A0A087YC13_POEFO Loading...

Discoidin domain receptor tyrosine kinase 1

AlphaFold DB , UniProt , Accession A0A087YC13, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 553 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	45.7	Very low	51.4	Low	221 Å²	221	118.5 Å²	118.5	100%	1.089	66%	0.655	S	S	*	*				0	-6.4	0	-66	-178	-157.9	0	0	114.3
2	A	42.7	Very low	52.4	Low	82 Å²	82	114.9 Å²	114.9	68%	0.678	64%	0.639	S	S	*	*	H	α-helix	trans	-84.4	-11.7	-178.4	0	0	0	0	0	115.6	T6	A2-T6 PolarHBondContact O-OG1 2.93Å
3	S	51.9	Low	53.5	Low	84 Å²	84	111.5 Å²	111.5	59%	0.587	62%	0.623	S	S	*	*	H	α-helix	trans	-89.6	-21.1	-172.1	-178.3	0	0	0	0	114.7
4	T	48.5	Very low	54.3	Low	106 Å²	106	110.8 Å²	110.8	65%	0.65	62%	0.615	S	S	*	*	H	α-helix	trans	-82.5	-35.2	-178.9	34.3	0	0	0	0	111.6	R7 L8	T4-R7 PolarHBondContact O-N 3.47Å; T4-L8 PolarHBondContact O-N 3.34Å; T4-L8 VanDerWaalsContact O-N 3.15Å
5	T	49.9	Very low	54.3	Low	85 Å²	85	107.1 Å²	107.1	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-68.1	-37.9	-179.9	-25.1	0	0	0	0	112.4	L8 L9	T5-L8 PolarHBondContact O-N 3.04Å; T5-L9 PolarHBondContact O-N 3.44Å; T5-L9 VanDerWaalsContact O-N 3.08Å
6	T	49.7	Very low	54.4	Low	95 Å²	95	104.9 Å²	104.9	58%	0.583	59%	0.59	S	S	*	*	H	α-helix	trans	-71.2	-35.3	178.6	-14.3	0	0	0	0	112.5	A2 L10	A2-T6 PolarHBondContact O-OG1 2.93Å; T6-L10 WeakPolarHBondContact O-CB 3.19Å; T6-L10 PolarHBondContact O-N 3.15Å
7	R	52.1	Low	54.2	Low	190 Å²	190	104.7 Å²	104.7	72%	0.717	59%	0.587	S	S	*	*	H	α-helix	trans	-66.8	-41.5	173.9	-77.9	-171.4	176.2	-166.5	-0.6	111.4	T4 L9 L10 V11	T4-R7 PolarHBondContact O-N 3.47Å; R7-L9 VanDerWaalsContact C-N 3.35Å; R7-L10 PolarHBondContact O-N 3.08Å; R7-V11 WeakPolarHBondContact O-CG2 3.46Å; R7-V11 PolarHBondContact O-N 3.04Å
8	L	53	Low	53.7	Low	128 Å²	128	101.4 Å²	101.4	67%	0.67	58%	0.575	S	S	*	*	H	α-helix	trans	-64.2	-40.9	177.9	-157.1	75.9	0	0	0	111.7	T4 T5 V11 T12	T4-L8 PolarHBondContact O-N 3.34Å; T4-L8 VanDerWaalsContact O-N 3.15Å; T5-L8 PolarHBondContact O-N 3.04Å; L8-V11 PolarHBondContact O-N 3.49Å; L8-T12 PolarHBondContact O-N 2.97Å; L8-T12 PolarHBondContact O-OG1 3.01Å
9	L	54.2	Low	53.1	Low	109 Å²	109	102.9 Å²	102.9	57%	0.571	58%	0.576	S	S	*	*	H	α-helix	trans	-65.7	-37.2	176.1	-121.8	128.5	0	0	0	112.9	T5 R7 T12 V13	T5-L9 PolarHBondContact O-N 3.44Å; T5-L9 VanDerWaalsContact O-N 3.08Å; R7-L9 VanDerWaalsContact C-N 3.35Å; L9-T12 WeakPolarHBondContact CA-OG1 3.05Å; L9-T12 PolarHBondContact O-OG1 3.02Å; L9-T12 VanDerWaalsContact O-OG1 3.09Å; L9-V13 WeakPolarHBondContact O-CB 3.36Å; L9-V13 WeakPolarHBondContact O-CG2 3.44Å; L9-V13 PolarHBondContact O-N 3.01Å
10	L	54.7	Low	52.5	Low	115 Å²	115	105 Å²	105	60%	0.602	58%	0.579	S	S	*	*	H	α-helix	trans	-69.6	-41.2	177.5	-159.9	90.5	0	0	0	111.2	T6 R7 V13 I14	T6-L10 WeakPolarHBondContact O-CB 3.19Å; T6-L10 PolarHBondContact O-N 3.15Å; R7-L10 PolarHBondContact O-N 3.08Å; L10-V13 PolarHBondContact O-N 3.45Å; L10-I14 HydrophobicContact CD2-CD1 4.09Å; L10-I14 HydrophobicContact CG-CD1 4.04Å; L10-I14 WeakPolarHBondContact O-CB 3.41Å; L10-I14 WeakPolarHBondContact O-CD1 3.16Å; L10-I14 WeakPolarHBondContact O-CG1 3.38Å; L10-I14 PolarHBondContact O-N 2.95Å
11	V	63.6	Low	51.8	Low	88 Å²	88	104.5 Å²	104.5	53%	0.533	58%	0.579	S	S	.	*	H	α-helix	trans	-65.6	-44.9	176.7	176.1	0	0	0	0	110.7	R7 L8 V13 I14 S15	R7-V11 WeakPolarHBondContact O-CG2 3.46Å; R7-V11 PolarHBondContact O-N 3.04Å; L8-V11 PolarHBondContact O-N 3.49Å; V11-V13 PolarHBondContact O-N 2.86Å; V11-I14 PolarHBondContact O-N 3.48Å; V11-S15 WeakPolarHBondContact O-CB 3.26Å; V11-S15 PolarHBondContact O-N 3.09Å; V11-S15 PolarHBondContact O-OG 3.29Å
12	T	62.6	Low	51.5	Low	76 Å²	76	99 Å²	99	47%	0.466	55%	0.553	S	S	.	*	H	α-helix	trans	-64.9	-38.7	177.1	44	0	0	0	0	112.7	L8 L9 S15 V16	L8-T12 PolarHBondContact O-N 2.97Å; L8-T12 PolarHBondContact O-OG1 3.01Å; L9-T12 WeakPolarHBondContact CA-OG1 3.05Å; L9-T12 PolarHBondContact O-OG1 3.02Å; L9-T12 VanDerWaalsContact O-OG1 3.09Å; T12-S15 PolarHBondContact O-N 3Å; T12-V16 WeakPolarHBondContact O-CB 3.38Å; T12-V16 WeakPolarHBondContact O-CG2 3.45Å; T12-V16 PolarHBondContact O-N 3.47Å
13	V	66.8	Low	51.4	Low	71 Å²	71	97.7 Å²	97.7	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-39.7	175.3	170.7	0	0	0	0	111.5	L9 L10 V11 L17	L9-V13 WeakPolarHBondContact O-CB 3.36Å; L9-V13 WeakPolarHBondContact O-CG2 3.44Å; L9-V13 PolarHBondContact O-N 3.01Å; L10-V13 PolarHBondContact O-N 3.45Å; V11-V13 PolarHBondContact O-N 2.86Å; V13-L17 HydrophobicContact CG1-CD1 3.76Å; V13-L17 HydrophobicContact CG1-CG 4.3Å; V13-L17 VanDerWaalsContact O-CB 3.27Å; V13-L17 WeakPolarHBondContact O-CB 3.28Å; V13-L17 WeakPolarHBondContact O-CG 3.14Å; V13-L17 PolarHBondContact O-N 3.29Å
14	I	64.7	Low	50.8	Low	101 Å²	101	97.9 Å²	97.9	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-40.2	175.9	-68.9	166.4	0	0	0	111	L10 V11 L17 A18	L10-I14 HydrophobicContact CD2-CD1 4.09Å; L10-I14 HydrophobicContact CG-CD1 4.04Å; L10-I14 WeakPolarHBondContact O-CB 3.41Å; L10-I14 WeakPolarHBondContact O-CD1 3.16Å; L10-I14 WeakPolarHBondContact O-CG1 3.38Å; L10-I14 PolarHBondContact O-N 2.95Å; V11-I14 PolarHBondContact O-N 3.48Å; I14-L17 PolarHBondContact O-N 2.76Å; I14-A18 VanDerWaalsContact O-CB 3.26Å; I14-A18 WeakPolarHBondContact O-CB 3.39Å; I14-A18 PolarHBondContact O-N 2.89Å
15	S	54.5	Low	50.6	Low	56 Å²	56	100.1 Å²	100.1	39%	0.392	54%	0.543	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175.2	-62.3	0	0	0	0	112	V11 T12 A18 E19	V11-S15 WeakPolarHBondContact O-CB 3.26Å; V11-S15 PolarHBondContact O-N 3.09Å; V11-S15 PolarHBondContact O-OG 3.29Å; T12-S15 PolarHBondContact O-N 3Å; S15-A18 PolarHBondContact O-N 2.85Å; S15-E19 WeakPolarHBondContact O-CB 3.39Å; S15-E19 WeakPolarHBondContact O-CG 3.45Å; S15-E19 PolarHBondContact O-N 3.2Å
16	V	56.2	Low	50.6	Low	71 Å²	71	100.1 Å²	100.1	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-38.6	176.9	171.5	0	0	0	0	111.3	T12 E19 F20	T12-V16 WeakPolarHBondContact O-CB 3.38Å; T12-V16 WeakPolarHBondContact O-CG2 3.45Å; T12-V16 PolarHBondContact O-N 3.47Å; V16-E19 PolarHBondContact O-N 3.46Å; V16-F20 HydrophobicContact CG1-CD2 4.03Å; V16-F20 HydrophobicContact CG1-CE2 4.4Å; V16-F20 WeakPolarHBondContact O-CB 3.18Å; V16-F20 WeakPolarHBondContact O-CD2 3.27Å; V16-F20 PolarHBondContact O-N 2.82Å
17	L	50.6	Low	51.1	Low	102 Å²	102	101.2 Å²	101.2	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-69.8	-35.6	174.9	-73.2	171.4	0	0	0	112.1	V13 I14 F20 V21	V13-L17 HydrophobicContact CG1-CD1 3.76Å; V13-L17 HydrophobicContact CG1-CG 4.3Å; V13-L17 VanDerWaalsContact O-CB 3.27Å; V13-L17 WeakPolarHBondContact O-CB 3.28Å; V13-L17 WeakPolarHBondContact O-CG 3.14Å; V13-L17 PolarHBondContact O-N 3.29Å; I14-L17 PolarHBondContact O-N 2.76Å; L17-F20 PolarHBondContact O-N 3.45Å; L17-V21 WeakPolarHBondContact O-CB 3.19Å; L17-V21 WeakPolarHBondContact O-CG2 3.5Å; L17-V21 PolarHBondContact O-N 2.87Å
18	A	44.8	Very low	52.4	Low	45 Å²	45	99.8 Å²	99.8	37%	0.372	54%	0.538	S	S	.	.	H	α-helix	trans	-66.2	-43.4	172.7	0	0	0	0	0	111	I14 S15 F20 V21 I22	I14-A18 VanDerWaalsContact O-CB 3.26Å; I14-A18 WeakPolarHBondContact O-CB 3.39Å; I14-A18 PolarHBondContact O-N 2.89Å; S15-A18 PolarHBondContact O-N 2.85Å; A18-F20 PolarHBondContact O-N 3.41Å; A18-V21 PolarHBondContact O-N 2.86Å; A18-I22 WeakPolarHBondContact O-CB 3.42Å; A18-I22 WeakPolarHBondContact O-CD1 3.29Å; A18-I22 WeakPolarHBondContact O-CG1 3.33Å; A18-I22 PolarHBondContact O-N 3.22Å
19	E	42	Very low	54	Low	130 Å²	130	95.1 Å²	95.1	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-39.3	173	-76.1	172.4	-178.8	0	0	112.2	S15 V16 S23	S15-E19 WeakPolarHBondContact O-CB 3.39Å; S15-E19 WeakPolarHBondContact O-CG 3.45Å; S15-E19 PolarHBondContact O-N 3.2Å; V16-E19 PolarHBondContact O-N 3.46Å; E19-S23 VanDerWaalsContact O-CB 3.23Å; E19-S23 WeakPolarHBondContact O-CB 3.34Å; E19-S23 PolarHBondContact O-N 2.86Å
20	F	41.9	Very low	55.6	Low	144 Å²	144	93.7 Å²	93.7	63%	0.632	50%	0.501	S	S	*	.	H	α-helix	trans	-68.8	-36.7	174.7	-105.2	-87.6	0	0	0	113.3	V16 L17 A18 S24	V16-F20 HydrophobicContact CG1-CD2 4.03Å; V16-F20 HydrophobicContact CG1-CE2 4.4Å; V16-F20 WeakPolarHBondContact O-CB 3.18Å; V16-F20 WeakPolarHBondContact O-CD2 3.27Å; V16-F20 PolarHBondContact O-N 2.82Å; L17-F20 PolarHBondContact O-N 3.45Å; A18-F20 PolarHBondContact O-N 3.41Å; F20-S24 WeakPolarHBondContact O-CB 3.38Å; F20-S24 PolarHBondContact O-N 2.74Å
21	V	37.3	Very low	57.1	Low	95 Å²	95	89.8 Å²	89.8	58%	0.576	48%	0.48	S	S	*	.	H	α-helix	trans	-72.6	-37.6	176.8	170.7	0	0	0	0	110.8	L17 A18 S24	L17-V21 WeakPolarHBondContact O-CB 3.19Å; L17-V21 WeakPolarHBondContact O-CG2 3.5Å; L17-V21 PolarHBondContact O-N 2.87Å; A18-V21 PolarHBondContact O-N 2.86Å; V21-S24 PolarHBondContact O-N 2.94Å
22	I	40.9	Very low	58.2	Low	106 Å²	106	88.7 Å²	88.7	54%	0.544	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-44.2	173.2	-65.7	162.5	0	0	0	110.3	A18 S24 E25 D26	A18-I22 WeakPolarHBondContact O-CB 3.42Å; A18-I22 WeakPolarHBondContact O-CD1 3.29Å; A18-I22 WeakPolarHBondContact O-CG1 3.33Å; A18-I22 PolarHBondContact O-N 3.22Å; I22-S24 VanDerWaalsContact C-N 3.26Å; I22-S24 PolarHBondContact O-N 2.8Å; I22-E25 PolarHBondContact O-N 3.24Å; I22-D26 PolarHBondContact O-N 2.88Å
23	S	39.8	Very low	59.3	Low	55 Å²	55	86.6 Å²	86.6	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-62.7	-29.8	175.1	166.4	0	0	0	0	113.5	E19 E25 H27	E19-S23 VanDerWaalsContact O-CB 3.23Å; E19-S23 WeakPolarHBondContact O-CB 3.34Å; E19-S23 PolarHBondContact O-N 2.86Å; S23-E25 VanDerWaalsContact C-N 3.31Å; S23-E25 PolarHBondContact O-N 2.89Å; S23-H27 PolarHBondContact O-CD2 2.84Å; S23-H27 VanDerWaalsContact O-CD2 3.24Å
24	S	38.5	Very low	60.1	Low	88 Å²	88	88.1 Å²	88.1	62%	0.615	47%	0.468	S	S	*	.	H	α-helix	trans	-71.2	-23.7	177.8	176.7	0	0	0	0	113.3	F20 V21 I22	F20-S24 WeakPolarHBondContact O-CB 3.38Å; F20-S24 PolarHBondContact O-N 2.74Å; V21-S24 PolarHBondContact O-N 2.94Å; I22-S24 VanDerWaalsContact C-N 3.26Å; I22-S24 PolarHBondContact O-N 2.8Å
25	E	44.1	Very low	61.3	Low	152 Å²	152	89 Å²	89	71%	0.71	47%	0.47	S	S	*	.	H	α-helix	trans	-87.6	-27.6	177.3	-67.6	-161.2	156	0	0	112.4	I22 S23 H27 K28	I22-E25 PolarHBondContact O-N 3.24Å; S23-E25 VanDerWaalsContact C-N 3.31Å; S23-E25 PolarHBondContact O-N 2.89Å; E25-H27 PolarHBondContact O-N 2.81Å; E25-H27 VanDerWaalsContact O-N 3.15Å; E25-K28 PolarHBondContact O-N 3.25Å
26	D	51.1	Low	63.2	Low	86 Å²	86	86.3 Å²	86.3	46%	0.46	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-14.2	-176.9	-79.5	-26.9	0	0	0	115.2	I22 S342	I22-D26 PolarHBondContact O-N 2.88Å; D26-S342 PolarHBondContact O-OG 3.17Å
27	H	59.2	Low	65.1	Low	118 Å²	118	87.6 Å²	87.6	55%	0.546	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.4	-178.1	-63.8	-50.3	0	0	0	114.4	S23 E25 P340	S23-H27 PolarHBondContact O-CD2 2.84Å; S23-H27 VanDerWaalsContact O-CD2 3.24Å; E25-H27 PolarHBondContact O-N 2.81Å; E25-H27 VanDerWaalsContact O-N 3.15Å; H27-P340 WeakPolarHBondContact O-CG 3.32Å
28	K	79.7	Confident	67.3	Low	160 Å²	160	88.5 Å²	88.5	70%	0.696	45%	0.446	S	S	*	.	S	Bend	trans	-81.7	129.6	177.9	-166.8	179.6	174.8	-171.3	0	109.3	E25 H30 Q290	E25-K28 PolarHBondContact O-N 3.25Å; K28-H30 PolarHBondContact O-N 2.82Å; K28-Q290 PolarHBondContact O-NE2 2.84Å; K28-Q290 VanDerWaalsContact O-NE2 3.09Å
29	W	87.9	Confident	69.8	Low	29 Å²	29	87.6 Å²	87.6	11%	0.11	44%	0.438	C	S	.	.			trans	-62.5	129	169.7	-173.5	-102.1	0	0	0	109.7	F31 L242 Q290 H292 P340 E368 S370	W29-F31 PolarHBondContact NE1-O 3.15Å; W29-L242 HydrophobicContact CB-CD1 3.84Å; W29-L242 HydrophobicContact CD2-CD1 4.25Å; W29-L242 HydrophobicContact CD2-CD2 3.74Å; W29-L242 HydrophobicContact CE3-CD2 4.14Å; W29-L242 HydrophobicContact CG-CD1 3.74Å; W29-L242 HydrophobicContact CG-CD2 4.05Å; W29-L242 HydrophobicContact CG-CG 4.42Å; W29-L242 HydrophobicContact CH2-CD2 4.5Å; W29-L242 HydrophobicContact CZ2-CD2 4.22Å; W29-L242 HydrophobicContact CZ3-CD2 4.46Å; W29-Q290 HydrophobicContact CE3-CB 4.02Å; W29-Q290 HydrophobicContact CH2-CB 4.2Å; W29-Q290 HydrophobicContact CZ3-CB 3.59Å; W29-H292 HydrophobicContact CE3-CB 4.43Å; W29-H292 HydrophobicContact CZ3-CB 4.02Å; W29-P340 HydrophobicContact CE3-CB 3.94Å; W29-E368 HydrophobicContact CH2-CB 3.87Å; W29-E368 HydrophobicContact CH2-CG 3.37Å; W29-E368 HydrophobicContact CZ2-CB 3.98Å; W29-E368 HydrophobicContact CZ2-CG 3.04Å; W29-E368 HydrophobicContact CZ3-CG 4.46Å; W29-S370 WeakPolarHBondContact CH2-OG 3.41Å; W29-S370 VanDerWaalsContact CZ2-CB 3.49Å; W29-S370 WeakPolarHBondContact CZ2-OG 3.35Å
30	H	86	Confident	72.5	Confident	79 Å²	79	82.5 Å²	82.5	37%	0.366	42%	0.415	S	S	.	.	S	Bend	trans	-85.4	-26.6	-167.1	72.2	-90.7	0	0	0	114.5	K28 Q290 S370 L372	K28-H30 PolarHBondContact O-N 2.82Å; H30-Q290 VanDerWaalsContact N-OE1 3.17Å; H30-Q290 PolarHBondContact ND1-OE1 3.03Å; H30-S370 WeakPolarHBondContact CE1-CB 3.39Å; H30-S370 PolarHBondContact CE1-OG 3.49Å; H30-S370 PolarHBondContact ND1-OG 3.28Å; H30-L372 WeakPolarHBondContact CE1-CD1 3.3Å; H30-L372 VanDerWaalsContact ND1-CD1 3.28Å; H30-L372 WeakPolarHBondContact ND1-CD1 3.38Å
31	F	87.6	Confident	75.1	Confident	34 Å²	34	75.7 Å²	75.7	15%	0.149	39%	0.385	C	S	.	.			trans	-98.6	112.2	-179.7	179.1	-112	0	0	0	110.9	W29 P33 C36 F101 W192	W29-F31 PolarHBondContact NE1-O 3.15Å; F31-P33 HydrophobicContact CD1-CG 4.17Å; F31-P33 HydrophobicContact CE1-CB 4.35Å; F31-P33 HydrophobicContact CE1-CG 3.86Å; F31-P33 WeakPolarHBondContact O-CD 3.49Å; F31-C36 HydrophobicContact CE2-CB 4.47Å; F31-C36 HydrophobicContact CZ-CB 4.43Å; F31-F101 HydrophobicContact CE1-CD2 4.22Å; F31-F101 HydrophobicContact CE1-CE1 4.49Å; F31-F101 AromaticContact CE1-CE2 3.89Å; F31-F101 HydrophobicContact CE1-CE2 3.89Å; F31-F101 HydrophobicContact CE1-CZ 4.01Å; F31-F101 HydrophobicContact CZ-CB 4.48Å; F31-F101 HydrophobicContact CZ-CD1 4.09Å; F31-F101 AromaticContact CZ-CD2 3.91Å; F31-F101 HydrophobicContact CZ-CD2 3.91Å; F31-F101 HydrophobicContact CZ-CE1 4.18Å; F31-F101 AromaticContact CZ-CE2 4Å; F31-F101 HydrophobicContact CZ-CE2 4Å; F31-F101 AromaticContact CZ-CG 3.92Å; F31-F101 HydrophobicContact CZ-CG 3.92Å; F31-F101 HydrophobicContact CZ-CZ 4.1Å; F31-W192 HydrophobicContact CE1-CZ3 4.15Å; F31-W192 HydrophobicContact CE2-CZ3 4.39Å; F31-W192 HydrophobicContact CZ-CZ3 4.01Å
32	D	86.1	Confident	78	Confident	64 Å²	64	71.1 Å²	71.1	34%	0.342	36%	0.357	S	S	.	.			trans	-105.9	104.7	177.3	-175.6	-5.9	0	0	0	110.6	T34 Q35	D32-T34 PolarHBondContact O-N 2.7Å; D32-T34 WeakPolarHBondContact OD1-CB 3.12Å; D32-T34 PolarHBondContact OD1-N 2.81Å; D32-T34 PolarHBondContact OD1-OG1 2.89Å; D32-T34 PolarHBondContact OD2-OG1 3.02Å; D32-Q35 HydrophobicContact CB-CB 4.5Å; D32-Q35 HydrophobicContact CB-CG 4.34Å; D32-Q35 PolarHBondContact O-N 3.1Å; D32-Q35 VanDerWaalsContact O-N 3.11Å; D32-Q35 PolarHBondContact OD2-NE2 2.87Å
33	P	84.9	Confident	80.7	Confident	33 Å²	33	69.2 Å²	69.2	21%	0.214	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-63.5	-24.8	-178.8	-18.5	30.2	0	0	0	112.9	F31 Q35 C36 F101 G240	F31-P33 HydrophobicContact CD1-CG 4.17Å; F31-P33 HydrophobicContact CE1-CB 4.35Å; F31-P33 HydrophobicContact CE1-CG 3.86Å; F31-P33 WeakPolarHBondContact O-CD 3.49Å; P33-Q35 PolarHBondContact O-N 3.44Å; P33-C36 PolarHBondContact O-N 3.37Å; P33-F101 HydrophobicContact CB-CE1 4.31Å; P33-F101 HydrophobicContact CB-CZ 4.35Å; P33-G240 WeakPolarHBondContact CG-O 3.33Å
34	T	85.2	Confident	83.4	Confident	103 Å²	103	71.3 Å²	71.3	63%	0.632	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23.8	179.5	71.2	0	0	0	0	111.9	D32	D32-T34 PolarHBondContact O-N 2.7Å; D32-T34 WeakPolarHBondContact OD1-CB 3.12Å; D32-T34 PolarHBondContact OD1-N 2.81Å; D32-T34 PolarHBondContact OD1-OG1 2.89Å; D32-T34 PolarHBondContact OD2-OG1 3.02Å
35	Q	89.3	Confident	86.1	Confident	118 Å²	118	69.1 Å²	69.1	55%	0.551	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-93.5	1.3	175.1	-61.2	-179.6	36.5	0	0	112.7	D32 P33 Y38	D32-Q35 HydrophobicContact CB-CB 4.5Å; D32-Q35 HydrophobicContact CB-CG 4.34Å; D32-Q35 PolarHBondContact O-N 3.1Å; D32-Q35 VanDerWaalsContact O-N 3.11Å; D32-Q35 PolarHBondContact OD2-NE2 2.87Å; P33-Q35 PolarHBondContact O-N 3.44Å; Q35-Y38 WeakPolarHBondContact O-CE2 3.49Å; Q35-Y38 VanDerWaalsContact O-CZ 3.26Å; Q35-Y38 PolarHBondContact O-OH 3.18Å
36	C	94.1	Very high	88.6	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	34%	0.34	C	S	.	.			trans	-105.2	58.7	-178.6	-173.9	0	0	0	0	110.8	F31 P33 F101 G189 C190	F31-C36 HydrophobicContact CE2-CB 4.47Å; F31-C36 HydrophobicContact CZ-CB 4.43Å; P33-C36 PolarHBondContact O-N 3.37Å; C36-F101 HydrophobicContact CB-CD1 4.35Å; C36-F101 WeakPolarHBondContact SG-CD1 3.44Å; C36-G189 WeakPolarHBondContact O-CA 3.13Å; C36-C190 HydrophobicContact CB-CB 3.98Å; C36-C190 WeakPolarHBondContact CB-SG 3.05Å; C36-C190 WeakPolarHBondContact SG-CB 3.48Å; C36-C190 PolarHBondContact SG-N 3.31Å; C36-C190 CovalentContact SG-SG 2.03Å; C36-C190 PolarHBondContact SG-SG 3.37Å
37	R	95.8	Very high	90.9	Very high	98 Å²	98	63.1 Å²	63.1	37%	0.37	32%	0.321	S	S	.	.			trans	-137.3	29.3	-171.7	-59.5	178	70.5	92.7	-13.1	112.8	A103 L104 D159	R37-A103 HydrophobicContact CG-CB 4.47Å; R37-L104 HydrophobicContact CB-CD1 3.96Å; R37-L104 HydrophobicContact CG-CD1 3.77Å; R37-L104 VanDerWaalsContact NH1-CD1 3.31Å; R37-D159 IonicContact CZ-OD1 3.8Å; R37-D159 IonicContact NH1-OD1 3.79Å; R37-D159 PolarHBondContact NH1-OD1 3.49Å; R37-D159 IonicContact NH2-OD1 3.28Å; R37-D159 PolarHBondContact NH2-OD1 3.02Å; R37-D159 IonicContact NH2-OD2 3.72Å
38	Y	96.6	Very high	92.8	Very high	121 Å²	121	60.1 Å²	60.1	48%	0.475	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.6	-179.9	-53.6	-75.6	0	0	0	110.8	Q35 L40 Y188 G189 C190	Q35-Y38 WeakPolarHBondContact O-CE2 3.49Å; Q35-Y38 VanDerWaalsContact O-CZ 3.26Å; Q35-Y38 PolarHBondContact O-OH 3.18Å; Y38-L40 PolarHBondContact O-N 2.87Å; Y38-Y188 CarbonylContact O-C 3.59Å; Y38-Y188 WeakPolarHBondContact O-CA 3.28Å; Y38-G189 PolarHBondContact N-O 2.74Å; Y38-G189 PolarHBondContact O-N 3.41Å; Y38-C190 HydrophobicContact CD2-CB 4.43Å
39	A	97.9	Very high	93.6	Very high	25 Å²	25	56.4 Å²	56.4	21%	0.207	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	133.2	169.1	0	0	0	0	0	109.5	E186 Y188	A39-E186 HydrophobicContact CB-CG 4.16Å; A39-Y188 HydrophobicContact CB-CD1 4.17Å; A39-Y188 HydrophobicContact CB-CE1 4.01Å
40	L	98.3	Very high	94.1	Very high	24 Å²	24	59.4 Å²	59.4	13%	0.126	33%	0.325	C	S	.	.			trans	-90.5	-13	-173.9	-63.1	-173.2	0	0	0	113.1	Y38 I47 L96 H100 V102 L187	Y38-L40 PolarHBondContact O-N 2.87Å; L40-I47 HydrophobicContact CB-CD1 4.48Å; L40-I47 WeakPolarHBondContact O-CG1 3.38Å; L40-L96 HydrophobicContact CB-CD2 4.32Å; L40-L96 HydrophobicContact CD1-CD1 3.91Å; L40-L96 HydrophobicContact CD1-CD2 4.27Å; L40-H100 HydrophobicContact CD1-CB 4.28Å; L40-V102 HydrophobicContact CD1-CG2 4.16Å; L40-L187 HydrophobicContact CB-CB 4.23Å; L40-L187 WeakPolarHBondContact CB-O 3.42Å; L40-L187 HydrophobicContact CD1-CB 3.83Å; L40-L187 HydrophobicContact CG-CB 4.23Å; L40-L187 WeakPolarHBondContact CG-O 3.41Å; L40-L187 PolarHBondContact N-O 3.3Å
41	G	97.9	Very high	94.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	128.4	24.6	158.6	0	0	0	0	0	116.2	D44 G45 T46 I47 R68 E186	G41-D44 WeakPolarHBondContact CA-OD1 3.18Å; G41-G45 PolarHBondContact O-N 3.35Å; G41-T46 PolarHBondContact O-N 2.77Å; G41-I47 WeakPolarHBondContact O-CB 3.12Å; G41-I47 PolarHBondContact O-N 2.86Å; G41-R68 PolarHBondContact O-NH1 3.36Å; G41-E186 PolarHBondContact N-OE1 3.15Å
42	M	98.3	Very high	95.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-52.5	172.9	-64.7	-65.4	-65.6	0	0	110	I47 I52 R68 I94 V185 E186 L187	M42-I47 HydrophobicContact CG-CD1 4.05Å; M42-I47 HydrophobicContact SD-CB 4.46Å; M42-I47 HydrophobicContact SD-CD1 3.81Å; M42-I47 HydrophobicContact SD-CG2 4.28Å; M42-I52 HydrophobicContact CE-CD1 3.72Å; M42-I52 HydrophobicContact CE-CG1 4.17Å; M42-I52 HydrophobicContact CE-CG2 4.18Å; M42-I52 HydrophobicContact SD-CD1 4.03Å; M42-I52 HydrophobicContact SD-CG1 4.25Å; M42-R68 HydrophobicContact CE-CG 4.28Å; M42-R68 WeakPolarHBondContact O-CB 2.92Å; M42-R68 VanDerWaalsContact O-CD 3.23Å; M42-R68 WeakPolarHBondContact O-CD 3.24Å; M42-R68 WeakPolarHBondContact O-CG 3.3Å; M42-R68 PolarHBondContact O-NH1 3.26Å; M42-I94 HydrophobicContact CE-CG1 4.04Å; M42-I94 HydrophobicContact SD-CG1 3.74Å; M42-I94 HydrophobicContact SD-CG2 4.02Å; M42-V185 WeakPolarHBondContact CB-O 3.46Å; M42-V185 HydrophobicContact CE-CG2 3.89Å; M42-V185 WeakPolarHBondContact CG-O 3.48Å; M42-E186 WeakPolarHBondContact CB-OE1 3.32Å; M42-E186 WeakPolarHBondContact CG-OE1 3.2Å; M42-E186 PolarHBondContact N-OE1 2.94Å; M42-E186 VanDerWaalsContact N-OE1 3.07Å; M42-E186 PolarHBondContact N-OE2 2.9Å; M42-L187 HydrophobicContact CG-CD1 4Å; M42-L187 HydrophobicContact SD-CD1 4.44Å
43	E	97	Very high	95.9	Very high	66 Å²	66	55.1 Å²	55.1	31%	0.308	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-41.3	-176.9	-179.2	169.4	176.1	0	0	112.9	L69 S70 E186	E43-L69 HydrophobicContact CB-CB 4.46Å; E43-S70 VanDerWaalsContact CD-CB 3.46Å; E43-S70 WeakPolarHBondContact OE1-CB 3.46Å; E43-S70 PolarHBondContact OE1-OG 2.83Å; E43-S70 PolarHBondContact OE2-OG 3.44Å; E43-E186 WeakPolarHBondContact CB-OE2 3.42Å; E43-E186 PolarHBondContact N-OE2 3.2Å
44	D	95.6	Very high	96.5	Very high	99 Å²	99	55 Å²	55	53%	0.529	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-8.6	-173.3	78.8	-10.4	0	0	0	114.5	G41 T46	G41-D44 WeakPolarHBondContact CA-OD1 3.18Å; D44-T46 VanDerWaalsContact CG-OG1 3.28Å; D44-T46 VanDerWaalsContact OD1-CB 3.24Å; D44-T46 WeakPolarHBondContact OD1-CB 3.38Å; D44-T46 PolarHBondContact OD1-N 2.85Å; D44-T46 PolarHBondContact OD1-OG1 3.18Å; D44-T46 PolarHBondContact OD2-OG1 3.11Å
45	G	96.3	Very high	97.1	Very high	42 Å²	42	52 Å²	52	43%	0.433	29%	0.293	S	S	.	.	S	Bend	trans	82.6	6.9	179.9	0	0	0	0	0	115.3	G41 I47	G41-G45 PolarHBondContact O-N 3.35Å; G45-I47 PolarHBondContact O-N 2.79Å
46	T	97.1	Very high	97.5	Very high	101 Å²	101	48 Å²	48	62%	0.62	28%	0.278	S	S	*	.			trans	-61.1	-35.9	173.9	-63.9	0	0	0	0	111.2	G41 D44 P48	G41-T46 PolarHBondContact O-N 2.77Å; D44-T46 VanDerWaalsContact CG-OG1 3.28Å; D44-T46 VanDerWaalsContact OD1-CB 3.24Å; D44-T46 WeakPolarHBondContact OD1-CB 3.38Å; D44-T46 PolarHBondContact OD1-N 2.85Å; D44-T46 PolarHBondContact OD1-OG1 3.18Å; D44-T46 PolarHBondContact OD2-OG1 3.11Å; T46-P48 WeakPolarHBondContact O-CD 3.4Å
47	I	98.4	Very high	97.6	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.051	29%	0.292	C	S	.	.	S	Bend	trans	-80.8	116.1	167.4	-62.3	171.6	0	0	0	107.4	L40 G41 M42 G45 D51 I52 R68 I94 L96	L40-I47 HydrophobicContact CB-CD1 4.48Å; L40-I47 WeakPolarHBondContact O-CG1 3.38Å; G41-I47 WeakPolarHBondContact O-CB 3.12Å; G41-I47 PolarHBondContact O-N 2.86Å; M42-I47 HydrophobicContact CG-CD1 4.05Å; M42-I47 HydrophobicContact SD-CB 4.46Å; M42-I47 HydrophobicContact SD-CD1 3.81Å; M42-I47 HydrophobicContact SD-CG2 4.28Å; G45-I47 PolarHBondContact O-N 2.79Å; I47-D51 HydrophobicContact CG2-CB 4.02Å; I47-I52 HydrophobicContact CG2-CD1 4.3Å; I47-I52 HydrophobicContact CG2-CG1 3.91Å; I47-R68 PolarHBondContact O-NH1 2.78Å; I47-R68 PolarHBondContact O-NH2 2.9Å; I47-I94 HydrophobicContact CD1-CG2 3.91Å; I47-I94 HydrophobicContact CG2-CG2 4.23Å; I47-L96 HydrophobicContact CD1-CD2 3.75Å; I47-L96 HydrophobicContact CG1-CD2 4.48Å
48	P	98.3	Very high	97.7	Very high	56 Å²	56	52.5 Å²	52.5	36%	0.364	30%	0.303	S	S	.	.			trans	-75.3	160.5	-179.9	32.6	-37.2	0	0	0	112.4	T46 S50 D51	T46-P48 WeakPolarHBondContact O-CD 3.4Å; P48-S50 PolarHBondContact O-N 2.88Å; P48-S50 VanDerWaalsContact O-N 3.14Å; P48-D51 WeakPolarHBondContact CD-OD2 3.23Å; P48-D51 HydrophobicContact CG-CB 4.34Å; P48-D51 WeakPolarHBondContact CG-OD2 3.47Å; P48-D51 PolarHBondContact O-N 2.73Å
49	D	98.4	Very high	97.7	Very high	82 Å²	82	48.5 Å²	48.5	44%	0.439	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58.3	-29.4	-178.3	-69.5	-2.3	0	0	0	113.6	D51 I52 K65 R68	D49-D51 PolarHBondContact O-N 2.78Å; D49-I52 PolarHBondContact O-N 3.32Å; D49-K65 HydrophobicContact CB-CB 4Å; D49-R68 IonicContact OD1-CZ 3.21Å; D49-R68 IonicContact OD1-NE 3.01Å; D49-R68 IonicContact OD1-NH2 3.23Å; D49-R68 PolarHBondContact OD1-NH2 2.87Å
50	S	98.4	Very high	97.6	Very high	92 Å²	92	53.5 Å²	53.5	64%	0.643	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-61.1	-24.9	177.4	54.3	0	0	0	0	113.4	P48	P48-S50 PolarHBondContact O-N 2.88Å; P48-S50 VanDerWaalsContact O-N 3.14Å
51	D	98.6	Very high	97.4	Very high	19 Å²	19	53.9 Å²	53.9	10%	0.102	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-96.8	-2.1	-173.6	-58.4	-11.5	0	0	0	111.7	I47 P48 D49 I94 D95 H97	I47-D51 HydrophobicContact CG2-CB 4.02Å; P48-D51 WeakPolarHBondContact CD-OD2 3.23Å; P48-D51 HydrophobicContact CG-CB 4.34Å; P48-D51 WeakPolarHBondContact CG-OD2 3.47Å; P48-D51 PolarHBondContact O-N 2.73Å; D49-D51 PolarHBondContact O-N 2.78Å; D51-I94 WeakPolarHBondContact O-CA 3.21Å; D51-D95 HydrophobicContact CB-CB 4.28Å; D51-D95 WeakPolarHBondContact CB-O 3.17Å; D51-D95 PolarHBondContact O-N 2.82Å; D51-H97 VanDerWaalsContact CG-NE2 3.29Å; D51-H97 IonicContact OD1-CE1 2.77Å; D51-H97 PolarHBondContact OD1-CE1 2.79Å; D51-H97 IonicContact OD1-NE2 3.54Å; D51-H97 PolarHBondContact OD1-NE2 2.06Å; D51-H97 IonicContact OD2-CD2 2.75Å; D51-H97 PolarHBondContact OD2-CD2 3.02Å; D51-H97 IonicContact OD2-CE1 3.59Å; D51-H97 IonicContact OD2-NE2 2.65Å; D51-H97 PolarHBondContact OD2-NE2 2.96Å
52	I	98.8	Very high	97.4	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.041	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	108.7	177.3	-47.2	171.9	0	0	0	107.9	M42 I47 D49 A64 R68 L92 Q93	M42-I52 HydrophobicContact CE-CD1 3.72Å; M42-I52 HydrophobicContact CE-CG1 4.17Å; M42-I52 HydrophobicContact CE-CG2 4.18Å; M42-I52 HydrophobicContact SD-CD1 4.03Å; M42-I52 HydrophobicContact SD-CG1 4.25Å; I47-I52 HydrophobicContact CG2-CD1 4.3Å; I47-I52 HydrophobicContact CG2-CG1 3.91Å; D49-I52 PolarHBondContact O-N 3.32Å; I52-A64 HydrophobicContact CG2-CB 4.03Å; I52-A64 VanDerWaalsContact CG2-O 3.26Å; I52-A64 WeakPolarHBondContact CG2-O 3.44Å; I52-A64 WeakPolarHBondContact O-CB 3.31Å; I52-R68 HydrophobicContact CD1-CG 4.18Å; I52-R68 VanDerWaalsContact CD1-CZ 3.42Å; I52-L92 HydrophobicContact CG2-CD1 3.86Å; I52-Q93 WeakPolarHBondContact CA-O 3.37Å
53	T	98.6	Very high	97.4	Very high	59 Å²	59	57.3 Å²	57.3	36%	0.362	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	161.4	-177.3	54.5	0	0	0	0	110.5	Q93	T53-Q93 PolarHBondContact N-O 3.28Å; T53-Q93 PolarHBondContact O-N 3.44Å; T53-Q93 WeakPolarHBondContact OG1-CB 3.16Å
54	A	98.4	Very high	97.4	Very high	30 Å²	30	54.7 Å²	54.7	25%	0.248	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	161.6	177.6	0	0	0	0	0	111.3	S56 A64 W78 Y91 L92	A54-S56 VanDerWaalsContact C-N 3.26Å; A54-S56 PolarHBondContact O-N 3.35Å; A54-A64 HydrophobicContact CB-CB 3.79Å; A54-W78 HydrophobicContact CB-CD2 4.44Å; A54-W78 HydrophobicContact CB-CZ2 3.84Å; A54-Y91 CarbonylContact C-O 3.51Å; A54-Y91 VanDerWaalsContact CA-O 3.23Å; A54-Y91 WeakPolarHBondContact CA-O 3.18Å; A54-Y91 WeakPolarHBondContact CB-O 3.44Å; A54-L92 HydrophobicContact CB-CD1 4.31Å
55	S	97.3	Very high	97.5	Very high	41 Å²	41	52.8 Å²	52.8	29%	0.287	31%	0.314	S	S	.	.	S	Bend	trans	-58.6	-39.2	170.5	50.7	0	0	0	0	112.6	E90 Y91	S55-E90 WeakPolarHBondContact CB-OE2 3.44Å; S55-E90 VanDerWaalsContact OG-CA 3.25Å; S55-E90 WeakPolarHBondContact OG-CA 3.22Å; S55-E90 PolarHBondContact OG-OE2 2.94Å; S55-Y91 PolarHBondContact N-O 2.95Å; S55-Y91 PolarHBondContact OG-N 2.85Å; S55-Y91 PolarHBondContact OG-O 2.93Å
56	S	97.1	Very high	97.6	Very high	33 Å²	33	51.6 Å²	51.6	23%	0.231	30%	0.297	C	S	.	.			trans	-164.1	171.3	-178.1	74.4	0	0	0	0	110.7	A54 W78 A81 E90	A54-S56 VanDerWaalsContact C-N 3.26Å; A54-S56 PolarHBondContact O-N 3.35Å; S56-W78 PolarHBondContact O-NE1 2.98Å; S56-A81 WeakPolarHBondContact OG-CB 3.11Å; S56-A81 PolarHBondContact OG-N 3.09Å; S56-E90 WeakPolarHBondContact CB-OE2 3.42Å; S56-E90 PolarHBondContact OG-OE2 3.27Å
57	A	97.6	Very high	97.6	Very high	36 Å²	36	46.8 Å²	46.8	30%	0.298	27%	0.267	S	S	.	.			trans	-141.6	141.3	172.3	0	0	0	0	0	110.2	E63 C79 A81	A57-E63 HydrophobicContact CB-CG 4.22Å; A57-C79 CarbonylContact C-O 3.59Å; A57-C79 WeakPolarHBondContact CA-O 3.5Å; A57-A81 WeakPolarHBondContact O-CB 3.31Å
58	W	96.4	Very high	97.6	Very high	159 Å²	159	47 Å²	47	60%	0.602	27%	0.267	S	S	*	.	S	Bend	trans	-62.5	-41.7	176.3	179.2	-83.5	0	0	0	112.7	T62 C79 A81	W58-T62 WeakPolarHBondContact CB-OG1 3.11Å; W58-T62 PolarHBondContact N-OG1 2.98Å; W58-C79 HydrophobicContact CB-CB 4.27Å; W58-C79 PolarHBondContact N-O 2.77Å; W58-A81 VanDerWaalsContact CE3-O 3.27Å
59	S	96.4	Very high	97.5	Very high	37 Å²	37	44.3 Å²	44.3	26%	0.259	25%	0.25	S	C	.	.	S	Bend	trans	-153	170.2	174.5	51.5	0	0	0	0	110.5	S61 T62 E63	S59-S61 PolarHBondContact O-N 2.8Å; S59-S61 PolarHBondContact OG-OG 3.01Å; S59-T62 PolarHBondContact N-OG1 3.27Å; S59-T62 VanDerWaalsContact N-OG1 3.09Å; S59-T62 CarbonylContact O-C 3.5Å; S59-T62 PolarHBondContact O-N 3.49Å; S59-T62 PolarHBondContact O-OG1 3.48Å; S59-E63 PolarHBondContact O-N 3.26Å
60	D	96.2	Very high	97.3	Very high	129 Å²	129	42.6 Å²	42.6	69%	0.69	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-56.1	-32.4	174.3	-59.1	0.3	0	0	0	112	T62 E63	D60-T62 VanDerWaalsContact C-N 3.27Å; D60-T62 PolarHBondContact O-N 2.8Å; D60-E63 WeakPolarHBondContact O-CG 3.42Å
61	S	95.5	Very high	96.9	Very high	32 Å²	32	39.5 Å²	39.5	22%	0.224	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-75.3	-7.7	176.3	53.9	0	0	0	0	114.6	S59 H66 D75	S59-S61 PolarHBondContact O-N 2.8Å; S59-S61 PolarHBondContact OG-OG 3.01Å; S61-H66 PolarHBondContact O-CD2 3.44Å; S61-H66 VanDerWaalsContact O-CD2 3.23Å; S61-D75 VanDerWaalsContact CB-CG 3.48Å; S61-D75 VanDerWaalsContact CB-OD2 3.23Å; S61-D75 WeakPolarHBondContact CB-OD2 3.4Å; S61-D75 PolarHBondContact O-N 3.09Å; S61-D75 VanDerWaalsContact OG-CG 3.29Å; S61-D75 PolarHBondContact OG-OD2 3.45Å
62	T	96.5	Very high	96.3	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.037	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-126.1	25.9	176.9	68.2	0	0	0	0	112	W58 S59 D60 D75 A77 W78 C79	W58-T62 WeakPolarHBondContact CB-OG1 3.11Å; W58-T62 PolarHBondContact N-OG1 2.98Å; S59-T62 PolarHBondContact N-OG1 3.27Å; S59-T62 VanDerWaalsContact N-OG1 3.09Å; S59-T62 CarbonylContact O-C 3.5Å; S59-T62 PolarHBondContact O-N 3.49Å; S59-T62 PolarHBondContact O-OG1 3.48Å; D60-T62 VanDerWaalsContact C-N 3.27Å; D60-T62 PolarHBondContact O-N 2.8Å; T62-D75 HydrophobicContact CG2-CB 3.93Å; T62-A77 WeakPolarHBondContact CA-O 3.13Å; T62-W78 WeakPolarHBondContact O-CA 3.29Å; T62-W78 VanDerWaalsContact O-CD1 3.29Å; T62-C79 HydrophobicContact CG2-CB 4.16Å; T62-C79 PolarHBondContact O-N 3.39Å; T62-C79 VanDerWaalsContact O-N 3.16Å
63	E	97.7	Very high	95.9	Very high	66 Å²	66	46.6 Å²	46.6	31%	0.308	27%	0.269	S	S	.	.	S	Bend	trans	-61.1	166.3	174.1	-79.5	177.7	179	0	0	113	A57 S59 D60 K65 H66	A57-E63 HydrophobicContact CB-CG 4.22Å; S59-E63 PolarHBondContact O-N 3.26Å; D60-E63 WeakPolarHBondContact O-CG 3.42Å; E63-K65 VanDerWaalsContact C-N 3.27Å; E63-K65 HydrophobicContact CB-CG 4.38Å; E63-K65 PolarHBondContact O-N 3.49Å; E63-K65 IonicContact OE2-NZ 3Å; E63-K65 PolarHBondContact OE2-NZ 2.95Å; E63-H66 WeakPolarHBondContact O-CB 3.28Å; E63-H66 PolarHBondContact O-N 3.4Å
64	A	98.3	Very high	95.5	Very high	11 Å²	11	46 Å²	46	9%	0.091	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-51.9	-41.6	-176.3	0	0	0	0	0	113.6	I52 A54 H66 G67 L92	I52-A64 HydrophobicContact CG2-CB 4.03Å; I52-A64 VanDerWaalsContact CG2-O 3.26Å; I52-A64 WeakPolarHBondContact CG2-O 3.44Å; I52-A64 WeakPolarHBondContact O-CB 3.31Å; A54-A64 HydrophobicContact CB-CB 3.79Å; A64-H66 PolarHBondContact O-N 2.91Å; A64-H66 VanDerWaalsContact O-N 3.14Å; A64-G67 WeakPolarHBondContact O-CA 3.43Å; A64-G67 PolarHBondContact O-N 3.46Å; A64-L92 HydrophobicContact CB-CD1 3.79Å
65	K	97.3	Very high	95.3	Very high	60 Å²	60	48.5 Å²	48.5	26%	0.261	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-58	-24.7	177.7	68.5	-171.3	-179	-137.2	0	114.4	D49 E63 G67 R68	D49-K65 HydrophobicContact CB-CB 4Å; E63-K65 VanDerWaalsContact C-N 3.27Å; E63-K65 HydrophobicContact CB-CG 4.38Å; E63-K65 PolarHBondContact O-N 3.49Å; E63-K65 IonicContact OE2-NZ 3Å; E63-K65 PolarHBondContact OE2-NZ 2.95Å; K65-G67 PolarHBondContact O-N 3.28Å; K65-R68 WeakPolarHBondContact O-CG 3.45Å
66	H	97.8	Very high	95.1	Very high	16 Å²	16	46.5 Å²	46.5	7%	0.074	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-80.8	-1.8	176	-59.6	-52.1	0	0	0	112.4	S61 E63 A64 R68 E73 A77 W78	S61-H66 PolarHBondContact O-CD2 3.44Å; S61-H66 VanDerWaalsContact O-CD2 3.23Å; E63-H66 WeakPolarHBondContact O-CB 3.28Å; E63-H66 PolarHBondContact O-N 3.4Å; A64-H66 PolarHBondContact O-N 2.91Å; A64-H66 VanDerWaalsContact O-N 3.14Å; H66-R68 PolarHBondContact O-N 3.32Å; H66-E73 PolarHBondContact ND1-O 2.99Å; H66-A77 CarbonylContact O-C 3.55Å; H66-A77 WeakPolarHBondContact O-CA 3.43Å; H66-W78 PolarHBondContact O-N 2.99Å
67	G	97.6	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-78.6	18.3	174.7	0	0	0	0	0	115	A64 K65 L183 R184 V185	A64-G67 WeakPolarHBondContact O-CA 3.43Å; A64-G67 PolarHBondContact O-N 3.46Å; K65-G67 PolarHBondContact O-N 3.28Å; G67-L183 WeakPolarHBondContact CA-O 3.41Å; G67-R184 CarbonylContact O-C 3.49Å; G67-R184 VanDerWaalsContact O-CA 3.26Å; G67-R184 WeakPolarHBondContact O-CA 3.28Å; G67-V185 PolarHBondContact O-N 3.24Å
68	R	98.3	Very high	95.1	Very high	14 Å²	14	43.3 Å²	43.3	5%	0.053	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-80.7	132.2	178.6	-65.1	172.4	-178.7	-77	0.8	111.3	G41 M42 I47 D49 I52 K65 H66 T71 R184	G41-R68 PolarHBondContact O-NH1 3.36Å; M42-R68 HydrophobicContact CE-CG 4.28Å; M42-R68 WeakPolarHBondContact O-CB 2.92Å; M42-R68 VanDerWaalsContact O-CD 3.23Å; M42-R68 WeakPolarHBondContact O-CD 3.24Å; M42-R68 WeakPolarHBondContact O-CG 3.3Å; M42-R68 PolarHBondContact O-NH1 3.26Å; I47-R68 PolarHBondContact O-NH1 2.78Å; I47-R68 PolarHBondContact O-NH2 2.9Å; D49-R68 IonicContact OD1-CZ 3.21Å; D49-R68 IonicContact OD1-NE 3.01Å; D49-R68 IonicContact OD1-NH2 3.23Å; D49-R68 PolarHBondContact OD1-NH2 2.87Å; I52-R68 HydrophobicContact CD1-CG 4.18Å; I52-R68 VanDerWaalsContact CD1-CZ 3.42Å; K65-R68 WeakPolarHBondContact O-CG 3.45Å; H66-R68 PolarHBondContact O-N 3.32Å; R68-T71 HydrophobicContact CB-CG2 3.7Å; R68-T71 WeakPolarHBondContact CB-OG1 3.29Å; R68-T71 PolarHBondContact O-N 3.33Å; R68-T71 PolarHBondContact O-OG1 3.24Å; R68-R184 WeakPolarHBondContact O-CB 3.29Å; R68-R184 VanDerWaalsContact O-CD 3.3Å; R68-R184 WeakPolarHBondContact O-CD 3.44Å; R68-R184 WeakPolarHBondContact O-CG 3.36Å
69	L	97.4	Very high	95.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	145	176.8	-158	76.3	0	0	0	111.9	E43 T71 Q108 I155 V185 E186	E43-L69 HydrophobicContact CB-CB 4.46Å; L69-T71 WeakPolarHBondContact O-CG2 3.45Å; L69-T71 PolarHBondContact O-N 3.15Å; L69-Q108 HydrophobicContact CD1-CB 3.66Å; L69-I155 HydrophobicContact CD1-CG1 4.42Å; L69-I155 HydrophobicContact CD1-CG2 4.4Å; L69-I155 HydrophobicContact CD2-CD1 4.08Å; L69-I155 HydrophobicContact CD2-CG1 4.35Å; L69-I155 HydrophobicContact CD2-CG2 4.03Å; L69-I155 HydrophobicContact CG-CD1 4.44Å; L69-I155 HydrophobicContact CG-CG1 4.45Å; L69-V185 PolarHBondContact N-O 3.15Å; L69-V185 VanDerWaalsContact N-O 3.1Å; L69-E186 HydrophobicContact CB-CB 3.86Å; L69-E186 HydrophobicContact CD2-CB 3.65Å; L69-E186 HydrophobicContact CD2-CG 4.47Å; L69-E186 HydrophobicContact CG-CB 4.26Å
70	S	93.9	Very high	95.2	Very high	47 Å²	47	34.8 Å²	34.8	33%	0.329	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-0.4	175.6	-50.6	0	0	0	0	116.2	E43	E43-S70 VanDerWaalsContact CD-CB 3.46Å; E43-S70 WeakPolarHBondContact OE1-CB 3.46Å; E43-S70 PolarHBondContact OE1-OG 2.83Å; E43-S70 PolarHBondContact OE2-OG 3.44Å
