100-S104 VanDerWaalsContact O-N 3.12Å; I101-S104 PolarHBondContact O-N 2.84Å; I101-S104 VanDerWaalsContact O-N 3.14Å; M102-S104 VanDerWaalsContact C-N 3.26Å
105	D	96.8	Very high	96.2	Very high	27 Å²	27	43.7 Å²	43.7	14%	0.144	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-110.7	118	178.7	-168.4	-19.1	0	0	0	110	R43 T47 G99 D100 G103 S107	R43-D105 IonicContact CZ-OD2 3.75Å; R43-D105 IonicContact NH2-OD1 3.77Å; R43-D105 IonicContact NH2-OD2 2.7Å; R43-D105 PolarHBondContact NH2-OD2 3.29Å; T47-D105 HydrophobicContact CG2-CB 4.32Å; G99-D105 CarbonylContact C-O 3.43Å; G99-D105 WeakPolarHBondContact CA-O 3.36Å; D100-D105 CarbonylContact C-O 3.56Å; D100-D105 VanDerWaalsContact C-O 3.29Å; D100-D105 PolarHBondContact N-O 2.83Å; D100-D105 PolarHBondContact O-N 3.39Å; G103-D105 PolarHBondContact O-N 3.43Å; D105-S107 WeakPolarHBondContact OD1-CB 3.24Å; D105-S107 PolarHBondContact OD1-N 3.29Å; D105-S107 PolarHBondContact OD1-OG 3.38Å
106	A	96.5	Very high	96	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.			trans	-110.7	19.5	-179.2	0	0	0	0	0	112.6	C46 F48 V61 W63 V125	C46-A106 HydrophobicContact CB-CB 4.32Å; C46-A106 CarbonylContact O-C 3.53Å; C46-A106 WeakPolarHBondContact O-CA 3.34Å; C46-A106 PolarHBondContact O-N 3.37Å; F48-A106 HydrophobicContact CD1-CB 4.19Å; F48-A106 HydrophobicContact CE1-CB 4.38Å; V61-A106 HydrophobicContact CG1-CB 3.85Å; V61-A106 HydrophobicContact CG2-CB 3.98Å; W63-A106 PolarHBondContact NE1-O 2.97Å; A106-V125 HydrophobicContact CB-CG2 3.89Å
107	S	98.1	Very high	96	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.			trans	-70.9	150.8	-173.1	-56.1	0	0	0	0	113.7	L44 K45 C46 A98 G99 D105	L44-S107 WeakPolarHBondContact O-CA 3.35Å; L44-S107 WeakPolarHBondContact O-CB 3.38Å; K45-S107 WeakPolarHBondContact CA-OG 3.22Å; C46-S107 PolarHBondContact N-OG 2.92Å; C46-S107 PolarHBondContact O-N 2.98Å; C46-S107 PolarHBondContact O-OG 3.34Å; A98-S107 CarbonylContact C-O 3.59Å; A98-S107 VanDerWaalsContact C-O 3.3Å; A98-S107 WeakPolarHBondContact CA-O 3.47Å; A98-S107 PolarHBondContact N-O 3.39Å; G99-S107 PolarHBondContact N-O 3.49Å; D105-S107 WeakPolarHBondContact OD1-CB 3.24Å; D105-S107 PolarHBondContact OD1-N 3.29Å; D105-S107 PolarHBondContact OD1-OG 3.38Å
108	I	98	Very high	96	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	157.9	171.7	60.2	172.3	0	0	0	110.9	L44 W63 I76 F77 V95 H96 W97	L44-I108 HydrophobicContact CB-CG1 4.02Å; L44-I108 HydrophobicContact CD1-CD1 4.2Å; L44-I108 HydrophobicContact CD1-CG1 4.3Å; L44-I108 HydrophobicContact CG-CG1 4.48Å; L44-I108 PolarHBondContact N-O 2.88Å; L44-I108 PolarHBondContact O-N 3.01Å; W63-I108 HydrophobicContact CB-CD1 4.29Å; W63-I108 HydrophobicContact CD2-CD1 3.62Å; W63-I108 HydrophobicContact CD2-CG1 3.99Å; W63-I108 HydrophobicContact CE3-CD1 3.85Å; W63-I108 HydrophobicContact CE3-CG1 4.32Å; W63-I108 HydrophobicContact CG-CD1 3.85Å; W63-I108 HydrophobicContact CG-CG1 4.47Å; W63-I108 HydrophobicContact CG-CG2 4.37Å; W63-I108 HydrophobicContact CH2-CG1 4.27Å; W63-I108 HydrophobicContact CZ2-CD1 4.48Å; W63-I108 HydrophobicContact CZ2-CG1 3.95Å; W63-I108 HydrophobicContact CZ3-CD1 4.38Å; W63-I108 HydrophobicContact CZ3-CG1 4.46Å; I76-I108 HydrophobicContact CD1-CD1 4.06Å; F77-I108 HydrophobicContact CD1-CG2 4.02Å; F77-I108 HydrophobicContact CD2-CG2 4.46Å; F77-I108 HydrophobicContact CE1-CG2 4.28Å; F77-I108 HydrophobicContact CG-CG2 4.12Å; V95-I108 HydrophobicContact CG1-CB 4.11Å; V95-I108 HydrophobicContact CG1-CD1 3.86Å; V95-I108 HydrophobicContact CG1-CG2 4.28Å; H96-I108 CarbonylContact O-C 3.59Å; H96-I108 WeakPolarHBondContact O-CA 3.37Å; W97-I108 HydrophobicContact CE3-CG2 4.29Å
109	I	97.8	Very high	96	Very high	51 Å²	51	43.9 Å²	43.9	26%	0.262	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.5	168.7	-69.3	164.7	0	0	0	108.5	D41 V42 R43 V95 H96 A98 R111	D41-I109 HydrophobicContact CB-CG2 4.32Å; V42-I109 CarbonylContact O-C 3.57Å; V42-I109 WeakPolarHBondContact O-CA 3.45Å; R43-I109 HydrophobicContact CB-CG1 4.23Å; R43-I109 HydrophobicContact CG-CG1 4.18Å; V95-I109 CarbonylContact C-O 3.59Å; V95-I109 WeakPolarHBondContact CA-O 3.46Å; H96-I109 HydrophobicContact CB-CB 4.43Å; H96-I109 PolarHBondContact N-O 2.9Å; H96-I109 PolarHBondContact O-N 3.33Å; A98-I109 HydrophobicContact CB-CB 4.43Å; A98-I109 HydrophobicContact CB-CD1 3.57Å; A98-I109 HydrophobicContact CB-CG1 3.57Å; I109-R111 HydrophobicContact CG2-CG 4.1Å
110	L	97.6	Very high	96.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.3	165.5	-70.4	172.3	0	0	0	108.7	D41 V42 L44 F91 R94 V95 V113 Y121 L140	D41-L110 CarbonylContact C-O 3.58Å; D41-L110 WeakPolarHBondContact CA-O 3.5Å; V42-L110 HydrophobicContact CG1-CB 3.86Å; V42-L110 HydrophobicContact CG1-CD1 4.36Å; V42-L110 PolarHBondContact N-O 3.24Å; V42-L110 PolarHBondContact O-N 3.48Å; L44-L110 HydrophobicContact CD1-CD1 3.63Å; L44-L110 HydrophobicContact CD1-CG 4.2Å; L44-L110 HydrophobicContact CG-CD1 4.16Å; F91-L110 HydrophobicContact CD1-CD2 3.87Å; F91-L110 HydrophobicContact CE1-CD2 3.96Å; R94-L110 WeakPolarHBondContact O-CA 3.15Å; V95-L110 HydrophobicContact CB-CD2 4.45Å; V95-L110 HydrophobicContact CG2-CD2 3.6Å; L110-V113 HydrophobicContact CB-CG1 3.92Å; L110-Y121 HydrophobicContact CD1-CD1 4.36Å; L110-Y121 HydrophobicContact CD1-CE1 3.6Å; L110-Y121 HydrophobicContact CD1-CE2 4.43Å; L110-L140 HydrophobicContact CD1-CD2 3.9Å
111	R	97.2	Very high	96.2	Very high	111 Å²	111	40 Å²	40	42%	0.419	21%	0.206	S	C	.	.			trans	-91.3	145.2	179.3	-67.2	-168.6	179.3	171.7	-2.5	112.9	D41 R94 H96 I109 V113	D41-R111 WeakPolarHBondContact OD1-CA 3.46Å; R94-R111 PolarHBondContact O-N 3.15Å; H96-R111 VanDerWaalsContact CD2-CD 3.43Å; H96-R111 WeakPolarHBondContact CD2-CD 3.26Å; H96-R111 PolarHBondContact CD2-NE 3.21Å; H96-R111 WeakPolarHBondContact NE2-CD 3.38Å; H96-R111 PolarHBondContact NE2-NE 2.95Å; H96-R111 PolarHBondContact NE2-NH1 3.43Å; I109-R111 HydrophobicContact CG2-CG 4.1Å; R111-V113 PolarHBondContact O-N 2.94Å
112	E	96.2	Very high	96.4	Very high	98 Å²	98	40.7 Å²	40.7	46%	0.458	21%	0.211	S	C	.	.	S	Bend	trans	45.9	59.9	176.9	-63.9	170.8	-107.2	0	0	111.7	T40 D41 R94	T40-E112 PolarHBondContact O-N 3.01Å; D41-E112 PolarHBondContact OD1-N 3.46Å; R94-E112 IonicContact CZ-OE1 3.96Å; R94-E112 IonicContact NH1-OE1 2.73Å; R94-E112 PolarHBondContact NH1-OE1 2.87Å; R94-E112 IonicContact NH1-OE2 3.12Å; R94-E112 PolarHBondContact NH1-OE2 3.21Å; R94-E112 VanDerWaalsContact NH1-OE2 3.12Å
