A0A3Q0KUI2_SCHMA Loading...

Putative gelsolin

AlphaFold DB , UniProt , Accession A0A3Q0KUI2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 373 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	32.2	Very low	34.7	Very low	235 Å²	235	121.4 Å²	121.4	100%	1.158	70%	0.701	S	S	*	*				0	101.3	0	-69.7	177.6	-139.4	0	0	107.1	L3	M1-L3 PolarHBondContact O-N 3Å; M1-L3 VanDerWaalsContact O-N 3.12Å
2	A	28.5	Very low	36.4	Very low	107 Å²	107	112.2 Å²	112.2	88%	0.884	65%	0.646	S	S	*	*			trans	-69.4	107.1	171.8	0	0	0	0	0	106.7	S4	A2-S4 PolarHBondContact O-N 3.19Å
3	L	27.8	Very low	36.9	Very low	166 Å²	166	109.3 Å²	109.3	87%	0.869	62%	0.624	S	S	*	*			trans	-59.1	108.5	171.9	-74	159.8	0	0	0	106.8	M1 T5	M1-L3 PolarHBondContact O-N 3Å; M1-L3 VanDerWaalsContact O-N 3.12Å; L3-T5 PolarHBondContact O-N 3.38Å
4	S	27.1	Very low	37	Very low	105 Å²	105	105.8 Å²	105.8	73%	0.734	62%	0.623	S	S	*	*			trans	-58.3	110.3	167.5	54.9	0	0	0	0	106.9	A2	A2-S4 PolarHBondContact O-N 3.19Å
5	T	27.5	Very low	37.3	Very low	123 Å²	123	100.1 Å²	100.1	76%	0.755	59%	0.59	S	S	*	*			trans	-54	130.2	168.3	31	0	0	0	0	107.9	L3 S7	L3-T5 PolarHBondContact O-N 3.38Å; T5-S7 PolarHBondContact O-N 2.79Å
6	P	31.5	Very low	37.2	Very low	113 Å²	113	104.1 Å²	104.1	73%	0.734	61%	0.608	S	S	*	*			trans	-56.7	130.3	172.4	25.1	-31.2	0	0	0	106.6	Q8	P6-Q8 PolarHBondContact O-N 3.39Å
7	S	37.1	Very low	37.5	Very low	80 Å²	80	99.3 Å²	99.3	56%	0.559	58%	0.579	S	S	*	*			trans	-44.5	103.5	176.2	44.4	0	0	0	0	109	T5 E9	T5-S7 PolarHBondContact O-N 2.79Å; S7-E9 PolarHBondContact O-N 3.21Å
8	Q	36	Very low	37.5	Very low	188 Å²	188	95.6 Å²	95.6	88%	0.879	56%	0.559	S	S	*	*			trans	-56.1	132.9	178.2	-89.1	175.7	-46.9	0	0	107.9	P6 Y10	P6-Q8 PolarHBondContact O-N 3.39Å; Q8-Y10 PolarHBondContact O-N 3.17Å
9	E	43.6	Very low	37.5	Very low	94 Å²	94	93.4 Å²	93.4	44%	0.439	54%	0.544	S	S	.	.			trans	-46.6	128.1	166.9	-90.7	175	173.9	0	0	108.1	S7 S11 Y262 K265	S7-E9 PolarHBondContact O-N 3.21Å; E9-S11 PolarHBondContact O-N 3.37Å; E9-Y262 PolarHBondContact OE1-OH 3.32Å; E9-K265 IonicContact OE1-NZ 3.4Å; E9-K265 PolarHBondContact OE1-NZ 3.22Å
10	Y	43.5	Very low	37.7	Very low	53 Å²	53	91 Å²	91	21%	0.208	53%	0.527	C	S	.	.			trans	-52.5	113	172.9	177.6	-107	0	0	0	109.3	Q8 W12 S99 S101	Q8-Y10 PolarHBondContact O-N 3.17Å; Y10-W12 HydrophobicContact CD1-CB 4.27Å; Y10-W12 AromaticContact CD1-CD1 3.83Å; Y10-W12 HydrophobicContact CD1-CG 4.48Å; Y10-W12 HydrophobicContact CE1-CB 3.69Å; Y10-W12 AromaticContact CE1-CD1 3.84Å; Y10-W12 HydrophobicContact CE1-CG 4.21Å; Y10-W12 PolarHBondContact O-N 3.36Å; Y10-S99 WeakPolarHBondContact CB-O 3.47Å; Y10-S99 WeakPolarHBondContact CD2-O 3.37Å; Y10-S101 VanDerWaalsContact CE2-O 3.3Å; Y10-S101 WeakPolarHBondContact CE2-O 3.47Å; Y10-S101 PolarHBondContact OH-O 3.43Å
11	S	47.3	Very low	37.8	Very low	71 Å²	71	87.9 Å²	87.9	50%	0.497	52%	0.515	S	S	.	.			trans	-99.3	73.7	-179	-178.5	0	0	0	0	109.3	E9 Q13 G14	E9-S11 PolarHBondContact O-N 3.37Å; S11-Q13 PolarHBondContact O-N 3.44Å; S11-Q13 VanDerWaalsContact O-N 3.16Å; S11-G14 PolarHBondContact O-N 3.5Å
12	W	54.5	Low	38.1	Very low	11 Å²	11	78.3 Å²	78.3	4%	0.042	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-60	-14.8	157.3	62	-103.7	0	0	0	111	Y10 G14 T15 H334 K338 P343 F344	Y10-W12 HydrophobicContact CD1-CB 4.27Å; Y10-W12 AromaticContact CD1-CD1 3.83Å; Y10-W12 HydrophobicContact CD1-CG 4.48Å; Y10-W12 HydrophobicContact CE1-CB 3.69Å; Y10-W12 AromaticContact CE1-CD1 3.84Å; Y10-W12 HydrophobicContact CE1-CG 4.21Å; Y10-W12 PolarHBondContact O-N 3.36Å; W12-G14 PolarHBondContact O-N 3.27Å; W12-T15 PolarHBondContact O-N 2.81Å; W12-T15 PolarHBondContact O-OG1 2.79Å; W12-H334 AromaticContact CE3-CE1 2.99Å; W12-H334 AromaticContact CE3-ND1 3.84Å; W12-H334 AromaticContact CE3-NE2 3.27Å; W12-H334 VanDerWaalsContact CE3-NE2 3.27Å; W12-H334 AromaticContact CH2-CE1 3.97Å; W12-H334 AromaticContact CZ3-CD2 3.65Å; W12-H334 AromaticContact CZ3-CE1 2.98Å; W12-H334 WeakPolarHBondContact CZ3-CE1 3.41Å; W12-H334 AromaticContact CZ3-CG 3.85Å; W12-H334 AromaticContact CZ3-ND1 3.45Å; W12-H334 WeakPolarHBondContact CZ3-ND1 3.48Å; W12-H334 AromaticContact CZ3-NE2 3.08Å; W12-H334 WeakPolarHBondContact CZ3-NE2 3.25Å; W12-K338 HydrophobicContact CH2-CB 4.04Å; W12-K338 HydrophobicContact CZ3-CB 4.17Å; W12-P343 HydrophobicContact CH2-CB 4.45Å; W12-P343 HydrophobicContact CZ2-CB 3.77Å; W12-P343 WeakPolarHBondContact CZ2-O 3.48Å; W12-F344 AromaticContact CD1-CD1 3.88Å; W12-F344 AromaticContact CD1-CE1 3.45Å; W12-F344 VanDerWaalsContact CD1-CE1 3.45Å; W12-F344 AromaticContact NE1-CD1 3.18Å; W12-F344 AromaticContact NE1-CE1 3.01Å
13	Q	43	Very low	38.5	Very low	75 Å²	75	78.8 Å²	78.8	35%	0.35	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-54.6	-22	175.6	-58.1	175.9	-5	0	0	113.2	S11 K338	S11-Q13 PolarHBondContact O-N 3.44Å; S11-Q13 VanDerWaalsContact O-N 3.16Å; Q13-K338 HydrophobicContact CB-CD 4.18Å; Q13-K338 HydrophobicContact CG-CD 4.42Å; Q13-K338 HydrophobicContact CG-CG 4.25Å; Q13-K338 PolarHBondContact O-NZ 3.3Å
14	G	38.9	Very low	39.2	Very low	60 Å²	60	77.2 Å²	77.2	62%	0.619	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-92.6	-12.2	175.7	0	0	0	0	0	115.2	S11 W12 N16	S11-G14 PolarHBondContact O-N 3.5Å; W12-G14 PolarHBondContact O-N 3.27Å; G14-N16 PolarHBondContact O-N 3.18Å
15	T	41.4	Very low	40.1	Very low	20 Å²	20	73.5 Å²	73.5	12%	0.123	42%	0.418	C	S	.	.			trans	-76.5	96.6	174.1	48.2	0	0	0	0	108.4	W12 L17 P103	W12-T15 PolarHBondContact O-N 2.81Å; W12-T15 PolarHBondContact O-OG1 2.79Å; T15-L17 PolarHBondContact O-N 2.96Å; T15-P103 HydrophobicContact CG2-CB 3.44Å; T15-P103 VanDerWaalsContact CG2-CB 3.44Å; T15-P103 HydrophobicContact CG2-CG 3.62Å
16	N	35.5	Very low	41	Very low	165 Å²	165	74.2 Å²	74.2	88%	0.882	41%	0.411	S	S	*	.			trans	-56.5	86.1	151.4	-79.3	-19.5	0	0	0	106.3	G14	G14-N16 PolarHBondContact O-N 3.18Å
17	L	42.6	Very low	41.7	Very low	22 Å²	22	77.2 Å²	77.2	12%	0.115	41%	0.413	C	S	.	.			trans	-56.1	134	171.4	-84.3	162.4	0	0	0	107.5	T15 L19 Y106	T15-L17 PolarHBondContact O-N 2.96Å; L17-L19 HydrophobicContact CB-CD2 4.29Å; L17-L19 HydrophobicContact CB-CG 4.17Å; L17-L19 PolarHBondContact O-N 3.05Å; L17-Y106 HydrophobicContact CD1-CE1 3.59Å; L17-Y106 HydrophobicContact CD2-CD1 3.54Å; L17-Y106 HydrophobicContact CD2-CE1 3.13Å; L17-Y106 HydrophobicContact CG-CD1 4.33Å; L17-Y106 HydrophobicContact CG-CE1 3.6Å
18	P	37.9	Very low	42.5	Very low	33 Å²	33	75.9 Å²	75.9	21%	0.214	40%	0.401	C	S	.	.			trans	-62.2	97.4	148.7	27.4	-25.5	0	0	0	104.8	T107	P18-T107 HydrophobicContact CG-CG2 3.4Å
19	L	35.9	Very low	43.6	Very low	54 Å²	54	70.2 Å²	70.2	28%	0.283	38%	0.38	S	S	.	.			trans	-66.3	146.4	-178.6	-75.2	151.9	0	0	0	108.3	L17 G21 S22 S331	L17-L19 HydrophobicContact CB-CD2 4.29Å; L17-L19 HydrophobicContact CB-CG 4.17Å; L17-L19 PolarHBondContact O-N 3.05Å; L19-G21 PolarHBondContact O-N 2.96Å; L19-G21 VanDerWaalsContact O-N 3.07Å; L19-S22 PolarHBondContact O-N 3.13Å; L19-S331 WeakPolarHBondContact CD1-OG 3.49Å; L19-S331 VanDerWaalsContact CD2-CA 3.44Å
20	F	42.7	Very low	44.8	Very low	45 Å²	45	71.2 Å²	71.2	20%	0.197	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-35.1	117	165.7	-74.9	-109.6	0	0	0	110.3	D25 V110 V114 Q327 L330	F20-D25 WeakPolarHBondContact CA-OD2 3.48Å; F20-V110 HydrophobicContact CD2-CG1 3.83Å; F20-V110 HydrophobicContact CE2-CG1 3.23Å; F20-V110 HydrophobicContact CZ-CG1 3.79Å; F20-V114 HydrophobicContact CD1-CG2 3.28Å; F20-V114 HydrophobicContact CE1-CB 4.46Å; F20-V114 HydrophobicContact CE1-CG2 3.04Å; F20-V114 HydrophobicContact CG-CG2 4.24Å; F20-V114 HydrophobicContact CZ-CG2 3.82Å; F20-Q327 VanDerWaalsContact O-O 3.09Å; F20-L330 HydrophobicContact CB-CD1 4.25Å; F20-L330 HydrophobicContact CD1-CD1 3.68Å; F20-L330 HydrophobicContact CD2-CB 4.19Å; F20-L330 HydrophobicContact CD2-CD1 3.3Å; F20-L330 HydrophobicContact CD2-CG 4.37Å; F20-L330 HydrophobicContact CE1-CD1 3.66Å; F20-L330 HydrophobicContact CE2-CD1 3.32Å; F20-L330 HydrophobicContact CG-CD1 3.5Å; F20-L330 VanDerWaalsContact CG-CD1 3.5Å; F20-L330 HydrophobicContact CZ-CD1 3.52Å
21	G	38.9	Very low	46.1	Very low	26 Å²	26	75.6 Å²	75.6	27%	0.268	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	11.1	179.8	0	0	0	0	0	116.2	L19 D25 Q327	L19-G21 PolarHBondContact O-N 2.96Å; L19-G21 VanDerWaalsContact O-N 3.07Å; G21-D25 PolarHBondContact N-OD2 3.28Å; G21-Q327 PolarHBondContact O-NE2 2.81Å
22	S	38.2	Very low	47.4	Very low	33 Å²	33	74 Å²	74	23%	0.231	39%	0.394	C	S	.	.			trans	-57.8	156.9	166	69.2	0	0	0	0	110.9	L19 E24 D25 K26	L19-S22 PolarHBondContact O-N 3.13Å; S22-E24 PolarHBondContact O-N 2.68Å; S22-D25 PolarHBondContact N-OD2 3.07Å; S22-D25 WeakPolarHBondContact O-CB 3.05Å; S22-D25 PolarHBondContact O-N 3.33Å; S22-K26 PolarHBondContact O-N 2.94Å
23	D	38	Very low	48.4	Very low	118 Å²	118	73.6 Å²	73.6	63%	0.631	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-16	175.5	-78.7	-33.9	0	0	0	113.2	K26	D23-K26 WeakPolarHBondContact O-CB 3.4Å; D23-K26 WeakPolarHBondContact OD1-CD 3.42Å; D23-K26 WeakPolarHBondContact OD1-CE 3.5Å; D23-K26 IonicContact OD1-NZ 2.74Å; D23-K26 PolarHBondContact OD1-NZ 3.13Å
24	E	41.4	Very low	50	Low	132 Å²	132	74.3 Å²	74.3	62%	0.617	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-34.7	174.5	-61.1	-177.8	148.4	0	0	112.4	S22 K26 K27	S22-E24 PolarHBondContact O-N 2.68Å; E24-K26 PolarHBondContact O-N 3.17Å; E24-K27 PolarHBondContact O-N 3.27Å; E24-K27 VanDerWaalsContact O-N 3.13Å
25	D	47.3	Very low	52.1	Low	27 Å²	27	78.8 Å²	78.8	14%	0.144	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-65.8	-27.2	172.1	-67.1	-31	0	0	0	111.2	F20 G21 S22 K27 V28	F20-D25 WeakPolarHBondContact CA-OD2 3.48Å; G21-D25 PolarHBondContact N-OD2 3.28Å; S22-D25 PolarHBondContact N-OD2 3.07Å; S22-D25 WeakPolarHBondContact O-CB 3.05Å; S22-D25 PolarHBondContact O-N 3.33Å; D25-K27 PolarHBondContact O-N 2.98Å; D25-K27 VanDerWaalsContact O-N 3.13Å; D25-V28 WeakPolarHBondContact O-CB 3.36Å; D25-V28 PolarHBondContact O-N 3.13Å
26	K	45.7	Very low	54.2	Low	139 Å²	139	80.2 Å²	80.2	60%	0.604	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-64	-15	174.7	-60.3	-176.9	-177.3	169.5	0	113.5	S22 D23 E24	S22-K26 PolarHBondContact O-N 2.94Å; D23-K26 WeakPolarHBondContact O-CB 3.4Å; D23-K26 WeakPolarHBondContact OD1-CD 3.42Å; D23-K26 WeakPolarHBondContact OD1-CE 3.5Å; D23-K26 IonicContact OD1-NZ 2.74Å; D23-K26 PolarHBondContact OD1-NZ 3.13Å; E24-K26 PolarHBondContact O-N 3.17Å
27	K	46	Very low	56.7	Low	175 Å²	175	79.9 Å²	79.9	76%	0.761	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-87.4	-12.4	174.9	-76.8	-177.3	179.3	172.9	0	113.6	E24 D25 T29	E24-K27 PolarHBondContact O-N 3.27Å; E24-K27 VanDerWaalsContact O-N 3.13Å; D25-K27 PolarHBondContact O-N 2.98Å; D25-K27 VanDerWaalsContact O-N 3.13Å; K27-T29 VanDerWaalsContact C-N 3.3Å; K27-T29 PolarHBondContact O-N 3.29Å
28	V	53.7	Low	59.1	Low	52 Å²	52	79.3 Å²	79.3	32%	0.315	40%	0.396	S	S	.	.			trans	-76	90.9	173.5	-176.4	0	0	0	0	106.9	D25 C33 E115	D25-V28 WeakPolarHBondContact O-CB 3.36Å; D25-V28 PolarHBondContact O-N 3.13Å; V28-C33 WeakPolarHBondContact CG1-SG 3.41Å; V28-E115 HydrophobicContact CG1-CG 3.76Å
29	T	59.8	Low	61.7	Low	70 Å²	70	77.7 Å²	77.7	43%	0.429	39%	0.386	S	S	.	.			trans	-68.8	145.3	173.1	55	0	0	0	0	108.2	K27 E31 S32 C33	K27-T29 VanDerWaalsContact C-N 3.3Å; K27-T29 PolarHBondContact O-N 3.29Å; T29-E31 PolarHBondContact O-N 3.35Å; T29-S32 PolarHBondContact N-OG 3.44Å; T29-S32 PolarHBondContact O-N 3.22Å; T29-S32 PolarHBondContact O-OG 3.06Å; T29-S32 PolarHBondContact OG1-N 2.99Å; T29-C33 PolarHBondContact O-N 3.09Å
30	K	67.6	Low	64.4	Low	115 Å²	115	77.9 Å²	77.9	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-49.1	-35.4	173.9	-163.2	-179.8	-178	172.8	0	111	C33 F34 T118	K30-C33 WeakPolarHBondContact O-CB 3.49Å; K30-C33 PolarHBondContact O-N 3.04Å; K30-F34 HydrophobicContact CD-CE2 4.29Å; K30-F34 HydrophobicContact CG-CD2 4.41Å; K30-F34 HydrophobicContact CG-CE2 3.81Å; K30-F34 WeakPolarHBondContact O-CD2 3.38Å; K30-F34 PolarHBondContact O-N 3.46Å; K30-T118 HydrophobicContact CG-CG2 3.98Å
31	E	70.8	Confident	66.8	Low	144 Å²	144	78.7 Å²	78.7	67%	0.673	40%	0.4	S	S	*	.	H	α-helix	trans	-62	-40.8	174.1	-65.1	166.1	175.2	0	0	113.7	T29 C33 F34 Q35	T29-E31 PolarHBondContact O-N 3.35Å; E31-C33 VanDerWaalsContact C-N 3.33Å; E31-C33 PolarHBondContact O-N 3.31Å; E31-F34 PolarHBondContact O-N 3.07Å; E31-Q35 WeakPolarHBondContact O-CG 3.44Å
32	S	75.3	Confident	69.4	Low	39 Å²	39	77.7 Å²	77.7	27%	0.273	39%	0.389	S	S	.	.	H	α-helix	trans	-67.7	-32.6	176.6	63.3	0	0	0	0	112.6	T29 F34 Q35	T29-S32 PolarHBondContact N-OG 3.44Å; T29-S32 PolarHBondContact O-N 3.22Å; T29-S32 PolarHBondContact O-OG 3.06Å; T29-S32 PolarHBondContact OG1-N 2.99Å; S32-F34 VanDerWaalsContact C-N 3.32Å; S32-F34 PolarHBondContact O-N 3.19Å; S32-Q35 PolarHBondContact O-N 3.03Å
33	C	75.1	Confident	71.9	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.007	40%	0.395	C	S	.	.	H	α-helix	trans	-61.4	-42.7	175.6	-55.6	0	0	0	0	111.1	V28 T29 K30 E31 Q35 E36 E115 V119	V28-C33 WeakPolarHBondContact CG1-SG 3.41Å; T29-C33 PolarHBondContact O-N 3.09Å; K30-C33 WeakPolarHBondContact O-CB 3.49Å; K30-C33 PolarHBondContact O-N 3.04Å; E31-C33 VanDerWaalsContact C-N 3.33Å; E31-C33 PolarHBondContact O-N 3.31Å; C33-Q35 PolarHBondContact O-N 3.45Å; C33-E36 PolarHBondContact O-N 3.29Å; C33-E115 HydrophobicContact CB-CB 4.48Å; C33-V119 HydrophobicContact CB-CG2 3.79Å
34	F	78.1	Confident	74.5	Confident	91 Å²	91	79.5 Å²	79.5	40%	0.399	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.8	179.7	-70.8	-68.1	0	0	0	114.3	K30 E31 S32 I43 V119	K30-F34 HydrophobicContact CD-CE2 4.29Å; K30-F34 HydrophobicContact CG-CD2 4.41Å; K30-F34 HydrophobicContact CG-CE2 3.81Å; K30-F34 WeakPolarHBondContact O-CD2 3.38Å; K30-F34 PolarHBondContact O-N 3.46Å; E31-F34 PolarHBondContact O-N 3.07Å; S32-F34 VanDerWaalsContact C-N 3.32Å; S32-F34 PolarHBondContact O-N 3.19Å; F34-I43 HydrophobicContact CD1-CD1 3.76Å; F34-I43 HydrophobicContact CE1-CD1 4.29Å; F34-V119 HydrophobicContact CD1-CG1 4.48Å; F34-V119 HydrophobicContact CD1-CG2 4.3Å; F34-V119 HydrophobicContact CE1-CB 4.47Å; F34-V119 HydrophobicContact CE1-CG1 4.08Å; F34-V119 HydrophobicContact CE1-CG2 4.29Å
35	Q	81.4	Confident	76.9	Confident	153 Å²	153	74 Å²	74	72%	0.715	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-14	177.5	-69.1	178.5	3.1	0	0	113.4	E31 S32 C33 E37	E31-Q35 WeakPolarHBondContact O-CG 3.44Å; S32-Q35 PolarHBondContact O-N 3.03Å; C33-Q35 PolarHBondContact O-N 3.45Å; Q35-E37 PolarHBondContact O-N 3.44Å
36	E	85.4	Confident	79.1	Confident	50 Å²	50	80.4 Å²	80.4	23%	0.234	40%	0.4	C	S	.	.			trans	-70.3	114.1	177.7	178.6	64.7	-103.9	0	0	110.3	C33 A38 W39 K112	C33-E36 PolarHBondContact O-N 3.29Å; E36-A38 HydrophobicContact CG-CB 3.97Å; E36-A38 PolarHBondContact O-N 2.94Å; E36-A38 VanDerWaalsContact O-N 3.09Å; E36-W39 HydrophobicContact CB-CG 4.2Å; E36-W39 HydrophobicContact CG-CD2 4.24Å; E36-W39 HydrophobicContact CG-CG 4.17Å; E36-W39 PolarHBondContact O-N 2.74Å; E36-K112 IonicContact OE2-NZ 3.93Å; E36-K112 PolarHBondContact OE2-NZ 2.92Å
37	E	89.4	Confident	81.4	Confident	158 Å²	158	77.2 Å²	77.2	74%	0.738	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-56.9	-29.9	-177	-67.6	-179.3	174.5	0	0	112.3	Q35 W39 C40	Q35-E37 PolarHBondContact O-N 3.44Å; E37-W39 PolarHBondContact O-N 2.72Å; E37-C40 PolarHBondContact O-N 2.84Å
38	A	91.9	Very high	83.8	Confident	10 Å²	10	72.3 Å²	72.3	8%	0.083	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-61.5	-25.2	178.5	0	0	0	0	0	113.2	E36 P41 W53 I60	E36-A38 HydrophobicContact CG-CB 3.97Å; E36-A38 PolarHBondContact O-N 2.94Å; E36-A38 VanDerWaalsContact O-N 3.09Å; A38-P41 WeakPolarHBondContact O-CD 3.43Å; A38-W53 WeakPolarHBondContact O-CZ2 3.44Å; A38-W53 PolarHBondContact O-NE1 2.74Å; A38-I60 HydrophobicContact CB-CB 4.23Å; A38-I60 HydrophobicContact CB-CG2 4.01Å
39	W	92.9	Very high	85.9	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-93.1	-14.5	-177.4	-50.6	150.2	0	0	0	113.7	E36 E37 P41 V42 I43 W53 I60 I78 K112 L116	E36-W39 HydrophobicContact CB-CG 4.2Å; E36-W39 HydrophobicContact CG-CD2 4.24Å; E36-W39 HydrophobicContact CG-CG 4.17Å; E36-W39 PolarHBondContact O-N 2.74Å; E37-W39 PolarHBondContact O-N 2.72Å; W39-P41 VanDerWaalsContact C-CD 3.48Å; W39-P41 VanDerWaalsContact C-N 3.33Å; W39-V42 WeakPolarHBondContact O-CA 3.43Å; W39-V42 WeakPolarHBondContact O-CB 3.42Å; W39-V42 PolarHBondContact O-N 3.47Å; W39-I43 WeakPolarHBondContact O-CG1 3.38Å; W39-I43 PolarHBondContact O-N 2.94Å; W39-I43 VanDerWaalsContact O-N 3.07Å; W39-W53 HydrophobicContact CE3-CH2 4.13Å; W39-W53 AromaticContact CE3-CZ2 3.89Å; W39-W53 HydrophobicContact CE3-CZ2 3.89Å; W39-W53 AromaticContact CZ3-CD2 3.95Å; W39-W53 HydrophobicContact CZ3-CD2 3.95Å; W39-W53 AromaticContact CZ3-CE2 3.8Å; W39-W53 HydrophobicContact CZ3-CE3 4.03Å; W39-W53 AromaticContact CZ3-CH2 3.84Å; W39-W53 HydrophobicContact CZ3-CH2 3.84Å; W39-W53 AromaticContact CZ3-CZ2 3.77Å; W39-W53 HydrophobicContact CZ3-CZ2 3.77Å; W39-W53 AromaticContact CZ3-CZ3 3.98Å; W39-W53 HydrophobicContact CZ3-CZ3 3.98Å; W39-I60 HydrophobicContact CH2-CG1 4.45Å; W39-I60 HydrophobicContact CH2-CG2 4.06Å; W39-I60 HydrophobicContact CZ3-CG2 4.35Å; W39-I78 HydrophobicContact CH2-CD1 4.32Å; W39-K112 HydrophobicContact CZ2-CB 4.13Å; W39-K112 HydrophobicContact CZ2-CD 4.06Å; W39-L116 HydrophobicContact CD2-CD1 3.92Å; W39-L116 HydrophobicContact CE3-CD1 3.75Å; W39-L116 HydrophobicContact CE3-CD2 4.4Å; W39-L116 HydrophobicContact CG-CD1 4.36Å; W39-L116 HydrophobicContact CH2-CB 4.25Å; W39-L116 HydrophobicContact CH2-CD2 4.2Å; W39-L116 HydrophobicContact CZ2-CB 4.12Å; W39-L116 HydrophobicContact CZ3-CD1 4.16Å; W39-L116 HydrophobicContact CZ3-CD2 3.96Å; W39-L116 HydrophobicContact CZ3-CG 4.45Å
40	C	92.1	Very high	87.7	Confident	57 Å²	57	73.6 Å²	73.6	39%	0.385	37%	0.374	S	S	.	.	H	α-helix	trans	-52.9	-43	178.2	-62.7	0	0	0	0	113.5	E37 V42 N44	E37-C40 PolarHBondContact O-N 2.84Å; C40-V42 VanDerWaalsContact C-N 3.29Å; C40-V42 PolarHBondContact O-N 3.25Å; C40-N44 PolarHBondContact O-N 2.94Å; C40-N44 PolarHBondContact O-ND2 3.16Å
41	P	93.6	Very high	89.2	Confident	62 Å²	62	68.7 Å²	68.7	40%	0.403	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-34.3	175.6	-23.4	35.6	0	0	0	113.4	A38 W39 T45 F51	A38-P41 WeakPolarHBondContact O-CD 3.43Å; W39-P41 VanDerWaalsContact C-CD 3.48Å; W39-P41 VanDerWaalsContact C-N 3.33Å; P41-T45 PolarHBondContact O-N 3.13Å; P41-T45 PolarHBondContact O-OG1 3.34Å; P41-F51 HydrophobicContact CB-CE1 3.68Å; P41-F51 HydrophobicContact CB-CZ 4.11Å
42	V	94.3	Very high	90.5	Very high	5 Å²	5	62 Å²	62	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-68.2	-47.7	-179.7	-178.7	0	0	0	0	110.5	W39 C40 N44 T45 F51 W53 L80 I82 L116 L120	W39-V42 WeakPolarHBondContact O-CA 3.43Å; W39-V42 WeakPolarHBondContact O-CB 3.42Å; W39-V42 PolarHBondContact O-N 3.47Å; C40-V42 VanDerWaalsContact C-N 3.29Å; C40-V42 PolarHBondContact O-N 3.25Å; V42-N44 PolarHBondContact O-N 2.65Å; V42-T45 WeakPolarHBondContact O-CB 3.35Å; V42-T45 PolarHBondContact O-N 3.36Å; V42-F51 HydrophobicContact CG2-CD2 4.17Å; V42-F51 HydrophobicContact CG2-CE2 4.22Å; V42-F51 HydrophobicContact CG2-CG 4.43Å; V42-W53 HydrophobicContact CG2-CH2 3.58Å; V42-W53 HydrophobicContact CG2-CZ2 3.79Å; V42-L80 HydrophobicContact CB-CD2 4.31Å; V42-L80 HydrophobicContact CG1-CD2 3.49Å; V42-L80 VanDerWaalsContact CG1-CD2 3.49Å; V42-L80 HydrophobicContact CG2-CD2 3.81Å; V42-I82 HydrophobicContact CG1-CD1 4.42Å; V42-L116 HydrophobicContact CG1-CD1 4.22Å; V42-L116 HydrophobicContact CG2-CD1 4.32Å; V42-L120 HydrophobicContact CG1-CD2 3.8Å; V42-L120 HydrophobicContact CG1-CG 4.49Å
43	I	91	Very high	91.5	Very high	71 Å²	71	60.4 Å²	60.4	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-57.7	-34.5	180	-64.4	161.6	0	0	0	111.7	F34 W39 V119	F34-I43 HydrophobicContact CD1-CD1 3.76Å; F34-I43 HydrophobicContact CE1-CD1 4.29Å; W39-I43 WeakPolarHBondContact O-CG1 3.38Å; W39-I43 PolarHBondContact O-N 2.94Å; W39-I43 VanDerWaalsContact O-N 3.07Å; I43-V119 HydrophobicContact CD1-CG1 4.04Å; I43-V119 HydrophobicContact CG1-CG1 3.55Å
44	N	91.5	Very high	92.5	Very high	118 Å²	118	62 Å²	62	63%	0.631	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.3	-179.3	-65.7	-64.1	0	0	0	113.7	C40 V42	C40-N44 PolarHBondContact O-N 2.94Å; C40-N44 PolarHBondContact O-ND2 3.16Å; V42-N44 PolarHBondContact O-N 2.65Å
45	T	93	Very high	93.3	Very high	18 Å²	18	57.7 Å²	57.7	11%	0.11	30%	0.297	C	S	.	.			trans	-91.8	123.7	-178.1	-67.1	0	0	0	0	111	P41 V42 C47 R49 F51 I82	P41-T45 PolarHBondContact O-N 3.13Å; P41-T45 PolarHBondContact O-OG1 3.34Å; V42-T45 WeakPolarHBondContact O-CB 3.35Å; V42-T45 PolarHBondContact O-N 3.36Å; T45-C47 WeakPolarHBondContact CG2-O 3.44Å; T45-R49 HydrophobicContact CG2-CB 4.04Å; T45-F51 HydrophobicContact CG2-CE2 4.41Å; T45-F51 WeakPolarHBondContact OG1-CZ 3.28Å; T45-I82 HydrophobicContact CG2-CD1 3.87Å
46	H	92	Very high	93.7	Very high	160 Å²	160	53.7 Å²	53.7	74%	0.741	28%	0.278	S	S	*	.			trans	-121	12.9	178.7	-55.2	-55.1	0	0	0	113.1
47	C	94.9	Very high	93.6	Very high	73 Å²	73	59.2 Å²	59.2	49%	0.493	30%	0.301	S	S	.	.	S	Bend	trans	-137.2	162.7	179.1	65.8	0	0	0	0	110.4	T45 R49	T45-C47 WeakPolarHBondContact CG2-O 3.44Å; C47-R49 PolarHBondContact O-N 2.99Å
48	P	97	Very high	93.3	Very high	72 Å²	72	58.2 Å²	58.2	47%	0.468	30%	0.295	S	S	.	.			trans	-54.9	133.1	176.2	-26	35.9	0	0	0	112	I82 P84	P48-I82 CarbonylContact C-O 3.48Å; P48-I82 WeakPolarHBondContact CA-O 3.35Å; P48-I82 WeakPolarHBondContact CB-O 3.46Å; P48-P84 HydrophobicContact CB-CG 4.46Å; P48-P84 HydrophobicContact CG-CG 3.51Å
49	R	97.4	Very high	93.1	Very high	112 Å²	112	63.6 Å²	63.6	42%	0.423	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	147.3	-177.3	-166.7	158.3	-172.9	163.7	7.8	111.2	T45 C47 F51 E65 I82	T45-R49 HydrophobicContact CG2-CB 4.04Å; C47-R49 PolarHBondContact O-N 2.99Å; R49-F51 HydrophobicContact CB-CE2 4Å; R49-F51 HydrophobicContact CB-CZ 4.49Å; R49-F51 HydrophobicContact CG-CD2 4.31Å; R49-F51 HydrophobicContact CG-CE2 3.83Å; R49-F51 HydrophobicContact CG-CZ 3.95Å; R49-E65 IonicContact CZ-OE1 2.72Å; R49-E65 IonicContact NH2-OE1 2.74Å; R49-E65 PolarHBondContact NH2-OE1 2.9Å; R49-I82 PolarHBondContact N-O 2.81Å; R49-I82 WeakPolarHBondContact O-CB 3.44Å; R49-I82 PolarHBondContact O-N 3.36Å
50	L	98	Very high	93	Very high	36 Å²	36	64 Å²	64	19%	0.188	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.2	170.3	-170.5	70.2	0	0	0	109	V52 Y68 V79 L80 N81 Y141 F142	L50-V52 HydrophobicContact CD2-CG2 4.43Å; L50-V52 HydrophobicContact CG-CG2 4.4Å; L50-Y68 HydrophobicContact CB-CE2 4.43Å; L50-Y68 HydrophobicContact CD2-CD2 3.93Å; L50-Y68 HydrophobicContact CD2-CE2 4.35Å; L50-Y68 HydrophobicContact CG-CD2 4.43Å; L50-Y68 HydrophobicContact CG-CE2 4.36Å; L50-V79 HydrophobicContact CD1-CG1 3.68Å; L50-V79 HydrophobicContact CG-CG1 4.44Å; L50-L80 WeakPolarHBondContact CA-O 3.48Å; L50-N81 HydrophobicContact CD1-CB 3.98Å; L50-Y141 HydrophobicContact CD1-CD2 4.08Å; L50-Y141 HydrophobicContact CD1-CG 4.11Å; L50-F142 HydrophobicContact CD2-CD1 4.46Å; L50-F142 HydrophobicContact CD2-CE1 3.96Å
51	F	98.2	Very high	93.1	Very high	13 Å²	13	67.1 Å²	67.1	6%	0.057	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.5	170.1	-65.6	-85.9	0	0	0	109.7	P41 V42 T45 R49 W53 V79 L80 I82	P41-F51 HydrophobicContact CB-CE1 3.68Å; P41-F51 HydrophobicContact CB-CZ 4.11Å; V42-F51 HydrophobicContact CG2-CD2 4.17Å; V42-F51 HydrophobicContact CG2-CE2 4.22Å; V42-F51 HydrophobicContact CG2-CG 4.43Å; T45-F51 HydrophobicContact CG2-CE2 4.41Å; T45-F51 WeakPolarHBondContact OG1-CZ 3.28Å; R49-F51 HydrophobicContact CB-CE2 4Å; R49-F51 HydrophobicContact CB-CZ 4.49Å; R49-F51 HydrophobicContact CG-CD2 4.31Å; R49-F51 HydrophobicContact CG-CE2 3.83Å; R49-F51 HydrophobicContact CG-CZ 3.95Å; F51-W53 HydrophobicContact CB-CE3 4.11Å; F51-W53 HydrophobicContact CB-CH2 3.14Å; F51-W53 HydrophobicContact CB-CZ2 3.63Å; F51-W53 HydrophobicContact CB-CZ3 3.42Å; F51-W53 VanDerWaalsContact CB-CZ3 3.42Å; F51-W53 HydrophobicContact CD1-CH2 4.32Å; F51-W53 HydrophobicContact CD1-CZ2 4.11Å; F51-W53 HydrophobicContact CD2-CH2 4.36Å; F51-W53 AromaticContact CG-CH2 3.74Å; F51-W53 HydrophobicContact CG-CH2 3.74Å; F51-W53 HydrophobicContact CG-CZ2 4Å; F51-W53 HydrophobicContact CG-CZ3 4.46Å; F51-V79 CarbonylContact O-C 3.38Å; F51-V79 VanDerWaalsContact O-CA 3.3Å; F51-V79 WeakPolarHBondContact O-CA 3.49Å; F51-L80 HydrophobicContact CB-CB 4.37Å; F51-L80 HydrophobicContact CD2-CD2 4.2Å; F51-L80 PolarHBondContact N-O 3.39Å; F51-L80 PolarHBondContact O-N 2.96Å; F51-I82 HydrophobicContact CD2-CD1 4.3Å; F51-I82 HydrophobicContact CE2-CD1 3.91Å
52	V	98	Very high	93.2	Very high	3 Å²	3	68.7 Å²	68.7	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.6	175.8	-176.2	0	0	0	0	108.9	L50 V63 Y68 Y77 I78 V79 F142	L50-V52 HydrophobicContact CD2-CG2 4.43Å; L50-V52 HydrophobicContact CG-CG2 4.4Å; V52-V63 HydrophobicContact CB-CB 4.2Å; V52-V63 HydrophobicContact CB-CG2 4.46Å; V52-V63 HydrophobicContact CG1-CB 4.04Å; V52-V63 HydrophobicContact CG1-CG2 3.84Å; V52-V63 PolarHBondContact O-N 3.07Å; V52-Y68 HydrophobicContact CB-CD1 3.83Å; V52-Y68 HydrophobicContact CB-CE1 3.55Å; V52-Y68 HydrophobicContact CB-CE2 4.45Å; V52-Y68 HydrophobicContact CB-CG 4.41Å; V52-Y68 HydrophobicContact CG2-CD1 3.76Å; V52-Y68 HydrophobicContact CG2-CD2 3.89Å; V52-Y68 HydrophobicContact CG2-CE1 3.78Å; V52-Y68 HydrophobicContact CG2-CE2 3.88Å; V52-Y68 HydrophobicContact CG2-CG 3.82Å; V52-Y68 PolarHBondContact N-OH 2.87Å; V52-Y77 HydrophobicContact CG1-CD1 4.42Å; V52-I78 WeakPolarHBondContact CA-O 3.49Å; V52-V79 HydrophobicContact CG1-CG2 4.07Å; V52-V79 HydrophobicContact CG2-CG1 4.24Å; V52-V79 HydrophobicContact CG2-CG2 4.15Å; V52-F142 HydrophobicContact CG2-CE1 4.17Å
53	W	97.5	Very high	93.3	Very high	6 Å²	6	69.7 Å²	69.7	2%	0.023	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.8	172.2	-55.1	-99.5	0	0	0	111.2	A38 W39 V42 F51 I60 R61 Y77 I78 L80 L116	A38-W53 WeakPolarHBondContact O-CZ2 3.44Å; A38-W53 PolarHBondContact O-NE1 2.74Å; W39-W53 HydrophobicContact CE3-CH2 4.13Å; W39-W53 AromaticContact CE3-CZ2 3.89Å; W39-W53 HydrophobicContact CE3-CZ2 3.89Å; W39-W53 AromaticContact CZ3-CD2 3.95Å; W39-W53 HydrophobicContact CZ3-CD2 3.95Å; W39-W53 AromaticContact CZ3-CE2 3.8Å; W39-W53 HydrophobicContact CZ3-CE3 4.03Å; W39-W53 AromaticContact CZ3-CH2 3.84Å; W39-W53 HydrophobicContact CZ3-CH2 3.84Å; W39-W53 AromaticContact CZ3-CZ2 3.77Å; W39-W53 HydrophobicContact CZ3-CZ2 3.77Å; W39-W53 AromaticContact CZ3-CZ3 3.98Å; W39-W53 HydrophobicContact CZ3-CZ3 3.98Å; V42-W53 HydrophobicContact CG2-CH2 3.58Å; V42-W53 HydrophobicContact CG2-CZ2 3.79Å; F51-W53 HydrophobicContact CB-CE3 4.11Å; F51-W53 HydrophobicContact CB-CH2 3.14Å; F51-W53 HydrophobicContact CB-CZ2 3.63Å; F51-W53 HydrophobicContact CB-CZ3 3.42Å; F51-W53 VanDerWaalsContact CB-CZ3 3.42Å; F51-W53 HydrophobicContact CD1-CH2 4.32Å; F51-W53 HydrophobicContact CD1-CZ2 4.11Å; F51-W53 HydrophobicContact CD2-CH2 4.36Å; F51-W53 AromaticContact CG-CH2 3.74Å; F51-W53 HydrophobicContact CG-CH2 3.74Å; F51-W53 HydrophobicContact CG-CZ2 4Å; F51-W53 HydrophobicContact CG-CZ3 4.46Å; W53-I60 HydrophobicContact CB-CG2 3.21Å; W53-I60 VanDerWaalsContact CD1-CG2 3.5Å; W53-I60 HydrophobicContact CD2-CG2 4.24Å; W53-I60 HydrophobicContact CG-CG2 3.39Å; W53-R61 CarbonylContact C-O 3.59Å; W53-R61 VanDerWaalsContact CA-O 3.23Å; W53-R61 WeakPolarHBondContact CA-O 3.1Å; W53-R61 WeakPolarHBondContact CB-O 3.3Å; W53-Y77 CarbonylContact O-C 3.43Å; W53-Y77 VanDerWaalsContact O-CA 3.27Å; W53-Y77 WeakPolarHBondContact O-CA 3.42Å; W53-Y77 WeakPolarHBondContact O-CB 3.17Å; W53-I78 HydrophobicContact CE3-CB 4.34Å; W53-I78 HydrophobicContact CE3-CG2 4.19Å; W53-I78 HydrophobicContact CZ3-CG2 4.49Å; W53-I78 PolarHBondContact N-O 2.93Å; W53-I78 PolarHBondContact O-N 3Å; W53-L80 HydrophobicContact CH2-CB 4.17Å; W53-L80 HydrophobicContact CH2-CD2 4.4Å; W53-L80 HydrophobicContact CZ3-CB 3.8Å; W53-L116 HydrophobicContact CH2-CD2 4.45Å; W53-L116 HydrophobicContact CZ3-CD2 4.19Å
54	R	95.9	Very high	93.5	Very high	34 Å²	34	70.6 Å²	70.6	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.1	174	-175.1	174	175.4	-175.8	3.2	109.1	Q56 R61 V63 D75 Y77 I152	R54-Q56 HydrophobicContact CB-CG 4.48Å; R54-Q56 HydrophobicContact CG-CG 4.26Å; R54-Q56 PolarHBondContact O-N 2.93Å; R54-R61 PolarHBondContact N-O 3.33Å; R54-R61 PolarHBondContact O-N 3.12Å; R54-V63 HydrophobicContact CB-CG2 3.95Å; R54-D75 HydrophobicContact CG-CB 4.49Å; R54-D75 IonicContact CZ-OD2 2.68Å; R54-D75 IonicContact NE-OD2 3.3Å; R54-D75 PolarHBondContact NE-OD2 3.31Å; R54-D75 IonicContact NH2-OD1 2.68Å; R54-D75 IonicContact NH2-OD2 3.88Å; R54-D75 PolarHBondContact NH2-OD2 2.94Å; R54-Y77 HydrophobicContact CB-CD1 3.84Å; R54-Y77 HydrophobicContact CB-CE1 3.65Å; R54-Y77 WeakPolarHBondContact CD-OH 3.46Å; R54-Y77 HydrophobicContact CG-CD1 4.08Å; R54-Y77 HydrophobicContact CG-CE1 3.58Å; R54-Y77 HydrophobicContact CG-CE2 4.4Å; R54-Y77 PolarHBondContact NE-OH 3.13Å; R54-I152 HydrophobicContact CG-CD1 4.41Å
55	V	93.2	Very high	93.6	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	124.2	172.1	-177.5	0	0	0	0	108.2	I60 S76 E105 T108 A109 I152	V55-I60 HydrophobicContact CB-CD1 4.44Å; V55-I60 HydrophobicContact CG2-CD1 3.73Å; V55-S76 WeakPolarHBondContact CB-O 3.22Å; V55-S76 WeakPolarHBondContact CG2-O 3.44Å; V55-S76 PolarHBondContact N-O 3.47Å; V55-E105 HydrophobicContact CG1-CB 4.21Å; V55-E105 HydrophobicContact CG1-CG 4.31Å; V55-T108 HydrophobicContact CG1-CG2 3.78Å; V55-A109 HydrophobicContact CG2-CB 3.95Å; V55-I152 WeakPolarHBondContact O-CD1 3.33Å
56	Q	90.6	Very high	93.4	Very high	69 Å²	69	76.1 Å²	76.1	32%	0.322	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	104.9	179.8	-46.2	-156.8	-24.8	0	0	110.3	R54 F58 K59 R61 I152	R54-Q56 HydrophobicContact CB-CG 4.48Å; R54-Q56 HydrophobicContact CG-CG 4.26Å; R54-Q56 PolarHBondContact O-N 2.93Å; Q56-F58 PolarHBondContact O-N 2.82Å; Q56-K59 PolarHBondContact N-O 2.86Å; Q56-K59 WeakPolarHBondContact O-CB 3.14Å; Q56-K59 PolarHBondContact O-N 3.09Å; Q56-R61 HydrophobicContact CB-CG 4.16Å; Q56-R61 HydrophobicContact CG-CB 4Å; Q56-R61 HydrophobicContact CG-CG 3.78Å; Q56-I152 VanDerWaalsContact CA-CD1 3.48Å; Q56-I152 HydrophobicContact CB-CD1 3.57Å; Q56-I152 HydrophobicContact CG-CD1 3.4Å; Q56-I152 VanDerWaalsContact CG-CD1 3.4Å
57	K	84.3	Confident	93.5	Very high	166 Å²	166	72.1 Å²	72.1	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	57.5	176.5	-57.9	-177.9	178.1	-175.8	0	112.1	K59	K57-K59 PolarHBondContact O-N 3.05Å
58	F	82.1	Confident	93.5	Very high	137 Å²	137	71 Å²	71	60%	0.601	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	7.8	-177.6	-51	-84.1	0	0	0	116.2	Q56 E104 T108	Q56-F58 PolarHBondContact O-N 2.82Å; F58-E104 HydrophobicContact CE1-CB 3.75Å; F58-E104 HydrophobicContact CE1-CG 4.34Å; F58-E104 HydrophobicContact CZ-CB 3.74Å; F58-E104 HydrophobicContact CZ-CG 4.02Å; F58-T108 WeakPolarHBondContact CD1-OG1 3.42Å
59	K	87.5	Confident	93.4	Very high	124 Å²	124	67.6 Å²	67.6	54%	0.539	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148	176.1	-62.1	-170.5	176.9	-168.4	0	111.3	Q56 K57	Q56-K59 PolarHBondContact N-O 2.86Å; Q56-K59 WeakPolarHBondContact O-CB 3.14Å; Q56-K59 PolarHBondContact O-N 3.09Å; K57-K59 PolarHBondContact O-N 3.05Å
60	I	91.4	Very high	93.2	Very high	7 Å²	7	64.1 Å²	64.1	4%	0.036	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.3	175.5	-59.8	-54.1	0	0	0	108.6	A38 W39 W53 V55 I78 T108 K112	A38-I60 HydrophobicContact CB-CB 4.23Å; A38-I60 HydrophobicContact CB-CG2 4.01Å; W39-I60 HydrophobicContact CH2-CG1 4.45Å; W39-I60 HydrophobicContact CH2-CG2 4.06Å; W39-I60 HydrophobicContact CZ3-CG2 4.35Å; W53-I60 HydrophobicContact CB-CG2 3.21Å; W53-I60 VanDerWaalsContact CD1-CG2 3.5Å; W53-I60 HydrophobicContact CD2-CG2 4.24Å; W53-I60 HydrophobicContact CG-CG2 3.39Å; V55-I60 HydrophobicContact CB-CD1 4.44Å; V55-I60 HydrophobicContact CG2-CD1 3.73Å; I60-I78 HydrophobicContact CD1-CD1 3.64Å; I60-I78 HydrophobicContact CG1-CD1 4.29Å; I60-T108 HydrophobicContact CD1-CG2 4.49Å; I60-K112 HydrophobicContact CD1-CB 4Å; I60-K112 HydrophobicContact CD1-CD 4.42Å; I60-K112 HydrophobicContact CD1-CG 3.78Å; I60-K112 HydrophobicContact CG1-CB 3.98Å; I60-K112 HydrophobicContact CG1-CD 3.66Å; I60-K112 HydrophobicContact CG1-CG 3.58Å