71	T	89.3	Confident	95.2	Very high	26 Å²	26	30.7 Å²	30.7	16%	0.16	19%	0.194	C	C	.	.			trans	-89.4	151.5	175.2	71.7	0	0	0	0	111.5	R68 L69 R184	R68-T71 HydrophobicContact CB-CG2 3.7Å; R68-T71 WeakPolarHBondContact CB-OG1 3.29Å; R68-T71 PolarHBondContact O-N 3.33Å; R68-T71 PolarHBondContact O-OG1 3.24Å; L69-T71 WeakPolarHBondContact O-CG2 3.45Å; L69-T71 PolarHBondContact O-N 3.15Å; T71-R184 VanDerWaalsContact O-CD 3.26Å; T71-R184 WeakPolarHBondContact O-CD 3.5Å; T71-R184 PolarHBondContact O-NH1 3.49Å
72	G	86.5	Confident	94.9	Very high	56 Å²	56	31.7 Å²	31.7	58%	0.577	20%	0.204	S	C	*	.			trans	-120.7	20	175.5	0	0	0	0	0	112.9
73	E	89.4	Confident	94.5	Very high	120 Å²	120	34.2 Å²	34.2	56%	0.561	22%	0.221	S	C	*	.			trans	-67.8	155	-180	-62.2	-169.7	160.1	0	0	112.1	H66 G76	H66-E73 PolarHBondContact ND1-O 2.99Å; E73-G76 WeakPolarHBondContact O-CA 3.36Å; E73-G76 PolarHBondContact O-N 2.84Å
74	G	90.8	Very high	94	Very high	47 Å²	47	31.4 Å²	31.4	49%	0.485	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	-135.1	-173.4	0	0	0	0	0	111.2
75	D	93.1	Very high	93.1	Very high	82 Å²	82	35.8 Å²	35.8	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	14.8	170.8	-72.3	-22.7	0	0	0	112.2	S61 T62 R110 A112	S61-D75 VanDerWaalsContact CB-CG 3.48Å; S61-D75 VanDerWaalsContact CB-OD2 3.23Å; S61-D75 WeakPolarHBondContact CB-OD2 3.4Å; S61-D75 PolarHBondContact O-N 3.09Å; S61-D75 VanDerWaalsContact OG-CG 3.29Å; S61-D75 PolarHBondContact OG-OD2 3.45Å; T62-D75 HydrophobicContact CG2-CB 3.93Å; D75-R110 VanDerWaalsContact O-CD 3.26Å; D75-R110 WeakPolarHBondContact O-CD 3.13Å; D75-R110 WeakPolarHBondContact O-CG 3.41Å; D75-R110 PolarHBondContact O-NH1 3.22Å; D75-R110 VanDerWaalsContact O-NH1 3.07Å; D75-A112 WeakPolarHBondContact O-CB 3.27Å
76	G	93.6	Very high	91.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	97.3	3.9	163.4	0	0	0	0	0	117.1	E73 R184	E73-G76 WeakPolarHBondContact O-CA 3.36Å; E73-G76 PolarHBondContact O-N 2.84Å; G76-R184 VanDerWaalsContact O-CD 3.28Å; G76-R184 WeakPolarHBondContact O-CD 3.32Å; G76-R184 PolarHBondContact O-NE 3.23Å
77	A	97.7	Very high	90.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-169.7	170.5	174.4	0	0	0	0	0	111.7	T62 H66 R110 C182 R184	T62-A77 WeakPolarHBondContact CA-O 3.13Å; H66-A77 CarbonylContact O-C 3.55Å; H66-A77 WeakPolarHBondContact O-CA 3.43Å; A77-R110 HydrophobicContact CB-CB 3.62Å; A77-R110 HydrophobicContact CB-CG 3.7Å; A77-C182 HydrophobicContact CB-CB 3.79Å; A77-R184 HydrophobicContact CB-CG 3.93Å
78	W	98.2	Very high	89.3	Confident	1 Å²	1	44.5 Å²	44.5	0%	0.004	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-78.4	136.4	158.3	166.9	66.2	0	0	0	110.3	A54 S56 T62 H66 P80 Y91 L92 P173 C182 L183	A54-W78 HydrophobicContact CB-CD2 4.44Å; A54-W78 HydrophobicContact CB-CZ2 3.84Å; S56-W78 PolarHBondContact O-NE1 2.98Å; T62-W78 WeakPolarHBondContact O-CA 3.29Å; T62-W78 VanDerWaalsContact O-CD1 3.29Å; H66-W78 PolarHBondContact O-N 2.99Å; W78-P80 HydrophobicContact CH2-CG 3.8Å; W78-P80 HydrophobicContact CZ2-CB 4.33Å; W78-P80 HydrophobicContact CZ2-CG 3.75Å; W78-P80 HydrophobicContact CZ3-CG 4.43Å; W78-Y91 WeakPolarHBondContact CZ2-O 3.43Å; W78-L92 HydrophobicContact CB-CD1 4.32Å; W78-L92 HydrophobicContact CD2-CB 4.11Å; W78-L92 HydrophobicContact CD2-CD1 3.96Å; W78-L92 HydrophobicContact CD2-CG 4.47Å; W78-L92 HydrophobicContact CE3-CB 3.56Å; W78-L92 HydrophobicContact CE3-CD1 4.16Å; W78-L92 HydrophobicContact CE3-CD2 4.14Å; W78-L92 HydrophobicContact CE3-CG 4.18Å; W78-L92 HydrophobicContact CG-CD1 4.01Å; W78-L92 HydrophobicContact CH2-CB 4.01Å; W78-L92 VanDerWaalsContact CH2-N 3.28Å; W78-L92 HydrophobicContact CZ3-CB 3.5Å; W78-P173 HydrophobicContact CH2-CG 4.25Å; W78-P173 HydrophobicContact CZ3-CG 4.4Å; W78-C182 CarbonylContact O-C 3.56Å; W78-C182 WeakPolarHBondContact O-CA 3.23Å; W78-C182 WeakPolarHBondContact O-CB 3.28Å; W78-L183 HydrophobicContact CE3-CB 3.91Å; W78-L183 HydrophobicContact CE3-CD1 4.41Å; W78-L183 HydrophobicContact CZ3-CB 4.24Å; W78-L183 HydrophobicContact CZ3-CD1 3.89Å; W78-L183 PolarHBondContact N-O 3.32Å; W78-L183 VanDerWaalsContact N-O 3.17Å; W78-L183 PolarHBondContact O-N 3.23Å
79	C	97.7	Very high	88.6	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.068	30%	0.298	C	S	.	.			trans	-135.4	128.1	176.5	-52.5	0	0	0	0	109.8	A57 W58 T62 C182	A57-C79 CarbonylContact C-O 3.59Å; A57-C79 WeakPolarHBondContact CA-O 3.5Å; W58-C79 HydrophobicContact CB-CB 4.27Å; W58-C79 PolarHBondContact N-O 2.77Å; T62-C79 HydrophobicContact CG2-CB 4.16Å; T62-C79 PolarHBondContact O-N 3.39Å; T62-C79 VanDerWaalsContact O-N 3.16Å; C79-C182 HydrophobicContact CB-CB 4.15Å; C79-C182 WeakPolarHBondContact CB-SG 2.87Å; C79-C182 WeakPolarHBondContact SG-CB 3.4Å; C79-C182 CovalentContact SG-SG 2.04Å; C79-C182 PolarHBondContact SG-SG 2.8Å
80	P	97.2	Very high	88.6	Confident	7 Å²	7	48.6 Å²	48.6	5%	0.045	30%	0.304	C	S	.	.			trans	-61.2	152.2	175.6	-19.7	31.4	0	0	0	112.8	W78 V84 E90 P173 V181	W78-P80 HydrophobicContact CH2-CG 3.8Å; W78-P80 HydrophobicContact CZ2-CB 4.33Å; W78-P80 HydrophobicContact CZ2-CG 3.75Å; W78-P80 HydrophobicContact CZ3-CG 4.43Å; P80-V84 HydrophobicContact CG-CG2 4.17Å; P80-E90 HydrophobicContact CB-CB 3.9Å; P80-E90 HydrophobicContact CB-CG 3.65Å; P80-E90 HydrophobicContact CG-CB 3.95Å; P80-E90 HydrophobicContact CG-CG 4.21Å; P80-P173 HydrophobicContact CG-CG 4.44Å; P80-V181 WeakPolarHBondContact CD-O 3.4Å; P80-V181 HydrophobicContact CG-CG2 4.18Å
81	A	94.9	Very high	88.7	Confident	44 Å²	44	48.9 Å²	48.9	36%	0.364	30%	0.298	S	S	.	.	S	Bend	trans	-66.5	-41.9	-178.3	0	0	0	0	0	113.2	S56 A57 W58	S56-A81 WeakPolarHBondContact OG-CB 3.11Å; S56-A81 PolarHBondContact OG-N 3.09Å; A57-A81 WeakPolarHBondContact O-CB 3.31Å; W58-A81 VanDerWaalsContact CE3-O 3.27Å
82	A	89.6	Confident	89.2	Confident	52 Å²	52	47.7 Å²	47.7	43%	0.43	29%	0.291	S	S	.	.	S	Bend	trans	-99.2	146.1	176.4	0	0	0	0	0	110.2	V84	A82-V84 PolarHBondContact O-N 3.34Å
83	P	87.8	Confident	89.8	Confident	60 Å²	60	46 Å²	46	39%	0.39	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-53.6	139.2	167.9	-25.5	34.9	0	0	0	111.2	V178	P83-V178 HydrophobicContact CB-CG1 3.58Å; P83-V178 HydrophobicContact CG-CG1 4.34Å
84	V	87.9	Confident	90.2	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.036	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-80.4	133.1	178.4	177.6	0	0	0	0	108.9	P80 A82 E90 P173 A175 V178 M179 V181	P80-V84 HydrophobicContact CG-CG2 4.17Å; A82-V84 PolarHBondContact O-N 3.34Å; V84-E90 HydrophobicContact CG2-CB 4.3Å; V84-E90 HydrophobicContact CG2-CG 4.22Å; V84-P173 WeakPolarHBondContact CG1-O 3.4Å; V84-P173 HydrophobicContact CG2-CG 4.18Å; V84-A175 HydrophobicContact CB-CB 4.27Å; V84-A175 HydrophobicContact CG1-CB 4.02Å; V84-V178 WeakPolarHBondContact O-CA 3.42Å; V84-M179 PolarHBondContact N-O 3.04Å; V84-M179 PolarHBondContact O-N 3.08Å; V84-M179 VanDerWaalsContact O-N 3.16Å; V84-V181 HydrophobicContact CB-CG2 4.11Å; V84-V181 HydrophobicContact CG2-CG2 3.5Å; V84-V181 VanDerWaalsContact CG2-CG2 3.5Å
85	F	78.7	Confident	90.6	Very high	104 Å²	104	39.2 Å²	39.2	46%	0.456	23%	0.225	S	C	.	.			trans	-140.3	151.2	173	-170.8	-114.2	0	0	0	105.1	N87 V178	F85-N87 PolarHBondContact O-N 2.86Å; F85-V178 HydrophobicContact CB-CG2 4.07Å; F85-V178 HydrophobicContact CD2-CB 4.34Å; F85-V178 HydrophobicContact CD2-CG2 3.41Å; F85-V178 VanDerWaalsContact CD2-CG2 3.41Å; F85-V178 HydrophobicContact CE2-CG2 4.06Å; F85-V178 HydrophobicContact CG-CG2 3.77Å
86	P	68.6	Low	90.9	Very high	68 Å²	68	36.2 Å²	36.2	44%	0.442	21%	0.208	S	C	.	.	S	Bend	trans	-62.8	7.7	-143.8	24.4	-35.4	0	0	0	117.9
87	N	69.3	Low	91	Very high	115 Å²	115	41.3 Å²	41.3	62%	0.615	23%	0.232	S	C	*	.	S	Bend	trans	-71.1	127.6	166	-48.2	-0.8	0	0	0	109.4	F85 S89	F85-N87 PolarHBondContact O-N 2.86Å; N87-S89 PolarHBondContact O-N 2.8Å
88	E	74.8	Confident	90.9	Very high	76 Å²	76	48 Å²	48	36%	0.355	26%	0.261	S	S	.	.	S	Bend	trans	-76.4	58.2	179.4	-62.7	173.8	-164	0	0	113	R124 Y172 L174	E88-R124 VanDerWaalsContact OE1-CD 3.23Å; E88-R124 WeakPolarHBondContact OE1-CD 3.49Å; E88-R124 IonicContact OE1-CZ 3.91Å; E88-R124 IonicContact OE1-NE 2.85Å; E88-R124 PolarHBondContact OE1-NE 2.9Å; E88-R124 IonicContact OE1-NH1 3.49Å; E88-R124 PolarHBondContact OE1-NH1 3.47Å; E88-R124 IonicContact OE1-NH2 3.76Å; E88-Y172 HydrophobicContact CB-CD1 4.17Å; E88-L174 HydrophobicContact CG-CD2 4.13Å
89	S	85.1	Confident	90.9	Very high	72 Å²	72	48 Å²	48	50%	0.503	26%	0.261	S	S	.	.			trans	-91.9	-36.2	-177.9	62.9	0	0	0	0	113.7	N87	N87-S89 PolarHBondContact O-N 2.8Å
90	E	95.8	Very high	90.9	Very high	28 Å²	28	48.6 Å²	48.6	13%	0.131	26%	0.263	C	S	.	.			trans	-91.2	140.4	-174.5	-58.3	-53.4	127.5	0	0	111.7	S55 S56 P80 V84 Y172 P173	S55-E90 WeakPolarHBondContact CB-OE2 3.44Å; S55-E90 VanDerWaalsContact OG-CA 3.25Å; S55-E90 WeakPolarHBondContact OG-CA 3.22Å; S55-E90 PolarHBondContact OG-OE2 2.94Å; S56-E90 WeakPolarHBondContact CB-OE2 3.42Å; S56-E90 PolarHBondContact OG-OE2 3.27Å; P80-E90 HydrophobicContact CB-CB 3.9Å; P80-E90 HydrophobicContact CB-CG 3.65Å; P80-E90 HydrophobicContact CG-CB 3.95Å; P80-E90 HydrophobicContact CG-CG 4.21Å; V84-E90 HydrophobicContact CG2-CB 4.3Å; V84-E90 HydrophobicContact CG2-CG 4.22Å; E90-Y172 VanDerWaalsContact O-CD1 3.3Å; E90-Y172 WeakPolarHBondContact O-CD1 3.48Å; E90-P173 HydrophobicContact CB-CG 4.31Å; E90-P173 WeakPolarHBondContact O-CD 3.28Å
91	Y	97.7	Very high	91	Very high	53 Å²	53	48.4 Å²	48.4	21%	0.208	26%	0.261	C	S	.	.			trans	-153.8	150.2	176.1	62.1	-92.7	0	0	0	113.5	A54 S55 W78 Q93 R170 F171 Y172	A54-Y91 CarbonylContact C-O 3.51Å; A54-Y91 VanDerWaalsContact CA-O 3.23Å; A54-Y91 WeakPolarHBondContact CA-O 3.18Å; A54-Y91 WeakPolarHBondContact CB-O 3.44Å; S55-Y91 PolarHBondContact N-O 2.95Å; S55-Y91 PolarHBondContact OG-N 2.85Å; S55-Y91 PolarHBondContact OG-O 2.93Å; W78-Y91 WeakPolarHBondContact CZ2-O 3.43Å; Y91-Q93 HydrophobicContact CD2-CB 4.02Å; Y91-Q93 HydrophobicContact CE2-CB 4.07Å; Y91-R170 HydrophobicContact CD2-CG 3.8Å; Y91-R170 HydrophobicContact CE2-CG 4.36Å; Y91-R170 HydrophobicContact CG-CG 4.32Å; Y91-R170 PolarHBondContact OH-NH2 2.85Å; Y91-F171 WeakPolarHBondContact CA-O 3.22Å; Y91-Y172 AromaticContact CD1-CE1 3.69Å; Y91-Y172 HydrophobicContact CD1-CE1 3.69Å; Y91-Y172 AromaticContact CD1-CZ 3.87Å; Y91-Y172 HydrophobicContact CG-CE1 4.03Å; Y91-Y172 AromaticContact CG-CZ 3.98Å
92	L	98.8	Very high	91.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.3	161.1	-174.4	65.2	0	0	0	108.2	I52 A54 A64 W78 I94 R170 F171 V185	I52-L92 HydrophobicContact CG2-CD1 3.86Å; A54-L92 HydrophobicContact CB-CD1 4.31Å; A64-L92 HydrophobicContact CB-CD1 3.79Å; W78-L92 HydrophobicContact CB-CD1 4.32Å; W78-L92 HydrophobicContact CD2-CB 4.11Å; W78-L92 HydrophobicContact CD2-CD1 3.96Å; W78-L92 HydrophobicContact CD2-CG 4.47Å; W78-L92 HydrophobicContact CE3-CB 3.56Å; W78-L92 HydrophobicContact CE3-CD1 4.16Å; W78-L92 HydrophobicContact CE3-CD2 4.14Å; W78-L92 HydrophobicContact CE3-CG 4.18Å; W78-L92 HydrophobicContact CG-CD1 4.01Å; W78-L92 HydrophobicContact CH2-CB 4.01Å; W78-L92 VanDerWaalsContact CH2-N 3.28Å; W78-L92 HydrophobicContact CZ3-CB 3.5Å; L92-I94 HydrophobicContact CD2-CD1 4.48Å; L92-I94 HydrophobicContact CG-CD1 4.26Å; L92-R170 CarbonylContact O-C 3.54Å; L92-R170 WeakPolarHBondContact O-CA 3.2Å; L92-F171 HydrophobicContact CB-CB 4.47Å; L92-F171 PolarHBondContact N-O 2.84Å; L92-F171 PolarHBondContact O-N 3.3Å; L92-V185 HydrophobicContact CD2-CG1 4.27Å; L92-V185 HydrophobicContact CD2-CG2 3.72Å
93	Q	98.8	Very high	91.5	Very high	22 Å²	22	44.2 Å²	44.2	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.6	-178.6	-179.8	-178.4	-61	0	0	110.4	I52 T53 Y91 W134 V169 R170	I52-Q93 WeakPolarHBondContact CA-O 3.37Å; T53-Q93 PolarHBondContact N-O 3.28Å; T53-Q93 PolarHBondContact O-N 3.44Å; T53-Q93 WeakPolarHBondContact OG1-CB 3.16Å; Y91-Q93 HydrophobicContact CD2-CB 4.02Å; Y91-Q93 HydrophobicContact CE2-CB 4.07Å; Q93-W134 HydrophobicContact CG-CH2 4.2Å; Q93-V169 WeakPolarHBondContact CA-O 3.37Å; Q93-R170 HydrophobicContact CB-CG 3.78Å; Q93-R170 HydrophobicContact CG-CG 3.88Å
94	I	98.9	Very high	92	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.4	175.3	-58.4	86.7	0	0	0	108.1	M42 I47 D51 L92 L96 M168 V169 F171 V185 L187	M42-I94 HydrophobicContact CE-CG1 4.04Å; M42-I94 HydrophobicContact SD-CG1 3.74Å; M42-I94 HydrophobicContact SD-CG2 4.02Å; I47-I94 HydrophobicContact CD1-CG2 3.91Å; I47-I94 HydrophobicContact CG2-CG2 4.23Å; D51-I94 WeakPolarHBondContact O-CA 3.21Å; L92-I94 HydrophobicContact CD2-CD1 4.48Å; L92-I94 HydrophobicContact CG-CD1 4.26Å; I94-L96 HydrophobicContact CG2-CD2 3.97Å; I94-M168 VanDerWaalsContact O-CA 3.26Å; I94-M168 WeakPolarHBondContact O-CA 3.42Å; I94-V169 PolarHBondContact N-O 2.79Å; I94-V169 PolarHBondContact O-N 2.68Å; I94-F171 HydrophobicContact CD1-CD2 3.75Å; I94-F171 HydrophobicContact CD1-CE2 3.72Å; I94-V185 HydrophobicContact CD1-CG2 4.01Å; I94-L187 HydrophobicContact CB-CD1 4.14Å; I94-L187 HydrophobicContact CD1-CD1 4.22Å; I94-L187 HydrophobicContact CG1-CD1 3.98Å; I94-L187 HydrophobicContact CG2-CD1 4.01Å
95	D	98.7	Very high	92.5	Very high	23 Å²	23	41.6 Å²	41.6	12%	0.123	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.3	169.4	-167.9	-9.3	0	0	0	109.8	D51 H97 R167 M168	D51-D95 HydrophobicContact CB-CB 4.28Å; D51-D95 WeakPolarHBondContact CB-O 3.17Å; D51-D95 PolarHBondContact O-N 2.82Å; D95-H97 WeakPolarHBondContact OD1-CA 3.45Å; D95-H97 PolarHBondContact OD1-N 2.98Å; D95-H97 IonicContact OD1-ND1 3.7Å; D95-H97 IonicContact OD2-ND1 2.94Å; D95-R167 IonicContact OD1-CZ 3.12Å; D95-R167 IonicContact OD1-NH1 3.94Å; D95-R167 PolarHBondContact OD1-NH1 2.94Å; D95-R167 IonicContact OD2-CZ 2.74Å; D95-R167 IonicContact OD2-NH1 3.44Å; D95-R167 PolarHBondContact OD2-NH1 3.4Å; D95-M168 HydrophobicContact CB-CE 4.17Å; D95-M168 HydrophobicContact CB-CG 4.23Å; D95-M168 WeakPolarHBondContact OD2-CE 3.31Å
96	L	98.4	Very high	93.4	Very high	18 Å²	18	36.6 Å²	36.6	9%	0.094	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-1.8	178.9	-56.5	172.4	0	0	0	112.3	L40 I47 I94 K98 H100 V102 R167	L40-L96 HydrophobicContact CB-CD2 4.32Å; L40-L96 HydrophobicContact CD1-CD1 3.91Å; L40-L96 HydrophobicContact CD1-CD2 4.27Å; I47-L96 HydrophobicContact CD1-CD2 3.75Å; I47-L96 HydrophobicContact CG1-CD2 4.48Å; I94-L96 HydrophobicContact CG2-CD2 3.97Å; L96-K98 PolarHBondContact O-N 3.31Å; L96-H100 WeakPolarHBondContact CB-ND1 3.26Å; L96-H100 HydrophobicContact CD1-CB 3.78Å; L96-V102 HydrophobicContact CD1-CG2 4.26Å; L96-R167 VanDerWaalsContact CB-O 3.29Å; L96-R167 WeakPolarHBondContact CB-O 3.4Å; L96-R167 WeakPolarHBondContact CG-O 3.13Å; L96-R167 PolarHBondContact N-O 3.32Å
97	H	95.9	Very high	94.8	Very high	108 Å²	108	33.4 Å²	33.4	50%	0.5	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	60.1	-34.5	-175.3	-66.8	-47.4	0	0	0	117.1	D51 D95 R167	D51-H97 VanDerWaalsContact CG-NE2 3.29Å; D51-H97 IonicContact OD1-CE1 2.77Å; D51-H97 PolarHBondContact OD1-CE1 2.79Å; D51-H97 IonicContact OD1-NE2 3.54Å; D51-H97 PolarHBondContact OD1-NE2 2.06Å; D51-H97 IonicContact OD2-CD2 2.75Å; D51-H97 PolarHBondContact OD2-CD2 3.02Å; D51-H97 IonicContact OD2-CE1 3.59Å; D51-H97 IonicContact OD2-NE2 2.65Å; D51-H97 PolarHBondContact OD2-NE2 2.96Å; D95-H97 WeakPolarHBondContact OD1-CA 3.45Å; D95-H97 PolarHBondContact OD1-N 2.98Å; D95-H97 IonicContact OD1-ND1 3.7Å; D95-H97 IonicContact OD2-ND1 2.94Å; H97-R167 WeakPolarHBondContact O-CD 3.39Å
98	K	96.2	Very high	96.2	Very high	139 Å²	139	28.6 Å²	28.6	60%	0.604	14%	0.14	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.5	175	-62.3	-179.8	-177.8	176.8	0	109.9	L96 H100	L96-K98 PolarHBondContact O-N 3.31Å; K98-H100 PolarHBondContact O-N 2.87Å; K98-H100 PolarHBondContact O-ND1 2.73Å
99	L	97.9	Very high	97.2	Very high	3 Å²	3	25 Å²	25	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	129.2	168.3	-66	177.3	0	0	0	110.1	R129 V165 R167 W192 Y197 E281	L99-R129 HydrophobicContact CD2-CB 3.84Å; L99-R129 HydrophobicContact CD2-CG 3.72Å; L99-V165 HydrophobicContact CB-CG1 4.34Å; L99-V165 HydrophobicContact CD2-CG1 4.42Å; L99-R167 HydrophobicContact CD2-CB 4.23Å; L99-W192 HydrophobicContact CB-CB 3.89Å; L99-W192 HydrophobicContact CB-CG 4.45Å; L99-W192 WeakPolarHBondContact O-CB 3.24Å; L99-W192 PolarHBondContact O-N 2.9Å; L99-Y197 HydrophobicContact CD1-CD2 4.35Å; L99-E281 HydrophobicContact CD1-CB 4.02Å; L99-E281 HydrophobicContact CD1-CG 4.29Å
100	H	98.4	Very high	97.8	Very high	22 Å²	22	23.4 Å²	23.4	10%	0.102	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.4	173.5	-73.2	73.7	0	0	0	109.6	L40 L96 K98 V102 V165 A166 C190	L40-H100 HydrophobicContact CD1-CB 4.28Å; L96-H100 WeakPolarHBondContact CB-ND1 3.26Å; L96-H100 HydrophobicContact CD1-CB 3.78Å; K98-H100 PolarHBondContact O-N 2.87Å; K98-H100 PolarHBondContact O-ND1 2.73Å; H100-V102 HydrophobicContact CB-CG2 4.14Å; H100-V165 WeakPolarHBondContact O-CA 3.38Å; H100-A166 PolarHBondContact N-O 3.2Å; H100-A166 PolarHBondContact O-N 2.82Å; H100-C190 CarbonylContact C-O 3.49Å; H100-C190 VanDerWaalsContact CA-O 3.29Å; H100-C190 WeakPolarHBondContact CA-O 3.29Å; H100-C190 WeakPolarHBondContact CB-O 3.08Å
101	F	98.2	Very high	97.6	Very high	3 Å²	3	25.3 Å²	25.3	1%	0.013	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	104.1	163.4	-175.1	-83.5	0	0	0	107.5	F31 P33 C36 A103 P163 V165 G189 C190 W192 D239	F31-F101 HydrophobicContact CE1-CD2 4.22Å; F31-F101 HydrophobicContact CE1-CE1 4.49Å; F31-F101 AromaticContact CE1-CE2 3.89Å; F31-F101 HydrophobicContact CE1-CE2 3.89Å; F31-F101 HydrophobicContact CE1-CZ 4.01Å; F31-F101 HydrophobicContact CZ-CB 4.48Å; F31-F101 HydrophobicContact CZ-CD1 4.09Å; F31-F101 AromaticContact CZ-CD2 3.91Å; F31-F101 HydrophobicContact CZ-CD2 3.91Å; F31-F101 HydrophobicContact CZ-CE1 4.18Å; F31-F101 AromaticContact CZ-CE2 4Å; F31-F101 HydrophobicContact CZ-CE2 4Å; F31-F101 AromaticContact CZ-CG 3.92Å; F31-F101 HydrophobicContact CZ-CG 3.92Å; F31-F101 HydrophobicContact CZ-CZ 4.1Å; P33-F101 HydrophobicContact CB-CE1 4.31Å; P33-F101 HydrophobicContact CB-CZ 4.35Å; C36-F101 HydrophobicContact CB-CD1 4.35Å; C36-F101 WeakPolarHBondContact SG-CD1 3.44Å; F101-A103 HydrophobicContact CD1-CB 4.35Å; F101-A103 HydrophobicContact CE1-CB 4.15Å; F101-P163 HydrophobicContact CD1-CB 4.26Å; F101-P163 HydrophobicContact CE1-CB 3.58Å; F101-P163 HydrophobicContact CE1-CG 3.83Å; F101-P163 HydrophobicContact CE2-CB 4.03Å; F101-P163 HydrophobicContact CE2-CG 3.76Å; F101-P163 HydrophobicContact CZ-CB 3.47Å; F101-P163 VanDerWaalsContact CZ-CB 3.47Å; F101-P163 HydrophobicContact CZ-CG 3.21Å; F101-V165 HydrophobicContact CD2-CG2 4.11Å; F101-G189 CarbonylContact O-C 3.48Å; F101-G189 WeakPolarHBondContact O-CA 3.4Å; F101-C190 PolarHBondContact N-O 3.03Å; F101-C190 PolarHBondContact O-N 2.83Å; F101-C190 VanDerWaalsContact O-N 3.08Å; F101-W192 HydrophobicContact CB-CE3 3.86Å; F101-W192 HydrophobicContact CB-CZ3 4.38Å; F101-W192 AromaticContact CD2-CE3 3.88Å; F101-W192 HydrophobicContact CD2-CE3 3.88Å; F101-W192 HydrophobicContact CD2-CH2 4.43Å; F101-W192 AromaticContact CD2-CZ3 3.57Å; F101-W192 HydrophobicContact CD2-CZ3 3.57Å; F101-W192 HydrophobicContact CE2-CZ3 4.23Å; F101-W192 HydrophobicContact CG-CE3 4.32Å; F101-W192 HydrophobicContact CG-CZ3 4.36Å; F101-D239 WeakPolarHBondContact CZ-O 3.49Å
102	V	98.5	Very high	97.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.4	-178.5	-173.2	0	0	0	0	108.3	L40 L96 H100 L160 I164 L187	L40-V102 HydrophobicContact CD1-CG2 4.16Å; L96-V102 HydrophobicContact CD1-CG2 4.26Å; H100-V102 HydrophobicContact CB-CG2 4.14Å; V102-L160 HydrophobicContact CG1-CD1 4Å; V102-I164 HydrophobicContact CB-CD1 4.32Å; V102-I164 HydrophobicContact CB-CG1 3.74Å; V102-I164 HydrophobicContact CG1-CG1 4.5Å; V102-I164 HydrophobicContact CG2-CG1 4.37Å; V102-I164 PolarHBondContact N-O 3.31Å; V102-I164 PolarHBondContact O-N 2.84Å; V102-L187 HydrophobicContact CG1-CB 4.36Å; V102-L187 HydrophobicContact CG1-CD2 4.23Å
103	A	97.4	Very high	96.6	Very high	8 Å²	8	30.7 Å²	30.7	7%	0.066	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-23.4	-175	0	0	0	0	0	113	R37 F101 L160 Y188	R37-A103 HydrophobicContact CG-CB 4.47Å; F101-A103 HydrophobicContact CD1-CB 4.35Å; F101-A103 HydrophobicContact CE1-CB 4.15Å; A103-L160 WeakPolarHBondContact O-CB 3.49Å; A103-L160 PolarHBondContact O-N 2.88Å; A103-Y188 PolarHBondContact N-O 2.93Å
104	L	97.6	Very high	96	Very high	9 Å²	9	31.5 Å²	31.5	5%	0.047	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	162.7	174.4	-40.7	71.3	0	0	0	112	R37 K158 Y188	R37-L104 HydrophobicContact CB-CD1 3.96Å; R37-L104 HydrophobicContact CG-CD1 3.77Å; R37-L104 VanDerWaalsContact NH1-CD1 3.31Å; L104-K158 VanDerWaalsContact CA-O 3.25Å; L104-K158 WeakPolarHBondContact CA-O 3.19Å; L104-K158 WeakPolarHBondContact CB-O 3.4Å; L104-Y188 HydrophobicContact CB-CD2 4.09Å; L104-Y188 HydrophobicContact CB-CG 4.36Å; L104-Y188 PolarHBondContact N-O 2.91Å; L104-Y188 VanDerWaalsContact N-O 3.11Å; L104-Y188 PolarHBondContact O-N 3.43Å
105	V	98.6	Very high	95.5	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.6	162.4	-62.7	0	0	0	0	110.1	Y123 L125 L157 K158 L160 F171 E186	V105-Y123 HydrophobicContact CG2-CE2 4.29Å; V105-Y123 VanDerWaalsContact CG2-OH 3.26Å; V105-Y123 WeakPolarHBondContact CG2-OH 3.42Å; V105-L125 HydrophobicContact CG1-CD1 4.28Å; V105-L125 HydrophobicContact CG2-CD1 4.1Å; V105-L157 WeakPolarHBondContact O-CA 3.27Å; V105-K158 HydrophobicContact CG2-CB 3.97Å; V105-K158 PolarHBondContact N-O 2.83Å; V105-K158 VanDerWaalsContact N-O 3.1Å; V105-K158 PolarHBondContact O-N 2.86Å; V105-L160 HydrophobicContact CG1-CD1 4.26Å; V105-L160 HydrophobicContact CG2-CD2 4.38Å; V105-F171 HydrophobicContact CB-CE1 3.9Å; V105-F171 HydrophobicContact CB-CZ 3.87Å; V105-F171 HydrophobicContact CG1-CE1 4.08Å; V105-F171 HydrophobicContact CG1-CZ 3.68Å; V105-F171 HydrophobicContact CG2-CE1 4.15Å; V105-E186 CarbonylContact C-O 3.01Å; V105-E186 WeakPolarHBondContact CA-O 3.38Å
106	G	98.3	Very high	95.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141	169.5	0	0	0	0	0	110.6	V156 V185 E186	G106-V156 CarbonylContact C-O 3.52Å; G106-V156 WeakPolarHBondContact CA-O 3.35Å; G106-V185 CarbonylContact O-C 3.57Å; G106-V185 WeakPolarHBondContact O-CA 3.24Å; G106-E186 PolarHBondContact N-O 3.34Å; G106-E186 PolarHBondContact O-N 3.21Å
107	T	98.5	Very high	94.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.9	173.2	66.2	0	0	0	0	111.7	Y123 N149 V156 F171 L183 R184 V185	T107-Y123 HydrophobicContact CG2-CD1 4.33Å; T107-Y123 HydrophobicContact CG2-CE1 3.63Å; T107-Y123 HydrophobicContact CG2-CE2 4.42Å; T107-N149 WeakPolarHBondContact CB-OD1 3.4Å; T107-N149 PolarHBondContact O-ND2 2.71Å; T107-N149 PolarHBondContact OG1-OD1 3.16Å; T107-V156 PolarHBondContact N-O 3.13Å; T107-V156 PolarHBondContact O-N 3.44Å; T107-F171 HydrophobicContact CG2-CD1 4.37Å; T107-F171 HydrophobicContact CG2-CE1 4.16Å; T107-L183 HydrophobicContact CG2-CD2 4.32Å; T107-R184 CarbonylContact C-O 3.33Å; T107-R184 WeakPolarHBondContact CA-O 3.49Å; T107-V185 HydrophobicContact CG2-CG1 4.3Å
108	Q	97.7	Very high	94.9	Very high	14 Å²	14	41 Å²	41	7%	0.065	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.9	177.1	-154.8	-179.6	21.1	0	0	109.3	L69 N149 Y153 I155 R184	L69-Q108 HydrophobicContact CD1-CB 3.66Å; Q108-N149 WeakPolarHBondContact CA-ND2 3.25Å; Q108-N149 PolarHBondContact N-OD1 3.05Å; Q108-Y153 PolarHBondContact NE2-O 3.24Å; Q108-I155 HydrophobicContact CG-CG1 4.28Å; Q108-R184 HydrophobicContact CB-CB 4.15Å; Q108-R184 VanDerWaalsContact CD-CZ 3.42Å; Q108-R184 VanDerWaalsContact CG-NH2 3.3Å; Q108-R184 PolarHBondContact N-O 3.46Å; Q108-R184 PolarHBondContact O-N 2.85Å; Q108-R184 VanDerWaalsContact OE1-NH1 3.1Å
109	G	96.8	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.			trans	-82.1	-172.1	175.8	0	0	0	0	0	113.3	H111 T152 R184	G109-H111 PolarHBondContact O-N 2.94Å; G109-T152 CarbonylContact C-O 3.56Å; G109-T152 VanDerWaalsContact C-O 3.28Å; G109-T152 VanDerWaalsContact O-O 3.11Å; G109-R184 PolarHBondContact O-NE 3.25Å; G109-R184 PolarHBondContact O-NH2 3.29Å
110	R	96.4	Very high	94.8	Very high	40 Å²	40	35.5 Å²	35.5	15%	0.151	18%	0.183	C	C	.	.			trans	-88.2	101.5	174.9	-170.6	-177.5	77.9	88.2	-5.3	110.5	D75 A77 A112 G116 E118 T152 C182	D75-R110 VanDerWaalsContact O-CD 3.26Å; D75-R110 WeakPolarHBondContact O-CD 3.13Å; D75-R110 WeakPolarHBondContact O-CG 3.41Å; D75-R110 PolarHBondContact O-NH1 3.22Å; D75-R110 VanDerWaalsContact O-NH1 3.07Å; A77-R110 HydrophobicContact CB-CB 3.62Å; A77-R110 HydrophobicContact CB-CG 3.7Å; R110-A112 HydrophobicContact CG-CB 4.24Å; R110-G116 VanDerWaalsContact NH2-CA 3.34Å; R110-G116 CarbonylContact O-C 3.49Å; R110-G116 VanDerWaalsContact O-CA 3.25Å; R110-G116 WeakPolarHBondContact O-CA 3.39Å; R110-E118 IonicContact CZ-OE2 3.05Å; R110-E118 PolarHBondContact N-O 3.31Å; R110-E118 IonicContact NE-OE2 3.21Å; R110-E118 PolarHBondContact NE-OE2 3.49Å; R110-E118 VanDerWaalsContact NH2-CD 3.34Å; R110-E118 IonicContact NH2-OE1 3.18Å; R110-E118 PolarHBondContact NH2-OE1 3.37Å; R110-E118 IonicContact NH2-OE2 2.75Å; R110-E118 PolarHBondContact NH2-OE2 3.47Å; R110-T152 VanDerWaalsContact O-CB 3.29Å; R110-T152 WeakPolarHBondContact O-CB 3.3Å; R110-T152 WeakPolarHBondContact O-CG2 3.45Å; R110-C182 HydrophobicContact CB-CB 3.67Å
111	H	91.4	Very high	94.7	Very high	67 Å²	67	39.6 Å²	39.6	31%	0.31	20%	0.198	S	C	.	.			trans	-77.7	-47.2	179	-173.6	56.3	0	0	0	112.4	G109 D113 G114 H115 G116	G109-H111 PolarHBondContact O-N 2.94Å; H111-D113 PolarHBondContact O-N 3.43Å; H111-G114 PolarHBondContact NE2-N 3.4Å; H111-G114 WeakPolarHBondContact O-CA 3.35Å; H111-G114 PolarHBondContact O-N 2.97Å; H111-H115 PolarHBondContact O-N 3.5Å; H111-G116 WeakPolarHBondContact O-CA 3.27Å; H111-G116 PolarHBondContact O-N 2.99Å
112	A	88.7	Confident	94.5	Very high	20 Å²	20	41 Å²	41	17%	0.165	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	43.6	58.8	178.8	0	0	0	0	0	113.3	D75 R110 G114 H115	D75-A112 WeakPolarHBondContact O-CB 3.27Å; R110-A112 HydrophobicContact CG-CB 4.24Å; A112-G114 PolarHBondContact O-N 3.1Å; A112-G114 VanDerWaalsContact O-N 3.11Å; A112-H115 WeakPolarHBondContact O-CB 3.37Å; A112-H115 PolarHBondContact O-N 3.48Å
113	D	86.1	Confident	94.5	Very high	147 Å²	147	41 Å²	41	79%	0.786	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	52.5	32.3	-177.9	-58.2	-34	0	0	0	114.6	H111 H115	H111-D113 PolarHBondContact O-N 3.43Å; D113-H115 VanDerWaalsContact C-N 3.32Å
114	G	87.8	Confident	94.5	Very high	39 Å²	39	42.8 Å²	42.8	40%	0.402	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	85.5	-2	-179.6	0	0	0	0	0	114.7	H111 A112	H111-G114 PolarHBondContact NE2-N 3.4Å; H111-G114 WeakPolarHBondContact O-CA 3.35Å; H111-G114 PolarHBondContact O-N 2.97Å; A112-G114 PolarHBondContact O-N 3.1Å; A112-G114 VanDerWaalsContact O-N 3.11Å
115	H	88.4	Confident	94.5	Very high	159 Å²	159	42.4 Å²	42.4	74%	0.736	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-21.8	174.8	-63.4	-68.5	0	0	0	112.9	H111 A112 D113	H111-H115 PolarHBondContact O-N 3.5Å; A112-H115 WeakPolarHBondContact O-CB 3.37Å; A112-H115 PolarHBondContact O-N 3.48Å; D113-H115 VanDerWaalsContact C-N 3.32Å
116	G	90	Very high	94.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.223	C	C	.	.			trans	-78.9	144.4	180	0	0	0	0	0	113.8	R110 H111	R110-G116 VanDerWaalsContact NH2-CA 3.34Å; R110-G116 CarbonylContact O-C 3.49Å; R110-G116 VanDerWaalsContact O-CA 3.25Å; R110-G116 WeakPolarHBondContact O-CA 3.39Å; H111-G116 WeakPolarHBondContact O-CA 3.27Å; H111-G116 PolarHBondContact O-N 2.99Å
117	Q	93.9	Very high	94.5	Very high	138 Å²	138	46.3 Å²	46.3	65%	0.645	23%	0.226	S	C	*	.			trans	-130	-3	-175.3	-60.4	-61.5	-43.1	0	0	112.6
118	E	95.8	Very high	94.6	Very high	53 Å²	53	46.3 Å²	46.3	25%	0.248	23%	0.226	C	C	.	.			trans	-98.3	131.5	-171.1	-53.3	79.4	-179.5	0	0	110.8	R110 C182	R110-E118 IonicContact CZ-OE2 3.05Å; R110-E118 PolarHBondContact N-O 3.31Å; R110-E118 IonicContact NE-OE2 3.21Å; R110-E118 PolarHBondContact NE-OE2 3.49Å; R110-E118 VanDerWaalsContact NH2-CD 3.34Å; R110-E118 IonicContact NH2-OE1 3.18Å; R110-E118 PolarHBondContact NH2-OE1 3.37Å; R110-E118 IonicContact NH2-OE2 2.75Å; R110-E118 PolarHBondContact NH2-OE2 3.47Å; E118-C182 HydrophobicContact CB-CB 4.05Å
119	F	96.6	Very high	94.6	Very high	25 Å²	25	46.3 Å²	46.3	11%	0.11	23%	0.225	C	C	.	.			trans	-155.8	164	177.2	59.1	-90.1	0	0	0	109.7	R121 N149 E150 N151 T152	F119-R121 HydrophobicContact CD2-CG 4.12Å; F119-R121 HydrophobicContact CE2-CG 3.64Å; F119-N149 HydrophobicContact CB-CB 4.26Å; F119-N149 HydrophobicContact CD2-CB 4.17Å; F119-N149 WeakPolarHBondContact CD2-O 3.28Å; F119-N149 VanDerWaalsContact CE2-O 3.28Å; F119-N149 WeakPolarHBondContact CE2-O 3.27Å; F119-E150 VanDerWaalsContact CE2-C 3.44Å; F119-E150 WeakPolarHBondContact CE2-O 3.47Å; F119-E150 WeakPolarHBondContact CZ-O 3.35Å; F119-N151 WeakPolarHBondContact CB-O 3.08Å; F119-T152 HydrophobicContact CD1-CG2 3.89Å
120	V	95.6	Very high	94.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.			trans	-103	118.7	179.6	172.2	0	0	0	0	110.2	S122 Y123 N149 P173 V181 L183	V120-S122 WeakPolarHBondContact CG1-O 3.29Å; V120-Y123 HydrophobicContact CG1-CD1 4.44Å; V120-N149 PolarHBondContact O-N 2.96Å; V120-P173 HydrophobicContact CG1-CB 4.07Å; V120-P173 HydrophobicContact CG2-CB 3.65Å; V120-V181 HydrophobicContact CG2-CB 3.63Å; V120-V181 HydrophobicContact CG2-CG1 4.29Å; V120-V181 HydrophobicContact CG2-CG2 3.94Å; V120-L183 HydrophobicContact CB-CD1 4.36Å; V120-L183 HydrophobicContact CB-CD2 3.78Å; V120-L183 HydrophobicContact CB-CG 3.98Å; V120-L183 HydrophobicContact CG1-CD2 4.39Å; V120-L183 HydrophobicContact CG2-CD1 3.78Å; V120-L183 HydrophobicContact CG2-CD2 3.88Å; V120-L183 HydrophobicContact CG2-CG 3.48Å; V120-L183 VanDerWaalsContact CG2-CG 3.48Å
121	R	95.6	Very high	94.5	Very high	109 Å²	109	48.4 Å²	48.4	41%	0.411	25%	0.245	S	C	.	.	S	Bend	trans	-77.9	-28.3	178.1	-72.5	-176.1	-178.7	129.5	6.2	113.7	F119 G148 N149	F119-R121 HydrophobicContact CD2-CG 4.12Å; F119-R121 HydrophobicContact CE2-CG 3.64Å; R121-G148 PolarHBondContact O-N 2.94Å; R121-N149 WeakPolarHBondContact CA-O 3.38Å
122	S	95.6	Very high	94.7	Very high	31 Å²	31	53.9 Å²	53.9	22%	0.217	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	151.3	177.3	55.4	0	0	0	0	110.8	V120 V146 L174	V120-S122 WeakPolarHBondContact CG1-O 3.29Å; S122-V146 CarbonylContact C-O 3.55Å; S122-V146 WeakPolarHBondContact CA-O 3.5Å; S122-V146 WeakPolarHBondContact CB-O 3.27Å; S122-L174 WeakPolarHBondContact O-CA 3.34Å; S122-L174 WeakPolarHBondContact O-CB 3.5Å; S122-L174 PolarHBondContact O-N 3.35Å
123	Y	97.1	Very high	95.1	Very high	1 Å²	1	57 Å²	57	0%	0.004	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	163.3	-179	58.8	-85	0	0	0	110.6	V105 T107 V120 L125 V146 F171 Y172	V105-Y123 HydrophobicContact CG2-CE2 4.29Å; V105-Y123 VanDerWaalsContact CG2-OH 3.26Å; V105-Y123 WeakPolarHBondContact CG2-OH 3.42Å; T107-Y123 HydrophobicContact CG2-CD1 4.33Å; T107-Y123 HydrophobicContact CG2-CE1 3.63Å; T107-Y123 HydrophobicContact CG2-CE2 4.42Å; V120-Y123 HydrophobicContact CG1-CD1 4.44Å; Y123-L125 HydrophobicContact CD2-CD2 4.03Å; Y123-L125 HydrophobicContact CD2-CG 4.07Å; Y123-L125 HydrophobicContact CE2-CD1 4.2Å; Y123-L125 HydrophobicContact CE2-CD2 3.84Å; Y123-L125 HydrophobicContact CE2-CG 3.83Å; Y123-V146 HydrophobicContact CD1-CB 4.32Å; Y123-V146 HydrophobicContact CD1-CG1 4.46Å; Y123-V146 HydrophobicContact CD2-CB 4.05Å; Y123-V146 HydrophobicContact CD2-CG2 4.45Å; Y123-V146 HydrophobicContact CE1-CB 4.02Å; Y123-V146 HydrophobicContact CE1-CG1 3.7Å; Y123-V146 HydrophobicContact CE2-CB 3.74Å; Y123-V146 HydrophobicContact CE2-CG1 3.81Å; Y123-V146 HydrophobicContact CE2-CG2 4.09Å; Y123-V146 HydrophobicContact CG-CB 4.33Å; Y123-V146 PolarHBondContact N-O 2.93Å; Y123-V146 PolarHBondContact O-N 3Å; Y123-V146 VanDerWaalsContact OH-CG1 3.3Å; Y123-V146 WeakPolarHBondContact OH-CG1 3.34Å; Y123-F171 HydrophobicContact CD2-CD1 4.05Å; Y123-F171 HydrophobicContact CE2-CD1 4Å; Y123-F171 HydrophobicContact CE2-CE1 4.17Å; Y123-Y172 CarbonylContact C-O 3.28Å; Y123-Y172 WeakPolarHBondContact CA-O 3.19Å; Y123-Y172 VanDerWaalsContact CB-O 3.28Å; Y123-Y172 WeakPolarHBondContact CB-O 3.43Å
124	R	97.5	Very high	95.6	Very high	46 Å²	46	51.8 Å²	51.8	17%	0.174	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	154.4	162.6	-65.5	-169	177.9	79.7	4.3	109.9	E88 E144 Y172 L174	E88-R124 VanDerWaalsContact OE1-CD 3.23Å; E88-R124 WeakPolarHBondContact OE1-CD 3.49Å; E88-R124 IonicContact OE1-CZ 3.91Å; E88-R124 IonicContact OE1-NE 2.85Å; E88-R124 PolarHBondContact OE1-NE 2.9Å; E88-R124 IonicContact OE1-NH1 3.49Å; E88-R124 PolarHBondContact OE1-NH1 3.47Å; E88-R124 IonicContact OE1-NH2 3.76Å; R124-E144 IonicContact NE-OE2 2.67Å; R124-E144 PolarHBondContact NE-OE2 2.94Å; R124-Y172 PolarHBondContact N-O 3.35Å; R124-Y172 PolarHBondContact O-N 3.35Å; R124-L174 HydrophobicContact CG-CD1 4.04Å; R124-L174 VanDerWaalsContact NH1-CD2 3.34Å
125	L	98.6	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135.5	171.1	-68.3	173.6	0	0	0	109.6	V105 Y123 W137 L160 V169 R170 F171	V105-L125 HydrophobicContact CG1-CD1 4.28Å; V105-L125 HydrophobicContact CG2-CD1 4.1Å; Y123-L125 HydrophobicContact CD2-CD2 4.03Å; Y123-L125 HydrophobicContact CD2-CG 4.07Å; Y123-L125 HydrophobicContact CE2-CD1 4.2Å; Y123-L125 HydrophobicContact CE2-CD2 3.84Å; Y123-L125 HydrophobicContact CE2-CG 3.83Å; L125-W137 HydrophobicContact CB-CB 3.98Å; L125-W137 PolarHBondContact O-N 2.85Å; L125-L160 HydrophobicContact CD1-CD2 3.59Å; L125-V169 HydrophobicContact CD2-CG1 4.29Å; L125-R170 WeakPolarHBondContact CA-O 3.36Å; L125-F171 HydrophobicContact CD2-CD1 3.53Å; L125-F171 HydrophobicContact CD2-CD2 4.26Å; L125-F171 HydrophobicContact CD2-CE1 3.6Å; L125-F171 HydrophobicContact CD2-CE2 4.3Å; L125-F171 HydrophobicContact CD2-CG 3.89Å; L125-F171 HydrophobicContact CD2-CZ 3.99Å
126	R	98.6	Very high	96.6	Very high	69 Å²	69	45.3 Å²	45.3	26%	0.26	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.2	162.8	-55	-171.7	70.1	177.6	-0.7	109.6	W134 I135 T136 V169 R170 Y172	R126-W134 HydrophobicContact CB-CE3 4.08Å; R126-W134 PolarHBondContact NH2-O 3.31Å; R126-I135 CarbonylContact C-O 3.53Å; R126-I135 WeakPolarHBondContact CA-O 3.35Å; R126-I135 WeakPolarHBondContact CB-O 3.35Å; R126-T136 PolarHBondContact NE-OG1 3.27Å; R126-V169 CarbonylContact O-C 3.47Å; R126-R170 HydrophobicContact CB-CB 4.45Å; R126-R170 PolarHBondContact N-O 2.98Å; R126-R170 PolarHBondContact O-N 2.88Å; R126-Y172 HydrophobicContact CB-CD2 4.38Å; R126-Y172 HydrophobicContact CB-CE2 3.86Å; R126-Y172 HydrophobicContact CG-CD2 3.89Å; R126-Y172 HydrophobicContact CG-CE2 3.6Å
127	Y	98.8	Very high	97	Very high	15 Å²	15	45.5 Å²	45.5	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	160.1	-178.4	65.1	-82.6	0	0	0	111.2	W134 I135 W137 I164 A166 M168 D222	Y127-W134 WeakPolarHBondContact O-CA 3.48Å; Y127-I135 HydrophobicContact CD1-CB 4.34Å; Y127-I135 WeakPolarHBondContact CD1-O 3.42Å; Y127-I135 HydrophobicContact CE1-CB 3.88Å; Y127-I135 HydrophobicContact CE1-CG2 3.73Å; Y127-I135 HydrophobicContact CE2-CB 4.11Å; Y127-I135 HydrophobicContact CE2-CD1 3.92Å; Y127-I135 HydrophobicContact CE2-CG2 4.4Å; Y127-I135 PolarHBondContact N-O 2.79Å; Y127-I135 PolarHBondContact O-N 3.32Å; Y127-I135 WeakPolarHBondContact OH-CG2 3.3Å; Y127-W137 HydrophobicContact CD1-CB 4.21Å; Y127-W137 HydrophobicContact CE1-CB 4.09Å; Y127-I164 HydrophobicContact CD1-CB 4.39Å; Y127-I164 HydrophobicContact CD1-CD1 4.06Å; Y127-I164 HydrophobicContact CD1-CG2 3.98Å; Y127-I164 HydrophobicContact CD2-CB 4.21Å; Y127-I164 HydrophobicContact CE1-CB 4.41Å; Y127-I164 HydrophobicContact CE1-CG2 3.73Å; Y127-I164 HydrophobicContact CE2-CB 4.22Å; Y127-I164 HydrophobicContact CE2-CG2 4.31Å; Y127-I164 HydrophobicContact CG-CB 4.29Å; Y127-I164 HydrophobicContact CG-CD1 3.89Å; Y127-I164 HydrophobicContact CG-CG2 4.38Å; Y127-A166 HydrophobicContact CD2-CB 4.03Å; Y127-A166 HydrophobicContact CG-CB 4.33Å; Y127-M168 CarbonylContact C-O 3.5Å; Y127-M168 VanDerWaalsContact CA-O 3.26Å; Y127-M168 WeakPolarHBondContact CA-O 3.03Å; Y127-D222 VanDerWaalsContact OH-CB 3.26Å; Y127-D222 WeakPolarHBondContact OH-CB 3.37Å; Y127-D222 PolarHBondContact OH-OD2 2.84Å; Y127-D222 VanDerWaalsContact OH-OD2 3.08Å