113	V	96.6	Very high	96.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.			trans	-61.8	144.3	-171.9	-61.8	0	0	0	0	112.2	A36 V37 N38 G39 T40 V42 L110 R111 Y117 V142	A36-V113 HydrophobicContact CB-CG2 3.87Å; V37-V113 WeakPolarHBondContact O-CG2 3.18Å; N38-V113 CarbonylContact C-O 3.54Å; N38-V113 WeakPolarHBondContact CA-O 3.19Å; N38-V113 PolarHBondContact OD1-O 2.92Å; G39-V113 PolarHBondContact N-O 2.85Å; T40-V113 WeakPolarHBondContact O-CG2 3.24Å; T40-V113 PolarHBondContact O-N 3.04Å; V42-V113 HydrophobicContact CB-CG1 4.38Å; V42-V113 HydrophobicContact CG1-CG1 3.54Å; L110-V113 HydrophobicContact CB-CG1 3.92Å; R111-V113 PolarHBondContact O-N 2.94Å; V113-Y117 HydrophobicContact CB-CD2 4.19Å; V113-V142 HydrophobicContact CB-CG2 4.36Å; V113-V142 HydrophobicContact CG2-CG1 4.11Å; V113-V142 HydrophobicContact CG2-CG2 4.26Å
114	K	95.8	Very high	96.5	Very high	88 Å²	88	35.4 Å²	35.4	38%	0.383	17%	0.171	S	C	.	.			trans	-122.7	159.7	-179.7	-61.4	-177.6	-177	-178	0	110.5	I116 Y117	K114-I116 HydrophobicContact CB-CG1 3.82Å; K114-I116 PolarHBondContact O-N 2.95Å; K114-Y117 HydrophobicContact CB-CD2 4.3Å; K114-Y117 HydrophobicContact CB-CE2 4.23Å; K114-Y117 HydrophobicContact CG-CE2 4.3Å; K114-Y117 VanDerWaalsContact N-CD2 3.26Å; K114-Y117 VanDerWaalsContact O-CB 3.3Å; K114-Y117 WeakPolarHBondContact O-CB 3.42Å; K114-Y117 PolarHBondContact O-N 3.47Å
115	F	95.2	Very high	96.4	Very high	84 Å²	84	33.9 Å²	33.9	37%	0.368	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-55.9	-27.8	177.1	-62.8	-59.4	0	0	0	114.2	N38 Y117 N118 V142 K144	N38-F115 HydrophobicContact CB-CE1 4.12Å; N38-F115 HydrophobicContact CB-CE2 4.18Å; N38-F115 HydrophobicContact CB-CZ 3.77Å; N38-F115 WeakPolarHBondContact ND2-CE2 3.37Å; F115-Y117 PolarHBondContact O-N 3.39Å; F115-N118 VanDerWaalsContact O-CB 3.28Å; F115-N118 WeakPolarHBondContact O-CB 3.41Å; F115-N118 VanDerWaalsContact O-CG 3.27Å; F115-N118 PolarHBondContact O-N 2.79Å; F115-N118 PolarHBondContact O-ND2 2.68Å; F115-N118 VanDerWaalsContact O-ND2 3.15Å; F115-V142 HydrophobicContact CD1-CB 4.12Å; F115-V142 HydrophobicContact CD1-CG1 3.83Å; F115-V142 WeakPolarHBondContact CD1-O 2.99Å; F115-V142 HydrophobicContact CE1-CG1 4.04Å; F115-V142 WeakPolarHBondContact CE1-O 3.45Å; F115-K144 HydrophobicContact CE1-CG 4.24Å; F115-K144 HydrophobicContact CZ-CG 3.64Å
116	I	93.8	Very high	96.2	Very high	98 Å²	98	33.7 Å²	33.7	50%	0.503	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-67.1	-15.7	175.8	60.1	164.2	0	0	0	113.6	I90 K114 N118	I90-I116 HydrophobicContact CB-CD1 4.11Å; I90-I116 HydrophobicContact CD1-CD1 4.26Å; I90-I116 HydrophobicContact CG2-CD1 4.21Å; K114-I116 HydrophobicContact CB-CG1 3.82Å; K114-I116 PolarHBondContact O-N 2.95Å; I116-N118 VanDerWaalsContact C-N 3.25Å
117	Y	95.4	Very high	95.9	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.016	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-86.3	4.1	176.8	-60	-21.7	0	0	0	112.7	F65 I90 F91 R94 V113 K114 F115 G119 Y121	F65-Y117 WeakPolarHBondContact CE2-O 3.24Å; I90-Y117 HydrophobicContact CB-CE1 4.06Å; I90-Y117 HydrophobicContact CD1-CD1 4.04Å; I90-Y117 HydrophobicContact CD1-CE1 4.02Å; I90-Y117 HydrophobicContact CG1-CD1 4.42Å; I90-Y117 HydrophobicContact CG1-CE1 3.96Å; I90-Y117 WeakPolarHBondContact O-CE1 3.5Å; I90-Y117 PolarHBondContact O-OH 3.23Å; F91-Y117 HydrophobicContact CD1-CD1 4.33Å; F91-Y117 HydrophobicContact CD1-CE1 4.23Å; F91-Y117 AromaticContact CE1-CD1 3.65Å; F91-Y117 HydrophobicContact CE1-CD1 3.65Å; F91-Y117 HydrophobicContact CE1-CE1 4.01Å; F91-Y117 AromaticContact CE1-CG 3.99Å; F91-Y117 HydrophobicContact CE1-CG 3.99Å; F91-Y117 AromaticContact CZ-CD1 3.78Å; F91-Y117 HydrophobicContact CZ-CD1 3.78Å; F91-Y117 HydrophobicContact CZ-CE1 4.32Å; F91-Y117 HydrophobicContact CZ-CG 4.37Å; R94-Y117 WeakPolarHBondContact CG-OH 3.31Å; V113-Y117 HydrophobicContact CB-CD2 4.19Å; K114-Y117 HydrophobicContact CB-CD2 4.3Å; K114-Y117 HydrophobicContact CB-CE2 4.23Å; K114-Y117 HydrophobicContact CG-CE2 4.3Å; K114-Y117 VanDerWaalsContact N-CD2 3.26Å; K114-Y117 VanDerWaalsContact O-CB 3.3Å; K114-Y117 WeakPolarHBondContact O-CB 3.42Å; K114-Y117 PolarHBondContact O-N 3.47Å; F115-Y117 PolarHBondContact O-N 3.39Å; Y117-G119 PolarHBondContact O-N 2.83Å; Y117-Y121 WeakPolarHBondContact CB-OH 3.36Å; Y117-Y121 WeakPolarHBondContact O-CE2 3.42Å; Y117-Y121 PolarHBondContact O-OH 2.86Å
118	N	95.9	Very high	95.3	Very high	41 Å²	41	36.3 Å²	36.3	22%	0.219	18%	0.177	C	C	.	.			trans	-63.7	124.2	172.1	-80.6	-25.7	0	0	0	111.5	L68 F115 I116 V142	L68-N118 PolarHBondContact N-O 2.79Å; F115-N118 VanDerWaalsContact O-CB 3.28Å; F115-N118 WeakPolarHBondContact O-CB 3.41Å; F115-N118 VanDerWaalsContact O-CG 3.27Å; F115-N118 PolarHBondContact O-N 2.79Å; F115-N118 PolarHBondContact O-ND2 2.68Å; F115-N118 VanDerWaalsContact O-ND2 3.15Å; I116-N118 VanDerWaalsContact C-N 3.25Å; N118-V142 WeakPolarHBondContact OD1-CA 3.43Å; N118-V142 WeakPolarHBondContact OD1-CB 3.32Å; N118-V142 WeakPolarHBondContact OD1-CG2 3.46Å; N118-V142 PolarHBondContact OD1-N 2.75Å
119	G	96.4	Very high	94.5	Very high	4 Å²	4	41.9 Å²	41.9	4%	0.041	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162	-166.7	-179.5	0	0	0	0	0	113.4	K66 Y117 L140	K66-G119 CarbonylContact O-C 3.58Å; K66-G119 VanDerWaalsContact O-CA 3.24Å; K66-G119 WeakPolarHBondContact O-CA 3.5Å; Y117-G119 PolarHBondContact O-N 2.83Å; G119-L140 PolarHBondContact N-O 2.82Å; G119-L140 PolarHBondContact O-N 3.2Å
120	T	97.8	Very high	93.2	Very high	27 Å²	27	40.1 Å²	40.1	17%	0.166	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.1	177.6	-55.9	0	0	0	0	109.4	K66 E137 I138	K66-T120 PolarHBondContact N-O 3.12Å; K66-T120 PolarHBondContact O-N 2.73Å; T120-E137 HydrophobicContact CG2-CB 4.31Å; T120-E137 HydrophobicContact CG2-CG 4.42Å; T120-I138 CarbonylContact C-O 3.36Å; T120-I138 WeakPolarHBondContact CA-O 3.48Å