61	R	94.2	Very high	93.1	Very high	123 Å²	123	62.5 Å²	62.5	46%	0.464	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.2	178.9	-65.8	-60.8	-166.4	179.2	2.3	110.5	W53 R54 Q56 V63	W53-R61 CarbonylContact C-O 3.59Å; W53-R61 VanDerWaalsContact CA-O 3.23Å; W53-R61 WeakPolarHBondContact CA-O 3.1Å; W53-R61 WeakPolarHBondContact CB-O 3.3Å; R54-R61 PolarHBondContact N-O 3.33Å; R54-R61 PolarHBondContact O-N 3.12Å; Q56-R61 HydrophobicContact CB-CG 4.16Å; Q56-R61 HydrophobicContact CG-CB 4Å; Q56-R61 HydrophobicContact CG-CG 3.78Å; R61-V63 PolarHBondContact O-N 3.23Å
62	P	96.1	Very high	93	Very high	95 Å²	95	63.4 Å²	63.4	62%	0.617	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	137.7	177.3	26.9	-33.7	0	0	0	110.1
63	V	95.6	Very high	92.8	Very high	26 Å²	26	63.4 Å²	63.4	16%	0.158	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-82.5	146.7	172	179.4	0	0	0	0	108.5	V52 R54 R61 E65 D67 Y68 Y77	V52-V63 HydrophobicContact CB-CB 4.2Å; V52-V63 HydrophobicContact CB-CG2 4.46Å; V52-V63 HydrophobicContact CG1-CB 4.04Å; V52-V63 HydrophobicContact CG1-CG2 3.84Å; V52-V63 PolarHBondContact O-N 3.07Å; R54-V63 HydrophobicContact CB-CG2 3.95Å; R61-V63 PolarHBondContact O-N 3.23Å; V63-E65 PolarHBondContact O-N 2.8Å; V63-D67 HydrophobicContact CG1-CB 3.82Å; V63-Y68 HydrophobicContact CB-CD1 4.31Å; V63-Y68 HydrophobicContact CB-CE1 4.06Å; V63-Y68 HydrophobicContact CG1-CD1 4.11Å; V63-Y68 HydrophobicContact CG1-CE1 4.33Å; V63-Y68 WeakPolarHBondContact O-CE1 3.43Å; V63-Y77 HydrophobicContact CG2-CD1 4.36Å; V63-Y77 HydrophobicContact CG2-CE1 4.31Å
64	N	94.3	Very high	92.5	Very high	90 Å²	90	63.6 Å²	63.6	48%	0.481	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-63.4	136.1	173.4	-169.4	-59.6	0	0	0	109.2	N66 D67 Y68	N64-N66 PolarHBondContact O-N 2.97Å; N64-N66 VanDerWaalsContact O-N 3.11Å; N64-N66 WeakPolarHBondContact OD1-CB 3.41Å; N64-N66 PolarHBondContact OD1-N 3.34Å; N64-N66 PolarHBondContact OD1-ND2 3.38Å; N64-N66 VanDerWaalsContact OD1-ND2 3.08Å; N64-D67 HydrophobicContact CB-CB 4.44Å; N64-D67 WeakPolarHBondContact O-CA 3.43Å; N64-D67 PolarHBondContact O-N 3.03Å; N64-Y68 VanDerWaalsContact O-CD1 3.26Å; N64-Y68 WeakPolarHBondContact O-CD1 3.24Å; N64-Y68 PolarHBondContact O-N 3.37Å
65	E	94	Very high	92.5	Very high	114 Å²	114	62 Å²	62	53%	0.533	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-57.3	-29.2	-179.5	-65.7	-176.1	176	0	0	112.5	R49 V63 D67 Y68	R49-E65 IonicContact CZ-OE1 2.72Å; R49-E65 IonicContact NH2-OE1 2.74Å; R49-E65 PolarHBondContact NH2-OE1 2.9Å; V63-E65 PolarHBondContact O-N 2.8Å; E65-D67 PolarHBondContact O-N 3.33Å; E65-Y68 HydrophobicContact CG-CE1 4.4Å; E65-Y68 HydrophobicContact CG-CE2 4.24Å; E65-Y68 WeakPolarHBondContact O-CB 3.34Å; E65-Y68 PolarHBondContact O-N 2.71Å
66	N	90.2	Very high	92.5	Very high	139 Å²	139	62 Å²	62	74%	0.743	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-69.7	-19.5	174.8	-63.3	-53.5	0	0	0	113.9	N64	N64-N66 PolarHBondContact O-N 2.97Å; N64-N66 VanDerWaalsContact O-N 3.11Å; N64-N66 WeakPolarHBondContact OD1-CB 3.41Å; N64-N66 PolarHBondContact OD1-N 3.34Å; N64-N66 PolarHBondContact OD1-ND2 3.38Å; N64-N66 VanDerWaalsContact OD1-ND2 3.08Å
67	D	92.4	Very high	92.8	Very high	76 Å²	76	58.8 Å²	58.8	41%	0.406	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-100.2	7	178.7	-67.2	-49.6	0	0	0	112.1	V63 N64 E65 G69 H70	V63-D67 HydrophobicContact CG1-CB 3.82Å; N64-D67 HydrophobicContact CB-CB 4.44Å; N64-D67 WeakPolarHBondContact O-CA 3.43Å; N64-D67 PolarHBondContact O-N 3.03Å; E65-D67 PolarHBondContact O-N 3.33Å; D67-G69 PolarHBondContact O-N 3.39Å; D67-H70 VanDerWaalsContact O-CB 3.29Å; D67-H70 WeakPolarHBondContact O-CB 3.38Å; D67-H70 PolarHBondContact O-N 2.75Å; D67-H70 IonicContact OD1-ND1 3.44Å; D67-H70 PolarHBondContact OD1-ND1 3.41Å
68	Y	95.6	Very high	93.5	Very high	49 Å²	49	50.9 Å²	50.9	19%	0.192	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	128.4	174.9	-77.5	13.1	0	0	0	109.9	L50 V52 V63 N64 E65	L50-Y68 HydrophobicContact CB-CE2 4.43Å; L50-Y68 HydrophobicContact CD2-CD2 3.93Å; L50-Y68 HydrophobicContact CD2-CE2 4.35Å; L50-Y68 HydrophobicContact CG-CD2 4.43Å; L50-Y68 HydrophobicContact CG-CE2 4.36Å; V52-Y68 HydrophobicContact CB-CD1 3.83Å; V52-Y68 HydrophobicContact CB-CE1 3.55Å; V52-Y68 HydrophobicContact CB-CE2 4.45Å; V52-Y68 HydrophobicContact CB-CG 4.41Å; V52-Y68 HydrophobicContact CG2-CD1 3.76Å; V52-Y68 HydrophobicContact CG2-CD2 3.89Å; V52-Y68 HydrophobicContact CG2-CE1 3.78Å; V52-Y68 HydrophobicContact CG2-CE2 3.88Å; V52-Y68 HydrophobicContact CG2-CG 3.82Å; V52-Y68 PolarHBondContact N-OH 2.87Å; V63-Y68 HydrophobicContact CB-CD1 4.31Å; V63-Y68 HydrophobicContact CB-CE1 4.06Å; V63-Y68 HydrophobicContact CG1-CD1 4.11Å; V63-Y68 HydrophobicContact CG1-CE1 4.33Å; V63-Y68 WeakPolarHBondContact O-CE1 3.43Å; N64-Y68 VanDerWaalsContact O-CD1 3.26Å; N64-Y68 WeakPolarHBondContact O-CD1 3.24Å; N64-Y68 PolarHBondContact O-N 3.37Å; E65-Y68 HydrophobicContact CG-CE1 4.4Å; E65-Y68 HydrophobicContact CG-CE2 4.24Å; E65-Y68 WeakPolarHBondContact O-CB 3.34Å; E65-Y68 PolarHBondContact O-N 2.71Å
69	G	94.3	Very high	94.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.01	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	-6.7	-171.5	0	0	0	0	0	113.8	D67 F145 R146	D67-G69 PolarHBondContact O-N 3.39Å; G69-F145 CarbonylContact O-C 3.59Å; G69-R146 PolarHBondContact O-N 3.14Å
70	H	94.4	Very high	94.8	Very high	39 Å²	39	38.5 Å²	38.5	18%	0.181	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	108.7	174.5	-58.9	165.8	0	0	0	110.9	D67 R146	D67-H70 VanDerWaalsContact O-CB 3.29Å; D67-H70 WeakPolarHBondContact O-CB 3.38Å; D67-H70 PolarHBondContact O-N 2.75Å; D67-H70 IonicContact OD1-ND1 3.44Å; D67-H70 PolarHBondContact OD1-ND1 3.41Å; H70-R146 VanDerWaalsContact CD2-CD 3.46Å; H70-R146 WeakPolarHBondContact CD2-CD 3.32Å; H70-R146 WeakPolarHBondContact NE2-CD 3.4Å; H70-R146 PolarHBondContact NE2-NE 3.26Å
71	F	96	Very high	95.1	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	153.2	-179.5	-64.4	-91.5	0	0	0	111.3	Y77 V79 W96 F138 F142 F145 R146 I147 L148	F71-Y77 HydrophobicContact CB-CE2 4.45Å; F71-Y77 AromaticContact CD1-CD1 3.9Å; F71-Y77 HydrophobicContact CD1-CD1 3.9Å; F71-Y77 AromaticContact CD1-CD2 3.62Å; F71-Y77 HydrophobicContact CD1-CD2 3.62Å; F71-Y77 HydrophobicContact CD1-CE1 4.22Å; F71-Y77 AromaticContact CD1-CE2 3.99Å; F71-Y77 HydrophobicContact CD1-CE2 3.99Å; F71-Y77 AromaticContact CD1-CG 3.59Å; F71-Y77 HydrophobicContact CD1-CG 3.59Å; F71-Y77 AromaticContact CE1-CD1 3.99Å; F71-Y77 HydrophobicContact CE1-CD1 3.99Å; F71-Y77 HydrophobicContact CE1-CD2 4.24Å; F71-Y77 AromaticContact CE1-CG 3.76Å; F71-Y77 HydrophobicContact CE1-CG 3.76Å; F71-V79 HydrophobicContact CE1-CG2 4.41Å; F71-V79 HydrophobicContact CZ-CG2 4.31Å; F71-W96 HydrophobicContact CB-CH2 3.96Å; F71-W96 HydrophobicContact CB-CZ2 4.19Å; F71-W96 HydrophobicContact CB-CZ3 4.18Å; F71-W96 HydrophobicContact CD1-CD2 4.08Å; F71-W96 HydrophobicContact CD1-CE3 4.03Å; F71-W96 HydrophobicContact CD1-CG 4.44Å; F71-W96 HydrophobicContact CD1-CZ3 4.41Å; F71-F138 AromaticContact CE1-CZ 3.97Å; F71-F138 HydrophobicContact CE1-CZ 3.97Å; F71-F138 HydrophobicContact CE2-CZ 4.32Å; F71-F138 HydrophobicContact CZ-CE1 4.26Å; F71-F138 AromaticContact CZ-CZ 3.65Å; F71-F138 HydrophobicContact CZ-CZ 3.65Å; F71-F142 HydrophobicContact CE2-CD2 4.33Å; F71-F142 HydrophobicContact CE2-CE1 4.39Å; F71-F142 AromaticContact CE2-CE2 3.9Å; F71-F142 HydrophobicContact CE2-CE2 3.9Å; F71-F142 AromaticContact CE2-CZ 3.94Å; F71-F142 HydrophobicContact CE2-CZ 3.94Å; F71-F142 HydrophobicContact CZ-CE1 4.33Å; F71-F142 AromaticContact CZ-CE2 3.92Å; F71-F142 HydrophobicContact CZ-CE2 3.92Å; F71-F142 AromaticContact CZ-CZ 3.67Å; F71-F142 HydrophobicContact CZ-CZ 3.67Å; F71-F145 AromaticContact CD2-CD2 3.94Å; F71-F145 HydrophobicContact CD2-CD2 3.94Å; F71-F145 AromaticContact CD2-CE2 3.42Å; F71-F145 HydrophobicContact CD2-CE2 3.42Å; F71-F145 VanDerWaalsContact CD2-CE2 3.42Å; F71-F145 HydrophobicContact CD2-CZ 4.19Å; F71-F145 AromaticContact CE2-CD2 3.78Å; F71-F145 HydrophobicContact CE2-CD2 3.78Å; F71-F145 AromaticContact CE2-CE2 3.33Å; F71-F145 HydrophobicContact CE2-CE2 3.33Å; F71-F145 HydrophobicContact CE2-CZ 4.4Å; F71-F145 HydrophobicContact CG-CE2 4.38Å; F71-F145 HydrophobicContact CZ-CE2 4.23Å; F71-R146 PolarHBondContact N-O 2.68Å; F71-I147 WeakPolarHBondContact O-CA 3.19Å; F71-L148 PolarHBondContact O-N 2.91Å
72	F	94.9	Very high	95.2	Very high	31 Å²	31	33.7 Å²	33.7	14%	0.136	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.1	176.4	-66.1	-55.4	0	0	0	109.7	G74 D75 Y77 W96 L148 G150 F156	F72-G74 PolarHBondContact O-N 2.95Å; F72-D75 VanDerWaalsContact CB-OD2 3.31Å; F72-D75 WeakPolarHBondContact CB-OD2 3.28Å; F72-D75 PolarHBondContact O-N 3.02Å; F72-D75 VanDerWaalsContact O-N 3.11Å; F72-Y77 VanDerWaalsContact CD2-OH 3.26Å; F72-Y77 WeakPolarHBondContact CD2-OH 3.17Å; F72-Y77 PolarHBondContact N-OH 2.91Å; F72-W96 WeakPolarHBondContact O-CZ3 3.42Å; F72-L148 WeakPolarHBondContact CA-O 3.49Å; F72-L148 HydrophobicContact CD1-CB 3.66Å; F72-L148 HydrophobicContact CE1-CB 3.66Å; F72-L148 HydrophobicContact CE1-CD1 3.82Å; F72-L148 HydrophobicContact CE1-CG 4.31Å; F72-G150 WeakPolarHBondContact CB-O 3.45Å; F72-F156 HydrophobicContact CB-CE2 3.97Å; F72-F156 HydrophobicContact CD1-CD2 4.4Å; F72-F156 AromaticContact CD1-CE1 3.96Å; F72-F156 HydrophobicContact CD1-CE1 3.96Å; F72-F156 AromaticContact CD1-CE2 3.17Å; F72-F156 HydrophobicContact CD1-CE2 3.17Å; F72-F156 AromaticContact CD1-CZ 2.95Å; F72-F156 HydrophobicContact CD1-CZ 2.95Å; F72-F156 HydrophobicContact CD2-CD2 4.06Å; F72-F156 AromaticContact CD2-CE2 3.44Å; F72-F156 HydrophobicContact CD2-CE2 3.44Å; F72-F156 VanDerWaalsContact CD2-CE2 3.44Å; F72-F156 AromaticContact CD2-CZ 4Å; F72-F156 HydrophobicContact CD2-CZ 4Å; F72-F156 HydrophobicContact CE1-CD1 4.35Å; F72-F156 HydrophobicContact CE1-CD2 4.37Å; F72-F156 AromaticContact CE1-CE1 3.32Å; F72-F156 HydrophobicContact CE1-CE1 3.32Å; F72-F156 AromaticContact CE1-CE2 3.35Å; F72-F156 HydrophobicContact CE1-CE2 3.35Å; F72-F156 AromaticContact CE1-CZ 2.78Å; F72-F156 HydrophobicContact CE1-CZ 2.78Å; F72-F156 HydrophobicContact CE2-CD2 4Å; F72-F156 HydrophobicContact CE2-CE1 4.32Å; F72-F156 AromaticContact CE2-CE2 3.58Å; F72-F156 HydrophobicContact CE2-CE2 3.58Å; F72-F156 AromaticContact CE2-CZ 3.86Å; F72-F156 HydrophobicContact CE2-CZ 3.86Å; F72-F156 HydrophobicContact CG-CD2 4.25Å; F72-F156 AromaticContact CG-CE2 3.22Å; F72-F156 HydrophobicContact CG-CE2 3.22Å; F72-F156 AromaticContact CG-CZ 3.59Å; F72-F156 HydrophobicContact CG-CZ 3.59Å; F72-F156 HydrophobicContact CZ-CD1 4.13Å; F72-F156 HydrophobicContact CZ-CD2 4.14Å; F72-F156 AromaticContact CZ-CE1 3.5Å; F72-F156 HydrophobicContact CZ-CE1 3.5Å; F72-F156 AromaticContact CZ-CE2 3.53Å; F72-F156 HydrophobicContact CZ-CE2 3.53Å; F72-F156 HydrophobicContact CZ-CG 4.46Å; F72-F156 AromaticContact CZ-CZ 3.27Å; F72-F156 HydrophobicContact CZ-CZ 3.27Å
73	N	94	Very high	95.2	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.6	-173.3	66.6	-0.2	0	0	0	115.3	D75 G98 S99 K100 S101 E131 I147 L148 N149 G150	N73-D75 VanDerWaalsContact C-N 3.31Å; N73-G98 CarbonylContact O-C 3.53Å; N73-G98 WeakPolarHBondContact O-CA 3.35Å; N73-S99 PolarHBondContact O-N 3.22Å; N73-K100 CarbonylContact O-C 3.43Å; N73-K100 VanDerWaalsContact O-CA 3.29Å; N73-K100 WeakPolarHBondContact O-CA 3.19Å; N73-K100 WeakPolarHBondContact O-CB 3.47Å; N73-K100 PolarHBondContact O-N 3.42Å; N73-S101 PolarHBondContact O-N 2.87Å; N73-E131 WeakPolarHBondContact CB-OE2 3.34Å; N73-I147 HydrophobicContact CB-CG2 4.3Å; N73-L148 PolarHBondContact N-O 3.18Å; N73-N149 PolarHBondContact ND2-OD1 3.11Å; N73-N149 VanDerWaalsContact OD1-CA 3.3Å; N73-N149 WeakPolarHBondContact OD1-CA 3.43Å; N73-G150 PolarHBondContact OD1-N 3.46Å
74	G	92.8	Very high	95.2	Very high	10 Å²	10	34.9 Å²	34.9	10%	0.103	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	2.4	173.3	0	0	0	0	0	114.1	F72 G150	F72-G74 PolarHBondContact O-N 2.95Å; G74-G150 WeakPolarHBondContact CA-O 3.32Å; G74-G150 PolarHBondContact N-O 2.73Å
75	D	94.2	Very high	95.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-131	172.6	179	-36	-61.6	0	0	0	112.8	R54 F72 N73 Y77 W96 G98 S101 E105 G151 I152	R54-D75 HydrophobicContact CG-CB 4.49Å; R54-D75 IonicContact CZ-OD2 2.68Å; R54-D75 IonicContact NE-OD2 3.3Å; R54-D75 PolarHBondContact NE-OD2 3.31Å; R54-D75 IonicContact NH2-OD1 2.68Å; R54-D75 IonicContact NH2-OD2 3.88Å; R54-D75 PolarHBondContact NH2-OD2 2.94Å; F72-D75 VanDerWaalsContact CB-OD2 3.31Å; F72-D75 WeakPolarHBondContact CB-OD2 3.28Å; F72-D75 PolarHBondContact O-N 3.02Å; F72-D75 VanDerWaalsContact O-N 3.11Å; N73-D75 VanDerWaalsContact C-N 3.31Å; D75-Y77 HydrophobicContact CB-CE2 3.86Å; D75-Y77 PolarHBondContact OD2-OH 3.06Å; D75-W96 WeakPolarHBondContact O-CZ3 3.49Å; D75-G98 PolarHBondContact O-N 3.04Å; D75-G98 VanDerWaalsContact O-N 3.12Å; D75-S101 VanDerWaalsContact C-OG 3.3Å; D75-E105 WeakPolarHBondContact CA-OE2 3.27Å; D75-G151 WeakPolarHBondContact OD1-CA 3.21Å; D75-G151 WeakPolarHBondContact OD2-CA 3.41Å; D75-I152 WeakPolarHBondContact OD1-CG1 3.41Å; D75-I152 PolarHBondContact OD1-N 3.26Å
76	S	94.7	Very high	94.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	151.1	169.9	-67.4	0	0	0	0	111.7	V55 W96 S101	V55-S76 WeakPolarHBondContact CB-O 3.22Å; V55-S76 WeakPolarHBondContact CG2-O 3.44Å; V55-S76 PolarHBondContact N-O 3.47Å; S76-W96 CarbonylContact C-O 3.41Å; S76-W96 VanDerWaalsContact CA-O 3.3Å; S76-W96 WeakPolarHBondContact CA-O 3.49Å; S76-S101 PolarHBondContact N-OG 3.46Å; S76-S101 PolarHBondContact OG-OG 2.89Å
77	Y	97.1	Very high	94.8	Very high	3 Å²	3	39 Å²	39	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	154.8	-175.5	-65.4	-106.6	0	0	0	110.8	V52 W53 R54 V63 F71 F72 D75 F95 W96	V52-Y77 HydrophobicContact CG1-CD1 4.42Å; W53-Y77 CarbonylContact O-C 3.43Å; W53-Y77 VanDerWaalsContact O-CA 3.27Å; W53-Y77 WeakPolarHBondContact O-CA 3.42Å; W53-Y77 WeakPolarHBondContact O-CB 3.17Å; R54-Y77 HydrophobicContact CB-CD1 3.84Å; R54-Y77 HydrophobicContact CB-CE1 3.65Å; R54-Y77 WeakPolarHBondContact CD-OH 3.46Å; R54-Y77 HydrophobicContact CG-CD1 4.08Å; R54-Y77 HydrophobicContact CG-CE1 3.58Å; R54-Y77 HydrophobicContact CG-CE2 4.4Å; R54-Y77 PolarHBondContact NE-OH 3.13Å; V63-Y77 HydrophobicContact CG2-CD1 4.36Å; V63-Y77 HydrophobicContact CG2-CE1 4.31Å; F71-Y77 HydrophobicContact CB-CE2 4.45Å; F71-Y77 AromaticContact CD1-CD1 3.9Å; F71-Y77 HydrophobicContact CD1-CD1 3.9Å; F71-Y77 AromaticContact CD1-CD2 3.62Å; F71-Y77 HydrophobicContact CD1-CD2 3.62Å; F71-Y77 HydrophobicContact CD1-CE1 4.22Å; F71-Y77 AromaticContact CD1-CE2 3.99Å; F71-Y77 HydrophobicContact CD1-CE2 3.99Å; F71-Y77 AromaticContact CD1-CG 3.59Å; F71-Y77 HydrophobicContact CD1-CG 3.59Å; F71-Y77 AromaticContact CE1-CD1 3.99Å; F71-Y77 HydrophobicContact CE1-CD1 3.99Å; F71-Y77 HydrophobicContact CE1-CD2 4.24Å; F71-Y77 AromaticContact CE1-CG 3.76Å; F71-Y77 HydrophobicContact CE1-CG 3.76Å; F72-Y77 VanDerWaalsContact CD2-OH 3.26Å; F72-Y77 WeakPolarHBondContact CD2-OH 3.17Å; F72-Y77 PolarHBondContact N-OH 2.91Å; D75-Y77 HydrophobicContact CB-CE2 3.86Å; D75-Y77 PolarHBondContact OD2-OH 3.06Å; Y77-F95 CarbonylContact O-C 3.49Å; Y77-F95 VanDerWaalsContact O-CA 3.28Å; Y77-F95 WeakPolarHBondContact O-CA 3.37Å; Y77-W96 AromaticContact CD2-CE3 3.67Å; Y77-W96 HydrophobicContact CD2-CE3 3.67Å; Y77-W96 AromaticContact CD2-CZ3 3.93Å; Y77-W96 HydrophobicContact CD2-CZ3 3.93Å; Y77-W96 HydrophobicContact CE2-CE3 4.28Å; Y77-W96 HydrophobicContact CE2-CZ3 4.08Å; Y77-W96 PolarHBondContact N-O 2.95Å; Y77-W96 PolarHBondContact O-N 3.43Å
78	I	97.4	Very high	94.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.7	170.5	-57.5	174.5	0	0	0	107.5	W39 V52 W53 I60 I93 H94 A109 K112 L116	W39-I78 HydrophobicContact CH2-CD1 4.32Å; V52-I78 WeakPolarHBondContact CA-O 3.49Å; W53-I78 HydrophobicContact CE3-CB 4.34Å; W53-I78 HydrophobicContact CE3-CG2 4.19Å; W53-I78 HydrophobicContact CZ3-CG2 4.49Å; W53-I78 PolarHBondContact N-O 2.93Å; W53-I78 PolarHBondContact O-N 3Å; I60-I78 HydrophobicContact CD1-CD1 3.64Å; I60-I78 HydrophobicContact CG1-CD1 4.29Å; I78-I93 HydrophobicContact CG2-CG2 4.07Å; I78-H94 CarbonylContact C-O 3.31Å; I78-H94 WeakPolarHBondContact CA-O 3.39Å; I78-A109 HydrophobicContact CG1-CB 4.49Å; I78-K112 HydrophobicContact CD1-CB 3.38Å; I78-L116 HydrophobicContact CG2-CD2 4.29Å
79	V	98.4	Very high	94.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.9	178.9	-179.7	0	0	0	0	108.5	L50 F51 V52 F71 I93 H94 F138 Y141 F142	L50-V79 HydrophobicContact CD1-CG1 3.68Å; L50-V79 HydrophobicContact CG-CG1 4.44Å; F51-V79 CarbonylContact O-C 3.38Å; F51-V79 VanDerWaalsContact O-CA 3.3Å; F51-V79 WeakPolarHBondContact O-CA 3.49Å; V52-V79 HydrophobicContact CG1-CG2 4.07Å; V52-V79 HydrophobicContact CG2-CG1 4.24Å; V52-V79 HydrophobicContact CG2-CG2 4.15Å; F71-V79 HydrophobicContact CE1-CG2 4.41Å; F71-V79 HydrophobicContact CZ-CG2 4.31Å; V79-I93 CarbonylContact O-C 3.54Å; V79-I93 WeakPolarHBondContact O-CA 3.42Å; V79-H94 HydrophobicContact CB-CB 4.28Å; V79-H94 PolarHBondContact N-O 3.15Å; V79-H94 PolarHBondContact O-N 3.22Å; V79-F138 HydrophobicContact CB-CE2 3.93Å; V79-F138 HydrophobicContact CG1-CE2 4.38Å; V79-F138 HydrophobicContact CG2-CE2 3.64Å; V79-F138 HydrophobicContact CG2-CZ 4.16Å; V79-Y141 HydrophobicContact CG1-CD2 4.19Å; V79-F142 HydrophobicContact CG1-CZ 4.21Å; V79-F142 HydrophobicContact CG2-CZ 4.29Å
80	L	98.3	Very high	94.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.9	172.6	170.4	66.2	0	0	0	109.1	V42 L50 F51 W53 I82 Y91 D92 I93 L116 L120	V42-L80 HydrophobicContact CB-CD2 4.31Å; V42-L80 HydrophobicContact CG1-CD2 3.49Å; V42-L80 VanDerWaalsContact CG1-CD2 3.49Å; V42-L80 HydrophobicContact CG2-CD2 3.81Å; L50-L80 WeakPolarHBondContact CA-O 3.48Å; F51-L80 HydrophobicContact CB-CB 4.37Å; F51-L80 HydrophobicContact CD2-CD2 4.2Å; F51-L80 PolarHBondContact N-O 3.39Å; F51-L80 PolarHBondContact O-N 2.96Å; W53-L80 HydrophobicContact CH2-CB 4.17Å; W53-L80 HydrophobicContact CH2-CD2 4.4Å; W53-L80 HydrophobicContact CZ3-CB 3.8Å; L80-I82 HydrophobicContact CD1-CG1 4.3Å; L80-I82 HydrophobicContact CD2-CD1 3.97Å; L80-I82 HydrophobicContact CD2-CG1 3.96Å; L80-I82 HydrophobicContact CG-CD1 4.43Å; L80-I82 HydrophobicContact CG-CG1 3.88Å; L80-Y91 HydrophobicContact CD1-CD1 4.48Å; L80-D92 WeakPolarHBondContact CA-O 3.43Å; L80-I93 HydrophobicContact CD1-CG1 3.75Å; L80-L116 HydrophobicContact CB-CD2 4.18Å; L80-L116 HydrophobicContact CD2-CD1 4.42Å; L80-L116 HydrophobicContact CD2-CD2 4.29Å; L80-L120 HydrophobicContact CD1-CD1 3.82Å; L80-L120 HydrophobicContact CD2-CD1 4.18Å
81	N	98.1	Very high	94.8	Very high	27 Å²	27	37.6 Å²	37.6	14%	0.144	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.7	169	177	51.1	0	0	0	109.7	L50 Y83 Y91 D92 Y141	L50-N81 HydrophobicContact CD1-CB 3.98Å; N81-Y83 WeakPolarHBondContact ND2-CD1 2.89Å; N81-Y91 WeakPolarHBondContact O-CA 3.43Å; N81-D92 HydrophobicContact CB-CB 4.41Å; N81-D92 PolarHBondContact N-O 2.86Å; N81-D92 PolarHBondContact O-N 2.72Å; N81-Y141 HydrophobicContact CB-CD1 4.43Å; N81-Y141 HydrophobicContact CB-CD2 4.42Å; N81-Y141 HydrophobicContact CB-CE1 3.86Å; N81-Y141 HydrophobicContact CB-CE2 3.82Å; N81-Y141 WeakPolarHBondContact ND2-CE1 3.22Å; N81-Y141 PolarHBondContact ND2-OH 3.07Å
82	I	97.6	Very high	94.9	Very high	2 Å²	2	38 Å²	38	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.5	173	-48.3	-173.7	0	0	0	108	V42 T45 P48 R49 F51 L80 L89 G90 Y91	V42-I82 HydrophobicContact CG1-CD1 4.42Å; T45-I82 HydrophobicContact CG2-CD1 3.87Å; P48-I82 CarbonylContact C-O 3.48Å; P48-I82 WeakPolarHBondContact CA-O 3.35Å; P48-I82 WeakPolarHBondContact CB-O 3.46Å; R49-I82 PolarHBondContact N-O 2.81Å; R49-I82 WeakPolarHBondContact O-CB 3.44Å; R49-I82 PolarHBondContact O-N 3.36Å; F51-I82 HydrophobicContact CD2-CD1 4.3Å; F51-I82 HydrophobicContact CE2-CD1 3.91Å; L80-I82 HydrophobicContact CD1-CG1 4.3Å; L80-I82 HydrophobicContact CD2-CD1 3.97Å; L80-I82 HydrophobicContact CD2-CG1 3.96Å; L80-I82 HydrophobicContact CG-CD1 4.43Å; L80-I82 HydrophobicContact CG-CG1 3.88Å; I82-L89 HydrophobicContact CG2-CB 4Å; I82-L89 HydrophobicContact CG2-CD1 3.83Å; I82-L89 HydrophobicContact CG2-CD2 4.16Å; I82-L89 HydrophobicContact CG2-CG 4.2Å; I82-G90 WeakPolarHBondContact CA-O 3.41Å; I82-Y91 HydrophobicContact CB-CD1 4.34Å; I82-Y91 HydrophobicContact CD1-CD1 4.33Å; I82-Y91 HydrophobicContact CD1-CE1 4.21Å; I82-Y91 HydrophobicContact CG1-CD1 3.95Å; I82-Y91 HydrophobicContact CG1-CE1 4.24Å; I82-Y91 HydrophobicContact CG2-CD1 3.95Å; I82-Y91 HydrophobicContact CG2-CE1 3.71Å
83	Y	96	Very high	95	Very high	52 Å²	52	36.5 Å²	36.5	20%	0.204	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.3	-173.9	59.1	-85.3	0	0	0	112.3	N81 K85 L89 G90 D92	N81-Y83 WeakPolarHBondContact ND2-CD1 2.89Å; Y83-K85 HydrophobicContact CD2-CB 4.46Å; Y83-K85 HydrophobicContact CE2-CB 4.2Å; Y83-K85 HydrophobicContact CE2-CD 4.34Å; Y83-K85 PolarHBondContact O-N 3.44Å; Y83-L89 CarbonylContact O-C 3.27Å; Y83-L89 VanDerWaalsContact O-CA 3.3Å; Y83-L89 WeakPolarHBondContact O-CA 3.18Å; Y83-G90 WeakPolarHBondContact CD1-O 3.45Å; Y83-G90 PolarHBondContact N-O 3.08Å; Y83-G90 PolarHBondContact O-N 2.96Å; Y83-D92 WeakPolarHBondContact CE1-OD2 3.39Å
84	P	95.4	Very high	95.2	Very high	95 Å²	95	36.3 Å²	36.3	62%	0.617	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	128	174.3	-13.3	26.6	0	0	0	110.8	P48	P48-P84 HydrophobicContact CB-CG 4.46Å; P48-P84 HydrophobicContact CG-CG 3.51Å
85	K	92.1	Very high	95.3	Very high	75 Å²	75	36.5 Å²	36.5	33%	0.326	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	100.1	174.8	-173.5	172.4	172.7	176.5	0	110.1	Y83 R87 G88 S355	Y83-K85 HydrophobicContact CD2-CB 4.46Å; Y83-K85 HydrophobicContact CE2-CB 4.2Å; Y83-K85 HydrophobicContact CE2-CD 4.34Å; Y83-K85 PolarHBondContact O-N 3.44Å; K85-R87 PolarHBondContact O-N 3.07Å; K85-R87 VanDerWaalsContact O-N 3.16Å; K85-G88 CarbonylContact C-O 3.5Å; K85-G88 PolarHBondContact N-O 2.87Å; K85-G88 CarbonylContact O-C 3.59Å; K85-G88 PolarHBondContact O-N 2.77Å; K85-S355 WeakPolarHBondContact CE-OG 3.48Å; K85-S355 PolarHBondContact NZ-OG 3.32Å
86	G	88.7	Confident	95.5	Very high	85 Å²	85	36.5 Å²	36.5	88%	0.876	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	-115.4	-176.9	0	0	0	0	0	111.8
87	R	87.7	Confident	95.4	Very high	268 Å²	268	36.7 Å²	36.7	100%	1.011	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-5.7	175.1	-65.7	-170.9	-178.1	-140.8	1.5	113.9	K85	K85-R87 PolarHBondContact O-N 3.07Å; K85-R87 VanDerWaalsContact O-N 3.16Å
88	G	92.3	Very high	95.2	Very high	43 Å²	43	36.6 Å²	36.6	44%	0.443	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	-155.5	-177.1	0	0	0	0	0	112.2	K85	K85-G88 CarbonylContact C-O 3.5Å; K85-G88 PolarHBondContact N-O 2.87Å; K85-G88 CarbonylContact O-C 3.59Å; K85-G88 PolarHBondContact O-N 2.77Å
89	L	94.6	Very high	94.9	Very high	45 Å²	45	38.4 Å²	38.4	24%	0.236	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145	177.3	-60.9	172.2	0	0	0	109.7	I82 Y83 Y91	I82-L89 HydrophobicContact CG2-CB 4Å; I82-L89 HydrophobicContact CG2-CD1 3.83Å; I82-L89 HydrophobicContact CG2-CD2 4.16Å; I82-L89 HydrophobicContact CG2-CG 4.2Å; Y83-L89 CarbonylContact O-C 3.27Å; Y83-L89 VanDerWaalsContact O-CA 3.3Å; Y83-L89 WeakPolarHBondContact O-CA 3.18Å; L89-Y91 HydrophobicContact CB-CE1 4.16Å; L89-Y91 HydrophobicContact CB-CE2 4.44Å
90	G	94.9	Very high	94.6	Very high	3 Å²	3	44.2 Å²	44.2	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	157.1	164.1	0	0	0	0	0	109.9	I82 Y83	I82-G90 WeakPolarHBondContact CA-O 3.41Å; Y83-G90 WeakPolarHBondContact CD1-O 3.45Å; Y83-G90 PolarHBondContact N-O 3.08Å; Y83-G90 PolarHBondContact O-N 2.96Å
91	Y	96.5	Very high	94.2	Very high	46 Å²	46	44.3 Å²	44.3	18%	0.18	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.4	-176.1	-50.1	-80.4	0	0	0	109.5	L80 N81 I82 L89 L120 Q123 A124 V125	L80-Y91 HydrophobicContact CD1-CD1 4.48Å; N81-Y91 WeakPolarHBondContact O-CA 3.43Å; I82-Y91 HydrophobicContact CB-CD1 4.34Å; I82-Y91 HydrophobicContact CD1-CD1 4.33Å; I82-Y91 HydrophobicContact CD1-CE1 4.21Å; I82-Y91 HydrophobicContact CG1-CD1 3.95Å; I82-Y91 HydrophobicContact CG1-CE1 4.24Å; I82-Y91 HydrophobicContact CG2-CD1 3.95Å; I82-Y91 HydrophobicContact CG2-CE1 3.71Å; L89-Y91 HydrophobicContact CB-CE1 4.16Å; L89-Y91 HydrophobicContact CB-CE2 4.44Å; Y91-L120 HydrophobicContact CD1-CD1 3.97Å; Y91-L120 HydrophobicContact CD1-CD2 3.96Å; Y91-L120 HydrophobicContact CE1-CD2 3.83Å; Y91-L120 HydrophobicContact CG-CD1 4Å; Y91-L120 HydrophobicContact CG-CD2 4.42Å; Y91-Q123 HydrophobicContact CD2-CB 3.98Å; Y91-Q123 HydrophobicContact CE2-CB 4.24Å; Y91-A124 VanDerWaalsContact O-CA 3.32Å; Y91-A124 WeakPolarHBondContact O-CA 3.42Å; Y91-V125 PolarHBondContact O-N 2.73Å
92	D	97.5	Very high	93.7	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.2	167.6	-56.3	-53.4	0	0	0	108.3	L80 N81 Y83 H94 V125 H127 Y141	L80-D92 WeakPolarHBondContact CA-O 3.43Å; N81-D92 HydrophobicContact CB-CB 4.41Å; N81-D92 PolarHBondContact N-O 2.86Å; N81-D92 PolarHBondContact O-N 2.72Å; Y83-D92 WeakPolarHBondContact CE1-OD2 3.39Å; D92-H94 WeakPolarHBondContact CB-NE2 2.98Å; D92-V125 CarbonylContact C-O 3.06Å; D92-V125 WeakPolarHBondContact CA-O 3.36Å; D92-H127 IonicContact OD1-NE2 2.89Å; D92-Y141 PolarHBondContact OD2-OH 3.37Å
93	I	97.6	Very high	93	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.7	173.5	-55.6	162.6	0	0	0	108.4	I78 V79 L80 T113 L116 D117 L120 A124 V125 Q126 H127	I78-I93 HydrophobicContact CG2-CG2 4.07Å; V79-I93 CarbonylContact O-C 3.54Å; V79-I93 WeakPolarHBondContact O-CA 3.42Å; L80-I93 HydrophobicContact CD1-CG1 3.75Å; I93-T113 HydrophobicContact CB-CG2 4.26Å; I93-T113 HydrophobicContact CG2-CG2 3.64Å; I93-L116 HydrophobicContact CD1-CB 4.13Å; I93-L116 HydrophobicContact CD1-CD2 4.13Å; I93-L116 HydrophobicContact CD1-CG 3.84Å; I93-L116 HydrophobicContact CG1-CD2 4.06Å; I93-L116 HydrophobicContact CG1-CG 4.28Å; I93-L116 HydrophobicContact CG2-CD2 4.1Å; I93-D117 HydrophobicContact CD1-CB 3.78Å; I93-L120 HydrophobicContact CD1-CD1 4.19Å; I93-L120 HydrophobicContact CG1-CD1 4.44Å; I93-A124 HydrophobicContact CD1-CB 3.52Å; I93-A124 HydrophobicContact CG1-CB 3.77Å; I93-V125 PolarHBondContact N-O 2.92Å; I93-Q126 CarbonylContact O-C 3.28Å; I93-Q126 WeakPolarHBondContact O-CA 3.48Å; I93-H127 PolarHBondContact O-N 2.72Å
94	H	97.6	Very high	92.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.7	174.4	-54.8	-110.9	0	0	0	109.1	I78 V79 D92 H127 E129 F138 Y141	I78-H94 CarbonylContact C-O 3.31Å; I78-H94 WeakPolarHBondContact CA-O 3.39Å; V79-H94 HydrophobicContact CB-CB 4.28Å; V79-H94 PolarHBondContact N-O 3.15Å; V79-H94 PolarHBondContact O-N 3.22Å; D92-H94 WeakPolarHBondContact CB-NE2 2.98Å; H94-H127 CarbonylContact C-O 3.59Å; H94-H127 VanDerWaalsContact CA-O 3.31Å; H94-H127 WeakPolarHBondContact CA-O 3.43Å; H94-H127 HydrophobicContact CB-CB 4.15Å; H94-H127 AromaticContact CE1-CD2 3.53Å; H94-H127 AromaticContact CE1-CE1 3.96Å; H94-H127 AromaticContact CE1-CG 3.36Å; H94-H127 AromaticContact CE1-ND1 3.63Å; H94-H127 AromaticContact CE1-NE2 3.93Å; H94-H127 WeakPolarHBondContact ND1-CB 3.44Å; H94-H127 AromaticContact ND1-CD2 3.9Å; H94-H127 AromaticContact ND1-CG 3.45Å; H94-H127 AromaticContact NE2-CD2 3.66Å; H94-H127 AromaticContact NE2-CG 3.95Å; H94-E129 HydrophobicContact CB-CG 3.93Å; H94-E129 IonicContact CE1-OE1 2.8Å; H94-E129 IonicContact CG-OE1 2.71Å; H94-E129 IonicContact ND1-OE1 3.33Å; H94-E129 PolarHBondContact ND1-OE1 2.85Å; H94-F138 HydrophobicContact CB-CD2 3.68Å; H94-F138 HydrophobicContact CB-CE2 3.88Å; H94-F138 AromaticContact CG-CD2 3.63Å; H94-F138 AromaticContact ND1-CD2 3.63Å; H94-Y141 AromaticContact CD2-CE2 3.67Å; H94-Y141 AromaticContact CE1-CE2 3.93Å; H94-Y141 AromaticContact NE2-CE2 3.28Å; H94-Y141 VanDerWaalsContact NE2-CE2 3.28Å; H94-Y141 WeakPolarHBondContact NE2-CE2 3.47Å; H94-Y141 AromaticContact NE2-CZ 3.52Å; H94-Y141 PolarHBondContact NE2-OH 2.68Å
95	F	95.7	Very high	92.2	Very high	13 Å²	13	45 Å²	45	6%	0.057	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.9	158.9	62.7	-83.3	0	0	0	108.9	Y77 V97 Y106 A109 V110 T113 H127 R128 E129	Y77-F95 CarbonylContact O-C 3.49Å; Y77-F95 VanDerWaalsContact O-CA 3.28Å; Y77-F95 WeakPolarHBondContact O-CA 3.37Å; F95-V97 HydrophobicContact CD2-CG2 4Å; F95-V97 HydrophobicContact CE2-CG2 4.38Å; F95-Y106 HydrophobicContact CD2-CE2 4.33Å; F95-Y106 AromaticContact CE2-CE2 3.83Å; F95-Y106 HydrophobicContact CE2-CE2 3.83Å; F95-A109 HydrophobicContact CB-CB 4.15Å; F95-V110 HydrophobicContact CD2-CG2 4.16Å; F95-V110 HydrophobicContact CE2-CG2 3.78Å; F95-V110 HydrophobicContact CZ-CG2 4.06Å; F95-T113 HydrophobicContact CD1-CG2 4.17Å; F95-H127 VanDerWaalsContact CD1-O 3.31Å; F95-H127 WeakPolarHBondContact CD1-O 3.26Å; F95-H127 PolarHBondContact N-O 2.85Å; F95-R128 HydrophobicContact CD2-CG 4.39Å; F95-R128 HydrophobicContact CE1-CB 4Å; F95-R128 HydrophobicContact CE2-CB 3.87Å; F95-R128 HydrophobicContact CE2-CG 3.52Å; F95-R128 HydrophobicContact CZ-CB 3.45Å; F95-R128 VanDerWaalsContact CZ-CB 3.45Å; F95-R128 HydrophobicContact CZ-CG 3.62Å; F95-E129 PolarHBondContact O-N 3.27Å
96	W	96.6	Very high	91.8	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	134.5	179.6	-178.2	97.9	0	0	0	110	F71 F72 D75 S76 Y77 G98 E129 E131 E134 F138 I147	F71-W96 HydrophobicContact CB-CH2 3.96Å; F71-W96 HydrophobicContact CB-CZ2 4.19Å; F71-W96 HydrophobicContact CB-CZ3 4.18Å; F71-W96 HydrophobicContact CD1-CD2 4.08Å; F71-W96 HydrophobicContact CD1-CE3 4.03Å; F71-W96 HydrophobicContact CD1-CG 4.44Å; F71-W96 HydrophobicContact CD1-CZ3 4.41Å; F72-W96 WeakPolarHBondContact O-CZ3 3.42Å; D75-W96 WeakPolarHBondContact O-CZ3 3.49Å; S76-W96 CarbonylContact C-O 3.41Å; S76-W96 VanDerWaalsContact CA-O 3.3Å; S76-W96 WeakPolarHBondContact CA-O 3.49Å; Y77-W96 AromaticContact CD2-CE3 3.67Å; Y77-W96 HydrophobicContact CD2-CE3 3.67Å; Y77-W96 AromaticContact CD2-CZ3 3.93Å; Y77-W96 HydrophobicContact CD2-CZ3 3.93Å; Y77-W96 HydrophobicContact CE2-CE3 4.28Å; Y77-W96 HydrophobicContact CE2-CZ3 4.08Å; Y77-W96 PolarHBondContact N-O 2.95Å; Y77-W96 PolarHBondContact O-N 3.43Å; W96-G98 VanDerWaalsContact CH2-CA 3.49Å; W96-G98 VanDerWaalsContact CZ3-N 3.26Å; W96-E129 CarbonylContact C-O 3.56Å; W96-E129 WeakPolarHBondContact CA-O 3.3Å; W96-E129 HydrophobicContact CB-CB 4.09Å; W96-E129 HydrophobicContact CG-CB 4.25Å; W96-E131 HydrophobicContact CH2-CB 4.32Å; W96-E131 HydrophobicContact CH2-CG 4.31Å; W96-E131 HydrophobicContact CZ2-CB 3.76Å; W96-E131 HydrophobicContact CZ2-CG 3.8Å; W96-E134 PolarHBondContact NE1-OE1 3.38Å; W96-F138 HydrophobicContact CB-CE1 4.42Å; W96-F138 HydrophobicContact CB-CE2 4.35Å; W96-F138 HydrophobicContact CB-CZ 3.79Å; W96-F138 AromaticContact CD1-CE1 3.45Å; W96-F138 VanDerWaalsContact CD1-CE1 3.45Å; W96-F138 AromaticContact CD1-CZ 3.72Å; W96-F138 HydrophobicContact CG-CE1 4.14Å; W96-F138 AromaticContact CG-CZ 3.95Å; W96-F138 HydrophobicContact CG-CZ 3.95Å; W96-I147 HydrophobicContact CH2-CG2 4.31Å; W96-I147 HydrophobicContact CZ2-CD1 4.22Å; W96-I147 HydrophobicContact CZ2-CG1 4.39Å; W96-I147 HydrophobicContact CZ2-CG2 4.3Å
97	V	93.6	Very high	91.6	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.03	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.2	-174.8	-168.4	0	0	0	0	110	F95 Y106 E129 E131	F95-V97 HydrophobicContact CD2-CG2 4Å; F95-V97 HydrophobicContact CE2-CG2 4.38Å; V97-Y106 HydrophobicContact CB-CD2 4.29Å; V97-Y106 HydrophobicContact CG1-CD2 3.84Å; V97-Y106 HydrophobicContact CG1-CG 4.48Å; V97-Y106 HydrophobicContact CG2-CD2 3.43Å; V97-Y106 VanDerWaalsContact CG2-CD2 3.43Å; V97-Y106 HydrophobicContact CG2-CE2 3.64Å; V97-E129 PolarHBondContact N-O 3.5Å; V97-E131 PolarHBondContact O-N 3.25Å