128	S	98.7	Very high	97.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	143.5	-179.7	-171.6	0	0	0	0	110.8	D130 G131 K133 R167 M168	S128-D130 PolarHBondContact OG-N 3.49Å; S128-D130 PolarHBondContact OG-OD1 3.28Å; S128-D130 VanDerWaalsContact OG-OD1 3.11Å; S128-G131 WeakPolarHBondContact OG-CA 3.48Å; S128-G131 PolarHBondContact OG-N 3.26Å; S128-K133 VanDerWaalsContact CB-O 3.24Å; S128-K133 WeakPolarHBondContact CB-O 3.32Å; S128-K133 PolarHBondContact OG-O 3.34Å; S128-R167 PolarHBondContact O-N 3.4Å; S128-M168 PolarHBondContact N-O 3.1Å; S128-M168 PolarHBondContact O-N 2.9Å
129	R	98.3	Very high	97.2	Very high	13 Å²	13	41.3 Å²	41.3	5%	0.049	19%	0.192	C	C	.	.	S	Bend	trans	-92.3	-30.3	170.9	-67.5	-177.2	-78.7	-76.9	4.5	112	L99 V165 Y197 D222	L99-R129 HydrophobicContact CD2-CB 3.84Å; L99-R129 HydrophobicContact CD2-CG 3.72Å; R129-V165 VanDerWaalsContact CG-O 3.26Å; R129-V165 WeakPolarHBondContact CG-O 3.48Å; R129-V165 PolarHBondContact NH1-O 2.91Å; R129-Y197 HydrophobicContact CB-CD2 4.15Å; R129-Y197 HydrophobicContact CB-CE2 3.48Å; R129-Y197 VanDerWaalsContact CB-CE2 3.48Å; R129-Y197 HydrophobicContact CG-CE2 4.48Å; R129-Y197 PolarHBondContact NE-O 2.94Å; R129-D222 IonicContact CZ-OD1 3.37Å; R129-D222 IonicContact CZ-OD2 2.68Å; R129-D222 VanDerWaalsContact CZ-OD2 3.28Å; R129-D222 IonicContact NH1-OD1 3.37Å; R129-D222 IonicContact NH1-OD2 3.82Å; R129-D222 PolarHBondContact NH1-OD2 2.91Å; R129-D222 VanDerWaalsContact NH2-CG 3.32Å; R129-D222 IonicContact NH2-OD1 2.96Å; R129-D222 PolarHBondContact NH2-OD1 3.28Å; R129-D222 IonicContact NH2-OD2 2.88Å; R129-D222 PolarHBondContact NH2-OD2 2.9Å
130	D	95.9	Very high	97.1	Very high	60 Å²	60	40.9 Å²	40.9	32%	0.321	19%	0.189	S	C	.	.	S	Bend	trans	-112.2	-7.3	-175.2	62.6	4	0	0	0	114.7	S128 K132 K133 Y197	S128-D130 PolarHBondContact OG-N 3.49Å; S128-D130 PolarHBondContact OG-OD1 3.28Å; S128-D130 VanDerWaalsContact OG-OD1 3.11Å; D130-K132 PolarHBondContact O-N 3Å; D130-K132 WeakPolarHBondContact OD1-CA 3.43Å; D130-K132 PolarHBondContact OD1-N 3.17Å; D130-K133 PolarHBondContact OD1-N 2.97Å; D130-Y197 WeakPolarHBondContact CB-OH 3.33Å
131	G	95.9	Very high	97	Very high	25 Å²	25	46.2 Å²	46.2	26%	0.258	21%	0.21	S	C	.	.	S	Bend	trans	75	0.9	-173	0	0	0	0	0	114.8	S128 W134 M168	S128-G131 WeakPolarHBondContact OG-CA 3.48Å; S128-G131 PolarHBondContact OG-N 3.26Å; G131-W134 PolarHBondContact O-NE1 2.84Å; G131-M168 VanDerWaalsContact CA-SD 3.55Å
132	K	95.8	Very high	97	Very high	181 Å²	181	43.2 Å²	43.2	79%	0.787	21%	0.212	S	C	*	.	S	Bend	trans	-110.3	-52.7	-178.2	-62.2	177.3	-176.9	173	0	111.2	D130	D130-K132 PolarHBondContact O-N 3Å; D130-K132 WeakPolarHBondContact OD1-CA 3.43Å; D130-K132 PolarHBondContact OD1-N 3.17Å
133	K	96.7	Very high	97	Very high	85 Å²	85	45.8 Å²	45.8	37%	0.37	22%	0.221	S	C	.	.	S	Bend	trans	-89	118.3	176	-174.6	-178.1	173	-169.7	0	108.7	S128 D130	S128-K133 VanDerWaalsContact CB-O 3.24Å; S128-K133 WeakPolarHBondContact CB-O 3.32Å; S128-K133 PolarHBondContact OG-O 3.34Å; D130-K133 PolarHBondContact OD1-N 2.97Å
134	W	97.6	Very high	97	Very high	39 Å²	39	48.4 Å²	48.4	15%	0.148	23%	0.233	C	C	.	.			trans	-108.2	122.5	178.9	-72.2	87.1	0	0	0	110.8	Q93 R126 Y127 G131 M168 R170	Q93-W134 HydrophobicContact CG-CH2 4.2Å; R126-W134 HydrophobicContact CB-CE3 4.08Å; R126-W134 PolarHBondContact NH2-O 3.31Å; Y127-W134 WeakPolarHBondContact O-CA 3.48Å; G131-W134 PolarHBondContact O-NE1 2.84Å; W134-M168 HydrophobicContact CH2-CB 3.62Å; W134-M168 HydrophobicContact CH2-SD 4.27Å; W134-M168 HydrophobicContact CZ2-CB 4.28Å; W134-M168 HydrophobicContact CZ2-SD 4.04Å; W134-M168 HydrophobicContact CZ3-CB 4.25Å; W134-R170 HydrophobicContact CE3-CG 4.28Å; W134-R170 HydrophobicContact CH2-CG 3.59Å; W134-R170 HydrophobicContact CZ2-CG 4.49Å; W134-R170 VanDerWaalsContact CZ2-CZ 3.47Å; W134-R170 HydrophobicContact CZ3-CB 3.98Å; W134-R170 HydrophobicContact CZ3-CG 3.48Å; W134-R170 VanDerWaalsContact CZ3-CG 3.48Å
135	I	98.1	Very high	96.9	Very high	23 Å²	23	48.2 Å²	48.2	12%	0.118	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135	-178.5	-57.6	164	0	0	0	108.2	R126 Y127 D222	R126-I135 CarbonylContact C-O 3.53Å; R126-I135 WeakPolarHBondContact CA-O 3.35Å; R126-I135 WeakPolarHBondContact CB-O 3.35Å; Y127-I135 HydrophobicContact CD1-CB 4.34Å; Y127-I135 WeakPolarHBondContact CD1-O 3.42Å; Y127-I135 HydrophobicContact CE1-CB 3.88Å; Y127-I135 HydrophobicContact CE1-CG2 3.73Å; Y127-I135 HydrophobicContact CE2-CB 4.11Å; Y127-I135 HydrophobicContact CE2-CD1 3.92Å; Y127-I135 HydrophobicContact CE2-CG2 4.4Å; Y127-I135 PolarHBondContact N-O 2.79Å; Y127-I135 PolarHBondContact O-N 3.32Å; Y127-I135 WeakPolarHBondContact OH-CG2 3.3Å; I135-D222 HydrophobicContact CD1-CB 4.09Å; I135-D222 WeakPolarHBondContact CD1-OD2 3.36Å; I135-D222 HydrophobicContact CG2-CB 4.24Å
136	T	97.8	Very high	96.8	Very high	39 Å²	39	48.2 Å²	48.2	24%	0.239	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.9	171.7	-59.2	0	0	0	0	108.7	R126 E144	R126-T136 PolarHBondContact NE-OG1 3.27Å; T136-E144 HydrophobicContact CG2-CB 4.32Å; T136-E144 HydrophobicContact CG2-CG 4.49Å
137	W	98.5	Very high	96.7	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.015	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-72.9	138	175	178	80.9	0	0	0	110.2	L125 Y127 D139 V146 L160 P162 I164	L125-W137 HydrophobicContact CB-CB 3.98Å; L125-W137 PolarHBondContact O-N 2.85Å; Y127-W137 HydrophobicContact CD1-CB 4.21Å; Y127-W137 HydrophobicContact CE1-CB 4.09Å; W137-D139 HydrophobicContact CH2-CB 3.63Å; W137-D139 HydrophobicContact CZ2-CB 3.97Å; W137-D139 HydrophobicContact CZ3-CB 4.28Å; W137-V146 HydrophobicContact CE3-CG2 3.96Å; W137-V146 HydrophobicContact CH2-CG2 4.47Å; W137-V146 HydrophobicContact CZ3-CG2 3.52Å; W137-L160 HydrophobicContact CD2-CD2 4.26Å; W137-L160 HydrophobicContact CH2-CD2 4.3Å; W137-L160 HydrophobicContact CZ2-CB 4.23Å; W137-L160 HydrophobicContact CZ2-CD2 3.89Å; W137-P162 PolarHBondContact NE1-O 3.47Å; W137-I164 HydrophobicContact CG-CG2 4.32Å
138	Q	97.5	Very high	96.6	Very high	90 Å²	90	46.7 Å²	46.7	42%	0.421	24%	0.24	S	C	.	.			trans	-132.6	142.2	173.2	-48	-170.4	-24.9	0	0	107.1	Q143 E144 P162	Q138-Q143 WeakPolarHBondContact CA-O 3.23Å; Q138-E144 HydrophobicContact CG-CG 3.95Å; Q138-E144 PolarHBondContact NE2-OE1 2.9Å; Q138-P162 WeakPolarHBondContact O-CD 3.41Å
139	D	96.4	Very high	96.5	Very high	13 Å²	13	46.8 Å²	46.8	7%	0.07	24%	0.241	C	C	.	.			trans	-71.3	174.6	173.2	71.2	17.1	0	0	0	112.1	W137 W141 G142 Q143 G161	W137-D139 HydrophobicContact CH2-CB 3.63Å; W137-D139 HydrophobicContact CZ2-CB 3.97Å; W137-D139 HydrophobicContact CZ3-CB 4.28Å; D139-W141 HydrophobicContact CB-CE3 4.21Å; D139-W141 PolarHBondContact O-N 3.49Å; D139-W141 WeakPolarHBondContact OD1-CA 3.35Å; D139-W141 PolarHBondContact OD1-N 3.33Å; D139-G142 PolarHBondContact O-N 2.78Å; D139-G142 PolarHBondContact OD1-N 3.45Å; D139-G142 VanDerWaalsContact OD1-N 3.12Å; D139-Q143 PolarHBondContact N-O 3.48Å; D139-Q143 WeakPolarHBondContact OD1-CB 3.08Å; D139-Q143 PolarHBondContact OD1-N 2.85Å; D139-Q143 WeakPolarHBondContact OD2-CB 3.15Å; D139-G161 CarbonylContact C-O 3.38Å; D139-G161 WeakPolarHBondContact CA-O 3.2Å; D139-G161 WeakPolarHBondContact CB-O 3.47Å
140	R	94.8	Very high	96.4	Very high	15 Å²	15	54.2 Å²	54.2	6%	0.057	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-14.8	179.2	-57.9	-169.4	-174	-79	9.1	114.2	G161 D239 E252 Y259	R140-G161 WeakPolarHBondContact CG-O 3.46Å; R140-G161 PolarHBondContact N-O 3.4Å; R140-D239 IonicContact CZ-OD2 3.24Å; R140-D239 IonicContact NH1-OD2 3.13Å; R140-D239 PolarHBondContact NH1-OD2 3.28Å; R140-D239 IonicContact NH2-OD2 2.77Å; R140-D239 PolarHBondContact NH2-OD2 3.36Å; R140-E252 IonicContact CZ-OE1 2.61Å; R140-E252 VanDerWaalsContact CZ-OE1 3.24Å; R140-E252 IonicContact NE-OE1 2.7Å; R140-E252 PolarHBondContact NE-OE1 3.29Å; R140-E252 VanDerWaalsContact NE-OE1 3.13Å; R140-E252 IonicContact NE-OE2 3.89Å; R140-E252 PolarHBondContact NE-OE2 3.02Å; R140-E252 VanDerWaalsContact NE-OE2 3.12Å; R140-E252 IonicContact NH2-OE1 3.11Å; R140-E252 PolarHBondContact NH2-OE1 3.47Å; R140-Y259 WeakPolarHBondContact CB-OH 3.05Å; R140-Y259 WeakPolarHBondContact CD-OH 2.95Å; R140-Y259 VanDerWaalsContact CG-OH 3.23Å; R140-Y259 WeakPolarHBondContact CG-OH 3.37Å; R140-Y259 PolarHBondContact NH1-OH 2.85Å
141	W	94.4	Very high	96.3	Very high	113 Å²	113	52.7 Å²	52.7	43%	0.428	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	7.7	179.4	-51.1	-74.2	0	0	0	112.9	D139 L253 R254	D139-W141 HydrophobicContact CB-CE3 4.21Å; D139-W141 PolarHBondContact O-N 3.49Å; D139-W141 WeakPolarHBondContact OD1-CA 3.35Å; D139-W141 PolarHBondContact OD1-N 3.33Å; W141-L253 VanDerWaalsContact CZ2-O 3.29Å; W141-L253 WeakPolarHBondContact CZ2-O 2.94Å; W141-L253 PolarHBondContact NE1-O 3.11Å; W141-R254 PolarHBondContact NE1-O 3.21Å
142	G	94.8	Very high	96.3	Very high	45 Å²	45	52.1 Å²	52.1	46%	0.464	26%	0.26	S	S	.	.	S	Bend	trans	81.4	15.3	177.1	0	0	0	0	0	114.5	D139	D139-G142 PolarHBondContact O-N 2.78Å; D139-G142 PolarHBondContact OD1-N 3.45Å; D139-G142 VanDerWaalsContact OD1-N 3.12Å
143	Q	95.9	Very high	96.1	Very high	85 Å²	85	48.9 Å²	48.9	40%	0.397	24%	0.243	S	C	.	.			trans	-88.6	122.4	179	177.2	62.8	59.5	0	0	110.6	Q138 D139 V145	Q138-Q143 WeakPolarHBondContact CA-O 3.23Å; D139-Q143 PolarHBondContact N-O 3.48Å; D139-Q143 WeakPolarHBondContact OD1-CB 3.08Å; D139-Q143 PolarHBondContact OD1-N 2.85Å; D139-Q143 WeakPolarHBondContact OD2-CB 3.15Å; Q143-V145 VanDerWaalsContact NE2-CB 3.3Å; Q143-V145 PolarHBondContact NE2-O 3.42Å
144	E	95.7	Very high	96	Very high	57 Å²	57	47.1 Å²	47.1	27%	0.266	24%	0.236	S	C	.	.			trans	-90.5	-32.4	-179.7	-40.2	-167.5	135.5	0	0	113.3	R124 T136 Q138 V146	R124-E144 IonicContact NE-OE2 2.67Å; R124-E144 PolarHBondContact NE-OE2 2.94Å; T136-E144 HydrophobicContact CG2-CB 4.32Å; T136-E144 HydrophobicContact CG2-CG 4.49Å; Q138-E144 HydrophobicContact CG-CG 3.95Å; Q138-E144 PolarHBondContact NE2-OE1 2.9Å; E144-V146 PolarHBondContact O-N 3.21Å
145	V	96	Very high	96	Very high	41 Å²	41	45.9 Å²	45.9	25%	0.248	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-79.1	123.2	-177.3	-177.8	0	0	0	0	109.6	Q143 L174	Q143-V145 VanDerWaalsContact NE2-CB 3.3Å; Q143-V145 PolarHBondContact NE2-O 3.42Å; V145-L174 HydrophobicContact CB-CD1 4.42Å; V145-L174 HydrophobicContact CG1-CD1 3.84Å; V145-L174 HydrophobicContact CG2-CD1 3.88Å
146	V	96.8	Very high	96	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.5	174.3	-175.1	0	0	0	0	109.4	S122 Y123 W137 E144 K158	S122-V146 CarbonylContact C-O 3.55Å; S122-V146 WeakPolarHBondContact CA-O 3.5Å; S122-V146 WeakPolarHBondContact CB-O 3.27Å; Y123-V146 HydrophobicContact CD1-CB 4.32Å; Y123-V146 HydrophobicContact CD1-CG1 4.46Å; Y123-V146 HydrophobicContact CD2-CB 4.05Å; Y123-V146 HydrophobicContact CD2-CG2 4.45Å; Y123-V146 HydrophobicContact CE1-CB 4.02Å; Y123-V146 HydrophobicContact CE1-CG1 3.7Å; Y123-V146 HydrophobicContact CE2-CB 3.74Å; Y123-V146 HydrophobicContact CE2-CG1 3.81Å; Y123-V146 HydrophobicContact CE2-CG2 4.09Å; Y123-V146 HydrophobicContact CG-CB 4.33Å; Y123-V146 PolarHBondContact N-O 2.93Å; Y123-V146 PolarHBondContact O-N 3Å; Y123-V146 VanDerWaalsContact OH-CG1 3.3Å; Y123-V146 WeakPolarHBondContact OH-CG1 3.34Å; W137-V146 HydrophobicContact CE3-CG2 3.96Å; W137-V146 HydrophobicContact CH2-CG2 4.47Å; W137-V146 HydrophobicContact CZ3-CG2 3.52Å; E144-V146 PolarHBondContact O-N 3.21Å; V146-K158 HydrophobicContact CG1-CB 4.08Å; V146-K158 HydrophobicContact CG1-CD 3.83Å; V146-K158 HydrophobicContact CG1-CG 3.63Å
147	S	96.3	Very high	96	Very high	45 Å²	45	44.4 Å²	44.4	32%	0.315	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	125.5	170.2	-65.4	0	0	0	0	110.5	N501	S147-N501 WeakPolarHBondContact CB-ND2 3.49Å
148	G	95.9	Very high	95.9	Very high	7 Å²	7	45.2 Å²	45.2	7%	0.072	23%	0.227	C	C	.	.			trans	-102.1	-135.8	179.8	0	0	0	0	0	112.7	R121	R121-G148 PolarHBondContact O-N 2.94Å
149	N	97.4	Very high	95.8	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.216	C	C	.	.			trans	-87.1	153.1	-170	-59.1	88.1	0	0	0	113.5	T107 Q108 F119 V120 R121 E154	T107-N149 WeakPolarHBondContact CB-OD1 3.4Å; T107-N149 PolarHBondContact O-ND2 2.71Å; T107-N149 PolarHBondContact OG1-OD1 3.16Å; Q108-N149 WeakPolarHBondContact CA-ND2 3.25Å; Q108-N149 PolarHBondContact N-OD1 3.05Å; F119-N149 HydrophobicContact CB-CB 4.26Å; F119-N149 HydrophobicContact CD2-CB 4.17Å; F119-N149 WeakPolarHBondContact CD2-O 3.28Å; F119-N149 VanDerWaalsContact CE2-O 3.28Å; F119-N149 WeakPolarHBondContact CE2-O 3.27Å; V120-N149 PolarHBondContact O-N 2.96Å; R121-N149 WeakPolarHBondContact CA-O 3.38Å; N149-E154 PolarHBondContact ND2-O 2.77Å
150	E	95.9	Very high	95.9	Very high	170 Å²	170	42.5 Å²	42.5	79%	0.794	22%	0.215	S	C	*	.	S	Bend	trans	-106.3	-11.6	171.5	-62.2	-170.1	167.1	0	0	113.1	F119	F119-E150 VanDerWaalsContact CE2-C 3.44Å; F119-E150 WeakPolarHBondContact CE2-O 3.47Å; F119-E150 WeakPolarHBondContact CZ-O 3.35Å
151	N	94.9	Very high	95.9	Very high	27 Å²	27	42.9 Å²	42.9	14%	0.144	22%	0.224	C	C	.	.	S	Bend	trans	-149.2	-176.8	179.9	60.4	61.1	0	0	0	110.5	F119 Y153 E154	F119-N151 WeakPolarHBondContact CB-O 3.08Å; N151-Y153 HydrophobicContact CB-CD1 4.3Å; N151-Y153 HydrophobicContact CB-CE1 3.92Å; N151-Y153 PolarHBondContact OD1-N 3.02Å; N151-Y153 VanDerWaalsContact OD1-N 3.11Å; N151-E154 WeakPolarHBondContact ND2-CG 3.46Å; N151-E154 PolarHBondContact ND2-OE2 3.15Å; N151-E154 WeakPolarHBondContact OD1-CB 3.37Å; N151-E154 PolarHBondContact OD1-N 3.17Å
152	T	95.1	Very high	96	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.086	21%	0.207	C	C	.	.	S	Bend	trans	-91	-9.7	-173.1	57.5	0	0	0	0	115.4	G109 R110 F119 R184	G109-T152 CarbonylContact C-O 3.56Å; G109-T152 VanDerWaalsContact C-O 3.28Å; G109-T152 VanDerWaalsContact O-O 3.11Å; R110-T152 VanDerWaalsContact O-CB 3.29Å; R110-T152 WeakPolarHBondContact O-CB 3.3Å; R110-T152 WeakPolarHBondContact O-CG2 3.45Å; F119-T152 HydrophobicContact CD1-CG2 3.89Å; T152-R184 PolarHBondContact O-NH2 2.84Å
153	Y	91.3	Very high	96.1	Very high	113 Å²	113	37.1 Å²	37.1	44%	0.443	19%	0.193	S	C	.	.	S	Bend	trans	-127.1	-23	-166.2	59.8	-92.7	0	0	0	114.9	Q108 N151	Q108-Y153 PolarHBondContact NE2-O 3.24Å; N151-Y153 HydrophobicContact CB-CD1 4.3Å; N151-Y153 HydrophobicContact CB-CE1 3.92Å; N151-Y153 PolarHBondContact OD1-N 3.02Å; N151-Y153 VanDerWaalsContact OD1-N 3.11Å
154	E	95	Very high	96.2	Very high	48 Å²	48	33.3 Å²	33.3	22%	0.224	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-78.5	139.5	177	-66.6	178.2	171.7	0	0	111.2	N149 N151 N497	N149-E154 PolarHBondContact ND2-O 2.77Å; N151-E154 WeakPolarHBondContact ND2-CG 3.46Å; N151-E154 PolarHBondContact ND2-OE2 3.15Å; N151-E154 WeakPolarHBondContact OD1-CB 3.37Å; N151-E154 PolarHBondContact OD1-N 3.17Å; E154-N497 HydrophobicContact CG-CB 4.17Å
155	I	97.1	Very high	96.3	Very high	12 Å²	12	31 Å²	31	6%	0.062	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.8	174.8	-61.7	166.9	0	0	0	107.7	L69 Q108 L157 P494 V499	L69-I155 HydrophobicContact CD1-CG1 4.42Å; L69-I155 HydrophobicContact CD1-CG2 4.4Å; L69-I155 HydrophobicContact CD2-CD1 4.08Å; L69-I155 HydrophobicContact CD2-CG1 4.35Å; L69-I155 HydrophobicContact CD2-CG2 4.03Å; L69-I155 HydrophobicContact CG-CD1 4.44Å; L69-I155 HydrophobicContact CG-CG1 4.45Å; Q108-I155 HydrophobicContact CG-CG1 4.28Å; I155-L157 HydrophobicContact CG2-CD2 4.02Å; I155-L157 HydrophobicContact CG2-CG 4.39Å; I155-P494 HydrophobicContact CD1-CB 4.14Å; I155-P494 HydrophobicContact CD1-CG 4.03Å; I155-V499 PolarHBondContact O-N 2.6Å
156	V	97.9	Very high	96.5	Very high	8 Å²	8	29.1 Å²	29.1	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.7	172.7	177.1	0	0	0	0	108.5	G106 T107 V499 N501	G106-V156 CarbonylContact C-O 3.52Å; G106-V156 WeakPolarHBondContact CA-O 3.35Å; T107-V156 PolarHBondContact N-O 3.13Å; T107-V156 PolarHBondContact O-N 3.44Å; V156-V499 WeakPolarHBondContact CA-O 3.47Å; V156-N501 HydrophobicContact CG1-CB 4.04Å
157	L	97.9	Very high	96.5	Very high	24 Å²	24	31.3 Å²	31.3	13%	0.126	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.6	173.3	-63	-178.6	0	0	0	110.2	V105 I155 Y188 V498 V499 I500 N501	V105-L157 WeakPolarHBondContact O-CA 3.27Å; I155-L157 HydrophobicContact CG2-CD2 4.02Å; I155-L157 HydrophobicContact CG2-CG 4.39Å; L157-Y188 HydrophobicContact CD2-CD2 4.45Å; L157-Y188 HydrophobicContact CD2-CE2 3.66Å; L157-V498 HydrophobicContact CD1-CG1 3.44Å; L157-V498 VanDerWaalsContact CD1-CG1 3.44Å; L157-V498 HydrophobicContact CG-CG1 3.77Å; L157-V499 PolarHBondContact N-O 3.33Å; L157-I500 HydrophobicContact CB-CG1 4.44Å; L157-I500 HydrophobicContact CD1-CG1 4.38Å; L157-N501 PolarHBondContact O-N 2.8Å
158	K	97.4	Very high	96.6	Very high	20 Å²	20	30.1 Å²	30.1	9%	0.087	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.2	171.6	177	65.8	175.7	179	0	109.8	L104 V105 V146 L160	L104-K158 VanDerWaalsContact CA-O 3.25Å; L104-K158 WeakPolarHBondContact CA-O 3.19Å; L104-K158 WeakPolarHBondContact CB-O 3.4Å; V105-K158 HydrophobicContact CG2-CB 3.97Å; V105-K158 PolarHBondContact N-O 2.83Å; V105-K158 VanDerWaalsContact N-O 3.1Å; V105-K158 PolarHBondContact O-N 2.86Å; V146-K158 HydrophobicContact CG1-CB 4.08Å; V146-K158 HydrophobicContact CG1-CD 3.83Å; V146-K158 HydrophobicContact CG1-CG 3.63Å; K158-L160 HydrophobicContact CG-CD2 4.28Å; K158-L160 PolarHBondContact O-N 2.93Å
159	D	95.8	Very high	96.8	Very high	38 Å²	38	29.9 Å²	29.9	20%	0.203	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	125.9	163.1	-83.8	-65.6	0	0	0	110.1	R37 G161 N502	R37-D159 IonicContact CZ-OD1 3.8Å; R37-D159 IonicContact NH1-OD1 3.79Å; R37-D159 PolarHBondContact NH1-OD1 3.49Å; R37-D159 IonicContact NH2-OD1 3.28Å; R37-D159 PolarHBondContact NH2-OD1 3.02Å; R37-D159 IonicContact NH2-OD2 3.72Å; D159-G161 PolarHBondContact O-N 2.89Å; D159-N502 WeakPolarHBondContact CB-OD1 3.47Å; D159-N502 PolarHBondContact OD2-ND2 2.75Å
160	L	97.3	Very high	96.8	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	95.2	173	-58.2	-177.3	0	0	0	107.8	V102 A103 V105 L125 W137 K158 P162 P163 I164	V102-L160 HydrophobicContact CG1-CD1 4Å; A103-L160 WeakPolarHBondContact O-CB 3.49Å; A103-L160 PolarHBondContact O-N 2.88Å; V105-L160 HydrophobicContact CG1-CD1 4.26Å; V105-L160 HydrophobicContact CG2-CD2 4.38Å; L125-L160 HydrophobicContact CD1-CD2 3.59Å; W137-L160 HydrophobicContact CD2-CD2 4.26Å; W137-L160 HydrophobicContact CH2-CD2 4.3Å; W137-L160 HydrophobicContact CZ2-CB 4.23Å; W137-L160 HydrophobicContact CZ2-CD2 3.89Å; K158-L160 HydrophobicContact CG-CD2 4.28Å; K158-L160 PolarHBondContact O-N 2.93Å; L160-P162 CarbonylContact C-O 3.56Å; L160-P162 VanDerWaalsContact C-O 3.25Å; L160-P162 CarbonylContact O-C 3.56Å; L160-P163 WeakPolarHBondContact O-CA 3.37Å; L160-I164 HydrophobicContact CD1-CD1 4.14Å; L160-I164 HydrophobicContact CD1-CG1 4.1Å
161	G	95.2	Very high	97	Very high	23 Å²	23	23.6 Å²	23.6	24%	0.237	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102.4	168.3	0	0	0	0	0	109.3	D139 R140 D159	D139-G161 CarbonylContact C-O 3.38Å; D139-G161 WeakPolarHBondContact CA-O 3.2Å; D139-G161 WeakPolarHBondContact CB-O 3.47Å; R140-G161 WeakPolarHBondContact CG-O 3.46Å; R140-G161 PolarHBondContact N-O 3.4Å; D159-G161 PolarHBondContact O-N 2.89Å
162	P	96.6	Very high	97.1	Very high	13 Å²	13	22.9 Å²	22.9	8%	0.084	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-78.9	156.9	3.9	34.6	-37.6	0	0	0	113.9	W137 Q138 L160 T220	W137-P162 PolarHBondContact NE1-O 3.47Å; Q138-P162 WeakPolarHBondContact O-CD 3.41Å; L160-P162 CarbonylContact C-O 3.56Å; L160-P162 VanDerWaalsContact C-O 3.25Å; L160-P162 CarbonylContact O-C 3.56Å; P162-T220 HydrophobicContact CB-CG2 3.89Å; P162-T220 HydrophobicContact CG-CG2 3.64Å
163	P	97.3	Very high	97.2	Very high	25 Å²	25	22.3 Å²	22.3	16%	0.162	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	161.4	171	27.8	-32.4	0	0	0	110.5	F101 L160 D239	F101-P163 HydrophobicContact CD1-CB 4.26Å; F101-P163 HydrophobicContact CE1-CB 3.58Å; F101-P163 HydrophobicContact CE1-CG 3.83Å; F101-P163 HydrophobicContact CE2-CB 4.03Å; F101-P163 HydrophobicContact CE2-CG 3.76Å; F101-P163 HydrophobicContact CZ-CB 3.47Å; F101-P163 VanDerWaalsContact CZ-CB 3.47Å; F101-P163 HydrophobicContact CZ-CG 3.21Å; L160-P163 WeakPolarHBondContact O-CA 3.37Å; P163-D239 HydrophobicContact CG-CB 4.34Å; P163-D239 WeakPolarHBondContact CG-O 3.39Å
164	I	97.8	Very high	97.3	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140	-178.3	61.7	178.9	0	0	0	111.5	V102 Y127 W137 L160 A166 V169	V102-I164 HydrophobicContact CB-CD1 4.32Å; V102-I164 HydrophobicContact CB-CG1 3.74Å; V102-I164 HydrophobicContact CG1-CG1 4.5Å; V102-I164 HydrophobicContact CG2-CG1 4.37Å; V102-I164 PolarHBondContact N-O 3.31Å; V102-I164 PolarHBondContact O-N 2.84Å; Y127-I164 HydrophobicContact CD1-CB 4.39Å; Y127-I164 HydrophobicContact CD1-CD1 4.06Å; Y127-I164 HydrophobicContact CD1-CG2 3.98Å; Y127-I164 HydrophobicContact CD2-CB 4.21Å; Y127-I164 HydrophobicContact CE1-CB 4.41Å; Y127-I164 HydrophobicContact CE1-CG2 3.73Å; Y127-I164 HydrophobicContact CE2-CB 4.22Å; Y127-I164 HydrophobicContact CE2-CG2 4.31Å; Y127-I164 HydrophobicContact CG-CB 4.29Å; Y127-I164 HydrophobicContact CG-CD1 3.89Å; Y127-I164 HydrophobicContact CG-CG2 4.38Å; W137-I164 HydrophobicContact CG-CG2 4.32Å; L160-I164 HydrophobicContact CD1-CD1 4.14Å; L160-I164 HydrophobicContact CD1-CG1 4.1Å; I164-A166 HydrophobicContact CD1-CB 4.3Å; I164-A166 HydrophobicContact CG1-CB 4.4Å; I164-V169 HydrophobicContact CD1-CG2 4.29Å
165	V	98.4	Very high	97.1	Very high	10 Å²	10	15.7 Å²	15.7	6%	0.061	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	110.6	166	179.1	0	0	0	0	108.4	L99 H100 F101 R129 W192 L234	L99-V165 HydrophobicContact CB-CG1 4.34Å; L99-V165 HydrophobicContact CD2-CG1 4.42Å; H100-V165 WeakPolarHBondContact O-CA 3.38Å; F101-V165 HydrophobicContact CD2-CG2 4.11Å; R129-V165 VanDerWaalsContact CG-O 3.26Å; R129-V165 WeakPolarHBondContact CG-O 3.48Å; R129-V165 PolarHBondContact NH1-O 2.91Å; V165-W192 HydrophobicContact CG1-CB 4.28Å; V165-W192 HydrophobicContact CG1-CD2 4.19Å; V165-W192 HydrophobicContact CG1-CG 3.79Å; V165-W192 HydrophobicContact CG2-CD2 4Å; V165-W192 HydrophobicContact CG2-CE3 4.25Å; V165-W192 HydrophobicContact CG2-CG 4.44Å; V165-W192 HydrophobicContact CG2-CH2 4.46Å; V165-W192 HydrophobicContact CG2-CZ2 4.25Å; V165-W192 HydrophobicContact CG2-CZ3 4.46Å; V165-L234 HydrophobicContact CB-CD1 3.75Å; V165-L234 HydrophobicContact CG1-CD1 4Å; V165-L234 HydrophobicContact CG2-CD1 4.08Å
166	A	98.3	Very high	96.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.6	-170.6	0	0	0	0	0	112.6	H100 Y127 I164 V169	H100-A166 PolarHBondContact N-O 3.2Å; H100-A166 PolarHBondContact O-N 2.82Å; Y127-A166 HydrophobicContact CD2-CB 4.03Å; Y127-A166 HydrophobicContact CG-CB 4.33Å; I164-A166 HydrophobicContact CD1-CB 4.3Å; I164-A166 HydrophobicContact CG1-CB 4.4Å; A166-V169 HydrophobicContact CB-CG2 4.08Å
167	R	98.2	Very high	96	Very high	47 Å²	47	26.1 Å²	26.1	18%	0.177	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-42	165.1	-176.4	179.9	74.5	93.2	-7.8	110.7	D95 L96 H97 L99 S128	D95-R167 IonicContact OD1-CZ 3.12Å; D95-R167 IonicContact OD1-NH1 3.94Å; D95-R167 PolarHBondContact OD1-NH1 2.94Å; D95-R167 IonicContact OD2-CZ 2.74Å; D95-R167 IonicContact OD2-NH1 3.44Å; D95-R167 PolarHBondContact OD2-NH1 3.4Å; L96-R167 VanDerWaalsContact CB-O 3.29Å; L96-R167 WeakPolarHBondContact CB-O 3.4Å; L96-R167 WeakPolarHBondContact CG-O 3.13Å; L96-R167 PolarHBondContact N-O 3.32Å; H97-R167 WeakPolarHBondContact O-CD 3.39Å; L99-R167 HydrophobicContact CD2-CB 4.23Å; S128-R167 PolarHBondContact O-N 3.4Å
168	M	98.8	Very high	95.6	Very high	21 Å²	21	29.7 Å²	29.7	10%	0.103	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.6	179.4	-64.4	174.3	154.7	0	0	110.7	I94 D95 Y127 S128 G131 W134	I94-M168 VanDerWaalsContact O-CA 3.26Å; I94-M168 WeakPolarHBondContact O-CA 3.42Å; D95-M168 HydrophobicContact CB-CE 4.17Å; D95-M168 HydrophobicContact CB-CG 4.23Å; D95-M168 WeakPolarHBondContact OD2-CE 3.31Å; Y127-M168 CarbonylContact C-O 3.5Å; Y127-M168 VanDerWaalsContact CA-O 3.26Å; Y127-M168 WeakPolarHBondContact CA-O 3.03Å; S128-M168 PolarHBondContact N-O 3.1Å; S128-M168 PolarHBondContact O-N 2.9Å; G131-M168 VanDerWaalsContact CA-SD 3.55Å; W134-M168 HydrophobicContact CH2-CB 3.62Å; W134-M168 HydrophobicContact CH2-SD 4.27Å; W134-M168 HydrophobicContact CZ2-CB 4.28Å; W134-M168 HydrophobicContact CZ2-SD 4.04Å; W134-M168 HydrophobicContact CZ3-CB 4.25Å
169	V	98.9	Very high	95.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.2	176.9	-177.7	0	0	0	0	109.5	Q93 I94 L125 R126 I164 A166 F171 L187	Q93-V169 WeakPolarHBondContact CA-O 3.37Å; I94-V169 PolarHBondContact N-O 2.79Å; I94-V169 PolarHBondContact O-N 2.68Å; L125-V169 HydrophobicContact CD2-CG1 4.29Å; R126-V169 CarbonylContact O-C 3.47Å; I164-V169 HydrophobicContact CD1-CG2 4.29Å; A166-V169 HydrophobicContact CB-CG2 4.08Å; V169-F171 HydrophobicContact CG1-CD2 4.42Å; V169-F171 HydrophobicContact CG1-CE2 3.98Å; V169-L187 HydrophobicContact CB-CD2 3.72Å; V169-L187 HydrophobicContact CG1-CD2 3.99Å; V169-L187 HydrophobicContact CG2-CD2 3.61Å
170	R	98.8	Very high	95	Very high	39 Å²	39	31.7 Å²	31.7	15%	0.147	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.3	175.9	-79.5	178.8	-178.5	172.2	0.1	111.4	Y91 L92 Q93 L125 R126 W134 Y172	Y91-R170 HydrophobicContact CD2-CG 3.8Å; Y91-R170 HydrophobicContact CE2-CG 4.36Å; Y91-R170 HydrophobicContact CG-CG 4.32Å; Y91-R170 PolarHBondContact OH-NH2 2.85Å; L92-R170 CarbonylContact O-C 3.54Å; L92-R170 WeakPolarHBondContact O-CA 3.2Å; Q93-R170 HydrophobicContact CB-CG 3.78Å; Q93-R170 HydrophobicContact CG-CG 3.88Å; L125-R170 WeakPolarHBondContact CA-O 3.36Å; R126-R170 HydrophobicContact CB-CB 4.45Å; R126-R170 PolarHBondContact N-O 2.98Å; R126-R170 PolarHBondContact O-N 2.88Å; W134-R170 HydrophobicContact CE3-CG 4.28Å; W134-R170 HydrophobicContact CH2-CG 3.59Å; W134-R170 HydrophobicContact CZ2-CG 4.49Å; W134-R170 VanDerWaalsContact CZ2-CZ 3.47Å; W134-R170 HydrophobicContact CZ3-CB 3.98Å; W134-R170 HydrophobicContact CZ3-CG 3.48Å; W134-R170 VanDerWaalsContact CZ3-CG 3.48Å; R170-Y172 HydrophobicContact CB-CD2 3.97Å; R170-Y172 HydrophobicContact CB-CE2 3.44Å; R170-Y172 VanDerWaalsContact CB-CE2 3.44Å; R170-Y172 VanDerWaalsContact CD-OH 3.28Å; R170-Y172 WeakPolarHBondContact CD-OH 3.13Å; R170-Y172 HydrophobicContact CG-CE2 4.23Å; R170-Y172 PolarHBondContact NH1-OH 2.81Å
171	F	98.7	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	114.2	171.2	-68	-104.1	0	0	0	108.9	Y91 L92 I94 V105 T107 Y123 L125 V169 P173 V185 L187	Y91-F171 WeakPolarHBondContact CA-O 3.22Å; L92-F171 HydrophobicContact CB-CB 4.47Å; L92-F171 PolarHBondContact N-O 2.84Å; L92-F171 PolarHBondContact O-N 3.3Å; I94-F171 HydrophobicContact CD1-CD2 3.75Å; I94-F171 HydrophobicContact CD1-CE2 3.72Å; V105-F171 HydrophobicContact CB-CE1 3.9Å; V105-F171 HydrophobicContact CB-CZ 3.87Å; V105-F171 HydrophobicContact CG1-CE1 4.08Å; V105-F171 HydrophobicContact CG1-CZ 3.68Å; V105-F171 HydrophobicContact CG2-CE1 4.15Å; T107-F171 HydrophobicContact CG2-CD1 4.37Å; T107-F171 HydrophobicContact CG2-CE1 4.16Å; Y123-F171 HydrophobicContact CD2-CD1 4.05Å; Y123-F171 HydrophobicContact CE2-CD1 4Å; Y123-F171 HydrophobicContact CE2-CE1 4.17Å; L125-F171 HydrophobicContact CD2-CD1 3.53Å; L125-F171 HydrophobicContact CD2-CD2 4.26Å; L125-F171 HydrophobicContact CD2-CE1 3.6Å; L125-F171 HydrophobicContact CD2-CE2 4.3Å; L125-F171 HydrophobicContact CD2-CG 3.89Å; L125-F171 HydrophobicContact CD2-CZ 3.99Å; V169-F171 HydrophobicContact CG1-CD2 4.42Å; V169-F171 HydrophobicContact CG1-CE2 3.98Å; F171-P173 VanDerWaalsContact O-CD 3.26Å; F171-P173 WeakPolarHBondContact O-CD 3.32Å; F171-V185 HydrophobicContact CD1-CG1 3.86Å; F171-V185 HydrophobicContact CD2-CG1 4.3Å; F171-V185 HydrophobicContact CD2-CG2 4.33Å; F171-V185 HydrophobicContact CE1-CB 4.17Å; F171-V185 HydrophobicContact CE1-CG1 3.93Å; F171-V185 HydrophobicContact CE2-CB 4.22Å; F171-V185 HydrophobicContact CE2-CG1 4.39Å; F171-V185 HydrophobicContact CE2-CG2 4.05Å; F171-V185 HydrophobicContact CG-CG1 4.05Å; F171-V185 HydrophobicContact CZ-CB 4Å; F171-V185 HydrophobicContact CZ-CG1 4.2Å; F171-V185 HydrophobicContact CZ-CG2 4.31Å; F171-L187 HydrophobicContact CE2-CD1 4.49Å; F171-L187 HydrophobicContact CE2-CG 4.48Å
172	Y	97.8	Very high	95	Very high	12 Å²	12	30.6 Å²	30.6	5%	0.047	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	98.3	177.3	-74.9	-95.4	0	0	0	109.3	E88 E90 Y91 Y123 R124 R126 R170	E88-Y172 HydrophobicContact CB-CD1 4.17Å; E90-Y172 VanDerWaalsContact O-CD1 3.3Å; E90-Y172 WeakPolarHBondContact O-CD1 3.48Å; Y91-Y172 AromaticContact CD1-CE1 3.69Å; Y91-Y172 HydrophobicContact CD1-CE1 3.69Å; Y91-Y172 AromaticContact CD1-CZ 3.87Å; Y91-Y172 HydrophobicContact CG-CE1 4.03Å; Y91-Y172 AromaticContact CG-CZ 3.98Å; Y123-Y172 CarbonylContact C-O 3.28Å; Y123-Y172 WeakPolarHBondContact CA-O 3.19Å; Y123-Y172 VanDerWaalsContact CB-O 3.28Å; Y123-Y172 WeakPolarHBondContact CB-O 3.43Å; R124-Y172 PolarHBondContact N-O 3.35Å; R124-Y172 PolarHBondContact O-N 3.35Å; R126-Y172 HydrophobicContact CB-CD2 4.38Å; R126-Y172 HydrophobicContact CB-CE2 3.86Å; R126-Y172 HydrophobicContact CG-CD2 3.89Å; R126-Y172 HydrophobicContact CG-CE2 3.6Å; R170-Y172 HydrophobicContact CB-CD2 3.97Å; R170-Y172 HydrophobicContact CB-CE2 3.44Å; R170-Y172 VanDerWaalsContact CB-CE2 3.44Å; R170-Y172 VanDerWaalsContact CD-OH 3.28Å; R170-Y172 WeakPolarHBondContact CD-OH 3.13Å; R170-Y172 HydrophobicContact CG-CE2 4.23Å; R170-Y172 PolarHBondContact NH1-OH 2.81Å
173	P	96.8	Very high	95	Very high	2 Å²	2	30 Å²	30	1%	0.013	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	139.1	174.6	25.8	-36.6	0	0	0	111.4	W78 P80 V84 E90 V120 F171 V181 L183	W78-P173 HydrophobicContact CH2-CG 4.25Å; W78-P173 HydrophobicContact CZ3-CG 4.4Å; P80-P173 HydrophobicContact CG-CG 4.44Å; V84-P173 WeakPolarHBondContact CG1-O 3.4Å; V84-P173 HydrophobicContact CG2-CG 4.18Å; E90-P173 HydrophobicContact CB-CG 4.31Å; E90-P173 WeakPolarHBondContact O-CD 3.28Å; V120-P173 HydrophobicContact CG1-CB 4.07Å; V120-P173 HydrophobicContact CG2-CB 3.65Å; F171-P173 VanDerWaalsContact O-CD 3.26Å; F171-P173 WeakPolarHBondContact O-CD 3.32Å; P173-V181 HydrophobicContact CB-CG2 3.86Å; P173-V181 HydrophobicContact CG-CG2 4.21Å; P173-L183 HydrophobicContact CB-CD1 4Å; P173-L183 HydrophobicContact CG-CD1 4.34Å
174	L	93.9	Very high	95.1	Very high	16 Å²	16	29.4 Å²	29.4	8%	0.084	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	149.5	173.5	-55.5	-179.2	0	0	0	110.6	E88 S122 R124 V145	E88-L174 HydrophobicContact CG-CD2 4.13Å; S122-L174 WeakPolarHBondContact O-CA 3.34Å; S122-L174 WeakPolarHBondContact O-CB 3.5Å; S122-L174 PolarHBondContact O-N 3.35Å; R124-L174 HydrophobicContact CG-CD1 4.04Å; R124-L174 VanDerWaalsContact NH1-CD2 3.34Å; V145-L174 HydrophobicContact CB-CD1 4.42Å; V145-L174 HydrophobicContact CG1-CD1 3.84Å; V145-L174 HydrophobicContact CG2-CD1 3.88Å
175	A	90.3	Very high	95.1	Very high	6 Å²	6	29.2 Å²	29.2	5%	0.05	15%	0.147	C	C	.	.			trans	-141.9	138.9	171.8	0	0	0	0	0	111.1	V84 R177 M179	V84-A175 HydrophobicContact CB-CB 4.27Å; V84-A175 HydrophobicContact CG1-CB 4.02Å; A175-R177 VanDerWaalsContact C-N 3.28Å; A175-R177 VanDerWaalsContact CB-O 3.27Å; A175-R177 WeakPolarHBondContact CB-O 3.47Å; A175-M179 HydrophobicContact CB-CG 3.51Å; A175-M179 HydrophobicContact CB-SD 3.79Å
176	D	86.2	Confident	95.1	Very high	109 Å²	109	28.8 Å²	28.8	58%	0.583	14%	0.144	S	C	*	.	S	Bend	trans	-75.4	-18.6	177	62.8	-40.1	0	0	0	112.9
177	R	86.7	Confident	95.2	Very high	131 Å²	131	28.8 Å²	28.8	49%	0.494	14%	0.144	S	C	.	.	S	Bend	trans	-145.6	163.7	178.5	58.8	-174.9	177	-104.5	12.7	109.4	A175 M179	A175-R177 VanDerWaalsContact C-N 3.28Å; A175-R177 VanDerWaalsContact CB-O 3.27Å; A175-R177 WeakPolarHBondContact CB-O 3.47Å; R177-M179 PolarHBondContact O-N 3.01Å
178	V	88	Confident	95.2	Very high	99 Å²	99	27.8 Å²	27.8	60%	0.6	14%	0.141	S	C	*	.	S	Bend	trans	-61.2	112.4	178.7	-175.4	0	0	0	0	108.7	P83 V84 F85	P83-V178 HydrophobicContact CB-CG1 3.58Å; P83-V178 HydrophobicContact CG-CG1 4.34Å; V84-V178 WeakPolarHBondContact O-CA 3.42Å; F85-V178 HydrophobicContact CB-CG2 4.07Å; F85-V178 HydrophobicContact CD2-CB 4.34Å; F85-V178 HydrophobicContact CD2-CG2 3.41Å; F85-V178 VanDerWaalsContact CD2-CG2 3.41Å; F85-V178 HydrophobicContact CE2-CG2 4.06Å; F85-V178 HydrophobicContact CG-CG2 3.77Å
179	M	88.6	Confident	95.1	Very high	39 Å²	39	26.8 Å²	26.8	19%	0.192	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-148.2	148.7	178.6	63.5	-172.1	-74.7	0	0	111.9	V84 A175 R177 V181	V84-M179 PolarHBondContact N-O 3.04Å; V84-M179 PolarHBondContact O-N 3.08Å; V84-M179 VanDerWaalsContact O-N 3.16Å; A175-M179 HydrophobicContact CB-CG 3.51Å; A175-M179 HydrophobicContact CB-SD 3.79Å; R177-M179 PolarHBondContact O-N 3.01Å; M179-V181 HydrophobicContact CE-CG1 4.04Å; M179-V181 HydrophobicContact CG-CG1 3.75Å; M179-V181 HydrophobicContact SD-CG1 4.35Å
180	S	92.6	Very high	95.1	Very high	60 Å²	60	28.1 Å²	28.1	42%	0.42	14%	0.144	S	C	.	.			trans	-76.4	130.4	168	-58.7	0	0	0	0	108.3
181	V	95.4	Very high	95	Very high	4 Å²	4	29 Å²	29	2%	0.024	15%	0.154	C	C	.	.			trans	-128.6	152.6	-178.1	-57.8	0	0	0	0	108.9	P80 V84 V120 P173 M179	P80-V181 WeakPolarHBondContact CD-O 3.4Å; P80-V181 HydrophobicContact CG-CG2 4.18Å; V84-V181 HydrophobicContact CB-CG2 4.11Å; V84-V181 HydrophobicContact CG2-CG2 3.5Å; V84-V181 VanDerWaalsContact CG2-CG2 3.5Å; V120-V181 HydrophobicContact CG2-CB 3.63Å; V120-V181 HydrophobicContact CG2-CG1 4.29Å; V120-V181 HydrophobicContact CG2-CG2 3.94Å; P173-V181 HydrophobicContact CB-CG2 3.86Å; P173-V181 HydrophobicContact CG-CG2 4.21Å; M179-V181 HydrophobicContact CE-CG1 4.04Å; M179-V181 HydrophobicContact CG-CG1 3.75Å; M179-V181 HydrophobicContact SD-CG1 4.35Å
182	C	97.1	Very high	94.9	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.034	16%	0.156	C	C	.	.			trans	-141.4	150.7	175.2	-59.2	0	0	0	0	109.1	A77 W78 C79 R110 E118	A77-C182 HydrophobicContact CB-CB 3.79Å; W78-C182 CarbonylContact O-C 3.56Å; W78-C182 WeakPolarHBondContact O-CA 3.23Å; W78-C182 WeakPolarHBondContact O-CB 3.28Å; C79-C182 HydrophobicContact CB-CB 4.15Å; C79-C182 WeakPolarHBondContact CB-SG 2.87Å; C79-C182 WeakPolarHBondContact SG-CB 3.4Å; C79-C182 CovalentContact SG-SG 2.04Å; C79-C182 PolarHBondContact SG-SG 2.8Å; R110-C182 HydrophobicContact CB-CB 3.67Å; E118-C182 HydrophobicContact CB-CB 4.05Å
183	L	97.3	Very high	94.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-134.2	138.7	-175.4	-86.9	164.6	0	0	0	110.8	G67 W78 T107 V120 P173 V185	G67-L183 WeakPolarHBondContact CA-O 3.41Å; W78-L183 HydrophobicContact CE3-CB 3.91Å; W78-L183 HydrophobicContact CE3-CD1 4.41Å; W78-L183 HydrophobicContact CZ3-CB 4.24Å; W78-L183 HydrophobicContact CZ3-CD1 3.89Å; W78-L183 PolarHBondContact N-O 3.32Å; W78-L183 VanDerWaalsContact N-O 3.17Å; W78-L183 PolarHBondContact O-N 3.23Å; T107-L183 HydrophobicContact CG2-CD2 4.32Å; V120-L183 HydrophobicContact CB-CD1 4.36Å; V120-L183 HydrophobicContact CB-CD2 3.78Å; V120-L183 HydrophobicContact CB-CG 3.98Å; V120-L183 HydrophobicContact CG1-CD2 4.39Å; V120-L183 HydrophobicContact CG2-CD1 3.78Å; V120-L183 HydrophobicContact CG2-CD2 3.88Å; V120-L183 HydrophobicContact CG2-CG 3.48Å; V120-L183 VanDerWaalsContact CG2-CG 3.48Å; P173-L183 HydrophobicContact CB-CD1 4Å; P173-L183 HydrophobicContact CG-CD1 4.34Å; L183-V185 HydrophobicContact CB-CG1 4.42Å; L183-V185 HydrophobicContact CD2-CG1 4.34Å