121	Y	97.7	Very high	91.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.5	172.4	-67	-99.5	0	0	0	108.5	L44 T64 F65 I76 F91 L110 Y117 E137 I138 L140	L44-Y121 HydrophobicContact CD1-CD1 3.49Å; L44-Y121 VanDerWaalsContact CD1-CD1 3.49Å; L44-Y121 HydrophobicContact CD1-CD2 4.11Å; L44-Y121 HydrophobicContact CD1-CE1 4.04Å; L44-Y121 HydrophobicContact CD1-CG 3.53Å; T64-Y121 CarbonylContact O-C 3.47Å; T64-Y121 WeakPolarHBondContact O-CA 3.28Å; F65-Y121 HydrophobicContact CB-CD1 4.41Å; F65-Y121 HydrophobicContact CB-CE1 4.24Å; F65-Y121 HydrophobicContact CD2-CD1 4.17Å; F65-Y121 HydrophobicContact CD2-CD2 4.18Å; F65-Y121 AromaticContact CD2-CE1 3.67Å; F65-Y121 HydrophobicContact CD2-CE1 3.67Å; F65-Y121 AromaticContact CD2-CE2 3.65Å; F65-Y121 HydrophobicContact CD2-CE2 3.65Å; F65-Y121 HydrophobicContact CD2-CG 4.4Å; F65-Y121 AromaticContact CD2-CZ 3.38Å; F65-Y121 HydrophobicContact CE2-CE1 4.43Å; F65-Y121 AromaticContact CE2-CE2 3.81Å; F65-Y121 HydrophobicContact CE2-CE2 3.81Å; F65-Y121 AromaticContact CE2-CZ 3.71Å; F65-Y121 HydrophobicContact CG-CE1 4.28Å; I76-Y121 HydrophobicContact CD1-CD1 3.52Å; I76-Y121 HydrophobicContact CD1-CE1 3.62Å; F91-Y121 AromaticContact CE1-CE1 3.96Å; F91-Y121 HydrophobicContact CE1-CE1 3.96Å; F91-Y121 WeakPolarHBondContact CE1-OH 3.39Å; F91-Y121 HydrophobicContact CZ-CE1 4.06Å; F91-Y121 WeakPolarHBondContact CZ-OH 3.35Å; L110-Y121 HydrophobicContact CD1-CD1 4.36Å; L110-Y121 HydrophobicContact CD1-CE1 3.6Å; L110-Y121 HydrophobicContact CD1-CE2 4.43Å; Y117-Y121 WeakPolarHBondContact CB-OH 3.36Å; Y117-Y121 WeakPolarHBondContact O-CE2 3.42Å; Y117-Y121 PolarHBondContact O-OH 2.86Å; Y121-E137 CarbonylContact O-C 3.53Å; Y121-I138 PolarHBondContact N-O 3.34Å; Y121-I138 PolarHBondContact O-N 3.04Å; Y121-L140 HydrophobicContact CD2-CB 3.8Å; Y121-L140 HydrophobicContact CD2-CD2 4.45Å; Y121-L140 HydrophobicContact CE2-CB 3.56Å; Y121-L140 HydrophobicContact CE2-CD2 3.64Å; Y121-L140 HydrophobicContact CE2-CG 4.25Å
122	T	97.3	Very high	90.1	Very high	22 Å²	22	47.1 Å²	47.1	14%	0.135	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.2	-174.5	-62.6	0	0	0	0	108.9	W63 T64 V135 G136	W63-T122 CarbonylContact C-O 3.55Å; W63-T122 VanDerWaalsContact CA-O 3.25Å; W63-T122 WeakPolarHBondContact CA-O 3.07Å; T64-T122 PolarHBondContact N-O 3.39Å; T64-T122 PolarHBondContact O-N 2.88Å; T64-T122 WeakPolarHBondContact OG1-CB 3.3Å; T122-V135 HydrophobicContact CG2-CG1 3.06Å; T122-G136 CarbonylContact C-O 3.29Å; T122-G136 WeakPolarHBondContact CA-O 3.35Å
123	C	96.5	Very high	88.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.3	175.5	179.6	0	0	0	0	109	C46 W63 G136	C46-C123 HydrophobicContact CB-CB 3.67Å; C46-C123 WeakPolarHBondContact CB-SG 3.41Å; C46-C123 WeakPolarHBondContact SG-CB 3.17Å; C46-C123 CovalentContact SG-SG 2.04Å; C46-C123 PolarHBondContact SG-SG 3.43Å; W63-C123 HydrophobicContact CD2-CB 4.02Å; W63-C123 HydrophobicContact CE3-CB 4.07Å; W63-C123 HydrophobicContact CH2-CB 3.76Å; W63-C123 HydrophobicContact CZ2-CB 3.68Å; W63-C123 HydrophobicContact CZ3-CB 3.93Å; C123-G136 PolarHBondContact N-O 2.97Å; C123-G136 PolarHBondContact O-N 2.82Å
124	Q	94.4	Very high	88.1	Confident	57 Å²	57	45.8 Å²	45.8	27%	0.266	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.2	174.9	-173.7	178.1	9.5	0	0	109.4	V61 S62 H132	V61-Q124 WeakPolarHBondContact CA-O 3.41Å; S62-Q124 PolarHBondContact N-O 3.49Å; S62-Q124 PolarHBondContact O-N 3.47Å; Q124-H132 PolarHBondContact NE2-CD2 2.85Å
125	V	93.8	Very high	87.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.5	-179.4	-175.1	0	0	0	0	109.2	F48 V59 I60 V61 A106 G133	F48-V125 HydrophobicContact CB-CB 4.46Å; F48-V125 HydrophobicContact CB-CG1 4.41Å; F48-V125 HydrophobicContact CB-CG2 4.36Å; F48-V125 HydrophobicContact CD1-CB 4.43Å; F48-V125 HydrophobicContact CD1-CG1 3.83Å; F48-V125 HydrophobicContact CD1-CG2 4.04Å; F48-V125 HydrophobicContact CD2-CG1 4.02Å; F48-V125 HydrophobicContact CE1-CG1 4.02Å; F48-V125 HydrophobicContact CE2-CG1 4.2Å; F48-V125 HydrophobicContact CG-CB 4.37Å; F48-V125 HydrophobicContact CG-CG1 3.83Å; F48-V125 HydrophobicContact CG-CG2 4.34Å; F48-V125 HydrophobicContact CZ-CG1 4.2Å; V59-V125 HydrophobicContact CG1-CG1 4.26Å; I60-V125 WeakPolarHBondContact O-CA 3.39Å; V61-V125 HydrophobicContact CG1-CG2 4.42Å; V61-V125 HydrophobicContact CG2-CG1 4.4Å; V61-V125 HydrophobicContact CG2-CG2 4.32Å; A106-V125 HydrophobicContact CB-CG2 3.89Å; V125-G133 WeakPolarHBondContact O-CA 3.36Å; V125-G133 PolarHBondContact O-N 2.98Å
126	T	91.9	Very high	87.8	Confident	23 Å²	23	41.7 Å²	41.7	14%	0.141	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.4	175.8	-55.1	0	0	0	0	108.8	V59 I60	V59-T126 WeakPolarHBondContact CA-O 2.97Å; I60-T126 PolarHBondContact N-O 3.33Å; I60-T126 PolarHBondContact O-N 3.08Å
127	N	90.5	Very high	87.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.242	C	C	.	.			trans	-124.1	92.5	175.6	-177.8	34.6	0	0	0	109.3	M26 S50 A52 V59 D130	M26-N127 HydrophobicContact CE-CB 3.38Å; S50-N127 PolarHBondContact OG-ND2 3.33Å; A52-N127 PolarHBondContact O-ND2 3.18Å; V59-N127 HydrophobicContact CG2-CB 4.18Å; V59-N127 WeakPolarHBondContact CG2-OD1 3.37Å; N127-D130 WeakPolarHBondContact O-CA 3.25Å; N127-D130 WeakPolarHBondContact O-CB 3.37Å; N127-D130 PolarHBondContact O-N 3.09Å
128	P	86.5	Confident	88	Confident	54 Å²	54	42 Å²	42	35%	0.351	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	140.3	178.6	-24.8	34.9	0	0	0	111.9	L58	L58-P128 HydrophobicContact CB-CG 4.49Å; L58-P128 WeakPolarHBondContact O-CD 3.36Å
129	P	80.6	Confident	88.1	Confident	117 Å²	117	46.7 Å²	46.7	76%	0.76	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.7	4.4	8.7	36.3	-37.9	0	0	0	115	V131	P129-V131 PolarHBondContact O-N 2.92Å
130	D	69.8	Low	88.2	Confident	14 Å²	14	46.9 Å²	46.9	8%	0.075	26%	0.255	C	S	.	.	S	Bend	trans	-61.6	129.3	177.3	-63.3	-27.5	0	0	0	109.5	S24 S50 N127	S24-D130 PolarHBondContact OG-OD1 2.81Å; S50-D130 PolarHBondContact OG-OD2 3.49Å; N127-D130 WeakPolarHBondContact O-CA 3.25Å; N127-D130 WeakPolarHBondContact O-CB 3.37Å; N127-D130 PolarHBondContact O-N 3.09Å
131	V	64.4	Low	88.1	Confident	127 Å²	127	53.3 Å²	53.3	77%	0.77	28%	0.277	S	S	*	.			trans	-65.9	142.4	172.2	-174.7	0	0	0	0	108	P129 G133	P129-V131 PolarHBondContact O-N 2.92Å; V131-G133 PolarHBondContact O-N 2.82Å