98	G	93.9	Very high	91.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.			trans	-72.1	148	173.9	0	0	0	0	0	112.5	N73 D75 W96 K100 S101	N73-G98 CarbonylContact O-C 3.53Å; N73-G98 WeakPolarHBondContact O-CA 3.35Å; D75-G98 PolarHBondContact O-N 3.04Å; D75-G98 VanDerWaalsContact O-N 3.12Å; W96-G98 VanDerWaalsContact CH2-CA 3.49Å; W96-G98 VanDerWaalsContact CZ3-N 3.26Å; G98-K100 PolarHBondContact O-N 2.87Å; G98-S101 WeakPolarHBondContact O-CB 3.28Å; G98-S101 PolarHBondContact O-N 2.84Å
99	S	90.9	Very high	91.6	Very high	38 Å²	38	24.6 Å²	24.6	27%	0.266	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-10.4	-178.8	61.7	0	0	0	0	115.2	Y10 N73 E131	Y10-S99 WeakPolarHBondContact CB-O 3.47Å; Y10-S99 WeakPolarHBondContact CD2-O 3.37Å; N73-S99 PolarHBondContact O-N 3.22Å; S99-E131 WeakPolarHBondContact CB-OE2 3.29Å; S99-E131 PolarHBondContact N-OE2 3.14Å; S99-E131 PolarHBondContact OG-OE2 3Å
100	K	90.4	Very high	91.1	Very high	122 Å²	122	22.8 Å²	22.8	53%	0.53	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	9.9	178	-58.8	177.1	-174.8	165.2	0	112.1	N73 G98 N149	N73-K100 CarbonylContact O-C 3.43Å; N73-K100 VanDerWaalsContact O-CA 3.29Å; N73-K100 WeakPolarHBondContact O-CA 3.19Å; N73-K100 WeakPolarHBondContact O-CB 3.47Å; N73-K100 PolarHBondContact O-N 3.42Å; G98-K100 PolarHBondContact O-N 2.87Å; K100-N149 PolarHBondContact NZ-OD1 2.96Å
101	S	89.8	Confident	90.6	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.021	13%	0.13	C	C	.	.			trans	-70.6	146.3	176.5	-174.6	0	0	0	0	110.9	Y10 N73 D75 S76 G98 E105	Y10-S101 VanDerWaalsContact CE2-O 3.3Å; Y10-S101 WeakPolarHBondContact CE2-O 3.47Å; Y10-S101 PolarHBondContact OH-O 3.43Å; N73-S101 PolarHBondContact O-N 2.87Å; D75-S101 VanDerWaalsContact C-OG 3.3Å; S76-S101 PolarHBondContact N-OG 3.46Å; S76-S101 PolarHBondContact OG-OG 2.89Å; G98-S101 WeakPolarHBondContact O-CB 3.28Å; G98-S101 PolarHBondContact O-N 2.84Å; S101-E105 WeakPolarHBondContact OG-CB 3.43Å; S101-E105 PolarHBondContact OG-OE2 2.83Å
102	T	87.8	Confident	90.3	Very high	22 Å²	22	24.6 Å²	24.6	14%	0.135	13%	0.126	C	C	.	.			trans	-77	154	-176.1	86.5	0	0	0	0	111.6	E104 E105 Y106 E153	T102-E104 WeakPolarHBondContact CB-OE2 3.23Å; T102-E104 PolarHBondContact O-N 3.46Å; T102-E104 PolarHBondContact OG1-N 2.77Å; T102-E104 PolarHBondContact OG1-OE2 3.37Å; T102-E105 PolarHBondContact N-OE2 2.88Å; T102-E105 PolarHBondContact O-N 2.88Å; T102-E105 PolarHBondContact OG1-N 2.92Å; T102-Y106 PolarHBondContact O-N 2.81Å; T102-E153 HydrophobicContact CG2-CG 4.46Å
103	P	84.1	Confident	90	Very high	56 Å²	56	24.2 Å²	24.2	36%	0.364	12%	0.124	S	C	.	.	H	α-helix	trans	-47.1	-39.4	169.8	-35.4	41.5	0	0	0	115	T15 T107	T15-P103 HydrophobicContact CG2-CB 3.44Å; T15-P103 VanDerWaalsContact CG2-CB 3.44Å; T15-P103 HydrophobicContact CG2-CG 3.62Å; P103-T107 WeakPolarHBondContact O-CB 3.35Å; P103-T107 PolarHBondContact O-N 2.77Å; P103-T107 PolarHBondContact O-OG1 3.21Å
104	E	86.3	Confident	89.4	Confident	98 Å²	98	26 Å²	26	46%	0.458	14%	0.135	S	C	.	.	H	α-helix	trans	-70.7	-42.8	-177.5	-59.3	76.2	-163.8	0	0	111.5	F58 T102 Y106 T107 T108	F58-E104 HydrophobicContact CE1-CB 3.75Å; F58-E104 HydrophobicContact CE1-CG 4.34Å; F58-E104 HydrophobicContact CZ-CB 3.74Å; F58-E104 HydrophobicContact CZ-CG 4.02Å; T102-E104 WeakPolarHBondContact CB-OE2 3.23Å; T102-E104 PolarHBondContact O-N 3.46Å; T102-E104 PolarHBondContact OG1-N 2.77Å; T102-E104 PolarHBondContact OG1-OE2 3.37Å; E104-Y106 VanDerWaalsContact C-N 3.35Å; E104-T107 PolarHBondContact O-N 2.76Å; E104-T108 WeakPolarHBondContact O-CB 3.37Å; E104-T108 PolarHBondContact O-N 2.87Å; E104-T108 PolarHBondContact O-OG1 3.49Å
105	E	87	Confident	89.1	Confident	13 Å²	13	27 Å²	27	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-42.9	175.4	-70.6	-178.5	147.3	0	0	111.5	V55 D75 S101 T102 T108 A109	V55-E105 HydrophobicContact CG1-CB 4.21Å; V55-E105 HydrophobicContact CG1-CG 4.31Å; D75-E105 WeakPolarHBondContact CA-OE2 3.27Å; S101-E105 WeakPolarHBondContact OG-CB 3.43Å; S101-E105 PolarHBondContact OG-OE2 2.83Å; T102-E105 PolarHBondContact N-OE2 2.88Å; T102-E105 PolarHBondContact O-N 2.88Å; T102-E105 PolarHBondContact OG1-N 2.92Å; E105-T108 WeakPolarHBondContact O-CB 3.35Å; E105-T108 PolarHBondContact O-N 2.88Å; E105-A109 WeakPolarHBondContact O-CB 3.34Å; E105-A109 PolarHBondContact O-N 2.75Å
106	Y	85.1	Confident	88.9	Confident	13 Å²	13	26.4 Å²	26.4	5%	0.051	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-49.8	175.4	173.3	-119.1	0	0	0	111.6	L17 F95 V97 T102 E104 T108 A109 V110	L17-Y106 HydrophobicContact CD1-CE1 3.59Å; L17-Y106 HydrophobicContact CD2-CD1 3.54Å; L17-Y106 HydrophobicContact CD2-CE1 3.13Å; L17-Y106 HydrophobicContact CG-CD1 4.33Å; L17-Y106 HydrophobicContact CG-CE1 3.6Å; F95-Y106 HydrophobicContact CD2-CE2 4.33Å; F95-Y106 AromaticContact CE2-CE2 3.83Å; F95-Y106 HydrophobicContact CE2-CE2 3.83Å; V97-Y106 HydrophobicContact CB-CD2 4.29Å; V97-Y106 HydrophobicContact CG1-CD2 3.84Å; V97-Y106 HydrophobicContact CG1-CG 4.48Å; V97-Y106 HydrophobicContact CG2-CD2 3.43Å; V97-Y106 VanDerWaalsContact CG2-CD2 3.43Å; V97-Y106 HydrophobicContact CG2-CE2 3.64Å; T102-Y106 PolarHBondContact O-N 2.81Å; E104-Y106 VanDerWaalsContact C-N 3.35Å; Y106-T108 VanDerWaalsContact C-N 3.29Å; Y106-T108 PolarHBondContact O-N 2.88Å; Y106-A109 WeakPolarHBondContact O-CB 3.18Å; Y106-A109 PolarHBondContact O-N 2.91Å; Y106-A109 VanDerWaalsContact O-N 3.16Å; Y106-V110 HydrophobicContact CD2-CG2 4.45Å; Y106-V110 HydrophobicContact CE2-CG2 4.03Å; Y106-V110 WeakPolarHBondContact O-CG2 3.23Å; Y106-V110 PolarHBondContact O-N 2.79Å
107	T	84.3	Confident	88.6	Confident	26 Å²	26	27 Å²	27	16%	0.16	14%	0.14	C	C	.	.	H	α-helix	trans	-59.4	-42.2	177.1	-58.5	0	0	0	0	111.3	P18 P103 E104 A109 V110 Q111	P18-T107 HydrophobicContact CG-CG2 3.4Å; P103-T107 WeakPolarHBondContact O-CB 3.35Å; P103-T107 PolarHBondContact O-N 2.77Å; P103-T107 PolarHBondContact O-OG1 3.21Å; E104-T107 PolarHBondContact O-N 2.76Å; T107-A109 PolarHBondContact O-N 3.46Å; T107-V110 PolarHBondContact O-N 3.35Å; T107-Q111 WeakPolarHBondContact O-CG 3.46Å; T107-Q111 PolarHBondContact O-N 2.71Å
108	T	88.9	Confident	88.4	Confident	5 Å²	5	28.5 Å²	28.5	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-43.8	176.2	-55.7	0	0	0	0	111.4	V55 F58 I60 E104 E105 Y106 V110 Q111 K112	V55-T108 HydrophobicContact CG1-CG2 3.78Å; F58-T108 WeakPolarHBondContact CD1-OG1 3.42Å; I60-T108 HydrophobicContact CD1-CG2 4.49Å; E104-T108 WeakPolarHBondContact O-CB 3.37Å; E104-T108 PolarHBondContact O-N 2.87Å; E104-T108 PolarHBondContact O-OG1 3.49Å; E105-T108 WeakPolarHBondContact O-CB 3.35Å; E105-T108 PolarHBondContact O-N 2.88Å; Y106-T108 VanDerWaalsContact C-N 3.29Å; Y106-T108 PolarHBondContact O-N 2.88Å; T108-V110 VanDerWaalsContact C-N 3.29Å; T108-V110 PolarHBondContact O-N 3.14Å; T108-Q111 PolarHBondContact O-N 3.29Å; T108-K112 HydrophobicContact CG2-CG 4.13Å; T108-K112 VanDerWaalsContact O-CB 3.28Å; T108-K112 WeakPolarHBondContact O-CB 3.5Å; T108-K112 WeakPolarHBondContact O-CG 3.48Å; T108-K112 PolarHBondContact O-N 2.71Å
109	A	90	Very high	88.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-40.2	179.2	0	0	0	0	0	111.8	V55 I78 F95 E105 Y106 T107 T113	V55-A109 HydrophobicContact CG2-CB 3.95Å; I78-A109 HydrophobicContact CG1-CB 4.49Å; F95-A109 HydrophobicContact CB-CB 4.15Å; E105-A109 WeakPolarHBondContact O-CB 3.34Å; E105-A109 PolarHBondContact O-N 2.75Å; Y106-A109 WeakPolarHBondContact O-CB 3.18Å; Y106-A109 PolarHBondContact O-N 2.91Å; Y106-A109 VanDerWaalsContact O-N 3.16Å; T107-A109 PolarHBondContact O-N 3.46Å; A109-T113 WeakPolarHBondContact O-CB 3.45Å; A109-T113 PolarHBondContact O-N 2.84Å; A109-T113 PolarHBondContact O-OG1 3.5Å
110	V	84.9	Confident	88.3	Confident	7 Å²	7	28.2 Å²	28.2	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-63.8	-54.1	175.7	168.7	0	0	0	0	111.1	F20 F95 Y106 T107 T108 K112 T113 V114	F20-V110 HydrophobicContact CD2-CG1 3.83Å; F20-V110 HydrophobicContact CE2-CG1 3.23Å; F20-V110 HydrophobicContact CZ-CG1 3.79Å; F95-V110 HydrophobicContact CD2-CG2 4.16Å; F95-V110 HydrophobicContact CE2-CG2 3.78Å; F95-V110 HydrophobicContact CZ-CG2 4.06Å; Y106-V110 HydrophobicContact CD2-CG2 4.45Å; Y106-V110 HydrophobicContact CE2-CG2 4.03Å; Y106-V110 WeakPolarHBondContact O-CG2 3.23Å; Y106-V110 PolarHBondContact O-N 2.79Å; T107-V110 PolarHBondContact O-N 3.35Å; T108-V110 VanDerWaalsContact C-N 3.29Å; T108-V110 PolarHBondContact O-N 3.14Å; V110-K112 VanDerWaalsContact C-N 3.29Å; V110-K112 PolarHBondContact O-N 3.14Å; V110-T113 WeakPolarHBondContact O-CB 3.35Å; V110-T113 PolarHBondContact O-N 3.36Å; V110-T113 VanDerWaalsContact O-N 3.11Å; V110-V114 PolarHBondContact O-N 3.16Å
111	Q	84.8	Confident	88.3	Confident	63 Å²	63	29 Å²	29	29%	0.294	15%	0.151	S	C	.	.	H	α-helix	trans	-57.3	-43	179.3	-73.8	174.1	-23.4	0	0	112	T107 T108 T113 V114 E115	T107-Q111 WeakPolarHBondContact O-CG 3.46Å; T107-Q111 PolarHBondContact O-N 2.71Å; T108-Q111 PolarHBondContact O-N 3.29Å; Q111-T113 VanDerWaalsContact C-N 3.31Å; Q111-T113 PolarHBondContact O-N 2.88Å; Q111-V114 WeakPolarHBondContact O-CB 3.47Å; Q111-V114 PolarHBondContact O-N 2.75Å; Q111-E115 PolarHBondContact O-N 3.4Å
112	K	90.9	Very high	88.2	Confident	24 Å²	24	33.9 Å²	33.9	10%	0.104	17%	0.173	C	C	.	.	H	α-helix	trans	-71.1	-26	-179.5	-69.7	-76	166.9	-167.3	0	113	E36 W39 I60 I78 T108 V110 E115 L116	E36-K112 IonicContact OE2-NZ 3.93Å; E36-K112 PolarHBondContact OE2-NZ 2.92Å; W39-K112 HydrophobicContact CZ2-CB 4.13Å; W39-K112 HydrophobicContact CZ2-CD 4.06Å; I60-K112 HydrophobicContact CD1-CB 4Å; I60-K112 HydrophobicContact CD1-CD 4.42Å; I60-K112 HydrophobicContact CD1-CG 3.78Å; I60-K112 HydrophobicContact CG1-CB 3.98Å; I60-K112 HydrophobicContact CG1-CD 3.66Å; I60-K112 HydrophobicContact CG1-CG 3.58Å; I78-K112 HydrophobicContact CD1-CB 3.38Å; T108-K112 HydrophobicContact CG2-CG 4.13Å; T108-K112 VanDerWaalsContact O-CB 3.28Å; T108-K112 WeakPolarHBondContact O-CB 3.5Å; T108-K112 WeakPolarHBondContact O-CG 3.48Å; T108-K112 PolarHBondContact O-N 2.71Å; V110-K112 VanDerWaalsContact C-N 3.29Å; V110-K112 PolarHBondContact O-N 3.14Å; K112-E115 VanDerWaalsContact CD-OE2 3.28Å; K112-E115 WeakPolarHBondContact CD-OE2 3.11Å; K112-E115 WeakPolarHBondContact CE-OE2 3.15Å; K112-E115 IonicContact NZ-OE1 3.44Å; K112-E115 PolarHBondContact NZ-OE1 3.31Å; K112-E115 IonicContact NZ-OE2 3.09Å; K112-E115 PolarHBondContact NZ-OE2 2.91Å; K112-L116 WeakPolarHBondContact O-CB 3.36Å; K112-L116 PolarHBondContact O-N 3.38Å
113	T	89.8	Confident	88.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-41.7	169.8	-63.4	0	0	0	0	111.3	I93 F95 A109 V110 Q111 L116 D117 Q126	I93-T113 HydrophobicContact CB-CG2 4.26Å; I93-T113 HydrophobicContact CG2-CG2 3.64Å; F95-T113 HydrophobicContact CD1-CG2 4.17Å; A109-T113 WeakPolarHBondContact O-CB 3.45Å; A109-T113 PolarHBondContact O-N 2.84Å; A109-T113 PolarHBondContact O-OG1 3.5Å; V110-T113 WeakPolarHBondContact O-CB 3.35Å; V110-T113 PolarHBondContact O-N 3.36Å; V110-T113 VanDerWaalsContact O-N 3.11Å; Q111-T113 VanDerWaalsContact C-N 3.31Å; Q111-T113 PolarHBondContact O-N 2.88Å; T113-L116 PolarHBondContact O-N 2.98Å; T113-D117 PolarHBondContact O-N 2.94Å; T113-Q126 HydrophobicContact CG2-CB 4.48Å; T113-Q126 HydrophobicContact CG2-CG 4.27Å
114	V	85.9	Confident	88.8	Confident	37 Å²	37	34.4 Å²	34.4	22%	0.224	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-46.6	175.2	178	0	0	0	0	111.7	F20 V110 Q111 L116 D117 T118	F20-V114 HydrophobicContact CD1-CG2 3.28Å; F20-V114 HydrophobicContact CE1-CB 4.46Å; F20-V114 HydrophobicContact CE1-CG2 3.04Å; F20-V114 HydrophobicContact CG-CG2 4.24Å; F20-V114 HydrophobicContact CZ-CG2 3.82Å; V110-V114 PolarHBondContact O-N 3.16Å; Q111-V114 WeakPolarHBondContact O-CB 3.47Å; Q111-V114 PolarHBondContact O-N 2.75Å; V114-L116 VanDerWaalsContact C-N 3.28Å; V114-L116 PolarHBondContact O-N 3.34Å; V114-D117 PolarHBondContact O-N 3.44Å; V114-T118 WeakPolarHBondContact O-CB 3.26Å; V114-T118 PolarHBondContact O-N 3.18Å; V114-T118 PolarHBondContact O-OG1 2.9Å
115	E	89.9	Confident	89.3	Confident	22 Å²	22	29.9 Å²	29.9	10%	0.103	15%	0.148	C	C	.	.	H	α-helix	trans	-56.7	-45.7	176.5	-76.8	-177.3	-169.3	0	0	111	V28 C33 Q111 K112 T118 V119	V28-E115 HydrophobicContact CG1-CG 3.76Å; C33-E115 HydrophobicContact CB-CB 4.48Å; Q111-E115 PolarHBondContact O-N 3.4Å; K112-E115 VanDerWaalsContact CD-OE2 3.28Å; K112-E115 WeakPolarHBondContact CD-OE2 3.11Å; K112-E115 WeakPolarHBondContact CE-OE2 3.15Å; K112-E115 IonicContact NZ-OE1 3.44Å; K112-E115 PolarHBondContact NZ-OE1 3.31Å; K112-E115 IonicContact NZ-OE2 3.09Å; K112-E115 PolarHBondContact NZ-OE2 2.91Å; E115-T118 WeakPolarHBondContact O-CB 3.45Å; E115-T118 PolarHBondContact O-N 3.41Å; E115-V119 WeakPolarHBondContact O-CG2 3.37Å; E115-V119 PolarHBondContact O-N 3.04Å
116	L	92.7	Very high	89.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.2	-41.8	-179.6	-178.2	56.9	0	0	0	112.4	W39 V42 W53 I78 L80 I93 K112 T113 V114 T118 V119 L120	W39-L116 HydrophobicContact CD2-CD1 3.92Å; W39-L116 HydrophobicContact CE3-CD1 3.75Å; W39-L116 HydrophobicContact CE3-CD2 4.4Å; W39-L116 HydrophobicContact CG-CD1 4.36Å; W39-L116 HydrophobicContact CH2-CB 4.25Å; W39-L116 HydrophobicContact CH2-CD2 4.2Å; W39-L116 HydrophobicContact CZ2-CB 4.12Å; W39-L116 HydrophobicContact CZ3-CD1 4.16Å; W39-L116 HydrophobicContact CZ3-CD2 3.96Å; W39-L116 HydrophobicContact CZ3-CG 4.45Å; V42-L116 HydrophobicContact CG1-CD1 4.22Å; V42-L116 HydrophobicContact CG2-CD1 4.32Å; W53-L116 HydrophobicContact CH2-CD2 4.45Å; W53-L116 HydrophobicContact CZ3-CD2 4.19Å; I78-L116 HydrophobicContact CG2-CD2 4.29Å; L80-L116 HydrophobicContact CB-CD2 4.18Å; L80-L116 HydrophobicContact CD2-CD1 4.42Å; L80-L116 HydrophobicContact CD2-CD2 4.29Å; I93-L116 HydrophobicContact CD1-CB 4.13Å; I93-L116 HydrophobicContact CD1-CD2 4.13Å; I93-L116 HydrophobicContact CD1-CG 3.84Å; I93-L116 HydrophobicContact CG1-CD2 4.06Å; I93-L116 HydrophobicContact CG1-CG 4.28Å; I93-L116 HydrophobicContact CG2-CD2 4.1Å; K112-L116 WeakPolarHBondContact O-CB 3.36Å; K112-L116 PolarHBondContact O-N 3.38Å; T113-L116 PolarHBondContact O-N 2.98Å; V114-L116 VanDerWaalsContact C-N 3.28Å; V114-L116 PolarHBondContact O-N 3.34Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 3.05Å; L116-V119 WeakPolarHBondContact O-CB 3.08Å; L116-V119 PolarHBondContact O-N 3.04Å; L116-L120 HydrophobicContact CD1-CD1 4.42Å; L116-L120 HydrophobicContact CG-CD1 4.35Å; L116-L120 WeakPolarHBondContact O-CG 3.45Å; L116-L120 PolarHBondContact O-N 2.74Å
117	D	90.8	Very high	90.1	Very high	14 Å²	14	29.7 Å²	29.7	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-64.9	-35.3	175.4	-168.2	27.9	0	0	0	111.8	I93 T113 V114 V119 L120 E121 E122 A124 Q126	I93-D117 HydrophobicContact CD1-CB 3.78Å; T113-D117 PolarHBondContact O-N 2.94Å; V114-D117 PolarHBondContact O-N 3.44Å; D117-V119 VanDerWaalsContact C-N 3.33Å; D117-V119 PolarHBondContact O-N 3.12Å; D117-L120 CarbonylContact O-C 3.55Å; D117-L120 VanDerWaalsContact O-C 3.27Å; D117-L120 WeakPolarHBondContact O-CA 3.5Å; D117-L120 PolarHBondContact O-N 3.09Å; D117-E121 PolarHBondContact O-N 3.11Å; D117-E121 VanDerWaalsContact O-N 3.13Å; D117-E122 PolarHBondContact O-N 3.08Å; D117-E122 WeakPolarHBondContact OD1-CA 3.42Å; D117-A124 VanDerWaalsContact OD1-CB 3.24Å; D117-A124 WeakPolarHBondContact OD1-CB 3.39Å; D117-A124 PolarHBondContact OD1-N 3.33Å; D117-A124 VanDerWaalsContact OD1-N 3.09Å; D117-Q126 PolarHBondContact OD2-NE2 3.28Å
118	T	89.1	Confident	90.6	Very high	36 Å²	36	29.2 Å²	29.2	22%	0.221	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-39.7	173.1	-57.2	0	0	0	0	111.8	K30 V114 E115 L116 L120 E121	K30-T118 HydrophobicContact CG-CG2 3.98Å; V114-T118 WeakPolarHBondContact O-CB 3.26Å; V114-T118 PolarHBondContact O-N 3.18Å; V114-T118 PolarHBondContact O-OG1 2.9Å; E115-T118 WeakPolarHBondContact O-CB 3.45Å; E115-T118 PolarHBondContact O-N 3.41Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 3.05Å; T118-L120 PolarHBondContact O-N 2.77Å; T118-E121 PolarHBondContact O-N 3.4Å
119	V	90.9	Very high	90.9	Very high	14 Å²	14	29 Å²	29	9%	0.085	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-32.2	173.3	170.1	0	0	0	0	111.3	C33 F34 I43 E115 L116 D117 E121	C33-V119 HydrophobicContact CB-CG2 3.79Å; F34-V119 HydrophobicContact CD1-CG1 4.48Å; F34-V119 HydrophobicContact CD1-CG2 4.3Å; F34-V119 HydrophobicContact CE1-CB 4.47Å; F34-V119 HydrophobicContact CE1-CG1 4.08Å; F34-V119 HydrophobicContact CE1-CG2 4.29Å; I43-V119 HydrophobicContact CD1-CG1 4.04Å; I43-V119 HydrophobicContact CG1-CG1 3.55Å; E115-V119 WeakPolarHBondContact O-CG2 3.37Å; E115-V119 PolarHBondContact O-N 3.04Å; L116-V119 WeakPolarHBondContact O-CB 3.08Å; L116-V119 PolarHBondContact O-N 3.04Å; D117-V119 VanDerWaalsContact C-N 3.33Å; D117-V119 PolarHBondContact O-N 3.12Å; V119-E121 VanDerWaalsContact C-N 3.31Å
120	L	91.7	Very high	91.1	Very high	17 Å²	17	29.7 Å²	29.7	9%	0.089	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	18.2	177.5	-63.9	175	0	0	0	113.6	V42 L80 Y91 I93 L116 D117 T118 E122 Q123 A124	V42-L120 HydrophobicContact CG1-CD2 3.8Å; V42-L120 HydrophobicContact CG1-CG 4.49Å; L80-L120 HydrophobicContact CD1-CD1 3.82Å; L80-L120 HydrophobicContact CD2-CD1 4.18Å; Y91-L120 HydrophobicContact CD1-CD1 3.97Å; Y91-L120 HydrophobicContact CD1-CD2 3.96Å; Y91-L120 HydrophobicContact CE1-CD2 3.83Å; Y91-L120 HydrophobicContact CG-CD1 4Å; Y91-L120 HydrophobicContact CG-CD2 4.42Å; I93-L120 HydrophobicContact CD1-CD1 4.19Å; I93-L120 HydrophobicContact CG1-CD1 4.44Å; L116-L120 HydrophobicContact CD1-CD1 4.42Å; L116-L120 HydrophobicContact CG-CD1 4.35Å; L116-L120 WeakPolarHBondContact O-CG 3.45Å; L116-L120 PolarHBondContact O-N 2.74Å; D117-L120 CarbonylContact O-C 3.55Å; D117-L120 VanDerWaalsContact O-C 3.27Å; D117-L120 WeakPolarHBondContact O-CA 3.5Å; D117-L120 PolarHBondContact O-N 3.09Å; T118-L120 PolarHBondContact O-N 2.77Å; L120-E122 VanDerWaalsContact C-N 3.3Å; L120-E122 PolarHBondContact O-N 2.84Å; L120-Q123 WeakPolarHBondContact O-CB 3.34Å; L120-Q123 WeakPolarHBondContact O-CG 3.41Å; L120-Q123 PolarHBondContact O-N 2.97Å; L120-Q123 VanDerWaalsContact O-N 3.17Å; L120-A124 HydrophobicContact CD1-CB 4.21Å
121	E	89.4	Confident	91.5	Very high	140 Å²	140	29.7 Å²	29.7	65%	0.654	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	38.2	176.4	-54.7	-176.2	172.1	0	0	114.2	D117 T118 V119 Q123	D117-E121 PolarHBondContact O-N 3.11Å; D117-E121 VanDerWaalsContact O-N 3.13Å; T118-E121 PolarHBondContact O-N 3.4Å; V119-E121 VanDerWaalsContact C-N 3.31Å; E121-Q123 HydrophobicContact CB-CG 4.47Å; E121-Q123 PolarHBondContact O-N 3.3Å; E121-Q123 VanDerWaalsContact O-N 3.13Å; E121-Q123 PolarHBondContact O-NE2 3.36Å
122	E	88.5	Confident	91.7	Very high	105 Å²	105	30.6 Å²	30.6	49%	0.491	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	25.6	-179.5	-57	-174.2	-162.6	0	0	113.3	D117 L120 K326 Q354	D117-E122 PolarHBondContact O-N 3.08Å; D117-E122 WeakPolarHBondContact OD1-CA 3.42Å; L120-E122 VanDerWaalsContact C-N 3.3Å; L120-E122 PolarHBondContact O-N 2.84Å; E122-K326 IonicContact OE2-NZ 3.21Å; E122-K326 PolarHBondContact OE2-NZ 3.11Å; E122-Q354 PolarHBondContact O-NE2 2.76Å
123	Q	91.3	Very high	91.7	Very high	88 Å²	88	31.2 Å²	31.2	41%	0.411	15%	0.148	S	C	.	.			trans	-88.5	-8.3	178.1	-60.7	-54.7	-64.9	0	0	113.1	Y91 L120 E121 N353	Y91-Q123 HydrophobicContact CD2-CB 3.98Å; Y91-Q123 HydrophobicContact CE2-CB 4.24Å; L120-Q123 WeakPolarHBondContact O-CB 3.34Å; L120-Q123 WeakPolarHBondContact O-CG 3.41Å; L120-Q123 PolarHBondContact O-N 2.97Å; L120-Q123 VanDerWaalsContact O-N 3.17Å; E121-Q123 HydrophobicContact CB-CG 4.47Å; E121-Q123 PolarHBondContact O-N 3.3Å; E121-Q123 VanDerWaalsContact O-N 3.13Å; E121-Q123 PolarHBondContact O-NE2 3.36Å; Q123-N353 PolarHBondContact NE2-ND2 2.91Å; Q123-N353 PolarHBondContact OE1-ND2 3.37Å
124	A	93.7	Very high	91.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.008	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.3	-174.5	0	0	0	0	0	113.1	Y91 I93 D117 L120 Q354	Y91-A124 VanDerWaalsContact O-CA 3.32Å; Y91-A124 WeakPolarHBondContact O-CA 3.42Å; I93-A124 HydrophobicContact CD1-CB 3.52Å; I93-A124 HydrophobicContact CG1-CB 3.77Å; D117-A124 VanDerWaalsContact OD1-CB 3.24Å; D117-A124 WeakPolarHBondContact OD1-CB 3.39Å; D117-A124 PolarHBondContact OD1-N 3.33Å; D117-A124 VanDerWaalsContact OD1-N 3.09Å; L120-A124 HydrophobicContact CD1-CB 4.21Å; A124-Q354 VanDerWaalsContact C-NE2 3.31Å; A124-Q354 PolarHBondContact O-NE2 3.05Å; A124-Q354 PolarHBondContact O-OE1 2.75Å
125	V	95.2	Very high	92.3	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	130.4	165.3	-175.8	0	0	0	0	107.5	Y91 D92 I93 H127 T348 V349 I350 Q354	Y91-V125 PolarHBondContact O-N 2.73Å; D92-V125 CarbonylContact C-O 3.06Å; D92-V125 WeakPolarHBondContact CA-O 3.36Å; I93-V125 PolarHBondContact N-O 2.92Å; V125-H127 VanDerWaalsContact CG1-NE2 3.28Å; V125-H127 WeakPolarHBondContact CG1-NE2 3.17Å; V125-H127 PolarHBondContact O-CD2 3.36Å; V125-T348 HydrophobicContact CG1-CG2 3.4Å; V125-T348 VanDerWaalsContact CG1-CG2 3.4Å; V125-V349 WeakPolarHBondContact CG1-O 3.39Å; V125-I350 HydrophobicContact CG1-CG1 4Å; V125-Q354 HydrophobicContact CG2-CB 3.92Å; V125-Q354 HydrophobicContact CG2-CG 4.47Å
126	Q	94.7	Very high	92.3	Very high	21 Å²	21	34.3 Å²	34.3	10%	0.098	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136.9	-178.3	-56.1	179.4	19.5	0	0	110.6	I93 T113 D117 T348 V349	I93-Q126 CarbonylContact O-C 3.28Å; I93-Q126 WeakPolarHBondContact O-CA 3.48Å; T113-Q126 HydrophobicContact CG2-CB 4.48Å; T113-Q126 HydrophobicContact CG2-CG 4.27Å; D117-Q126 PolarHBondContact OD2-NE2 3.28Å; Q126-T348 CarbonylContact O-C 3.55Å; Q126-T348 WeakPolarHBondContact O-CA 3.44Å; Q126-V349 HydrophobicContact CB-CB 4.24Å; Q126-V349 PolarHBondContact N-O 3.45Å; Q126-V349 PolarHBondContact O-N 2.91Å
127	H	95.3	Very high	92.4	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.2	-176	-57.3	-105.6	0	0	0	110.9	D92 I93 H94 F95 V125 V347 T348	D92-H127 IonicContact OD1-NE2 2.89Å; I93-H127 PolarHBondContact O-N 2.72Å; H94-H127 CarbonylContact C-O 3.59Å; H94-H127 VanDerWaalsContact CA-O 3.31Å; H94-H127 WeakPolarHBondContact CA-O 3.43Å; H94-H127 HydrophobicContact CB-CB 4.15Å; H94-H127 AromaticContact CE1-CD2 3.53Å; H94-H127 AromaticContact CE1-CE1 3.96Å; H94-H127 AromaticContact CE1-CG 3.36Å; H94-H127 AromaticContact CE1-ND1 3.63Å; H94-H127 AromaticContact CE1-NE2 3.93Å; H94-H127 WeakPolarHBondContact ND1-CB 3.44Å; H94-H127 AromaticContact ND1-CD2 3.9Å; H94-H127 AromaticContact ND1-CG 3.45Å; H94-H127 AromaticContact NE2-CD2 3.66Å; H94-H127 AromaticContact NE2-CG 3.95Å; F95-H127 VanDerWaalsContact CD1-O 3.31Å; F95-H127 WeakPolarHBondContact CD1-O 3.26Å; F95-H127 PolarHBondContact N-O 2.85Å; V125-H127 VanDerWaalsContact CG1-NE2 3.28Å; V125-H127 WeakPolarHBondContact CG1-NE2 3.17Å; V125-H127 PolarHBondContact O-CD2 3.36Å; H127-V347 CarbonylContact C-O 3.52Å; H127-V347 WeakPolarHBondContact CA-O 3.5Å; H127-T348 VanDerWaalsContact CE1-CG2 3.47Å; H127-T348 WeakPolarHBondContact CE1-CG2 3.45Å; H127-T348 PolarHBondContact ND1-OG1 2.82Å
128	R	95	Very high	92.7	Very high	17 Å²	17	35.7 Å²	35.7	6%	0.064	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.1	164.6	-177.9	-172.7	82.9	163.7	6.9	108.9	F95 V130 P343 I345 P346 V347	F95-R128 HydrophobicContact CD2-CG 4.39Å; F95-R128 HydrophobicContact CE1-CB 4Å; F95-R128 HydrophobicContact CE2-CB 3.87Å; F95-R128 HydrophobicContact CE2-CG 3.52Å; F95-R128 HydrophobicContact CZ-CB 3.45Å; F95-R128 VanDerWaalsContact CZ-CB 3.45Å; F95-R128 HydrophobicContact CZ-CG 3.62Å; R128-V130 HydrophobicContact CG-CG2 4.28Å; R128-P343 PolarHBondContact NH2-O 3.06Å; R128-I345 PolarHBondContact NH2-O 2.83Å; R128-P346 WeakPolarHBondContact O-CA 3.49Å; R128-V347 HydrophobicContact CB-CB 3.92Å; R128-V347 HydrophobicContact CB-CG2 4.42Å; R128-V347 PolarHBondContact N-O 2.82Å; R128-V347 PolarHBondContact O-N 3.1Å
129	E	95.5	Very high	92.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.2	174.9	-51.3	-64.5	174.7	0	0	109.8	H94 F95 W96 V97 E134 S135 F138	H94-E129 HydrophobicContact CB-CG 3.93Å; H94-E129 IonicContact CE1-OE1 2.8Å; H94-E129 IonicContact CG-OE1 2.71Å; H94-E129 IonicContact ND1-OE1 3.33Å; H94-E129 PolarHBondContact ND1-OE1 2.85Å; F95-E129 PolarHBondContact O-N 3.27Å; W96-E129 CarbonylContact C-O 3.56Å; W96-E129 WeakPolarHBondContact CA-O 3.3Å; W96-E129 HydrophobicContact CB-CB 4.09Å; W96-E129 HydrophobicContact CG-CB 4.25Å; V97-E129 PolarHBondContact N-O 3.5Å; E129-E134 HydrophobicContact CB-CG 4.48Å; E129-E134 WeakPolarHBondContact OE2-CA 3.26Å; E129-S135 PolarHBondContact OE1-OG 3.29Å; E129-S135 PolarHBondContact OE2-N 2.78Å; E129-S135 PolarHBondContact OE2-OG 3.28Å; E129-F138 HydrophobicContact CG-CB 4.04Å; E129-F138 HydrophobicContact CG-CD1 4.3Å; E129-F138 HydrophobicContact CG-CD2 3.83Å; E129-F138 HydrophobicContact CG-CE2 4.29Å; E129-F138 HydrophobicContact CG-CG 3.81Å
130	V	93.4	Very high	93	Very high	15 Å²	15	37.1 Å²	37.1	9%	0.091	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.8	-179.5	-177.2	0	0	0	0	108.5	R128 R132 Y133 E134 F344	R128-V130 HydrophobicContact CG-CG2 4.28Å; V130-R132 PolarHBondContact O-N 2.92Å; V130-Y133 CarbonylContact O-C 3.48Å; V130-Y133 WeakPolarHBondContact O-CA 3.45Å; V130-Y133 PolarHBondContact O-N 2.82Å; V130-E134 PolarHBondContact O-N 2.79Å; V130-F344 HydrophobicContact CG1-CB 4.16Å; V130-F344 HydrophobicContact CG1-CD1 4.23Å
131	E	92.8	Very high	93.2	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.028	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.8	127.8	177.7	-167.4	-155.7	138	0	0	111.6	N73 W96 V97 S99 Y133 E134 I147 Q182	N73-E131 WeakPolarHBondContact CB-OE2 3.34Å; W96-E131 HydrophobicContact CH2-CB 4.32Å; W96-E131 HydrophobicContact CH2-CG 4.31Å; W96-E131 HydrophobicContact CZ2-CB 3.76Å; W96-E131 HydrophobicContact CZ2-CG 3.8Å; V97-E131 PolarHBondContact O-N 3.25Å; S99-E131 WeakPolarHBondContact CB-OE2 3.29Å; S99-E131 PolarHBondContact N-OE2 3.14Å; S99-E131 PolarHBondContact OG-OE2 3Å; E131-Y133 WeakPolarHBondContact O-CD2 3.47Å; E131-Y133 PolarHBondContact O-N 2.78Å; E131-E134 VanDerWaalsContact CA-OE1 3.3Å; E131-E134 WeakPolarHBondContact CA-OE1 3.31Å; E131-I147 HydrophobicContact CG-CD1 3.88Å; E131-I147 HydrophobicContact CG-CG2 4.02Å; E131-Q182 PolarHBondContact OE1-NE2 3.26Å
132	R	88.8	Confident	93.3	Very high	82 Å²	82	31.9 Å²	31.9	31%	0.309	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	-4.2	-179.3	-49.8	175.3	-173.9	-154.9	-8.1	115.7	V130 E134	V130-R132 PolarHBondContact O-N 2.92Å; R132-E134 VanDerWaalsContact CA-OE2 3.3Å; R132-E134 WeakPolarHBondContact CA-OE2 3.32Å; R132-E134 VanDerWaalsContact N-CD 3.34Å; R132-E134 PolarHBondContact N-OE1 2.92Å; R132-E134 VanDerWaalsContact N-OE1 3.15Å; R132-E134 PolarHBondContact N-OE2 2.81Å
133	Y	91.6	Very high	93.1	Very high	38 Å²	38	31.6 Å²	31.6	15%	0.149	16%	0.164	C	C	.	.			trans	-128.3	24.6	-179.8	-60.9	-84.3	0	0	0	110.8	V130 E131 K265 Y267 F344 P346	V130-Y133 CarbonylContact O-C 3.48Å; V130-Y133 WeakPolarHBondContact O-CA 3.45Å; V130-Y133 PolarHBondContact O-N 2.82Å; E131-Y133 WeakPolarHBondContact O-CD2 3.47Å; E131-Y133 PolarHBondContact O-N 2.78Å; Y133-K265 WeakPolarHBondContact CE1-O 3.31Å; Y133-K265 PolarHBondContact OH-O 2.8Å; Y133-Y267 AromaticContact CD1-CD2 3.87Å; Y133-Y267 HydrophobicContact CD1-CD2 3.87Å; Y133-Y267 AromaticContact CD1-CE2 3.66Å; Y133-Y267 HydrophobicContact CD1-CE2 3.66Å; Y133-Y267 AromaticContact CE1-CD2 3.48Å; Y133-Y267 HydrophobicContact CE1-CD2 3.48Å; Y133-Y267 VanDerWaalsContact CE1-CD2 3.48Å; Y133-Y267 AromaticContact CE1-CE2 3.19Å; Y133-Y267 HydrophobicContact CE1-CE2 3.19Å; Y133-Y267 HydrophobicContact CE1-CG 4.45Å; Y133-Y267 AromaticContact CE1-CZ 3.96Å; Y133-Y267 AromaticContact CZ-CE2 3.73Å; Y133-F344 WeakPolarHBondContact CB-O 3.32Å; Y133-F344 HydrophobicContact CD1-CB 4.4Å; Y133-F344 HydrophobicContact CD2-CB 3.46Å; Y133-F344 VanDerWaalsContact CD2-CB 3.46Å; Y133-F344 HydrophobicContact CD2-CD2 4.49Å; Y133-F344 HydrophobicContact CD2-CG 4.28Å; Y133-F344 HydrophobicContact CE2-CB 3.69Å; Y133-F344 AromaticContact CE2-CD2 3.86Å; Y133-F344 HydrophobicContact CE2-CD2 3.86Å; Y133-F344 HydrophobicContact CE2-CG 4.11Å; Y133-F344 HydrophobicContact CG-CB 3.85Å; Y133-P346 WeakPolarHBondContact O-CD 3.19Å; Y133-P346 WeakPolarHBondContact O-CG 3.28Å
134	E	93.3	Very high	92.9	Very high	13 Å²	13	28 Å²	28	6%	0.061	15%	0.148	C	C	.	.			trans	-66.8	145.2	-177.4	-58	87.6	165.5	0	0	112.5	W96 E129 V130 E131 R132 F138 K139 F145 I147	W96-E134 PolarHBondContact NE1-OE1 3.38Å; E129-E134 HydrophobicContact CB-CG 4.48Å; E129-E134 WeakPolarHBondContact OE2-CA 3.26Å; V130-E134 PolarHBondContact O-N 2.79Å; E131-E134 VanDerWaalsContact CA-OE1 3.3Å; E131-E134 WeakPolarHBondContact CA-OE1 3.31Å; R132-E134 VanDerWaalsContact CA-OE2 3.3Å; R132-E134 WeakPolarHBondContact CA-OE2 3.32Å; R132-E134 VanDerWaalsContact N-CD 3.34Å; R132-E134 PolarHBondContact N-OE1 2.92Å; R132-E134 VanDerWaalsContact N-OE1 3.15Å; R132-E134 PolarHBondContact N-OE2 2.81Å; E134-F138 HydrophobicContact CB-CD1 3.94Å; E134-F138 HydrophobicContact CG-CD1 3.97Å; E134-F138 HydrophobicContact CG-CE1 4.17Å; E134-K139 HydrophobicContact CB-CD 4.26Å; E134-K139 HydrophobicContact CB-CG 4.06Å; E134-F145 HydrophobicContact CG-CE1 4.27Å; E134-F145 HydrophobicContact CG-CZ 4.01Å; E134-I147 WeakPolarHBondContact OE1-CD1 3.06Å
135	S	93.7	Very high	92.9	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.021	15%	0.148	C	C	.	.			trans	-60.2	155.5	173.2	69.8	0	0	0	0	111.8	E129 L137 F138 K139	E129-S135 PolarHBondContact OE1-OG 3.29Å; E129-S135 PolarHBondContact OE2-N 2.78Å; E129-S135 PolarHBondContact OE2-OG 3.28Å; S135-L137 VanDerWaalsContact C-N 3.27Å; S135-F138 PolarHBondContact O-N 3.36Å; S135-F138 VanDerWaalsContact OG-CB 3.27Å; S135-F138 WeakPolarHBondContact OG-CB 3.34Å; S135-F138 PolarHBondContact OG-N 2.9Å; S135-K139 VanDerWaalsContact O-CE 3.31Å; S135-K139 WeakPolarHBondContact O-CE 3.34Å; S135-K139 PolarHBondContact O-N 2.85Å
136	N	91.4	Very high	92.8	Very high	108 Å²	108	28.9 Å²	28.9	58%	0.578	15%	0.151	S	C	*	.	H	α-helix	trans	-69.3	-33	175.7	-71	-41.5	0	0	0	110.9	K139 S140 E358	N136-K139 PolarHBondContact OD1-NZ 3.35Å; N136-S140 WeakPolarHBondContact O-CB 3.35Å; N136-S140 PolarHBondContact O-N 2.82Å; N136-E358 PolarHBondContact N-OE1 2.98Å
137	L	94.9	Very high	92.8	Very high	43 Å²	43	28 Å²	28	23%	0.225	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-53.3	172.6	177.7	60.7	0	0	0	111.3	S135 K139 S140 Y141 E358	S135-L137 VanDerWaalsContact C-N 3.27Å; L137-K139 PolarHBondContact O-N 2.78Å; L137-S140 VanDerWaalsContact O-CB 3.3Å; L137-S140 WeakPolarHBondContact O-CB 3.26Å; L137-S140 PolarHBondContact O-N 2.85Å; L137-S140 PolarHBondContact O-OG 3.48Å; L137-Y141 HydrophobicContact CD1-CE1 3.77Å; L137-Y141 WeakPolarHBondContact CD1-OH 3.3Å; L137-Y141 HydrophobicContact CG-CE1 4.23Å; L137-Y141 VanDerWaalsContact CG-OH 3.26Å; L137-Y141 WeakPolarHBondContact CG-OH 3.43Å; L137-E358 PolarHBondContact N-OE1 2.58Å; L137-E358 VanDerWaalsContact N-OE1 3.1Å