184	R	98.4	Very high	94.5	Very high	11 Å²	11	35 Å²	35	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.2	156	-70	178.8	-71.2	158.3	4.3	108.1	G67 R68 T71 G76 A77 T107 Q108 G109 T152	G67-R184 CarbonylContact O-C 3.49Å; G67-R184 VanDerWaalsContact O-CA 3.26Å; G67-R184 WeakPolarHBondContact O-CA 3.28Å; R68-R184 WeakPolarHBondContact O-CB 3.29Å; R68-R184 VanDerWaalsContact O-CD 3.3Å; R68-R184 WeakPolarHBondContact O-CD 3.44Å; R68-R184 WeakPolarHBondContact O-CG 3.36Å; T71-R184 VanDerWaalsContact O-CD 3.26Å; T71-R184 WeakPolarHBondContact O-CD 3.5Å; T71-R184 PolarHBondContact O-NH1 3.49Å; G76-R184 VanDerWaalsContact O-CD 3.28Å; G76-R184 WeakPolarHBondContact O-CD 3.32Å; G76-R184 PolarHBondContact O-NE 3.23Å; A77-R184 HydrophobicContact CB-CG 3.93Å; T107-R184 CarbonylContact C-O 3.33Å; T107-R184 WeakPolarHBondContact CA-O 3.49Å; Q108-R184 HydrophobicContact CB-CB 4.15Å; Q108-R184 VanDerWaalsContact CD-CZ 3.42Å; Q108-R184 VanDerWaalsContact CG-NH2 3.3Å; Q108-R184 PolarHBondContact N-O 3.46Å; Q108-R184 PolarHBondContact O-N 2.85Å; Q108-R184 VanDerWaalsContact OE1-NH1 3.1Å; G109-R184 PolarHBondContact O-NE 3.25Å; G109-R184 PolarHBondContact O-NH2 3.29Å; T152-R184 PolarHBondContact O-NH2 2.84Å
185	V	98.6	Very high	94.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	156.2	-172.5	-53.4	0	0	0	0	112.5	M42 G67 L69 L92 I94 G106 T107 F171 L183	M42-V185 WeakPolarHBondContact CB-O 3.46Å; M42-V185 HydrophobicContact CE-CG2 3.89Å; M42-V185 WeakPolarHBondContact CG-O 3.48Å; G67-V185 PolarHBondContact O-N 3.24Å; L69-V185 PolarHBondContact N-O 3.15Å; L69-V185 VanDerWaalsContact N-O 3.1Å; L92-V185 HydrophobicContact CD2-CG1 4.27Å; L92-V185 HydrophobicContact CD2-CG2 3.72Å; I94-V185 HydrophobicContact CD1-CG2 4.01Å; G106-V185 CarbonylContact O-C 3.57Å; G106-V185 WeakPolarHBondContact O-CA 3.24Å; T107-V185 HydrophobicContact CG2-CG1 4.3Å; F171-V185 HydrophobicContact CD1-CG1 3.86Å; F171-V185 HydrophobicContact CD2-CG1 4.3Å; F171-V185 HydrophobicContact CD2-CG2 4.33Å; F171-V185 HydrophobicContact CE1-CB 4.17Å; F171-V185 HydrophobicContact CE1-CG1 3.93Å; F171-V185 HydrophobicContact CE2-CB 4.22Å; F171-V185 HydrophobicContact CE2-CG1 4.39Å; F171-V185 HydrophobicContact CE2-CG2 4.05Å; F171-V185 HydrophobicContact CG-CG1 4.05Å; F171-V185 HydrophobicContact CZ-CB 4Å; F171-V185 HydrophobicContact CZ-CG1 4.2Å; F171-V185 HydrophobicContact CZ-CG2 4.31Å; L183-V185 HydrophobicContact CB-CG1 4.42Å; L183-V185 HydrophobicContact CD2-CG1 4.34Å
186	E	98.7	Very high	94.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.2	165.7	-176.2	58.3	-85.4	0	0	109.1	A39 G41 M42 E43 L69 V105 G106 Y188	A39-E186 HydrophobicContact CB-CG 4.16Å; G41-E186 PolarHBondContact N-OE1 3.15Å; M42-E186 WeakPolarHBondContact CB-OE1 3.32Å; M42-E186 WeakPolarHBondContact CG-OE1 3.2Å; M42-E186 PolarHBondContact N-OE1 2.94Å; M42-E186 VanDerWaalsContact N-OE1 3.07Å; M42-E186 PolarHBondContact N-OE2 2.9Å; E43-E186 WeakPolarHBondContact CB-OE2 3.42Å; E43-E186 PolarHBondContact N-OE2 3.2Å; L69-E186 HydrophobicContact CB-CB 3.86Å; L69-E186 HydrophobicContact CD2-CB 3.65Å; L69-E186 HydrophobicContact CD2-CG 4.47Å; L69-E186 HydrophobicContact CG-CB 4.26Å; V105-E186 CarbonylContact C-O 3.01Å; V105-E186 WeakPolarHBondContact CA-O 3.38Å; G106-E186 PolarHBondContact N-O 3.34Å; G106-E186 PolarHBondContact O-N 3.21Å; E186-Y188 HydrophobicContact CB-CE2 3.74Å; E186-Y188 HydrophobicContact CG-CD2 4.16Å; E186-Y188 HydrophobicContact CG-CE1 3.98Å; E186-Y188 HydrophobicContact CG-CE2 3.56Å; E186-Y188 VanDerWaalsContact CG-CZ 3.45Å
187	L	98.7	Very high	95.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.9	170.7	-61.1	96.3	0	0	0	109	L40 M42 I94 V102 V169 F171	L40-L187 HydrophobicContact CB-CB 4.23Å; L40-L187 WeakPolarHBondContact CB-O 3.42Å; L40-L187 HydrophobicContact CD1-CB 3.83Å; L40-L187 HydrophobicContact CG-CB 4.23Å; L40-L187 WeakPolarHBondContact CG-O 3.41Å; L40-L187 PolarHBondContact N-O 3.3Å; M42-L187 HydrophobicContact CG-CD1 4Å; M42-L187 HydrophobicContact SD-CD1 4.44Å; I94-L187 HydrophobicContact CB-CD1 4.14Å; I94-L187 HydrophobicContact CD1-CD1 4.22Å; I94-L187 HydrophobicContact CG1-CD1 3.98Å; I94-L187 HydrophobicContact CG2-CD1 4.01Å; V102-L187 HydrophobicContact CG1-CB 4.36Å; V102-L187 HydrophobicContact CG1-CD2 4.23Å; V169-L187 HydrophobicContact CB-CD2 3.72Å; V169-L187 HydrophobicContact CG1-CD2 3.99Å; V169-L187 HydrophobicContact CG2-CD2 3.61Å; F171-L187 HydrophobicContact CE2-CD1 4.49Å; F171-L187 HydrophobicContact CE2-CG 4.48Å
188	Y	98.6	Very high	96	Very high	27 Å²	27	26.1 Å²	26.1	11%	0.106	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.8	179.1	-58	-97.3	0	0	0	110.8	Y38 A39 A103 L104 L157 E186	Y38-Y188 CarbonylContact O-C 3.59Å; Y38-Y188 WeakPolarHBondContact O-CA 3.28Å; A39-Y188 HydrophobicContact CB-CD1 4.17Å; A39-Y188 HydrophobicContact CB-CE1 4.01Å; A103-Y188 PolarHBondContact N-O 2.93Å; L104-Y188 HydrophobicContact CB-CD2 4.09Å; L104-Y188 HydrophobicContact CB-CG 4.36Å; L104-Y188 PolarHBondContact N-O 2.91Å; L104-Y188 VanDerWaalsContact N-O 3.11Å; L104-Y188 PolarHBondContact O-N 3.43Å; L157-Y188 HydrophobicContact CD2-CD2 4.45Å; L157-Y188 HydrophobicContact CD2-CE2 3.66Å; E186-Y188 HydrophobicContact CB-CE2 3.74Å; E186-Y188 HydrophobicContact CG-CD2 4.16Å; E186-Y188 HydrophobicContact CG-CE1 3.98Å; E186-Y188 HydrophobicContact CG-CE2 3.56Å; E186-Y188 VanDerWaalsContact CG-CZ 3.45Å
189	G	98.1	Very high	96.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	-151.3	-172.9	0	0	0	0	0	113.6	C36 Y38 F101	C36-G189 WeakPolarHBondContact O-CA 3.13Å; Y38-G189 PolarHBondContact N-O 2.74Å; Y38-G189 PolarHBondContact O-N 3.41Å; F101-G189 CarbonylContact O-C 3.48Å; F101-G189 WeakPolarHBondContact O-CA 3.4Å
190	C	97.2	Very high	97	Very high	28 Å²	28	21.1 Å²	21.1	19%	0.189	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	166.9	170.5	67.4	0	0	0	0	110.4	C36 Y38 H100 F101 W192	C36-C190 HydrophobicContact CB-CB 3.98Å; C36-C190 WeakPolarHBondContact CB-SG 3.05Å; C36-C190 WeakPolarHBondContact SG-CB 3.48Å; C36-C190 PolarHBondContact SG-N 3.31Å; C36-C190 CovalentContact SG-SG 2.03Å; C36-C190 PolarHBondContact SG-SG 3.37Å; Y38-C190 HydrophobicContact CD2-CB 4.43Å; H100-C190 CarbonylContact C-O 3.49Å; H100-C190 VanDerWaalsContact CA-O 3.29Å; H100-C190 WeakPolarHBondContact CA-O 3.29Å; H100-C190 WeakPolarHBondContact CB-O 3.08Å; F101-C190 PolarHBondContact N-O 3.03Å; F101-C190 PolarHBondContact O-N 2.83Å; F101-C190 VanDerWaalsContact O-N 3.08Å; C190-W192 PolarHBondContact O-N 2.75Å
191	V	96.6	Very high	97.3	Very high	59 Å²	59	18.2 Å²	18.2	36%	0.358	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	134.8	176	-179.4	0	0	0	0	110.1	N193	V191-N193 VanDerWaalsContact C-N 3.33Å; V191-N193 WeakPolarHBondContact CG1-OD1 3.48Å; V191-N193 PolarHBondContact O-N 2.94Å
192	W	96.4	Very high	97.4	Very high	11 Å²	11	18.5 Å²	18.5	4%	0.042	10%	0.097	C	C	.	.			trans	-80	79.6	177.8	-174.6	-118.9	0	0	0	111.3	F31 L99 F101 V165 C190 D194 G195 L196 C238	F31-W192 HydrophobicContact CE1-CZ3 4.15Å; F31-W192 HydrophobicContact CE2-CZ3 4.39Å; F31-W192 HydrophobicContact CZ-CZ3 4.01Å; L99-W192 HydrophobicContact CB-CB 3.89Å; L99-W192 HydrophobicContact CB-CG 4.45Å; L99-W192 WeakPolarHBondContact O-CB 3.24Å; L99-W192 PolarHBondContact O-N 2.9Å; F101-W192 HydrophobicContact CB-CE3 3.86Å; F101-W192 HydrophobicContact CB-CZ3 4.38Å; F101-W192 AromaticContact CD2-CE3 3.88Å; F101-W192 HydrophobicContact CD2-CE3 3.88Å; F101-W192 HydrophobicContact CD2-CH2 4.43Å; F101-W192 AromaticContact CD2-CZ3 3.57Å; F101-W192 HydrophobicContact CD2-CZ3 3.57Å; F101-W192 HydrophobicContact CE2-CZ3 4.23Å; F101-W192 HydrophobicContact CG-CE3 4.32Å; F101-W192 HydrophobicContact CG-CZ3 4.36Å; V165-W192 HydrophobicContact CG1-CB 4.28Å; V165-W192 HydrophobicContact CG1-CD2 4.19Å; V165-W192 HydrophobicContact CG1-CG 3.79Å; V165-W192 HydrophobicContact CG2-CD2 4Å; V165-W192 HydrophobicContact CG2-CE3 4.25Å; V165-W192 HydrophobicContact CG2-CG 4.44Å; V165-W192 HydrophobicContact CG2-CH2 4.46Å; V165-W192 HydrophobicContact CG2-CZ2 4.25Å; V165-W192 HydrophobicContact CG2-CZ3 4.46Å; C190-W192 PolarHBondContact O-N 2.75Å; W192-D194 VanDerWaalsContact C-N 3.27Å; W192-D194 HydrophobicContact CD2-CB 4.18Å; W192-D194 HydrophobicContact CH2-CB 4.23Å; W192-D194 HydrophobicContact CZ2-CB 3.76Å; W192-D194 PolarHBondContact O-N 2.78Å; W192-G195 PolarHBondContact O-N 2.94Å; W192-L196 HydrophobicContact CZ2-CB 4.42Å; W192-L196 PolarHBondContact NE1-O 3.37Å; W192-C238 HydrophobicContact CH2-CB 4.2Å; W192-C238 HydrophobicContact CZ2-CB 4.21Å
193	N	93.1	Very high	97.5	Very high	117 Å²	117	20.1 Å²	20.1	63%	0.626	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.5	-175	-74.7	-33.8	0	0	0	114.5	V191 G195 R284	V191-N193 VanDerWaalsContact C-N 3.33Å; V191-N193 WeakPolarHBondContact CG1-OD1 3.48Å; V191-N193 PolarHBondContact O-N 2.94Å; N193-G195 PolarHBondContact O-N 2.74Å; N193-R284 PolarHBondContact O-NH1 2.96Å; N193-R284 PolarHBondContact O-NH2 2.83Å
194	D	93.7	Very high	97.6	Very high	12 Å²	12	20.7 Å²	20.7	6%	0.064	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-40.2	171	-166.3	-59.6	0	0	0	110.3	W192 L196 R284 S370 F371	W192-D194 VanDerWaalsContact C-N 3.27Å; W192-D194 HydrophobicContact CD2-CB 4.18Å; W192-D194 HydrophobicContact CH2-CB 4.23Å; W192-D194 HydrophobicContact CZ2-CB 3.76Å; W192-D194 PolarHBondContact O-N 2.78Å; D194-L196 PolarHBondContact O-N 3.07Å; D194-L196 VanDerWaalsContact OD1-CB 3.27Å; D194-L196 WeakPolarHBondContact OD1-CB 3.37Å; D194-L196 PolarHBondContact OD1-N 3.13Å; D194-R284 VanDerWaalsContact O-CZ 3.29Å; D194-R284 PolarHBondContact O-NH1 3.02Å; D194-S370 VanDerWaalsContact OD2-CA 3.28Å; D194-S370 WeakPolarHBondContact OD2-CA 3.45Å; D194-F371 WeakPolarHBondContact OD1-CD2 3.5Å; D194-F371 PolarHBondContact OD2-N 2.81Å
195	G	95.3	Very high	97.5	Very high	1 Å²	1	22 Å²	22	1%	0.01	12%	0.12	C	C	.	.			trans	72.9	4.2	179	0	0	0	0	0	114.1	W192 N193 Y197 F280 E281	W192-G195 PolarHBondContact O-N 2.94Å; N193-G195 PolarHBondContact O-N 2.74Å; G195-Y197 PolarHBondContact O-N 3.39Å; G195-F280 VanDerWaalsContact O-CA 3.31Å; G195-F280 WeakPolarHBondContact O-CA 3.26Å; G195-E281 PolarHBondContact O-N 2.91Å
196	L	97.9	Very high	97.5	Very high	2 Å²	2	25 Å²	25	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	122.9	170.6	-175.5	67.2	0	0	0	109.9	W192 D194 A198 Y199 L234 C238 F278 F280 F371	W192-L196 HydrophobicContact CZ2-CB 4.42Å; W192-L196 PolarHBondContact NE1-O 3.37Å; D194-L196 PolarHBondContact O-N 3.07Å; D194-L196 VanDerWaalsContact OD1-CB 3.27Å; D194-L196 WeakPolarHBondContact OD1-CB 3.37Å; D194-L196 PolarHBondContact OD1-N 3.13Å; L196-A198 WeakPolarHBondContact CD1-O 3.23Å; L196-Y199 HydrophobicContact CD2-CD1 4.26Å; L196-L234 HydrophobicContact CD2-CD2 3.85Å; L196-L234 HydrophobicContact CG-CD2 3.79Å; L196-C238 HydrophobicContact CD2-CB 4.12Å; L196-F278 HydrophobicContact CD1-CB 3.75Å; L196-F278 HydrophobicContact CD1-CD1 3.91Å; L196-F278 HydrophobicContact CD1-CG 4.32Å; L196-F278 HydrophobicContact CD2-CD1 4.48Å; L196-F280 HydrophobicContact CB-CD1 4.42Å; L196-F280 HydrophobicContact CB-CE1 4.13Å; L196-F280 HydrophobicContact CD1-CE1 4.2Å; L196-F280 HydrophobicContact CD1-CE2 4.4Å; L196-F280 HydrophobicContact CD1-CZ 4.05Å; L196-F371 HydrophobicContact CD1-CE2 4.44Å; L196-F371 HydrophobicContact CD2-CE2 4.48Å
197	Y	97.8	Very high	97.5	Very high	67 Å²	67	25.2 Å²	25.2	26%	0.263	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-37	-177.6	180	-89.8	0	0	0	112	L99 R129 D130 G195 H279	L99-Y197 HydrophobicContact CD1-CD2 4.35Å; R129-Y197 HydrophobicContact CB-CD2 4.15Å; R129-Y197 HydrophobicContact CB-CE2 3.48Å; R129-Y197 VanDerWaalsContact CB-CE2 3.48Å; R129-Y197 HydrophobicContact CG-CE2 4.48Å; R129-Y197 PolarHBondContact NE-O 2.94Å; D130-Y197 WeakPolarHBondContact CB-OH 3.33Å; G195-Y197 PolarHBondContact O-N 3.39Å; Y197-H279 WeakPolarHBondContact CA-O 3.36Å; Y197-H279 WeakPolarHBondContact CB-O 3.26Å; Y197-H279 PolarHBondContact N-O 3.28Å
198	A	98.4	Very high	97.3	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.033	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	155.2	174.3	0	0	0	0	0	110.7	L196 G233 H279	L196-A198 WeakPolarHBondContact CD1-O 3.23Å; A198-G233 CarbonylContact C-O 3.48Å; A198-G233 WeakPolarHBondContact CA-O 3.43Å; A198-H279 HydrophobicContact CB-CB 4.49Å; A198-H279 PolarHBondContact N-O 2.92Å; A198-H279 PolarHBondContact O-N 3Å
199	Y	98.8	Very high	97	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.8	161.2	57.6	-98.3	0	0	0	111.5	L196 A201 D218 Y221 G233 L234 G235 Q236 L237 E277	L196-Y199 HydrophobicContact CD2-CD1 4.26Å; Y199-A201 HydrophobicContact CD2-CB 4.38Å; Y199-D218 PolarHBondContact OH-OD2 3.22Å; Y199-Y221 AromaticContact CD2-CE2 3.96Å; Y199-Y221 HydrophobicContact CD2-CE2 3.96Å; Y199-Y221 AromaticContact CE2-CD2 3.77Å; Y199-Y221 HydrophobicContact CE2-CD2 3.77Å; Y199-Y221 AromaticContact CE2-CE2 3.48Å; Y199-Y221 HydrophobicContact CE2-CE2 3.48Å; Y199-Y221 VanDerWaalsContact CE2-CE2 3.48Å; Y199-Y221 AromaticContact CZ-CD2 3.85Å; Y199-Y221 AromaticContact CZ-CE2 3.82Å; Y199-Y221 PolarHBondContact O-OH 2.89Å; Y199-G233 PolarHBondContact N-O 2.93Å; Y199-L234 HydrophobicContact CD1-CD2 3.88Å; Y199-L234 HydrophobicContact CE1-CD2 4.2Å; Y199-G235 WeakPolarHBondContact OH-CA 3.33Å; Y199-G235 PolarHBondContact OH-N 3.37Å; Y199-Q236 PolarHBondContact OH-N 3.22Å; Y199-L237 HydrophobicContact CD2-CD1 4.24Å; Y199-L237 HydrophobicContact CE1-CB 3.89Å; Y199-L237 HydrophobicContact CE2-CD1 3.96Å; Y199-L237 HydrophobicContact CE2-CG 4.39Å; Y199-L237 PolarHBondContact OH-N 2.9Å; Y199-E277 CarbonylContact C-O 3.59Å; Y199-E277 WeakPolarHBondContact CA-O 3.46Å
200	T	98.8	Very high	96.7	Very high	32 Å²	32	38.3 Å²	38.3	20%	0.196	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	122.8	173.7	-63.6	0	0	0	0	108.6	M229 Q230 F231 I276 E277	T200-M229 HydrophobicContact CG2-CE 3.8Å; T200-Q230 CarbonylContact C-O 3.56Å; T200-Q230 WeakPolarHBondContact CA-O 3.02Å; T200-Q230 WeakPolarHBondContact CG2-O 3.43Å; T200-F231 HydrophobicContact CG2-CB 3.98Å; T200-F231 WeakPolarHBondContact OG1-CB 3.11Å; T200-I276 VanDerWaalsContact O-CA 3.31Å; T200-I276 WeakPolarHBondContact O-CA 3.24Å; T200-I276 WeakPolarHBondContact O-CG2 3.17Å; T200-E277 PolarHBondContact N-O 3.07Å; T200-E277 PolarHBondContact O-N 2.93Å
201	A	98.6	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.6	-175.7	0	0	0	0	0	111.2	Y199 Q230 W264 I276	Y199-A201 HydrophobicContact CD2-CB 4.38Å; A201-Q230 PolarHBondContact N-O 3.49Å; A201-Q230 PolarHBondContact O-N 3.39Å; A201-W264 HydrophobicContact CB-CZ2 4.42Å; A201-I276 HydrophobicContact CB-CG1 4.16Å; A201-I276 HydrophobicContact CB-CG2 4.25Å
202	P	98.4	Very high	96	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	147.3	166.6	-19.2	31.4	0	0	0	111.1	M229 W264 L269 V274 D275	P202-M229 HydrophobicContact CB-SD 4.08Å; P202-M229 HydrophobicContact CG-CE 4.49Å; P202-M229 HydrophobicContact CG-SD 3.97Å; P202-W264 PolarHBondContact O-NE1 3Å; P202-L269 HydrophobicContact CB-CD1 3.77Å; P202-L269 HydrophobicContact CG-CD1 4.06Å; P202-V274 HydrophobicContact CG-CG1 4.45Å; P202-D275 WeakPolarHBondContact CD-O 3.3Å
203	V	98.4	Very high	96	Very high	40 Å²	40	44 Å²	44	24%	0.242	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-59.4	141.8	173	-64.4	0	0	0	0	110.7	T225 G228 Q230	V203-T225 HydrophobicContact CG1-CG2 3.61Å; V203-G228 PolarHBondContact N-O 3.04Å; V203-Q230 HydrophobicContact CG1-CG 4.01Å
204	G	98.1	Very high	96.2	Very high	12 Å²	12	38.4 Å²	38.4	12%	0.124	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.8	152.5	174.4	0	0	0	0	0	112.7	L216 G263	G204-L216 VanDerWaalsContact CA-O 3.26Å; G204-L216 WeakPolarHBondContact CA-O 3.29Å; G204-G263 CarbonylContact C-O 3.46Å; G204-G263 WeakPolarHBondContact CA-O 3.46Å
205	H	98.2	Very high	96.4	Very high	39 Å²	39	42.8 Å²	42.8	18%	0.181	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-103.1	163.9	-176.9	-65.1	159.1	0	0	0	112	L216 G263 S265 A268 W363	H205-L216 WeakPolarHBondContact O-CB 3.48Å; H205-L216 PolarHBondContact O-N 3.27Å; H205-G263 PolarHBondContact N-O 3.4Å; H205-S265 PolarHBondContact ND1-N 2.85Å; H205-A268 WeakPolarHBondContact ND1-CB 3.5Å; H205-W363 HydrophobicContact CB-CH2 3.88Å; H205-W363 HydrophobicContact CB-CZ3 3.86Å
206	V	97.9	Very high	96.5	Very high	64 Å²	64	42.8 Å²	42.8	39%	0.388	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.4	174.8	-176.9	0	0	0	0	109.7	P213 V214 Y215 W363	V206-P213 HydrophobicContact CG1-CB 4.13Å; V206-V214 WeakPolarHBondContact CA-O 3.44Å; V206-Y215 HydrophobicContact CG1-CD1 4.26Å; V206-Y215 HydrophobicContact CG1-CE1 4.36Å; V206-Y215 HydrophobicContact CG2-CD1 3.69Å; V206-Y215 HydrophobicContact CG2-CE1 4.12Å; V206-W363 WeakPolarHBondContact O-CH2 3.29Å
207	M	97.6	Very high	96.5	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.2	173.3	-178.1	-168.6	-64.7	0	0	109.7	L209 V214 L216 F247 V301 W363	M207-L209 HydrophobicContact CG-CD2 4.17Å; M207-L209 HydrophobicContact CG-CG 4.22Å; M207-L209 PolarHBondContact O-N 2.83Å; M207-L209 HydrophobicContact SD-CD1 4.29Å; M207-L209 HydrophobicContact SD-CD2 3.79Å; M207-L209 HydrophobicContact SD-CG 4Å; M207-V214 HydrophobicContact CB-CB 4.22Å; M207-V214 PolarHBondContact N-O 3.34Å; M207-V214 PolarHBondContact O-N 3.22Å; M207-L216 HydrophobicContact CB-CD1 3.89Å; M207-L216 HydrophobicContact CE-CD1 4.13Å; M207-F247 HydrophobicContact CE-CE2 4.09Å; M207-F247 HydrophobicContact CE-CZ 3.99Å; M207-F247 HydrophobicContact SD-CE2 3.68Å; M207-F247 HydrophobicContact SD-CZ 3.64Å; M207-V301 HydrophobicContact CE-CG2 3.64Å; M207-W363 HydrophobicContact CB-CH2 3.66Å; M207-W363 HydrophobicContact CB-CZ2 3.6Å; M207-W363 HydrophobicContact CB-CZ3 4.12Å; M207-W363 HydrophobicContact CE-CB 4.05Å; M207-W363 HydrophobicContact CE-CD2 3.49Å; M207-W363 VanDerWaalsContact CE-CD2 3.49Å; M207-W363 HydrophobicContact CE-CE3 3.92Å; M207-W363 HydrophobicContact CE-CG 3.53Å; M207-W363 HydrophobicContact CG-CH2 4.39Å; M207-W363 HydrophobicContact CG-CZ2 3.84Å
208	N	95.3	Very high	96.5	Very high	133 Å²	133	42.4 Å²	42.4	71%	0.711	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	93.6	179.1	-64.6	-49.2	0	0	0	110.2
209	L	92.8	Very high	96.4	Very high	38 Å²	38	43.9 Å²	43.9	20%	0.199	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	159	168.9	-62.5	179.7	0	0	0	110.1	M207 G211 I212 V214 F247 I248	M207-L209 HydrophobicContact CG-CD2 4.17Å; M207-L209 HydrophobicContact CG-CG 4.22Å; M207-L209 PolarHBondContact O-N 2.83Å; M207-L209 HydrophobicContact SD-CD1 4.29Å; M207-L209 HydrophobicContact SD-CD2 3.79Å; M207-L209 HydrophobicContact SD-CG 4Å; L209-G211 PolarHBondContact O-N 2.96Å; L209-I212 WeakPolarHBondContact CB-O 3.05Å; L209-I212 PolarHBondContact N-O 3.26Å; L209-I212 VanDerWaalsContact N-O 3.1Å; L209-I212 PolarHBondContact O-N 3.4Å; L209-V214 HydrophobicContact CD1-CG2 3.85Å; L209-V214 HydrophobicContact CG-CG2 4.26Å; L209-F247 HydrophobicContact CD1-CE2 4.3Å; L209-F247 HydrophobicContact CD1-CZ 4.39Å; L209-I248 HydrophobicContact CD1-CD1 3.55Å; L209-I248 HydrophobicContact CD1-CG1 4.21Å
210	P	92.2	Very high	96.4	Very high	131 Å²	131	45 Å²	45	85%	0.851	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	105.4	-180	-26.7	35.5	0	0	0	112.4	I212	P210-I212 VanDerWaalsContact C-N 3.32Å; P210-I212 PolarHBondContact O-N 3.44Å
211	G	86.9	Confident	96.4	Very high	83 Å²	83	44.9 Å²	44.9	86%	0.856	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	2.4	178.9	0	0	0	0	0	116.2	L209	L209-G211 PolarHBondContact O-N 2.96Å
212	I	91.6	Very high	96.3	Very high	78 Å²	78	46 Å²	46	40%	0.4	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	108.6	-177	-54.3	178.1	0	0	0	110	L209 P210 V214 P257	L209-I212 WeakPolarHBondContact CB-O 3.05Å; L209-I212 PolarHBondContact N-O 3.26Å; L209-I212 VanDerWaalsContact N-O 3.1Å; L209-I212 PolarHBondContact O-N 3.4Å; P210-I212 VanDerWaalsContact C-N 3.32Å; P210-I212 PolarHBondContact O-N 3.44Å; I212-V214 HydrophobicContact CG2-CG2 4.36Å; I212-P257 HydrophobicContact CG2-CG 4.32Å
213	P	95.8	Very high	96.3	Very high	56 Å²	56	46.5 Å²	46.5	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	129.6	166.3	30.5	-31.5	0	0	0	109.8	V206 Y215	V206-P213 HydrophobicContact CG1-CB 4.13Å; P213-Y215 HydrophobicContact CB-CE2 4.04Å; P213-Y215 HydrophobicContact CG-CE2 3.98Å
214	V	97.6	Very high	96.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.4	176.2	-178.2	0	0	0	0	107.5	V206 M207 L209 I212 L216 F247 I248 P257	V206-V214 WeakPolarHBondContact CA-O 3.44Å; M207-V214 HydrophobicContact CB-CB 4.22Å; M207-V214 PolarHBondContact N-O 3.34Å; M207-V214 PolarHBondContact O-N 3.22Å; L209-V214 HydrophobicContact CD1-CG2 3.85Å; L209-V214 HydrophobicContact CG-CG2 4.26Å; I212-V214 HydrophobicContact CG2-CG2 4.36Å; V214-L216 HydrophobicContact CG1-CD2 3.84Å; V214-L216 HydrophobicContact CG1-CG 4.02Å; V214-F247 HydrophobicContact CG1-CD2 4.07Å; V214-F247 HydrophobicContact CG1-CE2 4.16Å; V214-I248 HydrophobicContact CG2-CG1 4.35Å; V214-P257 WeakPolarHBondContact CG1-O 3.43Å; V214-P257 HydrophobicContact CG2-CB 4.4Å
215	Y	97.3	Very high	96.2	Very high	104 Å²	104	50.7 Å²	50.7	41%	0.408	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	113.1	-176.7	-57.4	-95.2	0	0	0	108.5	V206 P213 W256 P257 G258	V206-Y215 HydrophobicContact CG1-CD1 4.26Å; V206-Y215 HydrophobicContact CG1-CE1 4.36Å; V206-Y215 HydrophobicContact CG2-CD1 3.69Å; V206-Y215 HydrophobicContact CG2-CE1 4.12Å; P213-Y215 HydrophobicContact CB-CE2 4.04Å; P213-Y215 HydrophobicContact CG-CE2 3.98Å; Y215-W256 HydrophobicContact CD2-CB 4.45Å; Y215-W256 HydrophobicContact CD2-CG 4.41Å; Y215-P257 PolarHBondContact N-O 3.1Å; Y215-G258 CarbonylContact O-C 3.53Å
216	L	98.3	Very high	96.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.325	C	S	.	.			trans	-111.2	40.6	-175	-55.9	156.1	0	0	0	109.9	G204 H205 M207 V214 Y261 L262 G263 W363 L365	G204-L216 VanDerWaalsContact CA-O 3.26Å; G204-L216 WeakPolarHBondContact CA-O 3.29Å; H205-L216 WeakPolarHBondContact O-CB 3.48Å; H205-L216 PolarHBondContact O-N 3.27Å; M207-L216 HydrophobicContact CB-CD1 3.89Å; M207-L216 HydrophobicContact CE-CD1 4.13Å; V214-L216 HydrophobicContact CG1-CD2 3.84Å; V214-L216 HydrophobicContact CG1-CG 4.02Å; L216-Y261 CarbonylContact C-O 3.56Å; L216-Y261 WeakPolarHBondContact CA-O 3.21Å; L216-L262 WeakPolarHBondContact O-CD1 3.36Å; L216-G263 PolarHBondContact O-N 3.11Å; L216-W363 HydrophobicContact CD1-CE3 3.91Å; L216-W363 HydrophobicContact CD1-CH2 4.48Å; L216-W363 HydrophobicContact CD1-CZ3 3.68Å; L216-L365 HydrophobicContact CD1-CD2 3.51Å; L216-L365 HydrophobicContact CD2-CD1 4.21Å; L216-L365 HydrophobicContact CD2-CD2 3.97Å; L216-L365 HydrophobicContact CG-CD2 4.22Å
217	N	97.3	Very high	96	Very high	52 Å²	52	60.1 Å²	60.1	28%	0.278	35%	0.347	S	S	.	.	S	Bend	trans	-90.8	159.4	178.8	66.2	-75.1	0	0	0	110.8	S219 Q236 L262	N217-S219 PolarHBondContact ND2-OG 3.33Å; N217-S219 PolarHBondContact O-N 3.42Å; N217-S219 PolarHBondContact O-OG 3.19Å; N217-Q236 PolarHBondContact O-OE1 3.35Å; N217-Q236 VanDerWaalsContact O-OE1 3.06Å; N217-L262 VanDerWaalsContact C-CD1 3.43Å
218	D	98.2	Very high	95.9	Very high	9 Å²	9	61.5 Å²	61.5	5%	0.048	36%	0.364	C	S	.	.			trans	-79.6	104.9	173.1	-162.3	-26.7	0	0	0	108.3	Y199 Y221 Q236 L262	Y199-D218 PolarHBondContact OH-OD2 3.22Å; D218-Y221 PolarHBondContact OD1-N 3.4Å; D218-Y221 WeakPolarHBondContact OD2-CD2 3.32Å; D218-Q236 WeakPolarHBondContact OD1-CG 3.46Å; D218-Q236 PolarHBondContact OD1-N 3.5Å; D218-L262 HydrophobicContact CB-CD1 3.68Å; D218-L262 HydrophobicContact CB-CD2 4.29Å
219	S	97.1	Very high	96	Very high	36 Å²	36	58.6 Å²	58.6	25%	0.252	35%	0.347	S	S	.	.	S	Bend	trans	-87.7	-18.2	-167.1	-53.5	0	0	0	0	112.7	N217 Q236 W256 Y259	N217-S219 PolarHBondContact ND2-OG 3.33Å; N217-S219 PolarHBondContact O-N 3.42Å; N217-S219 PolarHBondContact O-OG 3.19Å; S219-Q236 VanDerWaalsContact CB-OE1 3.29Å; S219-Q236 PolarHBondContact OG-OE1 2.73Å; S219-W256 VanDerWaalsContact OG-CZ2 3.22Å; S219-W256 WeakPolarHBondContact OG-CZ2 3.49Å; S219-Y259 VanDerWaalsContact CB-CE2 3.46Å
220	T	97.5	Very high	96.2	Very high	25 Å²	25	57.3 Å²	57.3	15%	0.153	34%	0.34	C	S	.	.	S	Bend	trans	-118.1	12	-177.4	59.5	0	0	0	0	112.3	P162 D222 Q236 Y259	P162-T220 HydrophobicContact CB-CG2 3.89Å; P162-T220 HydrophobicContact CG-CG2 3.64Å; T220-D222 PolarHBondContact O-N 3.26Å; T220-D222 VanDerWaalsContact O-N 3.15Å; T220-Q236 HydrophobicContact CG2-CG 4.35Å; T220-Q236 WeakPolarHBondContact OG1-CG 2.99Å; T220-Q236 PolarHBondContact OG1-N 2.86Å; T220-Y259 WeakPolarHBondContact CG2-OH 3.37Å
221	Y	98.4	Very high	96.5	Very high	29 Å²	29	54.9 Å²	54.9	11%	0.114	32%	0.316	C	S	.	.			trans	-59.8	116.1	-178.8	-166.2	-109	0	0	0	112.2	Y199 D218 G223 Q230 F231 G232 G233 L234	Y199-Y221 AromaticContact CD2-CE2 3.96Å; Y199-Y221 HydrophobicContact CD2-CE2 3.96Å; Y199-Y221 AromaticContact CE2-CD2 3.77Å; Y199-Y221 HydrophobicContact CE2-CD2 3.77Å; Y199-Y221 AromaticContact CE2-CE2 3.48Å; Y199-Y221 HydrophobicContact CE2-CE2 3.48Å; Y199-Y221 VanDerWaalsContact CE2-CE2 3.48Å; Y199-Y221 AromaticContact CZ-CD2 3.85Å; Y199-Y221 AromaticContact CZ-CE2 3.82Å; Y199-Y221 PolarHBondContact O-OH 2.89Å; D218-Y221 PolarHBondContact OD1-N 3.4Å; D218-Y221 WeakPolarHBondContact OD2-CD2 3.32Å; Y221-G223 VanDerWaalsContact C-N 3.33Å; Y221-G223 PolarHBondContact O-N 3.22Å; Y221-Q230 HydrophobicContact CD1-CB 3.91Å; Y221-Q230 HydrophobicContact CD1-CG 3.83Å; Y221-Q230 HydrophobicContact CE1-CB 3.52Å; Y221-Q230 HydrophobicContact CE1-CG 3.95Å; Y221-Q230 HydrophobicContact CE2-CB 4.32Å; Y221-Q230 HydrophobicContact CG-CB 4.43Å; Y221-Q230 HydrophobicContact CG-CG 4.34Å; Y221-F231 WeakPolarHBondContact OH-CA 3.11Å; Y221-F231 PolarHBondContact OH-N 2.86Å; Y221-F231 PolarHBondContact OH-O 3.19Å; Y221-F231 VanDerWaalsContact OH-O 3.07Å; Y221-G232 PolarHBondContact OH-N 2.8Å; Y221-G233 VanDerWaalsContact CE2-C 3.47Å; Y221-G233 WeakPolarHBondContact CE2-O 3.39Å; Y221-G233 PolarHBondContact OH-N 2.73Å; Y221-G233 PolarHBondContact OH-O 2.77Å; Y221-L234 CarbonylContact C-O 3.49Å; Y221-L234 WeakPolarHBondContact CA-O 3.37Å
222	D	98.1	Very high	97	Very high	22 Å²	22	52.6 Å²	52.6	12%	0.118	29%	0.292	C	S	.	.			trans	-91.5	4.4	-172.8	81.5	0.3	0	0	0	114.1	Y127 R129 I135 T220 G233 L234	Y127-D222 VanDerWaalsContact OH-CB 3.26Å; Y127-D222 WeakPolarHBondContact OH-CB 3.37Å; Y127-D222 PolarHBondContact OH-OD2 2.84Å; Y127-D222 VanDerWaalsContact OH-OD2 3.08Å; R129-D222 IonicContact CZ-OD1 3.37Å; R129-D222 IonicContact CZ-OD2 2.68Å; R129-D222 VanDerWaalsContact CZ-OD2 3.28Å; R129-D222 IonicContact NH1-OD1 3.37Å; R129-D222 IonicContact NH1-OD2 3.82Å; R129-D222 PolarHBondContact NH1-OD2 2.91Å; R129-D222 VanDerWaalsContact NH2-CG 3.32Å; R129-D222 IonicContact NH2-OD1 2.96Å; R129-D222 PolarHBondContact NH2-OD1 3.28Å; R129-D222 IonicContact NH2-OD2 2.88Å; R129-D222 PolarHBondContact NH2-OD2 2.9Å; I135-D222 HydrophobicContact CD1-CB 4.09Å; I135-D222 WeakPolarHBondContact CD1-OD2 3.36Å; I135-D222 HydrophobicContact CG2-CB 4.24Å; T220-D222 PolarHBondContact O-N 3.26Å; T220-D222 VanDerWaalsContact O-N 3.15Å; D222-G233 WeakPolarHBondContact OD1-CA 3.26Å; D222-L234 PolarHBondContact N-O 2.96Å; D222-L234 PolarHBondContact OD1-N 3.45Å
223	G	97.6	Very high	97.3	Very high	21 Å²	21	48.9 Å²	48.9	22%	0.216	27%	0.273	C	S	.	.	S	Bend	trans	-91.3	-146.4	-177.9	0	0	0	0	0	113.4	Y221	Y221-G223 VanDerWaalsContact C-N 3.33Å; Y221-G223 PolarHBondContact O-N 3.22Å
224	S	97.6	Very high	97.5	Very high	54 Å²	54	46.6 Å²	46.6	38%	0.378	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.2	175.7	-60.7	0	0	0	0	110	Q230 F231	S224-Q230 CarbonylContact O-C 3.38Å; S224-Q230 WeakPolarHBondContact O-CA 3.39Å; S224-F231 PolarHBondContact N-O 3.05Å; S224-F231 PolarHBondContact O-N 2.03Å
225	T	97.5	Very high	97.5	Very high	85 Å²	85	47 Å²	47	52%	0.521	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.5	175.4	-55.9	0	0	0	0	108.8	V203 M229 Q230	V203-T225 HydrophobicContact CG1-CG2 3.61Å; T225-M229 CarbonylContact C-O 3.58Å; T225-M229 VanDerWaalsContact CA-O 3.3Å; T225-M229 WeakPolarHBondContact CA-O 3.18Å; T225-Q230 HydrophobicContact CG2-CG 4.17Å; T225-Q230 WeakPolarHBondContact OG1-CG 3.42Å
226	E	96.8	Very high	97.5	Very high	117 Å²	117	42.2 Å²	42.2	55%	0.547	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	134.3	178	-166.1	173.9	173.3	0	0	109.7	G228 M229 F231	E226-G228 PolarHBondContact O-N 3.11Å; E226-G228 VanDerWaalsContact O-N 3.07Å; E226-M229 PolarHBondContact N-O 2.71Å; E226-M229 PolarHBondContact O-N 3.2Å; E226-F231 HydrophobicContact CB-CE1 3.83Å; E226-F231 HydrophobicContact CB-CZ 4.41Å
227	Q	94.1	Very high	97.5	Very high	184 Å²	184	42.3 Å²	42.3	86%	0.86	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	35.3	176.4	-63.7	174.4	15.8	0	0	114.8	M229	Q227-M229 VanDerWaalsContact C-N 3.32Å
228	G	95.1	Very high	97.5	Very high	35 Å²	35	40 Å²	40	36%	0.361	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	12.3	-179.7	0	0	0	0	0	114.7	V203 E226	V203-G228 PolarHBondContact N-O 3.04Å; E226-G228 PolarHBondContact O-N 3.11Å; E226-G228 VanDerWaalsContact O-N 3.07Å
229	M	97.9	Very high	97.3	Very high	72 Å²	72	40.1 Å²	40.1	36%	0.355	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.9	173.3	-69.3	-63.8	-59	0	0	110.6	T200 P202 T225 E226 Q227	T200-M229 HydrophobicContact CG2-CE 3.8Å; P202-M229 HydrophobicContact CB-SD 4.08Å; P202-M229 HydrophobicContact CG-CE 4.49Å; P202-M229 HydrophobicContact CG-SD 3.97Å; T225-M229 CarbonylContact C-O 3.58Å; T225-M229 VanDerWaalsContact CA-O 3.3Å; T225-M229 WeakPolarHBondContact CA-O 3.18Å; E226-M229 PolarHBondContact N-O 2.71Å; E226-M229 PolarHBondContact O-N 3.2Å; Q227-M229 VanDerWaalsContact C-N 3.32Å
230	Q	98.3	Very high	97.1	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134	172	-77.4	173.8	-22.8	0	0	109	T200 A201 V203 Y221 S224 T225	T200-Q230 CarbonylContact C-O 3.56Å; T200-Q230 WeakPolarHBondContact CA-O 3.02Å; T200-Q230 WeakPolarHBondContact CG2-O 3.43Å; A201-Q230 PolarHBondContact N-O 3.49Å; A201-Q230 PolarHBondContact O-N 3.39Å; V203-Q230 HydrophobicContact CG1-CG 4.01Å; Y221-Q230 HydrophobicContact CD1-CB 3.91Å; Y221-Q230 HydrophobicContact CD1-CG 3.83Å; Y221-Q230 HydrophobicContact CE1-CB 3.52Å; Y221-Q230 HydrophobicContact CE1-CG 3.95Å; Y221-Q230 HydrophobicContact CE2-CB 4.32Å; Y221-Q230 HydrophobicContact CG-CB 4.43Å; Y221-Q230 HydrophobicContact CG-CG 4.34Å; S224-Q230 CarbonylContact O-C 3.38Å; S224-Q230 WeakPolarHBondContact O-CA 3.39Å; T225-Q230 HydrophobicContact CG2-CG 4.17Å; T225-Q230 WeakPolarHBondContact OG1-CG 3.42Å
231	F	98.2	Very high	97	Very high	80 Å²	80	38.7 Å²	38.7	35%	0.351	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159.9	179	61.9	-85.6	0	0	0	112.7	T200 Y221 S224 E226 G233	T200-F231 HydrophobicContact CG2-CB 3.98Å; T200-F231 WeakPolarHBondContact OG1-CB 3.11Å; Y221-F231 WeakPolarHBondContact OH-CA 3.11Å; Y221-F231 PolarHBondContact OH-N 2.86Å; Y221-F231 PolarHBondContact OH-O 3.19Å; Y221-F231 VanDerWaalsContact OH-O 3.07Å; S224-F231 PolarHBondContact N-O 3.05Å; S224-F231 PolarHBondContact O-N 2.03Å; E226-F231 HydrophobicContact CB-CE1 3.83Å; E226-F231 HydrophobicContact CB-CZ 4.41Å; F231-G233 VanDerWaalsContact C-N 3.33Å; F231-G233 PolarHBondContact O-N 3.2Å
232	G	97.3	Very high	96.9	Very high	35 Å²	35	39.1 Å²	39.1	36%	0.361	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	69.2	24	174.1	0	0	0	0	0	115.5	Y221	Y221-G232 PolarHBondContact OH-N 2.8Å
233	G	98.1	Very high	96.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	-177.6	178.8	0	0	0	0	0	114.1	A198 Y199 Y221 D222 F231	A198-G233 CarbonylContact C-O 3.48Å; A198-G233 WeakPolarHBondContact CA-O 3.43Å; Y199-G233 PolarHBondContact N-O 2.93Å; Y221-G233 VanDerWaalsContact CE2-C 3.47Å; Y221-G233 WeakPolarHBondContact CE2-O 3.39Å; Y221-G233 PolarHBondContact OH-N 2.73Å; Y221-G233 PolarHBondContact OH-O 2.77Å; D222-G233 WeakPolarHBondContact OD1-CA 3.26Å; F231-G233 VanDerWaalsContact C-N 3.33Å; F231-G233 PolarHBondContact O-N 3.2Å
234	L	98.7	Very high	96.7	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.042	22%	0.223	C	C	.	.			trans	-126.2	163.7	175.8	-63.7	176.9	0	0	0	108.8	V165 L196 Y199 Y221 D222	V165-L234 HydrophobicContact CB-CD1 3.75Å; V165-L234 HydrophobicContact CG1-CD1 4Å; V165-L234 HydrophobicContact CG2-CD1 4.08Å; L196-L234 HydrophobicContact CD2-CD2 3.85Å; L196-L234 HydrophobicContact CG-CD2 3.79Å; Y199-L234 HydrophobicContact CD1-CD2 3.88Å; Y199-L234 HydrophobicContact CE1-CD2 4.2Å; Y221-L234 CarbonylContact C-O 3.49Å; Y221-L234 WeakPolarHBondContact CA-O 3.37Å; D222-L234 PolarHBondContact N-O 2.96Å; D222-L234 PolarHBondContact OD1-N 3.45Å
235	G	98.1	Very high	96.6	Very high	7 Å²	7	39 Å²	39	7%	0.072	22%	0.223	C	C	.	.			trans	-172.1	-147.1	-174.6	0	0	0	0	0	110.6	Y199 L237 C238 D239	Y199-G235 WeakPolarHBondContact OH-CA 3.33Å; Y199-G235 PolarHBondContact OH-N 3.37Å; G235-L237 PolarHBondContact O-N 2.8Å; G235-L237 VanDerWaalsContact O-N 3.1Å; G235-C238 PolarHBondContact O-N 2.86Å; G235-C238 VanDerWaalsContact O-N 3.1Å; G235-C238 PolarHBondContact O-SG 2.85Å; G235-D239 PolarHBondContact O-N 2.84Å
236	Q	97.9	Very high	96.6	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.023	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-62.4	-24.1	-169.5	-62.4	-170.8	-92.8	0	0	114.2	Y199 N217 D218 S219 T220 C238 Y259	Y199-Q236 PolarHBondContact OH-N 3.22Å; N217-Q236 PolarHBondContact O-OE1 3.35Å; N217-Q236 VanDerWaalsContact O-OE1 3.06Å; D218-Q236 WeakPolarHBondContact OD1-CG 3.46Å; D218-Q236 PolarHBondContact OD1-N 3.5Å; S219-Q236 VanDerWaalsContact CB-OE1 3.29Å; S219-Q236 PolarHBondContact OG-OE1 2.73Å; T220-Q236 HydrophobicContact CG2-CG 4.35Å; T220-Q236 WeakPolarHBondContact OG1-CG 2.99Å; T220-Q236 PolarHBondContact OG1-N 2.86Å; Q236-C238 PolarHBondContact O-N 2.95Å; Q236-C238 VanDerWaalsContact O-N 3.11Å; Q236-Y259 PolarHBondContact NE2-O 2.89Å; Q236-Y259 PolarHBondContact OE1-O 2.96Å
237	L	98.2	Very high	96.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-67.8	-8.1	177.9	-66.5	-175	0	0	0	114.1	Y199 G235 L262 I276 I366 E368 I369	Y199-L237 HydrophobicContact CD2-CD1 4.24Å; Y199-L237 HydrophobicContact CE1-CB 3.89Å; Y199-L237 HydrophobicContact CE2-CD1 3.96Å; Y199-L237 HydrophobicContact CE2-CG 4.39Å; Y199-L237 PolarHBondContact OH-N 2.9Å; G235-L237 PolarHBondContact O-N 2.8Å; G235-L237 VanDerWaalsContact O-N 3.1Å; L237-L262 HydrophobicContact CD1-CD2 3.82Å; L237-L262 HydrophobicContact CD2-CB 3.87Å; L237-L262 HydrophobicContact CD2-CD2 4.01Å; L237-L262 HydrophobicContact CG-CB 4.48Å; L237-L262 HydrophobicContact CG-CD2 3.8Å; L237-I276 HydrophobicContact CD1-CD1 4.29Å; L237-I366 HydrophobicContact CD2-CB 4.11Å; L237-I366 HydrophobicContact CD2-CG2 3.74Å; L237-E368 CarbonylContact O-C 3.55Å; L237-E368 WeakPolarHBondContact O-CA 3.26Å; L237-I369 HydrophobicContact CD1-CD1 4.14Å; L237-I369 PolarHBondContact O-N 3.33Å
238	C	96.6	Very high	96.6	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.027	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-144.8	25.5	-178.6	63.6	0	0	0	0	112.8	W192 L196 G235 Q236 E368	W192-C238 HydrophobicContact CH2-CB 4.2Å; W192-C238 HydrophobicContact CZ2-CB 4.21Å; L196-C238 HydrophobicContact CD2-CB 4.12Å; G235-C238 PolarHBondContact O-N 2.86Å; G235-C238 VanDerWaalsContact O-N 3.1Å; G235-C238 PolarHBondContact O-SG 2.85Å; Q236-C238 PolarHBondContact O-N 2.95Å; Q236-C238 VanDerWaalsContact O-N 3.11Å; C238-E368 WeakPolarHBondContact CA-OE1 3.18Å
239	D	94.6	Very high	96.5	Very high	11 Å²	11	29.3 Å²	29.3	6%	0.059	17%	0.165	C	C	.	.	S	Bend	trans	-92.5	-1.3	-177.7	83.9	-11.4	0	0	0	112.9	F101 R140 P163 G235 V241 E368	F101-D239 WeakPolarHBondContact CZ-O 3.49Å; R140-D239 IonicContact CZ-OD2 3.24Å; R140-D239 IonicContact NH1-OD2 3.13Å; R140-D239 PolarHBondContact NH1-OD2 3.28Å; R140-D239 IonicContact NH2-OD2 2.77Å; R140-D239 PolarHBondContact NH2-OD2 3.36Å; P163-D239 HydrophobicContact CG-CB 4.34Å; P163-D239 WeakPolarHBondContact CG-O 3.39Å; G235-D239 PolarHBondContact O-N 2.84Å; D239-V241 VanDerWaalsContact OD1-CB 3.24Å; D239-V241 WeakPolarHBondContact OD1-CB 3.42Å; D239-V241 VanDerWaalsContact OD1-CG2 3.3Å; D239-V241 WeakPolarHBondContact OD1-CG2 3.49Å; D239-V241 PolarHBondContact OD1-N 3.5Å; D239-E368 PolarHBondContact N-OE2 3.27Å