132	H	66.4	Low	88	Confident	131 Å²	131	53.7 Å²	53.7	61%	0.606	28%	0.279	S	S	*	.	S	Bend	trans	-13.2	113.6	179.5	-70.1	92.6	0	0	0	114.1	Q124	Q124-H132 PolarHBondContact NE2-CD2 2.85Å
133	G	68.3	Low	87.8	Confident	5 Å²	5	54.1 Å²	54.1	5%	0.052	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-59.6	157.8	178.9	0	0	0	0	0	112.7	V125 V131	V125-G133 WeakPolarHBondContact O-CA 3.36Å; V125-G133 PolarHBondContact O-N 2.98Å; V131-G133 PolarHBondContact O-N 2.82Å
134	P	81.3	Confident	87.5	Confident	65 Å²	65	62.4 Å²	62.4	42%	0.422	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-58	149	173.6	26.9	-34.1	0	0	0	110.2	M26 V28	M26-P134 WeakPolarHBondContact O-CD 3.2Å; M26-P134 VanDerWaalsContact O-CG 3.27Å; M26-P134 WeakPolarHBondContact O-CG 3.36Å; V28-P134 HydrophobicContact CB-CG 4.44Å; V28-P134 HydrophobicContact CG2-CG 4.23Å; V28-P134 VanDerWaalsContact CG2-O 3.25Å; V28-P134 WeakPolarHBondContact CG2-O 3.41Å
135	V	90	Very high	87	Confident	81 Å²	81	64.6 Å²	64.6	49%	0.491	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-82.1	120.3	-175.5	-179.8	0	0	0	0	109.3	T122 E137	T122-V135 HydrophobicContact CG2-CG1 3.06Å; V135-E137 HydrophobicContact CG1-CG 4.47Å
136	G	94.8	Very high	86.1	Confident	5 Å²	5	67 Å²	67	5%	0.052	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.2	173.9	0	0	0	0	0	110.9	T122 C123	T122-G136 CarbonylContact C-O 3.29Å; T122-G136 WeakPolarHBondContact CA-O 3.35Å; C123-G136 PolarHBondContact N-O 2.97Å; C123-G136 PolarHBondContact O-N 2.82Å
137	E	96.9	Very high	85	Confident	110 Å²	110	69.6 Å²	69.6	51%	0.514	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	144.1	177	-67	-168.7	171.7	0	0	112.1	T30 T120 Y121 V135	T30-E137 PolarHBondContact OG1-O 2.95Å; T120-E137 HydrophobicContact CG2-CB 4.31Å; T120-E137 HydrophobicContact CG2-CG 4.42Å; Y121-E137 CarbonylContact O-C 3.53Å; V135-E137 HydrophobicContact CG1-CG 4.47Å
138	I	98.1	Very high	83.8	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.5	175.4	-63.4	170.3	0	0	0	108.8	T30 G32 V34 L44 K45 W63 T120 Y121	T30-I138 HydrophobicContact CG2-CD1 4.2Å; T30-I138 HydrophobicContact CG2-CG1 4.02Å; G32-I138 CarbonylContact O-C 3.6Å; G32-I138 WeakPolarHBondContact O-CA 3.39Å; G32-I138 WeakPolarHBondContact O-CG2 3.3Å; V34-I138 HydrophobicContact CB-CG2 4.33Å; V34-I138 HydrophobicContact CG2-CG2 3.77Å; L44-I138 HydrophobicContact CB-CD1 4Å; L44-I138 HydrophobicContact CD2-CG2 4.03Å; K45-I138 WeakPolarHBondContact O-CD1 3.33Å; W63-I138 HydrophobicContact CH2-CD1 3.63Å; W63-I138 HydrophobicContact CZ3-CD1 3.93Å; T120-I138 CarbonylContact C-O 3.36Å; T120-I138 WeakPolarHBondContact CA-O 3.48Å; Y121-I138 PolarHBondContact N-O 3.34Å; Y121-I138 PolarHBondContact O-N 3.04Å
139	R	97.5	Very high	83	Confident	139 Å²	139	77.7 Å²	77.7	53%	0.525	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	108.4	177.2	-57.8	175.6	78	112.7	-0.4	108.3	G32 D33 V34	G32-R139 PolarHBondContact O-N 3.37Å; D33-R139 VanDerWaalsContact OD1-CB 3.3Å; D33-R139 WeakPolarHBondContact OD1-CB 3.4Å; D33-R139 WeakPolarHBondContact OD1-CD 3.49Å; V34-R139 PolarHBondContact N-O 2.88Å
140	L	97.4	Very high	82.8	Confident	7 Å²	7	79.6 Å²	79.6	4%	0.037	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.6	179.5	-176.9	65.7	0	0	0	110.2	V34 A36 V42 L44 L110 G119 Y121 V142	V34-L140 HydrophobicContact CB-CD1 4.16Å; V34-L140 HydrophobicContact CG1-CD1 3.93Å; V34-L140 CarbonylContact O-C 3.57Å; V34-L140 WeakPolarHBondContact O-CA 3.43Å; A36-L140 HydrophobicContact CB-CD1 4.07Å; V42-L140 HydrophobicContact CG1-CD1 4.19Å; V42-L140 HydrophobicContact CG1-CD2 4.44Å; V42-L140 HydrophobicContact CG2-CD1 4.35Å; L44-L140 HydrophobicContact CD2-CD1 4.36Å; L110-L140 HydrophobicContact CD1-CD2 3.9Å; G119-L140 PolarHBondContact N-O 2.82Å; G119-L140 PolarHBondContact O-N 3.2Å; Y121-L140 HydrophobicContact CD2-CB 3.8Å; Y121-L140 HydrophobicContact CD2-CD2 4.45Å; Y121-L140 HydrophobicContact CE2-CB 3.56Å; Y121-L140 HydrophobicContact CE2-CD2 3.64Å; Y121-L140 HydrophobicContact CE2-CG 4.25Å; L140-V142 HydrophobicContact CD2-CG2 4.32Å; L140-V142 HydrophobicContact CG-CG2 4.28Å
141	R	96.1	Very high	83.1	Confident	163 Å²	163	84.2 Å²	84.2	62%	0.615	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.1	172.5	177.7	178.2	-88.7	-129.8	-1.2	110.3	V34 E35 A36 V143	V34-R141 PolarHBondContact O-N 3.41Å; E35-R141 CarbonylContact C-O 3.5Å; E35-R141 VanDerWaalsContact CA-O 3.26Å; E35-R141 WeakPolarHBondContact CA-O 3.05Å; E35-R141 HydrophobicContact CG-CB 4.33Å; E35-R141 WeakPolarHBondContact OE1-CD 3.01Å; A36-R141 PolarHBondContact N-O 2.92Å; R141-V143 HydrophobicContact CG-CG1 4.09Å
142	V	95.4	Very high	84	Confident	8 Å²	8	82.3 Å²	82.3	5%	0.048	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.4	177.8	-175.3	0	0	0	0	109.2	A36 N38 V113 F115 N118 L140	A36-V142 CarbonylContact O-C 3.59Å; A36-V142 WeakPolarHBondContact O-CA 3.32Å; N38-V142 HydrophobicContact CB-CG1 3.99Å; V113-V142 HydrophobicContact CB-CG2 4.36Å; V113-V142 HydrophobicContact CG2-CG1 4.11Å; V113-V142 HydrophobicContact CG2-CG2 4.26Å; F115-V142 HydrophobicContact CD1-CB 4.12Å; F115-V142 HydrophobicContact CD1-CG1 3.83Å; F115-V142 WeakPolarHBondContact CD1-O 2.99Å; F115-V142 HydrophobicContact CE1-CG1 4.04Å; F115-V142 WeakPolarHBondContact CE1-O 3.45Å; N118-V142 WeakPolarHBondContact OD1-CA 3.43Å; N118-V142 WeakPolarHBondContact OD1-CB 3.32Å; N118-V142 WeakPolarHBondContact OD1-CG2 3.46Å; N118-V142 PolarHBondContact OD1-N 2.75Å; L140-V142 HydrophobicContact CD2-CG2 4.32Å; L140-V142 HydrophobicContact CG-CG2 4.28Å
143	V	94.3	Very high	84.9	Confident	30 Å²	30	82.6 Å²	82.6	18%	0.182	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	160.7	-176.2	-65	0	0	0	0	111.4	A36 V37 N38 R141 T145	A36-V143 WeakPolarHBondContact O-CG2 3.44Å; A36-V143 PolarHBondContact O-N 2.84Å; V37-V143 WeakPolarHBondContact CA-O 3.37Å; V37-V143 HydrophobicContact CG2-CG2 4.18Å; N38-V143 PolarHBondContact N-O 2.9Å; R141-V143 HydrophobicContact CG-CG1 4.09Å; V143-T145 WeakPolarHBondContact CG2-O 3.25Å
144	K	90.4	Very high	85.9	Confident	174 Å²	174	87 Å²	87	76%	0.757	44%	0.435	S	S	*	.	S	Bend	trans	-75.3	-34.2	178	-73.6	177.7	-179.2	-178.4	0	112.7	F115	F115-K144 HydrophobicContact CE1-CG 4.24Å; F115-K144 HydrophobicContact CZ-CG 3.64Å