138	F	96.5	Very high	92.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.6	-47.8	-179.3	179.5	-105.9	0	0	0	112.8	F71 V79 H94 W96 E129 E134 S135 S140 Y141 F142 F145	F71-F138 AromaticContact CE1-CZ 3.97Å; F71-F138 HydrophobicContact CE1-CZ 3.97Å; F71-F138 HydrophobicContact CE2-CZ 4.32Å; F71-F138 HydrophobicContact CZ-CE1 4.26Å; F71-F138 AromaticContact CZ-CZ 3.65Å; F71-F138 HydrophobicContact CZ-CZ 3.65Å; V79-F138 HydrophobicContact CB-CE2 3.93Å; V79-F138 HydrophobicContact CG1-CE2 4.38Å; V79-F138 HydrophobicContact CG2-CE2 3.64Å; V79-F138 HydrophobicContact CG2-CZ 4.16Å; H94-F138 HydrophobicContact CB-CD2 3.68Å; H94-F138 HydrophobicContact CB-CE2 3.88Å; H94-F138 AromaticContact CG-CD2 3.63Å; H94-F138 AromaticContact ND1-CD2 3.63Å; W96-F138 HydrophobicContact CB-CE1 4.42Å; W96-F138 HydrophobicContact CB-CE2 4.35Å; W96-F138 HydrophobicContact CB-CZ 3.79Å; W96-F138 AromaticContact CD1-CE1 3.45Å; W96-F138 VanDerWaalsContact CD1-CE1 3.45Å; W96-F138 AromaticContact CD1-CZ 3.72Å; W96-F138 HydrophobicContact CG-CE1 4.14Å; W96-F138 AromaticContact CG-CZ 3.95Å; W96-F138 HydrophobicContact CG-CZ 3.95Å; E129-F138 HydrophobicContact CG-CB 4.04Å; E129-F138 HydrophobicContact CG-CD1 4.3Å; E129-F138 HydrophobicContact CG-CD2 3.83Å; E129-F138 HydrophobicContact CG-CE2 4.29Å; E129-F138 HydrophobicContact CG-CG 3.81Å; E134-F138 HydrophobicContact CB-CD1 3.94Å; E134-F138 HydrophobicContact CG-CD1 3.97Å; E134-F138 HydrophobicContact CG-CE1 4.17Å; S135-F138 PolarHBondContact O-N 3.36Å; S135-F138 VanDerWaalsContact OG-CB 3.27Å; S135-F138 WeakPolarHBondContact OG-CB 3.34Å; S135-F138 PolarHBondContact OG-N 2.9Å; F138-S140 PolarHBondContact O-N 2.98Å; F138-Y141 HydrophobicContact CD2-CD2 4.46Å; F138-Y141 WeakPolarHBondContact O-CD2 3.31Å; F138-Y141 PolarHBondContact O-N 2.73Å; F138-F142 HydrophobicContact CD1-CE2 4.35Å; F138-F142 HydrophobicContact CD2-CE2 4.43Å; F138-F142 HydrophobicContact CE1-CE2 4.06Å; F138-F142 HydrophobicContact CE2-CE2 4.15Å; F138-F142 HydrophobicContact CE2-CZ 4.46Å; F138-F142 AromaticContact CZ-CE2 3.95Å; F138-F142 HydrophobicContact CZ-CE2 3.95Å; F138-F142 HydrophobicContact CZ-CZ 4.41Å; F138-F142 WeakPolarHBondContact O-CD2 3.34Å; F138-F142 WeakPolarHBondContact O-CE2 3.28Å; F138-F145 HydrophobicContact CD1-CE2 4.11Å; F138-F145 HydrophobicContact CD1-CZ 4.23Å; F138-F145 AromaticContact CE1-CE2 3.48Å; F138-F145 HydrophobicContact CE1-CE2 3.48Å; F138-F145 VanDerWaalsContact CE1-CE2 3.48Å; F138-F145 AromaticContact CE1-CZ 3.7Å; F138-F145 HydrophobicContact CE1-CZ 3.7Å; F138-F145 HydrophobicContact CZ-CE2 4.36Å
139	K	93.4	Very high	92.6	Very high	25 Å²	25	30.3 Å²	30.3	11%	0.109	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-26.1	178.1	-67.3	179.9	-65.9	175.4	0	112.6	E134 S135 N136 L137 Y141 F142 F145 E174	E134-K139 HydrophobicContact CB-CD 4.26Å; E134-K139 HydrophobicContact CB-CG 4.06Å; S135-K139 VanDerWaalsContact O-CE 3.31Å; S135-K139 WeakPolarHBondContact O-CE 3.34Å; S135-K139 PolarHBondContact O-N 2.85Å; N136-K139 PolarHBondContact OD1-NZ 3.35Å; L137-K139 PolarHBondContact O-N 2.78Å; K139-Y141 PolarHBondContact O-N 3.29Å; K139-F142 PolarHBondContact O-N 3.03Å; K139-F145 HydrophobicContact CD-CD1 4.49Å; K139-F145 HydrophobicContact CG-CD1 4.22Å; K139-F145 HydrophobicContact CG-CE1 4.29Å; K139-E174 WeakPolarHBondContact CD-OE1 3.43Å; K139-E174 VanDerWaalsContact CE-OE1 3.3Å; K139-E174 WeakPolarHBondContact CE-OE1 3.36Å; K139-E174 IonicContact NZ-OE1 3.56Å; K139-E174 PolarHBondContact NZ-OE1 2.88Å
140	S	92.8	Very high	92.3	Very high	55 Å²	55	31.2 Å²	31.2	39%	0.385	17%	0.17	S	C	.	.	H	α-helix	trans	-66.1	-21	-179	81.2	0	0	0	0	114.3	N136 L137 F138 F142	N136-S140 WeakPolarHBondContact O-CB 3.35Å; N136-S140 PolarHBondContact O-N 2.82Å; L137-S140 VanDerWaalsContact O-CB 3.3Å; L137-S140 WeakPolarHBondContact O-CB 3.26Å; L137-S140 PolarHBondContact O-N 2.85Å; L137-S140 PolarHBondContact O-OG 3.48Å; F138-S140 PolarHBondContact O-N 2.98Å; S140-F142 PolarHBondContact O-N 2.78Å
141	Y	95.2	Very high	92	Very high	39 Å²	39	30.5 Å²	30.5	15%	0.153	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-20.3	179.1	-52.9	-30.5	0	0	0	113.3	L50 V79 N81 D92 H94 L137 F138 K139	L50-Y141 HydrophobicContact CD1-CD2 4.08Å; L50-Y141 HydrophobicContact CD1-CG 4.11Å; V79-Y141 HydrophobicContact CG1-CD2 4.19Å; N81-Y141 HydrophobicContact CB-CD1 4.43Å; N81-Y141 HydrophobicContact CB-CD2 4.42Å; N81-Y141 HydrophobicContact CB-CE1 3.86Å; N81-Y141 HydrophobicContact CB-CE2 3.82Å; N81-Y141 WeakPolarHBondContact ND2-CE1 3.22Å; N81-Y141 PolarHBondContact ND2-OH 3.07Å; D92-Y141 PolarHBondContact OD2-OH 3.37Å; H94-Y141 AromaticContact CD2-CE2 3.67Å; H94-Y141 AromaticContact CE1-CE2 3.93Å; H94-Y141 AromaticContact NE2-CE2 3.28Å; H94-Y141 VanDerWaalsContact NE2-CE2 3.28Å; H94-Y141 WeakPolarHBondContact NE2-CE2 3.47Å; H94-Y141 AromaticContact NE2-CZ 3.52Å; H94-Y141 PolarHBondContact NE2-OH 2.68Å; L137-Y141 HydrophobicContact CD1-CE1 3.77Å; L137-Y141 WeakPolarHBondContact CD1-OH 3.3Å; L137-Y141 HydrophobicContact CG-CE1 4.23Å; L137-Y141 VanDerWaalsContact CG-OH 3.26Å; L137-Y141 WeakPolarHBondContact CG-OH 3.43Å; F138-Y141 HydrophobicContact CD2-CD2 4.46Å; F138-Y141 WeakPolarHBondContact O-CD2 3.31Å; F138-Y141 PolarHBondContact O-N 2.73Å; K139-Y141 PolarHBondContact O-N 3.29Å
142	F	93	Very high	91.6	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.035	17%	0.174	C	C	.	.			trans	-113.9	124.6	-173.1	-47.7	-69.3	0	0	0	110.3	L50 V52 F71 V79 F138 K139 S140 C144 F145	L50-F142 HydrophobicContact CD2-CD1 4.46Å; L50-F142 HydrophobicContact CD2-CE1 3.96Å; V52-F142 HydrophobicContact CG2-CE1 4.17Å; F71-F142 HydrophobicContact CE2-CD2 4.33Å; F71-F142 HydrophobicContact CE2-CE1 4.39Å; F71-F142 AromaticContact CE2-CE2 3.9Å; F71-F142 HydrophobicContact CE2-CE2 3.9Å; F71-F142 AromaticContact CE2-CZ 3.94Å; F71-F142 HydrophobicContact CE2-CZ 3.94Å; F71-F142 HydrophobicContact CZ-CE1 4.33Å; F71-F142 AromaticContact CZ-CE2 3.92Å; F71-F142 HydrophobicContact CZ-CE2 3.92Å; F71-F142 AromaticContact CZ-CZ 3.67Å; F71-F142 HydrophobicContact CZ-CZ 3.67Å; V79-F142 HydrophobicContact CG1-CZ 4.21Å; V79-F142 HydrophobicContact CG2-CZ 4.29Å; F138-F142 HydrophobicContact CD1-CE2 4.35Å; F138-F142 HydrophobicContact CD2-CE2 4.43Å; F138-F142 HydrophobicContact CE1-CE2 4.06Å; F138-F142 HydrophobicContact CE2-CE2 4.15Å; F138-F142 HydrophobicContact CE2-CZ 4.46Å; F138-F142 AromaticContact CZ-CE2 3.95Å; F138-F142 HydrophobicContact CZ-CE2 3.95Å; F138-F142 HydrophobicContact CZ-CZ 4.41Å; F138-F142 WeakPolarHBondContact O-CD2 3.34Å; F138-F142 WeakPolarHBondContact O-CE2 3.28Å; K139-F142 PolarHBondContact O-N 3.03Å; S140-F142 PolarHBondContact O-N 2.78Å; F142-C144 PolarHBondContact O-N 3.32Å; F142-F145 HydrophobicContact CB-CB 4.48Å; F142-F145 HydrophobicContact CB-CD2 4.5Å; F142-F145 AromaticContact CD2-CD2 3.64Å; F142-F145 HydrophobicContact CD2-CD2 3.64Å; F142-F145 HydrophobicContact CD2-CE2 4.12Å; F142-F145 HydrophobicContact CE2-CD2 4.23Å; F142-F145 HydrophobicContact CE2-CE2 4.26Å; F142-F145 HydrophobicContact CG-CD2 4.28Å
143	S	83.4	Confident	90.9	Very high	99 Å²	99	35.7 Å²	35.7	69%	0.692	19%	0.194	S	C	*	.	S	Bend	trans	-65	-27.9	171.3	55.7	0	0	0	0	112.1
144	C	87.7	Confident	89.8	Confident	12 Å²	12	36.8 Å²	36.8	8%	0.081	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	110.7	179	172.4	0	0	0	0	108.9	F142 R146 F179	F142-C144 PolarHBondContact O-N 3.32Å; C144-R146 WeakPolarHBondContact SG-CG 3.46Å; C144-R146 PolarHBondContact SG-NE 2.91Å; C144-F179 HydrophobicContact CB-CE2 3.98Å; C144-F179 HydrophobicContact CB-CZ 3.9Å; C144-F179 WeakPolarHBondContact SG-CE2 3.46Å
145	F	93.4	Very high	87.9	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	103.5	-179.8	-172.1	-115.1	0	0	0	110.2	G69 F71 E134 F138 K139 F142 I147 F179 Q180 V181	G69-F145 CarbonylContact O-C 3.59Å; F71-F145 AromaticContact CD2-CD2 3.94Å; F71-F145 HydrophobicContact CD2-CD2 3.94Å; F71-F145 AromaticContact CD2-CE2 3.42Å; F71-F145 HydrophobicContact CD2-CE2 3.42Å; F71-F145 VanDerWaalsContact CD2-CE2 3.42Å; F71-F145 HydrophobicContact CD2-CZ 4.19Å; F71-F145 AromaticContact CE2-CD2 3.78Å; F71-F145 HydrophobicContact CE2-CD2 3.78Å; F71-F145 AromaticContact CE2-CE2 3.33Å; F71-F145 HydrophobicContact CE2-CE2 3.33Å; F71-F145 HydrophobicContact CE2-CZ 4.4Å; F71-F145 HydrophobicContact CG-CE2 4.38Å; F71-F145 HydrophobicContact CZ-CE2 4.23Å; E134-F145 HydrophobicContact CG-CE1 4.27Å; E134-F145 HydrophobicContact CG-CZ 4.01Å; F138-F145 HydrophobicContact CD1-CE2 4.11Å; F138-F145 HydrophobicContact CD1-CZ 4.23Å; F138-F145 AromaticContact CE1-CE2 3.48Å; F138-F145 HydrophobicContact CE1-CE2 3.48Å; F138-F145 VanDerWaalsContact CE1-CE2 3.48Å; F138-F145 AromaticContact CE1-CZ 3.7Å; F138-F145 HydrophobicContact CE1-CZ 3.7Å; F138-F145 HydrophobicContact CZ-CE2 4.36Å; K139-F145 HydrophobicContact CD-CD1 4.49Å; K139-F145 HydrophobicContact CG-CD1 4.22Å; K139-F145 HydrophobicContact CG-CE1 4.29Å; F142-F145 HydrophobicContact CB-CB 4.48Å; F142-F145 HydrophobicContact CB-CD2 4.5Å; F142-F145 AromaticContact CD2-CD2 3.64Å; F142-F145 HydrophobicContact CD2-CD2 3.64Å; F142-F145 HydrophobicContact CD2-CE2 4.12Å; F142-F145 HydrophobicContact CE2-CD2 4.23Å; F142-F145 HydrophobicContact CE2-CE2 4.26Å; F142-F145 HydrophobicContact CG-CD2 4.28Å; F145-I147 HydrophobicContact CE1-CD1 3.76Å; F145-I147 HydrophobicContact CE1-CG1 3.96Å; F145-I147 HydrophobicContact CZ-CD1 4.23Å; F145-I147 HydrophobicContact CZ-CG1 4.25Å; F145-F179 PolarHBondContact N-O 2.74Å; F145-F179 VanDerWaalsContact N-O 3.1Å; F145-Q180 HydrophobicContact CD1-CB 4.37Å; F145-Q180 HydrophobicContact CD1-CG 3.88Å; F145-Q180 CarbonylContact O-C 3.58Å; F145-Q180 WeakPolarHBondContact O-CA 3.27Å; F145-V181 PolarHBondContact O-N 3.44Å
146	R	93.8	Very high	85.9	Confident	17 Å²	17	42.3 Å²	42.3	6%	0.064	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.5	-177.9	-52	-172.9	-168	179.4	-9.6	110.9	G69 H70 F71 C144 V181 F224 Q227 E231	G69-R146 PolarHBondContact O-N 3.14Å; H70-R146 VanDerWaalsContact CD2-CD 3.46Å; H70-R146 WeakPolarHBondContact CD2-CD 3.32Å; H70-R146 WeakPolarHBondContact NE2-CD 3.4Å; H70-R146 PolarHBondContact NE2-NE 3.26Å; F71-R146 PolarHBondContact N-O 2.68Å; C144-R146 WeakPolarHBondContact SG-CG 3.46Å; C144-R146 PolarHBondContact SG-NE 2.91Å; R146-V181 CarbonylContact C-O 3.51Å; R146-V181 VanDerWaalsContact CA-O 3.22Å; R146-V181 WeakPolarHBondContact CA-O 3.41Å; R146-V181 HydrophobicContact CG-CB 4.38Å; R146-F224 VanDerWaalsContact CZ-CE2 3.47Å; R146-F224 VanDerWaalsContact NE-CE2 3.32Å; R146-Q227 VanDerWaalsContact NH2-CD 3.3Å; R146-E231 IonicContact CZ-OE1 2.74Å; R146-E231 IonicContact NH1-OE1 2.94Å; R146-E231 PolarHBondContact NH1-OE1 3Å; R146-E231 VanDerWaalsContact NH1-OE1 3.09Å; R146-E231 IonicContact NH1-OE2 2.86Å; R146-E231 PolarHBondContact NH1-OE2 3.34Å; R146-E231 IonicContact NH2-OE1 2.93Å; R146-E231 PolarHBondContact NH2-OE1 3.15Å
147	I	94.9	Very high	83.8	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.5	171.1	-52.2	173.5	0	0	0	108	F71 N73 W96 E131 E134 F145 V181 Q182 E183	F71-I147 WeakPolarHBondContact O-CA 3.19Å; N73-I147 HydrophobicContact CB-CG2 4.3Å; W96-I147 HydrophobicContact CH2-CG2 4.31Å; W96-I147 HydrophobicContact CZ2-CD1 4.22Å; W96-I147 HydrophobicContact CZ2-CG1 4.39Å; W96-I147 HydrophobicContact CZ2-CG2 4.3Å; E131-I147 HydrophobicContact CG-CD1 3.88Å; E131-I147 HydrophobicContact CG-CG2 4.02Å; E134-I147 WeakPolarHBondContact OE1-CD1 3.06Å; F145-I147 HydrophobicContact CE1-CD1 3.76Å; F145-I147 HydrophobicContact CE1-CG1 3.96Å; F145-I147 HydrophobicContact CZ-CD1 4.23Å; F145-I147 HydrophobicContact CZ-CG1 4.25Å; I147-V181 PolarHBondContact N-O 2.88Å; I147-Q182 HydrophobicContact CB-CG 4.28Å; I147-Q182 CarbonylContact O-C 3.53Å; I147-Q182 WeakPolarHBondContact O-CA 3.44Å; I147-E183 PolarHBondContact O-N 3.5Å
148	L	93.2	Very high	80.9	Confident	26 Å²	26	53.7 Å²	53.7	14%	0.136	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	154.6	179.8	-64.2	176.6	0	0	0	111.2	F71 F72 N73 L169 E183	F71-L148 PolarHBondContact O-N 2.91Å; F72-L148 WeakPolarHBondContact CA-O 3.49Å; F72-L148 HydrophobicContact CD1-CB 3.66Å; F72-L148 HydrophobicContact CE1-CB 3.66Å; F72-L148 HydrophobicContact CE1-CD1 3.82Å; F72-L148 HydrophobicContact CE1-CG 4.31Å; N73-L148 PolarHBondContact N-O 3.18Å; L148-L169 HydrophobicContact CD2-CD2 3.78Å; L148-E183 HydrophobicContact CD2-CB 4.23Å
149	N	91.7	Very high	78.2	Confident	41 Å²	41	57 Å²	57	22%	0.219	30%	0.297	C	S	.	.	S	Bend	trans	-73.9	146.8	176.2	-77.1	-52.9	0	0	0	111.4	N73 K100 E183	N73-N149 PolarHBondContact ND2-OD1 3.11Å; N73-N149 VanDerWaalsContact OD1-CA 3.3Å; N73-N149 WeakPolarHBondContact OD1-CA 3.43Å; K100-N149 PolarHBondContact NZ-OD1 2.96Å; N149-E183 HydrophobicContact CB-CG 4.42Å; N149-E183 VanDerWaalsContact CB-OE1 3.29Å; N149-E183 WeakPolarHBondContact CB-OE1 3.4Å; N149-E183 PolarHBondContact N-OE2 3.4Å; N149-E183 VanDerWaalsContact ND2-CG 3.35Å; N149-E183 WeakPolarHBondContact ND2-CG 3.31Å; N149-E183 PolarHBondContact ND2-OE1 2.69Å
150	G	89.1	Confident	75.9	Confident	19 Å²	19	59.6 Å²	59.6	20%	0.196	32%	0.315	C	S	.	.			trans	105.9	-162.4	174.3	0	0	0	0	0	111.4	F72 N73 G74 S154	F72-G150 WeakPolarHBondContact CB-O 3.45Å; N73-G150 PolarHBondContact OD1-N 3.46Å; G74-G150 WeakPolarHBondContact CA-O 3.32Å; G74-G150 PolarHBondContact N-O 2.73Å; G150-S154 WeakPolarHBondContact CA-OG 3.4Å
151	G	86.9	Confident	74	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.01	34%	0.338	C	S	.	.			trans	167.6	-166.7	-171	0	0	0	0	0	111.6	D75 S154 G155 F156	D75-G151 WeakPolarHBondContact OD1-CA 3.21Å; D75-G151 WeakPolarHBondContact OD2-CA 3.41Å; G151-S154 PolarHBondContact N-OG 3.21Å; G151-S154 PolarHBondContact O-N 2.92Å; G151-S154 PolarHBondContact O-OG 3.19Å; G151-G155 PolarHBondContact O-N 2.72Å; G151-F156 VanDerWaalsContact N-CE2 3.3Å; G151-F156 WeakPolarHBondContact O-CD2 3.37Å; G151-F156 PolarHBondContact O-N 3Å
152	I	83.9	Confident	72.1	Confident	39 Å²	39	68.8 Å²	68.8	20%	0.2	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-44.1	-179.5	-63.3	168.8	0	0	0	110.3	R54 V55 Q56 D75 S154 G155	R54-I152 HydrophobicContact CG-CD1 4.41Å; V55-I152 WeakPolarHBondContact O-CD1 3.33Å; Q56-I152 VanDerWaalsContact CA-CD1 3.48Å; Q56-I152 HydrophobicContact CB-CD1 3.57Å; Q56-I152 HydrophobicContact CG-CD1 3.4Å; Q56-I152 VanDerWaalsContact CG-CD1 3.4Å; D75-I152 WeakPolarHBondContact OD1-CG1 3.41Å; D75-I152 PolarHBondContact OD1-N 3.26Å; I152-S154 PolarHBondContact O-N 2.74Å; I152-G155 WeakPolarHBondContact O-CA 3.39Å; I152-G155 PolarHBondContact O-N 3.38Å
153	E	75.5	Confident	70.8	Confident	157 Å²	157	75 Å²	75	73%	0.734	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-39.3	179.3	-71.1	-145.6	143.4	0	0	112.8	T102 G155	T102-E153 HydrophobicContact CG2-CG 4.46Å; E153-G155 PolarHBondContact O-N 2.77Å
154	S	68.7	Low	70.5	Confident	62 Å²	62	74.2 Å²	74.2	43%	0.434	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	1.3	174	70.4	0	0	0	0	113.5	G150 G151 I152 F156 R157	G150-S154 WeakPolarHBondContact CA-OG 3.4Å; G151-S154 PolarHBondContact N-OG 3.21Å; G151-S154 PolarHBondContact O-N 2.92Å; G151-S154 PolarHBondContact O-OG 3.19Å; I152-S154 PolarHBondContact O-N 2.74Å; S154-F156 PolarHBondContact O-N 2.75Å; S154-R157 PolarHBondContact O-N 3.39Å
155	G	53	Low	70.4	Confident	47 Å²	47	77.5 Å²	77.5	49%	0.485	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	25.6	178.7	0	0	0	0	0	113.4	G151 I152 E153 R157 R158	G151-G155 PolarHBondContact O-N 2.72Å; I152-G155 WeakPolarHBondContact O-CA 3.39Å; I152-G155 PolarHBondContact O-N 3.38Å; E153-G155 PolarHBondContact O-N 2.77Å; G155-R157 PolarHBondContact O-N 3.28Å; G155-R158 PolarHBondContact O-N 3.26Å
156	F	52.1	Low	70.3	Confident	85 Å²	85	79.2 Å²	79.2	37%	0.373	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	27.6	53.1	-169.6	-123.5	-79.9	0	0	0	111.7	F72 G151 S154 R158	F72-F156 HydrophobicContact CB-CE2 3.97Å; F72-F156 HydrophobicContact CD1-CD2 4.4Å; F72-F156 AromaticContact CD1-CE1 3.96Å; F72-F156 HydrophobicContact CD1-CE1 3.96Å; F72-F156 AromaticContact CD1-CE2 3.17Å; F72-F156 HydrophobicContact CD1-CE2 3.17Å; F72-F156 AromaticContact CD1-CZ 2.95Å; F72-F156 HydrophobicContact CD1-CZ 2.95Å; F72-F156 HydrophobicContact CD2-CD2 4.06Å; F72-F156 AromaticContact CD2-CE2 3.44Å; F72-F156 HydrophobicContact CD2-CE2 3.44Å; F72-F156 VanDerWaalsContact CD2-CE2 3.44Å; F72-F156 AromaticContact CD2-CZ 4Å; F72-F156 HydrophobicContact CD2-CZ 4Å; F72-F156 HydrophobicContact CE1-CD1 4.35Å; F72-F156 HydrophobicContact CE1-CD2 4.37Å; F72-F156 AromaticContact CE1-CE1 3.32Å; F72-F156 HydrophobicContact CE1-CE1 3.32Å; F72-F156 AromaticContact CE1-CE2 3.35Å; F72-F156 HydrophobicContact CE1-CE2 3.35Å; F72-F156 AromaticContact CE1-CZ 2.78Å; F72-F156 HydrophobicContact CE1-CZ 2.78Å; F72-F156 HydrophobicContact CE2-CD2 4Å; F72-F156 HydrophobicContact CE2-CE1 4.32Å; F72-F156 AromaticContact CE2-CE2 3.58Å; F72-F156 HydrophobicContact CE2-CE2 3.58Å; F72-F156 AromaticContact CE2-CZ 3.86Å; F72-F156 HydrophobicContact CE2-CZ 3.86Å; F72-F156 HydrophobicContact CG-CD2 4.25Å; F72-F156 AromaticContact CG-CE2 3.22Å; F72-F156 HydrophobicContact CG-CE2 3.22Å; F72-F156 AromaticContact CG-CZ 3.59Å; F72-F156 HydrophobicContact CG-CZ 3.59Å; F72-F156 HydrophobicContact CZ-CD1 4.13Å; F72-F156 HydrophobicContact CZ-CD2 4.14Å; F72-F156 AromaticContact CZ-CE1 3.5Å; F72-F156 HydrophobicContact CZ-CE1 3.5Å; F72-F156 AromaticContact CZ-CE2 3.53Å; F72-F156 HydrophobicContact CZ-CE2 3.53Å; F72-F156 HydrophobicContact CZ-CG 4.46Å; F72-F156 AromaticContact CZ-CZ 3.27Å; F72-F156 HydrophobicContact CZ-CZ 3.27Å; G151-F156 VanDerWaalsContact N-CE2 3.3Å; G151-F156 WeakPolarHBondContact O-CD2 3.37Å; G151-F156 PolarHBondContact O-N 3Å; S154-F156 PolarHBondContact O-N 2.75Å; F156-R158 PolarHBondContact O-N 3.35Å
157	R	46.1	Very low	70.3	Confident	140 Å²	140	80.9 Å²	80.9	53%	0.528	41%	0.413	S	S	.	.			trans	14	101.1	-167.8	-65.4	-179.8	-178.7	-151.6	5	112.2	S154 G155 T159 Q165	S154-R157 PolarHBondContact O-N 3.39Å; G155-R157 PolarHBondContact O-N 3.28Å; R157-T159 HydrophobicContact CB-CG2 3.92Å; R157-T159 PolarHBondContact O-N 2.62Å; R157-Q165 VanDerWaalsContact NH1-CG 3.34Å
158	R	35.5	Very low	70.4	Confident	249 Å²	249	80.8 Å²	80.8	94%	0.94	41%	0.413	S	S	*	.			trans	-52.7	77.1	150.9	-80.1	-178.5	174	176.2	-1.9	107.9	G155 F156 T160	G155-R158 PolarHBondContact O-N 3.26Å; F156-R158 PolarHBondContact O-N 3.35Å; R158-T160 PolarHBondContact O-N 3.33Å
159	T	38.9	Very low	70.6	Confident	71 Å²	71	79.9 Å²	79.9	44%	0.436	41%	0.408	S	S	.	.			trans	-66.1	125.9	164	45.4	0	0	0	0	103.1	R157 E163	R157-T159 HydrophobicContact CB-CG2 3.92Å; R157-T159 PolarHBondContact O-N 2.62Å; T159-E163 WeakPolarHBondContact CB-O 3.3Å; T159-E163 WeakPolarHBondContact CG2-O 3.15Å
160	T	45.3	Very low	70.8	Confident	78 Å²	78	79.5 Å²	79.5	48%	0.479	41%	0.405	S	S	.	.			trans	-43.7	145.1	156	51.2	0	0	0	0	107	R158 N162 E163	R158-T160 PolarHBondContact O-N 3.33Å; T160-N162 PolarHBondContact O-N 3.07Å; T160-E163 PolarHBondContact O-N 3.26Å; T160-E163 PolarHBondContact OG1-OE2 3.01Å
161	P	52.2	Low	71	Confident	134 Å²	134	78.6 Å²	78.6	87%	0.87	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-13.4	-172.9	-29.5	33.8	0	0	0	116
162	N	56.7	Low	71.2	Confident	154 Å²	154	80.7 Å²	80.7	82%	0.824	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-4.8	-174.2	-65	-9.4	0	0	0	115.7	T160	T160-N162 PolarHBondContact O-N 3.07Å
163	E	64	Low	71.2	Confident	137 Å²	137	80.6 Å²	80.6	64%	0.64	41%	0.405	S	S	*	.			trans	-109.9	92.9	-177.2	-74.3	-176.4	163.8	0	0	112	T159 T160	T159-E163 WeakPolarHBondContact CB-O 3.3Å; T159-E163 WeakPolarHBondContact CG2-O 3.15Å; T160-E163 PolarHBondContact O-N 3.26Å; T160-E163 PolarHBondContact OG1-OE2 3.01Å
164	Y	78.5	Confident	71.2	Confident	83 Å²	83	74.8 Å²	74.8	33%	0.325	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-83.3	131.7	174.3	-169.4	-91.9	0	0	0	111	P166 R167 D200 L201 G202 R232	Y164-P166 WeakPolarHBondContact O-CD 3.3Å; Y164-R167 PolarHBondContact OH-NE 3.37Å; Y164-R167 PolarHBondContact OH-NH2 3.11Å; Y164-D200 WeakPolarHBondContact CE1-O 3.41Å; Y164-D200 PolarHBondContact OH-OD1 2.84Å; Y164-D200 PolarHBondContact OH-OD2 3.1Å; Y164-L201 WeakPolarHBondContact CD1-O 3.17Å; Y164-G202 VanDerWaalsContact CD1-CA 3.5Å; Y164-G202 VanDerWaalsContact CG-CA 3.46Å; Y164-R232 PolarHBondContact OH-NH2 2.99Å; Y164-R232 VanDerWaalsContact OH-NH2 3.07Å
165	Q	84.7	Confident	71.5	Confident	81 Å²	81	74.9 Å²	74.9	38%	0.379	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-81.6	119.9	172.8	-171.2	-166	1.5	0	0	110.3	R157	R157-Q165 VanDerWaalsContact NH1-CG 3.34Å
166	P	91.8	Very high	72.7	Confident	41 Å²	41	74.6 Å²	74.6	27%	0.266	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-57.6	139	173.7	-26	36.9	0	0	0	112.2	Y164 L186 D200 L201	Y164-P166 WeakPolarHBondContact O-CD 3.3Å; P166-L186 HydrophobicContact CB-CD2 4.05Å; P166-D200 WeakPolarHBondContact CA-O 3.4Å; P166-L201 HydrophobicContact CB-CD2 3.76Å; P166-L201 HydrophobicContact CG-CD2 4.12Å
167	R	94.6	Very high	73.8	Confident	52 Å²	52	81.1 Å²	81.1	20%	0.196	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.9	175.1	62.9	-173.9	170	-162.5	-4.1	111.8	Y164 L169 E183 D200	Y164-R167 PolarHBondContact OH-NE 3.37Å; Y164-R167 PolarHBondContact OH-NH2 3.11Å; R167-L169 HydrophobicContact CG-CD2 4.23Å; R167-E183 HydrophobicContact CB-CG 4.01Å; R167-D200 HydrophobicContact CG-CB 3.85Å; R167-D200 IonicContact CZ-OD2 2.71Å; R167-D200 PolarHBondContact N-O 3.33Å; R167-D200 IonicContact NE-OD2 2.73Å; R167-D200 PolarHBondContact NE-OD2 2.59Å; R167-D200 IonicContact NH2-OD2 3.14Å; R167-D200 PolarHBondContact NH2-OD2 3.38Å; R167-D200 VanDerWaalsContact NH2-OD2 3.1Å; R167-D200 PolarHBondContact O-N 3.13Å
168	L	96.6	Very high	75.6	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.1	174	-173.8	63.6	0	0	0	108.9	E183 V184 L186 L191 F197 L199 L256	L168-E183 WeakPolarHBondContact O-CA 3.27Å; L168-V184 HydrophobicContact CB-CG2 4.05Å; L168-V184 HydrophobicContact CD2-CG2 3.84Å; L168-V184 HydrophobicContact CG-CG2 3.76Å; L168-V184 PolarHBondContact O-N 3.38Å; L168-L186 HydrophobicContact CB-CD1 4.04Å; L168-L191 HydrophobicContact CD1-CD2 4.43Å; L168-L191 HydrophobicContact CD2-CD2 4.14Å; L168-F197 HydrophobicContact CD1-CB 4.1Å; L168-F197 HydrophobicContact CD2-CD1 4.41Å; L168-F197 HydrophobicContact CG-CD1 4.36Å; L168-L199 HydrophobicContact CD1-CB 4.23Å; L168-L256 HydrophobicContact CD1-CD2 4.35Å; L168-L256 HydrophobicContact CD2-CD2 4.08Å
169	L	96.2	Very high	78.2	Confident	6 Å²	6	68.5 Å²	68.5	3%	0.031	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.3	179.9	-52.3	177.3	0	0	0	109.2	L148 R167 V181 Q182 E183 F197 I198 F224	L148-L169 HydrophobicContact CD2-CD2 3.78Å; R167-L169 HydrophobicContact CG-CD2 4.23Å; L169-V181 HydrophobicContact CB-CG1 3.66Å; L169-V181 HydrophobicContact CD1-CG1 3.95Å; L169-V181 HydrophobicContact CD2-CG1 4.45Å; L169-V181 HydrophobicContact CG-CG1 4.23Å; L169-Q182 CarbonylContact C-O 3.53Å; L169-Q182 WeakPolarHBondContact CA-O 3.46Å; L169-E183 HydrophobicContact CD2-CB 3.92Å; L169-E183 HydrophobicContact CD2-CG 4.09Å; L169-F197 CarbonylContact O-C 3.53Å; L169-F197 VanDerWaalsContact O-CA 3.25Å; L169-F197 WeakPolarHBondContact O-CA 3.45Å; L169-I198 HydrophobicContact CB-CB 4.18Å; L169-I198 HydrophobicContact CD1-CG2 4.45Å; L169-I198 PolarHBondContact N-O 2.85Å; L169-I198 PolarHBondContact O-N 2.91Å; L169-F224 HydrophobicContact CD1-CE1 4.33Å
170	H	95.7	Very high	80.7	Confident	33 Å²	33	65.8 Å²	65.8	15%	0.153	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121	171.2	-176.2	-171.1	0	0	0	108.8	V181 Q182 V184 D195 F197	H170-V181 WeakPolarHBondContact O-CA 3.37Å; H170-Q182 PolarHBondContact N-O 3.47Å; H170-Q182 PolarHBondContact O-N 3.08Å; H170-V184 HydrophobicContact CB-CG1 3.68Å; H170-V184 HydrophobicContact CB-CG2 4.3Å; H170-D195 IonicContact CD2-OD2 2.78Å; H170-D195 IonicContact CE1-OD2 3.1Å; H170-D195 PolarHBondContact CE1-OD2 2.92Å; H170-D195 WeakPolarHBondContact NE2-CB 3.33Å; H170-D195 VanDerWaalsContact NE2-CG 3.29Å; H170-D195 IonicContact NE2-OD2 2.58Å; H170-D195 PolarHBondContact NE2-OD2 3.44Å; H170-F197 HydrophobicContact CB-CD1 4.04Å; H170-F197 HydrophobicContact CB-CE1 3.75Å; H170-F197 AromaticContact CD2-CE1 3.62Å; H170-F197 AromaticContact CD2-CZ 3.59Å; H170-F197 AromaticContact CG-CE1 3.65Å; H170-F197 AromaticContact NE2-CZ 3.83Å
171	F	95.2	Very high	83.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	115.3	178.8	-170.9	-83.5	0	0	0	110.4	F179 V181 V196 I198 K217 N220 A221 F224	F171-F179 HydrophobicContact CD2-CD2 4.41Å; F171-F179 HydrophobicContact CE1-CB 4.02Å; F171-F179 HydrophobicContact CE2-CB 4Å; F171-F179 HydrophobicContact CE2-CD1 4.46Å; F171-F179 AromaticContact CE2-CD2 3.49Å; F171-F179 HydrophobicContact CE2-CD2 3.49Å; F171-F179 VanDerWaalsContact CE2-CD2 3.49Å; F171-F179 HydrophobicContact CE2-CE2 4.07Å; F171-F179 AromaticContact CE2-CG 3.72Å; F171-F179 HydrophobicContact CE2-CG 3.72Å; F171-F179 HydrophobicContact CZ-CB 3.47Å; F171-F179 VanDerWaalsContact CZ-CB 3.47Å; F171-F179 HydrophobicContact CZ-CD1 4.11Å; F171-F179 AromaticContact CZ-CD2 3.82Å; F171-F179 HydrophobicContact CZ-CD2 3.82Å; F171-F179 AromaticContact CZ-CG 3.52Å; F171-F179 HydrophobicContact CZ-CG 3.52Å; F171-V181 HydrophobicContact CD2-CG2 3.7Å; F171-V181 HydrophobicContact CE2-CG2 4.05Å; F171-V196 HydrophobicContact CB-CB 4.28Å; F171-V196 WeakPolarHBondContact CB-O 3.45Å; F171-V196 PolarHBondContact N-O 2.73Å; F171-I198 HydrophobicContact CD2-CD1 4.47Å; F171-K217 HydrophobicContact CD1-CG 3.95Å; F171-K217 HydrophobicContact CE1-CG 4.27Å; F171-N220 HydrophobicContact CE1-CB 4.14Å; F171-N220 HydrophobicContact CZ-CB 3.92Å; F171-A221 HydrophobicContact CB-CB 4.39Å; F171-A221 HydrophobicContact CD1-CB 3.81Å; F171-A221 HydrophobicContact CD2-CB 3.99Å; F171-A221 HydrophobicContact CE1-CB 4.05Å; F171-A221 HydrophobicContact CE2-CB 4.22Å; F171-A221 HydrophobicContact CG-CB 3.79Å; F171-A221 HydrophobicContact CZ-CB 4.25Å; F171-F224 HydrophobicContact CD2-CB 4.35Å; F171-F224 HydrophobicContact CD2-CD1 4.32Å; F171-F224 HydrophobicContact CD2-CG 4.35Å; F171-F224 HydrophobicContact CE2-CB 3.71Å; F171-F224 HydrophobicContact CE2-CD1 4.44Å; F171-F224 HydrophobicContact CE2-CG 4.03Å
172	L	90.9	Very high	85.1	Confident	45 Å²	45	56.4 Å²	56.4	24%	0.236	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.8	-178.5	-68.4	166.3	0	0	0	108.9	F179 Q180	L172-F179 WeakPolarHBondContact O-CA 3.37Å; L172-Q180 HydrophobicContact CB-CB 4.05Å; L172-Q180 HydrophobicContact CD1-CG 4.22Å; L172-Q180 PolarHBondContact N-O 3.05Å; L172-Q180 PolarHBondContact O-N 3.29Å
173	Q	83.9	Confident	86.9	Confident	37 Å²	37	49.9 Å²	49.9	17%	0.173	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.3	173.8	-173.9	66.7	50.6	0	0	109.6	G176 R178 K217 N220	Q173-G176 PolarHBondContact NE2-O 3.26Å; Q173-R178 PolarHBondContact NE2-O 3.37Å; Q173-K217 HydrophobicContact CB-CB 4.19Å; Q173-K217 HydrophobicContact CB-CG 4.07Å; Q173-N220 PolarHBondContact NE2-ND2 3.08Å; Q173-N220 PolarHBondContact OE1-ND2 3.09Å
174	E	75.7	Confident	88.3	Confident	35 Å²	35	44.3 Å²	44.3	16%	0.164	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-96.6	142.1	161.4	-59.1	-152.6	150.7	0	0	107.6	K139 G176 R178	K139-E174 WeakPolarHBondContact CD-OE1 3.43Å; K139-E174 VanDerWaalsContact CE-OE1 3.3Å; K139-E174 WeakPolarHBondContact CE-OE1 3.36Å; K139-E174 IonicContact NZ-OE1 3.56Å; K139-E174 PolarHBondContact NZ-OE1 2.88Å; E174-G176 PolarHBondContact O-N 2.98Å; E174-R178 CarbonylContact C-O 3.57Å; E174-R178 HydrophobicContact CB-CB 4.24Å; E174-R178 PolarHBondContact N-O 3.25Å
175	G	74.8	Confident	89.1	Confident	65 Å²	65	43.3 Å²	43.3	67%	0.67	22%	0.223	S	C	*	.	S	Bend	trans	-46.3	141.5	-165.7	0	0	0	0	0	115.3
176	G	76.7	Confident	89.6	Confident	40 Å²	40	41.4 Å²	41.4	41%	0.412	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	-126.8	-176.3	0	0	0	0	0	112.8	Q173 E174 N220	Q173-G176 PolarHBondContact NE2-O 3.26Å; E174-G176 PolarHBondContact O-N 2.98Å; G176-N220 PolarHBondContact O-ND2 2.89Å
177	R	76.3	Confident	89.8	Confident	223 Å²	223	39.5 Å²	39.5	84%	0.842	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-7.1	-175.8	-69.4	-174	-179.6	177.3	0.6	115	F179	R177-F179 WeakPolarHBondContact O-CD1 3.42Å
178	R	83.4	Confident	89.8	Confident	98 Å²	98	40.3 Å²	40.3	37%	0.37	21%	0.21	S	C	.	.			trans	-80.4	140.9	-179	-69.2	-174.8	-64.5	157.1	-0.5	110	Q173 E174	Q173-R178 PolarHBondContact NE2-O 3.37Å; E174-R178 CarbonylContact C-O 3.57Å; E174-R178 HydrophobicContact CB-CB 4.24Å; E174-R178 PolarHBondContact N-O 3.25Å
179	F	89.5	Confident	89.8	Confident	25 Å²	25	43.2 Å²	43.2	11%	0.11	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	155	177.3	58.7	-94.4	0	0	0	110.7	C144 F145 F171 L172 R177 V181 F224	C144-F179 HydrophobicContact CB-CE2 3.98Å; C144-F179 HydrophobicContact CB-CZ 3.9Å; C144-F179 WeakPolarHBondContact SG-CE2 3.46Å; F145-F179 PolarHBondContact N-O 2.74Å; F145-F179 VanDerWaalsContact N-O 3.1Å; F171-F179 HydrophobicContact CD2-CD2 4.41Å; F171-F179 HydrophobicContact CE1-CB 4.02Å; F171-F179 HydrophobicContact CE2-CB 4Å; F171-F179 HydrophobicContact CE2-CD1 4.46Å; F171-F179 AromaticContact CE2-CD2 3.49Å; F171-F179 HydrophobicContact CE2-CD2 3.49Å; F171-F179 VanDerWaalsContact CE2-CD2 3.49Å; F171-F179 HydrophobicContact CE2-CE2 4.07Å; F171-F179 AromaticContact CE2-CG 3.72Å; F171-F179 HydrophobicContact CE2-CG 3.72Å; F171-F179 HydrophobicContact CZ-CB 3.47Å; F171-F179 VanDerWaalsContact CZ-CB 3.47Å; F171-F179 HydrophobicContact CZ-CD1 4.11Å; F171-F179 AromaticContact CZ-CD2 3.82Å; F171-F179 HydrophobicContact CZ-CD2 3.82Å; F171-F179 AromaticContact CZ-CG 3.52Å; F171-F179 HydrophobicContact CZ-CG 3.52Å; L172-F179 WeakPolarHBondContact O-CA 3.37Å; R177-F179 WeakPolarHBondContact O-CD1 3.42Å; F179-V181 HydrophobicContact CD2-CG2 3.8Å; F179-V181 HydrophobicContact CE2-CG2 4.02Å; F179-F224 HydrophobicContact CD2-CD2 4.35Å; F179-F224 HydrophobicContact CE2-CB 4.26Å; F179-F224 AromaticContact CE2-CD2 3.36Å; F179-F224 HydrophobicContact CE2-CD2 3.36Å; F179-F224 AromaticContact CE2-CE2 3.99Å; F179-F224 HydrophobicContact CE2-CE2 3.99Å; F179-F224 HydrophobicContact CE2-CG 4.1Å; F179-F224 HydrophobicContact CZ-CB 4.29Å; F179-F224 AromaticContact CZ-CD2 3.79Å; F179-F224 HydrophobicContact CZ-CD2 3.79Å; F179-F224 HydrophobicContact CZ-CG 4.48Å
180	Q	92.7	Very high	89.7	Confident	15 Å²	15	43.5 Å²	43.5	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.1	173.1	171.7	177.9	21.7	0	0	109.2	F145 L172	F145-Q180 HydrophobicContact CD1-CB 4.37Å; F145-Q180 HydrophobicContact CD1-CG 3.88Å; F145-Q180 CarbonylContact O-C 3.58Å; F145-Q180 WeakPolarHBondContact O-CA 3.27Å; L172-Q180 HydrophobicContact CB-CB 4.05Å; L172-Q180 HydrophobicContact CD1-CG 4.22Å; L172-Q180 PolarHBondContact N-O 3.05Å; L172-Q180 PolarHBondContact O-N 3.29Å
181	V	94.4	Very high	89.7	Confident	2 Å²	2	43 Å²	43	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.7	173	-175.3	0	0	0	0	108.7	F145 R146 I147 L169 H170 F171 F179 F224	F145-V181 PolarHBondContact O-N 3.44Å; R146-V181 CarbonylContact C-O 3.51Å; R146-V181 VanDerWaalsContact CA-O 3.22Å; R146-V181 WeakPolarHBondContact CA-O 3.41Å; R146-V181 HydrophobicContact CG-CB 4.38Å; I147-V181 PolarHBondContact N-O 2.88Å; L169-V181 HydrophobicContact CB-CG1 3.66Å; L169-V181 HydrophobicContact CD1-CG1 3.95Å; L169-V181 HydrophobicContact CD2-CG1 4.45Å; L169-V181 HydrophobicContact CG-CG1 4.23Å; H170-V181 WeakPolarHBondContact O-CA 3.37Å; F171-V181 HydrophobicContact CD2-CG2 3.7Å; F171-V181 HydrophobicContact CE2-CG2 4.05Å; F179-V181 HydrophobicContact CD2-CG2 3.8Å; F179-V181 HydrophobicContact CE2-CG2 4.02Å; V181-F224 HydrophobicContact CB-CE2 4.32Å; V181-F224 HydrophobicContact CB-CZ 4.05Å; V181-F224 HydrophobicContact CG1-CE1 4.03Å; V181-F224 HydrophobicContact CG1-CZ 3.8Å; V181-F224 HydrophobicContact CG2-CD1 4.33Å; V181-F224 HydrophobicContact CG2-CD2 4.03Å; V181-F224 HydrophobicContact CG2-CE1 4.03Å; V181-F224 HydrophobicContact CG2-CE2 3.64Å; V181-F224 HydrophobicContact CG2-CG 4.32Å; V181-F224 HydrophobicContact CG2-CZ 3.66Å
182	Q	94.2	Very high	89.7	Confident	13 Å²	13	45.8 Å²	45.8	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.6	-177.8	-179.5	166.4	29.4	0	0	111	E131 I147 L169 H170 V184	E131-Q182 PolarHBondContact OE1-NE2 3.26Å; I147-Q182 HydrophobicContact CB-CG 4.28Å; I147-Q182 CarbonylContact O-C 3.53Å; I147-Q182 WeakPolarHBondContact O-CA 3.44Å; L169-Q182 CarbonylContact C-O 3.53Å; L169-Q182 WeakPolarHBondContact CA-O 3.46Å; H170-Q182 PolarHBondContact N-O 3.47Å; H170-Q182 PolarHBondContact O-N 3.08Å; Q182-V184 PolarHBondContact O-N 3.33Å