240	G	93.3	Very high	96.3	Very high	10 Å²	10	28.1 Å²	28.1	10%	0.103	16%	0.161	C	C	.	.	S	Bend	trans	88	2	178.4	0	0	0	0	0	114.3	P33 L242 E368	P33-G240 WeakPolarHBondContact CG-O 3.33Å; G240-L242 PolarHBondContact O-N 3.37Å; G240-E368 WeakPolarHBondContact CA-OE2 3.33Å; G240-E368 PolarHBondContact N-OE1 2.87Å; G240-E368 PolarHBondContact N-OE2 3.42Å
241	V	94.5	Very high	95.8	Very high	22 Å²	22	33.8 Å²	33.8	13%	0.133	19%	0.186	C	C	.	.			trans	-90.9	106.7	-178.6	-177.7	0	0	0	0	110.8	D239 G243 D260 E368	D239-V241 VanDerWaalsContact OD1-CB 3.24Å; D239-V241 WeakPolarHBondContact OD1-CB 3.42Å; D239-V241 VanDerWaalsContact OD1-CG2 3.3Å; D239-V241 WeakPolarHBondContact OD1-CG2 3.49Å; D239-V241 PolarHBondContact OD1-N 3.5Å; V241-G243 PolarHBondContact O-N 3.03Å; V241-D260 HydrophobicContact CG1-CB 4.46Å; V241-E368 PolarHBondContact N-OE2 3.16Å
242	L	95.6	Very high	95.3	Very high	37 Å²	37	32.3 Å²	32.3	19%	0.194	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-78.7	119.1	169.8	-54	-175.8	0	0	0	109.9	W29 G240 K251 H292 E368	W29-L242 HydrophobicContact CB-CD1 3.84Å; W29-L242 HydrophobicContact CD2-CD1 4.25Å; W29-L242 HydrophobicContact CD2-CD2 3.74Å; W29-L242 HydrophobicContact CE3-CD2 4.14Å; W29-L242 HydrophobicContact CG-CD1 3.74Å; W29-L242 HydrophobicContact CG-CD2 4.05Å; W29-L242 HydrophobicContact CG-CG 4.42Å; W29-L242 HydrophobicContact CH2-CD2 4.5Å; W29-L242 HydrophobicContact CZ2-CD2 4.22Å; W29-L242 HydrophobicContact CZ3-CD2 4.46Å; G240-L242 PolarHBondContact O-N 3.37Å; L242-K251 WeakPolarHBondContact O-CD 2.99Å; L242-K251 WeakPolarHBondContact O-CE 3.19Å; L242-K251 PolarHBondContact O-NZ 2.89Å; L242-H292 HydrophobicContact CD2-CB 3.82Å; L242-E368 HydrophobicContact CD2-CB 3.71Å; L242-E368 HydrophobicContact CD2-CG 3.95Å
243	G	96.1	Very high	94.9	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-64.2	162	177.4	0	0	0	0	0	113.5	V241 Y261 H292 S367	V241-G243 PolarHBondContact O-N 3.03Å; G243-Y261 PolarHBondContact O-OH 3.24Å; G243-H292 PolarHBondContact O-CE1 3.01Å; G243-S367 VanDerWaalsContact N-CB 3.31Å; G243-S367 PolarHBondContact N-OG 3.1Å
244	G	95.8	Very high	94.5	Very high	21 Å²	21	43.8 Å²	43.8	22%	0.216	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-80.6	173	177.6	0	0	0	0	0	114.4	Y261 N294	G244-Y261 WeakPolarHBondContact O-CE2 3.42Å; G244-Y261 PolarHBondContact O-OH 3.37Å; G244-N294 PolarHBondContact O-ND2 2.92Å
245	D	96.6	Very high	94.3	Very high	73 Å²	73	44.5 Å²	44.5	39%	0.39	23%	0.227	S	C	.	.	S	Bend	trans	-64.6	-42.6	174.5	-73.1	-8.6	0	0	0	112	F247 N294 S337 S338	D245-F247 PolarHBondContact O-N 3.4Å; D245-N294 PolarHBondContact O-ND2 2.91Å; D245-S337 VanDerWaalsContact CG-CA 3.49Å; D245-S337 WeakPolarHBondContact OD1-CA 3.42Å; D245-S337 WeakPolarHBondContact OD1-CB 3.38Å; D245-S337 VanDerWaalsContact OD2-CB 3.24Å; D245-S337 WeakPolarHBondContact OD2-CB 3.5Å; D245-S337 PolarHBondContact OD2-OG 3.31Å; D245-S338 PolarHBondContact OD1-N 2.87Å; D245-S338 PolarHBondContact OD1-OG 3.18Å
246	D	96.3	Very high	94.1	Very high	36 Å²	36	48.6 Å²	48.6	19%	0.193	24%	0.24	C	C	.	.	S	Bend	trans	-85	103.5	167	-165.4	-28.2	0	0	0	109	I248 E249 R296	D246-I248 PolarHBondContact O-N 3.12Å; D246-I248 VanDerWaalsContact O-N 3.11Å; D246-I248 VanDerWaalsContact OD1-CB 3.24Å; D246-I248 WeakPolarHBondContact OD1-CB 3.3Å; D246-I248 WeakPolarHBondContact OD1-CG1 3.36Å; D246-I248 PolarHBondContact OD1-N 2.72Å; D246-E249 HydrophobicContact CB-CB 4.32Å; D246-E249 HydrophobicContact CB-CG 4.09Å; D246-E249 PolarHBondContact O-N 3.16Å; D246-E249 VanDerWaalsContact O-N 3.08Å; D246-R296 IonicContact OD1-CZ 3.5Å; D246-R296 IonicContact OD1-NH1 3.73Å; D246-R296 PolarHBondContact OD1-NH1 2.88Å; D246-R296 IonicContact OD1-NH2 2.79Å; D246-R296 IonicContact OD2-CZ 3.22Å; D246-R296 IonicContact OD2-NH1 3.74Å; D246-R296 PolarHBondContact OD2-NH1 3.5Å; D246-R296 IonicContact OD2-NH2 2.72Å; D246-R296 PolarHBondContact OD2-NH2 2.67Å
247	F	96.3	Very high	94	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.8	-179.7	62.4	-98.6	0	0	0	113.8	M207 L209 V214 D245 G258 Y261 R296 Q299 V301 L365	M207-F247 HydrophobicContact CE-CE2 4.09Å; M207-F247 HydrophobicContact CE-CZ 3.99Å; M207-F247 HydrophobicContact SD-CE2 3.68Å; M207-F247 HydrophobicContact SD-CZ 3.64Å; L209-F247 HydrophobicContact CD1-CE2 4.3Å; L209-F247 HydrophobicContact CD1-CZ 4.39Å; V214-F247 HydrophobicContact CG1-CD2 4.07Å; V214-F247 HydrophobicContact CG1-CE2 4.16Å; D245-F247 PolarHBondContact O-N 3.4Å; F247-G258 WeakPolarHBondContact O-CA 3.5Å; F247-G258 PolarHBondContact O-N 3.02Å; F247-Y261 HydrophobicContact CB-CD2 3.65Å; F247-Y261 HydrophobicContact CB-CE2 3.77Å; F247-Y261 HydrophobicContact CB-CG 4.4Å; F247-R296 HydrophobicContact CD1-CB 4.35Å; F247-R296 HydrophobicContact CE1-CB 4.28Å; F247-Q299 HydrophobicContact CE1-CB 4.33Å; F247-Q299 HydrophobicContact CZ-CB 4.41Å; F247-V301 HydrophobicContact CD1-CG2 4.25Å; F247-V301 HydrophobicContact CE1-CB 4.45Å; F247-V301 HydrophobicContact CE1-CG2 3.71Å; F247-V301 HydrophobicContact CZ-CG2 4.14Å; F247-L365 HydrophobicContact CB-CD1 3.73Å; F247-L365 HydrophobicContact CD1-CD1 3.8Å; F247-L365 HydrophobicContact CD2-CD1 3.99Å; F247-L365 HydrophobicContact CE1-CD1 4.43Å; F247-L365 HydrophobicContact CG-CD1 3.56Å
248	I	94.9	Very high	94	Very high	42 Å²	42	50.4 Å²	50.4	22%	0.215	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-33.1	174.3	-54.4	176.1	0	0	0	109.7	L209 V214 D246 P257	L209-I248 HydrophobicContact CD1-CD1 3.55Å; L209-I248 HydrophobicContact CD1-CG1 4.21Å; V214-I248 HydrophobicContact CG2-CG1 4.35Å; D246-I248 PolarHBondContact O-N 3.12Å; D246-I248 VanDerWaalsContact O-N 3.11Å; D246-I248 VanDerWaalsContact OD1-CB 3.24Å; D246-I248 WeakPolarHBondContact OD1-CB 3.3Å; D246-I248 WeakPolarHBondContact OD1-CG1 3.36Å; D246-I248 PolarHBondContact OD1-N 2.72Å; I248-P257 HydrophobicContact CG2-CB 3.79Å; I248-P257 HydrophobicContact CG2-CG 4.44Å; I248-P257 WeakPolarHBondContact O-CA 3.24Å
249	E	93.9	Very high	94	Very high	138 Å²	138	50.3 Å²	50.3	65%	0.645	25%	0.252	S	S	*	.	S	Bend	trans	-77	146.4	173.1	-62.6	-174	175.4	0	0	110	D246	D246-E249 HydrophobicContact CB-CB 4.32Å; D246-E249 HydrophobicContact CB-CG 4.09Å; D246-E249 PolarHBondContact O-N 3.16Å; D246-E249 VanDerWaalsContact O-N 3.08Å
250	T	92.1	Very high	94.2	Very high	47 Å²	47	50 Å²	50	29%	0.288	25%	0.25	S	C	.	.			trans	-127	143.5	-175.1	53	0	0	0	0	109.9	E252 V255 D260	T250-E252 VanDerWaalsContact C-N 3.34Å; T250-E252 PolarHBondContact OG1-O 2.95Å; T250-V255 HydrophobicContact CG2-CG2 3.83Å; T250-V255 WeakPolarHBondContact OG1-CG2 3.36Å; T250-D260 WeakPolarHBondContact CA-OD2 2.97Å
251	K	89.4	Confident	94.4	Very high	131 Å²	131	49.5 Å²	49.5	57%	0.57	25%	0.245	S	C	*	.	S	Bend	trans	-76.8	-29	173.1	-69.4	-170.7	176	175	0	111.5	L242 D260	L242-K251 WeakPolarHBondContact O-CD 2.99Å; L242-K251 WeakPolarHBondContact O-CE 3.19Å; L242-K251 PolarHBondContact O-NZ 2.89Å; K251-D260 PolarHBondContact N-OD2 2.79Å
252	E	87.7	Confident	94.6	Very high	49 Å²	49	48.5 Å²	48.5	23%	0.229	24%	0.239	C	C	.	.	S	Bend	trans	-79.9	143.7	176.2	-64.6	-64.7	167.8	0	0	111	R140 T250 V255 Y259	R140-E252 IonicContact CZ-OE1 2.61Å; R140-E252 VanDerWaalsContact CZ-OE1 3.24Å; R140-E252 IonicContact NE-OE1 2.7Å; R140-E252 PolarHBondContact NE-OE1 3.29Å; R140-E252 VanDerWaalsContact NE-OE1 3.13Å; R140-E252 IonicContact NE-OE2 3.89Å; R140-E252 PolarHBondContact NE-OE2 3.02Å; R140-E252 VanDerWaalsContact NE-OE2 3.12Å; R140-E252 IonicContact NH2-OE1 3.11Å; R140-E252 PolarHBondContact NH2-OE1 3.47Å; T250-E252 VanDerWaalsContact C-N 3.34Å; T250-E252 PolarHBondContact OG1-O 2.95Å; E252-V255 HydrophobicContact CB-CG1 4.06Å; E252-V255 HydrophobicContact CB-CG2 3.86Å; E252-V255 WeakPolarHBondContact O-CG2 3.44Å; E252-Y259 HydrophobicContact CB-CD1 4.26Å; E252-Y259 HydrophobicContact CB-CE1 4.32Å; E252-Y259 HydrophobicContact CG-CD1 4.29Å; E252-Y259 HydrophobicContact CG-CE1 4.09Å
253	L	88.2	Confident	94.7	Very high	136 Å²	136	46.7 Å²	46.7	71%	0.712	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	142.8	-178.4	-65.1	175.5	0	0	0	111.1	W141 V255	W141-L253 VanDerWaalsContact CZ2-O 3.29Å; W141-L253 WeakPolarHBondContact CZ2-O 2.94Å; W141-L253 PolarHBondContact NE1-O 3.11Å; L253-V255 VanDerWaalsContact C-N 3.27Å; L253-V255 PolarHBondContact O-N 3.1Å
254	R	90.3	Very high	94.9	Very high	140 Å²	140	46.6 Å²	46.6	53%	0.528	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	34.8	173.7	-50.8	178.3	-65.1	171	3	113.8	W141 Y506	W141-R254 PolarHBondContact NE1-O 3.21Å; R254-Y506 VanDerWaalsContact NH1-CD2 3.32Å; R254-Y506 VanDerWaalsContact NH1-CE2 3.29Å
255	V	93.8	Very high	95	Very high	23 Å²	23	46.2 Å²	46.2	14%	0.139	22%	0.222	C	C	.	.			trans	-107.5	168.9	169.9	-63.4	0	0	0	0	110.1	T250 E252 L253 Y259	T250-V255 HydrophobicContact CG2-CG2 3.83Å; T250-V255 WeakPolarHBondContact OG1-CG2 3.36Å; E252-V255 HydrophobicContact CB-CG1 4.06Å; E252-V255 HydrophobicContact CB-CG2 3.86Å; E252-V255 WeakPolarHBondContact O-CG2 3.44Å; L253-V255 VanDerWaalsContact C-N 3.27Å; L253-V255 PolarHBondContact O-N 3.1Å; V255-Y259 HydrophobicContact CB-CD1 4.07Å; V255-Y259 HydrophobicContact CB-CD2 3.71Å; V255-Y259 HydrophobicContact CB-CE2 4.28Å; V255-Y259 HydrophobicContact CB-CG 3.59Å; V255-Y259 HydrophobicContact CG1-CD1 4.05Å; V255-Y259 HydrophobicContact CG1-CD2 3.9Å; V255-Y259 HydrophobicContact CG1-CE1 4.12Å; V255-Y259 HydrophobicContact CG1-CE2 3.96Å; V255-Y259 HydrophobicContact CG1-CG 3.95Å; V255-Y259 HydrophobicContact CG2-CD1 3.89Å; V255-Y259 HydrophobicContact CG2-CD2 4.32Å; V255-Y259 HydrophobicContact CG2-CG 3.67Å
256	W	94.4	Very high	95	Very high	92 Å²	92	48.9 Å²	48.9	35%	0.348	23%	0.227	S	C	.	.			trans	-79.8	158.6	-179.3	48.6	87.2	0	0	0	112.2	Y215 S219 G258 Y259	Y215-W256 HydrophobicContact CD2-CB 4.45Å; Y215-W256 HydrophobicContact CD2-CG 4.41Å; S219-W256 VanDerWaalsContact OG-CZ2 3.22Å; S219-W256 WeakPolarHBondContact OG-CZ2 3.49Å; W256-G258 PolarHBondContact O-N 3.49Å; W256-Y259 HydrophobicContact CD2-CD2 4.1Å; W256-Y259 AromaticContact CE2-CD2 3.62Å; W256-Y259 HydrophobicContact CE3-CD2 4.48Å; W256-Y259 HydrophobicContact CH2-CD2 4.06Å; W256-Y259 AromaticContact CH2-CE2 3.9Å; W256-Y259 HydrophobicContact CH2-CE2 3.9Å; W256-Y259 AromaticContact CZ2-CD2 3.66Å; W256-Y259 HydrophobicContact CZ2-CD2 3.66Å; W256-Y259 AromaticContact CZ2-CE2 3.82Å; W256-Y259 HydrophobicContact CZ2-CE2 3.82Å; W256-Y259 HydrophobicContact CZ3-CD2 4.44Å; W256-Y259 HydrophobicContact CZ3-CE2 4.46Å; W256-Y259 AromaticContact NE1-CD2 3.89Å; W256-Y259 VanDerWaalsContact O-CB 3.3Å; W256-Y259 WeakPolarHBondContact O-CB 3.48Å; W256-Y259 PolarHBondContact O-N 2.87Å
257	P	96.6	Very high	95.1	Very high	45 Å²	45	55.6 Å²	55.6	29%	0.292	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	134.1	174.2	-25.2	35	0	0	0	112.3	I212 V214 Y215 I248	I212-P257 HydrophobicContact CG2-CG 4.32Å; V214-P257 WeakPolarHBondContact CG1-O 3.43Å; V214-P257 HydrophobicContact CG2-CB 4.4Å; Y215-P257 PolarHBondContact N-O 3.1Å; I248-P257 HydrophobicContact CG2-CB 3.79Å; I248-P257 HydrophobicContact CG2-CG 4.44Å; I248-P257 WeakPolarHBondContact O-CA 3.24Å
258	G	96.7	Very high	95.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-9.2	-176.7	0	0	0	0	0	115.1	Y215 F247 W256 D260 Y261	Y215-G258 CarbonylContact O-C 3.53Å; F247-G258 WeakPolarHBondContact O-CA 3.5Å; F247-G258 PolarHBondContact O-N 3.02Å; W256-G258 PolarHBondContact O-N 3.49Å; G258-D260 VanDerWaalsContact C-N 3.28Å; G258-D260 PolarHBondContact O-N 3.25Å; G258-D260 VanDerWaalsContact O-N 3.11Å; G258-Y261 PolarHBondContact O-N 2.84Å
259	Y	97.9	Very high	95.2	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.008	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-45.2	-169.4	-176.5	-93.6	0	0	0	113.6	R140 S219 T220 Q236 E252 V255 W256 Y261	R140-Y259 WeakPolarHBondContact CB-OH 3.05Å; R140-Y259 WeakPolarHBondContact CD-OH 2.95Å; R140-Y259 VanDerWaalsContact CG-OH 3.23Å; R140-Y259 WeakPolarHBondContact CG-OH 3.37Å; R140-Y259 PolarHBondContact NH1-OH 2.85Å; S219-Y259 VanDerWaalsContact CB-CE2 3.46Å; T220-Y259 WeakPolarHBondContact CG2-OH 3.37Å; Q236-Y259 PolarHBondContact NE2-O 2.89Å; Q236-Y259 PolarHBondContact OE1-O 2.96Å; E252-Y259 HydrophobicContact CB-CD1 4.26Å; E252-Y259 HydrophobicContact CB-CE1 4.32Å; E252-Y259 HydrophobicContact CG-CD1 4.29Å; E252-Y259 HydrophobicContact CG-CE1 4.09Å; V255-Y259 HydrophobicContact CB-CD1 4.07Å; V255-Y259 HydrophobicContact CB-CD2 3.71Å; V255-Y259 HydrophobicContact CB-CE2 4.28Å; V255-Y259 HydrophobicContact CB-CG 3.59Å; V255-Y259 HydrophobicContact CG1-CD1 4.05Å; V255-Y259 HydrophobicContact CG1-CD2 3.9Å; V255-Y259 HydrophobicContact CG1-CE1 4.12Å; V255-Y259 HydrophobicContact CG1-CE2 3.96Å; V255-Y259 HydrophobicContact CG1-CG 3.95Å; V255-Y259 HydrophobicContact CG2-CD1 3.89Å; V255-Y259 HydrophobicContact CG2-CD2 4.32Å; V255-Y259 HydrophobicContact CG2-CG 3.67Å; W256-Y259 HydrophobicContact CD2-CD2 4.1Å; W256-Y259 AromaticContact CE2-CD2 3.62Å; W256-Y259 HydrophobicContact CE3-CD2 4.48Å; W256-Y259 HydrophobicContact CH2-CD2 4.06Å; W256-Y259 AromaticContact CH2-CE2 3.9Å; W256-Y259 HydrophobicContact CH2-CE2 3.9Å; W256-Y259 AromaticContact CZ2-CD2 3.66Å; W256-Y259 HydrophobicContact CZ2-CD2 3.66Å; W256-Y259 AromaticContact CZ2-CE2 3.82Å; W256-Y259 HydrophobicContact CZ2-CE2 3.82Å; W256-Y259 HydrophobicContact CZ3-CD2 4.44Å; W256-Y259 HydrophobicContact CZ3-CE2 4.46Å; W256-Y259 AromaticContact NE1-CD2 3.89Å; W256-Y259 VanDerWaalsContact O-CB 3.3Å; W256-Y259 WeakPolarHBondContact O-CB 3.48Å; W256-Y259 PolarHBondContact O-N 2.87Å; Y259-Y261 PolarHBondContact O-N 3.37Å
260	D	97.2	Very high	95.3	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-5.9	-175.4	-56.5	-5.2	0	0	0	113.9	V241 T250 K251 G258 S367	V241-D260 HydrophobicContact CG1-CB 4.46Å; T250-D260 WeakPolarHBondContact CA-OD2 2.97Å; K251-D260 PolarHBondContact N-OD2 2.79Å; G258-D260 VanDerWaalsContact C-N 3.28Å; G258-D260 PolarHBondContact O-N 3.25Å; G258-D260 VanDerWaalsContact O-N 3.11Å; D260-S367 WeakPolarHBondContact O-CA 3.46Å; D260-S367 WeakPolarHBondContact O-CB 3.33Å
261	Y	98.4	Very high	95.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.			trans	-123.4	135.5	-175.1	-77.2	-82	0	0	0	112.3	L216 G243 G244 F247 G258 Y259 N294 S338 L365	L216-Y261 CarbonylContact C-O 3.56Å; L216-Y261 WeakPolarHBondContact CA-O 3.21Å; G243-Y261 PolarHBondContact O-OH 3.24Å; G244-Y261 WeakPolarHBondContact O-CE2 3.42Å; G244-Y261 PolarHBondContact O-OH 3.37Å; F247-Y261 HydrophobicContact CB-CD2 3.65Å; F247-Y261 HydrophobicContact CB-CE2 3.77Å; F247-Y261 HydrophobicContact CB-CG 4.4Å; G258-Y261 PolarHBondContact O-N 2.84Å; Y259-Y261 PolarHBondContact O-N 3.37Å; Y261-N294 HydrophobicContact CD1-CB 4.41Å; Y261-N294 HydrophobicContact CE1-CB 3.71Å; Y261-N294 PolarHBondContact OH-ND2 2.68Å; Y261-S338 VanDerWaalsContact OH-CB 3.23Å; Y261-S338 WeakPolarHBondContact OH-CB 3.4Å; Y261-L365 HydrophobicContact CD1-CB 3.71Å; Y261-L365 HydrophobicContact CE1-CB 4.35Å; Y261-L365 HydrophobicContact CG-CB 4.19Å
262	L	98.4	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.3	159.3	-166.2	60.3	0	0	0	109.2	L216 N217 D218 L237 W264 L365 I366	L216-L262 WeakPolarHBondContact O-CD1 3.36Å; N217-L262 VanDerWaalsContact C-CD1 3.43Å; D218-L262 HydrophobicContact CB-CD1 3.68Å; D218-L262 HydrophobicContact CB-CD2 4.29Å; L237-L262 HydrophobicContact CD1-CD2 3.82Å; L237-L262 HydrophobicContact CD2-CB 3.87Å; L237-L262 HydrophobicContact CD2-CD2 4.01Å; L237-L262 HydrophobicContact CG-CB 4.48Å; L237-L262 HydrophobicContact CG-CD2 3.8Å; L262-W264 HydrophobicContact CB-CH2 4.16Å; L262-W264 HydrophobicContact CB-CZ2 4.44Å; L262-W264 HydrophobicContact CD2-CH2 3.64Å; L262-W264 HydrophobicContact CD2-CZ2 3.36Å; L262-W264 HydrophobicContact CG-CH2 3.71Å; L262-W264 HydrophobicContact CG-CZ2 3.51Å; L262-W264 HydrophobicContact CG-CZ3 4.47Å; L262-L365 WeakPolarHBondContact O-CA 3.4Å; L262-I366 PolarHBondContact N-O 3.37Å; L262-I366 PolarHBondContact O-N 2.86Å
263	G	98.4	Very high	96.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	137.7	-168	0	0	0	0	0	114.9	G204 H205 L216 L364	G204-G263 CarbonylContact C-O 3.46Å; G204-G263 WeakPolarHBondContact CA-O 3.46Å; H205-G263 PolarHBondContact N-O 3.4Å; L216-G263 PolarHBondContact O-N 3.11Å; G263-L364 WeakPolarHBondContact CA-O 3.44Å
264	W	98.7	Very high	96.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.7	179.5	-53	-87.1	0	0	0	111	A201 P202 L262 L269 V274 I276 F359 W363 L364 I366	A201-W264 HydrophobicContact CB-CZ2 4.42Å; P202-W264 PolarHBondContact O-NE1 3Å; L262-W264 HydrophobicContact CB-CH2 4.16Å; L262-W264 HydrophobicContact CB-CZ2 4.44Å; L262-W264 HydrophobicContact CD2-CH2 3.64Å; L262-W264 HydrophobicContact CD2-CZ2 3.36Å; L262-W264 HydrophobicContact CG-CH2 3.71Å; L262-W264 HydrophobicContact CG-CZ2 3.51Å; L262-W264 HydrophobicContact CG-CZ3 4.47Å; W264-L269 HydrophobicContact CB-CD2 4.47Å; W264-V274 HydrophobicContact CB-CG2 3.76Å; W264-V274 HydrophobicContact CD2-CB 4.36Å; W264-V274 HydrophobicContact CD2-CG1 3.69Å; W264-V274 HydrophobicContact CD2-CG2 3.76Å; W264-V274 HydrophobicContact CE3-CB 4.38Å; W264-V274 HydrophobicContact CE3-CG1 3.95Å; W264-V274 HydrophobicContact CE3-CG2 3.81Å; W264-V274 HydrophobicContact CG-CG1 4.19Å; W264-V274 HydrophobicContact CG-CG2 3.77Å; W264-V274 HydrophobicContact CH2-CG1 4.16Å; W264-V274 HydrophobicContact CZ2-CG1 3.91Å; W264-V274 HydrophobicContact CZ3-CG1 4.19Å; W264-I276 HydrophobicContact CH2-CD1 4.01Å; W264-I276 HydrophobicContact CZ2-CD1 4.45Å; W264-F359 HydrophobicContact CB-CE1 4.38Å; W264-F359 HydrophobicContact CB-CZ 4.07Å; W264-F359 WeakPolarHBondContact O-CE1 3.41Å; W264-W363 VanDerWaalsContact C-CE3 3.45Å; W264-W363 WeakPolarHBondContact O-CA 3.26Å; W264-L364 HydrophobicContact CE3-CD2 4.5Å; W264-L364 HydrophobicContact CE3-CG 4.4Å; W264-L364 PolarHBondContact N-O 3.23Å; W264-L364 PolarHBondContact O-N 2.93Å; W264-I366 HydrophobicContact CZ3-CB 4.31Å; W264-I366 HydrophobicContact CZ3-CD1 4.04Å; W264-I366 HydrophobicContact CZ3-CG1 4.18Å
265	S	98.3	Very high	97.3	Very high	12 Å²	12	38.2 Å²	38.2	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.5	167.3	163.9	0	0	0	0	110.1	H205 E267 A268 L269	H205-S265 PolarHBondContact ND1-N 2.85Å; S265-E267 PolarHBondContact O-N 2.67Å; S265-E267 PolarHBondContact OG-N 3.48Å; S265-A268 PolarHBondContact O-N 2.47Å; S265-A268 PolarHBondContact OG-N 2.86Å; S265-L269 WeakPolarHBondContact O-CB 3.36Å; S265-L269 PolarHBondContact O-N 2.82Å
266	R	98.1	Very high	97.5	Very high	130 Å²	130	37.1 Å²	37.1	49%	0.491	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-38.7	174.5	-176.1	179.7	-179.1	179	0.8	112.3	G270 F359 R362	R266-G270 PolarHBondContact O-N 2.78Å; R266-F359 HydrophobicContact CB-CB 4.47Å; R266-F359 HydrophobicContact CB-CD1 3.95Å; R266-F359 HydrophobicContact CB-CD2 3.96Å; R266-F359 HydrophobicContact CB-CE1 4.13Å; R266-F359 HydrophobicContact CB-CE2 4.16Å; R266-F359 HydrophobicContact CB-CG 3.87Å; R266-F359 HydrophobicContact CB-CZ 4.24Å; R266-F359 HydrophobicContact CG-CB 4.34Å; R266-F359 HydrophobicContact CG-CD2 3.85Å; R266-F359 HydrophobicContact CG-CE2 4.31Å; R266-F359 HydrophobicContact CG-CG 4.02Å; R266-R362 WeakPolarHBondContact CB-O 3.26Å; R266-R362 PolarHBondContact N-O 3.49Å
267	E	97.3	Very high	97.7	Very high	176 Å²	176	35 Å²	35	82%	0.822	21%	0.206	S	C	*	.	H	α-helix	trans	-70.6	-51.4	-178.9	-178.6	178.3	-174.5	0	0	111.2	S265 L269 G270	S265-E267 PolarHBondContact O-N 2.67Å; S265-E267 PolarHBondContact OG-N 3.48Å; E267-L269 VanDerWaalsContact C-N 3.3Å; E267-L269 PolarHBondContact O-N 2.89Å; E267-G270 PolarHBondContact O-N 3.33Å
268	A	96.9	Very high	97.8	Very high	70 Å²	70	33 Å²	33	58%	0.579	19%	0.192	S	C	*	.	H	α-helix	trans	-67.5	-32.1	-178.3	0	0	0	0	0	112.4	H205 S265 G270	H205-A268 WeakPolarHBondContact ND1-CB 3.5Å; S265-A268 PolarHBondContact O-N 2.47Å; S265-A268 PolarHBondContact OG-N 2.86Å; A268-G270 VanDerWaalsContact C-N 3.33Å
269	L	96.7	Very high	97.9	Very high	35 Å²	35	35.5 Å²	35.5	18%	0.183	20%	0.204	C	C	.	.	H	α-helix	trans	-75.7	-23.1	177	-160	66.8	0	0	0	112.3	P202 W264 S265 E267 Q271 V274 F359	P202-L269 HydrophobicContact CB-CD1 3.77Å; P202-L269 HydrophobicContact CG-CD1 4.06Å; W264-L269 HydrophobicContact CB-CD2 4.47Å; S265-L269 WeakPolarHBondContact O-CB 3.36Å; S265-L269 PolarHBondContact O-N 2.82Å; E267-L269 VanDerWaalsContact C-N 3.3Å; E267-L269 PolarHBondContact O-N 2.89Å; L269-Q271 HydrophobicContact CB-CG 4.3Å; L269-Q271 HydrophobicContact CD2-CG 3.73Å; L269-Q271 VanDerWaalsContact CD2-NE2 3.33Å; L269-Q271 HydrophobicContact CG-CG 3.64Å; L269-Q271 PolarHBondContact O-N 2.81Å; L269-V274 HydrophobicContact CD2-CG2 3.89Å; L269-F359 HydrophobicContact CD2-CE2 4.09Å; L269-F359 HydrophobicContact CD2-CZ 4.08Å
270	G	96.5	Very high	97.9	Very high	70 Å²	70	35.8 Å²	35.8	72%	0.722	21%	0.205	S	C	*	.			trans	69.7	11.6	177.4	0	0	0	0	0	115.3	R266 E267 A268	R266-G270 PolarHBondContact O-N 2.78Å; E267-G270 PolarHBondContact O-N 3.33Å; A268-G270 VanDerWaalsContact C-N 3.33Å
271	Q	95.9	Very high	97.8	Very high	77 Å²	77	39 Å²	39	36%	0.36	22%	0.22	S	C	.	.	S	Bend	trans	-137.8	160.8	-178.2	54.5	177.1	9.5	0	0	112.5	L269 S273	L269-Q271 HydrophobicContact CB-CG 4.3Å; L269-Q271 HydrophobicContact CD2-CG 3.73Å; L269-Q271 VanDerWaalsContact CD2-NE2 3.33Å; L269-Q271 HydrophobicContact CG-CG 3.64Å; L269-Q271 PolarHBondContact O-N 2.81Å; Q271-S273 VanDerWaalsContact C-N 3.31Å; Q271-S273 VanDerWaalsContact CD-O 3.22Å; Q271-S273 VanDerWaalsContact CG-O 3.24Å; Q271-S273 WeakPolarHBondContact CG-O 3.41Å; Q271-S273 PolarHBondContact NE2-O 2.8Å; Q271-S273 PolarHBondContact O-N 3.36Å
272	G	97.4	Very high	97.6	Very high	33 Å²	33	42.3 Å²	42.3	34%	0.34	24%	0.235	S	C	.	.	S	Bend	trans	-80.9	-3.8	-176.6	0	0	0	0	0	115.3	F359	G272-F359 WeakPolarHBondContact O-CD2 3.49Å; G272-F359 PolarHBondContact O-N 3.46Å; G272-F359 VanDerWaalsContact O-N 3.13Å
273	S	98.6	Very high	97.5	Very high	8 Å²	8	43.7 Å²	43.7	6%	0.056	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	157.8	180	56.3	0	0	0	0	112.2	Q271 D275 F357	Q271-S273 VanDerWaalsContact C-N 3.31Å; Q271-S273 VanDerWaalsContact CD-O 3.22Å; Q271-S273 VanDerWaalsContact CG-O 3.24Å; Q271-S273 WeakPolarHBondContact CG-O 3.41Å; Q271-S273 PolarHBondContact NE2-O 2.8Å; Q271-S273 PolarHBondContact O-N 3.36Å; S273-D275 PolarHBondContact OG-OD1 3.37Å; S273-F357 CarbonylContact C-O 3.59Å; S273-F357 WeakPolarHBondContact CA-O 3.47Å; S273-F357 WeakPolarHBondContact CB-O 3.46Å
274	V	98.7	Very high	97.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	121	162.1	-177.7	0	0	0	0	107.5	P202 W264 L269 I276 K356 F357 F359 L364	P202-V274 HydrophobicContact CG-CG1 4.45Å; W264-V274 HydrophobicContact CB-CG2 3.76Å; W264-V274 HydrophobicContact CD2-CB 4.36Å; W264-V274 HydrophobicContact CD2-CG1 3.69Å; W264-V274 HydrophobicContact CD2-CG2 3.76Å; W264-V274 HydrophobicContact CE3-CB 4.38Å; W264-V274 HydrophobicContact CE3-CG1 3.95Å; W264-V274 HydrophobicContact CE3-CG2 3.81Å; W264-V274 HydrophobicContact CG-CG1 4.19Å; W264-V274 HydrophobicContact CG-CG2 3.77Å; W264-V274 HydrophobicContact CH2-CG1 4.16Å; W264-V274 HydrophobicContact CZ2-CG1 3.91Å; W264-V274 HydrophobicContact CZ3-CG1 4.19Å; L269-V274 HydrophobicContact CD2-CG2 3.89Å; V274-I276 HydrophobicContact CG1-CD1 4.3Å; V274-I276 HydrophobicContact CG1-CG1 3.99Å; V274-K356 WeakPolarHBondContact O-CA 3.39Å; V274-F357 HydrophobicContact CB-CB 4.47Å; V274-F357 PolarHBondContact N-O 3.4Å; V274-F357 PolarHBondContact O-N 3.06Å; V274-F359 HydrophobicContact CG2-CE1 4.21Å; V274-F359 HydrophobicContact CG2-CE2 3.94Å; V274-F359 HydrophobicContact CG2-CZ 3.5Å; V274-F359 VanDerWaalsContact CG2-CZ 3.5Å; V274-L364 HydrophobicContact CB-CD2 4.29Å; V274-L364 HydrophobicContact CG2-CD2 3.9Å
275	D	98.2	Very high	97.3	Very high	25 Å²	25	46.4 Å²	46.4	13%	0.134	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.3	179	-78.7	31.6	0	0	0	108.7	P202 S273 R354 K356	P202-D275 WeakPolarHBondContact CD-O 3.3Å; S273-D275 PolarHBondContact OG-OD1 3.37Å; D275-R354 IonicContact OD2-CZ 3.72Å; D275-R354 IonicContact OD2-NE 2.73Å; D275-R354 IonicContact OD2-NH2 3.64Å; D275-R354 PolarHBondContact OD2-NH2 2.83Å; D275-K356 WeakPolarHBondContact OD1-CD 3.2Å; D275-K356 WeakPolarHBondContact OD1-CG 3.5Å; D275-K356 VanDerWaalsContact OD2-CE 3.24Å; D275-K356 WeakPolarHBondContact OD2-CE 3.33Å; D275-K356 IonicContact OD2-NZ 3.59Å
276	I	98.8	Very high	97.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.9	175.9	-50	-179	0	0	0	109	T200 A201 L237 W264 V274 F278 C355 F357 I369	T200-I276 VanDerWaalsContact O-CA 3.31Å; T200-I276 WeakPolarHBondContact O-CA 3.24Å; T200-I276 WeakPolarHBondContact O-CG2 3.17Å; A201-I276 HydrophobicContact CB-CG1 4.16Å; A201-I276 HydrophobicContact CB-CG2 4.25Å; L237-I276 HydrophobicContact CD1-CD1 4.29Å; W264-I276 HydrophobicContact CH2-CD1 4.01Å; W264-I276 HydrophobicContact CZ2-CD1 4.45Å; V274-I276 HydrophobicContact CG1-CD1 4.3Å; V274-I276 HydrophobicContact CG1-CG1 3.99Å; I276-F278 HydrophobicContact CB-CE2 3.9Å; I276-F278 HydrophobicContact CB-CZ 3.79Å; I276-F278 HydrophobicContact CD1-CZ 4.49Å; I276-F278 HydrophobicContact CG2-CD1 4.21Å; I276-F278 HydrophobicContact CG2-CD2 4.31Å; I276-F278 HydrophobicContact CG2-CE1 3.57Å; I276-F278 HydrophobicContact CG2-CE2 3.7Å; I276-F278 HydrophobicContact CG2-CZ 3.28Å; I276-C355 PolarHBondContact N-O 2.73Å; I276-C355 PolarHBondContact O-N 2.98Å; I276-F357 HydrophobicContact CB-CE2 4.12Å; I276-F357 HydrophobicContact CD1-CD2 4.02Å; I276-F357 HydrophobicContact CD1-CE2 3.82Å; I276-F357 HydrophobicContact CG1-CD2 4.14Å; I276-F357 HydrophobicContact CG1-CE2 4.04Å; I276-I369 HydrophobicContact CD1-CD1 4.11Å
277	E	98.8	Very high	97.1	Very high	49 Å²	49	43 Å²	43	23%	0.229	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.9	174.5	-171.7	175.1	104.8	0	0	110.1	Y199 T200 H279 I352 L353 R354	Y199-E277 CarbonylContact C-O 3.59Å; Y199-E277 WeakPolarHBondContact CA-O 3.46Å; T200-E277 PolarHBondContact N-O 3.07Å; T200-E277 PolarHBondContact O-N 2.93Å; E277-H279 IonicContact OE1-CD2 3.62Å; E277-H279 IonicContact OE1-CE1 2.8Å; E277-H279 PolarHBondContact OE1-CE1 2.91Å; E277-H279 IonicContact OE1-NE2 3.82Å; E277-H279 PolarHBondContact OE1-NE2 2.88Å; E277-I352 HydrophobicContact CG-CG2 3.55Å; E277-L353 CarbonylContact C-O 3.44Å; E277-L353 VanDerWaalsContact CA-O 3.29Å; E277-L353 WeakPolarHBondContact CA-O 3.48Å; E277-R354 HydrophobicContact CG-CB 4.39Å
278	F	98.8	Very high	97	Very high	1 Å²	1	37 Å²	37	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.2	-176.7	-55.6	-85.6	0	0	0	109.3	L196 I276 F280 I352 L353 C355 F357 I369 F371	L196-F278 HydrophobicContact CD1-CB 3.75Å; L196-F278 HydrophobicContact CD1-CD1 3.91Å; L196-F278 HydrophobicContact CD1-CG 4.32Å; L196-F278 HydrophobicContact CD2-CD1 4.48Å; I276-F278 HydrophobicContact CB-CE2 3.9Å; I276-F278 HydrophobicContact CB-CZ 3.79Å; I276-F278 HydrophobicContact CD1-CZ 4.49Å; I276-F278 HydrophobicContact CG2-CD1 4.21Å; I276-F278 HydrophobicContact CG2-CD2 4.31Å; I276-F278 HydrophobicContact CG2-CE1 3.57Å; I276-F278 HydrophobicContact CG2-CE2 3.7Å; I276-F278 HydrophobicContact CG2-CZ 3.28Å; F278-F280 HydrophobicContact CB-CE2 3.66Å; F278-F280 HydrophobicContact CB-CZ 4.08Å; F278-I352 CarbonylContact O-C 2.92Å; F278-I352 VanDerWaalsContact O-CA 3.28Å; F278-I352 WeakPolarHBondContact O-CA 3.22Å; F278-I352 WeakPolarHBondContact O-CG2 3.49Å; F278-L353 HydrophobicContact CB-CB 4.35Å; F278-L353 HydrophobicContact CD2-CB 4.28Å; F278-L353 PolarHBondContact N-O 2.89Å; F278-L353 PolarHBondContact O-N 2.89Å; F278-C355 HydrophobicContact CE2-CB 4.22Å; F278-F357 HydrophobicContact CE2-CE2 4.46Å; F278-F357 HydrophobicContact CZ-CE2 4.46Å; F278-I369 HydrophobicContact CE1-CB 4.5Å; F278-I369 HydrophobicContact CE1-CD1 4.01Å; F278-I369 HydrophobicContact CE1-CG2 4.06Å; F278-I369 HydrophobicContact CZ-CD1 3.7Å; F278-I369 HydrophobicContact CZ-CG2 4.07Å; F278-F371 HydrophobicContact CB-CZ 4.17Å; F278-F371 AromaticContact CD1-CE2 3.74Å; F278-F371 HydrophobicContact CD1-CE2 3.74Å; F278-F371 AromaticContact CD1-CZ 3.61Å; F278-F371 HydrophobicContact CD1-CZ 3.61Å; F278-F371 HydrophobicContact CD2-CE1 4.45Å; F278-F371 AromaticContact CD2-CZ 3.74Å; F278-F371 HydrophobicContact CD2-CZ 3.74Å; F278-F371 HydrophobicContact CE1-CE2 4.04Å; F278-F371 AromaticContact CE1-CZ 3.83Å; F278-F371 HydrophobicContact CE1-CZ 3.83Å; F278-F371 AromaticContact CE2-CZ 3.94Å; F278-F371 HydrophobicContact CE2-CZ 3.94Å; F278-F371 HydrophobicContact CG-CE2 4.06Å; F278-F371 AromaticContact CG-CZ 3.56Å; F278-F371 HydrophobicContact CG-CZ 3.56Å; F278-F371 AromaticContact CZ-CZ 3.98Å; F278-F371 HydrophobicContact CZ-CZ 3.98Å
279	H	98.3	Very high	97.1	Very high	54 Å²	54	33.6 Å²	33.6	25%	0.25	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.2	179.2	-70.9	-117.1	0	0	0	108.6	Y197 A198 E277	Y197-H279 WeakPolarHBondContact CA-O 3.36Å; Y197-H279 WeakPolarHBondContact CB-O 3.26Å; Y197-H279 PolarHBondContact N-O 3.28Å; A198-H279 HydrophobicContact CB-CB 4.49Å; A198-H279 PolarHBondContact N-O 2.92Å; A198-H279 PolarHBondContact O-N 3Å; E277-H279 IonicContact OE1-CD2 3.62Å; E277-H279 IonicContact OE1-CE1 2.8Å; E277-H279 PolarHBondContact OE1-CE1 2.91Å; E277-H279 IonicContact OE1-NE2 3.82Å; E277-H279 PolarHBondContact OE1-NE2 2.88Å
280	F	97.8	Very high	97.1	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	146	179.8	-63.1	-96.3	0	0	0	110.2	G195 L196 F278 K282 F286 Q351 L353 F371	G195-F280 VanDerWaalsContact O-CA 3.31Å; G195-F280 WeakPolarHBondContact O-CA 3.26Å; L196-F280 HydrophobicContact CB-CD1 4.42Å; L196-F280 HydrophobicContact CB-CE1 4.13Å; L196-F280 HydrophobicContact CD1-CE1 4.2Å; L196-F280 HydrophobicContact CD1-CE2 4.4Å; L196-F280 HydrophobicContact CD1-CZ 4.05Å; F278-F280 HydrophobicContact CB-CE2 3.66Å; F278-F280 HydrophobicContact CB-CZ 4.08Å; F280-K282 VanDerWaalsContact C-N 3.27Å; F280-K282 PolarHBondContact O-N 3.07Å; F280-F286 HydrophobicContact CD1-CE1 4.12Å; F280-F286 AromaticContact CD1-CZ 3.79Å; F280-F286 HydrophobicContact CD1-CZ 3.79Å; F280-F286 HydrophobicContact CD2-CE1 4.24Å; F280-F286 HydrophobicContact CD2-CE2 4.45Å; F280-F286 AromaticContact CD2-CZ 3.54Å; F280-F286 HydrophobicContact CD2-CZ 3.54Å; F280-F286 AromaticContact CE1-CE1 3.55Å; F280-F286 HydrophobicContact CE1-CE1 3.55Å; F280-F286 AromaticContact CE1-CZ 3.69Å; F280-F286 HydrophobicContact CE1-CZ 3.69Å; F280-F286 AromaticContact CE2-CE1 3.7Å; F280-F286 HydrophobicContact CE2-CE1 3.7Å; F280-F286 AromaticContact CE2-CZ 3.43Å; F280-F286 HydrophobicContact CE2-CZ 3.43Å; F280-F286 VanDerWaalsContact CE2-CZ 3.43Å; F280-F286 HydrophobicContact CG-CE1 4.45Å; F280-F286 AromaticContact CG-CZ 3.74Å; F280-F286 HydrophobicContact CG-CZ 3.74Å; F280-F286 AromaticContact CZ-CE1 3.32Å; F280-F286 HydrophobicContact CZ-CE1 3.32Å; F280-F286 AromaticContact CZ-CZ 3.52Å; F280-F286 HydrophobicContact CZ-CZ 3.52Å; F280-Q351 WeakPolarHBondContact CD2-O 3.09Å; F280-Q351 PolarHBondContact N-O 3.43Å; F280-Q351 WeakPolarHBondContact O-CG 3.12Å; F280-L353 HydrophobicContact CD2-CD1 4.27Å; F280-L353 HydrophobicContact CE2-CD1 3.78Å; F280-F371 HydrophobicContact CE1-CB 4.11Å; F280-F371 AromaticContact CE1-CD2 3.84Å; F280-F371 HydrophobicContact CE1-CD2 3.84Å; F280-F371 HydrophobicContact CE1-CE2 4.41Å; F280-F371 AromaticContact CE1-CG 3.91Å; F280-F371 HydrophobicContact CE1-CG 3.91Å; F280-F371 HydrophobicContact CZ-CB 4.31Å; F280-F371 AromaticContact CZ-CD1 3.88Å; F280-F371 HydrophobicContact CZ-CD1 3.88Å; F280-F371 AromaticContact CZ-CD2 3.63Å; F280-F371 HydrophobicContact CZ-CD2 3.63Å; F280-F371 HydrophobicContact CZ-CE1 4.05Å; F280-F371 AromaticContact CZ-CE2 3.82Å; F280-F371 HydrophobicContact CZ-CE2 3.82Å; F280-F371 AromaticContact CZ-CG 3.66Å; F280-F371 HydrophobicContact CZ-CG 3.66Å; F280-F371 HydrophobicContact CZ-CZ 4.03Å
281	E	94.7	Very high	97.2	Very high	72 Å²	72	29.1 Å²	29.1	34%	0.336	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	-45.6	-178.4	-176.7	-175.6	-156.1	0	0	111.3	L99 G195 Q351	L99-E281 HydrophobicContact CD1-CB 4.02Å; L99-E281 HydrophobicContact CD1-CG 4.29Å; G195-E281 PolarHBondContact O-N 2.91Å; E281-Q351 PolarHBondContact O-NE2 2.98Å
282	K	93.9	Very high	97.3	Very high	70 Å²	70	25.9 Å²	25.9	30%	0.304	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	157.6	178.3	-63	-171.1	173.8	-161.5	0	110.8	F280 E378	F280-K282 VanDerWaalsContact C-N 3.27Å; F280-K282 PolarHBondContact O-N 3.07Å; K282-E378 IonicContact NZ-OE1 3.91Å; K282-E378 IonicContact NZ-OE2 2.72Å; K282-E378 PolarHBondContact NZ-OE2 2.72Å
283	P	95.9	Very high	97.4	Very high	28 Å²	28	24.3 Å²	24.3	18%	0.182	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	143.2	171.5	-13.5	26.9	0	0	0	111.1	A350 Q351 F376	P283-A350 CarbonylContact C-O 3.56Å; P283-A350 WeakPolarHBondContact CA-O 3.15Å; P283-Q351 HydrophobicContact CB-CB 4.21Å; P283-Q351 HydrophobicContact CG-CB 4.25Å; P283-Q351 HydrophobicContact CG-CG 4.46Å; P283-F376 CarbonylContact C-O 3.55Å; P283-F376 WeakPolarHBondContact CB-O 3.34Å; P283-F376 PolarHBondContact O-N 3.47Å; P283-F376 VanDerWaalsContact O-O 3.13Å
284	R	96.7	Very high	97.4	Very high	22 Å²	22	24 Å²	24	8%	0.083	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	153	-169.6	-79.3	171.8	161.9	-99.8	2.4	111.6	N193 D194 F286 P349 A350 S373 E374	N193-R284 PolarHBondContact O-NH1 2.96Å; N193-R284 PolarHBondContact O-NH2 2.83Å; D194-R284 VanDerWaalsContact O-CZ 3.29Å; D194-R284 PolarHBondContact O-NH1 3.02Å; R284-F286 HydrophobicContact CB-CD2 4.28Å; R284-F286 HydrophobicContact CB-CE2 3.6Å; R284-F286 HydrophobicContact CB-CZ 3.85Å; R284-F286 WeakPolarHBondContact O-CD2 3.5Å; R284-F286 WeakPolarHBondContact O-CE2 3.36Å; R284-P349 CarbonylContact O-C 3.54Å; R284-P349 VanDerWaalsContact O-CA 3.29Å; R284-P349 WeakPolarHBondContact O-CA 3.24Å; R284-A350 PolarHBondContact N-O 2.77Å; R284-A350 PolarHBondContact O-N 3.41Å; R284-S373 WeakPolarHBondContact CD-OG 3.46Å; R284-S373 PolarHBondContact NH1-O 2.81Å; R284-S373 PolarHBondContact NH1-OG 2.97Å; R284-E374 CarbonylContact C-O 3.6Å; R284-E374 WeakPolarHBondContact CA-O 3.39Å; R284-E374 WeakPolarHBondContact CB-O 3.28Å
285	L	96.5	Very high	97.3	Very high	36 Å²	36	24 Å²	24	19%	0.188	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.4	171.5	-160.5	74.8	0	0	0	109.2	G347 P349 S373 E374 F376	L285-G347 WeakPolarHBondContact CD1-O 3.28Å; L285-P349 HydrophobicContact CD1-CB 4.15Å; L285-S373 WeakPolarHBondContact O-CA 3.45Å; L285-S373 WeakPolarHBondContact O-CB 3.26Å; L285-E374 HydrophobicContact CB-CG 3.84Å; L285-E374 WeakPolarHBondContact CD2-OE1 3.41Å; L285-E374 PolarHBondContact N-O 3.1Å; L285-E374 PolarHBondContact O-N 2.85Å; L285-E374 VanDerWaalsContact O-N 3.15Å; L285-F376 HydrophobicContact CB-CB 4.25Å; L285-F376 HydrophobicContact CB-CD2 4.45Å; L285-F376 HydrophobicContact CD1-CD2 4.07Å; L285-F376 HydrophobicContact CD1-CE2 4.32Å