145	T	83	Confident	86.4	Confident	103 Å²	103	88.6 Å²	88.6	63%	0.632	44%	0.443	S	S	*	.	S	Bend	trans	-135.9	148.8	-175.8	50.8	0	0	0	0	108.3	V143 S147	V143-T145 WeakPolarHBondContact CG2-O 3.25Å; T145-S147 PolarHBondContact O-N 2.72Å
146	A	74	Confident	86.4	Confident	50 Å²	50	90.1 Å²	90.1	41%	0.413	45%	0.448	S	S	.	.			trans	-57	134.8	173.7	0	0	0	0	0	109.6	V37 F148	V37-A146 HydrophobicContact CG2-CB 3.92Å; A146-F148 VanDerWaalsContact C-N 3.32Å; A146-F148 PolarHBondContact O-N 3.15Å
147	S	68.8	Low	86.4	Confident	79 Å²	79	93.1 Å²	93.1	55%	0.552	47%	0.472	S	S	*	.			trans	-67.9	96.7	164.4	42.9	0	0	0	0	106.8	E35 T145 N149	E35-S147 WeakPolarHBondContact OE2-CB 3.36Å; E35-S147 PolarHBondContact OE2-OG 3.22Å; T145-S147 PolarHBondContact O-N 2.72Å; S147-N149 PolarHBondContact O-N 2.73Å
148	F	66.7	Low	86.3	Confident	121 Å²	121	92.9 Å²	92.9	53%	0.531	47%	0.473	S	S	.	.			trans	-63.2	121.7	167.9	-69.9	-77.8	0	0	0	106.9	A146 E150 L152 Y153	A146-F148 VanDerWaalsContact C-N 3.32Å; A146-F148 PolarHBondContact O-N 3.15Å; F148-E150 PolarHBondContact O-N 3.28Å; F148-L152 HydrophobicContact CD1-CD2 4.12Å; F148-Y153 HydrophobicContact CB-CD2 3.98Å; F148-Y153 HydrophobicContact CB-CE2 3.36Å; F148-Y153 HydrophobicContact CD2-CE2 4.43Å; F148-Y153 WeakPolarHBondContact CD2-OH 3.48Å; F148-Y153 HydrophobicContact CG-CE2 4.27Å
149	N	70.1	Confident	86.2	Confident	102 Å²	102	94.7 Å²	94.7	55%	0.545	49%	0.492	S	S	.	.			trans	-50.9	133.1	-176.4	-166.6	14.6	0	0	0	109.6	S147 L151 L152 Y153	S147-N149 PolarHBondContact O-N 2.73Å; N149-L151 PolarHBondContact O-N 3.46Å; N149-L152 WeakPolarHBondContact O-CB 3.44Å; N149-L152 PolarHBondContact O-N 3.03Å; N149-Y153 PolarHBondContact O-N 3.45Å
150	E	76.1	Confident	86.1	Confident	158 Å²	158	90.1 Å²	90.1	74%	0.738	49%	0.488	S	S	*	.	H	α-helix	trans	-53.1	-34	-179.6	-69.8	-175.5	159.9	0	0	111.4	F148 L152 Y153 L154	F148-E150 PolarHBondContact O-N 3.28Å; E150-L152 VanDerWaalsContact C-N 3.33Å; E150-L152 PolarHBondContact O-N 3.07Å; E150-Y153 PolarHBondContact O-N 2.82Å; E150-L154 WeakPolarHBondContact O-CG 3.38Å; E150-L154 PolarHBondContact O-N 2.84Å
151	L	76.4	Confident	86.1	Confident	111 Å²	111	91.6 Å²	91.6	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-60.1	-38	174.8	-63.7	175.8	0	0	0	113.2	N149 L154 V155	N149-L151 PolarHBondContact O-N 3.46Å; L151-L154 PolarHBondContact O-N 3.49Å; L151-V155 VanDerWaalsContact O-CG2 3.24Å; L151-V155 WeakPolarHBondContact O-CG2 3.42Å; L151-V155 PolarHBondContact O-N 3.02Å
152	L	82.3	Confident	86.1	Confident	87 Å²	87	89 Å²	89	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-68.7	-42	178.7	-175.7	66.7	0	0	0	110.9	F148 N149 E150 V155 L156	F148-L152 HydrophobicContact CD1-CD2 4.12Å; N149-L152 WeakPolarHBondContact O-CB 3.44Å; N149-L152 PolarHBondContact O-N 3.03Å; E150-L152 VanDerWaalsContact C-N 3.33Å; E150-L152 PolarHBondContact O-N 3.07Å; L152-V155 PolarHBondContact O-N 2.53Å; L152-L156 HydrophobicContact CG-CD1 4.38Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.41Å
153	Y	85.4	Confident	86.2	Confident	137 Å²	137	91.4 Å²	91.4	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-43.5	174.2	-81.7	-65.2	0	0	0	111.9	F148 N149 E150 V155 L156 A157	F148-Y153 HydrophobicContact CB-CD2 3.98Å; F148-Y153 HydrophobicContact CB-CE2 3.36Å; F148-Y153 HydrophobicContact CD2-CE2 4.43Å; F148-Y153 WeakPolarHBondContact CD2-OH 3.48Å; F148-Y153 HydrophobicContact CG-CE2 4.27Å; N149-Y153 PolarHBondContact O-N 3.45Å; E150-Y153 PolarHBondContact O-N 2.82Å; Y153-V155 PolarHBondContact O-N 2.81Å; Y153-L156 PolarHBondContact O-N 2.99Å; Y153-A157 WeakPolarHBondContact O-CB 3.37Å; Y153-A157 PolarHBondContact O-N 2.7Å
154	L	88.9	Confident	86.3	Confident	98 Å²	98	92.5 Å²	92.5	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-60.7	-44.8	176.6	-73.3	169.3	0	0	0	111.8	E150 L151 L156 A157 I158	E150-L154 WeakPolarHBondContact O-CG 3.38Å; E150-L154 PolarHBondContact O-N 2.84Å; L151-L154 PolarHBondContact O-N 3.49Å; L154-L156 PolarHBondContact O-N 2.95Å; L154-A157 PolarHBondContact O-N 2.9Å; L154-I158 WeakPolarHBondContact O-CB 3.49Å; L154-I158 WeakPolarHBondContact O-CD1 3.36Å; L154-I158 VanDerWaalsContact O-CG1 3.22Å; L154-I158 WeakPolarHBondContact O-CG1 3.25Å; L154-I158 PolarHBondContact O-N 2.82Å
155	V	91.5	Very high	86.7	Confident	98 Å²	98	88.3 Å²	88.3	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-44	177.7	169.9	0	0	0	0	111.4	L151 L152 Y153 G159	L151-V155 VanDerWaalsContact O-CG2 3.24Å; L151-V155 WeakPolarHBondContact O-CG2 3.42Å; L151-V155 PolarHBondContact O-N 3.02Å; L152-V155 PolarHBondContact O-N 2.53Å; Y153-V155 PolarHBondContact O-N 2.81Å; V155-G159 PolarHBondContact O-N 2.76Å
156	L	91.4	Very high	87.4	Confident	112 Å²	112	86.9 Å²	86.9	59%	0.586	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-41.8	177.4	-72.6	172.3	0	0	0	112.1	L152 Y153 L154 G160	L152-L156 HydrophobicContact CG-CD1 4.38Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.41Å; Y153-L156 PolarHBondContact O-N 2.99Å; L154-L156 PolarHBondContact O-N 2.95Å; L156-G160 PolarHBondContact O-N 2.87Å
157	A	93.3	Very high	88.5	Confident	68 Å²	68	91.2 Å²	91.2	56%	0.562	53%	0.525	S	S	*	.	H	α-helix	trans	-63.9	-46.9	177.9	0	0	0	0	0	111.9	Y153 L154 G161	Y153-A157 WeakPolarHBondContact O-CB 3.37Å; Y153-A157 PolarHBondContact O-N 2.7Å; L154-A157 PolarHBondContact O-N 2.9Å; A157-G161 PolarHBondContact O-N 2.8Å
158	I	95.3	Very high	89.8	Confident	105 Å²	105	90.7 Å²	90.7	54%	0.538	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-48.2	179.1	-65.3	164.8	0	0	0	110.4	L154 G160 G161 I162	L154-I158 WeakPolarHBondContact O-CB 3.49Å; L154-I158 WeakPolarHBondContact O-CD1 3.36Å; L154-I158 VanDerWaalsContact O-CG1 3.22Å; L154-I158 WeakPolarHBondContact O-CG1 3.25Å; L154-I158 PolarHBondContact O-N 2.82Å; I158-G160 PolarHBondContact O-N 2.83Å; I158-G161 PolarHBondContact O-N 2.87Å; I158-I162 HydrophobicContact CG2-CD1 3.9Å; I158-I162 WeakPolarHBondContact O-CG1 3.49Å; I158-I162 PolarHBondContact O-N 2.78Å
159	G	95.4	Very high	91.2	Very high	38 Å²	38	89.8 Å²	89.8	39%	0.392	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-44.1	179	0	0	0	0	0	112.4	V155 I162 A163	V155-G159 PolarHBondContact O-N 2.76Å; G159-I162 PolarHBondContact O-N 3.43Å; G159-A163 WeakPolarHBondContact O-CB 3.47Å; G159-A163 PolarHBondContact O-N 3.19Å