183	E	95	Very high	89.9	Confident	17 Å²	17	45.4 Å²	45.4	8%	0.079	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	121.6	169.1	-163.7	179.3	144.1	0	0	110.4	I147 L148 N149 R167 L168 L169	I147-E183 PolarHBondContact O-N 3.5Å; L148-E183 HydrophobicContact CD2-CB 4.23Å; N149-E183 HydrophobicContact CB-CG 4.42Å; N149-E183 VanDerWaalsContact CB-OE1 3.29Å; N149-E183 WeakPolarHBondContact CB-OE1 3.4Å; N149-E183 PolarHBondContact N-OE2 3.4Å; N149-E183 VanDerWaalsContact ND2-CG 3.35Å; N149-E183 WeakPolarHBondContact ND2-CG 3.31Å; N149-E183 PolarHBondContact ND2-OE1 2.69Å; R167-E183 HydrophobicContact CB-CG 4.01Å; L168-E183 WeakPolarHBondContact O-CA 3.27Å; L169-E183 HydrophobicContact CD2-CB 3.92Å; L169-E183 HydrophobicContact CD2-CG 4.09Å
184	V	94.2	Very high	90.4	Very high	20 Å²	20	46.8 Å²	46.8	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	171.7	178.2	-65.3	0	0	0	0	110	L168 H170 Q182 L186 F197	L168-V184 HydrophobicContact CB-CG2 4.05Å; L168-V184 HydrophobicContact CD2-CG2 3.84Å; L168-V184 HydrophobicContact CG-CG2 3.76Å; L168-V184 PolarHBondContact O-N 3.38Å; H170-V184 HydrophobicContact CB-CG1 3.68Å; H170-V184 HydrophobicContact CB-CG2 4.3Å; Q182-V184 PolarHBondContact O-N 3.33Å; V184-L186 PolarHBondContact O-N 3.39Å; V184-F197 HydrophobicContact CG2-CD1 4.44Å; V184-F197 HydrophobicContact CG2-CE1 4.41Å
185	D	94.1	Very high	91.3	Very high	62 Å²	62	46.1 Å²	46.1	33%	0.332	25%	0.251	S	S	.	.			trans	-57.1	129.9	176.3	-78.2	-50.1	0	0	0	110.8	S187 S190 V261	D185-S187 VanDerWaalsContact C-N 3.26Å; D185-S187 PolarHBondContact O-N 2.82Å; D185-S190 WeakPolarHBondContact O-CB 3.43Å; D185-S190 PolarHBondContact O-OG 3.21Å; D185-V261 HydrophobicContact CB-CG1 4.07Å; D185-V261 HydrophobicContact CB-CG2 3.9Å
186	L	95.2	Very high	92.4	Very high	41 Å²	41	43 Å²	43	22%	0.215	22%	0.219	C	C	.	.	S	Bend	trans	-67.8	86.3	171.7	-172.1	76.7	0	0	0	109	P166 L168 V184 L199 L256 P257 K259	P166-L186 HydrophobicContact CB-CD2 4.05Å; L168-L186 HydrophobicContact CB-CD1 4.04Å; V184-L186 PolarHBondContact O-N 3.39Å; L186-L199 HydrophobicContact CD1-CD1 3.54Å; L186-L256 HydrophobicContact CD1-CD2 3.76Å; L186-L256 HydrophobicContact CG-CD2 4.23Å; L186-P257 WeakPolarHBondContact O-CD 3.38Å; L186-P257 VanDerWaalsContact O-CG 3.29Å; L186-P257 WeakPolarHBondContact O-CG 3.05Å; L186-K259 WeakPolarHBondContact O-CE 3.43Å
187	S	96.3	Very high	93.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-156.2	149	-174.5	179.1	0	0	0	0	110.6	D185 N189 S190 P257 K259 V261	D185-S187 VanDerWaalsContact C-N 3.26Å; D185-S187 PolarHBondContact O-N 2.82Å; S187-N189 PolarHBondContact O-N 3.08Å; S187-N189 PolarHBondContact OG-N 2.95Å; S187-N189 VanDerWaalsContact OG-N 3.14Å; S187-S190 WeakPolarHBondContact O-CB 3.48Å; S187-S190 PolarHBondContact O-N 2.88Å; S187-P257 VanDerWaalsContact CA-O 3.26Å; S187-P257 WeakPolarHBondContact CA-O 3.37Å; S187-P257 PolarHBondContact OG-O 2.8Å; S187-P257 VanDerWaalsContact OG-O 3.1Å; S187-K259 WeakPolarHBondContact OG-CG 3.35Å; S187-K259 PolarHBondContact OG-N 2.88Å; S187-K259 PolarHBondContact OG-O 2.89Å; S187-V261 VanDerWaalsContact CB-CG2 3.48Å
188	I	95.4	Very high	94.4	Very high	69 Å²	69	30.6 Å²	30.6	35%	0.354	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-63.5	-30.9	171.6	-163.1	169.3	0	0	0	111.6	S190 L191 L253 L256 P257 D258	I188-S190 PolarHBondContact O-N 2.88Å; I188-L191 HydrophobicContact CG1-CD1 4.44Å; I188-L191 WeakPolarHBondContact O-CB 3.42Å; I188-L191 PolarHBondContact O-N 2.83Å; I188-L191 VanDerWaalsContact O-N 3.13Å; I188-L253 HydrophobicContact CD1-CD2 4.42Å; I188-L256 HydrophobicContact CB-CB 4.26Å; I188-P257 PolarHBondContact N-O 3.2Å; I188-P257 VanDerWaalsContact N-O 3.16Å; I188-D258 HydrophobicContact CG2-CB 4.09Å
189	N	95.4	Very high	95.1	Very high	61 Å²	61	25.9 Å²	25.9	33%	0.326	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-72.7	-10.1	-179.9	-64.7	-49.8	0	0	0	113.5	S187 D258 K259 V261 R263	S187-N189 PolarHBondContact O-N 3.08Å; S187-N189 PolarHBondContact OG-N 2.95Å; S187-N189 VanDerWaalsContact OG-N 3.14Å; N189-D258 PolarHBondContact ND2-OD1 2.92Å; N189-K259 PolarHBondContact ND2-O 2.85Å; N189-V261 HydrophobicContact CB-CB 4.4Å; N189-V261 HydrophobicContact CB-CG2 3.9Å; N189-R263 PolarHBondContact O-NH2 3.46Å
190	S	95.7	Very high	95.3	Very high	12 Å²	12	24.7 Å²	24.7	8%	0.084	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-78	-23.1	171.7	-64.4	0	0	0	0	112.5	D185 S187 I188 F197 V261	D185-S190 WeakPolarHBondContact O-CB 3.43Å; D185-S190 PolarHBondContact O-OG 3.21Å; S187-S190 WeakPolarHBondContact O-CB 3.48Å; S187-S190 PolarHBondContact O-N 2.88Å; I188-S190 PolarHBondContact O-N 2.88Å; S190-F197 WeakPolarHBondContact O-CE1 3.39Å; S190-F197 WeakPolarHBondContact O-CZ 3.15Å; S190-V261 WeakPolarHBondContact OG-CG2 3.48Å
191	L	95.5	Very high	95.3	Very high	24 Å²	24	24.9 Å²	24.9	13%	0.126	14%	0.138	C	C	.	.			trans	-69.1	144.8	-179.5	-58.5	-178.6	0	0	0	111	L168 I188 F197 W208 F252 L253 L256	L168-L191 HydrophobicContact CD1-CD2 4.43Å; L168-L191 HydrophobicContact CD2-CD2 4.14Å; I188-L191 HydrophobicContact CG1-CD1 4.44Å; I188-L191 WeakPolarHBondContact O-CB 3.42Å; I188-L191 PolarHBondContact O-N 2.83Å; I188-L191 VanDerWaalsContact O-N 3.13Å; L191-F197 HydrophobicContact CD2-CB 3.76Å; L191-F197 HydrophobicContact CD2-CD1 4.01Å; L191-F197 HydrophobicContact CD2-CD2 3.9Å; L191-F197 HydrophobicContact CD2-CG 3.6Å; L191-W208 HydrophobicContact CB-CH2 4.17Å; L191-W208 HydrophobicContact CB-CZ3 4.19Å; L191-W208 HydrophobicContact CD1-CD2 4.34Å; L191-W208 HydrophobicContact CD1-CZ2 4.23Å; L191-W208 HydrophobicContact CD2-CD2 4.49Å; L191-W208 HydrophobicContact CD2-CE3 4.18Å; L191-W208 HydrophobicContact CD2-CZ3 4.48Å; L191-F252 HydrophobicContact CD1-CE1 3.93Å; L191-F252 HydrophobicContact CD1-CZ 4.17Å; L191-F252 HydrophobicContact CD2-CZ 4.14Å; L191-L253 HydrophobicContact CD1-CD2 4.49Å; L191-L256 HydrophobicContact CD1-CD1 3.79Å; L191-L256 HydrophobicContact CD2-CD1 4.29Å; L191-L256 HydrophobicContact CG-CD1 4.19Å
192	D	94.2	Very high	95.1	Very high	57 Å²	57	25.3 Å²	25.3	31%	0.305	14%	0.143	S	C	.	.			trans	-136	127.2	176.7	-173.6	-72.4	0	0	0	109.7	T194 D195 F197	D192-T194 PolarHBondContact O-N 2.91Å; D192-T194 WeakPolarHBondContact OD1-CA 3.49Å; D192-T194 VanDerWaalsContact OD1-CB 3.23Å; D192-T194 WeakPolarHBondContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CG2 3.43Å; D192-T194 PolarHBondContact OD1-N 3.46Å; D192-T194 PolarHBondContact OD1-OG1 3.11Å; D192-D195 PolarHBondContact O-N 3.18Å; D192-D195 VanDerWaalsContact O-N 3.13Å; D192-F197 HydrophobicContact CB-CE2 4.05Å; D192-F197 HydrophobicContact CB-CZ 4.05Å
193	S	96	Very high	94.8	Very high	38 Å²	38	28.9 Å²	28.9	27%	0.266	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.1	-176.4	-49.7	0	0	0	0	113.9	G210 S211 K212 S213 E243	S193-G210 CarbonylContact O-C 3.05Å; S193-G210 WeakPolarHBondContact O-CA 3.3Å; S193-S211 PolarHBondContact O-N 2.76Å; S193-K212 CarbonylContact O-C 3.53Å; S193-K212 VanDerWaalsContact O-CA 3.3Å; S193-K212 WeakPolarHBondContact O-CA 3.48Å; S193-K212 VanDerWaalsContact O-CB 3.31Å; S193-K212 WeakPolarHBondContact O-CB 3.46Å; S193-K212 PolarHBondContact O-N 3.02Å; S193-S213 PolarHBondContact O-N 3.39Å; S193-E243 WeakPolarHBondContact CA-OE2 3.32Å; S193-E243 WeakPolarHBondContact CB-OE2 3.49Å; S193-E243 PolarHBondContact OG-OE1 3.12Å; S193-E243 PolarHBondContact OG-OE2 3Å
194	T	94.4	Very high	94.8	Very high	66 Å²	66	30.9 Å²	30.9	41%	0.405	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-8.8	179.8	72.4	0	0	0	0	114.1	D192 K212 S213	D192-T194 PolarHBondContact O-N 2.91Å; D192-T194 WeakPolarHBondContact OD1-CA 3.49Å; D192-T194 VanDerWaalsContact OD1-CB 3.23Å; D192-T194 WeakPolarHBondContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CG2 3.43Å; D192-T194 PolarHBondContact OD1-N 3.46Å; D192-T194 PolarHBondContact OD1-OG1 3.11Å; T194-K212 HydrophobicContact CG2-CB 4.13Å; T194-K212 HydrophobicContact CG2-CD 4.23Å; T194-S213 VanDerWaalsContact O-CA 3.27Å; T194-S213 WeakPolarHBondContact O-CA 3.36Å; T194-S213 WeakPolarHBondContact O-CB 3.45Å
195	D	94.8	Very high	94.8	Very high	21 Å²	21	30 Å²	30	11%	0.112	17%	0.172	C	C	.	.	S	Bend	trans	-124.4	178.1	-171.4	-78.2	-32.8	0	0	0	113.2	H170 D192 F197 G210 K217	H170-D195 IonicContact CD2-OD2 2.78Å; H170-D195 IonicContact CE1-OD2 3.1Å; H170-D195 PolarHBondContact CE1-OD2 2.92Å; H170-D195 WeakPolarHBondContact NE2-CB 3.33Å; H170-D195 VanDerWaalsContact NE2-CG 3.29Å; H170-D195 IonicContact NE2-OD2 2.58Å; H170-D195 PolarHBondContact NE2-OD2 3.44Å; D192-D195 PolarHBondContact O-N 3.18Å; D192-D195 VanDerWaalsContact O-N 3.13Å; D195-F197 HydrophobicContact CB-CE2 3.78Å; D195-F197 HydrophobicContact CB-CZ 4.31Å; D195-G210 WeakPolarHBondContact O-CA 3.46Å; D195-G210 PolarHBondContact O-N 3.05Å; D195-K217 IonicContact OD1-NZ 3.56Å; D195-K217 PolarHBondContact OD1-NZ 2.92Å
196	V	97.3	Very high	94.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	137	176.2	-179.7	0	0	0	0	108	F171 Q207 W208 K217 R218 A221	F171-V196 HydrophobicContact CB-CB 4.28Å; F171-V196 WeakPolarHBondContact CB-O 3.45Å; F171-V196 PolarHBondContact N-O 2.73Å; V196-Q207 HydrophobicContact CG1-CG 3.67Å; V196-W208 WeakPolarHBondContact CA-O 3.12Å; V196-K217 HydrophobicContact CB-CG 4.44Å; V196-K217 HydrophobicContact CG2-CD 4.12Å; V196-K217 HydrophobicContact CG2-CG 3.92Å; V196-R218 HydrophobicContact CG2-CG 3.93Å; V196-A221 HydrophobicContact CB-CB 4.18Å; V196-A221 HydrophobicContact CG1-CB 3.53Å
197	F	97.8	Very high	95.1	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148.5	180	-67.4	-97.5	0	0	0	110	L168 L169 H170 V184 S190 L191 D192 D195 W208	L168-F197 HydrophobicContact CD1-CB 4.1Å; L168-F197 HydrophobicContact CD2-CD1 4.41Å; L168-F197 HydrophobicContact CG-CD1 4.36Å; L169-F197 CarbonylContact O-C 3.53Å; L169-F197 VanDerWaalsContact O-CA 3.25Å; L169-F197 WeakPolarHBondContact O-CA 3.45Å; H170-F197 HydrophobicContact CB-CD1 4.04Å; H170-F197 HydrophobicContact CB-CE1 3.75Å; H170-F197 AromaticContact CD2-CE1 3.62Å; H170-F197 AromaticContact CD2-CZ 3.59Å; H170-F197 AromaticContact CG-CE1 3.65Å; H170-F197 AromaticContact NE2-CZ 3.83Å; V184-F197 HydrophobicContact CG2-CD1 4.44Å; V184-F197 HydrophobicContact CG2-CE1 4.41Å; S190-F197 WeakPolarHBondContact O-CE1 3.39Å; S190-F197 WeakPolarHBondContact O-CZ 3.15Å; L191-F197 HydrophobicContact CD2-CB 3.76Å; L191-F197 HydrophobicContact CD2-CD1 4.01Å; L191-F197 HydrophobicContact CD2-CD2 3.9Å; L191-F197 HydrophobicContact CD2-CG 3.6Å; D192-F197 HydrophobicContact CB-CE2 4.05Å; D192-F197 HydrophobicContact CB-CZ 4.05Å; D195-F197 HydrophobicContact CB-CE2 3.78Å; D195-F197 HydrophobicContact CB-CZ 4.31Å; F197-W208 HydrophobicContact CB-CE3 4.44Å; F197-W208 AromaticContact CD2-CE3 3.83Å; F197-W208 HydrophobicContact CD2-CE3 3.83Å; F197-W208 AromaticContact CD2-CZ3 3.92Å; F197-W208 HydrophobicContact CD2-CZ3 3.92Å; F197-W208 HydrophobicContact CE2-CZ3 4.35Å; F197-W208 PolarHBondContact N-O 2.73Å; F197-W208 PolarHBondContact O-N 3.4Å
198	I	97.4	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.7	178.6	-61.5	171	0	0	0	108.8	L169 F171 L205 Y206 F224 L225	L169-I198 HydrophobicContact CB-CB 4.18Å; L169-I198 HydrophobicContact CD1-CG2 4.45Å; L169-I198 PolarHBondContact N-O 2.85Å; L169-I198 PolarHBondContact O-N 2.91Å; F171-I198 HydrophobicContact CD2-CD1 4.47Å; I198-L205 HydrophobicContact CG2-CD2 4.1Å; I198-Y206 CarbonylContact C-O 3.58Å; I198-Y206 WeakPolarHBondContact CA-O 3.42Å; I198-F224 HydrophobicContact CD1-CD1 3.34Å; I198-F224 HydrophobicContact CD1-CE1 3.66Å; I198-L225 HydrophobicContact CB-CD1 4.46Å; I198-L225 HydrophobicContact CD1-CD1 4.07Å; I198-L225 HydrophobicContact CG1-CD1 4.08Å; I198-L225 HydrophobicContact CG2-CD1 3.6Å
199	L	97.1	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	119.9	169.2	172.2	70.9	0	0	0	108.4	L168 L186 L201 L205 Y206 F252 Y255 L256	L168-L199 HydrophobicContact CD1-CB 4.23Å; L186-L199 HydrophobicContact CD1-CD1 3.54Å; L199-L201 HydrophobicContact CD1-CD2 3.88Å; L199-L201 HydrophobicContact CD2-CD1 4.42Å; L199-L201 HydrophobicContact CD2-CD2 4.07Å; L199-L201 HydrophobicContact CD2-CG 4.34Å; L199-L201 HydrophobicContact CG-CD2 3.84Å; L199-L201 HydrophobicContact CG-CG 4.14Å; L199-L205 WeakPolarHBondContact O-CA 3.42Å; L199-Y206 HydrophobicContact CD2-CD2 4.01Å; L199-Y206 HydrophobicContact CG-CD2 4.46Å; L199-Y206 PolarHBondContact N-O 2.78Å; L199-Y206 PolarHBondContact O-N 3.46Å; L199-F252 HydrophobicContact CB-CD2 3.7Å; L199-F252 HydrophobicContact CB-CE2 3.55Å; L199-F252 HydrophobicContact CD2-CD2 3.67Å; L199-F252 HydrophobicContact CD2-CE2 4.23Å; L199-F252 HydrophobicContact CD2-CG 4.43Å; L199-F252 HydrophobicContact CG-CD2 4.35Å; L199-Y255 HydrophobicContact CD2-CD2 4.24Å; L199-Y255 HydrophobicContact CD2-CG 4.27Å; L199-L256 HydrophobicContact CD1-CD2 4.4Å
200	D	94.9	Very high	95.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	112.4	-176.8	179.2	7.3	0	0	0	110	Y164 P166 R167 G202 L205 R232	Y164-D200 WeakPolarHBondContact CE1-O 3.41Å; Y164-D200 PolarHBondContact OH-OD1 2.84Å; Y164-D200 PolarHBondContact OH-OD2 3.1Å; P166-D200 WeakPolarHBondContact CA-O 3.4Å; R167-D200 HydrophobicContact CG-CB 3.85Å; R167-D200 IonicContact CZ-OD2 2.71Å; R167-D200 PolarHBondContact N-O 3.33Å; R167-D200 IonicContact NE-OD2 2.73Å; R167-D200 PolarHBondContact NE-OD2 2.59Å; R167-D200 IonicContact NH2-OD2 3.14Å; R167-D200 PolarHBondContact NH2-OD2 3.38Å; R167-D200 VanDerWaalsContact NH2-OD2 3.1Å; R167-D200 PolarHBondContact O-N 3.13Å; D200-G202 PolarHBondContact OD1-N 3.33Å; D200-L205 HydrophobicContact CB-CD2 3.69Å; D200-L205 WeakPolarHBondContact OD1-CD2 3.45Å; D200-R232 IonicContact OD1-CZ 2.73Å; D200-R232 VanDerWaalsContact OD1-CZ 3.25Å; D200-R232 IonicContact OD1-NH1 3.52Å; D200-R232 PolarHBondContact OD1-NH1 2.9Å; D200-R232 IonicContact OD1-NH2 3.99Å; D200-R232 PolarHBondContact OD1-NH2 3.31Å; D200-R232 IonicContact OD2-CZ 3.36Å; D200-R232 IonicContact OD2-NH1 2.82Å; D200-R232 IonicContact OD2-NH2 2.98Å; D200-R232 PolarHBondContact OD2-NH2 2.77Å
201	L	92.2	Very high	95.4	Very high	18 Å²	18	21.9 Å²	21.9	9%	0.094	13%	0.131	C	C	.	.			trans	-107	10.8	179.9	-52.5	-179.7	0	0	0	111.9	Y164 P166 L199 S203 K204 Y206 Y255	Y164-L201 WeakPolarHBondContact CD1-O 3.17Å; P166-L201 HydrophobicContact CB-CD2 3.76Å; P166-L201 HydrophobicContact CG-CD2 4.12Å; L199-L201 HydrophobicContact CD1-CD2 3.88Å; L199-L201 HydrophobicContact CD2-CD1 4.42Å; L199-L201 HydrophobicContact CD2-CD2 4.07Å; L199-L201 HydrophobicContact CD2-CG 4.34Å; L199-L201 HydrophobicContact CG-CD2 3.84Å; L199-L201 HydrophobicContact CG-CG 4.14Å; L201-S203 VanDerWaalsContact C-N 3.25Å; L201-S203 PolarHBondContact O-N 3.41Å; L201-K204 WeakPolarHBondContact CA-O 3.13Å; L201-K204 HydrophobicContact CB-CB 4.41Å; L201-K204 WeakPolarHBondContact CB-O 3.42Å; L201-K204 HydrophobicContact CD1-CB 4.41Å; L201-K204 PolarHBondContact N-O 3.21Å; L201-Y206 HydrophobicContact CD1-CD2 4.26Å; L201-Y206 HydrophobicContact CD1-CE2 3.87Å; L201-Y255 HydrophobicContact CD1-CD2 3.85Å; L201-Y255 HydrophobicContact CD1-CE1 4.41Å; L201-Y255 HydrophobicContact CD1-CE2 3.53Å; L201-Y255 HydrophobicContact CD1-CG 4.43Å; L201-Y255 HydrophobicContact CD2-CD1 3.89Å; L201-Y255 HydrophobicContact CD2-CD2 4.22Å; L201-Y255 HydrophobicContact CD2-CE1 4.07Å; L201-Y255 HydrophobicContact CD2-CE2 4.4Å; L201-Y255 HydrophobicContact CD2-CG 3.97Å
202	G	89.6	Confident	95.4	Very high	12 Å²	12	28.4 Å²	28.4	12%	0.124	16%	0.158	C	C	.	.	S	Bend	trans	80	-66.9	-177.3	0	0	0	0	0	112.1	Y164 D200 R232 C236	Y164-G202 VanDerWaalsContact CD1-CA 3.5Å; Y164-G202 VanDerWaalsContact CG-CA 3.46Å; D200-G202 PolarHBondContact OD1-N 3.33Å; G202-R232 WeakPolarHBondContact O-CD 3.3Å; G202-R232 PolarHBondContact O-NH1 3.42Å; G202-C236 PolarHBondContact O-SG 2.88Å
203	S	89.2	Confident	95.4	Very high	88 Å²	88	26 Å²	26	62%	0.615	15%	0.146	S	C	*	.	S	Bend	trans	-81.7	-18.4	177.8	68.3	0	0	0	0	113.7	L201 C236 K237	L201-S203 VanDerWaalsContact C-N 3.25Å; L201-S203 PolarHBondContact O-N 3.41Å; S203-C236 WeakPolarHBondContact O-CA 3.14Å; S203-C236 PolarHBondContact O-SG 2.76Å; S203-K237 PolarHBondContact O-N 2.52Å
204	K	93.4	Very high	95.2	Very high	58 Å²	58	28 Å²	28	25%	0.252	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.5	179.6	-161.2	170.8	-173.3	-179.5	0	110.5	L201 Y206 K237 E251	L201-K204 WeakPolarHBondContact CA-O 3.13Å; L201-K204 HydrophobicContact CB-CB 4.41Å; L201-K204 WeakPolarHBondContact CB-O 3.42Å; L201-K204 HydrophobicContact CD1-CB 4.41Å; L201-K204 PolarHBondContact N-O 3.21Å; K204-Y206 HydrophobicContact CD-CE2 3.7Å; K204-Y206 WeakPolarHBondContact CE-OH 3.29Å; K204-Y206 HydrophobicContact CG-CD2 4.42Å; K204-Y206 HydrophobicContact CG-CE2 3.93Å; K204-Y206 PolarHBondContact NZ-OH 3.26Å; K204-K237 CarbonylContact C-O 3.58Å; K204-K237 VanDerWaalsContact CA-O 3.27Å; K204-K237 WeakPolarHBondContact CA-O 3.4Å; K204-K237 HydrophobicContact CG-CB 4.27Å; K204-E251 IonicContact NZ-OE2 3.68Å; K204-E251 PolarHBondContact NZ-OE2 3.02Å
205	L	95.3	Very high	95.1	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.6	176.6	-74.2	163.2	0	0	0	108.6	I198 L199 D200 L225 V228 C236 K237 T238 A239	I198-L205 HydrophobicContact CG2-CD2 4.1Å; L199-L205 WeakPolarHBondContact O-CA 3.42Å; D200-L205 HydrophobicContact CB-CD2 3.69Å; D200-L205 WeakPolarHBondContact OD1-CD2 3.45Å; L205-L225 HydrophobicContact CB-CD1 3.79Å; L205-L225 HydrophobicContact CB-CG 4.09Å; L205-L225 HydrophobicContact CD1-CG 4.42Å; L205-V228 HydrophobicContact CD1-CB 4.06Å; L205-V228 HydrophobicContact CD1-CG1 3.88Å; L205-V228 HydrophobicContact CD2-CG1 4.19Å; L205-C236 HydrophobicContact CD1-CB 4.33Å; L205-C236 VanDerWaalsContact CD1-SG 3.56Å; L205-C236 WeakPolarHBondContact CG-SG 3.07Å; L205-K237 PolarHBondContact N-O 2.9Å; L205-T238 HydrophobicContact CB-CG2 4.3Å; L205-T238 HydrophobicContact CD1-CG2 4.46Å; L205-T238 CarbonylContact O-C 3.59Å; L205-T238 WeakPolarHBondContact O-CA 3.19Å; L205-A239 PolarHBondContact O-N 2.84Å
206	Y	97	Very high	95	Very high	12 Å²	12	37.9 Å²	37.9	5%	0.047	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.6	173.7	-71	-82.9	0	0	0	109.7	I198 L199 L201 K204 A239 L241 E251 F252	I198-Y206 CarbonylContact C-O 3.58Å; I198-Y206 WeakPolarHBondContact CA-O 3.42Å; L199-Y206 HydrophobicContact CD2-CD2 4.01Å; L199-Y206 HydrophobicContact CG-CD2 4.46Å; L199-Y206 PolarHBondContact N-O 2.78Å; L199-Y206 PolarHBondContact O-N 3.46Å; L201-Y206 HydrophobicContact CD1-CD2 4.26Å; L201-Y206 HydrophobicContact CD1-CE2 3.87Å; K204-Y206 HydrophobicContact CD-CE2 3.7Å; K204-Y206 WeakPolarHBondContact CE-OH 3.29Å; K204-Y206 HydrophobicContact CG-CD2 4.42Å; K204-Y206 HydrophobicContact CG-CE2 3.93Å; K204-Y206 PolarHBondContact NZ-OH 3.26Å; Y206-A239 CarbonylContact C-O 3.59Å; Y206-A239 WeakPolarHBondContact CA-O 3.48Å; Y206-A239 HydrophobicContact CD1-CB 3.67Å; Y206-A239 HydrophobicContact CE1-CB 3.76Å; Y206-L241 HydrophobicContact CD1-CD1 3.84Å; Y206-L241 HydrophobicContact CD1-CG 4.36Å; Y206-L241 HydrophobicContact CE1-CD1 4.33Å; Y206-E251 WeakPolarHBondContact OH-CB 3.49Å; Y206-E251 PolarHBondContact OH-OE2 2.85Å; Y206-F252 HydrophobicContact CD1-CB 4.25Å; Y206-F252 HydrophobicContact CE1-CB 4.46Å; Y206-F252 HydrophobicContact CG-CB 4.3Å; Y206-F252 HydrophobicContact CG-CD2 4.09Å
207	Q	97.5	Very high	94.8	Very high	4 Å²	4	39 Å²	39	2%	0.019	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	122.2	162.7	176.7	177.4	-30.2	0	0	108.5	V196 N209 R218 A222 L225 A239 V240 L241	V196-Q207 HydrophobicContact CG1-CG 3.67Å; Q207-N209 PolarHBondContact NE2-OD1 3.04Å; Q207-R218 PolarHBondContact NE2-O 2.83Å; Q207-A222 VanDerWaalsContact OE1-N 3.11Å; Q207-L225 HydrophobicContact CB-CD1 4.18Å; Q207-L225 HydrophobicContact CB-CD2 4.33Å; Q207-A239 PolarHBondContact N-O 3.37Å; Q207-V240 HydrophobicContact CB-CG2 4.33Å; Q207-V240 HydrophobicContact CG-CG1 4.5Å; Q207-V240 CarbonylContact O-C 3.56Å; Q207-V240 WeakPolarHBondContact O-CA 3.4Å; Q207-L241 PolarHBondContact O-N 3.49Å
208	W	98	Very high	94.6	Very high	11 Å²	11	42 Å²	42	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.9	172.3	-177.9	91.6	0	0	0	109.5	L191 V196 F197 L241 E243 F252	L191-W208 HydrophobicContact CB-CH2 4.17Å; L191-W208 HydrophobicContact CB-CZ3 4.19Å; L191-W208 HydrophobicContact CD1-CD2 4.34Å; L191-W208 HydrophobicContact CD1-CZ2 4.23Å; L191-W208 HydrophobicContact CD2-CD2 4.49Å; L191-W208 HydrophobicContact CD2-CE3 4.18Å; L191-W208 HydrophobicContact CD2-CZ3 4.48Å; V196-W208 WeakPolarHBondContact CA-O 3.12Å; F197-W208 HydrophobicContact CB-CE3 4.44Å; F197-W208 AromaticContact CD2-CE3 3.83Å; F197-W208 HydrophobicContact CD2-CE3 3.83Å; F197-W208 AromaticContact CD2-CZ3 3.92Å; F197-W208 HydrophobicContact CD2-CZ3 3.92Å; F197-W208 HydrophobicContact CE2-CZ3 4.35Å; F197-W208 PolarHBondContact N-O 2.73Å; F197-W208 PolarHBondContact O-N 3.4Å; W208-L241 CarbonylContact C-O 3.54Å; W208-L241 WeakPolarHBondContact CA-O 3.27Å; W208-E243 HydrophobicContact CH2-CB 4.05Å; W208-E243 HydrophobicContact CH2-CG 4.1Å; W208-E243 HydrophobicContact CZ2-CB 3.46Å; W208-E243 VanDerWaalsContact CZ2-CB 3.46Å; W208-E243 HydrophobicContact CZ2-CG 3.54Å; W208-F252 HydrophobicContact CB-CE1 3.88Å; W208-F252 HydrophobicContact CB-CE2 3.78Å; W208-F252 HydrophobicContact CB-CZ 3.38Å; W208-F252 AromaticContact CD1-CD1 3.89Å; W208-F252 AromaticContact CD1-CE1 3.35Å; W208-F252 AromaticContact CD1-CZ 3.83Å; W208-F252 HydrophobicContact CD2-CE1 4.42Å; W208-F252 HydrophobicContact CD2-CZ 4.44Å; W208-F252 HydrophobicContact CG-CD1 4.47Å; W208-F252 AromaticContact CG-CE1 3.62Å; W208-F252 HydrophobicContact CG-CE1 3.62Å; W208-F252 HydrophobicContact CG-CE2 4.43Å; W208-F252 AromaticContact CG-CZ 3.6Å; W208-F252 HydrophobicContact CG-CZ 3.6Å; W208-F252 AromaticContact NE1-CE1 3.98Å
209	N	97.8	Very high	94.5	Very high	8 Å²	8	49 Å²	49	4%	0.043	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.1	179.6	-60.7	-35.9	0	0	0	110.1	Q207 R218 L241 D242 E243	Q207-N209 PolarHBondContact NE2-OD1 3.04Å; N209-R218 HydrophobicContact CB-CG 4.16Å; N209-L241 PolarHBondContact N-O 3.09Å; N209-D242 VanDerWaalsContact CB-OD1 3.23Å; N209-D242 WeakPolarHBondContact CB-OD1 3.24Å; N209-D242 PolarHBondContact ND2-OD1 3.22Å; N209-E243 PolarHBondContact O-N 2.68Å
210	G	97.1	Very high	94.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.24	C	C	.	.			trans	-60	142.1	168.3	0	0	0	0	0	110.9	S193 D195 K212 S213 R218	S193-G210 CarbonylContact O-C 3.05Å; S193-G210 WeakPolarHBondContact O-CA 3.3Å; D195-G210 WeakPolarHBondContact O-CA 3.46Å; D195-G210 PolarHBondContact O-N 3.05Å; G210-K212 PolarHBondContact O-N 3.22Å; G210-K212 VanDerWaalsContact O-N 3.14Å; G210-S213 VanDerWaalsContact O-CB 3.31Å; G210-S213 WeakPolarHBondContact O-CB 3.5Å; G210-S213 PolarHBondContact O-N 3Å; G210-S213 PolarHBondContact O-OG 3.05Å; G210-R218 PolarHBondContact O-NH2 3.3Å; G210-R218 VanDerWaalsContact O-NH2 3.17Å
211	S	96.5	Very high	94.3	Very high	41 Å²	41	49.9 Å²	49.9	29%	0.287	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.1	-177.3	54.9	0	0	0	0	113.3	S193 R218 E243	S193-S211 PolarHBondContact O-N 2.76Å; S211-R218 PolarHBondContact O-NH2 2.94Å; S211-E243 WeakPolarHBondContact CA-OE2 3.08Å; S211-E243 WeakPolarHBondContact CB-OE2 2.98Å; S211-E243 PolarHBondContact N-OE2 3.25Å; S211-E243 PolarHBondContact OG-OE2 2.93Å
212	K	95.6	Very high	94.4	Very high	160 Å²	160	50.4 Å²	50.4	70%	0.696	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	1.8	179	-55.6	175.7	-176.5	173	0	113.5	S193 T194 G210	S193-K212 CarbonylContact O-C 3.53Å; S193-K212 VanDerWaalsContact O-CA 3.3Å; S193-K212 WeakPolarHBondContact O-CA 3.48Å; S193-K212 VanDerWaalsContact O-CB 3.31Å; S193-K212 WeakPolarHBondContact O-CB 3.46Å; S193-K212 PolarHBondContact O-N 3.02Å; T194-K212 HydrophobicContact CG2-CB 4.13Å; T194-K212 HydrophobicContact CG2-CD 4.23Å; G210-K212 PolarHBondContact O-N 3.22Å; G210-K212 VanDerWaalsContact O-N 3.14Å
213	S	94.5	Very high	94.5	Very high	7 Å²	7	54.1 Å²	54.1	5%	0.049	26%	0.261	C	S	.	.			trans	-68.7	142.8	175.9	67.9	0	0	0	0	111.5	S193 T194 G210 R218	S193-S213 PolarHBondContact O-N 3.39Å; T194-S213 VanDerWaalsContact O-CA 3.27Å; T194-S213 WeakPolarHBondContact O-CA 3.36Å; T194-S213 WeakPolarHBondContact O-CB 3.45Å; G210-S213 VanDerWaalsContact O-CB 3.31Å; G210-S213 WeakPolarHBondContact O-CB 3.5Å; G210-S213 PolarHBondContact O-N 3Å; G210-S213 PolarHBondContact O-OG 3.05Å; S213-R218 PolarHBondContact O-NE 2.73Å; S213-R218 VanDerWaalsContact O-NE 3.16Å; S213-R218 PolarHBondContact O-NH2 3.34Å; S213-R218 PolarHBondContact OG-NE 3.48Å; S213-R218 PolarHBondContact OG-NH2 2.78Å
214	N	92.1	Very high	94.7	Very high	79 Å²	79	50 Å²	50	42%	0.422	23%	0.232	S	C	.	.			trans	-79.4	157.2	-177.5	74.4	48.1	0	0	0	112.4	E216 K217 R218	N214-E216 PolarHBondContact O-N 3.39Å; N214-E216 PolarHBondContact OD1-N 3.46Å; N214-K217 PolarHBondContact O-N 3.16Å; N214-K217 WeakPolarHBondContact OD1-CB 3.4Å; N214-K217 PolarHBondContact OD1-N 2.99Å; N214-R218 WeakPolarHBondContact O-CG 3.41Å; N214-R218 PolarHBondContact O-N 3.22Å
215	K	93.1	Very high	94.7	Very high	188 Å²	188	47.5 Å²	47.5	82%	0.817	22%	0.221	S	C	*	.	H	α-helix	trans	-62.3	-38.3	-175.1	-66	-177.4	-179	179.4	0	113.3	R218 Y219	K215-R218 PolarHBondContact O-N 3.4Å; K215-Y219 WeakPolarHBondContact O-CB 3.38Å; K215-Y219 PolarHBondContact O-N 2.98Å
216	E	91.7	Very high	94.5	Very high	107 Å²	107	52 Å²	52	50%	0.5	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-45.6	-179.2	-176.5	175.2	-163.8	0	0	111.5	N214 R218 Y219 N220	N214-E216 PolarHBondContact O-N 3.39Å; N214-E216 PolarHBondContact OD1-N 3.46Å; E216-R218 PolarHBondContact O-N 3.35Å; E216-Y219 WeakPolarHBondContact O-CB 3.47Å; E216-Y219 PolarHBondContact O-N 3.26Å; E216-N220 PolarHBondContact O-N 3.17Å
217	K	92.5	Very high	94.1	Very high	25 Å²	25	55.3 Å²	55.3	11%	0.109	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-44.9	174.9	-175.3	-178.9	-62.1	177.2	0	111.3	F171 Q173 D195 V196 N214 Y219 N220 A221	F171-K217 HydrophobicContact CD1-CG 3.95Å; F171-K217 HydrophobicContact CE1-CG 4.27Å; Q173-K217 HydrophobicContact CB-CB 4.19Å; Q173-K217 HydrophobicContact CB-CG 4.07Å; D195-K217 IonicContact OD1-NZ 3.56Å; D195-K217 PolarHBondContact OD1-NZ 2.92Å; V196-K217 HydrophobicContact CB-CG 4.44Å; V196-K217 HydrophobicContact CG2-CD 4.12Å; V196-K217 HydrophobicContact CG2-CG 3.92Å; N214-K217 PolarHBondContact O-N 3.16Å; N214-K217 WeakPolarHBondContact OD1-CB 3.4Å; N214-K217 PolarHBondContact OD1-N 2.99Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.32Å; K217-N220 PolarHBondContact O-N 2.87Å; K217-A221 VanDerWaalsContact O-CB 3.23Å; K217-A221 WeakPolarHBondContact O-CB 3.35Å; K217-A221 PolarHBondContact O-N 3.06Å
218	R	95.1	Very high	93.7	Very high	64 Å²	64	55.5 Å²	55.5	24%	0.242	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-40.8	176	-64	-179.9	-161	-161	7.7	112.1	V196 Q207 N209 G210 S211 S213 N214 K215 E216 A222 D242	V196-R218 HydrophobicContact CG2-CG 3.93Å; Q207-R218 PolarHBondContact NE2-O 2.83Å; N209-R218 HydrophobicContact CB-CG 4.16Å; G210-R218 PolarHBondContact O-NH2 3.3Å; G210-R218 VanDerWaalsContact O-NH2 3.17Å; S211-R218 PolarHBondContact O-NH2 2.94Å; S213-R218 PolarHBondContact O-NE 2.73Å; S213-R218 VanDerWaalsContact O-NE 3.16Å; S213-R218 PolarHBondContact O-NH2 3.34Å; S213-R218 PolarHBondContact OG-NE 3.48Å; S213-R218 PolarHBondContact OG-NH2 2.78Å; N214-R218 WeakPolarHBondContact O-CG 3.41Å; N214-R218 PolarHBondContact O-N 3.22Å; K215-R218 PolarHBondContact O-N 3.4Å; E216-R218 PolarHBondContact O-N 3.35Å; R218-A222 PolarHBondContact O-N 3.47Å; R218-A222 VanDerWaalsContact O-N 3.12Å; R218-D242 IonicContact NH1-OD1 2.75Å; R218-D242 PolarHBondContact NH1-OD1 3.12Å; R218-D242 VanDerWaalsContact NH1-OD1 3.1Å
219	Y	94.1	Very high	93.4	Very high	145 Å²	145	55.7 Å²	55.7	57%	0.569	27%	0.265	S	S	*	.	H	α-helix	trans	-66.6	-48.9	177.8	174.1	-96.8	0	0	0	112	K215 E216 K217 A221 A222 Q223	K215-Y219 WeakPolarHBondContact O-CB 3.38Å; K215-Y219 PolarHBondContact O-N 2.98Å; E216-Y219 WeakPolarHBondContact O-CB 3.47Å; E216-Y219 PolarHBondContact O-N 3.26Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.32Å; Y219-A221 VanDerWaalsContact C-N 3.33Å; Y219-A221 PolarHBondContact O-N 3.16Å; Y219-A222 WeakPolarHBondContact O-CB 3.39Å; Y219-A222 PolarHBondContact O-N 2.85Å; Y219-A222 VanDerWaalsContact O-N 3.11Å; Y219-Q223 HydrophobicContact CD1-CG 4.38Å; Y219-Q223 HydrophobicContact CE1-CG 3.92Å; Y219-Q223 PolarHBondContact O-N 3.09Å
220	N	92.9	Very high	92.9	Very high	19 Å²	19	59.4 Å²	59.4	10%	0.102	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-36.2	179.6	-71.3	-24	0	0	0	111.9	F171 Q173 G176 E216 K217 A222 Q223 F224	F171-N220 HydrophobicContact CE1-CB 4.14Å; F171-N220 HydrophobicContact CZ-CB 3.92Å; Q173-N220 PolarHBondContact NE2-ND2 3.08Å; Q173-N220 PolarHBondContact OE1-ND2 3.09Å; G176-N220 PolarHBondContact O-ND2 2.89Å; E216-N220 PolarHBondContact O-N 3.17Å; K217-N220 PolarHBondContact O-N 2.87Å; N220-A222 VanDerWaalsContact C-N 3.3Å; N220-A222 PolarHBondContact O-N 3.41Å; N220-Q223 PolarHBondContact O-N 2.88Å; N220-F224 PolarHBondContact O-N 3.47Å
221	A	94.7	Very high	92.4	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-38.6	171.3	0	0	0	0	0	112.2	F171 V196 K217 Y219 F224 L225	F171-A221 HydrophobicContact CB-CB 4.39Å; F171-A221 HydrophobicContact CD1-CB 3.81Å; F171-A221 HydrophobicContact CD2-CB 3.99Å; F171-A221 HydrophobicContact CE1-CB 4.05Å; F171-A221 HydrophobicContact CE2-CB 4.22Å; F171-A221 HydrophobicContact CG-CB 3.79Å; F171-A221 HydrophobicContact CZ-CB 4.25Å; V196-A221 HydrophobicContact CB-CB 4.18Å; V196-A221 HydrophobicContact CG1-CB 3.53Å; K217-A221 VanDerWaalsContact O-CB 3.23Å; K217-A221 WeakPolarHBondContact O-CB 3.35Å; K217-A221 PolarHBondContact O-N 3.06Å; Y219-A221 VanDerWaalsContact C-N 3.33Å; Y219-A221 PolarHBondContact O-N 3.16Å; A221-F224 WeakPolarHBondContact O-CB 3.49Å; A221-F224 PolarHBondContact O-N 2.95Å; A221-L225 WeakPolarHBondContact O-CB 3.22Å; A221-L225 PolarHBondContact O-N 3.13Å
222	A	94.9	Very high	92	Very high	29 Å²	29	64.6 Å²	64.6	24%	0.24	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-38.7	175.4	0	0	0	0	0	111.9	Q207 R218 Y219 N220 F224 L225 L226	Q207-A222 VanDerWaalsContact OE1-N 3.11Å; R218-A222 PolarHBondContact O-N 3.47Å; R218-A222 VanDerWaalsContact O-N 3.12Å; Y219-A222 WeakPolarHBondContact O-CB 3.39Å; Y219-A222 PolarHBondContact O-N 2.85Å; Y219-A222 VanDerWaalsContact O-N 3.11Å; N220-A222 VanDerWaalsContact C-N 3.3Å; N220-A222 PolarHBondContact O-N 3.41Å; A222-F224 VanDerWaalsContact C-N 3.33Å; A222-L225 WeakPolarHBondContact O-CB 3.45Å; A222-L225 PolarHBondContact O-N 3.37Å; A222-L226 WeakPolarHBondContact O-CG 3.19Å; A222-L226 PolarHBondContact O-N 3.18Å
223	Q	92.3	Very high	91.5	Very high	90 Å²	90	63.1 Å²	63.1	42%	0.421	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-43	173.2	-63.5	-53.5	-56.9	0	0	111.5	Y219 N220 L226 Q227	Y219-Q223 HydrophobicContact CD1-CG 4.38Å; Y219-Q223 HydrophobicContact CE1-CG 3.92Å; Y219-Q223 PolarHBondContact O-N 3.09Å; N220-Q223 PolarHBondContact O-N 2.88Å; Q223-L226 PolarHBondContact O-N 2.89Å; Q223-Q227 PolarHBondContact O-N 3.47Å