286	F	97.3	Very high	97.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	115	-171.1	-73.9	-90.6	0	0	0	112.6	F280 R284 L345 G347 R348 A350 L353 F371	F280-F286 HydrophobicContact CD1-CE1 4.12Å; F280-F286 AromaticContact CD1-CZ 3.79Å; F280-F286 HydrophobicContact CD1-CZ 3.79Å; F280-F286 HydrophobicContact CD2-CE1 4.24Å; F280-F286 HydrophobicContact CD2-CE2 4.45Å; F280-F286 AromaticContact CD2-CZ 3.54Å; F280-F286 HydrophobicContact CD2-CZ 3.54Å; F280-F286 AromaticContact CE1-CE1 3.55Å; F280-F286 HydrophobicContact CE1-CE1 3.55Å; F280-F286 AromaticContact CE1-CZ 3.69Å; F280-F286 HydrophobicContact CE1-CZ 3.69Å; F280-F286 AromaticContact CE2-CE1 3.7Å; F280-F286 HydrophobicContact CE2-CE1 3.7Å; F280-F286 AromaticContact CE2-CZ 3.43Å; F280-F286 HydrophobicContact CE2-CZ 3.43Å; F280-F286 VanDerWaalsContact CE2-CZ 3.43Å; F280-F286 HydrophobicContact CG-CE1 4.45Å; F280-F286 AromaticContact CG-CZ 3.74Å; F280-F286 HydrophobicContact CG-CZ 3.74Å; F280-F286 AromaticContact CZ-CE1 3.32Å; F280-F286 HydrophobicContact CZ-CE1 3.32Å; F280-F286 AromaticContact CZ-CZ 3.52Å; F280-F286 HydrophobicContact CZ-CZ 3.52Å; R284-F286 HydrophobicContact CB-CD2 4.28Å; R284-F286 HydrophobicContact CB-CE2 3.6Å; R284-F286 HydrophobicContact CB-CZ 3.85Å; R284-F286 WeakPolarHBondContact O-CD2 3.5Å; R284-F286 WeakPolarHBondContact O-CE2 3.36Å; F286-L345 HydrophobicContact CB-CB 3.94Å; F286-L345 HydrophobicContact CB-CD1 3.69Å; F286-L345 HydrophobicContact CB-CG 4.48Å; F286-L345 HydrophobicContact CD1-CD1 3.99Å; F286-L345 HydrophobicContact CG-CD1 4.18Å; F286-L345 CarbonylContact O-C 3.6Å; F286-L345 WeakPolarHBondContact O-CB 3.48Å; F286-G347 WeakPolarHBondContact O-CA 3.23Å; F286-G347 PolarHBondContact O-N 2.74Å; F286-R348 PolarHBondContact N-O 3.28Å; F286-R348 PolarHBondContact O-N 3.19Å; F286-A350 HydrophobicContact CD2-CB 3.82Å; F286-A350 HydrophobicContact CE2-CB 3.69Å; F286-A350 WeakPolarHBondContact CE2-O 3.41Å; F286-L353 HydrophobicContact CD1-CD1 4.21Å; F286-L353 HydrophobicContact CD1-CD2 4.05Å; F286-L353 HydrophobicContact CD2-CD1 3.79Å; F286-L353 HydrophobicContact CE1-CD1 3.91Å; F286-L353 HydrophobicContact CE1-CD2 4.24Å; F286-L353 HydrophobicContact CE2-CD1 3.45Å; F286-L353 VanDerWaalsContact CE2-CD1 3.45Å; F286-L353 HydrophobicContact CG-CD1 4.16Å; F286-L353 HydrophobicContact CG-CD2 4.3Å; F286-L353 HydrophobicContact CZ-CD1 3.52Å; F286-F371 HydrophobicContact CD1-CB 4.3Å; F286-F371 AromaticContact CD1-CD1 3.97Å; F286-F371 HydrophobicContact CD1-CD1 3.97Å; F286-F371 HydrophobicContact CD1-CG 4.49Å; F286-F371 HydrophobicContact CE1-CB 4.04Å; F286-F371 AromaticContact CE1-CD1 3.88Å; F286-F371 HydrophobicContact CE1-CD1 3.88Å; F286-F371 HydrophobicContact CE1-CG 4.14Å
287	N	95.8	Very high	97	Very high	69 Å²	69	28.1 Å²	28.1	37%	0.369	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-59	179	-66.8	-28.4	0	0	0	110.9	L345 G346 L372	N287-L345 PolarHBondContact O-N 3.31Å; N287-G346 PolarHBondContact O-N 3.37Å; N287-L372 WeakPolarHBondContact CB-O 3.48Å; N287-L372 PolarHBondContact N-O 3.23Å
288	N	96.1	Very high	96.6	Very high	50 Å²	50	30.8 Å²	30.8	27%	0.267	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	149.2	-178.1	-73.6	-16.6	0	0	0	111.2	L343 P344 L372	N288-L343 WeakPolarHBondContact CA-O 3.49Å; N288-P344 WeakPolarHBondContact OD1-CA 3.36Å; N288-L372 HydrophobicContact CB-CB 4.22Å; N288-L372 HydrophobicContact CB-CD1 4.13Å; N288-L372 PolarHBondContact N-O 3.47Å; N288-L372 PolarHBondContact O-N 3.01Å
289	M	97.7	Very high	96.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.1	162.7	173.9	174	71.9	0	0	108.2	V291 V307 L343 L345 F357 I369 S370 F371	M289-V291 HydrophobicContact CE-CG2 4.13Å; M289-V291 HydrophobicContact CG-CG2 3.97Å; M289-V291 HydrophobicContact SD-CG2 4.26Å; M289-V307 HydrophobicContact CE-CG1 4.12Å; M289-L343 HydrophobicContact CB-CB 4.37Å; M289-L343 HydrophobicContact CE-CB 4.43Å; M289-L343 HydrophobicContact CE-CD1 3.31Å; M289-L343 PolarHBondContact N-O 2.77Å; M289-L343 WeakPolarHBondContact O-CB 3.23Å; M289-L343 PolarHBondContact O-N 2.89Å; M289-L345 HydrophobicContact CB-CD1 3.83Å; M289-L345 HydrophobicContact CB-CD2 4.33Å; M289-L345 HydrophobicContact CB-CG 4.13Å; M289-F357 HydrophobicContact CE-CE1 3.93Å; M289-F357 HydrophobicContact CE-CZ 3.89Å; M289-F357 HydrophobicContact SD-CZ 4.3Å; M289-I369 HydrophobicContact CG-CG2 4.09Å; M289-I369 HydrophobicContact SD-CG2 4.12Å; M289-S370 CarbonylContact C-O 3.52Å; M289-S370 WeakPolarHBondContact CA-O 3.19Å; M289-F371 HydrophobicContact CB-CD1 4.07Å; M289-F371 HydrophobicContact CB-CE1 4.13Å; M289-F371 HydrophobicContact CG-CD1 4.09Å; M289-F371 HydrophobicContact CG-CE1 3.77Å; M289-F371 HydrophobicContact CG-CZ 4.3Å; M289-F371 HydrophobicContact SD-CD1 4.36Å; M289-F371 HydrophobicContact SD-CE1 3.48Å; M289-F371 WeakPolarHBondContact SD-CE1 3.25Å; M289-F371 HydrophobicContact SD-CZ 3.86Å
290	Q	97.6	Very high	96.3	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.047	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.1	170.5	-73	-171.1	-30.5	0	0	109.5	K28 W29 H30 I341 S342 I369 S370 L372	K28-Q290 PolarHBondContact O-NE2 2.84Å; K28-Q290 VanDerWaalsContact O-NE2 3.09Å; W29-Q290 HydrophobicContact CE3-CB 4.02Å; W29-Q290 HydrophobicContact CH2-CB 4.2Å; W29-Q290 HydrophobicContact CZ3-CB 3.59Å; H30-Q290 VanDerWaalsContact N-OE1 3.17Å; H30-Q290 PolarHBondContact ND1-OE1 3.03Å; Q290-I341 WeakPolarHBondContact CA-O 3.46Å; Q290-S342 PolarHBondContact NE2-OG 3.4Å; Q290-I369 WeakPolarHBondContact O-CA 3.38Å; Q290-S370 PolarHBondContact N-O 2.84Å; Q290-S370 PolarHBondContact O-N 3.44Å; Q290-L372 HydrophobicContact CG-CD1 4.24Å
291	V	98.3	Very high	96.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.1	178.3	-177.4	0	0	0	0	108.8	M289 F304 P340 I341 L343 F357 I366 I369	M289-V291 HydrophobicContact CE-CG2 4.13Å; M289-V291 HydrophobicContact CG-CG2 3.97Å; M289-V291 HydrophobicContact SD-CG2 4.26Å; V291-F304 HydrophobicContact CB-CE1 3.96Å; V291-F304 HydrophobicContact CB-CZ 4.14Å; V291-F304 HydrophobicContact CG1-CE1 3.7Å; V291-F304 HydrophobicContact CG1-CZ 4.36Å; V291-F304 HydrophobicContact CG2-CZ 4.43Å; V291-P340 CarbonylContact O-C 3.58Å; V291-P340 WeakPolarHBondContact O-CA 3.42Å; V291-I341 PolarHBondContact N-O 2.89Å; V291-I341 PolarHBondContact O-N 3.11Å; V291-L343 HydrophobicContact CG2-CD1 4.12Å; V291-F357 HydrophobicContact CG2-CE1 3.96Å; V291-F357 HydrophobicContact CG2-CZ 4.43Å; V291-I366 HydrophobicContact CG1-CD1 3.86Å; V291-I366 HydrophobicContact CG1-CG1 4.01Å; V291-I366 HydrophobicContact CG1-CG2 3.72Å; V291-I369 HydrophobicContact CG1-CG1 4.22Å; V291-I369 HydrophobicContact CG2-CG1 4.38Å; V291-I369 HydrophobicContact CG2-CG2 4.31Å
292	H	98.2	Very high	96.4	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.046	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.5	173.5	-170.7	-90.4	0	0	0	109.9	W29 L242 G243 I366 S367 E368	W29-H292 HydrophobicContact CE3-CB 4.43Å; W29-H292 HydrophobicContact CZ3-CB 4.02Å; L242-H292 HydrophobicContact CD2-CB 3.82Å; G243-H292 PolarHBondContact O-CE1 3.01Å; H292-I366 WeakPolarHBondContact O-CA 3.26Å; H292-S367 PolarHBondContact ND1-OG 2.62Å; H292-S367 PolarHBondContact O-N 3.27Å; H292-E368 HydrophobicContact CB-CB 4.1Å; H292-E368 PolarHBondContact N-O 3.05Å
293	S	98.1	Very high	96.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	145	-172.8	-171.9	0	0	0	0	111.9	S338 R339 L365	S293-S338 WeakPolarHBondContact O-CA 3.21Å; S293-R339 PolarHBondContact N-O 2.75Å; S293-R339 PolarHBondContact O-N 2.65Å; S293-L365 WeakPolarHBondContact CA-O 3.34Å; S293-L365 WeakPolarHBondContact CB-O 3.26Å; S293-L365 PolarHBondContact OG-O 2.7Å
294	N	98.5	Very high	96.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.126	C	C	.	.			trans	-80	141.1	178.3	-167.3	-82.7	0	0	0	111.2	G244 D245 Y261 R296 V301 R302 V303 L365	G244-N294 PolarHBondContact O-ND2 2.92Å; D245-N294 PolarHBondContact O-ND2 2.91Å; Y261-N294 HydrophobicContact CD1-CB 4.41Å; Y261-N294 HydrophobicContact CE1-CB 3.71Å; Y261-N294 PolarHBondContact OH-ND2 2.68Å; N294-R296 WeakPolarHBondContact OD1-CB 3.39Å; N294-R296 PolarHBondContact OD1-N 3.04Å; N294-V301 HydrophobicContact CB-CG1 3.86Å; N294-V301 WeakPolarHBondContact OD1-CG1 3.44Å; N294-R302 CarbonylContact O-C 3.56Å; N294-V303 PolarHBondContact O-N 3.14Å; N294-L365 HydrophobicContact CB-CB 3.99Å; N294-L365 HydrophobicContact CB-CD1 4.27Å; N294-L365 PolarHBondContact N-O 2.83Å
295	N	97.8	Very high	96.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.			trans	-119.9	25.5	-179.6	-161.2	46	0	0	0	113.7	H297 V301 V303 L333 D335 P336 S337	N295-H297 PolarHBondContact O-N 3.49Å; N295-H297 PolarHBondContact O-ND1 3.25Å; N295-V301 CarbonylContact C-O 3.48Å; N295-V303 HydrophobicContact CB-CG2 3.84Å; N295-L333 PolarHBondContact ND2-O 2.82Å; N295-L333 VanDerWaalsContact ND2-O 3.09Å; N295-D335 PolarHBondContact ND2-O 3.3Å; N295-P336 CarbonylContact C-O 3.4Å; N295-P336 WeakPolarHBondContact O-CA 3.24Å; N295-S337 VanDerWaalsContact CB-O 3.27Å; N295-S337 WeakPolarHBondContact CB-O 3.36Å
296	R	96.4	Very high	96.9	Very high	49 Å²	49	27.6 Å²	27.6	19%	0.185	14%	0.139	C	C	.	.			trans	-74.5	66.1	-178	-162.2	171.9	-169.8	-170	24	112.2	D246 F247 N294 T298 Q299 V301 P336	D246-R296 IonicContact OD1-CZ 3.5Å; D246-R296 IonicContact OD1-NH1 3.73Å; D246-R296 PolarHBondContact OD1-NH1 2.88Å; D246-R296 IonicContact OD1-NH2 2.79Å; D246-R296 IonicContact OD2-CZ 3.22Å; D246-R296 IonicContact OD2-NH1 3.74Å; D246-R296 PolarHBondContact OD2-NH1 3.5Å; D246-R296 IonicContact OD2-NH2 2.72Å; D246-R296 PolarHBondContact OD2-NH2 2.67Å; F247-R296 HydrophobicContact CD1-CB 4.35Å; F247-R296 HydrophobicContact CE1-CB 4.28Å; N294-R296 WeakPolarHBondContact OD1-CB 3.39Å; N294-R296 PolarHBondContact OD1-N 3.04Å; R296-T298 PolarHBondContact O-N 3.38Å; R296-T298 VanDerWaalsContact O-N 3.12Å; R296-Q299 VanDerWaalsContact CD-OE1 3.22Å; R296-Q299 PolarHBondContact O-N 2.85Å; R296-V301 CarbonylContact C-O 3.51Å; R296-V301 PolarHBondContact N-O 3.21Å; R296-V301 PolarHBondContact O-N 3.08Å; R296-P336 PolarHBondContact N-O 3.49Å
297	H	93.1	Very high	97	Very high	64 Å²	64	27.6 Å²	27.6	30%	0.296	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-63	-21.4	-175.5	57.4	-84.2	0	0	0	112.5	N295 Q299 G300 V301 K334	N295-H297 PolarHBondContact O-N 3.49Å; N295-H297 PolarHBondContact O-ND1 3.25Å; H297-Q299 PolarHBondContact O-N 3.43Å; H297-Q299 VanDerWaalsContact O-N 3.16Å; H297-G300 PolarHBondContact O-N 2.63Å; H297-V301 WeakPolarHBondContact CA-O 3.46Å; H297-V301 PolarHBondContact N-O 3.02Å; H297-K334 PolarHBondContact CE1-O 3.15Å
298	T	92.2	Very high	97.1	Very high	105 Å²	105	26.4 Å²	26.4	64%	0.644	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-59.7	-20.8	169.9	56.5	0	0	0	0	113.5	R296	R296-T298 PolarHBondContact O-N 3.38Å; R296-T298 VanDerWaalsContact O-N 3.12Å
299	Q	94.1	Very high	97.2	Very high	53 Å²	53	24 Å²	24	25%	0.248	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-112.2	12.3	175.4	-68	-179.7	-34	0	0	112.7	F247 R296 H297 V301 R362	F247-Q299 HydrophobicContact CE1-CB 4.33Å; F247-Q299 HydrophobicContact CZ-CB 4.41Å; R296-Q299 VanDerWaalsContact CD-OE1 3.22Å; R296-Q299 PolarHBondContact O-N 2.85Å; H297-Q299 PolarHBondContact O-N 3.43Å; H297-Q299 VanDerWaalsContact O-N 3.16Å; Q299-V301 VanDerWaalsContact C-N 3.34Å; Q299-R362 PolarHBondContact O-NH2 3.46Å
300	G	95.4	Very high	97.2	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.031	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	19.9	-178.8	0	0	0	0	0	114.6	H297 R362 W363	H297-G300 PolarHBondContact O-N 2.63Å; G300-R362 PolarHBondContact O-N 2.88Å; G300-W363 PolarHBondContact O-N 3.23Å
301	V	98	Very high	97.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-100.6	126	170.7	175.4	0	0	0	0	108.6	M207 F247 N294 N295 R296 H297 Q299 W363 L365	M207-V301 HydrophobicContact CE-CG2 3.64Å; F247-V301 HydrophobicContact CD1-CG2 4.25Å; F247-V301 HydrophobicContact CE1-CB 4.45Å; F247-V301 HydrophobicContact CE1-CG2 3.71Å; F247-V301 HydrophobicContact CZ-CG2 4.14Å; N294-V301 HydrophobicContact CB-CG1 3.86Å; N294-V301 WeakPolarHBondContact OD1-CG1 3.44Å; N295-V301 CarbonylContact C-O 3.48Å; R296-V301 CarbonylContact C-O 3.51Å; R296-V301 PolarHBondContact N-O 3.21Å; R296-V301 PolarHBondContact O-N 3.08Å; H297-V301 WeakPolarHBondContact CA-O 3.46Å; H297-V301 PolarHBondContact N-O 3.02Å; Q299-V301 VanDerWaalsContact C-N 3.34Å; V301-W363 HydrophobicContact CG2-CB 3.86Å; V301-L365 HydrophobicContact CG1-CB 4.2Å; V301-L365 HydrophobicContact CG1-CD1 3.79Å; V301-L365 HydrophobicContact CG1-CG 3.64Å; V301-L365 HydrophobicContact CG2-CD1 3.9Å; V301-L365 HydrophobicContact CG2-CG 4.16Å
302	R	97.8	Very high	97.2	Very high	65 Å²	65	28 Å²	28	25%	0.245	14%	0.138	C	C	.	.			trans	-141.2	147.2	178.1	-164	166.4	-173.4	147.1	3.7	111.2	N294 L330 A360 D361 W363	N294-R302 CarbonylContact O-C 3.56Å; R302-L330 PolarHBondContact NH2-O 3.06Å; R302-L330 VanDerWaalsContact NH2-O 3.08Å; R302-A360 HydrophobicContact CB-CB 4.09Å; R302-A360 HydrophobicContact CG-CB 3.87Å; R302-D361 HydrophobicContact CB-CB 3.55Å; R302-W363 PolarHBondContact N-O 2.89Å; R302-W363 VanDerWaalsContact N-O 3.13Å
303	V	97.6	Very high	97	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.			trans	-54.1	142.8	168	178.2	0	0	0	0	109.3	N294 N295 V328 L330 L333 I341 A360	N294-V303 PolarHBondContact O-N 3.14Å; N295-V303 HydrophobicContact CB-CG2 3.84Å; V303-V328 HydrophobicContact CG1-CG1 4.27Å; V303-L330 HydrophobicContact CB-CD2 4.37Å; V303-L333 HydrophobicContact CB-CD1 4.33Å; V303-L333 HydrophobicContact CG1-CD1 4.4Å; V303-L333 HydrophobicContact CG2-CD1 4.42Å; V303-I341 HydrophobicContact CG1-CD1 3.89Å; V303-I341 HydrophobicContact CG1-CG1 3.68Å; V303-A360 WeakPolarHBondContact O-CB 3.23Å
304	F	98.4	Very high	96.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.153	C	C	.	.			trans	-54.5	145.9	178.3	52.7	-90.2	0	0	0	112.3	V291 V307 V328 I341 L343 F357 Y358 L364	V291-F304 HydrophobicContact CB-CE1 3.96Å; V291-F304 HydrophobicContact CB-CZ 4.14Å; V291-F304 HydrophobicContact CG1-CE1 3.7Å; V291-F304 HydrophobicContact CG1-CZ 4.36Å; V291-F304 HydrophobicContact CG2-CZ 4.43Å; F304-V307 HydrophobicContact CD2-CG2 3.35Å; F304-V307 HydrophobicContact CE2-CG2 3.2Å; F304-V307 HydrophobicContact CG-CG2 4.26Å; F304-V307 HydrophobicContact CZ-CG2 4.01Å; F304-V328 HydrophobicContact CD2-CG2 3.6Å; F304-V328 HydrophobicContact CE2-CG2 3.34Å; F304-V328 HydrophobicContact CZ-CG2 4.33Å; F304-V328 WeakPolarHBondContact O-CB 3.37Å; F304-I341 HydrophobicContact CE1-CB 4.49Å; F304-I341 HydrophobicContact CE1-CG1 4.46Å; F304-I341 HydrophobicContact CE2-CG2 4.14Å; F304-I341 HydrophobicContact CZ-CB 3.91Å; F304-I341 HydrophobicContact CZ-CG1 4.25Å; F304-I341 HydrophobicContact CZ-CG2 3.75Å; F304-L343 HydrophobicContact CE2-CD1 4Å; F304-L343 HydrophobicContact CE2-CD2 4.22Å; F304-L343 HydrophobicContact CZ-CD1 3.91Å; F304-F357 HydrophobicContact CB-CB 4.27Å; F304-F357 AromaticContact CD1-CD1 3.97Å; F304-F357 HydrophobicContact CD1-CD1 3.97Å; F304-F357 HydrophobicContact CD2-CD1 4.33Å; F304-F357 HydrophobicContact CE1-CD1 4.16Å; F304-F357 HydrophobicContact CE2-CD1 4.49Å; F304-F357 HydrophobicContact CG-CD1 4.07Å; F304-F357 HydrophobicContact CZ-CD1 4.41Å; F304-Y358 CarbonylContact C-O 3.58Å; F304-Y358 WeakPolarHBondContact CA-O 3.37Å; F304-Y358 VanDerWaalsContact CB-O 3.28Å; F304-Y358 WeakPolarHBondContact CB-O 3.42Å; F304-L364 HydrophobicContact CB-CD1 4.07Å; F304-L364 HydrophobicContact CB-CD2 4.44Å; F304-L364 HydrophobicContact CD1-CD1 4.07Å
305	S	98.1	Very high	96.1	Very high	40 Å²	40	34.8 Å²	34.8	28%	0.28	18%	0.179	S	C	.	.	S	Bend	trans	-79.6	-31	-176.2	55.3	0	0	0	0	113.5	V328 Y358 F359	S305-V328 PolarHBondContact O-N 3.11Å; S305-Y358 PolarHBondContact N-O 3.17Å; S305-Y358 PolarHBondContact OG-O 2.81Å; S305-F359 PolarHBondContact OG-O 3.01Å
306	K	98.5	Very high	95.8	Very high	62 Å²	62	43.1 Å²	43.1	27%	0.27	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	162.8	174.3	62.2	172	-177.4	164.9	0	110	E308 T325 L326 Y358	K306-E308 IonicContact NZ-OE1 3.63Å; K306-E308 PolarHBondContact NZ-OE1 3.05Å; K306-T325 HydrophobicContact CD-CG2 4.05Å; K306-L326 CarbonylContact C-O 3.54Å; K306-L326 VanDerWaalsContact CA-O 3.22Å; K306-L326 WeakPolarHBondContact CA-O 3.46Å; K306-L326 WeakPolarHBondContact CB-O 3.34Å; K306-Y358 HydrophobicContact CD-CD2 4.18Å; K306-Y358 HydrophobicContact CD-CG 4.37Å; K306-Y358 HydrophobicContact CG-CD2 3.66Å; K306-Y358 HydrophobicContact CG-CE2 4.48Å; K306-Y358 HydrophobicContact CG-CG 3.8Å; K306-Y358 PolarHBondContact O-N 3.01Å
307	V	98.6	Very high	95.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.9	168.9	-171.3	0	0	0	0	109.7	M289 F304 C309 T325 L326 L343 C355 K356 F357	M289-V307 HydrophobicContact CE-CG1 4.12Å; F304-V307 HydrophobicContact CD2-CG2 3.35Å; F304-V307 HydrophobicContact CE2-CG2 3.2Å; F304-V307 HydrophobicContact CG-CG2 4.26Å; F304-V307 HydrophobicContact CZ-CG2 4.01Å; V307-C309 VanDerWaalsContact CG1-SG 3.58Å; V307-T325 CarbonylContact O-C 3.55Å; V307-T325 WeakPolarHBondContact O-CA 3.26Å; V307-L326 PolarHBondContact N-O 2.95Å; V307-L326 PolarHBondContact O-N 3.06Å; V307-L343 HydrophobicContact CB-CD1 4.31Å; V307-L343 HydrophobicContact CG2-CD1 3.69Å; V307-L343 HydrophobicContact CG2-CD2 4.44Å; V307-C355 HydrophobicContact CG1-CB 3.89Å; V307-K356 VanDerWaalsContact CA-O 3.28Å; V307-K356 WeakPolarHBondContact CA-O 3.15Å; V307-F357 HydrophobicContact CB-CD1 4.49Å; V307-F357 HydrophobicContact CG1-CD1 4.16Å; V307-F357 HydrophobicContact CG1-CE1 3.97Å; V307-F357 HydrophobicContact CG1-CZ 4.34Å; V307-F357 HydrophobicContact CG2-CD1 3.52Å; V307-F357 HydrophobicContact CG2-CE1 3.71Å; V307-F357 HydrophobicContact CG2-CG 4.45Å
308	E	98.5	Very high	95.6	Very high	44 Å²	44	47.8 Å²	47.8	21%	0.206	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.9	168.7	-68	-178.1	-179.4	0	0	109.8	K306 L324 T325 C355 K356 Y358	K306-E308 IonicContact NZ-OE1 3.63Å; K306-E308 PolarHBondContact NZ-OE1 3.05Å; E308-L324 CarbonylContact C-O 3.57Å; E308-L324 WeakPolarHBondContact CA-O 3.49Å; E308-T325 HydrophobicContact CG-CG2 3.92Å; E308-C355 CarbonylContact O-C 3.25Å; E308-C355 VanDerWaalsContact O-CA 3.3Å; E308-C355 WeakPolarHBondContact O-CA 3.5Å; E308-K356 HydrophobicContact CB-CB 4.43Å; E308-K356 PolarHBondContact N-O 3.49Å; E308-K356 PolarHBondContact O-N 3.17Å; E308-Y358 HydrophobicContact CB-CE2 4.13Å; E308-Y358 HydrophobicContact CG-CE2 3.8Å; E308-Y358 PolarHBondContact OE2-OH 3.45Å
309	C	98.4	Very high	95.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.7	-179.6	-64.8	0	0	0	0	112	V307 F311 L324 R354 C355	V307-C309 VanDerWaalsContact CG1-SG 3.58Å; C309-F311 HydrophobicContact CB-CE2 4.01Å; C309-F311 HydrophobicContact CB-CZ 4.02Å; C309-L324 PolarHBondContact N-O 3.41Å; C309-L324 PolarHBondContact O-N 3.23Å; C309-R354 CarbonylContact C-O 3.53Å; C309-R354 VanDerWaalsContact CA-O 3.31Å; C309-R354 WeakPolarHBondContact CA-O 3.48Å; C309-C355 HydrophobicContact CB-CB 4.26Å; C309-C355 WeakPolarHBondContact CB-SG 3.3Å; C309-C355 WeakPolarHBondContact SG-CB 3.18Å; C309-C355 CovalentContact SG-SG 2.06Å; C309-C355 PolarHBondContact SG-SG 2.89Å
310	L	98.1	Very high	95.8	Very high	48 Å²	48	46.1 Å²	46.1	25%	0.251	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	144.1	165.9	-70	166.9	0	0	0	109.1	W319 S320 A323 L353 R354	L310-W319 HydrophobicContact CB-CD2 4.41Å; L310-W319 HydrophobicContact CB-CE3 3.61Å; L310-W319 HydrophobicContact CB-CZ3 4.04Å; L310-S320 WeakPolarHBondContact CD2-O 3.25Å; L310-A323 HydrophobicContact CD2-CB 3.68Å; L310-A323 HydrophobicContact CG-CB 4.08Å; L310-L353 WeakPolarHBondContact O-CA 3.21Å; L310-R354 PolarHBondContact N-O 3.08Å; L310-R354 PolarHBondContact O-N 2.73Å
311	F	98	Very high	95.6	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.018	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.3	-175.9	-59.6	-96.2	0	0	0	109	C309 S320 L324 L345 R348 A350 L353	C309-F311 HydrophobicContact CB-CE2 4.01Å; C309-F311 HydrophobicContact CB-CZ 4.02Å; F311-S320 PolarHBondContact N-OG 3.38Å; F311-S320 VanDerWaalsContact O-CB 3.28Å; F311-S320 WeakPolarHBondContact O-CB 3.37Å; F311-S320 PolarHBondContact O-N 2.89Å; F311-S320 PolarHBondContact O-OG 3Å; F311-L324 HydrophobicContact CE2-CB 3.77Å; F311-L324 HydrophobicContact CE2-CD2 4.13Å; F311-L324 HydrophobicContact CZ-CB 4.41Å; F311-L324 HydrophobicContact CZ-CD2 3.97Å; F311-L345 HydrophobicContact CE1-CB 4.33Å; F311-L345 HydrophobicContact CE1-CD1 4.49Å; F311-L345 HydrophobicContact CZ-CB 4.33Å; F311-L345 HydrophobicContact CZ-CD2 4.15Å; F311-R348 HydrophobicContact CD1-CB 3.87Å; F311-R348 HydrophobicContact CE1-CB 3.93Å; F311-R348 VanDerWaalsContact CE2-CD 3.47Å; F311-R348 HydrophobicContact CG-CB 4.18Å; F311-R348 HydrophobicContact CZ-CB 4.3Å; F311-A350 HydrophobicContact CB-CB 4Å; F311-A350 HydrophobicContact CD1-CB 3.92Å; F311-A350 HydrophobicContact CG-CB 4.47Å; F311-L353 HydrophobicContact CD1-CD1 4.23Å; F311-L353 HydrophobicContact CD1-CD2 4.33Å; F311-L353 HydrophobicContact CD1-CG 3.94Å; F311-L353 HydrophobicContact CE1-CD2 3.97Å; F311-L353 HydrophobicContact CE1-CG 4.09Å
312	K	97.3	Very high	95.4	Very high	40 Å²	40	56.5 Å²	56.5	17%	0.174	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	105.3	175.3	-166.2	179.9	176.3	-169.3	0	108.2	G314 L315 Q317 W319 A350 Q351 I352	K312-G314 WeakPolarHBondContact CE-O 3.37Å; K312-G314 WeakPolarHBondContact CG-O 3.42Å; K312-G314 PolarHBondContact O-N 2.95Å; K312-L315 WeakPolarHBondContact CE-O 3.18Å; K312-L315 PolarHBondContact NZ-O 2.71Å; K312-Q317 WeakPolarHBondContact CE-O 3.36Å; K312-Q317 WeakPolarHBondContact CG-O 3.36Å; K312-W319 HydrophobicContact CB-CD2 4.01Å; K312-W319 HydrophobicContact CB-CE3 3.66Å; K312-W319 HydrophobicContact CB-CH2 4.25Å; K312-W319 HydrophobicContact CB-CZ3 3.78Å; K312-W319 HydrophobicContact CD-CD2 4.28Å; K312-W319 HydrophobicContact CD-CZ2 4.2Å; K312-W319 HydrophobicContact CG-CD2 4.39Å; K312-A350 CarbonylContact O-C 3.58Å; K312-Q351 PolarHBondContact O-N 3.13Å; K312-I352 HydrophobicContact CB-CB 4.13Å; K312-I352 HydrophobicContact CD-CD1 4.28Å; K312-I352 PolarHBondContact N-O 3.11Å; K312-I352 PolarHBondContact O-N 2.72Å
313	P	93.6	Very high	95.4	Very high	38 Å²	38	55.2 Å²	55.2	25%	0.247	31%	0.313	C	S	.	.	S	Bend	trans	-67.5	-20.3	-171.3	-6.8	18.5	0	0	0	115.1
314	G	90.1	Very high	95.4	Very high	11 Å²	11	56.6 Å²	56.6	11%	0.113	32%	0.321	C	S	.	.	S	Bend	trans	-159.5	164.7	168.6	0	0	0	0	0	111.9	K312 L316 Q317	K312-G314 WeakPolarHBondContact CE-O 3.37Å; K312-G314 WeakPolarHBondContact CG-O 3.42Å; K312-G314 PolarHBondContact O-N 2.95Å; G314-L316 PolarHBondContact O-N 2.93Å; G314-L316 VanDerWaalsContact O-N 3.1Å; G314-Q317 PolarHBondContact O-N 2.98Å
315	L	88.6	Confident	95.3	Very high	104 Å²	104	59.9 Å²	59.9	55%	0.545	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-35.1	-173.6	-59.3	-178.5	0	0	0	114.3	K312 I352	K312-L315 WeakPolarHBondContact CE-O 3.18Å; K312-L315 PolarHBondContact NZ-O 2.71Å; L315-I352 HydrophobicContact CD2-CD1 3.59Å; L315-I352 HydrophobicContact CD2-CG1 4.26Å
316	L	90.7	Very high	95.3	Very high	176 Å²	176	59 Å²	59	92%	0.921	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-6.8	-177.9	-58	-179.6	0	0	0	113.9	G314	G314-L316 PolarHBondContact O-N 2.93Å; G314-L316 VanDerWaalsContact O-N 3.1Å
317	Q	91.6	Very high	95.3	Very high	102 Å²	102	60.9 Å²	60.9	48%	0.477	35%	0.352	S	S	.	.	S	Bend	trans	-88.3	153.4	-177.9	-66.5	-172.4	-7.2	0	0	111.2	K312 G314	K312-Q317 WeakPolarHBondContact CE-O 3.36Å; K312-Q317 WeakPolarHBondContact CG-O 3.36Å; G314-Q317 PolarHBondContact O-N 2.98Å
318	P	95	Very high	95.2	Very high	109 Å²	109	61.6 Å²	61.6	71%	0.708	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-68	159.9	174.7	29.8	-35.3	0	0	0	111.5
319	W	96.6	Very high	94.9	Very high	89 Å²	89	63.4 Å²	63.4	34%	0.337	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-63.6	142.3	168.6	-69	98.2	0	0	0	110.9	L310 K312 I352 R354	L310-W319 HydrophobicContact CB-CD2 4.41Å; L310-W319 HydrophobicContact CB-CE3 3.61Å; L310-W319 HydrophobicContact CB-CZ3 4.04Å; K312-W319 HydrophobicContact CB-CD2 4.01Å; K312-W319 HydrophobicContact CB-CE3 3.66Å; K312-W319 HydrophobicContact CB-CH2 4.25Å; K312-W319 HydrophobicContact CB-CZ3 3.78Å; K312-W319 HydrophobicContact CD-CD2 4.28Å; K312-W319 HydrophobicContact CD-CZ2 4.2Å; K312-W319 HydrophobicContact CG-CD2 4.39Å; W319-I352 HydrophobicContact CH2-CB 4.34Å; W319-I352 HydrophobicContact CH2-CG2 3.71Å; W319-I352 HydrophobicContact CZ2-CG2 4.44Å; W319-I352 HydrophobicContact CZ3-CG2 4.45Å; W319-R354 HydrophobicContact CH2-CB 3.54Å; W319-R354 HydrophobicContact CZ2-CB 4.36Å; W319-R354 HydrophobicContact CZ3-CB 3.73Å
320	S	92.7	Very high	94.5	Very high	33 Å²	33	64.8 Å²	64.8	23%	0.231	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-59.9	140.8	172.6	67.6	0	0	0	0	110.6	L310 F311	L310-S320 WeakPolarHBondContact CD2-O 3.25Å; F311-S320 PolarHBondContact N-OG 3.38Å; F311-S320 VanDerWaalsContact O-CB 3.28Å; F311-S320 WeakPolarHBondContact O-CB 3.37Å; F311-S320 PolarHBondContact O-N 2.89Å; F311-S320 PolarHBondContact O-OG 3Å
321	S	91.9	Very high	94.1	Very high	116 Å²	116	70.4 Å²	70.4	81%	0.811	40%	0.404	S	S	*	.	S	Bend	trans	-133.6	137.1	171.5	-178.1	0	0	0	0	109.6
322	P	94.1	Very high	93.7	Very high	106 Å²	106	76 Å²	76	69%	0.688	43%	0.434	S	S	*	.	S	Bend	cis	-76.8	169.5	-1.9	33.3	-36.1	0	0	0	113.3
323	A	96.1	Very high	93.3	Very high	37 Å²	37	75.1 Å²	75.1	31%	0.306	43%	0.431	S	S	.	.			trans	-63.6	147.9	169.4	0	0	0	0	0	111.2	L310	L310-A323 HydrophobicContact CD2-CB 3.68Å; L310-A323 HydrophobicContact CG-CB 4.08Å
324	L	97.7	Very high	93.2	Very high	30 Å²	30	81.3 Å²	81.3	16%	0.157	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	115	171	180	64.4	0	0	0	109.1	E308 C309 F311 L326 L345	E308-L324 CarbonylContact C-O 3.57Å; E308-L324 WeakPolarHBondContact CA-O 3.49Å; C309-L324 PolarHBondContact N-O 3.41Å; C309-L324 PolarHBondContact O-N 3.23Å; F311-L324 HydrophobicContact CE2-CB 3.77Å; F311-L324 HydrophobicContact CE2-CD2 4.13Å; F311-L324 HydrophobicContact CZ-CB 4.41Å; F311-L324 HydrophobicContact CZ-CD2 3.97Å; L324-L326 HydrophobicContact CD1-CD2 4.16Å; L324-L326 HydrophobicContact CD2-CD1 4.09Å; L324-L326 HydrophobicContact CD2-CD2 4.22Å; L324-L326 HydrophobicContact CD2-CG 4.25Å; L324-L326 HydrophobicContact CG-CD1 4.38Å; L324-L326 HydrophobicContact CG-CD2 4.02Å; L324-L326 HydrophobicContact CG-CG 4.02Å; L324-L345 HydrophobicContact CD2-CD2 4.41Å
325	T	98.2	Very high	93.4	Very high	68 Å²	68	84 Å²	84	42%	0.417	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.5	175.9	-53.7	0	0	0	0	110.4	K306 V307 E308	K306-T325 HydrophobicContact CD-CG2 4.05Å; V307-T325 CarbonylContact O-C 3.55Å; V307-T325 WeakPolarHBondContact O-CA 3.26Å; E308-T325 HydrophobicContact CG-CG2 3.92Å
326	L	97.9	Very high	93.7	Very high	21 Å²	21	81.9 Å²	81.9	11%	0.11	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	101.6	-178.8	-60.4	174	0	0	0	109.3	K306 V307 L324 L343 P344 L345	K306-L326 CarbonylContact C-O 3.54Å; K306-L326 VanDerWaalsContact CA-O 3.22Å; K306-L326 WeakPolarHBondContact CA-O 3.46Å; K306-L326 WeakPolarHBondContact CB-O 3.34Å; V307-L326 PolarHBondContact N-O 2.95Å; V307-L326 PolarHBondContact O-N 3.06Å; L324-L326 HydrophobicContact CD1-CD2 4.16Å; L324-L326 HydrophobicContact CD2-CD1 4.09Å; L324-L326 HydrophobicContact CD2-CD2 4.22Å; L324-L326 HydrophobicContact CD2-CG 4.25Å; L324-L326 HydrophobicContact CG-CD1 4.38Å; L324-L326 HydrophobicContact CG-CD2 4.02Å; L324-L326 HydrophobicContact CG-CG 4.02Å; L326-L343 HydrophobicContact CB-CD2 4.07Å; L326-L343 HydrophobicContact CD1-CB 3.88Å; L326-L343 HydrophobicContact CD1-CD2 4.33Å; L326-P344 WeakPolarHBondContact CD1-O 3.44Å; L326-P344 HydrophobicContact CD2-CG 4.34Å; L326-P344 WeakPolarHBondContact CD2-O 3.3Å; L326-L345 HydrophobicContact CD1-CD2 4.13Å
327	P	97.7	Very high	93.9	Very high	103 Å²	103	75.3 Å²	75.3	67%	0.669	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	147.6	175.6	30.8	-33.8	0	0	0	111.4
328	V	96.1	Very high	94.2	Very high	14 Å²	14	71.2 Å²	71.2	9%	0.085	41%	0.41	C	S	.	.			trans	-106.5	124.9	172.5	-178.3	0	0	0	0	108.8	V303 F304 S305 L330 L333 I341 L343	V303-V328 HydrophobicContact CG1-CG1 4.27Å; F304-V328 HydrophobicContact CD2-CG2 3.6Å; F304-V328 HydrophobicContact CE2-CG2 3.34Å; F304-V328 HydrophobicContact CZ-CG2 4.33Å; F304-V328 WeakPolarHBondContact O-CB 3.37Å; S305-V328 PolarHBondContact O-N 3.11Å; V328-L330 VanDerWaalsContact C-N 3.29Å; V328-L330 HydrophobicContact CB-CD2 4.43Å; V328-L330 HydrophobicContact CG1-CD2 4.05Å; V328-L330 PolarHBondContact O-N 3.15Å; V328-L333 HydrophobicContact CG1-CD1 4.12Å; V328-I341 HydrophobicContact CG1-CG2 4.41Å; V328-I341 HydrophobicContact CG2-CG2 4.15Å; V328-L343 HydrophobicContact CG2-CD2 4.44Å
329	P	92.5	Very high	94.2	Very high	82 Å²	82	68.4 Å²	68.4	53%	0.532	39%	0.385	S	S	.	.			trans	-74.9	80.5	-178.9	31.3	-34.9	0	0	0	111	E331 D332	P329-E331 PolarHBondContact O-N 3.47Å; P329-E331 VanDerWaalsContact O-N 3.11Å; P329-D332 PolarHBondContact O-N 2.7Å
330	L	91	Very high	94.2	Very high	30 Å²	30	65.2 Å²	65.2	16%	0.157	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.7	-177.2	-62.6	-179.7	0	0	0	114.4	R302 V303 V328 L333 A360	R302-L330 PolarHBondContact NH2-O 3.06Å; R302-L330 VanDerWaalsContact NH2-O 3.08Å; V303-L330 HydrophobicContact CB-CD2 4.37Å; V328-L330 VanDerWaalsContact C-N 3.29Å; V328-L330 HydrophobicContact CB-CD2 4.43Å; V328-L330 HydrophobicContact CG1-CD2 4.05Å; V328-L330 PolarHBondContact O-N 3.15Å; L330-L333 HydrophobicContact CD2-CD1 4.24Å; L330-L333 PolarHBondContact O-N 3.08Å; L330-A360 HydrophobicContact CD1-CB 3.42Å; L330-A360 VanDerWaalsContact CD1-CB 3.42Å
331	E	89.2	Confident	94.4	Very high	165 Å²	165	64.5 Å²	64.5	77%	0.771	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-27.6	177.6	-62.4	-175.9	-176.3	0	0	112.2	P329 K334	P329-E331 PolarHBondContact O-N 3.47Å; P329-E331 VanDerWaalsContact O-N 3.11Å; E331-K334 VanDerWaalsContact O-CE 3.29Å; E331-K334 WeakPolarHBondContact O-CE 3.35Å
332	D	88.3	Confident	94.6	Very high	122 Å²	122	61 Å²	61	65%	0.652	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-19.2	178.2	-60.2	-28.6	0	0	0	111.6	P329 K334	P329-D332 PolarHBondContact O-N 2.7Å; D332-K334 PolarHBondContact O-N 2.87Å
333	L	90.2	Very high	94.7	Very high	22 Å²	22	56.1 Å²	56.1	12%	0.115	31%	0.313	C	S	.	.			trans	-94.8	66	-175.1	-54	-174.4	0	0	0	111.9	N295 V303 V328 L330 I341	N295-L333 PolarHBondContact ND2-O 2.82Å; N295-L333 VanDerWaalsContact ND2-O 3.09Å; V303-L333 HydrophobicContact CB-CD1 4.33Å; V303-L333 HydrophobicContact CG1-CD1 4.4Å; V303-L333 HydrophobicContact CG2-CD1 4.42Å; V328-L333 HydrophobicContact CG1-CD1 4.12Å; L330-L333 HydrophobicContact CD2-CD1 4.24Å; L330-L333 PolarHBondContact O-N 3.08Å; L333-I341 HydrophobicContact CD1-CD1 4.21Å
334	K	90.9	Very high	94.8	Very high	168 Å²	168	58 Å²	58	73%	0.73	32%	0.322	S	S	*	.			trans	-83.5	-30.9	-176.1	-64.2	-178.6	-176.6	173.7	0	114.1	H297 E331 D332	H297-K334 PolarHBondContact CE1-O 3.15Å; E331-K334 VanDerWaalsContact O-CE 3.29Å; E331-K334 WeakPolarHBondContact O-CE 3.35Å; D332-K334 PolarHBondContact O-N 2.87Å
335	D	93.8	Very high	94.7	Very high	66 Å²	66	56.6 Å²	56.6	35%	0.353	31%	0.314	S	S	.	.	S	Bend	trans	-81.3	150.7	-178.3	73.2	91.1	0	0	0	110.5	N295 S337 R339	N295-D335 PolarHBondContact ND2-O 3.3Å; D335-S337 PolarHBondContact O-N 3.18Å; D335-S337 WeakPolarHBondContact OD1-CB 3.48Å; D335-S337 PolarHBondContact OD1-N 3.19Å; D335-S337 VanDerWaalsContact OD1-N 3.1Å; D335-S337 PolarHBondContact OD1-OG 3.31Å; D335-R339 PolarHBondContact O-NH2 3.07Å; D335-R339 IonicContact OD1-CZ 2.95Å; D335-R339 IonicContact OD1-NH1 3.79Å; D335-R339 IonicContact OD1-NH2 2.71Å; D335-R339 PolarHBondContact OD1-NH2 2.86Å; D335-R339 IonicContact OD2-CZ 3.16Å; D335-R339 IonicContact OD2-NH1 2.71Å; D335-R339 PolarHBondContact OD2-NH1 3.41Å; D335-R339 IonicContact OD2-NH2 3.51Å; D335-R339 PolarHBondContact OD2-NH2 2.9Å
336	P	95.6	Very high	94.5	Very high	61 Å²	61	56.4 Å²	56.4	40%	0.396	33%	0.326	S	S	.	.			trans	-78	2.3	-174	32.6	-36.1	0	0	0	114	N295 R296	N295-P336 CarbonylContact C-O 3.4Å; N295-P336 WeakPolarHBondContact O-CA 3.24Å; R296-P336 PolarHBondContact N-O 3.49Å
337	S	95.9	Very high	94.3	Very high	37 Å²	37	56.6 Å²	56.6	26%	0.259	33%	0.333	S	S	.	.			trans	-69.5	141.5	-173.8	-64.7	0	0	0	0	112.4	D245 N295 D335 R339	D245-S337 VanDerWaalsContact CG-CA 3.49Å; D245-S337 WeakPolarHBondContact OD1-CA 3.42Å; D245-S337 WeakPolarHBondContact OD1-CB 3.38Å; D245-S337 VanDerWaalsContact OD2-CB 3.24Å; D245-S337 WeakPolarHBondContact OD2-CB 3.5Å; D245-S337 PolarHBondContact OD2-OG 3.31Å; N295-S337 VanDerWaalsContact CB-O 3.27Å; N295-S337 WeakPolarHBondContact CB-O 3.36Å; D335-S337 PolarHBondContact O-N 3.18Å; D335-S337 WeakPolarHBondContact OD1-CB 3.48Å; D335-S337 PolarHBondContact OD1-N 3.19Å; D335-S337 VanDerWaalsContact OD1-N 3.1Å; D335-S337 PolarHBondContact OD1-OG 3.31Å; S337-R339 PolarHBondContact O-NE 2.84Å; S337-R339 PolarHBondContact O-NH2 2.85Å
338	S	96.4	Very high	94.2	Very high	17 Å²	17	56.6 Å²	56.6	12%	0.119	32%	0.32	C	S	.	.			trans	-62.1	148.6	164.6	64.3	0	0	0	0	110.1	D245 Y261 S293	D245-S338 PolarHBondContact OD1-N 2.87Å; D245-S338 PolarHBondContact OD1-OG 3.18Å; Y261-S338 VanDerWaalsContact OH-CB 3.23Å; Y261-S338 WeakPolarHBondContact OH-CB 3.4Å; S293-S338 WeakPolarHBondContact O-CA 3.21Å
339	R	95.3	Very high	94.2	Very high	49 Å²	49	58 Å²	58	19%	0.185	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	157.1	-178.1	69.8	-163.9	71.2	-152	-4.5	112.7	S293 D335 S337 I341	S293-R339 PolarHBondContact N-O 2.75Å; S293-R339 PolarHBondContact O-N 2.65Å; D335-R339 PolarHBondContact O-NH2 3.07Å; D335-R339 IonicContact OD1-CZ 2.95Å; D335-R339 IonicContact OD1-NH1 3.79Å; D335-R339 IonicContact OD1-NH2 2.71Å; D335-R339 PolarHBondContact OD1-NH2 2.86Å; D335-R339 IonicContact OD2-CZ 3.16Å; D335-R339 IonicContact OD2-NH1 2.71Å; D335-R339 PolarHBondContact OD2-NH1 3.41Å; D335-R339 IonicContact OD2-NH2 3.51Å; D335-R339 PolarHBondContact OD2-NH2 2.9Å; S337-R339 PolarHBondContact O-NE 2.84Å; S337-R339 PolarHBondContact O-NH2 2.85Å; R339-I341 HydrophobicContact CG-CD1 3.7Å; R339-I341 HydrophobicContact CG-CG1 4.47Å
340	P	96.3	Very high	94.4	Very high	23 Å²	23	54.1 Å²	54.1	15%	0.149	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.5	164.2	31.7	-34.2	0	0	0	111.1	H27 W29 V291	H27-P340 WeakPolarHBondContact O-CG 3.32Å; W29-P340 HydrophobicContact CE3-CB 3.94Å; V291-P340 CarbonylContact O-C 3.58Å; V291-P340 WeakPolarHBondContact O-CA 3.42Å
341	I	96.6	Very high	94.7	Very high	18 Å²	18	54.3 Å²	54.3	9%	0.092	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	111.9	171.6	-53.6	-63.4	0	0	0	107.8	Q290 V291 V303 F304 V328 L333 R339 L343	Q290-I341 WeakPolarHBondContact CA-O 3.46Å; V291-I341 PolarHBondContact N-O 2.89Å; V291-I341 PolarHBondContact O-N 3.11Å; V303-I341 HydrophobicContact CG1-CD1 3.89Å; V303-I341 HydrophobicContact CG1-CG1 3.68Å; F304-I341 HydrophobicContact CE1-CB 4.49Å; F304-I341 HydrophobicContact CE1-CG1 4.46Å; F304-I341 HydrophobicContact CE2-CG2 4.14Å; F304-I341 HydrophobicContact CZ-CB 3.91Å; F304-I341 HydrophobicContact CZ-CG1 4.25Å; F304-I341 HydrophobicContact CZ-CG2 3.75Å; V328-I341 HydrophobicContact CG1-CG2 4.41Å; V328-I341 HydrophobicContact CG2-CG2 4.15Å; L333-I341 HydrophobicContact CD1-CD1 4.21Å; R339-I341 HydrophobicContact CG-CD1 3.7Å; R339-I341 HydrophobicContact CG-CG1 4.47Å; I341-L343 HydrophobicContact CG2-CD2 4.15Å; I341-L343 HydrophobicContact CG2-CG 4.25Å
342	S	96.2	Very high	95.1	Very high	41 Å²	41	46.8 Å²	46.8	29%	0.287	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.8	177.4	-63.1	0	0	0	0	110.2	D26 Q290	D26-S342 PolarHBondContact O-OG 3.17Å; Q290-S342 PolarHBondContact NE2-OG 3.4Å
343	L	96.9	Very high	95.6	Very high	4 Å²	4	41 Å²	41	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	111.5	-174.4	-66.5	167.9	0	0	0	109.9	N288 M289 V291 F304 V307 L326 V328 I341 L345	N288-L343 WeakPolarHBondContact CA-O 3.49Å; M289-L343 HydrophobicContact CB-CB 4.37Å; M289-L343 HydrophobicContact CE-CB 4.43Å; M289-L343 HydrophobicContact CE-CD1 3.31Å; M289-L343 PolarHBondContact N-O 2.77Å; M289-L343 WeakPolarHBondContact O-CB 3.23Å; M289-L343 PolarHBondContact O-N 2.89Å; V291-L343 HydrophobicContact CG2-CD1 4.12Å; F304-L343 HydrophobicContact CE2-CD1 4Å; F304-L343 HydrophobicContact CE2-CD2 4.22Å; F304-L343 HydrophobicContact CZ-CD1 3.91Å; V307-L343 HydrophobicContact CB-CD1 4.31Å; V307-L343 HydrophobicContact CG2-CD1 3.69Å; V307-L343 HydrophobicContact CG2-CD2 4.44Å; L326-L343 HydrophobicContact CB-CD2 4.07Å; L326-L343 HydrophobicContact CD1-CB 3.88Å; L326-L343 HydrophobicContact CD1-CD2 4.33Å; V328-L343 HydrophobicContact CG2-CD2 4.44Å; I341-L343 HydrophobicContact CG2-CD2 4.15Å; I341-L343 HydrophobicContact CG2-CG 4.25Å; L343-L345 PolarHBondContact O-N 2.77Å