160	G	96.1	Very high	92.5	Very high	43 Å²	43	89.4 Å²	89.4	44%	0.443	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-42.2	175.3	0	0	0	0	0	112.8	L156 I158 A163 A164	L156-G160 PolarHBondContact O-N 2.87Å; I158-G160 PolarHBondContact O-N 2.83Å; G160-A163 PolarHBondContact O-N 3.07Å; G160-A164 WeakPolarHBondContact O-CB 3.4Å; G160-A164 PolarHBondContact O-N 3.06Å
161	G	96.7	Very high	93.4	Very high	38 Å²	38	85 Å²	85	39%	0.392	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-47.5	177.1	0	0	0	0	0	113	A157 I158 A163 A164 V165	A157-G161 PolarHBondContact O-N 2.8Å; I158-G161 PolarHBondContact O-N 2.87Å; G161-A163 PolarHBondContact O-N 2.04Å; G161-A164 PolarHBondContact O-N 2.93Å; G161-V165 WeakPolarHBondContact O-CG2 3.15Å; G161-V165 PolarHBondContact O-N 2.82Å
162	I	97.4	Very high	94.4	Very high	108 Å²	108	83.9 Å²	83.9	55%	0.554	50%	0.495	S	S	*	.	H	α-helix	trans	-62.4	-45.9	178.6	-64.8	167.6	0	0	0	110.5	I158 G159 A164 V165 V166	I158-I162 HydrophobicContact CG2-CD1 3.9Å; I158-I162 WeakPolarHBondContact O-CG1 3.49Å; I158-I162 PolarHBondContact O-N 2.78Å; G159-I162 PolarHBondContact O-N 3.43Å; I162-A164 VanDerWaalsContact C-N 3.32Å; I162-A164 PolarHBondContact O-N 2.75Å; I162-V165 PolarHBondContact O-N 2.91Å; I162-V166 HydrophobicContact CG2-CG2 4.42Å; I162-V166 WeakPolarHBondContact O-CG2 3.25Å; I162-V166 PolarHBondContact O-N 3.34Å
163	A	96.9	Very high	95	Very high	60 Å²	60	83 Å²	83	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-60	-42.6	178.2	0	0	0	0	0	111.9	G159 G160 G161 V166 F167	G159-A163 WeakPolarHBondContact O-CB 3.47Å; G159-A163 PolarHBondContact O-N 3.19Å; G160-A163 PolarHBondContact O-N 3.07Å; G161-A163 PolarHBondContact O-N 2.04Å; A163-V166 PolarHBondContact O-N 2.75Å; A163-F167 VanDerWaalsContact O-CB 3.32Å; A163-F167 WeakPolarHBondContact O-CB 3.24Å; A163-F167 PolarHBondContact O-N 2.93Å
164	A	97.1	Very high	95.4	Very high	52 Å²	52	79.2 Å²	79.2	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-43.2	177.2	0	0	0	0	0	112.3	G160 G161 I162 F167 C168	G160-A164 WeakPolarHBondContact O-CB 3.4Å; G160-A164 PolarHBondContact O-N 3.06Å; G161-A164 PolarHBondContact O-N 2.93Å; I162-A164 VanDerWaalsContact C-N 3.32Å; I162-A164 PolarHBondContact O-N 2.75Å; A164-F167 PolarHBondContact O-N 3.32Å; A164-C168 WeakPolarHBondContact O-CB 3.5Å; A164-C168 PolarHBondContact O-N 3.24Å; A164-C168 PolarHBondContact O-SG 2.91Å; A164-C168 VanDerWaalsContact O-SG 3.34Å
165	V	97.4	Very high	95.6	Very high	87 Å²	87	77.8 Å²	77.8	53%	0.527	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-47.4	177.3	172.4	0	0	0	0	111	G161 I162 F167 C168 L169	G161-V165 WeakPolarHBondContact O-CG2 3.15Å; G161-V165 PolarHBondContact O-N 2.82Å; I162-V165 PolarHBondContact O-N 2.91Å; V165-F167 VanDerWaalsContact C-N 3.33Å; V165-F167 PolarHBondContact O-N 3.12Å; V165-C168 PolarHBondContact O-N 3.36Å; V165-L169 HydrophobicContact CG1-CD1 4.24Å; V165-L169 WeakPolarHBondContact O-CG 3.26Å; V165-L169 PolarHBondContact O-N 2.91Å
166	V	97.5	Very high	95.7	Very high	73 Å²	73	81.2 Å²	81.2	44%	0.442	49%	0.487	S	S	.	.	H	α-helix	trans	-61	-43.8	178.4	173	0	0	0	0	110.8	I162 A163 L169 I170	I162-V166 HydrophobicContact CG2-CG2 4.42Å; I162-V166 WeakPolarHBondContact O-CG2 3.25Å; I162-V166 PolarHBondContact O-N 3.34Å; A163-V166 PolarHBondContact O-N 2.75Å; V166-L169 PolarHBondContact O-N 3.44Å; V166-I170 HydrophobicContact CG1-CD1 3.91Å; V166-I170 WeakPolarHBondContact O-CG1 3.21Å; V166-I170 PolarHBondContact O-N 3.07Å
167	F	97.1	Very high	95.7	Very high	140 Å²	140	84.6 Å²	84.6	61%	0.614	49%	0.492	S	S	*	.	H	α-helix	trans	-60.5	-46.8	176.3	-176.9	-100.5	0	0	0	112	A163 A164 V165 L169 I170 V171	A163-F167 VanDerWaalsContact O-CB 3.32Å; A163-F167 WeakPolarHBondContact O-CB 3.24Å; A163-F167 PolarHBondContact O-N 2.93Å; A164-F167 PolarHBondContact O-N 3.32Å; V165-F167 VanDerWaalsContact C-N 3.33Å; V165-F167 PolarHBondContact O-N 3.12Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.1Å; F167-I170 PolarHBondContact O-N 3.12Å; F167-V171 HydrophobicContact CD1-CG2 4.25Å; F167-V171 HydrophobicContact CE1-CG2 3.88Å; F167-V171 HydrophobicContact CE2-CG2 4.47Å; F167-V171 HydrophobicContact CZ-CG2 4Å; F167-V171 WeakPolarHBondContact O-CG2 3.46Å; F167-V171 PolarHBondContact O-N 2.83Å
168	C	96.6	Very high	95.4	Very high	69 Å²	69	85.5 Å²	85.5	47%	0.466	49%	0.493	S	S	.	.	H	α-helix	trans	-57.8	-43.5	175	-77.1	0	0	0	0	112.1	A164 V165 V171 I172	A164-C168 WeakPolarHBondContact O-CB 3.5Å; A164-C168 PolarHBondContact O-N 3.24Å; A164-C168 PolarHBondContact O-SG 2.91Å; A164-C168 VanDerWaalsContact O-SG 3.34Å; V165-C168 PolarHBondContact O-N 3.36Å; C168-V171 PolarHBondContact O-N 3.44Å; C168-I172 WeakPolarHBondContact O-CB 3Å; C168-I172 WeakPolarHBondContact O-CD1 3.06Å; C168-I172 WeakPolarHBondContact O-CG1 3.41Å; C168-I172 PolarHBondContact O-N 2.83Å
169	L	96.9	Very high	95	Very high	101 Å²	101	87.7 Å²	87.7	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-42.5	176.9	-69.3	176.4	0	0	0	112	V165 V166 F167 V171 I172 V173	V165-L169 HydrophobicContact CG1-CD1 4.24Å; V165-L169 WeakPolarHBondContact O-CG 3.26Å; V165-L169 PolarHBondContact O-N 2.91Å; V166-L169 PolarHBondContact O-N 3.44Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.1Å; L169-V171 PolarHBondContact O-N 2.76Å; L169-I172 PolarHBondContact O-N 3.02Å; L169-V173 WeakPolarHBondContact O-CB 3.27Å; L169-V173 VanDerWaalsContact O-CG2 3.28Å; L169-V173 WeakPolarHBondContact O-CG2 3.5Å; L169-V173 PolarHBondContact O-N 2.94Å
170	I	96.4	Very high	94.6	Very high	95 Å²	95	94.7 Å²	94.7	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176.6	-68.4	166.4	0	0	0	110.9	V166 F167 V173 S174	V166-I170 HydrophobicContact CG1-CD1 3.91Å; V166-I170 WeakPolarHBondContact O-CG1 3.21Å; V166-I170 PolarHBondContact O-N 3.07Å; F167-I170 PolarHBondContact O-N 3.12Å; I170-V173 PolarHBondContact O-N 2.89Å; I170-S174 VanDerWaalsContact O-CB 3.24Å; I170-S174 WeakPolarHBondContact O-CB 3.47Å; I170-S174 PolarHBondContact O-N 3.14Å; I170-S174 PolarHBondContact O-OG 2.8Å