224	F	92	Very high	90.8	Very high	3 Å²	3	65.3 Å²	65.3	1%	0.013	33%	0.333	C	S	.	.	H	α-helix	trans	-62.1	-42.6	174.2	173.1	-95.3	0	0	0	112.4	R146 L169 F171 F179 V181 I198 N220 A221 A222 L226 Q227 V228	R146-F224 VanDerWaalsContact CZ-CE2 3.47Å; R146-F224 VanDerWaalsContact NE-CE2 3.32Å; L169-F224 HydrophobicContact CD1-CE1 4.33Å; F171-F224 HydrophobicContact CD2-CB 4.35Å; F171-F224 HydrophobicContact CD2-CD1 4.32Å; F171-F224 HydrophobicContact CD2-CG 4.35Å; F171-F224 HydrophobicContact CE2-CB 3.71Å; F171-F224 HydrophobicContact CE2-CD1 4.44Å; F171-F224 HydrophobicContact CE2-CG 4.03Å; F179-F224 HydrophobicContact CD2-CD2 4.35Å; F179-F224 HydrophobicContact CE2-CB 4.26Å; F179-F224 AromaticContact CE2-CD2 3.36Å; F179-F224 HydrophobicContact CE2-CD2 3.36Å; F179-F224 AromaticContact CE2-CE2 3.99Å; F179-F224 HydrophobicContact CE2-CE2 3.99Å; F179-F224 HydrophobicContact CE2-CG 4.1Å; F179-F224 HydrophobicContact CZ-CB 4.29Å; F179-F224 AromaticContact CZ-CD2 3.79Å; F179-F224 HydrophobicContact CZ-CD2 3.79Å; F179-F224 HydrophobicContact CZ-CG 4.48Å; V181-F224 HydrophobicContact CB-CE2 4.32Å; V181-F224 HydrophobicContact CB-CZ 4.05Å; V181-F224 HydrophobicContact CG1-CE1 4.03Å; V181-F224 HydrophobicContact CG1-CZ 3.8Å; V181-F224 HydrophobicContact CG2-CD1 4.33Å; V181-F224 HydrophobicContact CG2-CD2 4.03Å; V181-F224 HydrophobicContact CG2-CE1 4.03Å; V181-F224 HydrophobicContact CG2-CE2 3.64Å; V181-F224 HydrophobicContact CG2-CG 4.32Å; V181-F224 HydrophobicContact CG2-CZ 3.66Å; I198-F224 HydrophobicContact CD1-CD1 3.34Å; I198-F224 HydrophobicContact CD1-CE1 3.66Å; N220-F224 PolarHBondContact O-N 3.47Å; A221-F224 WeakPolarHBondContact O-CB 3.49Å; A221-F224 PolarHBondContact O-N 2.95Å; A222-F224 VanDerWaalsContact C-N 3.33Å; F224-L226 VanDerWaalsContact C-N 3.28Å; F224-L226 PolarHBondContact O-N 3.1Å; F224-Q227 WeakPolarHBondContact O-CB 3.3Å; F224-Q227 PolarHBondContact O-N 3.47Å; F224-Q227 VanDerWaalsContact O-N 3.09Å; F224-V228 HydrophobicContact CD1-CG2 4.23Å; F224-V228 HydrophobicContact CE1-CG2 3.71Å; F224-V228 HydrophobicContact CE2-CG2 4.08Å; F224-V228 HydrophobicContact CZ-CG2 3.62Å; F224-V228 WeakPolarHBondContact O-CG2 3.44Å; F224-V228 PolarHBondContact O-N 3.29Å
225	L	93.1	Very high	90.4	Very high	5 Å²	5	71.5 Å²	71.5	3%	0.026	35%	0.35	C	S	.	.	H	α-helix	trans	-57.5	-42.2	176.3	-158.6	89.2	0	0	0	111.7	I198 L205 Q207 A221 A222 V228 S229 T238	I198-L225 HydrophobicContact CB-CD1 4.46Å; I198-L225 HydrophobicContact CD1-CD1 4.07Å; I198-L225 HydrophobicContact CG1-CD1 4.08Å; I198-L225 HydrophobicContact CG2-CD1 3.6Å; L205-L225 HydrophobicContact CB-CD1 3.79Å; L205-L225 HydrophobicContact CB-CG 4.09Å; L205-L225 HydrophobicContact CD1-CG 4.42Å; Q207-L225 HydrophobicContact CB-CD1 4.18Å; Q207-L225 HydrophobicContact CB-CD2 4.33Å; A221-L225 WeakPolarHBondContact O-CB 3.22Å; A221-L225 PolarHBondContact O-N 3.13Å; A222-L225 WeakPolarHBondContact O-CB 3.45Å; A222-L225 PolarHBondContact O-N 3.37Å; L225-V228 PolarHBondContact O-N 3.03Å; L225-S229 PolarHBondContact O-N 2.85Å; L225-T238 HydrophobicContact CD2-CG2 3.57Å; L225-T238 HydrophobicContact CG-CG2 3.99Å
226	L	91.5	Very high	90.1	Very high	95 Å²	95	62.9 Å²	62.9	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-66.4	-39.1	175.5	-67.5	174	0	0	0	111.9	A222 Q223 F224 S229 S230	A222-L226 WeakPolarHBondContact O-CG 3.19Å; A222-L226 PolarHBondContact O-N 3.18Å; Q223-L226 PolarHBondContact O-N 2.89Å; F224-L226 VanDerWaalsContact C-N 3.28Å; F224-L226 PolarHBondContact O-N 3.1Å; L226-S229 PolarHBondContact O-N 2.69Å; L226-S230 WeakPolarHBondContact O-CB 3.18Å; L226-S230 PolarHBondContact O-N 2.79Å
227	Q	89.4	Confident	90.1	Very high	82 Å²	82	65.3 Å²	65.3	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-49.5	174.3	-173.9	-174.4	-16.7	0	0	111.1	R146 Q223 F224 S229 S230 E231	R146-Q227 VanDerWaalsContact NH2-CD 3.3Å; Q223-Q227 PolarHBondContact O-N 3.47Å; F224-Q227 WeakPolarHBondContact O-CB 3.3Å; F224-Q227 PolarHBondContact O-N 3.47Å; F224-Q227 VanDerWaalsContact O-N 3.09Å; Q227-S229 VanDerWaalsContact C-N 3.3Å; Q227-S229 PolarHBondContact O-N 2.88Å; Q227-S230 WeakPolarHBondContact O-CA 3.34Å; Q227-S230 WeakPolarHBondContact O-CB 3.37Å; Q227-S230 PolarHBondContact O-N 3.1Å; Q227-S230 VanDerWaalsContact O-N 3.09Å; Q227-E231 WeakPolarHBondContact CG-OE1 3.46Å; Q227-E231 PolarHBondContact NE2-OE1 3.24Å; Q227-E231 WeakPolarHBondContact O-CG 3.35Å; Q227-E231 PolarHBondContact O-N 2.8Å
228	V	89.4	Confident	90.2	Very high	8 Å²	8	67.2 Å²	67.2	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-36.8	178.2	180	0	0	0	0	111.5	L205 F224 L225 E231 R232	L205-V228 HydrophobicContact CD1-CB 4.06Å; L205-V228 HydrophobicContact CD1-CG1 3.88Å; L205-V228 HydrophobicContact CD2-CG1 4.19Å; F224-V228 HydrophobicContact CD1-CG2 4.23Å; F224-V228 HydrophobicContact CE1-CG2 3.71Å; F224-V228 HydrophobicContact CE2-CG2 4.08Å; F224-V228 HydrophobicContact CZ-CG2 3.62Å; F224-V228 WeakPolarHBondContact O-CG2 3.44Å; F224-V228 PolarHBondContact O-N 3.29Å; L225-V228 PolarHBondContact O-N 3.03Å; V228-E231 PolarHBondContact O-N 2.87Å; V228-R232 WeakPolarHBondContact O-CG 3.47Å; V228-R232 PolarHBondContact O-N 3.38Å
229	S	90.5	Very high	90.2	Very high	14 Å²	14	65.6 Å²	65.6	10%	0.098	34%	0.336	C	S	.	.	H	α-helix	trans	-65.1	-40	173.6	-172.5	0	0	0	0	112	L225 L226 Q227 R232 N233 G234 C236	L225-S229 PolarHBondContact O-N 2.85Å; L226-S229 PolarHBondContact O-N 2.69Å; Q227-S229 VanDerWaalsContact C-N 3.3Å; Q227-S229 PolarHBondContact O-N 2.88Å; S229-R232 CarbonylContact O-C 3.51Å; S229-R232 VanDerWaalsContact O-C 3.31Å; S229-R232 WeakPolarHBondContact O-CA 3.1Å; S229-R232 PolarHBondContact O-N 2.74Å; S229-N233 PolarHBondContact O-N 3.44Å; S229-G234 WeakPolarHBondContact O-CA 3.11Å; S229-G234 PolarHBondContact O-N 2.7Å; S229-C236 PolarHBondContact OG-O 2.91Å
230	S	89	Confident	90.3	Very high	87 Å²	87	62.7 Å²	62.7	61%	0.608	33%	0.333	S	S	*	.	H	α-helix	trans	-64.5	-42	175.6	-171.1	0	0	0	0	112.4	L226 Q227 R232 N233	L226-S230 WeakPolarHBondContact O-CB 3.18Å; L226-S230 PolarHBondContact O-N 2.79Å; Q227-S230 WeakPolarHBondContact O-CA 3.34Å; Q227-S230 WeakPolarHBondContact O-CB 3.37Å; Q227-S230 PolarHBondContact O-N 3.1Å; Q227-S230 VanDerWaalsContact O-N 3.09Å; S230-R232 PolarHBondContact O-N 2.84Å; S230-R232 VanDerWaalsContact O-N 3.08Å; S230-N233 WeakPolarHBondContact O-CA 3.3Å; S230-N233 PolarHBondContact O-N 2.98Å
231	E	86.1	Confident	90.5	Very high	96 Å²	96	63.1 Å²	63.1	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-55.5	-25.9	171.5	-70.4	166.7	-161.2	0	0	111.6	R146 Q227 V228	R146-E231 IonicContact CZ-OE1 2.74Å; R146-E231 IonicContact NH1-OE1 2.94Å; R146-E231 PolarHBondContact NH1-OE1 3Å; R146-E231 VanDerWaalsContact NH1-OE1 3.09Å; R146-E231 IonicContact NH1-OE2 2.86Å; R146-E231 PolarHBondContact NH1-OE2 3.34Å; R146-E231 IonicContact NH2-OE1 2.93Å; R146-E231 PolarHBondContact NH2-OE1 3.15Å; Q227-E231 WeakPolarHBondContact CG-OE1 3.46Å; Q227-E231 PolarHBondContact NE2-OE1 3.24Å; Q227-E231 WeakPolarHBondContact O-CG 3.35Å; Q227-E231 PolarHBondContact O-N 2.8Å; V228-E231 PolarHBondContact O-N 2.87Å
232	R	87.1	Confident	90.6	Very high	53 Å²	53	65.6 Å²	65.6	20%	0.2	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	25.8	175.5	-61.6	177.4	-176.1	159.5	6.2	113.6	Y164 D200 G202 V228 S229 S230 G234 R235 C236	Y164-R232 PolarHBondContact OH-NH2 2.99Å; Y164-R232 VanDerWaalsContact OH-NH2 3.07Å; D200-R232 IonicContact OD1-CZ 2.73Å; D200-R232 VanDerWaalsContact OD1-CZ 3.25Å; D200-R232 IonicContact OD1-NH1 3.52Å; D200-R232 PolarHBondContact OD1-NH1 2.9Å; D200-R232 IonicContact OD1-NH2 3.99Å; D200-R232 PolarHBondContact OD1-NH2 3.31Å; D200-R232 IonicContact OD2-CZ 3.36Å; D200-R232 IonicContact OD2-NH1 2.82Å; D200-R232 IonicContact OD2-NH2 2.98Å; D200-R232 PolarHBondContact OD2-NH2 2.77Å; G202-R232 WeakPolarHBondContact O-CD 3.3Å; G202-R232 PolarHBondContact O-NH1 3.42Å; V228-R232 WeakPolarHBondContact O-CG 3.47Å; V228-R232 PolarHBondContact O-N 3.38Å; S229-R232 CarbonylContact O-C 3.51Å; S229-R232 VanDerWaalsContact O-C 3.31Å; S229-R232 WeakPolarHBondContact O-CA 3.1Å; S229-R232 PolarHBondContact O-N 2.74Å; S230-R232 PolarHBondContact O-N 2.84Å; S230-R232 VanDerWaalsContact O-N 3.08Å; R232-G234 PolarHBondContact O-N 3.11Å; R232-G234 VanDerWaalsContact O-N 3.16Å; R232-R235 PolarHBondContact O-N 3.02Å; R232-R235 VanDerWaalsContact O-N 3.14Å; R232-C236 HydrophobicContact CB-CB 4.47Å
233	N	85.1	Confident	90.6	Very high	130 Å²	130	66.8 Å²	66.8	70%	0.695	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	32.2	-179.9	-50.6	110.5	0	0	0	113.8	S229 S230 R235	S229-N233 PolarHBondContact O-N 3.44Å; S230-N233 WeakPolarHBondContact O-CA 3.3Å; S230-N233 PolarHBondContact O-N 2.98Å; N233-R235 PolarHBondContact O-N 3.48Å
234	G	81.4	Confident	90.7	Very high	53 Å²	53	68.7 Å²	68.7	55%	0.546	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	9.3	179.4	0	0	0	0	0	115	S229 R232 C236	S229-G234 WeakPolarHBondContact O-CA 3.11Å; S229-G234 PolarHBondContact O-N 2.7Å; R232-G234 PolarHBondContact O-N 3.11Å; R232-G234 VanDerWaalsContact O-N 3.16Å; G234-C236 PolarHBondContact O-N 2.65Å
235	R	82.8	Confident	90.7	Very high	208 Å²	208	76.3 Å²	76.3	79%	0.785	40%	0.395	S	S	*	.			trans	-79.8	-2.2	-178.7	-59.3	-177.2	-169.8	170.9	4.7	113.3	R232 N233	R232-R235 PolarHBondContact O-N 3.02Å; R232-R235 VanDerWaalsContact O-N 3.14Å; N233-R235 PolarHBondContact O-N 3.48Å
236	C	86.5	Confident	90.7	Very high	8 Å²	8	77.2 Å²	77.2	5%	0.054	40%	0.401	C	S	.	.	S	Bend	trans	-97.2	123.5	-176.9	-166.5	0	0	0	0	110.8	G202 S203 L205 S229 R232 G234	G202-C236 PolarHBondContact O-SG 2.88Å; S203-C236 WeakPolarHBondContact O-CA 3.14Å; S203-C236 PolarHBondContact O-SG 2.76Å; L205-C236 HydrophobicContact CD1-CB 4.33Å; L205-C236 VanDerWaalsContact CD1-SG 3.56Å; L205-C236 WeakPolarHBondContact CG-SG 3.07Å; S229-C236 PolarHBondContact OG-O 2.91Å; R232-C236 HydrophobicContact CB-CB 4.47Å; G234-C236 PolarHBondContact O-N 2.65Å
237	K	92.1	Very high	90.6	Very high	157 Å²	157	76.1 Å²	76.1	68%	0.683	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	132.7	175.1	-67.7	-177.6	-178.9	179.1	0	109.8	S203 K204 L205	S203-K237 PolarHBondContact O-N 2.52Å; K204-K237 CarbonylContact C-O 3.58Å; K204-K237 VanDerWaalsContact CA-O 3.27Å; K204-K237 WeakPolarHBondContact CA-O 3.4Å; K204-K237 HydrophobicContact CG-CB 4.27Å; L205-K237 PolarHBondContact N-O 2.9Å
238	T	94.4	Very high	90.4	Very high	66 Å²	66	77.5 Å²	77.5	41%	0.405	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	145.6	176.9	55.1	0	0	0	0	111	L205 L225	L205-T238 HydrophobicContact CB-CG2 4.3Å; L205-T238 HydrophobicContact CD1-CG2 4.46Å; L205-T238 CarbonylContact O-C 3.59Å; L205-T238 WeakPolarHBondContact O-CA 3.19Å; L225-T238 HydrophobicContact CD2-CG2 3.57Å; L225-T238 HydrophobicContact CG-CG2 3.99Å
239	A	95.1	Very high	90.2	Very high	29 Å²	29	81.1 Å²	81.1	24%	0.24	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144.5	171.5	0	0	0	0	0	110	L205 Y206 Q207	L205-A239 PolarHBondContact O-N 2.84Å; Y206-A239 CarbonylContact C-O 3.59Å; Y206-A239 WeakPolarHBondContact CA-O 3.48Å; Y206-A239 HydrophobicContact CD1-CB 3.67Å; Y206-A239 HydrophobicContact CE1-CB 3.76Å; Q207-A239 PolarHBondContact N-O 3.37Å
240	V	96.1	Very high	90.3	Very high	84 Å²	84	82.4 Å²	82.4	51%	0.509	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.9	177.4	-176.2	0	0	0	0	108.4	Q207	Q207-V240 HydrophobicContact CB-CG2 4.33Å; Q207-V240 HydrophobicContact CG-CG1 4.5Å; Q207-V240 CarbonylContact O-C 3.56Å; Q207-V240 WeakPolarHBondContact O-CA 3.4Å
241	L	96.8	Very high	90.5	Very high	29 Å²	29	81.6 Å²	81.6	15%	0.152	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.1	179.8	-59.4	172.6	0	0	0	108.4	Y206 Q207 W208 N209 F252	Y206-L241 HydrophobicContact CD1-CD1 3.84Å; Y206-L241 HydrophobicContact CD1-CG 4.36Å; Y206-L241 HydrophobicContact CE1-CD1 4.33Å; Q207-L241 PolarHBondContact O-N 3.49Å; W208-L241 CarbonylContact C-O 3.54Å; W208-L241 WeakPolarHBondContact CA-O 3.27Å; N209-L241 PolarHBondContact N-O 3.09Å; L241-F252 HydrophobicContact CD1-CB 3.33Å; L241-F252 HydrophobicContact CD1-CD1 4.09Å; L241-F252 HydrophobicContact CD1-CD2 4.27Å; L241-F252 HydrophobicContact CD1-CG 3.66Å
242	D	96.4	Very high	90.9	Very high	51 Å²	51	77 Å²	77	27%	0.273	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.2	169.7	-66.5	-73.8	0	0	0	109.2	N209 R218 L244 F245 T246	N209-D242 VanDerWaalsContact CB-OD1 3.23Å; N209-D242 WeakPolarHBondContact CB-OD1 3.24Å; N209-D242 PolarHBondContact ND2-OD1 3.22Å; R218-D242 IonicContact NH1-OD1 2.75Å; R218-D242 PolarHBondContact NH1-OD1 3.12Å; R218-D242 VanDerWaalsContact NH1-OD1 3.1Å; D242-L244 PolarHBondContact O-N 3.18Å; D242-L244 VanDerWaalsContact O-N 3.09Å; D242-F245 HydrophobicContact CB-CD2 3.99Å; D242-F245 PolarHBondContact O-N 3.3Å; D242-T246 PolarHBondContact O-N 3.03Å; D242-T246 PolarHBondContact O-OG1 3.19Å
243	E	96.3	Very high	91.2	Very high	55 Å²	55	76.3 Å²	76.3	26%	0.257	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-40.2	-177.6	178.7	174.4	-153.6	0	0	112.9	S193 W208 N209 S211 F245 T246	S193-E243 WeakPolarHBondContact CA-OE2 3.32Å; S193-E243 WeakPolarHBondContact CB-OE2 3.49Å; S193-E243 PolarHBondContact OG-OE1 3.12Å; S193-E243 PolarHBondContact OG-OE2 3Å; W208-E243 HydrophobicContact CH2-CB 4.05Å; W208-E243 HydrophobicContact CH2-CG 4.1Å; W208-E243 HydrophobicContact CZ2-CB 3.46Å; W208-E243 VanDerWaalsContact CZ2-CB 3.46Å; W208-E243 HydrophobicContact CZ2-CG 3.54Å; N209-E243 PolarHBondContact O-N 2.68Å; S211-E243 WeakPolarHBondContact CA-OE2 3.08Å; S211-E243 WeakPolarHBondContact CB-OE2 2.98Å; S211-E243 PolarHBondContact N-OE2 3.25Å; S211-E243 PolarHBondContact OG-OE2 2.93Å; E243-F245 PolarHBondContact O-N 3.5Å; E243-T246 PolarHBondContact O-N 2.76Å
244	L	93.1	Very high	91.6	Very high	130 Å²	130	76.7 Å²	76.7	68%	0.681	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.9	-177.3	-61.6	177.6	0	0	0	114.1	D242	D242-L244 PolarHBondContact O-N 3.18Å; D242-L244 VanDerWaalsContact O-N 3.09Å
245	F	93.6	Very high	92.2	Very high	162 Å²	162	78.6 Å²	78.6	71%	0.711	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-8.6	-178.3	-52.9	-60	0	0	0	112.7	D242 E243 N247	D242-F245 HydrophobicContact CB-CD2 3.99Å; D242-F245 PolarHBondContact O-N 3.3Å; E243-F245 PolarHBondContact O-N 3.5Å; F245-N247 PolarHBondContact O-N 3Å
246	T	91.3	Very high	92.8	Very high	25 Å²	25	69.1 Å²	69.1	15%	0.153	37%	0.365	C	S	.	.			trans	-74.3	125.9	175.9	-50.8	0	0	0	0	108.6	D242 E243 D250 F252 L253	D242-T246 PolarHBondContact O-N 3.03Å; D242-T246 PolarHBondContact O-OG1 3.19Å; E243-T246 PolarHBondContact O-N 2.76Å; T246-D250 VanDerWaalsContact CA-OD2 3.32Å; T246-D250 WeakPolarHBondContact CA-OD2 3.03Å; T246-D250 HydrophobicContact CG2-CB 4.15Å; T246-F252 HydrophobicContact CG2-CD1 4.47Å; T246-L253 HydrophobicContact CG2-CD1 3.9Å; T246-L253 HydrophobicContact CG2-CD2 4.42Å; T246-L253 HydrophobicContact CG2-CG 3.96Å
247	N	90.4	Very high	93.1	Very high	72 Å²	72	71.8 Å²	71.8	39%	0.385	38%	0.382	S	S	.	.			trans	-119	165.9	179.9	65.1	75.4	0	0	0	110.4	F245 S249 D250 L253	F245-N247 PolarHBondContact O-N 3Å; N247-S249 PolarHBondContact O-N 3.36Å; N247-S249 WeakPolarHBondContact OD1-CA 3.21Å; N247-S249 WeakPolarHBondContact OD1-CB 3.23Å; N247-S249 PolarHBondContact OD1-N 3.48Å; N247-S249 PolarHBondContact OD1-OG 3.18Å; N247-D250 PolarHBondContact N-OD2 3.22Å; N247-D250 PolarHBondContact ND2-OD2 3.2Å; N247-D250 WeakPolarHBondContact O-CB 3.3Å; N247-D250 PolarHBondContact O-N 2.93Å; N247-L253 WeakPolarHBondContact O-CD1 3.3Å
248	S	84.6	Confident	93.2	Very high	111 Å²	111	70.7 Å²	70.7	78%	0.776	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.4	-176	53.1	0	0	0	0	115
249	S	86.3	Confident	93.2	Very high	84 Å²	84	71.3 Å²	71.3	59%	0.587	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.5	176.6	76.3	0	0	0	0	113.6	N247 E251 Q254	N247-S249 PolarHBondContact O-N 3.36Å; N247-S249 WeakPolarHBondContact OD1-CA 3.21Å; N247-S249 WeakPolarHBondContact OD1-CB 3.23Å; N247-S249 PolarHBondContact OD1-N 3.48Å; N247-S249 PolarHBondContact OD1-OG 3.18Å; S249-E251 PolarHBondContact O-N 2.98Å; S249-Q254 PolarHBondContact O-NE2 3.23Å; S249-Q254 VanDerWaalsContact O-NE2 3.11Å
250	D	91.6	Very high	93	Very high	41 Å²	41	75.7 Å²	75.7	22%	0.219	41%	0.407	C	S	.	.	S	Bend	trans	-62.8	128.3	178.6	-73.4	-53.9	0	0	0	111.2	T246 N247 F252 L253	T246-D250 VanDerWaalsContact CA-OD2 3.32Å; T246-D250 WeakPolarHBondContact CA-OD2 3.03Å; T246-D250 HydrophobicContact CG2-CB 4.15Å; N247-D250 PolarHBondContact N-OD2 3.22Å; N247-D250 PolarHBondContact ND2-OD2 3.2Å; N247-D250 WeakPolarHBondContact O-CB 3.3Å; N247-D250 PolarHBondContact O-N 2.93Å; D250-F252 PolarHBondContact O-N 2.94Å; D250-L253 PolarHBondContact O-N 3.01Å
251	E	92.8	Very high	92.7	Very high	70 Å²	70	73.3 Å²	73.3	33%	0.327	39%	0.392	S	S	.	.	H	α-helix	trans	-51.7	-34.7	-179.9	176.3	-178.3	-157.2	0	0	111.6	K204 Y206 S249 L253 Q254 Y255	K204-E251 IonicContact NZ-OE2 3.68Å; K204-E251 PolarHBondContact NZ-OE2 3.02Å; Y206-E251 WeakPolarHBondContact OH-CB 3.49Å; Y206-E251 PolarHBondContact OH-OE2 2.85Å; S249-E251 PolarHBondContact O-N 2.98Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.31Å; E251-Q254 WeakPolarHBondContact O-CB 2.87Å; E251-Q254 PolarHBondContact O-N 3.44Å; E251-Q254 VanDerWaalsContact O-N 3.11Å; E251-Y255 HydrophobicContact CG-CD2 4.11Å; E251-Y255 HydrophobicContact CG-CE2 3.61Å; E251-Y255 VanDerWaalsContact O-CD2 3.29Å; E251-Y255 WeakPolarHBondContact O-CD2 3.29Å
252	F	94.3	Very high	91.9	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-51.2	-48.4	175.3	169.8	-98.2	0	0	0	113.1	L191 L199 Y206 W208 L241 T246 D250 Q254 Y255 L256	L191-F252 HydrophobicContact CD1-CE1 3.93Å; L191-F252 HydrophobicContact CD1-CZ 4.17Å; L191-F252 HydrophobicContact CD2-CZ 4.14Å; L199-F252 HydrophobicContact CB-CD2 3.7Å; L199-F252 HydrophobicContact CB-CE2 3.55Å; L199-F252 HydrophobicContact CD2-CD2 3.67Å; L199-F252 HydrophobicContact CD2-CE2 4.23Å; L199-F252 HydrophobicContact CD2-CG 4.43Å; L199-F252 HydrophobicContact CG-CD2 4.35Å; Y206-F252 HydrophobicContact CD1-CB 4.25Å; Y206-F252 HydrophobicContact CE1-CB 4.46Å; Y206-F252 HydrophobicContact CG-CB 4.3Å; Y206-F252 HydrophobicContact CG-CD2 4.09Å; W208-F252 HydrophobicContact CB-CE1 3.88Å; W208-F252 HydrophobicContact CB-CE2 3.78Å; W208-F252 HydrophobicContact CB-CZ 3.38Å; W208-F252 AromaticContact CD1-CD1 3.89Å; W208-F252 AromaticContact CD1-CE1 3.35Å; W208-F252 AromaticContact CD1-CZ 3.83Å; W208-F252 HydrophobicContact CD2-CE1 4.42Å; W208-F252 HydrophobicContact CD2-CZ 4.44Å; W208-F252 HydrophobicContact CG-CD1 4.47Å; W208-F252 AromaticContact CG-CE1 3.62Å; W208-F252 HydrophobicContact CG-CE1 3.62Å; W208-F252 HydrophobicContact CG-CE2 4.43Å; W208-F252 AromaticContact CG-CZ 3.6Å; W208-F252 HydrophobicContact CG-CZ 3.6Å; W208-F252 AromaticContact NE1-CE1 3.98Å; L241-F252 HydrophobicContact CD1-CB 3.33Å; L241-F252 HydrophobicContact CD1-CD1 4.09Å; L241-F252 HydrophobicContact CD1-CD2 4.27Å; L241-F252 HydrophobicContact CD1-CG 3.66Å; T246-F252 HydrophobicContact CG2-CD1 4.47Å; D250-F252 PolarHBondContact O-N 2.94Å; F252-Q254 VanDerWaalsContact C-N 3.31Å; F252-Q254 PolarHBondContact O-N 3.23Å; F252-Y255 PolarHBondContact O-N 2.77Å; F252-L256 HydrophobicContact CD1-CD1 4.33Å; F252-L256 HydrophobicContact CE1-CD1 3.66Å; F252-L256 HydrophobicContact CE2-CD1 4.27Å; F252-L256 HydrophobicContact CZ-CD1 3.62Å
253	L	93.9	Very high	90.8	Very high	38 Å²	38	81.7 Å²	81.7	20%	0.199	42%	0.419	C	S	.	.	H	α-helix	trans	-72.6	-26	-178.2	-66.8	-176.9	0	0	0	112.2	I188 L191 T246 N247 D250 E251 Y255 L256	I188-L253 HydrophobicContact CD1-CD2 4.42Å; L191-L253 HydrophobicContact CD1-CD2 4.49Å; T246-L253 HydrophobicContact CG2-CD1 3.9Å; T246-L253 HydrophobicContact CG2-CD2 4.42Å; T246-L253 HydrophobicContact CG2-CG 3.96Å; N247-L253 WeakPolarHBondContact O-CD1 3.3Å; D250-L253 PolarHBondContact O-N 3.01Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.31Å; L253-Y255 PolarHBondContact O-N 3.47Å; L253-L256 HydrophobicContact CD2-CD1 4.45Å; L253-L256 PolarHBondContact O-N 3.28Å; L253-L256 VanDerWaalsContact O-N 3.07Å
254	Q	93.3	Very high	89.6	Confident	138 Å²	138	81.2 Å²	81.2	65%	0.645	42%	0.422	S	S	*	.	H	α-helix	trans	-66	-25.1	178.7	-58.6	178.8	15	0	0	112.7	S249 E251 F252 L256	S249-Q254 PolarHBondContact O-NE2 3.23Å; S249-Q254 VanDerWaalsContact O-NE2 3.11Å; E251-Q254 WeakPolarHBondContact O-CB 2.87Å; E251-Q254 PolarHBondContact O-N 3.44Å; E251-Q254 VanDerWaalsContact O-N 3.11Å; F252-Q254 VanDerWaalsContact C-N 3.31Å; F252-Q254 PolarHBondContact O-N 3.23Å; Q254-L256 VanDerWaalsContact C-N 3.35Å
255	Y	93.9	Very high	88.4	Confident	92 Å²	92	80.6 Å²	80.6	36%	0.361	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.7	174.8	-75.8	-80.3	0	0	0	114	L199 L201 E251 F252 L253 P257	L199-Y255 HydrophobicContact CD2-CD2 4.24Å; L199-Y255 HydrophobicContact CD2-CG 4.27Å; L201-Y255 HydrophobicContact CD1-CD2 3.85Å; L201-Y255 HydrophobicContact CD1-CE1 4.41Å; L201-Y255 HydrophobicContact CD1-CE2 3.53Å; L201-Y255 HydrophobicContact CD1-CG 4.43Å; L201-Y255 HydrophobicContact CD2-CD1 3.89Å; L201-Y255 HydrophobicContact CD2-CD2 4.22Å; L201-Y255 HydrophobicContact CD2-CE1 4.07Å; L201-Y255 HydrophobicContact CD2-CE2 4.4Å; L201-Y255 HydrophobicContact CD2-CG 3.97Å; E251-Y255 HydrophobicContact CG-CD2 4.11Å; E251-Y255 HydrophobicContact CG-CE2 3.61Å; E251-Y255 VanDerWaalsContact O-CD2 3.29Å; E251-Y255 WeakPolarHBondContact O-CD2 3.29Å; F252-Y255 PolarHBondContact O-N 2.77Å; L253-Y255 PolarHBondContact O-N 3.47Å; Y255-P257 WeakPolarHBondContact O-CD 3.02Å
256	L	95.2	Very high	87.3	Confident	9 Å²	9	82.5 Å²	82.5	5%	0.047	42%	0.422	C	S	.	.	S	Bend	trans	-108	91.2	-175.3	-63.4	-174.6	0	0	0	110.5	L168 L186 I188 L191 L199 F252 L253 Q254	L168-L256 HydrophobicContact CD1-CD2 4.35Å; L168-L256 HydrophobicContact CD2-CD2 4.08Å; L186-L256 HydrophobicContact CD1-CD2 3.76Å; L186-L256 HydrophobicContact CG-CD2 4.23Å; I188-L256 HydrophobicContact CB-CB 4.26Å; L191-L256 HydrophobicContact CD1-CD1 3.79Å; L191-L256 HydrophobicContact CD2-CD1 4.29Å; L191-L256 HydrophobicContact CG-CD1 4.19Å; L199-L256 HydrophobicContact CD1-CD2 4.4Å; F252-L256 HydrophobicContact CD1-CD1 4.33Å; F252-L256 HydrophobicContact CE1-CD1 3.66Å; F252-L256 HydrophobicContact CE2-CD1 4.27Å; F252-L256 HydrophobicContact CZ-CD1 3.62Å; L253-L256 HydrophobicContact CD2-CD1 4.45Å; L253-L256 PolarHBondContact O-N 3.28Å; L253-L256 VanDerWaalsContact O-N 3.07Å; Q254-L256 VanDerWaalsContact C-N 3.35Å
257	P	94.5	Very high	86.2	Confident	65 Å²	65	83.7 Å²	83.7	42%	0.422	42%	0.424	S	S	.	.			trans	-63.4	149.3	178.2	27.5	-35.7	0	0	0	111.4	L186 S187 I188 Y255 K259	L186-P257 WeakPolarHBondContact O-CD 3.38Å; L186-P257 VanDerWaalsContact O-CG 3.29Å; L186-P257 WeakPolarHBondContact O-CG 3.05Å; S187-P257 VanDerWaalsContact CA-O 3.26Å; S187-P257 WeakPolarHBondContact CA-O 3.37Å; S187-P257 PolarHBondContact OG-O 2.8Å; S187-P257 VanDerWaalsContact OG-O 3.1Å; I188-P257 PolarHBondContact N-O 3.2Å; I188-P257 VanDerWaalsContact N-O 3.16Å; Y255-P257 WeakPolarHBondContact O-CD 3.02Å; P257-K259 HydrophobicContact CG-CD 4.38Å; P257-K259 HydrophobicContact CG-CG 4.47Å; P257-K259 PolarHBondContact O-N 3.45Å
258	D	93.6	Very high	84.6	Confident	133 Å²	133	85.8 Å²	85.8	71%	0.711	44%	0.442	S	S	*	.			trans	-80.3	84.4	172.1	-171	7.1	0	0	0	110.4	I188 N189	I188-D258 HydrophobicContact CG2-CB 4.09Å; N189-D258 PolarHBondContact ND2-OD1 2.92Å
259	K	93.6	Very high	83.5	Confident	80 Å²	80	88.6 Å²	88.6	35%	0.348	44%	0.443	S	S	.	.			trans	-123.5	144.7	175.5	66.8	175.9	-171.3	-178.9	0	110.8	L186 S187 N189 P257	L186-K259 WeakPolarHBondContact O-CE 3.43Å; S187-K259 WeakPolarHBondContact OG-CG 3.35Å; S187-K259 PolarHBondContact OG-N 2.88Å; S187-K259 PolarHBondContact OG-O 2.89Å; N189-K259 PolarHBondContact ND2-O 2.85Å; P257-K259 HydrophobicContact CG-CD 4.38Å; P257-K259 HydrophobicContact CG-CG 4.47Å; P257-K259 PolarHBondContact O-N 3.45Å
260	P	90.9	Very high	82.6	Confident	120 Å²	120	85.7 Å²	85.7	78%	0.779	42%	0.423	S	S	*	.			trans	-60.5	143.3	176.6	25.7	-33.8	0	0	0	110.6
261	V	89.9	Confident	81.9	Confident	34 Å²	34	87.8 Å²	87.8	21%	0.206	44%	0.437	C	S	.	.			trans	-122.7	134.3	-178.8	176.9	0	0	0	0	108.3	D185 S187 N189 S190	D185-V261 HydrophobicContact CB-CG1 4.07Å; D185-V261 HydrophobicContact CB-CG2 3.9Å; S187-V261 VanDerWaalsContact CB-CG2 3.48Å; N189-V261 HydrophobicContact CB-CB 4.4Å; N189-V261 HydrophobicContact CB-CG2 3.9Å; S190-V261 WeakPolarHBondContact OG-CG2 3.48Å
262	Y	79.6	Confident	81.9	Confident	95 Å²	95	87.4 Å²	87.4	37%	0.373	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-84.6	123.7	173.9	-179	-89	0	0	0	109.8	E9	E9-Y262 PolarHBondContact OE1-OH 3.32Å
263	R	74.7	Confident	82	Confident	161 Å²	161	87.7 Å²	87.7	61%	0.608	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-98	130.6	175	-65.6	-177.3	-178.4	155.8	0.9	109.3	N189	N189-R263 PolarHBondContact O-NH2 3.46Å
264	S	70.2	Confident	82.1	Confident	45 Å²	45	85.9 Å²	85.9	32%	0.315	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-60.2	139.6	175.9	43.3	0	0	0	0	110.4	K266	S264-K266 PolarHBondContact O-N 3.15Å
265	K	69.3	Low	82.3	Confident	117 Å²	117	81.7 Å²	81.7	51%	0.509	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-68.1	118	175.2	-69.7	170.1	-175.4	144.4	0	108.2	E9 Y133 Y267	E9-K265 IonicContact OE1-NZ 3.4Å; E9-K265 PolarHBondContact OE1-NZ 3.22Å; Y133-K265 WeakPolarHBondContact CE1-O 3.31Å; Y133-K265 PolarHBondContact OH-O 2.8Å; K265-Y267 HydrophobicContact CB-CE1 4.28Å; K265-Y267 PolarHBondContact O-N 3.14Å
266	K	69.6	Low	82.4	Confident	203 Å²	203	79.1 Å²	79.1	88%	0.883	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-71.5	117.1	160.4	-71.5	-172.8	177.6	-178.4	0	106.8	S264 C268	S264-K266 PolarHBondContact O-N 3.15Å; K266-C268 PolarHBondContact O-N 3.33Å
267	Y	68.3	Low	82.4	Confident	50 Å²	50	78.7 Å²	78.7	20%	0.196	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-67.6	117.6	174.7	-58.6	-51.9	0	0	0	108	Y133 K265 R341 H342 P343 F344 I345	Y133-Y267 AromaticContact CD1-CD2 3.87Å; Y133-Y267 HydrophobicContact CD1-CD2 3.87Å; Y133-Y267 AromaticContact CD1-CE2 3.66Å; Y133-Y267 HydrophobicContact CD1-CE2 3.66Å; Y133-Y267 AromaticContact CE1-CD2 3.48Å; Y133-Y267 HydrophobicContact CE1-CD2 3.48Å; Y133-Y267 VanDerWaalsContact CE1-CD2 3.48Å; Y133-Y267 AromaticContact CE1-CE2 3.19Å; Y133-Y267 HydrophobicContact CE1-CE2 3.19Å; Y133-Y267 HydrophobicContact CE1-CG 4.45Å; Y133-Y267 AromaticContact CE1-CZ 3.96Å; Y133-Y267 AromaticContact CZ-CE2 3.73Å; K265-Y267 HydrophobicContact CB-CE1 4.28Å; K265-Y267 PolarHBondContact O-N 3.14Å; Y267-R341 WeakPolarHBondContact CD1-O 3.43Å; Y267-R341 WeakPolarHBondContact CE1-O 3.33Å; Y267-H342 HydrophobicContact CD1-CB 3.74Å; Y267-H342 HydrophobicContact CD2-CB 3.62Å; Y267-H342 HydrophobicContact CE1-CB 4.15Å; Y267-H342 HydrophobicContact CE2-CB 3.99Å; Y267-H342 HydrophobicContact CG-CB 3.46Å; Y267-H342 VanDerWaalsContact CG-CB 3.46Å; Y267-P343 VanDerWaalsContact OH-CD 3.26Å; Y267-P343 WeakPolarHBondContact OH-CD 3.35Å; Y267-P343 WeakPolarHBondContact OH-CG 3.26Å; Y267-F344 HydrophobicContact CE2-CB 4.17Å; Y267-F344 WeakPolarHBondContact OH-CD2 3.33Å; Y267-F344 PolarHBondContact OH-N 3.46Å; Y267-I345 HydrophobicContact CD2-CG2 3.71Å; Y267-I345 HydrophobicContact CE2-CG2 4.14Å
268	C	57.4	Low	82.3	Confident	115 Å²	115	75.7 Å²	75.7	78%	0.777	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-65.7	140.8	166.4	-169.9	0	0	0	0	107.3	K266 S270	K266-C268 PolarHBondContact O-N 3.33Å; C268-S270 PolarHBondContact O-N 3.32Å
269	E	59.8	Low	82	Confident	170 Å²	170	70.7 Å²	70.7	79%	0.794	35%	0.348	S	S	*	.			trans	-42.7	104.4	178.6	-75.7	-179.9	161.5	0	0	109.7
270	S	67.8	Low	81.3	Confident	24 Å²	24	73.5 Å²	73.5	17%	0.168	36%	0.362	C	S	.	.			trans	-77.3	162	176.9	57	0	0	0	0	108.8	C268 K272 G310 H342	C268-S270 PolarHBondContact O-N 3.32Å; S270-K272 PolarHBondContact O-N 3.03Å; S270-G310 WeakPolarHBondContact OG-CA 3.5Å; S270-G310 PolarHBondContact OG-O 3.06Å; S270-H342 VanDerWaalsContact CB-CE1 3.46Å; S270-H342 WeakPolarHBondContact CB-CE1 3.19Å; S270-H342 VanDerWaalsContact CB-ND1 3.34Å; S270-H342 WeakPolarHBondContact CB-ND1 3.2Å; S270-H342 PolarHBondContact OG-CE1 3.23Å; S270-H342 PolarHBondContact OG-ND1 3.24Å
271	T	78.6	Confident	80.7	Confident	84 Å²	84	74.7 Å²	74.7	52%	0.515	36%	0.362	S	S	.	.			trans	-61.2	115.2	-177.7	46.5	0	0	0	0	110	C273 N292	T271-C273 PolarHBondContact O-N 3.35Å; T271-N292 WeakPolarHBondContact CB-OD1 3.47Å; T271-N292 WeakPolarHBondContact CG2-OD1 3.42Å
272	K	92.7	Very high	80.1	Confident	63 Å²	63	76.1 Å²	76.1	27%	0.274	38%	0.383	S	S	.	.			trans	-51.3	136.3	173.1	-63.3	-176.8	-179.4	-165	0	110.9	S270 K291 N292 L294 D308 D364	S270-K272 PolarHBondContact O-N 3.03Å; K272-K291 CarbonylContact O-C 3.54Å; K272-N292 VanDerWaalsContact O-CA 3.3Å; K272-N292 WeakPolarHBondContact O-CA 3.29Å; K272-N292 PolarHBondContact O-N 3.09Å; K272-L294 HydrophobicContact CB-CD1 4.43Å; K272-L294 HydrophobicContact CB-CD2 4.14Å; K272-L294 HydrophobicContact CB-CG 3.94Å; K272-L294 HydrophobicContact CD-CD1 4.12Å; K272-L294 HydrophobicContact CD-CG 3.97Å; K272-L294 HydrophobicContact CG-CD1 4.41Å; K272-L294 HydrophobicContact CG-CG 4.33Å; K272-D308 CarbonylContact C-O 3.55Å; K272-D308 VanDerWaalsContact CA-O 3.24Å; K272-D308 WeakPolarHBondContact CA-O 3.41Å; K272-D364 IonicContact NZ-OD1 2.76Å; K272-D364 PolarHBondContact NZ-OD1 3.49Å
273	C	95.3	Very high	80.4	Confident	6 Å²	6	77.9 Å²	77.9	4%	0.041	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	159.5	176.9	50.8	0	0	0	0	113.1	T271 Y275 L288 V290 D308 Y336	T271-C273 PolarHBondContact O-N 3.35Å; C273-Y275 HydrophobicContact CB-CE2 4.19Å; C273-L288 HydrophobicContact CB-CD1 3.84Å; C273-V290 CarbonylContact C-O 3.47Å; C273-V290 VanDerWaalsContact CA-O 3.23Å; C273-V290 WeakPolarHBondContact CA-O 3Å; C273-V290 WeakPolarHBondContact CB-O 3.48Å; C273-D308 PolarHBondContact N-O 3.47Å; C273-D308 PolarHBondContact O-N 2.86Å; C273-Y336 PolarHBondContact SG-OH 2.88Å
274	I	97	Very high	80.9	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.2	175.3	-55.3	179.5	0	0	0	108.2	V289 V290 L294 V299 F305 L306 I307 W363	I274-V289 PolarHBondContact O-N 3.07Å; I274-V290 HydrophobicContact CB-CB 3.99Å; I274-V290 HydrophobicContact CB-CG2 4.25Å; I274-V290 HydrophobicContact CD1-CB 4.23Å; I274-V290 HydrophobicContact CD1-CG2 4.14Å; I274-V290 HydrophobicContact CG1-CB 4.14Å; I274-V290 HydrophobicContact CG1-CG2 4.48Å; I274-V290 PolarHBondContact N-O 2.87Å; I274-V290 PolarHBondContact O-N 3.01Å; I274-V290 VanDerWaalsContact O-N 3.13Å; I274-L294 HydrophobicContact CD1-CD2 4.07Å; I274-L294 HydrophobicContact CG1-CD2 3.55Å; I274-V299 HydrophobicContact CD1-CG2 4.34Å; I274-V299 HydrophobicContact CG2-CG2 4.27Å; I274-F305 HydrophobicContact CG2-CB 4.47Å; I274-F305 HydrophobicContact CG2-CD1 3.94Å; I274-L306 CarbonylContact C-O 3.58Å; I274-L306 VanDerWaalsContact CA-O 3.32Å; I274-L306 WeakPolarHBondContact CA-O 2.9Å; I274-I307 HydrophobicContact CG1-CG2 4.43Å; I274-I307 HydrophobicContact CG2-CG1 4.37Å; I274-W363 HydrophobicContact CD1-CZ3 4.11Å
275	Y	96.8	Very high	82	Confident	49 Å²	49	71.4 Å²	71.4	19%	0.192	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.1	169.9	-67	-101.3	0	0	0	110.3	C273 F286 D287 L288 F305 L306 Y336	C273-Y275 HydrophobicContact CB-CE2 4.19Å; Y275-F286 VanDerWaalsContact CB-CE2 3.4Å; Y275-F286 VanDerWaalsContact CB-CZ 3.43Å; Y275-F286 HydrophobicContact CD1-CD1 4.11Å; Y275-F286 AromaticContact CD1-CE1 3.52Å; Y275-F286 HydrophobicContact CD1-CE1 3.52Å; Y275-F286 HydrophobicContact CD1-CE2 4.22Å; Y275-F286 AromaticContact CD1-CZ 3.58Å; Y275-F286 HydrophobicContact CD1-CZ 3.58Å; Y275-F286 HydrophobicContact CD2-CZ 4.19Å; Y275-F286 AromaticContact CE1-CE1 3.99Å; Y275-F286 HydrophobicContact CE1-CE1 3.99Å; Y275-F286 HydrophobicContact CE1-CZ 4.37Å; Y275-F286 AromaticContact CG-CE1 3.94Å; Y275-F286 HydrophobicContact CG-CE1 3.94Å; Y275-F286 HydrophobicContact CG-CE2 4Å; Y275-F286 AromaticContact CG-CZ 3.48Å; Y275-F286 HydrophobicContact CG-CZ 3.48Å; Y275-F286 VanDerWaalsContact CG-CZ 3.48Å; Y275-D287 CarbonylContact C-O 3.59Å; Y275-D287 WeakPolarHBondContact CA-O 3.49Å; Y275-L288 HydrophobicContact CD1-CB 4.06Å; Y275-L288 HydrophobicContact CD1-CD1 4.35Å; Y275-L288 HydrophobicContact CD2-CD1 4.23Å; Y275-L288 HydrophobicContact CE1-CB 3.77Å; Y275-L288 HydrophobicContact CE1-CD1 3.98Å; Y275-L288 HydrophobicContact CE1-CG 4.44Å; Y275-L288 HydrophobicContact CE2-CD1 3.82Å; Y275-L288 HydrophobicContact CG-CD1 4.47Å; Y275-F305 CarbonylContact O-C 3.57Å; Y275-F305 VanDerWaalsContact O-CA 3.27Å; Y275-F305 WeakPolarHBondContact O-CA 3.47Å; Y275-L306 PolarHBondContact N-O 2.73Å; Y275-L306 PolarHBondContact O-N 2.88Å; Y275-Y336 HydrophobicContact CD2-CD2 4.5Å; Y275-Y336 AromaticContact CD2-CE2 3.97Å; Y275-Y336 HydrophobicContact CD2-CE2 3.97Å; Y275-Y336 HydrophobicContact CE2-CD2 4.13Å; Y275-Y336 AromaticContact CE2-CE2 3.29Å; Y275-Y336 HydrophobicContact CE2-CE2 3.29Å; Y275-Y336 AromaticContact CE2-CZ 3.72Å; Y275-Y336 AromaticContact CZ-CE2 3.63Å