344	P	97.2	Very high	96	Very high	77 Å²	77	44.2 Å²	44.2	50%	0.5	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	113	-178.2	29	-33.3	0	0	0	111.3	N288 L326	N288-P344 WeakPolarHBondContact OD1-CA 3.36Å; L326-P344 WeakPolarHBondContact CD1-O 3.44Å; L326-P344 HydrophobicContact CD2-CG 4.34Å; L326-P344 WeakPolarHBondContact CD2-O 3.3Å
345	L	97	Very high	96.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-12.9	179.4	-60.7	-175.2	0	0	0	112.7	F286 N287 M289 F311 L324 L326 L343 R348 L353 F371	F286-L345 HydrophobicContact CB-CB 3.94Å; F286-L345 HydrophobicContact CB-CD1 3.69Å; F286-L345 HydrophobicContact CB-CG 4.48Å; F286-L345 HydrophobicContact CD1-CD1 3.99Å; F286-L345 HydrophobicContact CG-CD1 4.18Å; F286-L345 CarbonylContact O-C 3.6Å; F286-L345 WeakPolarHBondContact O-CB 3.48Å; N287-L345 PolarHBondContact O-N 3.31Å; M289-L345 HydrophobicContact CB-CD1 3.83Å; M289-L345 HydrophobicContact CB-CD2 4.33Å; M289-L345 HydrophobicContact CB-CG 4.13Å; F311-L345 HydrophobicContact CE1-CB 4.33Å; F311-L345 HydrophobicContact CE1-CD1 4.49Å; F311-L345 HydrophobicContact CZ-CB 4.33Å; F311-L345 HydrophobicContact CZ-CD2 4.15Å; L324-L345 HydrophobicContact CD2-CD2 4.41Å; L326-L345 HydrophobicContact CD1-CD2 4.13Å; L343-L345 PolarHBondContact O-N 2.77Å; L345-R348 VanDerWaalsContact O-CD 3.28Å; L345-R348 WeakPolarHBondContact O-CD 3.49Å; L345-R348 WeakPolarHBondContact O-CG 3.49Å; L345-R348 PolarHBondContact O-NE 3.12Å; L345-L353 HydrophobicContact CD1-CD2 3.88Å; L345-F371 HydrophobicContact CD1-CD1 4.37Å
346	G	93.8	Very high	96.6	Very high	64 Å²	64	36 Å²	36	66%	0.66	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	78.3	29.3	165.6	0	0	0	0	0	114.9	N287	N287-G346 PolarHBondContact O-N 3.37Å
347	G	94.4	Very high	96.8	Very high	26 Å²	26	33.1 Å²	33.1	27%	0.268	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	64.4	40.8	177.5	0	0	0	0	0	112.4	L285 F286	L285-G347 WeakPolarHBondContact CD1-O 3.28Å; F286-G347 WeakPolarHBondContact O-CA 3.23Å; F286-G347 PolarHBondContact O-N 2.74Å
348	R	95	Very high	96.9	Very high	102 Å²	102	34 Å²	34	39%	0.385	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.8	-176	-70.9	175.5	-171.7	-91.2	-1.8	111	F286 F311 L345	F286-R348 PolarHBondContact N-O 3.28Å; F286-R348 PolarHBondContact O-N 3.19Å; F311-R348 HydrophobicContact CD1-CB 3.87Å; F311-R348 HydrophobicContact CE1-CB 3.93Å; F311-R348 VanDerWaalsContact CE2-CD 3.47Å; F311-R348 HydrophobicContact CG-CB 4.18Å; F311-R348 HydrophobicContact CZ-CB 4.3Å; L345-R348 VanDerWaalsContact O-CD 3.28Å; L345-R348 WeakPolarHBondContact O-CD 3.49Å; L345-R348 WeakPolarHBondContact O-CG 3.49Å; L345-R348 PolarHBondContact O-NE 3.12Å
349	P	95.4	Very high	97	Very high	45 Å²	45	33.8 Å²	33.8	29%	0.292	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	131.8	177.6	30	-34.1	0	0	0	111.2	R284 L285 F376	R284-P349 CarbonylContact O-C 3.54Å; R284-P349 VanDerWaalsContact O-CA 3.29Å; R284-P349 WeakPolarHBondContact O-CA 3.24Å; L285-P349 HydrophobicContact CD1-CB 4.15Å; P349-F376 HydrophobicContact CB-CD1 3.5Å; P349-F376 VanDerWaalsContact CB-CD1 3.5Å; P349-F376 HydrophobicContact CB-CE1 3.32Å; P349-F376 HydrophobicContact CB-CE2 4.43Å; P349-F376 HydrophobicContact CB-CG 4.15Å; P349-F376 HydrophobicContact CB-CZ 3.83Å; P349-F376 HydrophobicContact CG-CE1 4.14Å; P349-F376 HydrophobicContact CG-CZ 4.31Å
350	A	97.1	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153.7	177.7	0	0	0	0	0	111.3	P283 R284 F286 F311 K312 L353	P283-A350 CarbonylContact C-O 3.56Å; P283-A350 WeakPolarHBondContact CA-O 3.15Å; R284-A350 PolarHBondContact N-O 2.77Å; R284-A350 PolarHBondContact O-N 3.41Å; F286-A350 HydrophobicContact CD2-CB 3.82Å; F286-A350 HydrophobicContact CE2-CB 3.69Å; F286-A350 WeakPolarHBondContact CE2-O 3.41Å; F311-A350 HydrophobicContact CB-CB 4Å; F311-A350 HydrophobicContact CD1-CB 3.92Å; F311-A350 HydrophobicContact CG-CB 4.47Å; K312-A350 CarbonylContact O-C 3.58Å; A350-L353 HydrophobicContact CB-CD1 3.37Å; A350-L353 HydrophobicContact CB-CG 4.4Å
351	Q	97.4	Very high	97.2	Very high	33 Å²	33	34.1 Å²	34.1	15%	0.154	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-24.5	158.8	-171.7	175.4	19.8	0	0	110.9	F280 E281 P283 K312	F280-Q351 WeakPolarHBondContact CD2-O 3.09Å; F280-Q351 PolarHBondContact N-O 3.43Å; F280-Q351 WeakPolarHBondContact O-CG 3.12Å; E281-Q351 PolarHBondContact O-NE2 2.98Å; P283-Q351 HydrophobicContact CB-CB 4.21Å; P283-Q351 HydrophobicContact CG-CB 4.25Å; P283-Q351 HydrophobicContact CG-CG 4.46Å; K312-Q351 PolarHBondContact O-N 3.13Å
352	I	98.2	Very high	97.2	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.3	174.2	-53	172	0	0	0	108.6	E277 F278 K312 L315 W319	E277-I352 HydrophobicContact CG-CG2 3.55Å; F278-I352 CarbonylContact O-C 2.92Å; F278-I352 VanDerWaalsContact O-CA 3.28Å; F278-I352 WeakPolarHBondContact O-CA 3.22Å; F278-I352 WeakPolarHBondContact O-CG2 3.49Å; K312-I352 HydrophobicContact CB-CB 4.13Å; K312-I352 HydrophobicContact CD-CD1 4.28Å; K312-I352 PolarHBondContact N-O 3.11Å; K312-I352 PolarHBondContact O-N 2.72Å; L315-I352 HydrophobicContact CD2-CD1 3.59Å; L315-I352 HydrophobicContact CD2-CG1 4.26Å; W319-I352 HydrophobicContact CH2-CB 4.34Å; W319-I352 HydrophobicContact CH2-CG2 3.71Å; W319-I352 HydrophobicContact CZ2-CG2 4.44Å; W319-I352 HydrophobicContact CZ3-CG2 4.45Å
353	L	98.2	Very high	97.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.8	171	-84.5	71.2	0	0	0	108.7	E277 F278 F280 F286 L310 F311 L345 A350 F371	E277-L353 CarbonylContact C-O 3.44Å; E277-L353 VanDerWaalsContact CA-O 3.29Å; E277-L353 WeakPolarHBondContact CA-O 3.48Å; F278-L353 HydrophobicContact CB-CB 4.35Å; F278-L353 HydrophobicContact CD2-CB 4.28Å; F278-L353 PolarHBondContact N-O 2.89Å; F278-L353 PolarHBondContact O-N 2.89Å; F280-L353 HydrophobicContact CD2-CD1 4.27Å; F280-L353 HydrophobicContact CE2-CD1 3.78Å; F286-L353 HydrophobicContact CD1-CD1 4.21Å; F286-L353 HydrophobicContact CD1-CD2 4.05Å; F286-L353 HydrophobicContact CD2-CD1 3.79Å; F286-L353 HydrophobicContact CE1-CD1 3.91Å; F286-L353 HydrophobicContact CE1-CD2 4.24Å; F286-L353 HydrophobicContact CE2-CD1 3.45Å; F286-L353 VanDerWaalsContact CE2-CD1 3.45Å; F286-L353 HydrophobicContact CG-CD1 4.16Å; F286-L353 HydrophobicContact CG-CD2 4.3Å; F286-L353 HydrophobicContact CZ-CD1 3.52Å; L310-L353 WeakPolarHBondContact O-CA 3.21Å; F311-L353 HydrophobicContact CD1-CD1 4.23Å; F311-L353 HydrophobicContact CD1-CD2 4.33Å; F311-L353 HydrophobicContact CD1-CG 3.94Å; F311-L353 HydrophobicContact CE1-CD2 3.97Å; F311-L353 HydrophobicContact CE1-CG 4.09Å; L345-L353 HydrophobicContact CD1-CD2 3.88Å; A350-L353 HydrophobicContact CB-CD1 3.37Å; A350-L353 HydrophobicContact CB-CG 4.4Å; L353-F371 HydrophobicContact CD2-CD1 4.33Å; L353-F371 HydrophobicContact CD2-CE1 3.91Å
354	R	98.4	Very high	97.4	Very high	90 Å²	90	39.8 Å²	39.8	34%	0.34	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	113.6	166.5	179.1	176.5	174	177.1	2	108.8	D275 E277 C309 L310 W319	D275-R354 IonicContact OD2-CZ 3.72Å; D275-R354 IonicContact OD2-NE 2.73Å; D275-R354 IonicContact OD2-NH2 3.64Å; D275-R354 PolarHBondContact OD2-NH2 2.83Å; E277-R354 HydrophobicContact CG-CB 4.39Å; C309-R354 CarbonylContact C-O 3.53Å; C309-R354 VanDerWaalsContact CA-O 3.31Å; C309-R354 WeakPolarHBondContact CA-O 3.48Å; L310-R354 PolarHBondContact N-O 3.08Å; L310-R354 PolarHBondContact O-N 2.73Å; W319-R354 HydrophobicContact CH2-CB 3.54Å; W319-R354 HydrophobicContact CZ2-CB 4.36Å; W319-R354 HydrophobicContact CZ3-CB 3.73Å
355	C	98.7	Very high	97.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136	-177.2	-65.2	0	0	0	0	111.3	I276 F278 V307 E308 C309 F357	I276-C355 PolarHBondContact N-O 2.73Å; I276-C355 PolarHBondContact O-N 2.98Å; F278-C355 HydrophobicContact CE2-CB 4.22Å; V307-C355 HydrophobicContact CG1-CB 3.89Å; E308-C355 CarbonylContact O-C 3.25Å; E308-C355 VanDerWaalsContact O-CA 3.3Å; E308-C355 WeakPolarHBondContact O-CA 3.5Å; C309-C355 HydrophobicContact CB-CB 4.26Å; C309-C355 WeakPolarHBondContact CB-SG 3.3Å; C309-C355 WeakPolarHBondContact SG-CB 3.18Å; C309-C355 CovalentContact SG-SG 2.06Å; C309-C355 PolarHBondContact SG-SG 2.89Å; C355-F357 HydrophobicContact CB-CE2 3.9Å; C355-F357 HydrophobicContact CB-CZ 4.08Å
356	K	98.7	Very high	97.6	Very high	63 Å²	63	36.1 Å²	36.1	27%	0.274	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.8	176.1	-57.2	-166.1	177.7	-169.9	0	109.8	V274 D275 V307 E308 Y358	V274-K356 WeakPolarHBondContact O-CA 3.39Å; D275-K356 WeakPolarHBondContact OD1-CD 3.2Å; D275-K356 WeakPolarHBondContact OD1-CG 3.5Å; D275-K356 VanDerWaalsContact OD2-CE 3.24Å; D275-K356 WeakPolarHBondContact OD2-CE 3.33Å; D275-K356 IonicContact OD2-NZ 3.59Å; V307-K356 VanDerWaalsContact CA-O 3.28Å; V307-K356 WeakPolarHBondContact CA-O 3.15Å; E308-K356 HydrophobicContact CB-CB 4.43Å; E308-K356 PolarHBondContact N-O 3.49Å; E308-K356 PolarHBondContact O-N 3.17Å; K356-Y358 HydrophobicContact CB-CD2 4.39Å; K356-Y358 HydrophobicContact CB-CE2 3.82Å; K356-Y358 WeakPolarHBondContact O-CD2 3.44Å
357	F	98.8	Very high	97.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	107.5	178.1	-61.1	-88.4	0	0	0	109.5	S273 V274 I276 F278 M289 V291 F304 V307 C355 L364 I366 I369	S273-F357 CarbonylContact C-O 3.59Å; S273-F357 WeakPolarHBondContact CA-O 3.47Å; S273-F357 WeakPolarHBondContact CB-O 3.46Å; V274-F357 HydrophobicContact CB-CB 4.47Å; V274-F357 PolarHBondContact N-O 3.4Å; V274-F357 PolarHBondContact O-N 3.06Å; I276-F357 HydrophobicContact CB-CE2 4.12Å; I276-F357 HydrophobicContact CD1-CD2 4.02Å; I276-F357 HydrophobicContact CD1-CE2 3.82Å; I276-F357 HydrophobicContact CG1-CD2 4.14Å; I276-F357 HydrophobicContact CG1-CE2 4.04Å; F278-F357 HydrophobicContact CE2-CE2 4.46Å; F278-F357 HydrophobicContact CZ-CE2 4.46Å; M289-F357 HydrophobicContact CE-CE1 3.93Å; M289-F357 HydrophobicContact CE-CZ 3.89Å; M289-F357 HydrophobicContact SD-CZ 4.3Å; V291-F357 HydrophobicContact CG2-CE1 3.96Å; V291-F357 HydrophobicContact CG2-CZ 4.43Å; F304-F357 HydrophobicContact CB-CB 4.27Å; F304-F357 AromaticContact CD1-CD1 3.97Å; F304-F357 HydrophobicContact CD1-CD1 3.97Å; F304-F357 HydrophobicContact CD2-CD1 4.33Å; F304-F357 HydrophobicContact CE1-CD1 4.16Å; F304-F357 HydrophobicContact CE2-CD1 4.49Å; F304-F357 HydrophobicContact CG-CD1 4.07Å; F304-F357 HydrophobicContact CZ-CD1 4.41Å; V307-F357 HydrophobicContact CB-CD1 4.49Å; V307-F357 HydrophobicContact CG1-CD1 4.16Å; V307-F357 HydrophobicContact CG1-CE1 3.97Å; V307-F357 HydrophobicContact CG1-CZ 4.34Å; V307-F357 HydrophobicContact CG2-CD1 3.52Å; V307-F357 HydrophobicContact CG2-CE1 3.71Å; V307-F357 HydrophobicContact CG2-CG 4.45Å; C355-F357 HydrophobicContact CB-CE2 3.9Å; C355-F357 HydrophobicContact CB-CZ 4.08Å; F357-L364 HydrophobicContact CB-CD2 3.69Å; F357-I366 HydrophobicContact CD1-CD1 4.45Å; F357-I369 HydrophobicContact CZ-CD1 4.36Å
358	Y	98.8	Very high	98	Very high	55 Å²	55	32 Å²	32	22%	0.216	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	130.4	-175.6	-76.1	-99.1	0	0	0	111.4	F304 S305 K306 E308 K356	F304-Y358 CarbonylContact C-O 3.58Å; F304-Y358 WeakPolarHBondContact CA-O 3.37Å; F304-Y358 VanDerWaalsContact CB-O 3.28Å; F304-Y358 WeakPolarHBondContact CB-O 3.42Å; S305-Y358 PolarHBondContact N-O 3.17Å; S305-Y358 PolarHBondContact OG-O 2.81Å; K306-Y358 HydrophobicContact CD-CD2 4.18Å; K306-Y358 HydrophobicContact CD-CG 4.37Å; K306-Y358 HydrophobicContact CG-CD2 3.66Å; K306-Y358 HydrophobicContact CG-CE2 4.48Å; K306-Y358 HydrophobicContact CG-CG 3.8Å; K306-Y358 PolarHBondContact O-N 3.01Å; E308-Y358 HydrophobicContact CB-CE2 4.13Å; E308-Y358 HydrophobicContact CG-CE2 3.8Å; E308-Y358 PolarHBondContact OE2-OH 3.45Å; K356-Y358 HydrophobicContact CB-CD2 4.39Å; K356-Y358 HydrophobicContact CB-CE2 3.82Å; K356-Y358 WeakPolarHBondContact O-CD2 3.44Å
359	F	98.7	Very high	98.1	Very high	13 Å²	13	27.1 Å²	27.1	6%	0.057	12%	0.123	C	C	.	.			trans	-59.7	142.9	177.2	-69.6	-83	0	0	0	111.4	W264 R266 L269 G272 V274 S305 L364	W264-F359 HydrophobicContact CB-CE1 4.38Å; W264-F359 HydrophobicContact CB-CZ 4.07Å; W264-F359 WeakPolarHBondContact O-CE1 3.41Å; R266-F359 HydrophobicContact CB-CB 4.47Å; R266-F359 HydrophobicContact CB-CD1 3.95Å; R266-F359 HydrophobicContact CB-CD2 3.96Å; R266-F359 HydrophobicContact CB-CE1 4.13Å; R266-F359 HydrophobicContact CB-CE2 4.16Å; R266-F359 HydrophobicContact CB-CG 3.87Å; R266-F359 HydrophobicContact CB-CZ 4.24Å; R266-F359 HydrophobicContact CG-CB 4.34Å; R266-F359 HydrophobicContact CG-CD2 3.85Å; R266-F359 HydrophobicContact CG-CE2 4.31Å; R266-F359 HydrophobicContact CG-CG 4.02Å; L269-F359 HydrophobicContact CD2-CE2 4.09Å; L269-F359 HydrophobicContact CD2-CZ 4.08Å; G272-F359 WeakPolarHBondContact O-CD2 3.49Å; G272-F359 PolarHBondContact O-N 3.46Å; G272-F359 VanDerWaalsContact O-N 3.13Å; V274-F359 HydrophobicContact CG2-CE1 4.21Å; V274-F359 HydrophobicContact CG2-CE2 3.94Å; V274-F359 HydrophobicContact CG2-CZ 3.5Å; V274-F359 VanDerWaalsContact CG2-CZ 3.5Å; S305-F359 PolarHBondContact OG-O 3.01Å; F359-L364 HydrophobicContact CD1-CB 3.72Å; F359-L364 HydrophobicContact CE1-CB 3.54Å
360	A	97.8	Very high	98.2	Very high	33 Å²	33	25.1 Å²	25.1	27%	0.273	11%	0.11	S	C	.	.	S	Bend	trans	-108.9	-14.6	168.3	0	0	0	0	0	113	R302 V303 L330	R302-A360 HydrophobicContact CB-CB 4.09Å; R302-A360 HydrophobicContact CG-CB 3.87Å; V303-A360 WeakPolarHBondContact O-CB 3.23Å; L330-A360 HydrophobicContact CD1-CB 3.42Å; L330-A360 VanDerWaalsContact CD1-CB 3.42Å
361	D	97.1	Very high	98.2	Very high	45 Å²	45	25.2 Å²	25.2	24%	0.241	11%	0.111	C	C	.	.	S	Bend	trans	-150.8	-162	179.9	-152.3	-39.6	0	0	0	109.1	R302	R302-D361 HydrophobicContact CB-CB 3.55Å
362	R	97.8	Very high	98.1	Very high	153 Å²	153	26.5 Å²	26.5	58%	0.577	12%	0.118	S	C	*	.	S	Bend	trans	-66.8	-35.6	-177.8	-65.2	-176.5	-65.5	161.8	3.9	113	R266 Q299 G300	R266-R362 WeakPolarHBondContact CB-O 3.26Å; R266-R362 PolarHBondContact N-O 3.49Å; Q299-R362 PolarHBondContact O-NH2 3.46Å; G300-R362 PolarHBondContact O-N 2.88Å
363	W	98.6	Very high	98	Very high	29 Å²	29	27.2 Å²	27.2	11%	0.11	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.9	-176.4	-71.2	86.4	0	0	0	112.2	H205 V206 M207 L216 W264 G300 V301 R302 L365	H205-W363 HydrophobicContact CB-CH2 3.88Å; H205-W363 HydrophobicContact CB-CZ3 3.86Å; V206-W363 WeakPolarHBondContact O-CH2 3.29Å; M207-W363 HydrophobicContact CB-CH2 3.66Å; M207-W363 HydrophobicContact CB-CZ2 3.6Å; M207-W363 HydrophobicContact CB-CZ3 4.12Å; M207-W363 HydrophobicContact CE-CB 4.05Å; M207-W363 HydrophobicContact CE-CD2 3.49Å; M207-W363 VanDerWaalsContact CE-CD2 3.49Å; M207-W363 HydrophobicContact CE-CE3 3.92Å; M207-W363 HydrophobicContact CE-CG 3.53Å; M207-W363 HydrophobicContact CG-CH2 4.39Å; M207-W363 HydrophobicContact CG-CZ2 3.84Å; L216-W363 HydrophobicContact CD1-CE3 3.91Å; L216-W363 HydrophobicContact CD1-CH2 4.48Å; L216-W363 HydrophobicContact CD1-CZ3 3.68Å; W264-W363 VanDerWaalsContact C-CE3 3.45Å; W264-W363 WeakPolarHBondContact O-CA 3.26Å; G300-W363 PolarHBondContact O-N 3.23Å; V301-W363 HydrophobicContact CG2-CB 3.86Å; R302-W363 PolarHBondContact N-O 2.89Å; R302-W363 VanDerWaalsContact N-O 3.13Å; W363-L365 HydrophobicContact CE3-CD2 4.33Å
364	L	98.8	Very high	97.8	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.1	167.8	172.4	61.6	0	0	0	108	G263 W264 V274 F304 F357 F359 I366	G263-L364 WeakPolarHBondContact CA-O 3.44Å; W264-L364 HydrophobicContact CE3-CD2 4.5Å; W264-L364 HydrophobicContact CE3-CG 4.4Å; W264-L364 PolarHBondContact N-O 3.23Å; W264-L364 PolarHBondContact O-N 2.93Å; V274-L364 HydrophobicContact CB-CD2 4.29Å; V274-L364 HydrophobicContact CG2-CD2 3.9Å; F304-L364 HydrophobicContact CB-CD1 4.07Å; F304-L364 HydrophobicContact CB-CD2 4.44Å; F304-L364 HydrophobicContact CD1-CD1 4.07Å; F357-L364 HydrophobicContact CB-CD2 3.69Å; F359-L364 HydrophobicContact CD1-CB 3.72Å; F359-L364 HydrophobicContact CE1-CB 3.54Å; L364-I366 HydrophobicContact CD1-CG1 4.26Å; L364-I366 HydrophobicContact CD2-CD1 4.34Å; L364-I366 HydrophobicContact CG-CD1 4.46Å; L364-I366 HydrophobicContact CG-CG1 4.33Å
365	L	98.8	Very high	97.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.3	175.4	-50.7	-173.9	0	0	0	109.9	L216 F247 Y261 L262 S293 N294 V301 W363	L216-L365 HydrophobicContact CD1-CD2 3.51Å; L216-L365 HydrophobicContact CD2-CD1 4.21Å; L216-L365 HydrophobicContact CD2-CD2 3.97Å; L216-L365 HydrophobicContact CG-CD2 4.22Å; F247-L365 HydrophobicContact CB-CD1 3.73Å; F247-L365 HydrophobicContact CD1-CD1 3.8Å; F247-L365 HydrophobicContact CD2-CD1 3.99Å; F247-L365 HydrophobicContact CE1-CD1 4.43Å; F247-L365 HydrophobicContact CG-CD1 3.56Å; Y261-L365 HydrophobicContact CD1-CB 3.71Å; Y261-L365 HydrophobicContact CE1-CB 4.35Å; Y261-L365 HydrophobicContact CG-CB 4.19Å; L262-L365 WeakPolarHBondContact O-CA 3.4Å; S293-L365 WeakPolarHBondContact CA-O 3.34Å; S293-L365 WeakPolarHBondContact CB-O 3.26Å; S293-L365 PolarHBondContact OG-O 2.7Å; N294-L365 HydrophobicContact CB-CB 3.99Å; N294-L365 HydrophobicContact CB-CD1 4.27Å; N294-L365 PolarHBondContact N-O 2.83Å; V301-L365 HydrophobicContact CG1-CB 4.2Å; V301-L365 HydrophobicContact CG1-CD1 3.79Å; V301-L365 HydrophobicContact CG1-CG 3.64Å; V301-L365 HydrophobicContact CG2-CD1 3.9Å; V301-L365 HydrophobicContact CG2-CG 4.16Å; W363-L365 HydrophobicContact CE3-CD2 4.33Å
366	I	98.8	Very high	96.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.2	176.7	-60.3	176.6	0	0	0	107.4	L237 L262 W264 V291 H292 F357 L364 I369	L237-I366 HydrophobicContact CD2-CB 4.11Å; L237-I366 HydrophobicContact CD2-CG2 3.74Å; L262-I366 PolarHBondContact N-O 3.37Å; L262-I366 PolarHBondContact O-N 2.86Å; W264-I366 HydrophobicContact CZ3-CB 4.31Å; W264-I366 HydrophobicContact CZ3-CD1 4.04Å; W264-I366 HydrophobicContact CZ3-CG1 4.18Å; V291-I366 HydrophobicContact CG1-CD1 3.86Å; V291-I366 HydrophobicContact CG1-CG1 4.01Å; V291-I366 HydrophobicContact CG1-CG2 3.72Å; H292-I366 WeakPolarHBondContact O-CA 3.26Å; F357-I366 HydrophobicContact CD1-CD1 4.45Å; L364-I366 HydrophobicContact CD1-CG1 4.26Å; L364-I366 HydrophobicContact CD2-CD1 4.34Å; L364-I366 HydrophobicContact CG-CD1 4.46Å; L364-I366 HydrophobicContact CG-CG1 4.33Å; I366-I369 HydrophobicContact CD1-CD1 4.39Å; I366-I369 HydrophobicContact CG2-CD1 4.08Å; I366-I369 HydrophobicContact CG2-CG1 3.67Å
367	S	98.3	Very high	95.6	Very high	1 Å²	1	37 Å²	37	1%	0.007	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-30	173.7	67.8	0	0	0	0	112	G243 D260 H292	G243-S367 VanDerWaalsContact N-CB 3.31Å; G243-S367 PolarHBondContact N-OG 3.1Å; D260-S367 WeakPolarHBondContact O-CA 3.46Å; D260-S367 WeakPolarHBondContact O-CB 3.33Å; H292-S367 PolarHBondContact ND1-OG 2.62Å; H292-S367 PolarHBondContact O-N 3.27Å
368	E	98	Very high	93.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	143	-171.3	-172.5	76.4	-159.6	0	0	110.8	W29 L237 C238 D239 G240 V241 L242 H292	W29-E368 HydrophobicContact CH2-CB 3.87Å; W29-E368 HydrophobicContact CH2-CG 3.37Å; W29-E368 HydrophobicContact CZ2-CB 3.98Å; W29-E368 HydrophobicContact CZ2-CG 3.04Å; W29-E368 HydrophobicContact CZ3-CG 4.46Å; L237-E368 CarbonylContact O-C 3.55Å; L237-E368 WeakPolarHBondContact O-CA 3.26Å; C238-E368 WeakPolarHBondContact CA-OE1 3.18Å; D239-E368 PolarHBondContact N-OE2 3.27Å; G240-E368 WeakPolarHBondContact CA-OE2 3.33Å; G240-E368 PolarHBondContact N-OE1 2.87Å; G240-E368 PolarHBondContact N-OE2 3.42Å; V241-E368 PolarHBondContact N-OE2 3.16Å; L242-E368 HydrophobicContact CD2-CB 3.71Å; L242-E368 HydrophobicContact CD2-CG 3.95Å; H292-E368 HydrophobicContact CB-CB 4.1Å; H292-E368 PolarHBondContact N-O 3.05Å
369	I	98.4	Very high	91.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.2	175.1	-55.7	-176.9	0	0	0	108.2	L237 I276 F278 M289 Q290 V291 F357 I366 F371	L237-I369 HydrophobicContact CD1-CD1 4.14Å; L237-I369 PolarHBondContact O-N 3.33Å; I276-I369 HydrophobicContact CD1-CD1 4.11Å; F278-I369 HydrophobicContact CE1-CB 4.5Å; F278-I369 HydrophobicContact CE1-CD1 4.01Å; F278-I369 HydrophobicContact CE1-CG2 4.06Å; F278-I369 HydrophobicContact CZ-CD1 3.7Å; F278-I369 HydrophobicContact CZ-CG2 4.07Å; M289-I369 HydrophobicContact CG-CG2 4.09Å; M289-I369 HydrophobicContact SD-CG2 4.12Å; Q290-I369 WeakPolarHBondContact O-CA 3.38Å; V291-I369 HydrophobicContact CG1-CG1 4.22Å; V291-I369 HydrophobicContact CG2-CG1 4.38Å; V291-I369 HydrophobicContact CG2-CG2 4.31Å; F357-I369 HydrophobicContact CZ-CD1 4.36Å; I366-I369 HydrophobicContact CD1-CD1 4.39Å; I366-I369 HydrophobicContact CG2-CD1 4.08Å; I366-I369 HydrophobicContact CG2-CG1 3.67Å; I369-F371 HydrophobicContact CG2-CE2 3.75Å; I369-F371 HydrophobicContact CG2-CZ 3.77Å
370	S	97.1	Very high	88.5	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.2	179.7	57.3	0	0	0	0	112.1	W29 H30 D194 M289 Q290	W29-S370 WeakPolarHBondContact CH2-OG 3.41Å; W29-S370 VanDerWaalsContact CZ2-CB 3.49Å; W29-S370 WeakPolarHBondContact CZ2-OG 3.35Å; H30-S370 WeakPolarHBondContact CE1-CB 3.39Å; H30-S370 PolarHBondContact CE1-OG 3.49Å; H30-S370 PolarHBondContact ND1-OG 3.28Å; D194-S370 VanDerWaalsContact OD2-CA 3.28Å; D194-S370 WeakPolarHBondContact OD2-CA 3.45Å; M289-S370 CarbonylContact C-O 3.52Å; M289-S370 WeakPolarHBondContact CA-O 3.19Å; Q290-S370 PolarHBondContact N-O 2.84Å; Q290-S370 PolarHBondContact O-N 3.44Å
371	F	97.1	Very high	85.7	Confident	3 Å²	3	59.8 Å²	59.8	1%	0.013	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.6	-171.9	-61	-90.7	0	0	0	111.6	D194 L196 F278 F280 F286 M289 L345 L353 I369 S373	D194-F371 WeakPolarHBondContact OD1-CD2 3.5Å; D194-F371 PolarHBondContact OD2-N 2.81Å; L196-F371 HydrophobicContact CD1-CE2 4.44Å; L196-F371 HydrophobicContact CD2-CE2 4.48Å; F278-F371 HydrophobicContact CB-CZ 4.17Å; F278-F371 AromaticContact CD1-CE2 3.74Å; F278-F371 HydrophobicContact CD1-CE2 3.74Å; F278-F371 AromaticContact CD1-CZ 3.61Å; F278-F371 HydrophobicContact CD1-CZ 3.61Å; F278-F371 HydrophobicContact CD2-CE1 4.45Å; F278-F371 AromaticContact CD2-CZ 3.74Å; F278-F371 HydrophobicContact CD2-CZ 3.74Å; F278-F371 HydrophobicContact CE1-CE2 4.04Å; F278-F371 AromaticContact CE1-CZ 3.83Å; F278-F371 HydrophobicContact CE1-CZ 3.83Å; F278-F371 AromaticContact CE2-CZ 3.94Å; F278-F371 HydrophobicContact CE2-CZ 3.94Å; F278-F371 HydrophobicContact CG-CE2 4.06Å; F278-F371 AromaticContact CG-CZ 3.56Å; F278-F371 HydrophobicContact CG-CZ 3.56Å; F278-F371 AromaticContact CZ-CZ 3.98Å; F278-F371 HydrophobicContact CZ-CZ 3.98Å; F280-F371 HydrophobicContact CE1-CB 4.11Å; F280-F371 AromaticContact CE1-CD2 3.84Å; F280-F371 HydrophobicContact CE1-CD2 3.84Å; F280-F371 HydrophobicContact CE1-CE2 4.41Å; F280-F371 AromaticContact CE1-CG 3.91Å; F280-F371 HydrophobicContact CE1-CG 3.91Å; F280-F371 HydrophobicContact CZ-CB 4.31Å; F280-F371 AromaticContact CZ-CD1 3.88Å; F280-F371 HydrophobicContact CZ-CD1 3.88Å; F280-F371 AromaticContact CZ-CD2 3.63Å; F280-F371 HydrophobicContact CZ-CD2 3.63Å; F280-F371 HydrophobicContact CZ-CE1 4.05Å; F280-F371 AromaticContact CZ-CE2 3.82Å; F280-F371 HydrophobicContact CZ-CE2 3.82Å; F280-F371 AromaticContact CZ-CG 3.66Å; F280-F371 HydrophobicContact CZ-CG 3.66Å; F280-F371 HydrophobicContact CZ-CZ 4.03Å; F286-F371 HydrophobicContact CD1-CB 4.3Å; F286-F371 AromaticContact CD1-CD1 3.97Å; F286-F371 HydrophobicContact CD1-CD1 3.97Å; F286-F371 HydrophobicContact CD1-CG 4.49Å; F286-F371 HydrophobicContact CE1-CB 4.04Å; F286-F371 AromaticContact CE1-CD1 3.88Å; F286-F371 HydrophobicContact CE1-CD1 3.88Å; F286-F371 HydrophobicContact CE1-CG 4.14Å; M289-F371 HydrophobicContact CB-CD1 4.07Å; M289-F371 HydrophobicContact CB-CE1 4.13Å; M289-F371 HydrophobicContact CG-CD1 4.09Å; M289-F371 HydrophobicContact CG-CE1 3.77Å; M289-F371 HydrophobicContact CG-CZ 4.3Å; M289-F371 HydrophobicContact SD-CD1 4.36Å; M289-F371 HydrophobicContact SD-CE1 3.48Å; M289-F371 WeakPolarHBondContact SD-CE1 3.25Å; M289-F371 HydrophobicContact SD-CZ 3.86Å; L345-F371 HydrophobicContact CD1-CD1 4.37Å; L353-F371 HydrophobicContact CD2-CD1 4.33Å; L353-F371 HydrophobicContact CD2-CE1 3.91Å; I369-F371 HydrophobicContact CG2-CE2 3.75Å; I369-F371 HydrophobicContact CG2-CZ 3.77Å; F371-S373 PolarHBondContact O-N 3.1Å
372	L	95.3	Very high	83	Confident	59 Å²	59	64.5 Å²	64.5	31%	0.309	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.8	166.6	-67.7	85.9	0	0	0	108.4	H30 N287 N288 Q290	H30-L372 WeakPolarHBondContact CE1-CD1 3.3Å; H30-L372 VanDerWaalsContact ND1-CD1 3.28Å; H30-L372 WeakPolarHBondContact ND1-CD1 3.38Å; N287-L372 WeakPolarHBondContact CB-O 3.48Å; N287-L372 PolarHBondContact N-O 3.23Å; N288-L372 HydrophobicContact CB-CB 4.22Å; N288-L372 HydrophobicContact CB-CD1 4.13Å; N288-L372 PolarHBondContact N-O 3.47Å; N288-L372 PolarHBondContact O-N 3.01Å; Q290-L372 HydrophobicContact CG-CD1 4.24Å
373	S	95.3	Very high	80.2	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.154	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	163	-178.9	62.6	0	0	0	0	111.6	R284 L285 F371	R284-S373 WeakPolarHBondContact CD-OG 3.46Å; R284-S373 PolarHBondContact NH1-O 2.81Å; R284-S373 PolarHBondContact NH1-OG 2.97Å; L285-S373 WeakPolarHBondContact O-CA 3.45Å; L285-S373 WeakPolarHBondContact O-CB 3.26Å; F371-S373 PolarHBondContact O-N 3.1Å
374	E	94.4	Very high	77.3	Confident	100 Å²	100	65.2 Å²	65.2	47%	0.467	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.1	175.3	58.1	-173.5	164.2	0	0	110.8	R284 L285	R284-E374 CarbonylContact C-O 3.6Å; R284-E374 WeakPolarHBondContact CA-O 3.39Å; R284-E374 WeakPolarHBondContact CB-O 3.28Å; L285-E374 HydrophobicContact CB-CG 3.84Å; L285-E374 WeakPolarHBondContact CD2-OE1 3.41Å; L285-E374 PolarHBondContact N-O 3.1Å; L285-E374 PolarHBondContact O-N 2.85Å; L285-E374 VanDerWaalsContact O-N 3.15Å
375	P	92.4	Very high	74.2	Confident	98 Å²	98	70 Å²	70	64%	0.636	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.6	139.6	174.1	-25.2	34.8	0	0	0	112.2
376	F	86.3	Confident	71.1	Confident	94 Å²	94	80.1 Å²	80.1	41%	0.412	45%	0.447	S	S	.	.			trans	-137.9	131.8	-175.3	176	-97.9	0	0	0	111	P283 L285 P349	P283-F376 CarbonylContact C-O 3.55Å; P283-F376 WeakPolarHBondContact CB-O 3.34Å; P283-F376 PolarHBondContact O-N 3.47Å; P283-F376 VanDerWaalsContact O-O 3.13Å; L285-F376 HydrophobicContact CB-CB 4.25Å; L285-F376 HydrophobicContact CB-CD2 4.45Å; L285-F376 HydrophobicContact CD1-CD2 4.07Å; L285-F376 HydrophobicContact CD1-CE2 4.32Å; P349-F376 HydrophobicContact CB-CD1 3.5Å; P349-F376 VanDerWaalsContact CB-CD1 3.5Å; P349-F376 HydrophobicContact CB-CE1 3.32Å; P349-F376 HydrophobicContact CB-CE2 4.43Å; P349-F376 HydrophobicContact CB-CG 4.15Å; P349-F376 HydrophobicContact CB-CZ 3.83Å; P349-F376 HydrophobicContact CG-CE1 4.14Å; P349-F376 HydrophobicContact CG-CZ 4.31Å
377	G	70.9	Confident	67.9	Low	67 Å²	67	87.6 Å²	87.6	69%	0.691	48%	0.482	S	S	*	.	S	Bend	trans	83.8	29.3	165.1	0	0	0	0	0	117.5
378	E	59.9	Low	64.8	Low	120 Å²	120	96.4 Å²	96.4	56%	0.561	52%	0.523	S	S	*	.			trans	-111	135.4	159.3	-76.3	179.8	171.2	0	0	109.6	K282	K282-E378 IonicContact NZ-OE1 3.91Å; K282-E378 IonicContact NZ-OE2 2.72Å; K282-E378 PolarHBondContact NZ-OE2 2.72Å
379	D	44.5	Very low	61.7	Low	151 Å²	151	103.8 Å²	103.8	81%	0.807	56%	0.562	S	S	*	*			trans	-54.6	142.6	166.7	-81.6	-39.4	0	0	0	109.6	T381	D379-T381 PolarHBondContact O-N 3.41Å
380	E	42.5	Very low	58.5	Low	188 Å²	188	112.1 Å²	112.1	88%	0.879	60%	0.601	S	S	*	*	S	Bend	trans	-62.1	66.4	178	-64.2	-179	149	0	0	113.1
381	T	39.5	Very low	55.5	Low	121 Å²	121	117.6 Å²	117.6	74%	0.742	64%	0.637	S	S	*	*	S	Bend	trans	-116.2	-3.7	173.5	52.9	0	0	0	0	114.8	D379	D379-T381 PolarHBondContact O-N 3.41Å
382	D	40.8	Very low	52.2	Low	144 Å²	144	127.6 Å²	127.6	77%	0.77	68%	0.68	S	S	*	*	S	Bend	trans	-111.8	8.5	170.8	-88.1	-15.3	0	0	0	113.4	D384	D382-D384 PolarHBondContact O-N 3.23Å
383	A	39.3	Very low	49	Very low	77 Å²	77	130.2 Å²	130.2	64%	0.636	70%	0.703	S	S	*	*			trans	-89.4	50.5	164.2	0	0	0	0	0	110.3
384	D	36.6	Very low	46.2	Very low	120 Å²	120	134.9 Å²	134.9	64%	0.642	73%	0.733	S	S	*	*			trans	-144.9	85.1	169.8	-130.9	-2.2	0	0	0	111.4	D382 H387	D382-D384 PolarHBondContact O-N 3.23Å; D384-H387 IonicContact OD1-CD2 2.7Å
385	S	34	Very low	43.1	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	75%	0.752	S	S	*	*	S	Bend	trans	-173.3	72.7	139.4	42.8	0	0	0	0	108.6
386	F	34.3	Very low	40.4	Very low	212 Å²	212	138.9 Å²	138.9	93%	0.93	76%	0.758	S	S	*	*			trans	-175.7	61.4	145.1	-85	-59.1	0	0	0	109.3	Q388	F386-Q388 PolarHBondContact O-N 3.34Å
387	H	30.2	Very low	37.9	Very low	158 Å²	158	139.6 Å²	139.6	73%	0.731	78%	0.775	S	S	*	*			trans	-83.8	107	161	-86.2	-59.7	0	0	0	109.5	D384 N389	D384-H387 IonicContact OD1-CD2 2.7Å; H387-N389 PolarHBondContact O-N 2.88Å
388	Q	34.3	Very low	36.6	Very low	185 Å²	185	142 Å²	142	86%	0.864	78%	0.779	S	S	*	*			trans	-60.1	118.8	165.7	-79.4	-177.3	-14.6	0	0	109.7	F386 H390	F386-Q388 PolarHBondContact O-N 3.34Å; Q388-H390 PolarHBondContact O-N 3.14Å
389	N	32.1	Very low	35.2	Very low	156 Å²	156	142.4 Å²	142.4	83%	0.834	79%	0.79	S	S	*	*			trans	-65.9	115.9	165.8	-79.3	-50.1	0	0	0	109.9	H387	H387-N389 PolarHBondContact O-N 2.88Å
390	H	31.7	Very low	35.1	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.815	79%	0.785	S	S	*	*			trans	-139.8	144	149.8	-95.8	-57.3	0	0	0	111.8	Q388	Q388-H390 PolarHBondContact O-N 3.14Å
391	P	34.6	Very low	34.4	Very low	118 Å²	118	140 Å²	140	77%	0.766	79%	0.788	S	S	*	*			trans	-82.4	145	-154.9	31.7	-35.8	0	0	0	114.5
392	K	27.5	Very low	33.9	Very low	213 Å²	213	137.9 Å²	137.9	93%	0.926	79%	0.79	S	S	*	*			trans	-65.6	141.1	170.5	-77.6	174.4	174.6	173	0	112.1
393	S	28.3	Very low	33.3	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	80%	0.795	S	S	*	*			trans	-136.6	153.2	148.7	68	0	0	0	0	109.7
394	P	36.5	Very low	32.9	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	81%	0.805	S	S	*	*			trans	-105.2	147.4	-142	36.6	-30.2	0	0	0	114.5
395	D	28.4	Very low	32.4	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	81%	0.807	S	S	*	*			trans	-78.5	153.4	157	-98.8	-23.3	0	0	0	110.9
396	P	37.3	Very low	32	Very low	118 Å²	118	142.6 Å²	142.6	77%	0.766	81%	0.81	S	S	*	*			trans	-117.3	124.9	148.1	33.3	-19.6	0	0	0	111.2
397	S	32.4	Very low	31.8	Very low	110 Å²	110	138.1 Å²	138.1	77%	0.769	81%	0.805	S	S	*	*			trans	-74.1	175.9	155.5	44.6	0	0	0	0	109.9
398	P	43.6	Very low	31.6	Very low	118 Å²	118	133.9 Å²	133.9	77%	0.766	80%	0.804	S	S	*	*			cis	-142.6	178.6	19.1	36.4	-12.1	0	0	0	117.9
399	T	31.4	Very low	32.3	Very low	128 Å²	128	130.6 Å²	130.6	79%	0.785	80%	0.799	S	S	*	*			trans	-39.5	170	165.8	19.9	0	0	0	0	116.7
400	P	42	Very low	32.1	Very low	109 Å²	109	129 Å²	129	71%	0.708	80%	0.795	S	S	*	*			cis	-155.8	173.1	43.3	42.2	-18.8	0	0	0	120.9
401	L	27.9	Very low	32	Very low	178 Å²	178	125.7 Å²	125.7	93%	0.932	79%	0.792	S	S	*	*			trans	55.8	132.9	146.3	-104.9	78.7	0	0	0	122.7
402	G	28	Very low	31.8	Very low	77 Å²	77	124.2 Å²	124.2	79%	0.794	79%	0.785	S	S	*	*			trans	173.7	100.4	154.8	0	0	0	0	0	114.8
403	N	28.3	Very low	32.1	Very low	163 Å²	163	121.6 Å²	121.6	87%	0.872	78%	0.775	S	S	*	*			trans	-60.6	155.5	166.8	-73	-27.2	0	0	0	112
404	V	30.9	Very low	32.1	Very low	140 Å²	140	122.3 Å²	122.3	85%	0.848	77%	0.77	S	S	*	*				164.8	150.3	118.4	162.8	0	0	0	0	112
405	T	26	Very low	31.8	Very low	112 Å²	112	121.4 Å²	121.4	69%	0.687	77%	0.766	S	S	*	*			trans	-79.4	154.1	-166.8	-5.8	0	0	0	0	116.4
406	T	27.3	Very low	31.9	Very low	126 Å²	126	122.4 Å²	122.4	77%	0.773	76%	0.763	S	S	*	*			trans	66.4	141.8	142.7	33.5	0	0	0	0	124.8
407	S	29.2	Very low	31.5	Very low	118 Å²	118	120.5 Å²	120.5	83%	0.825	75%	0.753	S	S	*	*			trans	94.8	122.7	144.8	70.7	0	0	0	0	119.9
408	G	26.2	Very low	31.3	Very low	69 Å²	69	121 Å²	121	71%	0.711	75%	0.752	S	S	*	*			trans	-80.2	-157.9	154.3	0	0	0	0	0	110.9
409	P	49.1	Very low	30.7	Very low	117 Å²	117	120.6 Å²	120.6	76%	0.76	75%	0.752	S	S	*	*			cis	-135.5	-156.2	-1.3	38.6	-16.8	0	0	0	113.9
410	T	27.6	Very low	30.6	Very low	121 Å²	121	119.7 Å²	119.7	74%	0.742	75%	0.75	S	S	*	*			trans	81.6	111.5	159.3	39.4	0	0	0	0	120.2
411	S	29.7	Very low	30.1	Very low	108 Å²	108	123.9 Å²	123.9	76%	0.755	76%	0.758	S	S	*	*				90.3	143.1	96.1	74.9	0	0	0	0	112
412	S	29.9	Very low	31	Very low	87 Å²	87	120.8 Å²	120.8	61%	0.608	75%	0.748	S	S	*	*			cis	-175.6	179.4	24.4	37.1	0	0	0	0	109.8
413	H	33.4	Very low	31.1	Very low	158 Å²	158	121.5 Å²	121.5	73%	0.731	74%	0.741	S	S	*	*			trans	91.8	135.9	163.3	-60.8	-75.2	0	0	0	117.5
414	D	28	Very low	31.2	Very low	129 Å²	129	120.6 Å²	120.6	69%	0.69	73%	0.731	S	S	*	*			cis	-165.7	152.4	-2.6	-121.6	-28.2	0	0	0	110.8
415	S	31.3	Very low	31.1	Very low	100 Å²	100	122 Å²	122	70%	0.699	73%	0.727	S	S	*	*			trans	29.2	150.6	144.8	70.3	0	0	0	0	122.6
416	F	29.9	Very low	31.2	Very low	184 Å²	184	121 Å²	121	81%	0.807	73%	0.73	S	S	*	*			cis	-172.1	136.9	30	-161.8	-118	0	0	0	111.9
417	S	29	Very low	31.3	Very low	79 Å²	79	119.1 Å²	119.1	55%	0.552	73%	0.727	S	S	*	*			trans	49.9	154.5	137	101.2	0	0	0	0	123.1
418	T	29.3	Very low	31.2	Very low	120 Å²	120	120.1 Å²	120.1	74%	0.736	73%	0.727	S	S	*	*			cis	-169.4	151.4	11.1	-7	0	0	0	0	111.4
419	S	29.7	Very low	31.6	Very low	110 Å²	110	122.8 Å²	122.8	77%	0.769	73%	0.73	S	S	*	*			trans	62.3	145.6	134.8	-137.5	0	0	0	0	120.5
420	S	29.8	Very low	31.3	Very low	108 Å²	108	122.9 Å²	122.9	76%	0.755	73%	0.731	S	S	*	*			cis	-166.4	145.8	25.6	48.5	0	0	0	0	111.8
421	K	32.6	Very low	31.5	Very low	198 Å²	198	128.8 Å²	128.8	86%	0.861	74%	0.739	S	S	*	*			trans	-88.8	178.8	154.8	-110.3	-178.3	-174.1	-178.8	0	108.7
422	P	45.7	Very low	31.6	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	74%	0.743	S	S	*	*			cis	-158.5	-173.3	44.4	41.5	-16.7	0	0	0	119.3
423	S	29.7	Very low	31.6	Very low	92 Å²	92	127.9 Å²	127.9	64%	0.643	75%	0.751	S	S	*	*			trans	63.8	147.7	143	-86.6	0	0	0	0	122.4
424	E	30.6	Very low	31.6	Very low	144 Å²	144	128.5 Å²	128.5	67%	0.673	76%	0.759	S	S	*	*			cis	-179.8	162.5	-9.6	-124.9	167.6	165.2	0	0	111.9
425	F	28.5	Very low	32.3	Very low	171 Å²	171	127.4 Å²	127.4	75%	0.75	76%	0.758	S	S	*	*			trans	61	116.3	149	-74.8	-61.9	0	0	0	121.6
426	A	28.3	Very low	32.9	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	77%	0.766	S	S	*	*				81	148.9	79.9	0	0	0	0	0	113.9
427	A	30.1	Very low	33.2	Very low	86 Å²	86	125.3 Å²	125.3	71%	0.711	77%	0.766	S	S	*	*			cis	-170.3	176.5	-13.1	0	0	0	0	0	106.6
428	V	27.9	Very low	34	Very low	138 Å²	138	130.2 Å²	130.2	84%	0.836	78%	0.778	S	S	*	*			trans	98.6	122.7	152	-162.5	0	0	0	0	119.5
429	T	33.2	Very low	34.9	Very low	125 Å²	125	131.2 Å²	131.2	77%	0.767	78%	0.779	S	S	*	*			trans	-61.6	-178.6	165.5	39.8	0	0	0	0	114.4
430	P	43.5	Very low	36	Very low	120 Å²	120	132 Å²	132	78%	0.779	77%	0.774	S	S	*	*			cis	-147.5	170	18.2	39.6	-16	0	0	0	119.8
431	R	31.7	Very low	37.4	Very low	245 Å²	245	128.7 Å²	128.7	93%	0.925	76%	0.757	S	S	*	*			trans	41.1	125	149.6	-101.5	-176.5	174.4	158.9	-1.6	126.2
432	A	32.6	Very low	38.7	Very low	100 Å²	100	122.6 Å²	122.6	83%	0.826	74%	0.739	S	S	*	*				85.4	121.7	123.5	0	0	0	0	0	124
433	G	29.8	Very low	39.4	Very low	75 Å²	75	122.7 Å²	122.7	77%	0.773	73%	0.734	S	S	*	*			trans	142.8	98.9	147.2	0	0	0	0	0	118.3
434	L	31.9	Very low	41.1	Very low	172 Å²	172	122.5 Å²	122.5	90%	0.901	73%	0.729	S	S	*	*			trans	18.7	164.2	149.3	-70.9	154.3	0	0	0	123
435	P	44.5	Very low	42.8	Very low	105 Å²	105	118.7 Å²	118.7	68%	0.682	72%	0.722	S	S	*	*			cis	-135.3	162	-22.9	33.8	-12.8	0	0	0	116.6
436	V	42.5	Very low	45	Very low	143 Å²	143	115.3 Å²	115.3	87%	0.867	71%	0.711	S	S	*	*			trans	55.6	114.4	145.7	-177.3	0	0	0	0	121.7
437	A	37.3	Very low	47.2	Very low	98 Å²	98	116.7 Å²	116.7	81%	0.81	71%	0.705	S	S	*	*				-148.9	137.9	126.2	0	0	0	0	0	109.3