171	V	96.3	Very high	94	Very high	66 Å²	66	98.7 Å²	98.7	40%	0.4	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-46.2	176.9	172.9	0	0	0	0	110.6	F167 C168 L169 V173 S174 C175	F167-V171 HydrophobicContact CD1-CG2 4.25Å; F167-V171 HydrophobicContact CE1-CG2 3.88Å; F167-V171 HydrophobicContact CE2-CG2 4.47Å; F167-V171 HydrophobicContact CZ-CG2 4Å; F167-V171 WeakPolarHBondContact O-CG2 3.46Å; F167-V171 PolarHBondContact O-N 2.83Å; C168-V171 PolarHBondContact O-N 3.44Å; L169-V171 PolarHBondContact O-N 2.76Å; V171-V173 PolarHBondContact O-N 3.17Å; V171-S174 PolarHBondContact O-N 3.46Å; V171-C175 WeakPolarHBondContact O-CB 3.33Å; V171-C175 PolarHBondContact O-N 2.85Å; V171-C175 PolarHBondContact O-SG 2.94Å; V171-C175 VanDerWaalsContact O-SG 3.34Å
172	I	96.2	Very high	93.1	Very high	86 Å²	86	102.2 Å²	102.2	44%	0.441	52%	0.524	S	S	.	.	H	α-helix	trans	-60.2	-47.7	178.2	-69.6	163.9	0	0	0	110.9	C168 L169 C175 R176	C168-I172 WeakPolarHBondContact O-CB 3Å; C168-I172 WeakPolarHBondContact O-CD1 3.06Å; C168-I172 WeakPolarHBondContact O-CG1 3.41Å; C168-I172 PolarHBondContact O-N 2.83Å; L169-I172 PolarHBondContact O-N 3.02Å; I172-C175 PolarHBondContact O-N 3.42Å; I172-R176 VanDerWaalsContact O-CG 3.32Å; I172-R176 WeakPolarHBondContact O-CG 3.44Å; I172-R176 PolarHBondContact O-N 3.31Å
173	V	95.5	Very high	92.2	Very high	69 Å²	69	105.1 Å²	105.1	42%	0.418	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-43.6	179.5	171.5	0	0	0	0	110.8	L169 I170 V171 R176 R177	L169-V173 WeakPolarHBondContact O-CB 3.27Å; L169-V173 VanDerWaalsContact O-CG2 3.28Å; L169-V173 WeakPolarHBondContact O-CG2 3.5Å; L169-V173 PolarHBondContact O-N 2.94Å; I170-V173 PolarHBondContact O-N 2.89Å; V171-V173 PolarHBondContact O-N 3.17Å; V173-R176 PolarHBondContact O-N 3.34Å; V173-R177 HydrophobicContact CG1-CG 4.45Å; V173-R177 WeakPolarHBondContact O-CB 3.5Å; V173-R177 WeakPolarHBondContact O-CG 3.38Å; V173-R177 PolarHBondContact O-N 3.3Å
174	S	93.2	Very high	91.2	Very high	57 Å²	57	108.2 Å²	108.2	40%	0.399	53%	0.533	S	S	.	.	H	α-helix	trans	-60	-48.8	176.1	-62.2	0	0	0	0	111.3	I170 V171 R176 R177 C178	I170-S174 VanDerWaalsContact O-CB 3.24Å; I170-S174 WeakPolarHBondContact O-CB 3.47Å; I170-S174 PolarHBondContact O-N 3.14Å; I170-S174 PolarHBondContact O-OG 2.8Å; V171-S174 PolarHBondContact O-N 3.46Å; S174-R176 VanDerWaalsContact C-N 3.33Å; S174-R176 PolarHBondContact O-N 3.24Å; S174-R177 PolarHBondContact O-N 3.18Å; S174-R177 VanDerWaalsContact O-N 3.16Å; S174-C178 WeakPolarHBondContact O-CB 3.49Å; S174-C178 PolarHBondContact O-N 3.28Å; S174-C178 PolarHBondContact O-SG 2.89Å
175	C	94	Very high	90	Very high	69 Å²	69	113.4 Å²	113.4	47%	0.466	54%	0.541	S	S	.	.	H	α-helix	trans	-58.4	-42.4	174.9	-76.1	0	0	0	0	112.4	V171 I172 C178 K179	V171-C175 WeakPolarHBondContact O-CB 3.33Å; V171-C175 PolarHBondContact O-N 2.85Å; V171-C175 PolarHBondContact O-SG 2.94Å; V171-C175 VanDerWaalsContact O-SG 3.34Å; I172-C175 PolarHBondContact O-N 3.42Å; C175-C178 PolarHBondContact O-N 3.41Å; C175-K179 WeakPolarHBondContact O-CB 3.39Å; C175-K179 WeakPolarHBondContact O-CG 3.15Å; C175-K179 PolarHBondContact O-N 2.6Å
176	R	93.1	Very high	88.6	Confident	170 Å²	170	115.6 Å²	115.6	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-65.7	-39.8	176.2	-72	-176	106.3	105.7	1.5	112	I172 V173 S174 R180	I172-R176 VanDerWaalsContact O-CG 3.32Å; I172-R176 WeakPolarHBondContact O-CG 3.44Å; I172-R176 PolarHBondContact O-N 3.31Å; V173-R176 PolarHBondContact O-N 3.34Å; S174-R176 VanDerWaalsContact C-N 3.33Å; S174-R176 PolarHBondContact O-N 3.24Å; R176-R180 WeakPolarHBondContact O-CB 3.45Å; R176-R180 WeakPolarHBondContact O-CG 3.34Å; R176-R180 PolarHBondContact O-N 3.24Å
177	R	90.7	Very high	87.1	Confident	183 Å²	183	118.1 Å²	118.1	69%	0.691	56%	0.556	S	S	*	*	H	α-helix	trans	-66.5	-45.1	175.2	-75.6	-174	178	177.3	0.1	111.7	V173 S174 K179 R180 K181	V173-R177 HydrophobicContact CG1-CG 4.45Å; V173-R177 WeakPolarHBondContact O-CB 3.5Å; V173-R177 WeakPolarHBondContact O-CG 3.38Å; V173-R177 PolarHBondContact O-N 3.3Å; S174-R177 PolarHBondContact O-N 3.18Å; S174-R177 VanDerWaalsContact O-N 3.16Å; R177-K179 PolarHBondContact O-N 2.77Å; R177-R180 PolarHBondContact O-N 3.15Å; R177-K181 WeakPolarHBondContact O-CB 3.43Å; R177-K181 PolarHBondContact O-N 2.61Å
178	C	86.9	Confident	85.5	Confident	86 Å²	86	116.8 Å²	116.8	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-58.9	-46.5	174.2	-69.9	0	0	0	0	111.2	S174 C175 K181 H182	S174-C178 WeakPolarHBondContact O-CB 3.49Å; S174-C178 PolarHBondContact O-N 3.28Å; S174-C178 PolarHBondContact O-SG 2.89Å; C175-C178 PolarHBondContact O-N 3.41Å; C178-K181 PolarHBondContact O-N 3Å; C178-H182 WeakPolarHBondContact O-CB 3.21Å; C178-H182 PolarHBondContact O-N 2.86Å
179	K	87.8	Confident	83.8	Confident	151 Å²	151	115.6 Å²	115.6	66%	0.657	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-41.9	175.5	-77	-170.9	178.4	-171.7	0	112.6	C175 R177 H182 R183	C175-K179 WeakPolarHBondContact O-CB 3.39Å; C175-K179 WeakPolarHBondContact O-CG 3.15Å; C175-K179 PolarHBondContact O-N 2.6Å; R177-K179 PolarHBondContact O-N 2.77Å; K179-H182 PolarHBondContact O-N 2.79Å; K179-R183 WeakPolarHBondContact O-CB 3.37Å; K179-R183 PolarHBondContact O-N 2.91Å
180	R	85.9	Confident	82	Confident	185 Å²	185	117.4 Å²	117.4	70%	0.698	56%	0.561	S	S	*	*	H	α-helix	trans	-62.3	-48.2	175.7	-81.6	-174.2	177.6	-175.7	-0.4	111.3	R176 R177 H182 R183 Q184	R176-R180 WeakPolarHBondContact O-CB 3.45Å; R176-R180 WeakPolarHBondContact O-CG 3.34Å; R176-R180 PolarHBondContact O-N 3.24Å; R177-R180 PolarHBondContact O-N 3.15Å; R180-H182 VanDerWaalsContact C-N 3.35Å; R180-H182 PolarHBondContact O-N 2.88Å; R180-R183 WeakPolarHBondContact O-CB 3.37Å; R180-R183 PolarHBondContact O-N 3.41Å; R180-Q184 PolarHBondContact O-N 2.9Å
181	K	83.8	Confident	80.2	Confident	128 Å²	128	121.1 Å²	121.1	56%	0.557	58%	0.577	S	S	*	*	H	α-helix	trans	-61.8	-40.9	177.9	-169.3	175.3	-174.6	177.1	0	112.1	R177 C178 Q184 R185	R177-K181 WeakPolarHBondContact O-CB 3.43Å; R177-K181 PolarHBondContact O-N 2.61Å; C178-K181 PolarHBondContact O-N 3Å; K181-Q184 PolarHBondContact O-N 2.87Å; K181-R185 WeakPolarHBondContact O-CG 3.45Å; K181-R185 PolarHBondContact O-N 2.98Å