276	K	96.5	Very high	83.1	Confident	38 Å²	38	68.5 Å²	68.5	17%	0.165	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.2	171.6	169.1	172.8	155.3	159.4	0	108.2	S278 E280 F286 D287 V289 D303 F305	K276-S278 VanDerWaalsContact CE-OG 3.26Å; K276-S278 WeakPolarHBondContact CE-OG 3.49Å; K276-E280 IonicContact NZ-OE2 2.79Å; K276-E280 PolarHBondContact NZ-OE2 2.7Å; K276-F286 WeakPolarHBondContact O-CA 3.4Å; K276-D287 PolarHBondContact N-O 3.32Å; K276-D287 PolarHBondContact O-N 2.93Å; K276-V289 HydrophobicContact CB-CG2 3.42Å; K276-V289 VanDerWaalsContact CB-CG2 3.42Å; K276-D303 HydrophobicContact CD-CB 4.21Å; K276-D303 WeakPolarHBondContact CE-OD1 3.35Å; K276-D303 WeakPolarHBondContact CE-OD2 3.09Å; K276-D303 HydrophobicContact CG-CB 4.07Å; K276-D303 IonicContact NZ-OD1 2.69Å; K276-D303 PolarHBondContact NZ-OD1 3.28Å; K276-D303 VanDerWaalsContact NZ-OD1 3.14Å; K276-D303 IonicContact NZ-OD2 3.03Å; K276-D303 PolarHBondContact NZ-OD2 2.96Å; K276-F305 HydrophobicContact CB-CD1 4.02Å; K276-F305 HydrophobicContact CB-CE1 3.79Å; K276-F305 HydrophobicContact CD-CE1 4.21Å; K276-F305 HydrophobicContact CD-CZ 4.23Å; K276-F305 HydrophobicContact CG-CE1 4.09Å; K276-F305 HydrophobicContact CG-CZ 4.34Å
277	L	94.3	Very high	84.3	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.3	169.6	-179.6	70.9	0	0	0	107.1	L284 S285 F286 V304 N328 Y332	L277-L284 HydrophobicContact CD1-CD2 3.53Å; L277-L284 HydrophobicContact CD1-CG 4.09Å; L277-L284 HydrophobicContact CD2-CD2 4.3Å; L277-L284 HydrophobicContact CG-CD2 4.13Å; L277-S285 WeakPolarHBondContact CA-O 3.38Å; L277-S285 WeakPolarHBondContact CD1-O 3.5Å; L277-F286 HydrophobicContact CB-CD2 4.26Å; L277-F286 HydrophobicContact CD1-CB 4.24Å; L277-F286 HydrophobicContact CD1-CD2 4.15Å; L277-V304 HydrophobicContact CB-CB 4.09Å; L277-V304 HydrophobicContact CB-CG1 4.23Å; L277-V304 HydrophobicContact CD2-CB 4.36Å; L277-V304 HydrophobicContact CD2-CG1 4.22Å; L277-V304 PolarHBondContact N-O 3Å; L277-V304 PolarHBondContact O-N 2.71Å; L277-N328 HydrophobicContact CD2-CB 4.38Å; L277-Y332 HydrophobicContact CD1-CD1 3.7Å; L277-Y332 HydrophobicContact CD1-CD2 4.04Å; L277-Y332 HydrophobicContact CD1-CE1 3.78Å; L277-Y332 HydrophobicContact CD1-CE2 4.13Å; L277-Y332 HydrophobicContact CD1-CG 3.81Å; L277-Y332 HydrophobicContact CD2-CD2 4.32Å; L277-Y332 HydrophobicContact CD2-CG 4.32Å
278	S	92.4	Very high	85.6	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.014	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.6	-172.3	-164.8	0	0	0	0	111.2	K276 E280 L284 S285 D303 E325	K276-S278 VanDerWaalsContact CE-OG 3.26Å; K276-S278 WeakPolarHBondContact CE-OG 3.49Å; S278-E280 WeakPolarHBondContact OG-CG 3.47Å; S278-L284 CarbonylContact O-C 3.58Å; S278-L284 WeakPolarHBondContact O-CA 3.37Å; S278-S285 PolarHBondContact N-O 2.81Å; S278-S285 VanDerWaalsContact N-O 3.09Å; S278-S285 PolarHBondContact O-N 3.05Å; S278-D303 WeakPolarHBondContact CB-OD1 2.97Å; S278-D303 PolarHBondContact OG-OD1 2.79Å; S278-E325 WeakPolarHBondContact CA-OE1 3.4Å
279	D	86.6	Confident	87.4	Confident	29 Å²	29	62.4 Å²	62.4	16%	0.155	34%	0.337	C	S	.	.			trans	-117.2	17.2	171.6	70.3	3.4	0	0	0	113.7	D281 G282 L284 L322 E325	D279-D281 PolarHBondContact O-N 3.16Å; D279-D281 VanDerWaalsContact O-N 3.08Å; D279-G282 WeakPolarHBondContact O-CA 3.47Å; D279-G282 PolarHBondContact O-N 2.96Å; D279-L284 HydrophobicContact CB-CD1 3.97Å; D279-L322 WeakPolarHBondContact OD1-CD1 3.44Å; D279-E325 HydrophobicContact CB-CG 4.43Å; D279-E325 PolarHBondContact N-OE1 2.9Å
280	E	80.5	Confident	89.1	Confident	139 Å²	139	54.8 Å²	54.8	65%	0.65	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-33.7	179.9	-75.1	179.7	138.5	0	0	113.4	K276 S278 G282	K276-E280 IonicContact NZ-OE2 2.79Å; K276-E280 PolarHBondContact NZ-OE2 2.7Å; S278-E280 WeakPolarHBondContact OG-CG 3.47Å; E280-G282 VanDerWaalsContact C-N 3.25Å; E280-G282 PolarHBondContact O-N 3.47Å
281	D	78.1	Confident	90.3	Very high	145 Å²	145	59.5 Å²	59.5	78%	0.775	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	8.1	179.4	-69.8	-35.7	0	0	0	113.8	D279 N283	D279-D281 PolarHBondContact O-N 3.16Å; D279-D281 VanDerWaalsContact O-N 3.08Å; D281-N283 VanDerWaalsContact C-N 3.26Å; D281-N283 PolarHBondContact O-N 2.82Å
282	G	77.7	Confident	90.9	Very high	63 Å²	63	60.3 Å²	60.3	65%	0.649	32%	0.321	S	S	*	.	S	Bend	trans	82.8	-6.6	-178.1	0	0	0	0	0	114.7	D279 E280	D279-G282 WeakPolarHBondContact O-CA 3.47Å; D279-G282 PolarHBondContact O-N 2.96Å; E280-G282 VanDerWaalsContact C-N 3.25Å; E280-G282 PolarHBondContact O-N 3.47Å
283	N	84.2	Confident	90.9	Very high	132 Å²	132	61.5 Å²	61.5	71%	0.706	33%	0.328	S	S	*	.	S	Bend	trans	-129.5	147.2	168.6	-67.9	-57.6	0	0	0	109.2	D281 S285	D281-N283 VanDerWaalsContact C-N 3.26Å; D281-N283 PolarHBondContact O-N 2.82Å; N283-S285 PolarHBondContact O-N 3Å; N283-S285 VanDerWaalsContact O-N 3.11Å
284	L	86.7	Confident	90.8	Very high	43 Å²	43	61.2 Å²	61.2	23%	0.225	33%	0.326	C	S	.	.			trans	-62.3	112.2	175.6	-128.1	95.5	0	0	0	110.6	L277 S278 D279 C324 N328 Y332	L277-L284 HydrophobicContact CD1-CD2 3.53Å; L277-L284 HydrophobicContact CD1-CG 4.09Å; L277-L284 HydrophobicContact CD2-CD2 4.3Å; L277-L284 HydrophobicContact CG-CD2 4.13Å; S278-L284 CarbonylContact O-C 3.58Å; S278-L284 WeakPolarHBondContact O-CA 3.37Å; D279-L284 HydrophobicContact CB-CD1 3.97Å; L284-C324 HydrophobicContact CD1-CB 4.08Å; L284-C324 WeakPolarHBondContact CD1-SG 3.5Å; L284-N328 HydrophobicContact CD2-CB 3.64Å; L284-Y332 HydrophobicContact CD2-CD2 4.26Å; L284-Y332 HydrophobicContact CD2-CE2 3.48Å; L284-Y332 VanDerWaalsContact CD2-CE2 3.48Å
285	S	91.7	Very high	90.7	Very high	28 Å²	28	62 Å²	62	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.8	173.4	86.5	0	0	0	0	110.8	L277 S278 N283 D287	L277-S285 WeakPolarHBondContact CA-O 3.38Å; L277-S285 WeakPolarHBondContact CD1-O 3.5Å; S278-S285 PolarHBondContact N-O 2.81Å; S278-S285 VanDerWaalsContact N-O 3.09Å; S278-S285 PolarHBondContact O-N 3.05Å; N283-S285 PolarHBondContact O-N 3Å; N283-S285 VanDerWaalsContact O-N 3.11Å; S285-D287 VanDerWaalsContact CB-OD2 3.3Å; S285-D287 WeakPolarHBondContact CB-OD2 3.37Å; S285-D287 PolarHBondContact OG-OD2 2.94Å
286	F	94	Very high	90.6	Very high	56 Å²	56	64.7 Å²	64.7	25%	0.246	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	93.3	178.2	-178	-111.7	0	0	0	109.9	Y275 K276 L277 L306 Y332 Y336	Y275-F286 VanDerWaalsContact CB-CE2 3.4Å; Y275-F286 VanDerWaalsContact CB-CZ 3.43Å; Y275-F286 HydrophobicContact CD1-CD1 4.11Å; Y275-F286 AromaticContact CD1-CE1 3.52Å; Y275-F286 HydrophobicContact CD1-CE1 3.52Å; Y275-F286 HydrophobicContact CD1-CE2 4.22Å; Y275-F286 AromaticContact CD1-CZ 3.58Å; Y275-F286 HydrophobicContact CD1-CZ 3.58Å; Y275-F286 HydrophobicContact CD2-CZ 4.19Å; Y275-F286 AromaticContact CE1-CE1 3.99Å; Y275-F286 HydrophobicContact CE1-CE1 3.99Å; Y275-F286 HydrophobicContact CE1-CZ 4.37Å; Y275-F286 AromaticContact CG-CE1 3.94Å; Y275-F286 HydrophobicContact CG-CE1 3.94Å; Y275-F286 HydrophobicContact CG-CE2 4Å; Y275-F286 AromaticContact CG-CZ 3.48Å; Y275-F286 HydrophobicContact CG-CZ 3.48Å; Y275-F286 VanDerWaalsContact CG-CZ 3.48Å; K276-F286 WeakPolarHBondContact O-CA 3.4Å; L277-F286 HydrophobicContact CB-CD2 4.26Å; L277-F286 HydrophobicContact CD1-CB 4.24Å; L277-F286 HydrophobicContact CD1-CD2 4.15Å; F286-L306 HydrophobicContact CE2-CB 4.44Å; F286-L306 HydrophobicContact CE2-CD1 4.29Å; F286-L306 HydrophobicContact CE2-CD2 3.72Å; F286-L306 HydrophobicContact CE2-CG 4.38Å; F286-L306 HydrophobicContact CZ-CD2 3.74Å; F286-Y332 HydrophobicContact CB-CD1 3.73Å; F286-Y332 HydrophobicContact CB-CE1 3.62Å; F286-Y332 HydrophobicContact CD1-CD1 4.23Å; F286-Y332 AromaticContact CD2-CD1 3.82Å; F286-Y332 HydrophobicContact CD2-CD1 3.82Å; F286-Y332 AromaticContact CG-CD1 3.65Å; F286-Y332 HydrophobicContact CG-CD1 3.65Å; F286-Y332 HydrophobicContact CG-CE1 4.08Å; F286-Y336 HydrophobicContact CE1-CD2 4.17Å; F286-Y336 HydrophobicContact CZ-CD2 4.19Å; F286-Y336 HydrophobicContact CZ-CG 4.43Å
287	D	94.6	Very high	90.5	Very high	86 Å²	86	72.4 Å²	72.4	46%	0.46	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.6	-164.1	-63.8	-56.8	0	0	0	112.2	Y275 K276 S285 V289	Y275-D287 CarbonylContact C-O 3.59Å; Y275-D287 WeakPolarHBondContact CA-O 3.49Å; K276-D287 PolarHBondContact N-O 3.32Å; K276-D287 PolarHBondContact O-N 2.93Å; S285-D287 VanDerWaalsContact CB-OD2 3.3Å; S285-D287 WeakPolarHBondContact CB-OD2 3.37Å; S285-D287 PolarHBondContact OG-OD2 2.94Å; D287-V289 PolarHBondContact O-N 2.74Å
288	L	95.5	Very high	90.4	Very high	83 Å²	83	74 Å²	74	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.6	173.1	177.8	67.8	0	0	0	109.7	C273 Y275 V290 K291	C273-L288 HydrophobicContact CB-CD1 3.84Å; Y275-L288 HydrophobicContact CD1-CB 4.06Å; Y275-L288 HydrophobicContact CD1-CD1 4.35Å; Y275-L288 HydrophobicContact CD2-CD1 4.23Å; Y275-L288 HydrophobicContact CE1-CB 3.77Å; Y275-L288 HydrophobicContact CE1-CD1 3.98Å; Y275-L288 HydrophobicContact CE1-CG 4.44Å; Y275-L288 HydrophobicContact CE2-CD1 3.82Å; Y275-L288 HydrophobicContact CG-CD1 4.47Å; L288-V290 VanDerWaalsContact CD1-O 3.29Å; L288-V290 WeakPolarHBondContact CD1-O 3.45Å; L288-K291 HydrophobicContact CD2-CB 4.38Å; L288-K291 HydrophobicContact CD2-CD 4.34Å
289	V	95.3	Very high	90.5	Very high	70 Å²	70	75.2 Å²	75.2	42%	0.424	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-42.5	-179.6	-174.4	0	0	0	0	111.4	I274 K276 D287	I274-V289 PolarHBondContact O-N 3.07Å; K276-V289 HydrophobicContact CB-CG2 3.42Å; K276-V289 VanDerWaalsContact CB-CG2 3.42Å; D287-V289 PolarHBondContact O-N 2.74Å
290	V	95	Very high	90.8	Very high	10 Å²	10	76.6 Å²	76.6	6%	0.061	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	141.7	-175.8	-170.8	0	0	0	0	111.3	C273 I274 L288 H293 P295 S298	C273-V290 CarbonylContact C-O 3.47Å; C273-V290 VanDerWaalsContact CA-O 3.23Å; C273-V290 WeakPolarHBondContact CA-O 3Å; C273-V290 WeakPolarHBondContact CB-O 3.48Å; I274-V290 HydrophobicContact CB-CB 3.99Å; I274-V290 HydrophobicContact CB-CG2 4.25Å; I274-V290 HydrophobicContact CD1-CB 4.23Å; I274-V290 HydrophobicContact CD1-CG2 4.14Å; I274-V290 HydrophobicContact CG1-CB 4.14Å; I274-V290 HydrophobicContact CG1-CG2 4.48Å; I274-V290 PolarHBondContact N-O 2.87Å; I274-V290 PolarHBondContact O-N 3.01Å; I274-V290 VanDerWaalsContact O-N 3.13Å; L288-V290 VanDerWaalsContact CD1-O 3.29Å; L288-V290 WeakPolarHBondContact CD1-O 3.45Å; V290-H293 WeakPolarHBondContact CG1-CE1 3.38Å; V290-H293 WeakPolarHBondContact CG1-ND1 3.46Å; V290-H293 WeakPolarHBondContact CG1-O 3.27Å; V290-P295 HydrophobicContact CG1-CG 4.07Å; V290-P295 HydrophobicContact CG2-CG 4.15Å; V290-S298 WeakPolarHBondContact CG2-OG 3.35Å
291	K	93.4	Very high	91.5	Very high	123 Å²	123	73.7 Å²	73.7	54%	0.535	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.8	177.9	-168.2	178	-177.8	175.1	0	111.7	K272 L288 H293	K272-K291 CarbonylContact O-C 3.54Å; L288-K291 HydrophobicContact CD2-CB 4.38Å; L288-K291 HydrophobicContact CD2-CD 4.34Å; K291-H293 PolarHBondContact O-CD2 2.64Å; K291-H293 PolarHBondContact O-N 3.22Å
292	N	91.3	Very high	92.2	Very high	101 Å²	101	69.9 Å²	69.9	54%	0.54	36%	0.363	S	S	.	.	S	Bend	trans	67	2.6	179.2	-55.7	-37.8	0	0	0	116.7	T271 K272	T271-N292 WeakPolarHBondContact CB-OD1 3.47Å; T271-N292 WeakPolarHBondContact CG2-OD1 3.42Å; K272-N292 VanDerWaalsContact O-CA 3.3Å; K272-N292 WeakPolarHBondContact O-CA 3.29Å; K272-N292 PolarHBondContact O-N 3.09Å
293	H	92	Very high	93	Very high	89 Å²	89	67 Å²	67	41%	0.412	33%	0.333	S	S	.	.			trans	-152.4	160.9	176.4	59.3	94.7	0	0	0	110.2	V290 K291 P295 D364	V290-H293 WeakPolarHBondContact CG1-CE1 3.38Å; V290-H293 WeakPolarHBondContact CG1-ND1 3.46Å; V290-H293 WeakPolarHBondContact CG1-O 3.27Å; K291-H293 PolarHBondContact O-CD2 2.64Å; K291-H293 PolarHBondContact O-N 3.22Å; H293-P295 VanDerWaalsContact ND1-CD 3.34Å; H293-P295 WeakPolarHBondContact ND1-CD 2.94Å; H293-P295 WeakPolarHBondContact ND1-CG 3.36Å; H293-D364 WeakPolarHBondContact CA-OD2 3.46Å; H293-D364 WeakPolarHBondContact CB-OD2 3.44Å
294	L	94.4	Very high	93.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.299	C	S	.	.			trans	-124.1	80.2	179.7	-62.1	-179.3	0	0	0	110.4	K272 I274 I307 A309 A362 W363 D364	K272-L294 HydrophobicContact CB-CD1 4.43Å; K272-L294 HydrophobicContact CB-CD2 4.14Å; K272-L294 HydrophobicContact CB-CG 3.94Å; K272-L294 HydrophobicContact CD-CD1 4.12Å; K272-L294 HydrophobicContact CD-CG 3.97Å; K272-L294 HydrophobicContact CG-CD1 4.41Å; K272-L294 HydrophobicContact CG-CG 4.33Å; I274-L294 HydrophobicContact CD1-CD2 4.07Å; I274-L294 HydrophobicContact CG1-CD2 3.55Å; L294-I307 HydrophobicContact CD1-CG2 4.09Å; L294-I307 HydrophobicContact CD2-CG2 3.89Å; L294-I307 HydrophobicContact CG-CG2 4.5Å; L294-A309 HydrophobicContact CD1-CB 3.92Å; L294-A362 HydrophobicContact CD1-CB 4.46Å; L294-W363 HydrophobicContact CB-CE3 3.9Å; L294-W363 HydrophobicContact CB-CZ3 4.23Å; L294-D364 PolarHBondContact N-OD2 3.46Å; L294-D364 PolarHBondContact O-N 2.77Å
295	P	94.5	Very high	94.1	Very high	16 Å²	16	58.8 Å²	58.8	10%	0.104	29%	0.289	C	S	.	.			trans	-83.5	121	177.1	33.5	-29.7	0	0	0	109.5	V290 H293 R297 S298	V290-P295 HydrophobicContact CG1-CG 4.07Å; V290-P295 HydrophobicContact CG2-CG 4.15Å; H293-P295 VanDerWaalsContact ND1-CD 3.34Å; H293-P295 WeakPolarHBondContact ND1-CD 2.94Å; H293-P295 WeakPolarHBondContact ND1-CG 3.36Å; P295-R297 HydrophobicContact CB-CG 4.23Å; P295-R297 PolarHBondContact O-N 2.96Å; P295-R297 VanDerWaalsContact O-N 3.08Å; P295-S298 WeakPolarHBondContact CG-OG 3.48Å; P295-S298 WeakPolarHBondContact O-CB 3.41Å; P295-S298 PolarHBondContact O-N 2.93Å
296	K	94.1	Very high	94.3	Very high	106 Å²	106	57.5 Å²	57.5	46%	0.461	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-53.7	-34.4	-177.7	-170.5	171.2	-171.4	165.6	0	113.4	S298 V299 E360 W363	K296-S298 PolarHBondContact O-N 2.76Å; K296-S298 VanDerWaalsContact O-N 3.14Å; K296-V299 PolarHBondContact O-N 3.33Å; K296-E360 IonicContact NZ-OE1 3.1Å; K296-E360 PolarHBondContact NZ-OE1 3.04Å; K296-E360 IonicContact NZ-OE2 3.46Å; K296-E360 PolarHBondContact NZ-OE2 2.75Å; K296-W363 HydrophobicContact CB-CD2 3.97Å; K296-W363 HydrophobicContact CB-CE3 4.29Å; K296-W363 HydrophobicContact CB-CG 4.09Å; K296-W363 HydrophobicContact CD-CG 4.42Å; K296-W363 HydrophobicContact CG-CD2 4.2Å; K296-W363 HydrophobicContact CG-CG 4.36Å; K296-W363 HydrophobicContact CG-CZ2 4.4Å
297	R	93.6	Very high	94.5	Very high	200 Å²	200	54.8 Å²	54.8	76%	0.755	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-63.2	-13.4	178.3	69.4	-177.5	-178.3	-156.6	1.9	115.7	P295 V299	P295-R297 HydrophobicContact CB-CG 4.23Å; P295-R297 PolarHBondContact O-N 2.96Å; P295-R297 VanDerWaalsContact O-N 3.08Å; R297-V299 VanDerWaalsContact C-N 3.31Å
298	S	93.5	Very high	94.5	Very high	34 Å²	34	50.7 Å²	50.7	24%	0.238	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-85.9	-5	179.4	-72.1	0	0	0	0	113.5	V290 P295 K296 F305	V290-S298 WeakPolarHBondContact CG2-OG 3.35Å; P295-S298 WeakPolarHBondContact CG-OG 3.48Å; P295-S298 WeakPolarHBondContact O-CB 3.41Å; P295-S298 PolarHBondContact O-N 2.93Å; K296-S298 PolarHBondContact O-N 2.76Å; K296-S298 VanDerWaalsContact O-N 3.14Å; S298-F305 WeakPolarHBondContact O-CE1 3.34Å
299	V	94.2	Very high	94.4	Very high	26 Å²	26	46.9 Å²	46.9	16%	0.158	23%	0.227	C	C	.	.			trans	-107.8	126.5	174.9	177.1	0	0	0	0	108.1	I274 K296 R297 F305 I307 Y316 W363	I274-V299 HydrophobicContact CD1-CG2 4.34Å; I274-V299 HydrophobicContact CG2-CG2 4.27Å; K296-V299 PolarHBondContact O-N 3.33Å; R297-V299 VanDerWaalsContact C-N 3.31Å; V299-F305 HydrophobicContact CB-CD2 4.44Å; V299-F305 HydrophobicContact CB-CG 4.38Å; V299-F305 HydrophobicContact CG1-CB 4.25Å; V299-F305 HydrophobicContact CG1-CD2 3.73Å; V299-F305 HydrophobicContact CG1-CE2 4.24Å; V299-F305 HydrophobicContact CG1-CG 3.98Å; V299-F305 HydrophobicContact CG2-CB 4.16Å; V299-F305 HydrophobicContact CG2-CD1 4.16Å; V299-F305 HydrophobicContact CG2-CG 4.06Å; V299-I307 HydrophobicContact CG2-CD1 4.09Å; V299-I307 HydrophobicContact CG2-CG1 4.11Å; V299-Y316 HydrophobicContact CG1-CD1 3.43Å; V299-Y316 VanDerWaalsContact CG1-CD1 3.43Å; V299-Y316 HydrophobicContact CG1-CE1 3.79Å; V299-Y316 HydrophobicContact CG1-CG 3.85Å; V299-W363 HydrophobicContact CB-CH2 4.41Å; V299-W363 HydrophobicContact CG2-CH2 3.74Å; V299-W363 HydrophobicContact CG2-CZ3 4.37Å
300	N	93.7	Very high	94.2	Very high	59 Å²	59	43.6 Å²	43.6	32%	0.316	21%	0.207	S	C	.	.			trans	-115.7	179.3	176.9	68.6	32.2	0	0	0	109.6	D302 D303 F305 Y316	N300-D302 PolarHBondContact OD1-N 3.05Å; N300-D303 PolarHBondContact OD1-N 2.82Å; N300-D303 PolarHBondContact OD1-OD2 3.34Å; N300-F305 WeakPolarHBondContact O-CE2 3.46Å; N300-F305 VanDerWaalsContact OD1-CE2 3.23Å; N300-F305 WeakPolarHBondContact OD1-CE2 3.26Å; N300-F305 WeakPolarHBondContact OD1-CZ 3.33Å; N300-Y316 WeakPolarHBondContact O-CE1 3.23Å
301	E	94.4	Very high	94	Very high	78 Å²	78	48.5 Å²	48.5	36%	0.364	23%	0.225	S	C	.	.	S	Bend	trans	-95.4	3.7	178.7	-65.3	176.5	179.7	0	0	113.6	G318 S319 R320	E301-G318 CarbonylContact O-C 3.56Å; E301-G318 VanDerWaalsContact O-C 3.28Å; E301-G318 WeakPolarHBondContact O-CA 3.27Å; E301-S319 PolarHBondContact O-N 2.98Å; E301-S319 VanDerWaalsContact O-N 3.14Å; E301-S319 PolarHBondContact OE2-OG 3.12Å; E301-R320 WeakPolarHBondContact O-CB 3.47Å; E301-R320 PolarHBondContact O-N 3.42Å; E301-R320 IonicContact OE2-CZ 3.25Å; E301-R320 IonicContact OE2-NH1 3.73Å; E301-R320 PolarHBondContact OE2-NH1 2.9Å
302	D	93.5	Very high	94.1	Very high	65 Å²	65	42.9 Å²	42.9	35%	0.348	20%	0.201	S	C	.	.	S	Bend	trans	-88.1	-23.7	-174.1	-56.7	-56.6	0	0	0	112.5	N300 R320 C321	N300-D302 PolarHBondContact OD1-N 3.05Å; D302-R320 IonicContact OD1-CZ 2.65Å; D302-R320 IonicContact OD1-NE 3.15Å; D302-R320 PolarHBondContact OD1-NE 3.45Å; D302-R320 IonicContact OD1-NH2 2.93Å; D302-R320 PolarHBondContact OD1-NH2 2.94Å; D302-R320 IonicContact OD2-NH2 3.99Å; D302-R320 PolarHBondContact OD2-NH2 2.82Å; D302-C321 WeakPolarHBondContact O-CA 3.17Å; D302-C321 PolarHBondContact O-N 2.88Å
303	D	94.6	Very high	94.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.011	18%	0.175	C	C	.	.	S	Bend	trans	-133.3	179.1	-173.9	-54.3	-85.7	0	0	0	112.5	K276 S278 N300 F305 G318	K276-D303 HydrophobicContact CD-CB 4.21Å; K276-D303 WeakPolarHBondContact CE-OD1 3.35Å; K276-D303 WeakPolarHBondContact CE-OD2 3.09Å; K276-D303 HydrophobicContact CG-CB 4.07Å; K276-D303 IonicContact NZ-OD1 2.69Å; K276-D303 PolarHBondContact NZ-OD1 3.28Å; K276-D303 VanDerWaalsContact NZ-OD1 3.14Å; K276-D303 IonicContact NZ-OD2 3.03Å; K276-D303 PolarHBondContact NZ-OD2 2.96Å; S278-D303 WeakPolarHBondContact CB-OD1 2.97Å; S278-D303 PolarHBondContact OG-OD1 2.79Å; N300-D303 PolarHBondContact OD1-N 2.82Å; N300-D303 PolarHBondContact OD1-OD2 3.34Å; D303-F305 HydrophobicContact CB-CD2 4.45Å; D303-F305 HydrophobicContact CB-CE2 3.76Å; D303-F305 HydrophobicContact CB-CZ 4.08Å; D303-G318 PolarHBondContact O-N 3.45Å; D303-G318 VanDerWaalsContact O-N 3.14Å
304	V	95.5	Very high	94.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.4	168.1	171.3	0	0	0	0	110.1	L277 L306 V315 Y316 I317 C321 E325 A329	L277-V304 HydrophobicContact CB-CB 4.09Å; L277-V304 HydrophobicContact CB-CG1 4.23Å; L277-V304 HydrophobicContact CD2-CB 4.36Å; L277-V304 HydrophobicContact CD2-CG1 4.22Å; L277-V304 PolarHBondContact N-O 3Å; L277-V304 PolarHBondContact O-N 2.71Å; V304-L306 HydrophobicContact CG1-CD1 4.26Å; V304-V315 HydrophobicContact CG1-CG1 4.25Å; V304-Y316 CarbonylContact C-O 3.55Å; V304-Y316 WeakPolarHBondContact CA-O 3.48Å; V304-I317 HydrophobicContact CG2-CG1 4.48Å; V304-I317 HydrophobicContact CG2-CG2 4.39Å; V304-C321 HydrophobicContact CG2-CB 4.23Å; V304-E325 HydrophobicContact CG2-CB 3.9Å; V304-A329 HydrophobicContact CG1-CB 3.66Å; V304-A329 HydrophobicContact CG2-CB 4.34Å
305	F	97.2	Very high	94.5	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.013	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.4	178.5	-64.1	-96.6	0	0	0	112.2	I274 Y275 K276 S298 V299 N300 D303 I307 V315 Y316	I274-F305 HydrophobicContact CG2-CB 4.47Å; I274-F305 HydrophobicContact CG2-CD1 3.94Å; Y275-F305 CarbonylContact O-C 3.57Å; Y275-F305 VanDerWaalsContact O-CA 3.27Å; Y275-F305 WeakPolarHBondContact O-CA 3.47Å; K276-F305 HydrophobicContact CB-CD1 4.02Å; K276-F305 HydrophobicContact CB-CE1 3.79Å; K276-F305 HydrophobicContact CD-CE1 4.21Å; K276-F305 HydrophobicContact CD-CZ 4.23Å; K276-F305 HydrophobicContact CG-CE1 4.09Å; K276-F305 HydrophobicContact CG-CZ 4.34Å; S298-F305 WeakPolarHBondContact O-CE1 3.34Å; V299-F305 HydrophobicContact CB-CD2 4.44Å; V299-F305 HydrophobicContact CB-CG 4.38Å; V299-F305 HydrophobicContact CG1-CB 4.25Å; V299-F305 HydrophobicContact CG1-CD2 3.73Å; V299-F305 HydrophobicContact CG1-CE2 4.24Å; V299-F305 HydrophobicContact CG1-CG 3.98Å; V299-F305 HydrophobicContact CG2-CB 4.16Å; V299-F305 HydrophobicContact CG2-CD1 4.16Å; V299-F305 HydrophobicContact CG2-CG 4.06Å; N300-F305 WeakPolarHBondContact O-CE2 3.46Å; N300-F305 VanDerWaalsContact OD1-CE2 3.23Å; N300-F305 WeakPolarHBondContact OD1-CE2 3.26Å; N300-F305 WeakPolarHBondContact OD1-CZ 3.33Å; D303-F305 HydrophobicContact CB-CD2 4.45Å; D303-F305 HydrophobicContact CB-CE2 3.76Å; D303-F305 HydrophobicContact CB-CZ 4.08Å; F305-I307 HydrophobicContact CB-CG1 4.37Å; F305-V315 CarbonylContact O-C 3.51Å; F305-V315 WeakPolarHBondContact O-CA 3.33Å; F305-Y316 HydrophobicContact CD2-CD1 4.18Å; F305-Y316 PolarHBondContact N-O 3Å; F305-Y316 PolarHBondContact O-N 3.46Å
306	L	96.7	Very high	94.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114	168.7	-85	63.8	0	0	0	108.4	I274 Y275 F286 V304 L313 V315 A333 Y336	I274-L306 CarbonylContact C-O 3.58Å; I274-L306 VanDerWaalsContact CA-O 3.32Å; I274-L306 WeakPolarHBondContact CA-O 2.9Å; Y275-L306 PolarHBondContact N-O 2.73Å; Y275-L306 PolarHBondContact O-N 2.88Å; F286-L306 HydrophobicContact CE2-CB 4.44Å; F286-L306 HydrophobicContact CE2-CD1 4.29Å; F286-L306 HydrophobicContact CE2-CD2 3.72Å; F286-L306 HydrophobicContact CE2-CG 4.38Å; F286-L306 HydrophobicContact CZ-CD2 3.74Å; V304-L306 HydrophobicContact CG1-CD1 4.26Å; L306-L313 HydrophobicContact CB-CD1 4.27Å; L306-V315 HydrophobicContact CD1-CG1 4.27Å; L306-V315 HydrophobicContact CG-CG2 4.36Å; L306-A333 VanDerWaalsContact CD2-CA 3.47Å; L306-A333 HydrophobicContact CD2-CB 3.94Å; L306-A333 HydrophobicContact CG-CB 4.29Å; L306-Y336 HydrophobicContact CD2-CD1 4.46Å; L306-Y336 HydrophobicContact CD2-CG 4.37Å
307	I	96.9	Very high	94.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	99.7	-175	-55.8	144.8	0	0	0	107.4	I274 L294 V299 F305 F314 L359 W363	I274-I307 HydrophobicContact CG1-CG2 4.43Å; I274-I307 HydrophobicContact CG2-CG1 4.37Å; L294-I307 HydrophobicContact CD1-CG2 4.09Å; L294-I307 HydrophobicContact CD2-CG2 3.89Å; L294-I307 HydrophobicContact CG-CG2 4.5Å; V299-I307 HydrophobicContact CG2-CD1 4.09Å; V299-I307 HydrophobicContact CG2-CG1 4.11Å; F305-I307 HydrophobicContact CB-CG1 4.37Å; I307-F314 HydrophobicContact CB-CB 4.19Å; I307-F314 HydrophobicContact CD1-CB 4.37Å; I307-F314 PolarHBondContact N-O 3.11Å; I307-F314 PolarHBondContact O-N 2.88Å; I307-L359 HydrophobicContact CD1-CD1 4.16Å; I307-L359 HydrophobicContact CD1-CD2 4.47Å; I307-L359 HydrophobicContact CG2-CD1 4.22Å; I307-W363 HydrophobicContact CD1-CH2 3.57Å; I307-W363 HydrophobicContact CD1-CZ2 4.13Å; I307-W363 HydrophobicContact CG1-CH2 3.96Å; I307-W363 HydrophobicContact CG1-CZ3 4.49Å; I307-W363 HydrophobicContact CG2-CH2 3.96Å; I307-W363 HydrophobicContact CG2-CZ3 3.86Å
308	D	95.6	Very high	94.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	110.6	179.9	-169.7	-7.3	0	0	0	110.2	K272 C273 G310 L313 Y336 H342	K272-D308 CarbonylContact C-O 3.55Å; K272-D308 VanDerWaalsContact CA-O 3.24Å; K272-D308 WeakPolarHBondContact CA-O 3.41Å; C273-D308 PolarHBondContact N-O 3.47Å; C273-D308 PolarHBondContact O-N 2.86Å; D308-G310 VanDerWaalsContact C-N 3.29Å; D308-G310 VanDerWaalsContact OD1-CA 3.27Å; D308-G310 WeakPolarHBondContact OD1-CA 3.4Å; D308-G310 PolarHBondContact OD1-N 3.02Å; D308-L313 HydrophobicContact CB-CD1 4Å; D308-Y336 HydrophobicContact CB-CE1 4.19Å; D308-Y336 WeakPolarHBondContact OD2-CE1 3.23Å; D308-Y336 PolarHBondContact OD2-OH 3.13Å; D308-H342 IonicContact OD1-NE2 3.96Å; D308-H342 PolarHBondContact OD1-NE2 2.81Å; D308-H342 IonicContact OD2-CD2 2.75Å; D308-H342 IonicContact OD2-CE1 2.55Å; D308-H342 PolarHBondContact OD2-CE1 3.4Å; D308-H342 VanDerWaalsContact OD2-CE1 3.3Å; D308-H342 IonicContact OD2-NE2 2.84Å; D308-H342 PolarHBondContact OD2-NE2 3.03Å
309	A	93.7	Very high	94.5	Very high	3 Å²	3	23 Å²	23	3%	0.025	12%	0.118	C	C	.	.			trans	-86.4	-1.3	174.7	0	0	0	0	0	113.3	L294 Y311 H312 F314 A362	L294-A309 HydrophobicContact CD1-CB 3.92Å; A309-Y311 HydrophobicContact CB-CD1 4.23Å; A309-Y311 HydrophobicContact CB-CE1 3.76Å; A309-Y311 VanDerWaalsContact O-CD1 3.27Å; A309-Y311 WeakPolarHBondContact O-CD1 3.5Å; A309-Y311 PolarHBondContact O-N 3.29Å; A309-H312 PolarHBondContact N-O 3.46Å; A309-F314 HydrophobicContact CB-CE2 4.24Å; A309-A362 HydrophobicContact CB-CB 4.14Å
310	G	91.4	Very high	94.4	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.01	14%	0.135	C	C	.	.	S	Bend	trans	83.5	-16.9	178.7	0	0	0	0	0	115.7	S270 D308	S270-G310 WeakPolarHBondContact OG-CA 3.5Å; S270-G310 PolarHBondContact OG-O 3.06Å; D308-G310 VanDerWaalsContact C-N 3.29Å; D308-G310 VanDerWaalsContact OD1-CA 3.27Å; D308-G310 WeakPolarHBondContact OD1-CA 3.4Å; D308-G310 PolarHBondContact OD1-N 3.02Å
311	Y	90.8	Very high	94.2	Very high	113 Å²	113	26.3 Å²	26.3	44%	0.443	13%	0.126	S	C	.	.	S	Bend	trans	-119.1	-10.1	170.2	62.4	-90.9	0	0	0	112.7	A309 P346	A309-Y311 HydrophobicContact CB-CD1 4.23Å; A309-Y311 HydrophobicContact CB-CE1 3.76Å; A309-Y311 VanDerWaalsContact O-CD1 3.27Å; A309-Y311 WeakPolarHBondContact O-CD1 3.5Å; A309-Y311 PolarHBondContact O-N 3.29Å; Y311-P346 WeakPolarHBondContact O-CD 3.43Å
312	H	93.7	Very high	93.9	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.023	13%	0.131	C	C	.	.			trans	-156.3	133	-176.8	-155.5	133.8	0	0	0	108.7	A309 F314 P346 T348 E358	A309-H312 PolarHBondContact N-O 3.46Å; H312-F314 HydrophobicContact CB-CE2 3.84Å; H312-F314 HydrophobicContact CB-CZ 3.89Å; H312-F314 AromaticContact CD2-CE1 3.61Å; H312-F314 AromaticContact CD2-CE2 3.98Å; H312-F314 AromaticContact CD2-CZ 3.58Å; H312-F314 AromaticContact CG-CE2 3.95Å; H312-F314 AromaticContact CG-CZ 3.55Å; H312-F314 AromaticContact ND1-CZ 3.94Å; H312-F314 AromaticContact NE2-CE1 3.63Å; H312-F314 AromaticContact NE2-CZ 3.98Å; H312-P346 PolarHBondContact CD2-O 3.02Å; H312-T348 PolarHBondContact NE2-OG1 3.29Å; H312-E358 IonicContact CE1-OE2 2.7Å; H312-E358 PolarHBondContact CE1-OE2 3.14Å; H312-E358 IonicContact ND1-OE2 3.86Å
313	L	95.3	Very high	93.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.4	174.4	177.4	67.8	0	0	0	109.4	L306 D308 A333 Y336 L337 I345 P346 V347 T348	L306-L313 HydrophobicContact CB-CD1 4.27Å; D308-L313 HydrophobicContact CB-CD1 4Å; L313-A333 HydrophobicContact CD2-CB 3.99Å; L313-Y336 HydrophobicContact CD1-CD1 4.45Å; L313-Y336 HydrophobicContact CD1-CE1 4.32Å; L313-Y336 HydrophobicContact CD2-CD1 4.35Å; L313-L337 HydrophobicContact CB-CD2 4.38Å; L313-L337 HydrophobicContact CD2-CD1 3.68Å; L313-L337 HydrophobicContact CD2-CD2 3.97Å; L313-L337 HydrophobicContact CD2-CG 3.66Å; L313-I345 HydrophobicContact CB-CD1 3.97Å; L313-P346 PolarHBondContact N-O 3.12Å; L313-V347 HydrophobicContact CB-CG2 4.3Å; L313-V347 HydrophobicContact CD2-CG1 4.37Å; L313-V347 HydrophobicContact CD2-CG2 4.26Å; L313-V347 CarbonylContact O-C 3.58Å; L313-V347 VanDerWaalsContact O-CA 3.26Å; L313-V347 WeakPolarHBondContact O-CA 3.23Å; L313-T348 PolarHBondContact O-N 2.78Å
314	F	96.6	Very high	92.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132	172.5	-52.5	-90.4	0	0	0	109.5	I307 A309 H312 T348 I350 E358 L359 A362	I307-F314 HydrophobicContact CB-CB 4.19Å; I307-F314 HydrophobicContact CD1-CB 4.37Å; I307-F314 PolarHBondContact N-O 3.11Å; I307-F314 PolarHBondContact O-N 2.88Å; A309-F314 HydrophobicContact CB-CE2 4.24Å; H312-F314 HydrophobicContact CB-CE2 3.84Å; H312-F314 HydrophobicContact CB-CZ 3.89Å; H312-F314 AromaticContact CD2-CE1 3.61Å; H312-F314 AromaticContact CD2-CE2 3.98Å; H312-F314 AromaticContact CD2-CZ 3.58Å; H312-F314 AromaticContact CG-CE2 3.95Å; H312-F314 AromaticContact CG-CZ 3.55Å; H312-F314 AromaticContact ND1-CZ 3.94Å; H312-F314 AromaticContact NE2-CE1 3.63Å; H312-F314 AromaticContact NE2-CZ 3.98Å; F314-T348 CarbonylContact C-O 3.52Å; F314-T348 WeakPolarHBondContact CA-O 3.31Å; F314-T348 HydrophobicContact CD1-CG2 4.41Å; F314-I350 HydrophobicContact CD1-CD1 3.98Å; F314-E358 HydrophobicContact CE1-CB 3.96Å; F314-E358 HydrophobicContact CZ-CB 4.04Å; F314-L359 HydrophobicContact CB-CD1 3.93Å; F314-L359 HydrophobicContact CD1-CB 3.79Å; F314-L359 HydrophobicContact CD1-CD1 4.16Å; F314-L359 HydrophobicContact CD1-CG 4.44Å; F314-L359 HydrophobicContact CD2-CD1 3.75Å; F314-L359 HydrophobicContact CE1-CB 3.89Å; F314-L359 HydrophobicContact CE2-CD1 4.29Å; F314-L359 HydrophobicContact CG-CB 4.21Å; F314-L359 HydrophobicContact CG-CD1 3.68Å; F314-L359 HydrophobicContact CG-CG 4.4Å; F314-L359 HydrophobicContact CZ-CB 4.38Å; F314-A362 HydrophobicContact CE2-CB 3.82Å; F314-A362 HydrophobicContact CZ-CB 4.35Å
315	V	96.1	Very high	92.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.5	173.2	-176.9	0	0	0	0	106.9	V304 F305 L306 A329 A333 V347 T348 V349 I350	V304-V315 HydrophobicContact CG1-CG1 4.25Å; F305-V315 CarbonylContact O-C 3.51Å; F305-V315 WeakPolarHBondContact O-CA 3.33Å; L306-V315 HydrophobicContact CD1-CG1 4.27Å; L306-V315 HydrophobicContact CG-CG2 4.36Å; V315-A329 HydrophobicContact CG1-CB 4.01Å; V315-A333 HydrophobicContact CG2-CB 3.67Å; V315-V347 HydrophobicContact CG2-CG1 3.92Å; V315-T348 PolarHBondContact N-O 2.83Å; V315-V349 HydrophobicContact CB-CG1 4.44Å; V315-V349 HydrophobicContact CB-CG2 4.32Å; V315-V349 CarbonylContact O-C 3.5Å; V315-V349 WeakPolarHBondContact O-CA 3.3Å; V315-I350 PolarHBondContact O-N 3.17Å
316	Y	96.4	Very high	91.8	Very high	32 Å²	32	35.3 Å²	35.3	13%	0.125	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.7	178	179.8	-93.5	0	0	0	110	V299 N300 V304 F305 I350 S352	V299-Y316 HydrophobicContact CG1-CD1 3.43Å; V299-Y316 VanDerWaalsContact CG1-CD1 3.43Å; V299-Y316 HydrophobicContact CG1-CE1 3.79Å; V299-Y316 HydrophobicContact CG1-CG 3.85Å; N300-Y316 WeakPolarHBondContact O-CE1 3.23Å; V304-Y316 CarbonylContact C-O 3.55Å; V304-Y316 WeakPolarHBondContact CA-O 3.48Å; F305-Y316 HydrophobicContact CD2-CD1 4.18Å; F305-Y316 PolarHBondContact N-O 3Å; F305-Y316 PolarHBondContact O-N 3.46Å; Y316-I350 WeakPolarHBondContact CA-O 3.21Å; Y316-S352 WeakPolarHBondContact OH-CA 3.13Å; Y316-S352 WeakPolarHBondContact OH-CB 3.46Å
317	I	93.6	Very high	90.9	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.128	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	109.1	179.3	-57.3	178	0	0	0	108.5	V304 K326 V349 I350 S352	V304-I317 HydrophobicContact CG2-CG1 4.48Å; V304-I317 HydrophobicContact CG2-CG2 4.39Å; I317-K326 HydrophobicContact CD1-CG 4.39Å; I317-K326 HydrophobicContact CG2-CB 4.36Å; I317-K326 HydrophobicContact CG2-CD 4.28Å; I317-K326 HydrophobicContact CG2-CG 4Å; I317-V349 HydrophobicContact CD1-CG1 3.55Å; I317-V349 HydrophobicContact CG1-CG1 4.2Å; I317-I350 PolarHBondContact N-O 3.16Å; I317-S352 PolarHBondContact O-N 2.96Å
318	G	93.8	Very high	90.1	Very high	5 Å²	5	41.4 Å²	41.4	5%	0.052	21%	0.211	C	C	.	.			trans	-60.1	148.9	177.1	0	0	0	0	0	113.2	E301 D303 R320 C321	E301-G318 CarbonylContact O-C 3.56Å; E301-G318 VanDerWaalsContact O-C 3.28Å; E301-G318 WeakPolarHBondContact O-CA 3.27Å; D303-G318 PolarHBondContact O-N 3.45Å; D303-G318 VanDerWaalsContact O-N 3.14Å; G318-R320 PolarHBondContact O-N 2.78Å; G318-C321 PolarHBondContact O-SG 3.18Å