438	K	44.9	Very low	49.6	Very low	182 Å²	182	117.8 Å²	117.8	79%	0.791	70%	0.698	S	S	*	*			trans	-77.4	126.9	-172.8	-173.6	174.1	178.1	172.1	0	110.2
439	D	49.5	Very low	52.3	Low	141 Å²	141	113.4 Å²	113.4	75%	0.754	68%	0.68	S	S	*	*			trans	-119.4	104.6	178.5	-164.7	7.7	0	0	0	109.7	G441	D439-G441 PolarHBondContact O-N 2.97Å; D439-G441 PolarHBondContact OD1-N 3.32Å
440	D	51	Low	54.7	Low	127 Å²	127	111 Å²	111	68%	0.679	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	21.5	178.8	-74.5	-38.3	0	0	0	112.3
441	G	59	Low	56.8	Low	38 Å²	38	110.7 Å²	110.7	39%	0.392	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-9.5	178.7	0	0	0	0	0	116.8	D439 T444	D439-G441 PolarHBondContact O-N 2.97Å; D439-G441 PolarHBondContact OD1-N 3.32Å; G441-T444 PolarHBondContact O-OG1 3.45Å
442	S	59.8	Low	59.6	Low	69 Å²	69	102.5 Å²	102.5	48%	0.483	64%	0.636	S	S	.	*	H	α-helix	trans	-80.4	-35.7	-167.8	-171.8	0	0	0	0	114.3	T444 I446	S442-T444 PolarHBondContact O-N 3.19Å; S442-I446 WeakPolarHBondContact O-CD1 3.23Å; S442-I446 VanDerWaalsContact O-CG1 3.29Å; S442-I446 WeakPolarHBondContact O-CG1 3.45Å; S442-I446 PolarHBondContact O-N 3.02Å
443	N	61.8	Low	62.3	Low	115 Å²	115	99.6 Å²	99.6	62%	0.615	62%	0.615	S	S	*	*	H	α-helix	trans	-74.2	-32.5	-171.9	-64.5	-35.7	0	0	0	113	L447	N443-L447 WeakPolarHBondContact O-CB 3.32Å; N443-L447 WeakPolarHBondContact O-CD1 3.35Å; N443-L447 VanDerWaalsContact O-CG 3.27Å; N443-L447 WeakPolarHBondContact O-CG 3.09Å; N443-L447 PolarHBondContact O-N 2.86Å; N443-L447 VanDerWaalsContact O-N 3.1Å
444	T	64.2	Low	65.2	Low	88 Å²	88	100.9 Å²	100.9	54%	0.54	60%	0.603	S	S	.	*	H	α-helix	trans	-73.1	-39.1	177.6	38.7	0	0	0	0	112.2	G441 S442 L447 I448	G441-T444 PolarHBondContact O-OG1 3.45Å; S442-T444 PolarHBondContact O-N 3.19Å; T444-L447 PolarHBondContact O-N 3.03Å; T444-I448 WeakPolarHBondContact O-CD1 3.41Å; T444-I448 WeakPolarHBondContact O-CG1 3.14Å; T444-I448 PolarHBondContact O-N 2.92Å
445	A	67.4	Low	68.1	Low	64 Å²	64	96.7 Å²	96.7	53%	0.529	58%	0.581	S	S	.	*	H	α-helix	trans	-65.6	-39.2	176.5	0	0	0	0	0	112.4	I448 G449	A445-I448 PolarHBondContact O-N 2.87Å; A445-G449 PolarHBondContact O-N 2.98Å
446	I	74.1	Confident	70.3	Confident	100 Å²	100	96.9 Å²	96.9	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-68.6	-41	176.5	-64.7	167.5	0	0	0	110.9	S442 I448 G449 C450	S442-I446 WeakPolarHBondContact O-CD1 3.23Å; S442-I446 VanDerWaalsContact O-CG1 3.29Å; S442-I446 WeakPolarHBondContact O-CG1 3.45Å; S442-I446 PolarHBondContact O-N 3.02Å; I446-I448 PolarHBondContact O-N 3.12Å; I446-G449 PolarHBondContact O-N 2.62Å; I446-C450 PolarHBondContact O-N 3.4Å
447	L	75.3	Confident	72.6	Confident	120 Å²	120	95.5 Å²	95.5	63%	0.628	56%	0.563	S	S	*	*	H	α-helix	trans	-63.1	-41	175.6	-79.5	165.5	0	0	0	112.3	N443 T444 C450 L451	N443-L447 WeakPolarHBondContact O-CB 3.32Å; N443-L447 WeakPolarHBondContact O-CD1 3.35Å; N443-L447 VanDerWaalsContact O-CG 3.27Å; N443-L447 WeakPolarHBondContact O-CG 3.09Å; N443-L447 PolarHBondContact O-N 2.86Å; N443-L447 VanDerWaalsContact O-N 3.1Å; T444-L447 PolarHBondContact O-N 3.03Å; L447-C450 PolarHBondContact O-N 2.92Å; L447-L451 WeakPolarHBondContact O-CB 3.3Å; L447-L451 PolarHBondContact O-N 3.43Å
448	I	80.8	Confident	75	Confident	109 Å²	109	95.5 Å²	95.5	56%	0.559	55%	0.548	S	S	*	.	H	α-helix	trans	-65.1	-41.7	175.5	-66	162.4	0	0	0	110.3	T444 A445 I446 C450 L451 V452	T444-I448 WeakPolarHBondContact O-CD1 3.41Å; T444-I448 WeakPolarHBondContact O-CG1 3.14Å; T444-I448 PolarHBondContact O-N 2.92Å; A445-I448 PolarHBondContact O-N 2.87Å; I446-I448 PolarHBondContact O-N 3.12Å; I448-C450 PolarHBondContact O-N 2.91Å; I448-L451 PolarHBondContact O-N 2.93Å; I448-V452 HydrophobicContact CG2-CG2 4.39Å; I448-V452 WeakPolarHBondContact O-CB 3.35Å; I448-V452 VanDerWaalsContact O-CG2 3.26Å; I448-V452 WeakPolarHBondContact O-CG2 3.34Å; I448-V452 PolarHBondContact O-N 2.94Å
449	G	83.8	Confident	77.3	Confident	45 Å²	45	91.2 Å²	91.2	46%	0.464	53%	0.534	S	S	.	.	H	α-helix	trans	-60.4	-44.2	175	0	0	0	0	0	113.1	A445 I446 G453	A445-G449 PolarHBondContact O-N 2.98Å; I446-G449 PolarHBondContact O-N 2.62Å; G449-G453 PolarHBondContact O-N 2.87Å
450	C	83.6	Confident	79.3	Confident	74 Å²	74	87.1 Å²	87.1	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-41.6	175.4	-75.6	0	0	0	0	112.2	I446 L447 I448 G453 I454	I446-C450 PolarHBondContact O-N 3.4Å; L447-C450 PolarHBondContact O-N 2.92Å; I448-C450 PolarHBondContact O-N 2.91Å; C450-G453 PolarHBondContact O-N 2.75Å; C450-I454 VanDerWaalsContact O-CG1 3.3Å; C450-I454 WeakPolarHBondContact O-CG1 3.35Å; C450-I454 PolarHBondContact O-N 2.94Å
451	L	87.3	Confident	81.2	Confident	114 Å²	114	84.5 Å²	84.5	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-62.8	-44.8	178.3	-159.7	93	0	0	0	111.1	L447 I448 G453 I454 I455	L447-L451 WeakPolarHBondContact O-CB 3.3Å; L447-L451 PolarHBondContact O-N 3.43Å; I448-L451 PolarHBondContact O-N 2.93Å; L451-G453 VanDerWaalsContact C-N 3.34Å; L451-I454 PolarHBondContact O-N 2.77Å; L451-I455 HydrophobicContact CD2-CD1 4.22Å; L451-I455 HydrophobicContact CG-CD1 4.26Å; L451-I455 WeakPolarHBondContact O-CD1 3.13Å; L451-I455 VanDerWaalsContact O-CG1 3.25Å; L451-I455 WeakPolarHBondContact O-CG1 3.47Å; L451-I455 PolarHBondContact O-N 3.02Å
452	V	90.9	Very high	82.8	Confident	74 Å²	74	86.8 Å²	86.8	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-40.2	176.3	173.6	0	0	0	0	110.9	I448 I455 L456	I448-V452 HydrophobicContact CG2-CG2 4.39Å; I448-V452 WeakPolarHBondContact O-CB 3.35Å; I448-V452 VanDerWaalsContact O-CG2 3.26Å; I448-V452 WeakPolarHBondContact O-CG2 3.34Å; I448-V452 PolarHBondContact O-N 2.94Å; V452-I455 PolarHBondContact O-N 2.85Å; V452-L456 HydrophobicContact CG1-CD1 4.11Å; V452-L456 HydrophobicContact CG1-CG 4.49Å; V452-L456 WeakPolarHBondContact O-CG 3.16Å; V452-L456 PolarHBondContact O-N 2.78Å
453	G	89.3	Confident	84.4	Confident	38 Å²	38	88 Å²	88	39%	0.392	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.3	0	0	0	0	0	113.2	G449 C450 L451 L456 L457	G449-G453 PolarHBondContact O-N 2.87Å; C450-G453 PolarHBondContact O-N 2.75Å; L451-G453 VanDerWaalsContact C-N 3.34Å; G453-L456 PolarHBondContact O-N 2.84Å; G453-L457 WeakPolarHBondContact O-CB 3.12Å; G453-L457 PolarHBondContact O-N 3.02Å
454	I	90.8	Very high	85.7	Confident	102 Å²	102	86.4 Å²	86.4	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-42.3	177.1	-67.1	164.8	0	0	0	110.7	C450 L451 L456 L457 L458	C450-I454 VanDerWaalsContact O-CG1 3.3Å; C450-I454 WeakPolarHBondContact O-CG1 3.35Å; C450-I454 PolarHBondContact O-N 2.94Å; L451-I454 PolarHBondContact O-N 2.77Å; I454-L456 PolarHBondContact O-N 3.47Å; I454-L457 PolarHBondContact O-N 2.89Å; I454-L458 HydrophobicContact CG2-CD1 3.97Å; I454-L458 HydrophobicContact CG2-CG 4.38Å; I454-L458 WeakPolarHBondContact O-CG 3.28Å; I454-L458 PolarHBondContact O-N 2.94Å
455	I	92.3	Very high	87	Confident	84 Å²	84	86.2 Å²	86.2	43%	0.431	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-44	177.8	-68.7	165.3	0	0	0	110.8	L451 V452 L457 L458 L459	L451-I455 HydrophobicContact CD2-CD1 4.22Å; L451-I455 HydrophobicContact CG-CD1 4.26Å; L451-I455 WeakPolarHBondContact O-CD1 3.13Å; L451-I455 VanDerWaalsContact O-CG1 3.25Å; L451-I455 WeakPolarHBondContact O-CG1 3.47Å; L451-I455 PolarHBondContact O-N 3.02Å; V452-I455 PolarHBondContact O-N 2.85Å; I455-L457 VanDerWaalsContact C-N 3.34Å; I455-L457 PolarHBondContact O-N 3.47Å; I455-L458 PolarHBondContact O-N 3.19Å; I455-L459 HydrophobicContact CG2-CD1 4.18Å; I455-L459 WeakPolarHBondContact O-CG 3.38Å; I455-L459 PolarHBondContact O-N 2.75Å
456	L	90.8	Very high	87.9	Confident	109 Å²	109	87.9 Å²	87.9	57%	0.571	50%	0.503	S	S	*	.	H	α-helix	trans	-64.7	-37.6	176.8	-72.2	173.7	0	0	0	112.3	V452 G453 I454 L459 A460	V452-L456 HydrophobicContact CG1-CD1 4.11Å; V452-L456 HydrophobicContact CG1-CG 4.49Å; V452-L456 WeakPolarHBondContact O-CG 3.16Å; V452-L456 PolarHBondContact O-N 2.78Å; G453-L456 PolarHBondContact O-N 2.84Å; I454-L456 PolarHBondContact O-N 3.47Å; L456-L459 PolarHBondContact O-N 2.86Å; L456-A460 PolarHBondContact O-N 2.97Å
457	L	90.3	Very high	88.5	Confident	115 Å²	115	90.3 Å²	90.3	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-66.7	-43	176.4	-170	145.9	0	0	0	111.5	G453 I454 I455 A460 V461	G453-L457 WeakPolarHBondContact O-CB 3.12Å; G453-L457 PolarHBondContact O-N 3.02Å; I454-L457 PolarHBondContact O-N 2.89Å; I455-L457 VanDerWaalsContact C-N 3.34Å; I455-L457 PolarHBondContact O-N 3.47Å; L457-A460 PolarHBondContact O-N 3.2Å; L457-V461 HydrophobicContact CD2-CG2 4.3Å; L457-V461 WeakPolarHBondContact O-CG2 3.44Å; L457-V461 PolarHBondContact O-N 2.88Å
458	L	89.3	Confident	88.7	Confident	97 Å²	97	93.1 Å²	93.1	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-40.8	175.4	-72.1	170.8	0	0	0	111.9	I454 I455 A460 V461 I462	I454-L458 HydrophobicContact CG2-CD1 3.97Å; I454-L458 HydrophobicContact CG2-CG 4.38Å; I454-L458 WeakPolarHBondContact O-CG 3.28Å; I454-L458 PolarHBondContact O-N 2.94Å; I455-L458 PolarHBondContact O-N 3.19Å; L458-A460 VanDerWaalsContact C-N 3.35Å; L458-A460 PolarHBondContact O-N 2.93Å; L458-V461 PolarHBondContact O-N 3.18Å; L458-I462 VanDerWaalsContact O-CG1 3.27Å; L458-I462 WeakPolarHBondContact O-CG1 3.34Å; L458-I462 PolarHBondContact O-N 2.55Å
459	L	93.1	Very high	88.6	Confident	92 Å²	92	93.3 Å²	93.3	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-41.2	174.8	-74.1	172.9	0	0	0	111.8	I455 L456 I462 V463	I455-L459 HydrophobicContact CG2-CD1 4.18Å; I455-L459 WeakPolarHBondContact O-CG 3.38Å; I455-L459 PolarHBondContact O-N 2.75Å; L456-L459 PolarHBondContact O-N 2.86Å; L459-I462 PolarHBondContact O-N 2.77Å; L459-V463 VanDerWaalsContact O-CG2 3.27Å; L459-V463 WeakPolarHBondContact O-CG2 3.23Å; L459-V463 PolarHBondContact O-N 2.04Å
460	A	90.7	Very high	88.6	Confident	56 Å²	56	98 Å²	98	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-42.4	175	0	0	0	0	0	111.9	L456 L457 L458 V463 V464	L456-A460 PolarHBondContact O-N 2.97Å; L457-A460 PolarHBondContact O-N 3.2Å; L458-A460 VanDerWaalsContact C-N 3.35Å; L458-A460 PolarHBondContact O-N 2.93Å; A460-V463 PolarHBondContact O-N 2.87Å; A460-V464 VanDerWaalsContact O-CG2 3.32Å; A460-V464 WeakPolarHBondContact O-CG2 3.37Å; A460-V464 PolarHBondContact O-N 2.83Å
461	V	91.5	Very high	88	Confident	71 Å²	71	100.2 Å²	100.2	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-44.4	175.7	172.3	0	0	0	0	111.2	L457 L458 V463 V464 I465	L457-V461 HydrophobicContact CD2-CG2 4.3Å; L457-V461 WeakPolarHBondContact O-CG2 3.44Å; L457-V461 PolarHBondContact O-N 2.88Å; L458-V461 PolarHBondContact O-N 3.18Å; V461-V463 VanDerWaalsContact C-N 3.35Å; V461-V463 PolarHBondContact O-N 3.17Å; V461-V464 PolarHBondContact O-N 2.76Å; V461-I465 HydrophobicContact CG1-CD1 3.87Å; V461-I465 HydrophobicContact CG1-CG1 4.46Å; V461-I465 VanDerWaalsContact O-CG1 3.32Å; V461-I465 WeakPolarHBondContact O-CG1 3.48Å; V461-I465 PolarHBondContact O-N 3.09Å
462	I	92.9	Very high	87.4	Confident	87 Å²	87	102.5 Å²	102.5	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.6	-68.6	165.2	0	0	0	110.6	L458 L459 V464 I465 L466	L458-I462 VanDerWaalsContact O-CG1 3.27Å; L458-I462 WeakPolarHBondContact O-CG1 3.34Å; L458-I462 PolarHBondContact O-N 2.55Å; L459-I462 PolarHBondContact O-N 2.77Å; I462-V464 VanDerWaalsContact C-N 3.32Å; I462-V464 PolarHBondContact O-N 3.17Å; I462-I465 PolarHBondContact O-N 3.4Å; I462-L466 HydrophobicContact CG2-CD1 3.88Å; I462-L466 HydrophobicContact CG2-CG 4.25Å; I462-L466 WeakPolarHBondContact O-CB 3.38Å; I462-L466 VanDerWaalsContact O-CG 3.32Å; I462-L466 WeakPolarHBondContact O-CG 3.49Å; I462-L466 PolarHBondContact O-N 2.92Å
463	V	91.9	Very high	86.6	Confident	93 Å²	93	106 Å²	106	56%	0.564	52%	0.524	S	S	*	.	H	α-helix	trans	-61.1	-40.6	176	170.1	0	0	0	0	111.1	L459 A460 V461 L466 W467	L459-V463 VanDerWaalsContact O-CG2 3.27Å; L459-V463 WeakPolarHBondContact O-CG2 3.23Å; L459-V463 PolarHBondContact O-N 2.04Å; A460-V463 PolarHBondContact O-N 2.87Å; V461-V463 VanDerWaalsContact C-N 3.35Å; V461-V463 PolarHBondContact O-N 3.17Å; V463-L466 PolarHBondContact O-N 2.95Å; V463-W467 WeakPolarHBondContact O-CB 3.25Å; V463-W467 PolarHBondContact O-N 3.48Å
464	V	89.3	Confident	85.7	Confident	83 Å²	83	107.5 Å²	107.5	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-38.8	175.9	171.2	0	0	0	0	111.9	A460 V461 I462 W467 R468	A460-V464 VanDerWaalsContact O-CG2 3.32Å; A460-V464 WeakPolarHBondContact O-CG2 3.37Å; A460-V464 PolarHBondContact O-N 2.83Å; V461-V464 PolarHBondContact O-N 2.76Å; I462-V464 VanDerWaalsContact C-N 3.32Å; I462-V464 PolarHBondContact O-N 3.17Å; V464-W467 PolarHBondContact O-N 3.44Å; V464-R468 WeakPolarHBondContact O-CB 3.38Å; V464-R468 WeakPolarHBondContact O-CG 3.47Å; V464-R468 PolarHBondContact O-N 2.87Å
465	I	91.2	Very high	84.2	Confident	84 Å²	84	107 Å²	107	43%	0.431	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-47.3	175.7	-68.1	167	0	0	0	110.2	V461 I462 W467 R468 Q469	V461-I465 HydrophobicContact CG1-CD1 3.87Å; V461-I465 HydrophobicContact CG1-CG1 4.46Å; V461-I465 VanDerWaalsContact O-CG1 3.32Å; V461-I465 WeakPolarHBondContact O-CG1 3.48Å; V461-I465 PolarHBondContact O-N 3.09Å; I462-I465 PolarHBondContact O-N 3.4Å; I465-W467 VanDerWaalsContact C-N 3.33Å; I465-W467 PolarHBondContact O-N 3.22Å; I465-R468 PolarHBondContact O-N 2.91Å; I465-Q469 WeakPolarHBondContact O-CB 3.43Å; I465-Q469 WeakPolarHBondContact O-CG 3.26Å; I465-Q469 PolarHBondContact O-N 3.16Å
466	L	87.6	Confident	82.3	Confident	98 Å²	98	105.5 Å²	105.5	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-38.5	177.5	-68.7	176	0	0	0	111.5	I462 V463 Q469 Y470	I462-L466 HydrophobicContact CG2-CD1 3.88Å; I462-L466 HydrophobicContact CG2-CG 4.25Å; I462-L466 WeakPolarHBondContact O-CB 3.38Å; I462-L466 VanDerWaalsContact O-CG 3.32Å; I462-L466 WeakPolarHBondContact O-CG 3.49Å; I462-L466 PolarHBondContact O-N 2.92Å; V463-L466 PolarHBondContact O-N 2.95Å; L466-Q469 PolarHBondContact O-N 2.82Å; L466-Y470 WeakPolarHBondContact O-CB 3.29Å; L466-Y470 PolarHBondContact O-N 3.21Å
467	W	85.3	Confident	80.4	Confident	152 Å²	152	108 Å²	108	58%	0.576	53%	0.532	S	S	*	.	H	α-helix	trans	-63.2	-45.5	173.7	-173.5	-94.7	0	0	0	111	V463 V464 I465 Q469 Y470 W471	V463-W467 WeakPolarHBondContact O-CB 3.25Å; V463-W467 PolarHBondContact O-N 3.48Å; V464-W467 PolarHBondContact O-N 3.44Å; I465-W467 VanDerWaalsContact C-N 3.33Å; I465-W467 PolarHBondContact O-N 3.22Å; W467-Q469 PolarHBondContact O-N 2.58Å; W467-Y470 PolarHBondContact O-N 3.23Å; W467-W471 AromaticContact CD1-CD1 3.61Å; W467-W471 AromaticContact CD1-NE1 3.91Å; W467-W471 AromaticContact CD2-CD1 3.87Å; W467-W471 AromaticContact CD2-NE1 3.79Å; W467-W471 AromaticContact CE2-CD1 3.51Å; W467-W471 AromaticContact CE2-NE1 3.02Å; W467-W471 AromaticContact CG-CD1 3.96Å; W467-W471 AromaticContact CH2-NE1 3.92Å; W467-W471 AromaticContact CZ2-CE2 3.96Å; W467-W471 HydrophobicContact CZ2-CZ2 4.24Å; W467-W471 AromaticContact CZ2-NE1 3.12Å; W467-W471 AromaticContact NE1-CD1 3.31Å; W467-W471 VanDerWaalsContact NE1-CD1 3.31Å; W467-W471 AromaticContact NE1-CE2 3.99Å; W467-W471 AromaticContact NE1-NE1 3.12Å; W467-W471 VanDerWaalsContact NE1-NE1 3.12Å; W467-W471 WeakPolarHBondContact O-CB 3.43Å; W467-W471 VanDerWaalsContact O-CD1 3.23Å; W467-W471 PolarHBondContact O-N 3.11Å
468	R	80.9	Confident	78.2	Confident	178 Å²	178	105.8 Å²	105.8	67%	0.672	53%	0.53	S	S	*	.	H	α-helix	trans	-61.8	-40.8	173.7	-84.9	-174.8	160.4	-152	-5.1	112.3	V464 I465 K472	V464-R468 WeakPolarHBondContact O-CB 3.38Å; V464-R468 WeakPolarHBondContact O-CG 3.47Å; V464-R468 PolarHBondContact O-N 2.87Å; I465-R468 PolarHBondContact O-N 2.91Å; R468-K472 WeakPolarHBondContact O-CB 3.22Å; R468-K472 VanDerWaalsContact O-CG 3.3Å; R468-K472 WeakPolarHBondContact O-CG 3.46Å; R468-K472 PolarHBondContact O-N 2.94Å
469	Q	79.1	Confident	76	Confident	114 Å²	114	107.9 Å²	107.9	53%	0.533	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-39.4	176.5	-73.7	179.7	2.8	0	0	111.9	I465 L466 W467 K472 K473	I465-Q469 WeakPolarHBondContact O-CB 3.43Å; I465-Q469 WeakPolarHBondContact O-CG 3.26Å; I465-Q469 PolarHBondContact O-N 3.16Å; L466-Q469 PolarHBondContact O-N 2.82Å; W467-Q469 PolarHBondContact O-N 2.58Å; Q469-K472 PolarHBondContact O-N 3.37Å; Q469-K473 WeakPolarHBondContact O-CB 3.17Å; Q469-K473 PolarHBondContact O-N 2.81Å
470	Y	82.6	Confident	73.4	Confident	143 Å²	143	106.4 Å²	106.4	56%	0.561	55%	0.545	S	S	*	.	H	α-helix	trans	-63.7	-46.6	175.6	-177.5	-112	0	0	0	111	L466 W467 K473 I474	L466-Y470 WeakPolarHBondContact O-CB 3.29Å; L466-Y470 PolarHBondContact O-N 3.21Å; W467-Y470 PolarHBondContact O-N 3.23Å; Y470-K473 WeakPolarHBondContact O-CB 3.42Å; Y470-K473 PolarHBondContact O-N 2.89Å; Y470-K473 VanDerWaalsContact O-N 3.17Å; Y470-I474 HydrophobicContact CD1-CD1 3.41Å; Y470-I474 VanDerWaalsContact CD1-CD1 3.41Å; Y470-I474 HydrophobicContact CD2-CD1 3.99Å; Y470-I474 HydrophobicContact CE1-CD1 3.09Å; Y470-I474 HydrophobicContact CE1-CG1 4.49Å; Y470-I474 HydrophobicContact CE2-CD1 3.7Å; Y470-I474 HydrophobicContact CE2-CG1 4.47Å; Y470-I474 HydrophobicContact CG-CD1 3.84Å; Y470-I474 WeakPolarHBondContact O-CD1 3.48Å; Y470-I474 VanDerWaalsContact O-CG1 3.29Å; Y470-I474 WeakPolarHBondContact O-CG1 2.97Å; Y470-I474 PolarHBondContact O-N 2.61Å
471	W	71.4	Confident	70.9	Confident	121 Å²	121	108.5 Å²	108.5	46%	0.458	56%	0.556	S	S	.	*	H	α-helix	trans	-65.3	-40.5	174.1	-84.5	77.5	0	0	0	112.4	W467 K473 I474 L475	W467-W471 AromaticContact CD1-CD1 3.61Å; W467-W471 AromaticContact CD1-NE1 3.91Å; W467-W471 AromaticContact CD2-CD1 3.87Å; W467-W471 AromaticContact CD2-NE1 3.79Å; W467-W471 AromaticContact CE2-CD1 3.51Å; W467-W471 AromaticContact CE2-NE1 3.02Å; W467-W471 AromaticContact CG-CD1 3.96Å; W467-W471 AromaticContact CH2-NE1 3.92Å; W467-W471 AromaticContact CZ2-CE2 3.96Å; W467-W471 HydrophobicContact CZ2-CZ2 4.24Å; W467-W471 AromaticContact CZ2-NE1 3.12Å; W467-W471 AromaticContact NE1-CD1 3.31Å; W467-W471 VanDerWaalsContact NE1-CD1 3.31Å; W467-W471 AromaticContact NE1-CE2 3.99Å; W467-W471 AromaticContact NE1-NE1 3.12Å; W467-W471 VanDerWaalsContact NE1-NE1 3.12Å; W467-W471 WeakPolarHBondContact O-CB 3.43Å; W467-W471 VanDerWaalsContact O-CD1 3.23Å; W467-W471 PolarHBondContact O-N 3.11Å; W471-K473 VanDerWaalsContact C-N 3.26Å; W471-K473 PolarHBondContact O-N 3.07Å; W471-I474 PolarHBondContact O-N 2.96Å; W471-I474 VanDerWaalsContact O-N 3.15Å; W471-L475 HydrophobicContact CB-CD1 4.39Å; W471-L475 HydrophobicContact CE3-CD1 3.84Å; W471-L475 WeakPolarHBondContact O-CB 3.11Å; W471-L475 WeakPolarHBondContact O-CD1 3.28Å; W471-L475 PolarHBondContact O-N 3.44Å
472	K	73.9	Confident	68.3	Low	162 Å²	162	112.6 Å²	112.6	70%	0.704	57%	0.574	S	S	*	*	H	α-helix	trans	-58.7	-37.2	171.3	-80.2	-175.1	176.4	-167.2	0	112.2	R468 Q469 G476	R468-K472 WeakPolarHBondContact O-CB 3.22Å; R468-K472 VanDerWaalsContact O-CG 3.3Å; R468-K472 WeakPolarHBondContact O-CG 3.46Å; R468-K472 PolarHBondContact O-N 2.94Å; Q469-K472 PolarHBondContact O-N 3.37Å; K472-G476 PolarHBondContact O-N 3.45Å
473	K	74.6	Confident	65.7	Low	148 Å²	148	110.5 Å²	110.5	64%	0.643	57%	0.567	S	S	*	*	H	α-helix	trans	-74.4	-26	177.7	-163.3	174.2	-175.6	176.7	0	113.2	Q469 Y470 W471 K477	Q469-K473 WeakPolarHBondContact O-CB 3.17Å; Q469-K473 PolarHBondContact O-N 2.81Å; Y470-K473 WeakPolarHBondContact O-CB 3.42Å; Y470-K473 PolarHBondContact O-N 2.89Å; Y470-K473 VanDerWaalsContact O-N 3.17Å; W471-K473 VanDerWaalsContact C-N 3.26Å; W471-K473 PolarHBondContact O-N 3.07Å; K473-K477 WeakPolarHBondContact O-CG 3.48Å
474	I	70.5	Confident	63	Low	68 Å²	68	110.8 Å²	110.8	35%	0.349	57%	0.574	S	S	.	*	H	α-helix	trans	-87.1	-41.7	177.5	-68.4	157.6	0	0	0	111.3	Y470 W471 G476 K477 A478	Y470-I474 HydrophobicContact CD1-CD1 3.41Å; Y470-I474 VanDerWaalsContact CD1-CD1 3.41Å; Y470-I474 HydrophobicContact CD2-CD1 3.99Å; Y470-I474 HydrophobicContact CE1-CD1 3.09Å; Y470-I474 HydrophobicContact CE1-CG1 4.49Å; Y470-I474 HydrophobicContact CE2-CD1 3.7Å; Y470-I474 HydrophobicContact CE2-CG1 4.47Å; Y470-I474 HydrophobicContact CG-CD1 3.84Å; Y470-I474 WeakPolarHBondContact O-CD1 3.48Å; Y470-I474 VanDerWaalsContact O-CG1 3.29Å; Y470-I474 WeakPolarHBondContact O-CG1 2.97Å; Y470-I474 PolarHBondContact O-N 2.61Å; W471-I474 PolarHBondContact O-N 2.96Å; W471-I474 VanDerWaalsContact O-N 3.15Å; I474-G476 VanDerWaalsContact C-N 3.3Å; I474-K477 CarbonylContact O-C 3.51Å; I474-K477 WeakPolarHBondContact O-CA 3.39Å; I474-K477 PolarHBondContact O-N 3.45Å; I474-A478 PolarHBondContact O-N 2.82Å
475	L	58.4	Low	60.6	Low	91 Å²	91	111.9 Å²	111.9	48%	0.476	59%	0.585	S	S	.	*	H	α-helix	trans	-62.7	-38.3	169.1	-89.2	127	0	0	0	111	W471 K477 A478 Q479	W471-L475 HydrophobicContact CB-CD1 4.39Å; W471-L475 HydrophobicContact CE3-CD1 3.84Å; W471-L475 WeakPolarHBondContact O-CB 3.11Å; W471-L475 WeakPolarHBondContact O-CD1 3.28Å; W471-L475 PolarHBondContact O-N 3.44Å; L475-K477 PolarHBondContact O-N 3.11Å; L475-A478 PolarHBondContact O-N 2.94Å; L475-A478 VanDerWaalsContact O-N 3.16Å; L475-Q479 WeakPolarHBondContact O-CB 3.27Å; L475-Q479 PolarHBondContact O-N 2.81Å
476	G	53.6	Low	58.1	Low	54 Å²	54	114.6 Å²	114.6	56%	0.557	60%	0.596	S	S	*	*	H	α-helix	trans	-62.9	-18.2	171	0	0	0	0	0	114.4	K472 I474	K472-G476 PolarHBondContact O-N 3.45Å; I474-G476 VanDerWaalsContact C-N 3.3Å
477	K	50.8	Low	55.6	Low	162 Å²	162	115.2 Å²	115.2	70%	0.704	60%	0.599	S	S	*	*	H	α-helix	trans	-96.2	-24.7	173.1	-75.4	-177.9	176	-171.9	0	113.5	K473 I474 L475	K473-K477 WeakPolarHBondContact O-CG 3.48Å; I474-K477 CarbonylContact O-C 3.51Å; I474-K477 WeakPolarHBondContact O-CA 3.39Å; I474-K477 PolarHBondContact O-N 3.45Å; L475-K477 PolarHBondContact O-N 3.11Å
478	A	43.2	Very low	53.1	Low	67 Å²	67	118.8 Å²	118.8	55%	0.554	61%	0.612	S	S	*	*	H	α-helix	trans	-85	-26	176.5	0	0	0	0	0	112.8	I474 L475 G480	I474-A478 PolarHBondContact O-N 2.82Å; L475-A478 PolarHBondContact O-N 2.94Å; L475-A478 VanDerWaalsContact O-N 3.16Å; A478-G480 VanDerWaalsContact C-N 3.25Å; A478-G480 PolarHBondContact O-N 2.7Å
479	Q	43.2	Very low	51	Low	141 Å²	141	114.2 Å²	114.2	66%	0.659	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-76.8	-12.9	173.8	-151.4	154.5	-9.6	0	0	112.6	L475 S481	L475-Q479 WeakPolarHBondContact O-CB 3.27Å; L475-Q479 PolarHBondContact O-N 2.81Å; Q479-S481 PolarHBondContact O-N 2.8Å
480	G	39.3	Very low	48.8	Very low	62 Å²	62	115.4 Å²	115.4	64%	0.639	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-74.9	0.3	172.4	0	0	0	0	0	115.4	A478	A478-G480 VanDerWaalsContact C-N 3.25Å; A478-G480 PolarHBondContact O-N 2.7Å
481	S	38.3	Very low	46.5	Very low	100 Å²	100	116.5 Å²	116.5	70%	0.699	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-106.5	-7.4	179.7	-176.6	0	0	0	0	114.3	Q479	Q479-S481 PolarHBondContact O-N 2.8Å
482	L	35.8	Very low	44.8	Very low	157 Å²	157	113.2 Å²	113.2	82%	0.822	62%	0.619	S	S	*	*	S	Bend	trans	-118.2	7	177.7	-93.1	155.1	0	0	0	112.9
483	S	38	Very low	42.9	Very low	42 Å²	42	111.6 Å²	111.6	29%	0.294	62%	0.623	S	S	.	*			trans	-103.3	4.6	-171.8	157.3	0	0	0	0	114.1	S485 E486 L487	S483-S485 VanDerWaalsContact C-N 3.3Å; S483-S485 PolarHBondContact O-N 3.37Å; S483-E486 PolarHBondContact O-N 2.88Å; S483-L487 PolarHBondContact O-N 2.84Å; S483-L487 WeakPolarHBondContact OG-CD1 3.47Å
484	S	36	Very low	41	Very low	100 Å²	100	106.4 Å²	106.4	70%	0.699	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-16.3	-176.3	57.2	0	0	0	0	114.9
485	S	39.1	Very low	39.6	Very low	105 Å²	105	108.1 Å²	108.1	73%	0.734	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-20.1	176.3	33.9	0	0	0	0	113.6	S483	S483-S485 VanDerWaalsContact C-N 3.3Å; S483-S485 PolarHBondContact O-N 3.37Å
486	E	38.9	Very low	38.8	Very low	142 Å²	142	110.5 Å²	110.5	66%	0.664	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-17.9	178.7	-153.6	163	-175.9	0	0	111.8	S483 R488	S483-E486 PolarHBondContact O-N 2.88Å; E486-R488 VanDerWaalsContact C-N 3.31Å; E486-R488 PolarHBondContact O-N 3.45Å
487	L	35.2	Very low	38.9	Very low	111 Å²	111	112.7 Å²	112.7	58%	0.581	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	1	177.2	-125.8	90.9	0	0	0	115.2	S483	S483-L487 PolarHBondContact O-N 2.84Å; S483-L487 WeakPolarHBondContact OG-CD1 3.47Å
488	R	33.1	Very low	39.1	Very low	227 Å²	227	107.9 Å²	107.9	86%	0.857	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-5	172.4	-95.4	-169.3	-170.8	-175.8	3.5	114.4	E486	E486-R488 VanDerWaalsContact C-N 3.31Å; E486-R488 PolarHBondContact O-N 3.45Å
489	V	36.2	Very low	40.1	Very low	81 Å²	81	107.8 Å²	107.8	49%	0.491	61%	0.611	S	S	.	*	S	Bend	trans	-117.7	3.6	-178.8	-168	0	0	0	0	112.3	L491	V489-L491 PolarHBondContact O-N 2.93Å
490	H	33.2	Very low	41.4	Very low	140 Å²	140	105.7 Å²	105.7	65%	0.648	60%	0.603	S	S	*	*	S	Bend	trans	-84.7	18.3	170.1	-78.8	-69.7	0	0	0	114
491	L	34	Very low	42.3	Very low	166 Å²	166	104.4 Å²	104.4	87%	0.869	58%	0.582	S	S	*	*			trans	-126.1	55.6	173.9	-81.1	164	0	0	0	111	V489	V489-L491 PolarHBondContact O-N 2.93Å
492	S	36.5	Very low	43.1	Very low	52 Å²	52	103.6 Å²	103.6	36%	0.364	57%	0.569	S	S	.	*			trans	-140.7	56.2	158.6	68.2	0	0	0	0	109.7
493	V	34.1	Very low	43.1	Very low	127 Å²	127	101.5 Å²	101.5	77%	0.77	56%	0.563	S	S	*	*			trans	-102.9	106.1	149.3	-178.4	0	0	0	0	104.8	S495	V493-S495 PolarHBondContact O-N 3.16Å; V493-S495 VanDerWaalsContact O-N 3.16Å
494	P	33.8	Very low	43.1	Very low	39 Å²	39	103.1 Å²	103.1	25%	0.253	57%	0.566	S	S	.	*			trans	-56.6	123.9	168.8	-20.9	32.3	0	0	0	108	I155	I155-P494 HydrophobicContact CD1-CB 4.14Å; I155-P494 HydrophobicContact CD1-CG 4.03Å
495	S	41.5	Very low	42.7	Very low	105 Å²	105	104 Å²	104	73%	0.734	57%	0.572	S	S	*	*	S	Bend	trans	-70.8	133.5	166.1	-50.3	0	0	0	0	107.4	V493	V493-S495 PolarHBondContact O-N 3.16Å; V493-S495 VanDerWaalsContact O-N 3.16Å
496	D	41.8	Very low	42.6	Very low	140 Å²	140	107.3 Å²	107.3	75%	0.749	57%	0.57	S	S	*	*	S	Bend	trans	79.1	116.4	168.1	-50.1	-31.8	0	0	0	117.4
497	N	54.1	Low	41.9	Very low	100 Å²	100	105.1 Å²	105.1	54%	0.535	57%	0.57	S	S	.	*			trans	76.2	50.9	168.1	-49	-25.1	0	0	0	118.9	E154	E154-N497 HydrophobicContact CG-CB 4.17Å
498	V	56	Low	41.6	Very low	61 Å²	61	105.3 Å²	105.3	37%	0.37	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	167.9	-179.5	0	0	0	0	110.7	L157 I500	L157-V498 HydrophobicContact CD1-CG1 3.44Å; L157-V498 VanDerWaalsContact CD1-CG1 3.44Å; L157-V498 HydrophobicContact CG-CG1 3.77Å; V498-I500 HydrophobicContact CG1-CG1 4.39Å
499	V	65	Low	41.3	Very low	66 Å²	66	104.3 Å²	104.3	40%	0.4	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.5	116.7	171.9	-179.3	0	0	0	0	108.9	I155 V156 L157	I155-V499 PolarHBondContact O-N 2.6Å; V156-V499 WeakPolarHBondContact CA-O 3.47Å; L157-V499 PolarHBondContact N-O 3.33Å
500	I	68.9	Low	40.9	Very low	96 Å²	96	111.7 Å²	111.7	49%	0.492	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	108.9	172.2	-57.9	175.9	0	0	0	108.1	L157 V498 N502	L157-I500 HydrophobicContact CB-CG1 4.44Å; L157-I500 HydrophobicContact CD1-CG1 4.38Å; V498-I500 HydrophobicContact CG1-CG1 4.39Å; I500-N502 HydrophobicContact CG2-CB 4.43Å; I500-N502 WeakPolarHBondContact CG2-ND2 3.14Å; I500-N502 PolarHBondContact O-N 2.98Å
501	N	58.5	Low	40.7	Very low	36 Å²	36	112.9 Å²	112.9	19%	0.193	60%	0.604	C	S	.	*			trans	-91.6	76.9	-178	-163	4.7	0	0	0	111.8	S147 V156 L157	S147-N501 WeakPolarHBondContact CB-ND2 3.49Å; V156-N501 HydrophobicContact CG1-CB 4.04Å; L157-N501 PolarHBondContact O-N 2.8Å
502	N	55.1	Low	40.4	Very low	82 Å²	82	114.7 Å²	114.7	44%	0.439	60%	0.599	S	S	.	*			trans	-106.5	-2.2	173.3	-67.9	-9.3	0	0	0	113.2	D159 I500	D159-N502 WeakPolarHBondContact CB-OD1 3.47Å; D159-N502 PolarHBondContact OD2-ND2 2.75Å; I500-N502 HydrophobicContact CG2-CB 4.43Å; I500-N502 WeakPolarHBondContact CG2-ND2 3.14Å; I500-N502 PolarHBondContact O-N 2.98Å
503	T	35.8	Very low	39.8	Very low	113 Å²	113	119.9 Å²	119.9	69%	0.693	62%	0.621	S	S	*	*			trans	-106.7	103.5	-175.9	48	0	0	0	0	111.6	S505	T503-S505 PolarHBondContact O-N 3.18Å
504	H	38.9	Very low	39.5	Very low	77 Å²	77	121.1 Å²	121.1	36%	0.356	62%	0.618	S	S	.	*			trans	-77.2	111.4	153.8	-79.4	-75.2	0	0	0	109	Y506	H504-Y506 HydrophobicContact CB-CD2 3.9Å; H504-Y506 HydrophobicContact CB-CE2 3.68Å; H504-Y506 PolarHBondContact O-N 3.25Å
505	S	27.4	Very low	39.1	Very low	118 Å²	118	124.3 Å²	124.3	83%	0.825	64%	0.637	S	S	*	*			trans	-60.4	85.5	160.2	54.5	0	0	0	0	109.7	T503 S507	T503-S505 PolarHBondContact O-N 3.18Å; S505-S507 PolarHBondContact O-N 2.8Å
506	Y	36.8	Very low	38.3	Very low	174 Å²	174	128.2 Å²	128.2	68%	0.682	64%	0.641	S	S	*	*			trans	-75.3	106.3	159.3	-77.4	-86.8	0	0	0	107.3	R254 H504 S508	R254-Y506 VanDerWaalsContact NH1-CD2 3.32Å; R254-Y506 VanDerWaalsContact NH1-CE2 3.29Å; H504-Y506 HydrophobicContact CB-CD2 3.9Å; H504-Y506 HydrophobicContact CB-CE2 3.68Å; H504-Y506 PolarHBondContact O-N 3.25Å; Y506-S508 PolarHBondContact O-N 3.06Å
507	S	24.6	Very low	37.9	Very low	97 Å²	97	127.1 Å²	127.1	68%	0.678	64%	0.642	S	S	*	*			trans	-46.5	117.6	162	163.6	0	0	0	0	108.6	S505 R509	S505-S507 PolarHBondContact O-N 2.8Å; S507-R509 VanDerWaalsContact C-N 3.33Å; S507-R509 PolarHBondContact O-N 3.44Å
508	S	27.5	Very low	36.8	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	65%	0.653	S	S	*	*	S	Bend	trans	-50.7	89.4	169.4	161	0	0	0	0	110.8	Y506	Y506-S508 PolarHBondContact O-N 3.06Å
509	R	28.5	Very low	35.4	Very low	206 Å²	206	133.7 Å²	133.7	78%	0.777	68%	0.675	S	S	*	*			trans	-159.4	53.5	166.9	-132.3	-167.2	-61.7	-172.7	3.6	113.9	S507	S507-R509 VanDerWaalsContact C-N 3.33Å; S507-R509 PolarHBondContact O-N 3.44Å
510	Y	26.8	Very low	33.8	Very low	236 Å²	236	140.7 Å²	140.7	93%	0.925	69%	0.694	S	S	*	*			trans	-134.1	80.7	148.2	-99.3	-82.8	0	0	0	108.1	R512	Y510-R512 PolarHBondContact O-N 3.03Å
511	Q	29.4	Very low	32	Very low	165 Å²	165	142.4 Å²	142.4	77%	0.771	70%	0.704	S	S	*	*			trans	-78	113.6	173.2	-151.8	161	-12.8	0	0	107.1
512	R	27	Very low	30.6	Very low	203 Å²	203	148.1 Å²	148.1	77%	0.766	73%	0.73	S	S	*	*			trans	31.7	96.8	140.5	-169.9	-172.9	-65	163.9	-2	115.1	Y510	Y510-R512 PolarHBondContact O-N 3.03Å
513	I	25.2	Very low	29.4	Very low	162 Å²	162	149.8 Å²	149.8	83%	0.831	74%	0.739	S	S	*	*			trans	-103.9	107.5	159.2	-60.9	178.2	0	0	0	107.7
514	H	27.3	Very low	29.2	Very low	152 Å²	152	154 Å²	154	70%	0.704	74%	0.742	S	S	*	*			trans	-72.6	140.4	162.4	-86.1	-88.2	0	0	0	109.6
515	T	25.1	Very low	28.8	Very low	107 Å²	107	156.9 Å²	156.9	66%	0.656	76%	0.76	S	S	*	*			trans	-70.4	122.2	168.7	23.7	0	0	0	0	111.7
516	F	23.8	Very low	28.9	Very low	186 Å²	186	156.2 Å²	156.2	82%	0.816	76%	0.762	S	S	*	*				132	167	109.6	-78.3	-55.3	0	0	0	109
517	P	33.9	Very low	28.6	Very low	118 Å²	118	157.5 Å²	157.5	77%	0.766	77%	0.774	S	S	*	*			cis	-131.2	179	-28.5	33.3	-12.3	0	0	0	114.2
518	D	30.4	Very low	28.9	Very low	142 Å²	142	156.6 Å²	156.6	76%	0.759	78%	0.779	S	S	*	*			trans	-3.4	124.8	158.4	-151.3	14.1	0	0	0	119.7
519	D	28.5	Very low	29	Very low	157 Å²	157	160 Å²	160	84%	0.84	78%	0.783	S	S	*	*			trans	-170.2	153.2	134.7	-107.5	-30.9	0	0	0	113.2
520	R	30.5	Very low	29	Very low	212 Å²	212	160.8 Å²	160.8	80%	0.8	79%	0.787	S	S	*	*			trans	-82.5	164.8	-165.7	-62.1	173.7	169.2	172.7	-3.8	115.9
521	D	30	Very low	29.1	Very low	133 Å²	133	157.5 Å²	157.5	71%	0.711	78%	0.78	S	S	*	*			trans	98	123	137.9	-75.3	-44.1	0	0	0	122.6
522	H	30.6	Very low	29.3	Very low	156 Å²	156	158.5 Å²	158.5	72%	0.722	79%	0.785	S	S	*	*			trans	79.2	124.4	135.8	-90.7	63	0	0	0	124.2
523	D	29.8	Very low	29.6	Very low	117 Å²	117	155.1 Å²	155.1	63%	0.626	79%	0.789	S	S	*	*			trans	89.8	113.8	134.2	-81.8	-14.1	0	0	0	123.9
524	R	30.9	Very low	29.9	Very low	201 Å²	201	153.1 Å²	153.1	76%	0.758	79%	0.789	S	S	*	*				84.8	122.8	123.8	-76.7	-175.5	-173.6	-166.1	-1.2	123.1
525	D	30.3	Very low	30.2	Very low	138 Å²	138	150.1 Å²	150.1	74%	0.738	79%	0.791	S	S	*	*			trans	65.2	113.9	133.2	-52.3	-23.6	0	0	0	120.2
526	A	30	Very low	30.5	Very low	104 Å²	104	152.3 Å²	152.3	86%	0.86	80%	0.798	S	S	*	*				170.3	148.4	103.3	0	0	0	0	0	112.8
527	E	30.7	Very low	30.9	Very low	201 Å²	201	152 Å²	152	94%	0.939	80%	0.804	S	S	*	*			trans	-71	161	-166.6	-60.4	168.2	140	0	0	116.4
528	G	31.3	Very low	30.8	Very low	77 Å²	77	157.5 Å²	157.5	79%	0.794	81%	0.809	S	S	*	*			trans	-177.3	85.3	164.3	0	0	0	0	0	111.7
529	E	29.5	Very low	31	Very low	187 Å²	187	156.7 Å²	156.7	87%	0.874	81%	0.812	S	S	*	*			trans	-57.2	146.9	168.8	-75	175.9	127	0	0	112.2
530	Y	28	Very low	31.1	Very low	222 Å²	222	161.1 Å²	161.1	87%	0.871	82%	0.817	S	S	*	*				-162.5	145.6	129.2	-118.7	-84.9	0	0	0	112.5
531	Q	28.2	Very low	31.2	Very low	167 Å²	167	158.9 Å²	158.9	78%	0.78	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-68.7	146.7	-160.2	-88.5	131.5	-45.9	0	0	119.5
532	E	33.4	Very low	31.4	Very low	187 Å²	187	161 Å²	161	87%	0.874	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.1	145	154.1	-89.2	-176.3	147.8	0	0	112.2
533	P	34.1	Very low	31.4	Very low	131 Å²	131	164.1 Å²	164.1	85%	0.851	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-94.8	128.9	162.7	31.4	-22.9	0	0	0	111.8
534	S	30.9	Very low	31.5	Very low	120 Å²	120	164.8 Å²	164.8	84%	0.839	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-97.9	147.9	170.1	32.5	0	0	0	0	111.6
535	A	34.6	Very low	31.5	Very low	89 Å²	89	160.1 Å²	160.1	74%	0.736	83%	0.834	S	S	*	*			trans	155.6	144.9	147	0	0	0	0	0	108.9
536	L	31	Very low	31.5	Very low	154 Å²	154	160 Å²	160	81%	0.806	84%	0.838	S	S	*	*			cis	-177.2	145.5	-1.9	-107.2	163.3	0	0	0	103.4
537	L	31.3	Very low	31.6	Very low	180 Å²	180	160.3 Å²	160.3	94%	0.942	83%	0.834	S	S	*	*			trans	-172.1	139.4	135.8	-97.9	162	0	0	0	111.2
538	R	31.8	Very low	31.7	Very low	232 Å²	232	160 Å²	160	88%	0.875	83%	0.829	S	S	*	*			trans	-71.9	164.3	-164.5	-93.3	178.8	178	151.9	-2	115.8
539	P	36.3	Very low	31.8	Very low	125 Å²	125	165 Å²	165	81%	0.812	84%	0.837	S	S	*	*			trans	-84.2	156.9	179.1	35.2	-33.3	0	0	0	112.8
540	R	29.8	Very low	32.3	Very low	251 Å²	251	165.1 Å²	165.1	95%	0.947	84%	0.837	S	S	*	*			trans	-121.6	124.6	171.5	-157.5	174.7	-180	133.9	-0.4	109.9
541	D	33.5	Very low	32.9	Very low	164 Å²	164	161.8 Å²	161.8	88%	0.877	84%	0.835	S	S	*	*			trans	-69.9	160.1	-178.9	-89.4	-44.7	0	0	0	114.7
542	Q	32.4	Very low	33.6	Very low	179 Å²	179	162.9 Å²	162.9	84%	0.836	84%	0.837	S	S	*	*			trans	-83.5	143.3	-175.3	-164	173.6	16	0	0	112.7
543	R	31.2	Very low	34.2	Very low	221 Å²	221	166.5 Å²	166.5	83%	0.834	85%	0.853	S	S	*	*				177.6	134.8	129.7	-100.8	-178.2	-153.3	-174.7	5.2	115.5
544	D	31.3	Very low	34.2	Very low	130 Å²	130	168.3 Å²	168.3	70%	0.695	85%	0.853	S	S	*	*			trans	54.5	117	141	-59.2	-24.7	0	0	0	121.9
545	S	30.8	Very low	34.4	Very low	104 Å²	104	170.8 Å²	170.8	73%	0.727	85%	0.854	S	S	*	*				165.6	130.4	91.7	-67.4	0	0	0	0	114.5
546	T	31.2	Very low	34.4	Very low	136 Å²	136	175.4 Å²	175.4	83%	0.834	86%	0.861	S	S	*	*			trans	68.4	121.7	141.8	48	0	0	0	0	123.4
547	S	32.8	Very low	34.5	Very low	109 Å²	109	176.6 Å²	176.6	76%	0.762	86%	0.864	S	S	*	*			trans	-54.7	150.1	160.5	47.2	0	0	0	0	116.2
548	K	33.2	Very low	34.8	Very low	196 Å²	196	176.4 Å²	176.4	85%	0.852	86%	0.859	S	S	*	*			trans	-174.1	118.1	137.8	-103.4	175	-171.4	-177.2	0	109.5
549	L	33.1	Very low	35	Very low	181 Å²	181	172.7 Å²	172.7	95%	0.948	86%	0.858	S	S	*	*				176.7	122.8	124	-94.3	151.2	0	0	0	109.8
550	Q	39.3	Very low	34.9	Very low	189 Å²	189	176.1 Å²	176.1	88%	0.883	86%	0.861	S	S	*	*			trans	-109.4	150.2	-177.7	-160.3	172.9	8.8	0	0	108.7
551	N	39.9	Very low	35.2	Very low	153 Å²	153	170.4 Å²	170.4	82%	0.818	86%	0.855	S	S	*	*			trans	-63.7	163.2	179.8	-108.7	-20.5	0	0	0	115.7
552	K	43.9	Very low	35.4	Very low	189 Å²	189	170.9 Å²	170.9	82%	0.822	85%	0.853	S	S	*	*			trans	82.2	110.5	157.3	-73.6	178	177.1	-175.9	0	119.3
553	H	45.5	Very low	35.7	Very low	264 Å²	264	170.2 Å²	170.2	100%	1.222	85%	0.854	S	S	*	*				-149.6	0	101	-118.1	-55.4	0	0	0	112

Retrieved 553 of 553 residues in 391.3 ms (Link to these results)

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