182	H	79.3	Confident	78.4	Confident	112 Å²	112	125.7 Å²	125.7	52%	0.519	59%	0.593	S	S	.	*	H	α-helix	trans	-64.7	-41.1	174.9	-169.3	-73.9	0	0	0	111.9	C178 K179 R180 Q184 R185 Q186	C178-H182 WeakPolarHBondContact O-CB 3.21Å; C178-H182 PolarHBondContact O-N 2.86Å; K179-H182 PolarHBondContact O-N 2.79Å; R180-H182 VanDerWaalsContact C-N 3.35Å; R180-H182 PolarHBondContact O-N 2.88Å; H182-Q184 VanDerWaalsContact C-N 3.29Å; H182-Q184 PolarHBondContact O-N 3.48Å; H182-R185 PolarHBondContact O-N 3.3Å; H182-Q186 PolarHBondContact O-N 2.87Å; H182-Q186 VanDerWaalsContact O-N 3.09Å
183	R	77.7	Confident	76.4	Confident	168 Å²	168	126.5 Å²	126.5	63%	0.634	60%	0.602	S	S	*	*	H	α-helix	trans	-61.4	-39.5	176.1	-144.2	-171.5	-57.5	-117.9	4.6	111.6	K179 R180 Q186 L187	K179-R183 WeakPolarHBondContact O-CB 3.37Å; K179-R183 PolarHBondContact O-N 2.91Å; R180-R183 WeakPolarHBondContact O-CB 3.37Å; R180-R183 PolarHBondContact O-N 3.41Å; R183-Q186 PolarHBondContact O-N 2.92Å; R183-L187 PolarHBondContact O-N 2.97Å
184	Q	75.5	Confident	74.4	Confident	126 Å²	126	128.8 Å²	128.8	59%	0.589	62%	0.618	S	S	*	*	H	α-helix	trans	-68.7	-41	178.4	-160.4	161.1	-6.5	0	0	112.2	R180 K181 H182 Q186 L187 E188	R180-Q184 PolarHBondContact O-N 2.9Å; K181-Q184 PolarHBondContact O-N 2.87Å; H182-Q184 VanDerWaalsContact C-N 3.29Å; H182-Q184 PolarHBondContact O-N 3.48Å; Q184-Q186 VanDerWaalsContact C-N 3.32Å; Q184-Q186 PolarHBondContact O-N 3.36Å; Q184-L187 PolarHBondContact O-N 3.37Å; Q184-E188 PolarHBondContact O-N 2.93Å; Q184-E188 VanDerWaalsContact O-N 3.15Å
185	R	71.4	Confident	72.6	Confident	160 Å²	160	137.7 Å²	137.7	60%	0.604	64%	0.643	S	S	*	*	H	α-helix	trans	-64.6	-30.9	173.9	-73	179.4	175.9	-168.2	-6.1	114	K181 H182 G189	K181-R185 WeakPolarHBondContact O-CG 3.45Å; K181-R185 PolarHBondContact O-N 2.98Å; H182-R185 PolarHBondContact O-N 3.3Å; R185-G189 PolarHBondContact O-N 3.36Å; R185-G189 VanDerWaalsContact O-N 3.14Å
186	Q	69.3	Low	70.8	Confident	134 Å²	134	144 Å²	144	63%	0.626	66%	0.663	S	S	*	*	H	α-helix	trans	-74.2	-29.6	174.6	-77	-152.3	-34.2	0	0	113.1	H182 R183 Q184 D190	H182-Q186 PolarHBondContact O-N 2.87Å; H182-Q186 VanDerWaalsContact O-N 3.09Å; R183-Q186 PolarHBondContact O-N 2.92Å; Q184-Q186 VanDerWaalsContact C-N 3.32Å; Q184-Q186 PolarHBondContact O-N 3.36Å; Q186-D190 PolarHBondContact O-N 3.31Å
187	L	66.1	Low	69	Low	126 Å²	126	144.3 Å²	144.3	66%	0.66	67%	0.672	S	S	*	*	H	α-helix	trans	-69.3	-41.1	172.6	-88.8	144.9	0	0	0	111.6	R183 Q184	R183-L187 PolarHBondContact O-N 2.97Å; Q184-L187 PolarHBondContact O-N 3.37Å
188	E	63.5	Low	67.5	Low	111 Å²	111	146.5 Å²	146.5	52%	0.519	68%	0.68	S	S	.	*	H	α-helix	trans	-68.7	-36.1	176.8	-71.4	168.1	169.3	0	0	112.6	Q184 E191 E192	Q184-E188 PolarHBondContact O-N 2.93Å; Q184-E188 VanDerWaalsContact O-N 3.15Å; E188-E191 PolarHBondContact O-N 2.85Å; E188-E192 PolarHBondContact O-N 2.86Å
189	G	59.9	Low	65.9	Low	44 Å²	44	151.1 Å²	151.1	45%	0.454	69%	0.69	S	S	.	*	H	α-helix	trans	-75.2	-20.5	-179.8	0	0	0	0	0	115.9	R185	R185-G189 PolarHBondContact O-N 3.36Å; R185-G189 VanDerWaalsContact O-N 3.14Å
190	D	58.6	Low	64.8	Low	140 Å²	140	150.4 Å²	150.4	75%	0.749	69%	0.694	S	S	*	*	H	α-helix	trans	-83.4	-24.5	176	-151.6	33.8	0	0	0	111.5	Q186	Q186-D190 PolarHBondContact O-N 3.31Å
191	E	59.3	Low	63.6	Low	173 Å²	173	147.3 Å²	147.3	81%	0.808	70%	0.697	S	S	*	*	H	α-helix	trans	-81.1	-26.2	176.8	-157.5	173	165.8	0	0	112.6	E188 V193	E188-E191 PolarHBondContact O-N 2.85Å; E191-V193 PolarHBondContact O-N 3.36Å
192	E	58	Low	62.4	Low	161 Å²	161	147.5 Å²	147.5	75%	0.752	71%	0.71	S	S	*	*	S	Bend	trans	-81.8	-1.7	-179.7	-75	-170.5	177.3	0	0	115.2	E188 P194	E188-E192 PolarHBondContact O-N 2.86Å; E192-P194 WeakPolarHBondContact O-CD 3.3Å
193	V	55.8	Low	61.1	Low	104 Å²	104	145.4 Å²	145.4	63%	0.63	71%	0.711	S	S	*	*	S	Bend	trans	-74	108.5	175.2	-176.7	0	0	0	0	109.5	E191 R195	E191-V193 PolarHBondContact O-N 3.36Å; V193-R195 PolarHBondContact O-N 3.35Å
194	P	52.4	Low	59.6	Low	116 Å²	116	152.9 Å²	152.9	75%	0.753	74%	0.74	S	S	*	*			trans	-71.6	121.9	-176.3	-10.8	28.1	0	0	0	109.1	E192 K196	E192-P194 WeakPolarHBondContact O-CD 3.3Å; P194-K196 PolarHBondContact O-N 3.42Å
195	R	56.3	Low	58.8	Low	244 Å²	244	154.3 Å²	154.3	92%	0.921	75%	0.747	S	S	*	*			trans	-59.2	100.7	168.2	-166.3	-178.7	-148.2	-175	6.5	107.9	V193 E197	V193-R195 PolarHBondContact O-N 3.35Å; R195-E197 PolarHBondContact O-N 3.44Å
196	K	55.8	Low	58.2	Low	202 Å²	202	153.9 Å²	153.9	88%	0.878	76%	0.755	S	S	*	*			trans	-48.2	111.8	173.6	-118.9	-179.2	-178.9	178.9	0	108.6	P194 R198	P194-K196 PolarHBondContact O-N 3.42Å; K196-R198 PolarHBondContact O-N 3.09Å; K196-R198 VanDerWaalsContact O-N 3.13Å
197	E	56.1	Low	57.5	Low	177 Å²	177	155.1 Å²	155.1	83%	0.827	76%	0.762	S	S	*	*			trans	-53.4	115.9	171.7	-108.4	-175.4	155.3	0	0	109	R195 K199	R195-E197 PolarHBondContact O-N 3.44Å; E197-K199 PolarHBondContact O-N 3.4Å; E197-K199 VanDerWaalsContact O-N 3.14Å
198	R	57.3	Low	57	Low	228 Å²	228	156.8 Å²	156.8	86%	0.86	77%	0.768	S	S	*	*			trans	-72.8	99.2	165.5	175.9	176.5	-78.8	-163.9	-4.8	106.3	K196 D200	K196-R198 PolarHBondContact O-N 3.09Å; K196-R198 VanDerWaalsContact O-N 3.13Å; R198-D200 PolarHBondContact O-N 2.95Å
199	K	55	Low	56.6	Low	183 Å²	183	159.6 Å²	159.6	80%	0.796	78%	0.784	S	S	*	*			trans	-65.8	116.2	165.9	-76.8	-176.7	174.6	-177.9	0	108.4	E197	E197-K199 PolarHBondContact O-N 3.4Å; E197-K199 VanDerWaalsContact O-N 3.14Å
200	D	63.8	Low	56.4	Low	137 Å²	137	167.3 Å²	167.3	73%	0.733	81%	0.806	S	S	*	*			trans	-72.8	126.2	165.6	-106.1	-35.7	0	0	0	108.9	R198 T202	R198-D200 PolarHBondContact O-N 2.95Å; D200-T202 PolarHBondContact O-N 3.45Å
201	P	60.7	Low	56.3	Low	120 Å²	120	169.3 Å²	169.3	78%	0.779	81%	0.81	S	S	*	*			trans	-75.9	105.7	163.7	2.4	15.2	0	0	0	107.5
202	T	59.3	Low	56	Low	132 Å²	132	169 Å²	169	81%	0.81	81%	0.81	S	S	*	*			trans	-63	137	160.8	-28.7	0	0	0	0	108.9	D200	D200-T202 PolarHBondContact O-N 3.45Å
203	A	50.7	Low	55.9	Low	67 Å²	67	169.7 Å²	169.7	55%	0.554	82%	0.815	S	S	*	*				114.4	138.9	128.9	0	0	0	0	0	119
204	W	47.2	Very low	55.9	Low	326 Å²	326	175.6 Å²	175.6	100%	1.235	83%	0.831	S	S	*	*			trans	85.4	0	157	-50.4	101	0	0	0	118.2

Retrieved 204 of 204 residues in 178.5 ms (Link to these results)

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