319	S	91.8	Very high	89.7	Confident	67 Å²	67	41.5 Å²	41.5	47%	0.469	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.4	175.9	49.6	0	0	0	0	112.8	E301 S352	E301-S319 PolarHBondContact O-N 2.98Å; E301-S319 VanDerWaalsContact O-N 3.14Å; E301-S319 PolarHBondContact OE2-OG 3.12Å; S319-S352 WeakPolarHBondContact CA-OG 3.42Å; S319-S352 WeakPolarHBondContact CB-OG 3.29Å; S319-S352 PolarHBondContact N-OG 3.34Å
320	R	91.7	Very high	89.2	Confident	132 Å²	132	42.8 Å²	42.8	50%	0.498	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	6.9	-175.7	-60.5	-173.9	-63.3	-79.3	-0.8	112.9	E301 D302 G318	E301-R320 WeakPolarHBondContact O-CB 3.47Å; E301-R320 PolarHBondContact O-N 3.42Å; E301-R320 IonicContact OE2-CZ 3.25Å; E301-R320 IonicContact OE2-NH1 3.73Å; E301-R320 PolarHBondContact OE2-NH1 2.9Å; D302-R320 IonicContact OD1-CZ 2.65Å; D302-R320 IonicContact OD1-NE 3.15Å; D302-R320 PolarHBondContact OD1-NE 3.45Å; D302-R320 IonicContact OD1-NH2 2.93Å; D302-R320 PolarHBondContact OD1-NH2 2.94Å; D302-R320 IonicContact OD2-NH2 3.99Å; D302-R320 PolarHBondContact OD2-NH2 2.82Å; G318-R320 PolarHBondContact O-N 2.78Å
321	C	89.3	Confident	88.7	Confident	21 Å²	21	44.2 Å²	44.2	14%	0.142	23%	0.228	C	C	.	.			trans	-62.9	151.1	175.9	81.2	0	0	0	0	111.3	D302 V304 G318 E325	D302-C321 WeakPolarHBondContact O-CA 3.17Å; D302-C321 PolarHBondContact O-N 2.88Å; V304-C321 HydrophobicContact CG2-CB 4.23Å; G318-C321 PolarHBondContact O-SG 3.18Å; C321-E325 WeakPolarHBondContact CA-OE2 3.34Å; C321-E325 VanDerWaalsContact CB-OE2 3.22Å; C321-E325 WeakPolarHBondContact CB-OE2 3.4Å
322	L	87.3	Confident	88.7	Confident	88 Å²	88	42.1 Å²	42.1	46%	0.461	22%	0.219	S	C	.	.			trans	-75.9	151	179.8	-76	172.5	0	0	0	111	D279 C324 E325 K326	D279-L322 WeakPolarHBondContact OD1-CD1 3.44Å; L322-C324 PolarHBondContact O-N 2.88Å; L322-C324 VanDerWaalsContact O-N 3.15Å; L322-E325 HydrophobicContact CB-CG 4.34Å; L322-E325 PolarHBondContact N-OE2 3.02Å; L322-E325 WeakPolarHBondContact O-CB 3.36Å; L322-E325 PolarHBondContact O-N 2.77Å; L322-K326 PolarHBondContact O-N 2.87Å; L322-K326 VanDerWaalsContact O-N 3.13Å
323	P	83.5	Confident	88.5	Confident	101 Å²	101	42 Å²	42	66%	0.656	22%	0.219	S	C	*	.	H	α-helix	trans	-56.2	-33.7	-178.6	-27.3	35.1	0	0	0	113.2	Q327	P323-Q327 VanDerWaalsContact O-CB 3.22Å; P323-Q327 WeakPolarHBondContact O-CB 3.19Å; P323-Q327 PolarHBondContact O-N 2.88Å
324	C	83.7	Confident	88	Confident	52 Å²	52	43.4 Å²	43.4	35%	0.351	23%	0.226	S	C	.	.	H	α-helix	trans	-64.2	-42.2	177.9	-162	0	0	0	0	111.6	L284 L322 Q327 N328	L284-C324 HydrophobicContact CD1-CB 4.08Å; L284-C324 WeakPolarHBondContact CD1-SG 3.5Å; L322-C324 PolarHBondContact O-N 2.88Å; L322-C324 VanDerWaalsContact O-N 3.15Å; C324-Q327 PolarHBondContact O-N 3.19Å; C324-N328 WeakPolarHBondContact O-CB 3.38Å; C324-N328 PolarHBondContact O-N 2.89Å; C324-N328 PolarHBondContact O-ND2 2.76Å
325	E	85.9	Confident	87.6	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-49.4	177.1	-58.5	167.7	165.7	0	0	110.8	S278 D279 V304 C321 L322 Q327 N328 A329	S278-E325 WeakPolarHBondContact CA-OE1 3.4Å; D279-E325 HydrophobicContact CB-CG 4.43Å; D279-E325 PolarHBondContact N-OE1 2.9Å; V304-E325 HydrophobicContact CG2-CB 3.9Å; C321-E325 WeakPolarHBondContact CA-OE2 3.34Å; C321-E325 VanDerWaalsContact CB-OE2 3.22Å; C321-E325 WeakPolarHBondContact CB-OE2 3.4Å; L322-E325 HydrophobicContact CB-CG 4.34Å; L322-E325 PolarHBondContact N-OE2 3.02Å; L322-E325 WeakPolarHBondContact O-CB 3.36Å; L322-E325 PolarHBondContact O-N 2.77Å; E325-Q327 VanDerWaalsContact C-N 3.27Å; E325-Q327 PolarHBondContact O-N 3.27Å; E325-N328 PolarHBondContact O-N 2.6Å; E325-N328 VanDerWaalsContact O-N 3.12Å; E325-A329 PolarHBondContact O-N 3.21Å
326	K	83.9	Confident	87.4	Confident	94 Å²	94	50.4 Å²	50.4	41%	0.409	26%	0.257	S	S	.	.	H	α-helix	trans	-55.6	-44.5	176.7	-176.6	175.8	179.9	-176.8	0	111	E122 I317 L322 N328	E122-K326 IonicContact OE2-NZ 3.21Å; E122-K326 PolarHBondContact OE2-NZ 3.11Å; I317-K326 HydrophobicContact CD1-CG 4.39Å; I317-K326 HydrophobicContact CG2-CB 4.36Å; I317-K326 HydrophobicContact CG2-CD 4.28Å; I317-K326 HydrophobicContact CG2-CG 4Å; L322-K326 PolarHBondContact O-N 2.87Å; L322-K326 VanDerWaalsContact O-N 3.13Å; K326-N328 VanDerWaalsContact C-N 3.33Å; K326-N328 PolarHBondContact O-N 2.78Å
327	Q	77.4	Confident	87.2	Confident	80 Å²	80	48.9 Å²	48.9	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-64.8	-35.5	-179.9	-167.2	178.5	12.6	0	0	112.4	F20 G21 P323 C324 E325	F20-Q327 VanDerWaalsContact O-O 3.09Å; G21-Q327 PolarHBondContact O-NE2 2.81Å; P323-Q327 VanDerWaalsContact O-CB 3.22Å; P323-Q327 WeakPolarHBondContact O-CB 3.19Å; P323-Q327 PolarHBondContact O-N 2.88Å; C324-Q327 PolarHBondContact O-N 3.19Å; E325-Q327 VanDerWaalsContact C-N 3.27Å; E325-Q327 PolarHBondContact O-N 3.27Å
328	N	81.6	Confident	86.9	Confident	48 Å²	48	51.7 Å²	51.7	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-92.8	-13.6	-176.4	-74.6	-71.3	0	0	0	114.1	L277 L284 C324 E325 K326 L330 S331 Y332	L277-N328 HydrophobicContact CD2-CB 4.38Å; L284-N328 HydrophobicContact CD2-CB 3.64Å; C324-N328 WeakPolarHBondContact O-CB 3.38Å; C324-N328 PolarHBondContact O-N 2.89Å; C324-N328 PolarHBondContact O-ND2 2.76Å; E325-N328 PolarHBondContact O-N 2.6Å; E325-N328 VanDerWaalsContact O-N 3.12Å; K326-N328 VanDerWaalsContact C-N 3.33Å; K326-N328 PolarHBondContact O-N 2.78Å; N328-L330 VanDerWaalsContact C-N 3.34Å; N328-L330 PolarHBondContact O-N 3.02Å; N328-S331 WeakPolarHBondContact O-CB 3.37Å; N328-S331 PolarHBondContact O-N 3.23Å; N328-Y332 HydrophobicContact CB-CD2 3.97Å; N328-Y332 HydrophobicContact CB-CE2 4.03Å; N328-Y332 WeakPolarHBondContact O-CD2 3.42Å; N328-Y332 PolarHBondContact O-N 3.34Å
329	A	86	Confident	86.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-46.2	-51.4	-173.6	0	0	0	0	0	114.1	V304 V315 E325 Y332 A333	V304-A329 HydrophobicContact CG1-CB 3.66Å; V304-A329 HydrophobicContact CG2-CB 4.34Å; V315-A329 HydrophobicContact CG1-CB 4.01Å; E325-A329 PolarHBondContact O-N 3.21Å; A329-Y332 PolarHBondContact O-N 3.28Å; A329-A333 WeakPolarHBondContact O-CB 3.47Å; A329-A333 PolarHBondContact O-N 2.92Å
330	L	82.6	Confident	86.5	Confident	31 Å²	31	55 Å²	55	16%	0.162	28%	0.275	C	S	.	.	H	α-helix	trans	-74.2	-30.9	-177	-80	174.5	0	0	0	113.6	F20 N328 A333 H334 V349	F20-L330 HydrophobicContact CB-CD1 4.25Å; F20-L330 HydrophobicContact CD1-CD1 3.68Å; F20-L330 HydrophobicContact CD2-CB 4.19Å; F20-L330 HydrophobicContact CD2-CD1 3.3Å; F20-L330 HydrophobicContact CD2-CG 4.37Å; F20-L330 HydrophobicContact CE1-CD1 3.66Å; F20-L330 HydrophobicContact CE2-CD1 3.32Å; F20-L330 HydrophobicContact CG-CD1 3.5Å; F20-L330 VanDerWaalsContact CG-CD1 3.5Å; F20-L330 HydrophobicContact CZ-CD1 3.52Å; N328-L330 VanDerWaalsContact C-N 3.34Å; N328-L330 PolarHBondContact O-N 3.02Å; L330-A333 PolarHBondContact O-N 3.41Å; L330-H334 VanDerWaalsContact O-CB 3.32Å; L330-H334 WeakPolarHBondContact O-CB 3.27Å; L330-H334 PolarHBondContact O-N 2.8Å; L330-V349 HydrophobicContact CD1-CG2 4.2Å; L330-V349 HydrophobicContact CD2-CG2 3.5Å; L330-V349 HydrophobicContact CG-CG2 4.17Å
331	S	82.1	Confident	86.3	Confident	30 Å²	30	59.5 Å²	59.5	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-48	172.1	-178.8	0	0	0	0	111.1	L19 N328 A333 H334 H335	L19-S331 WeakPolarHBondContact CD1-OG 3.49Å; L19-S331 VanDerWaalsContact CD2-CA 3.44Å; N328-S331 WeakPolarHBondContact O-CB 3.37Å; N328-S331 PolarHBondContact O-N 3.23Å; S331-A333 PolarHBondContact O-N 3.18Å; S331-H334 PolarHBondContact O-N 2.96Å; S331-H335 WeakPolarHBondContact O-CB 3.31Å; S331-H335 PolarHBondContact O-N 3.39Å
332	Y	89.5	Confident	86.3	Confident	69 Å²	69	58.8 Å²	58.8	27%	0.271	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-40.4	176.9	-84.3	-104	0	0	0	111.5	L277 L284 F286 N328 A329 H334 H335 Y336	L277-Y332 HydrophobicContact CD1-CD1 3.7Å; L277-Y332 HydrophobicContact CD1-CD2 4.04Å; L277-Y332 HydrophobicContact CD1-CE1 3.78Å; L277-Y332 HydrophobicContact CD1-CE2 4.13Å; L277-Y332 HydrophobicContact CD1-CG 3.81Å; L277-Y332 HydrophobicContact CD2-CD2 4.32Å; L277-Y332 HydrophobicContact CD2-CG 4.32Å; L284-Y332 HydrophobicContact CD2-CD2 4.26Å; L284-Y332 HydrophobicContact CD2-CE2 3.48Å; L284-Y332 VanDerWaalsContact CD2-CE2 3.48Å; F286-Y332 HydrophobicContact CB-CD1 3.73Å; F286-Y332 HydrophobicContact CB-CE1 3.62Å; F286-Y332 HydrophobicContact CD1-CD1 4.23Å; F286-Y332 AromaticContact CD2-CD1 3.82Å; F286-Y332 HydrophobicContact CD2-CD1 3.82Å; F286-Y332 AromaticContact CG-CD1 3.65Å; F286-Y332 HydrophobicContact CG-CD1 3.65Å; F286-Y332 HydrophobicContact CG-CE1 4.08Å; N328-Y332 HydrophobicContact CB-CD2 3.97Å; N328-Y332 HydrophobicContact CB-CE2 4.03Å; N328-Y332 WeakPolarHBondContact O-CD2 3.42Å; N328-Y332 PolarHBondContact O-N 3.34Å; A329-Y332 PolarHBondContact O-N 3.28Å; Y332-H334 PolarHBondContact O-N 3.36Å; Y332-H335 PolarHBondContact O-N 2.85Å; Y332-Y336 WeakPolarHBondContact O-CB 3.39Å; Y332-Y336 PolarHBondContact O-N 2.78Å
333	A	90.8	Very high	86.4	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-44.1	174.7	0	0	0	0	0	112.7	L306 L313 V315 A329 L330 S331 L337	L306-A333 VanDerWaalsContact CD2-CA 3.47Å; L306-A333 HydrophobicContact CD2-CB 3.94Å; L306-A333 HydrophobicContact CG-CB 4.29Å; L313-A333 HydrophobicContact CD2-CB 3.99Å; V315-A333 HydrophobicContact CG2-CB 3.67Å; A329-A333 WeakPolarHBondContact O-CB 3.47Å; A329-A333 PolarHBondContact O-N 2.92Å; L330-A333 PolarHBondContact O-N 3.41Å; S331-A333 PolarHBondContact O-N 3.18Å; A333-L337 WeakPolarHBondContact O-CG 3.42Å; A333-L337 PolarHBondContact O-N 3.4Å
334	H	85.2	Confident	86.7	Confident	30 Å²	30	51.7 Å²	51.7	14%	0.139	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-47.5	177.4	-174.7	93.5	0	0	0	112	W12 L330 S331 Y332 Y336 L337 K338	W12-H334 AromaticContact CE3-CE1 2.99Å; W12-H334 AromaticContact CE3-ND1 3.84Å; W12-H334 AromaticContact CE3-NE2 3.27Å; W12-H334 VanDerWaalsContact CE3-NE2 3.27Å; W12-H334 AromaticContact CH2-CE1 3.97Å; W12-H334 AromaticContact CZ3-CD2 3.65Å; W12-H334 AromaticContact CZ3-CE1 2.98Å; W12-H334 WeakPolarHBondContact CZ3-CE1 3.41Å; W12-H334 AromaticContact CZ3-CG 3.85Å; W12-H334 AromaticContact CZ3-ND1 3.45Å; W12-H334 WeakPolarHBondContact CZ3-ND1 3.48Å; W12-H334 AromaticContact CZ3-NE2 3.08Å; W12-H334 WeakPolarHBondContact CZ3-NE2 3.25Å; L330-H334 VanDerWaalsContact O-CB 3.32Å; L330-H334 WeakPolarHBondContact O-CB 3.27Å; L330-H334 PolarHBondContact O-N 2.8Å; S331-H334 PolarHBondContact O-N 2.96Å; Y332-H334 PolarHBondContact O-N 3.36Å; H334-Y336 VanDerWaalsContact C-N 3.33Å; H334-Y336 PolarHBondContact O-N 2.81Å; H334-L337 PolarHBondContact O-N 2.57Å; H334-K338 WeakPolarHBondContact O-CB 2.99Å; H334-K338 PolarHBondContact O-N 2.64Å
335	H	88	Confident	87.1	Confident	120 Å²	120	49.4 Å²	49.4	56%	0.556	23%	0.227	S	C	*	.	H	α-helix	trans	-63.2	-41.1	178	-169.5	84.6	0	0	0	111.6	S331 Y332 K338 N339	S331-H335 WeakPolarHBondContact O-CB 3.31Å; S331-H335 PolarHBondContact O-N 3.39Å; Y332-H335 PolarHBondContact O-N 2.85Å; H335-K338 PolarHBondContact O-N 3.46Å; H335-N339 PolarHBondContact CD2-ND2 2.74Å; H335-N339 PolarHBondContact NE2-ND2 2.56Å; H335-N339 PolarHBondContact O-N 2.55Å; H335-N339 PolarHBondContact O-ND2 2.73Å
336	Y	92.2	Very high	87.5	Confident	27 Å²	27	49.6 Å²	49.6	11%	0.106	23%	0.229	C	C	.	.	H	α-helix	trans	-56.4	-58	173.9	171.3	-103.7	0	0	0	110.5	C273 Y275 F286 L306 D308 L313 Y332 H334 K338 N339 T340	C273-Y336 PolarHBondContact SG-OH 2.88Å; Y275-Y336 HydrophobicContact CD2-CD2 4.5Å; Y275-Y336 AromaticContact CD2-CE2 3.97Å; Y275-Y336 HydrophobicContact CD2-CE2 3.97Å; Y275-Y336 HydrophobicContact CE2-CD2 4.13Å; Y275-Y336 AromaticContact CE2-CE2 3.29Å; Y275-Y336 HydrophobicContact CE2-CE2 3.29Å; Y275-Y336 AromaticContact CE2-CZ 3.72Å; Y275-Y336 AromaticContact CZ-CE2 3.63Å; F286-Y336 HydrophobicContact CE1-CD2 4.17Å; F286-Y336 HydrophobicContact CZ-CD2 4.19Å; F286-Y336 HydrophobicContact CZ-CG 4.43Å; L306-Y336 HydrophobicContact CD2-CD1 4.46Å; L306-Y336 HydrophobicContact CD2-CG 4.37Å; D308-Y336 HydrophobicContact CB-CE1 4.19Å; D308-Y336 WeakPolarHBondContact OD2-CE1 3.23Å; D308-Y336 PolarHBondContact OD2-OH 3.13Å; L313-Y336 HydrophobicContact CD1-CD1 4.45Å; L313-Y336 HydrophobicContact CD1-CE1 4.32Å; L313-Y336 HydrophobicContact CD2-CD1 4.35Å; Y332-Y336 WeakPolarHBondContact O-CB 3.39Å; Y332-Y336 PolarHBondContact O-N 2.78Å; H334-Y336 VanDerWaalsContact C-N 3.33Å; H334-Y336 PolarHBondContact O-N 2.81Å; Y336-K338 VanDerWaalsContact C-N 3.27Å; Y336-K338 PolarHBondContact O-N 3.44Å; Y336-N339 WeakPolarHBondContact O-CA 3.43Å; Y336-N339 PolarHBondContact O-N 2.91Å; Y336-T340 HydrophobicContact CD1-CG2 4.09Å; Y336-T340 HydrophobicContact CD2-CG2 4.4Å; Y336-T340 HydrophobicContact CE1-CG2 3.65Å; Y336-T340 HydrophobicContact CE2-CG2 4Å; Y336-T340 HydrophobicContact CG-CG2 4.44Å; Y336-T340 WeakPolarHBondContact O-CG2 3.21Å; Y336-T340 PolarHBondContact O-N 3.13Å
337	L	90.6	Very high	88	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-39.2	-177.6	-77.5	178.2	0	0	0	113.1	L313 A333 H334 N339 T340 P343 I345 V347	L313-L337 HydrophobicContact CB-CD2 4.38Å; L313-L337 HydrophobicContact CD2-CD1 3.68Å; L313-L337 HydrophobicContact CD2-CD2 3.97Å; L313-L337 HydrophobicContact CD2-CG 3.66Å; A333-L337 WeakPolarHBondContact O-CG 3.42Å; A333-L337 PolarHBondContact O-N 3.4Å; H334-L337 PolarHBondContact O-N 2.57Å; L337-N339 PolarHBondContact O-N 2.77Å; L337-T340 PolarHBondContact O-N 3.3Å; L337-T340 PolarHBondContact O-OG1 3.07Å; L337-P343 WeakPolarHBondContact O-CA 3.38Å; L337-I345 HydrophobicContact CD2-CD1 3.96Å; L337-I345 HydrophobicContact CD2-CG1 3.85Å; L337-V347 HydrophobicContact CD1-CG2 3.51Å
338	K	87.8	Confident	88.9	Confident	84 Å²	84	41.7 Å²	41.7	37%	0.365	19%	0.194	S	C	.	.	H	α-helix	trans	-57.3	-29.5	176.7	-178.8	171.5	169.7	176.3	0	112.8	W12 Q13 H334 H335 Y336	W12-K338 HydrophobicContact CH2-CB 4.04Å; W12-K338 HydrophobicContact CZ3-CB 4.17Å; Q13-K338 HydrophobicContact CB-CD 4.18Å; Q13-K338 HydrophobicContact CG-CD 4.42Å; Q13-K338 HydrophobicContact CG-CG 4.25Å; Q13-K338 PolarHBondContact O-NZ 3.3Å; H334-K338 WeakPolarHBondContact O-CB 2.99Å; H334-K338 PolarHBondContact O-N 2.64Å; H335-K338 PolarHBondContact O-N 3.46Å; Y336-K338 VanDerWaalsContact C-N 3.27Å; Y336-K338 PolarHBondContact O-N 3.44Å
339	N	89.2	Confident	89.5	Confident	114 Å²	114	40.2 Å²	40.2	61%	0.61	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	3	179.3	-64.8	-58.2	0	0	0	113.5	H335 Y336 L337	H335-N339 PolarHBondContact CD2-ND2 2.74Å; H335-N339 PolarHBondContact NE2-ND2 2.56Å; H335-N339 PolarHBondContact O-N 2.55Å; H335-N339 PolarHBondContact O-ND2 2.73Å; Y336-N339 WeakPolarHBondContact O-CA 3.43Å; Y336-N339 PolarHBondContact O-N 2.91Å; L337-N339 PolarHBondContact O-N 2.77Å
340	T	88.9	Confident	89.9	Confident	29 Å²	29	40.3 Å²	40.3	18%	0.178	19%	0.187	C	C	.	.	S	Bend	trans	-94.6	175.2	176.7	71.1	0	0	0	0	112.6	Y336 L337 H342	Y336-T340 HydrophobicContact CD1-CG2 4.09Å; Y336-T340 HydrophobicContact CD2-CG2 4.4Å; Y336-T340 HydrophobicContact CE1-CG2 3.65Å; Y336-T340 HydrophobicContact CE2-CG2 4Å; Y336-T340 HydrophobicContact CG-CG2 4.44Å; Y336-T340 WeakPolarHBondContact O-CG2 3.21Å; Y336-T340 PolarHBondContact O-N 3.13Å; L337-T340 PolarHBondContact O-N 3.3Å; L337-T340 PolarHBondContact O-OG1 3.07Å; T340-H342 PolarHBondContact O-N 3.37Å; T340-H342 PolarHBondContact OG1-N 3.16Å
341	R	87.3	Confident	90.3	Very high	225 Å²	225	39.4 Å²	39.4	85%	0.849	19%	0.185	S	C	*	.	S	Bend	trans	-78.6	-6.6	172.2	-64.8	-177	179.9	-177.2	0	113.1	Y267 P343	Y267-R341 WeakPolarHBondContact CD1-O 3.43Å; Y267-R341 WeakPolarHBondContact CE1-O 3.33Å; R341-P343 VanDerWaalsContact C-CD 3.46Å
342	H	89.3	Confident	90.6	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.032	19%	0.188	C	C	.	.			trans	-135.3	52.6	-168.1	51.9	-90.7	0	0	0	113.4	Y267 S270 D308 T340 F344 I345	Y267-H342 HydrophobicContact CD1-CB 3.74Å; Y267-H342 HydrophobicContact CD2-CB 3.62Å; Y267-H342 HydrophobicContact CE1-CB 4.15Å; Y267-H342 HydrophobicContact CE2-CB 3.99Å; Y267-H342 HydrophobicContact CG-CB 3.46Å; Y267-H342 VanDerWaalsContact CG-CB 3.46Å; S270-H342 VanDerWaalsContact CB-CE1 3.46Å; S270-H342 WeakPolarHBondContact CB-CE1 3.19Å; S270-H342 VanDerWaalsContact CB-ND1 3.34Å; S270-H342 WeakPolarHBondContact CB-ND1 3.2Å; S270-H342 PolarHBondContact OG-CE1 3.23Å; S270-H342 PolarHBondContact OG-ND1 3.24Å; D308-H342 IonicContact OD1-NE2 3.96Å; D308-H342 PolarHBondContact OD1-NE2 2.81Å; D308-H342 IonicContact OD2-CD2 2.75Å; D308-H342 IonicContact OD2-CE1 2.55Å; D308-H342 PolarHBondContact OD2-CE1 3.4Å; D308-H342 VanDerWaalsContact OD2-CE1 3.3Å; D308-H342 IonicContact OD2-NE2 2.84Å; D308-H342 PolarHBondContact OD2-NE2 3.03Å; T340-H342 PolarHBondContact O-N 3.37Å; T340-H342 PolarHBondContact OG1-N 3.16Å; H342-F344 PolarHBondContact O-N 3.1Å; H342-F344 VanDerWaalsContact O-N 3.09Å; H342-I345 HydrophobicContact CB-CG2 3.9Å; H342-I345 WeakPolarHBondContact CD2-CD1 3.12Å; H342-I345 WeakPolarHBondContact O-CG1 3.29Å; H342-I345 PolarHBondContact O-N 2.7Å
343	P	89.5	Confident	90.4	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.084	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.4	-172.4	23.3	-36.1	0	0	0	115.4	W12 R128 Y267 L337 R341	W12-P343 HydrophobicContact CH2-CB 4.45Å; W12-P343 HydrophobicContact CZ2-CB 3.77Å; W12-P343 WeakPolarHBondContact CZ2-O 3.48Å; R128-P343 PolarHBondContact NH2-O 3.06Å; Y267-P343 VanDerWaalsContact OH-CD 3.26Å; Y267-P343 WeakPolarHBondContact OH-CD 3.35Å; Y267-P343 WeakPolarHBondContact OH-CG 3.26Å; L337-P343 WeakPolarHBondContact O-CA 3.38Å; R341-P343 VanDerWaalsContact C-CD 3.46Å
344	F	89.5	Confident	90.4	Very high	26 Å²	26	42 Å²	42	11%	0.114	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	0.7	-172.7	-54.4	-60.6	0	0	0	115	W12 V130 Y133 Y267 H342	W12-F344 AromaticContact CD1-CD1 3.88Å; W12-F344 AromaticContact CD1-CE1 3.45Å; W12-F344 VanDerWaalsContact CD1-CE1 3.45Å; W12-F344 AromaticContact NE1-CD1 3.18Å; W12-F344 AromaticContact NE1-CE1 3.01Å; V130-F344 HydrophobicContact CG1-CB 4.16Å; V130-F344 HydrophobicContact CG1-CD1 4.23Å; Y133-F344 WeakPolarHBondContact CB-O 3.32Å; Y133-F344 HydrophobicContact CD1-CB 4.4Å; Y133-F344 HydrophobicContact CD2-CB 3.46Å; Y133-F344 VanDerWaalsContact CD2-CB 3.46Å; Y133-F344 HydrophobicContact CD2-CD2 4.49Å; Y133-F344 HydrophobicContact CD2-CG 4.28Å; Y133-F344 HydrophobicContact CE2-CB 3.69Å; Y133-F344 AromaticContact CE2-CD2 3.86Å; Y133-F344 HydrophobicContact CE2-CD2 3.86Å; Y133-F344 HydrophobicContact CE2-CG 4.11Å; Y133-F344 HydrophobicContact CG-CB 3.85Å; Y267-F344 HydrophobicContact CE2-CB 4.17Å; Y267-F344 WeakPolarHBondContact OH-CD2 3.33Å; Y267-F344 PolarHBondContact OH-N 3.46Å; H342-F344 PolarHBondContact O-N 3.1Å; H342-F344 VanDerWaalsContact O-N 3.09Å
345	I	91.5	Very high	90.5	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	22%	0.216	C	C	.	.	S	Bend	trans	-57.7	155.2	179.5	61.6	169.7	0	0	0	111.9	R128 Y267 L313 L337 H342	R128-I345 PolarHBondContact NH2-O 2.83Å; Y267-I345 HydrophobicContact CD2-CG2 3.71Å; Y267-I345 HydrophobicContact CE2-CG2 4.14Å; L313-I345 HydrophobicContact CB-CD1 3.97Å; L337-I345 HydrophobicContact CD2-CD1 3.96Å; L337-I345 HydrophobicContact CD2-CG1 3.85Å; H342-I345 HydrophobicContact CB-CG2 3.9Å; H342-I345 WeakPolarHBondContact CD2-CD1 3.12Å; H342-I345 WeakPolarHBondContact O-CG1 3.29Å; H342-I345 PolarHBondContact O-N 2.7Å
346	P	93.5	Very high	90.7	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.052	19%	0.194	C	C	.	.			trans	-54.4	147.8	173	-19.7	27.7	0	0	0	111.7	R128 Y133 Y311 H312 L313	R128-P346 WeakPolarHBondContact O-CA 3.49Å; Y133-P346 WeakPolarHBondContact O-CD 3.19Å; Y133-P346 WeakPolarHBondContact O-CG 3.28Å; Y311-P346 WeakPolarHBondContact O-CD 3.43Å; H312-P346 PolarHBondContact CD2-O 3.02Å; L313-P346 PolarHBondContact N-O 3.12Å
347	V	95	Very high	90.7	Very high	8 Å²	8	43.5 Å²	43.5	5%	0.048	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.9	169.6	-174.9	0	0	0	0	108.5	H127 R128 L313 V315 L337	H127-V347 CarbonylContact C-O 3.52Å; H127-V347 WeakPolarHBondContact CA-O 3.5Å; R128-V347 HydrophobicContact CB-CB 3.92Å; R128-V347 HydrophobicContact CB-CG2 4.42Å; R128-V347 PolarHBondContact N-O 2.82Å; R128-V347 PolarHBondContact O-N 3.1Å; L313-V347 HydrophobicContact CB-CG2 4.3Å; L313-V347 HydrophobicContact CD2-CG1 4.37Å; L313-V347 HydrophobicContact CD2-CG2 4.26Å; L313-V347 CarbonylContact O-C 3.58Å; L313-V347 VanDerWaalsContact O-CA 3.26Å; L313-V347 WeakPolarHBondContact O-CA 3.23Å; V315-V347 HydrophobicContact CG2-CG1 3.92Å; L337-V347 HydrophobicContact CD1-CG2 3.51Å
348	T	96.1	Very high	90.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.4	174.1	-62.6	0	0	0	0	110	V125 Q126 H127 H312 L313 F314 V315 I350	V125-T348 HydrophobicContact CG1-CG2 3.4Å; V125-T348 VanDerWaalsContact CG1-CG2 3.4Å; Q126-T348 CarbonylContact O-C 3.55Å; Q126-T348 WeakPolarHBondContact O-CA 3.44Å; H127-T348 VanDerWaalsContact CE1-CG2 3.47Å; H127-T348 WeakPolarHBondContact CE1-CG2 3.45Å; H127-T348 PolarHBondContact ND1-OG1 2.82Å; H312-T348 PolarHBondContact NE2-OG1 3.29Å; L313-T348 PolarHBondContact O-N 2.78Å; F314-T348 CarbonylContact C-O 3.52Å; F314-T348 WeakPolarHBondContact CA-O 3.31Å; F314-T348 HydrophobicContact CD1-CG2 4.41Å; V315-T348 PolarHBondContact N-O 2.83Å; T348-I350 HydrophobicContact CG2-CD1 3.93Å; T348-I350 HydrophobicContact CG2-CG1 3.68Å
349	V	94.6	Very high	91.1	Very high	16 Å²	16	41 Å²	41	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.4	177.3	-170.1	0	0	0	0	108.6	V125 Q126 V315 I317 L330	V125-V349 WeakPolarHBondContact CG1-O 3.39Å; Q126-V349 HydrophobicContact CB-CB 4.24Å; Q126-V349 PolarHBondContact N-O 3.45Å; Q126-V349 PolarHBondContact O-N 2.91Å; V315-V349 HydrophobicContact CB-CG1 4.44Å; V315-V349 HydrophobicContact CB-CG2 4.32Å; V315-V349 CarbonylContact O-C 3.5Å; V315-V349 WeakPolarHBondContact O-CA 3.3Å; I317-V349 HydrophobicContact CD1-CG1 3.55Å; I317-V349 HydrophobicContact CG1-CG1 4.2Å; L330-V349 HydrophobicContact CD1-CG2 4.2Å; L330-V349 HydrophobicContact CD2-CG2 3.5Å; L330-V349 HydrophobicContact CG-CG2 4.17Å
350	I	94.2	Very high	91.4	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.4	-171.3	-51.7	162.1	0	0	0	108.3	V125 F314 V315 Y316 I317 T348 Q354 S356 L359	V125-I350 HydrophobicContact CG1-CG1 4Å; F314-I350 HydrophobicContact CD1-CD1 3.98Å; V315-I350 PolarHBondContact O-N 3.17Å; Y316-I350 WeakPolarHBondContact CA-O 3.21Å; I317-I350 PolarHBondContact N-O 3.16Å; T348-I350 HydrophobicContact CG2-CD1 3.93Å; T348-I350 HydrophobicContact CG2-CG1 3.68Å; I350-Q354 HydrophobicContact CG2-CB 3.9Å; I350-S356 VanDerWaalsContact CD1-CB 3.43Å; I350-L359 HydrophobicContact CD1-CB 3.91Å; I350-L359 HydrophobicContact CD1-CD2 3.55Å; I350-L359 HydrophobicContact CD1-CG 4.34Å
351	G	92	Very high	91.5	Very high	12 Å²	12	47.1 Å²	47.1	12%	0.124	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	155.8	167.8	0	0	0	0	0	112.3	N353 Q354	G351-N353 PolarHBondContact O-N 3.14Å; G351-N353 VanDerWaalsContact O-N 3.12Å; G351-Q354 WeakPolarHBondContact O-CA 3.41Å; G351-Q354 WeakPolarHBondContact O-CB 3.44Å; G351-Q354 PolarHBondContact O-N 2.75Å
352	S	88	Confident	91.8	Very high	38 Å²	38	36.5 Å²	36.5	27%	0.266	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-30.6	175.6	53.4	0	0	0	0	116.1	Y316 I317 S319 Q354	Y316-S352 WeakPolarHBondContact OH-CA 3.13Å; Y316-S352 WeakPolarHBondContact OH-CB 3.46Å; I317-S352 PolarHBondContact O-N 2.96Å; S319-S352 WeakPolarHBondContact CA-OG 3.42Å; S319-S352 WeakPolarHBondContact CB-OG 3.29Å; S319-S352 PolarHBondContact N-OG 3.34Å; S352-Q354 VanDerWaalsContact C-N 3.35Å
353	N	85.4	Confident	92.1	Very high	89 Å²	89	37.6 Å²	37.6	48%	0.476	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-4.7	176.3	63.3	-36.1	0	0	0	113.7	Q123 G351	Q123-N353 PolarHBondContact NE2-ND2 2.91Å; Q123-N353 PolarHBondContact OE1-ND2 3.37Å; G351-N353 PolarHBondContact O-N 3.14Å; G351-N353 VanDerWaalsContact O-N 3.12Å
354	Q	90.6	Very high	92.1	Very high	29 Å²	29	39.6 Å²	39.6	14%	0.136	20%	0.199	C	C	.	.			trans	-101.8	169.3	-176.7	-57.5	173.7	-12	0	0	110.7	E122 A124 V125 I350 G351 S352	E122-Q354 PolarHBondContact O-NE2 2.76Å; A124-Q354 VanDerWaalsContact C-NE2 3.31Å; A124-Q354 PolarHBondContact O-NE2 3.05Å; A124-Q354 PolarHBondContact O-OE1 2.75Å; V125-Q354 HydrophobicContact CG2-CB 3.92Å; V125-Q354 HydrophobicContact CG2-CG 4.47Å; I350-Q354 HydrophobicContact CG2-CB 3.9Å; G351-Q354 WeakPolarHBondContact O-CA 3.41Å; G351-Q354 WeakPolarHBondContact O-CB 3.44Å; G351-Q354 PolarHBondContact O-N 2.75Å; S352-Q354 VanDerWaalsContact C-N 3.35Å
355	S	87.5	Confident	91.9	Very high	59 Å²	59	49.6 Å²	49.6	41%	0.413	24%	0.236	S	C	.	.			trans	-142.4	134.9	-176.4	59.8	0	0	0	0	110	K85	K85-S355 WeakPolarHBondContact CE-OG 3.48Å; K85-S355 PolarHBondContact NZ-OG 3.32Å
356	S	92.4	Very high	90.7	Very high	11 Å²	11	53.8 Å²	53.8	8%	0.077	26%	0.259	C	S	.	.			trans	-126.1	120.6	174.8	171.7	0	0	0	0	110.2	I350 E358 L359 E360	I350-S356 VanDerWaalsContact CD1-CB 3.43Å; S356-E358 PolarHBondContact O-N 2.92Å; S356-E358 PolarHBondContact OG-N 3.11Å; S356-L359 PolarHBondContact O-N 3.19Å; S356-L359 PolarHBondContact OG-N 3.2Å; S356-E360 WeakPolarHBondContact O-CG 3.1Å; S356-E360 PolarHBondContact O-N 2.72Å
357	E	91.7	Very high	88.9	Confident	137 Å²	137	63.8 Å²	63.8	64%	0.64	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-32.8	174.1	-67	-167.8	174.6	0	0	112.3	E360 R361	E357-E360 PolarHBondContact O-N 2.69Å; E357-R361 WeakPolarHBondContact O-CG 3.34Å; E357-R361 PolarHBondContact O-N 3.01Å; E357-R361 VanDerWaalsContact O-N 3.08Å; E357-R361 IonicContact OE2-CZ 3.25Å; E357-R361 IonicContact OE2-NH2 3.73Å; E357-R361 PolarHBondContact OE2-NH2 3.05Å
358	E	93	Very high	86.8	Confident	22 Å²	22	67.4 Å²	67.4	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-67.5	-41.8	179	-67.4	-175.4	139	0	0	110.7	N136 L137 H312 F314 S356 R361 A362	N136-E358 PolarHBondContact N-OE1 2.98Å; L137-E358 PolarHBondContact N-OE1 2.58Å; L137-E358 VanDerWaalsContact N-OE1 3.1Å; H312-E358 IonicContact CE1-OE2 2.7Å; H312-E358 PolarHBondContact CE1-OE2 3.14Å; H312-E358 IonicContact ND1-OE2 3.86Å; F314-E358 HydrophobicContact CE1-CB 3.96Å; F314-E358 HydrophobicContact CZ-CB 4.04Å; S356-E358 PolarHBondContact O-N 2.92Å; S356-E358 PolarHBondContact OG-N 3.11Å; E358-R361 PolarHBondContact O-N 3.34Å; E358-A362 PolarHBondContact O-N 3.35Å; E358-A362 VanDerWaalsContact O-N 3.11Å
359	L	94.8	Very high	84.3	Confident	9 Å²	9	72.6 Å²	72.6	5%	0.047	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-43.6	173.6	179.1	57.2	0	0	0	111.7	I307 F314 I350 S356 R361 A362 W363	I307-L359 HydrophobicContact CD1-CD1 4.16Å; I307-L359 HydrophobicContact CD1-CD2 4.47Å; I307-L359 HydrophobicContact CG2-CD1 4.22Å; F314-L359 HydrophobicContact CB-CD1 3.93Å; F314-L359 HydrophobicContact CD1-CB 3.79Å; F314-L359 HydrophobicContact CD1-CD1 4.16Å; F314-L359 HydrophobicContact CD1-CG 4.44Å; F314-L359 HydrophobicContact CD2-CD1 3.75Å; F314-L359 HydrophobicContact CE1-CB 3.89Å; F314-L359 HydrophobicContact CE2-CD1 4.29Å; F314-L359 HydrophobicContact CG-CB 4.21Å; F314-L359 HydrophobicContact CG-CD1 3.68Å; F314-L359 HydrophobicContact CG-CG 4.4Å; F314-L359 HydrophobicContact CZ-CB 4.38Å; I350-L359 HydrophobicContact CD1-CB 3.91Å; I350-L359 HydrophobicContact CD1-CD2 3.55Å; I350-L359 HydrophobicContact CD1-CG 4.34Å; S356-L359 PolarHBondContact O-N 3.19Å; S356-L359 PolarHBondContact OG-N 3.2Å; L359-R361 PolarHBondContact O-N 3.26Å; L359-A362 WeakPolarHBondContact O-CB 3.32Å; L359-A362 PolarHBondContact O-N 2.95Å; L359-W363 HydrophobicContact CD1-CD2 4.47Å; L359-W363 HydrophobicContact CD1-CH2 4.07Å; L359-W363 HydrophobicContact CD1-CZ2 3.56Å; L359-W363 HydrophobicContact CD2-CZ2 3.97Å; L359-W363 HydrophobicContact CG-CZ2 3.82Å; L359-W363 PolarHBondContact O-N 3.24Å
360	E	94.1	Very high	81.7	Confident	100 Å²	100	75.8 Å²	75.8	47%	0.467	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-31.1	179.3	-70.8	-60.2	155.1	0	0	112.8	K296 S356 E357	K296-E360 IonicContact NZ-OE1 3.1Å; K296-E360 PolarHBondContact NZ-OE1 3.04Å; K296-E360 IonicContact NZ-OE2 3.46Å; K296-E360 PolarHBondContact NZ-OE2 2.75Å; S356-E360 WeakPolarHBondContact O-CG 3.1Å; S356-E360 PolarHBondContact O-N 2.72Å; E357-E360 PolarHBondContact O-N 2.69Å
361	R	92.5	Very high	79.2	Confident	173 Å²	173	85.5 Å²	85.5	65%	0.653	41%	0.414	S	S	*	.	H	α-helix	trans	-78.2	-22.9	173.1	-70.1	175.6	-167.3	140.9	12.2	113.4	E357 E358 L359	E357-R361 WeakPolarHBondContact O-CG 3.34Å; E357-R361 PolarHBondContact O-N 3.01Å; E357-R361 VanDerWaalsContact O-N 3.08Å; E357-R361 IonicContact OE2-CZ 3.25Å; E357-R361 IonicContact OE2-NH2 3.73Å; E357-R361 PolarHBondContact OE2-NH2 3.05Å; E358-R361 PolarHBondContact O-N 3.34Å; L359-R361 PolarHBondContact O-N 3.26Å
362	A	93	Very high	76.6	Confident	2 Å²	2	92.9 Å²	92.9	2%	0.017	45%	0.45	C	S	.	.	H	α-helix	trans	-76.1	-27.5	-178.3	0	0	0	0	0	112.9	L294 A309 F314 E358 L359	L294-A362 HydrophobicContact CD1-CB 4.46Å; A309-A362 HydrophobicContact CB-CB 4.14Å; F314-A362 HydrophobicContact CE2-CB 3.82Å; F314-A362 HydrophobicContact CZ-CB 4.35Å; E358-A362 PolarHBondContact O-N 3.35Å; E358-A362 VanDerWaalsContact O-N 3.11Å; L359-A362 WeakPolarHBondContact O-CB 3.32Å; L359-A362 PolarHBondContact O-N 2.95Å
363	W	94.5	Very high	74	Confident	29 Å²	29	103.1 Å²	103.1	11%	0.11	49%	0.493	C	S	.	.	S	Bend	trans	-59	140.3	177.5	-61.7	127.4	0	0	0	112.4	I274 L294 K296 V299 I307 L359	I274-W363 HydrophobicContact CD1-CZ3 4.11Å; L294-W363 HydrophobicContact CB-CE3 3.9Å; L294-W363 HydrophobicContact CB-CZ3 4.23Å; K296-W363 HydrophobicContact CB-CD2 3.97Å; K296-W363 HydrophobicContact CB-CE3 4.29Å; K296-W363 HydrophobicContact CB-CG 4.09Å; K296-W363 HydrophobicContact CD-CG 4.42Å; K296-W363 HydrophobicContact CG-CD2 4.2Å; K296-W363 HydrophobicContact CG-CG 4.36Å; K296-W363 HydrophobicContact CG-CZ2 4.4Å; V299-W363 HydrophobicContact CB-CH2 4.41Å; V299-W363 HydrophobicContact CG2-CH2 3.74Å; V299-W363 HydrophobicContact CG2-CZ3 4.37Å; I307-W363 HydrophobicContact CD1-CH2 3.57Å; I307-W363 HydrophobicContact CD1-CZ2 4.13Å; I307-W363 HydrophobicContact CG1-CH2 3.96Å; I307-W363 HydrophobicContact CG1-CZ3 4.49Å; I307-W363 HydrophobicContact CG2-CH2 3.96Å; I307-W363 HydrophobicContact CG2-CZ3 3.86Å; L359-W363 HydrophobicContact CD1-CD2 4.47Å; L359-W363 HydrophobicContact CD1-CH2 4.07Å; L359-W363 HydrophobicContact CD1-CZ2 3.56Å; L359-W363 HydrophobicContact CD2-CZ2 3.97Å; L359-W363 HydrophobicContact CG-CZ2 3.82Å; L359-W363 PolarHBondContact O-N 3.24Å
364	D	91.3	Very high	73.5	Confident	56 Å²	56	103.8 Å²	103.8	30%	0.299	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-71	135.3	170.5	-68.2	-30.3	0	0	0	109.5	K272 H293 L294 D366	K272-D364 IonicContact NZ-OD1 2.76Å; K272-D364 PolarHBondContact NZ-OD1 3.49Å; H293-D364 WeakPolarHBondContact CA-OD2 3.46Å; H293-D364 WeakPolarHBondContact CB-OD2 3.44Å; L294-D364 PolarHBondContact N-OD2 3.46Å; L294-D364 PolarHBondContact O-N 2.77Å; D364-D366 PolarHBondContact O-N 2.94Å
365	R	84.9	Confident	72.6	Confident	235 Å²	235	107.7 Å²	107.7	89%	0.887	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-59	128.4	177.6	-68.4	-173.6	-179.1	-173.7	0.4	109.6	R367	R365-R367 PolarHBondContact O-N 3.01Å
366	D	66.8	Low	71.7	Confident	93 Å²	93	110.4 Å²	110.4	50%	0.497	52%	0.518	S	S	.	.			trans	-65.8	103.5	179	-135.7	-9.3	0	0	0	108.7	D364 S368 T369	D364-D366 PolarHBondContact O-N 2.94Å; D366-S368 PolarHBondContact O-N 3.09Å; D366-T369 PolarHBondContact O-N 2.6Å; D366-T369 PolarHBondContact O-OG1 3.11Å; D366-T369 VanDerWaalsContact O-OG1 3.12Å
367	R	55.3	Low	70.5	Confident	217 Å²	217	116.3 Å²	116.3	82%	0.819	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-63.3	-6.1	-178.8	-69.2	-173.3	-179.4	-174.6	0.6	112.9	R365 T369 S370	R365-R367 PolarHBondContact O-N 3.01Å; R367-T369 PolarHBondContact O-N 2.56Å; R367-S370 PolarHBondContact O-OG 2.95Å
368	S	51.3	Low	69.2	Low	84 Å²	84	115 Å²	115	59%	0.587	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-66.3	-16.8	176	50.3	0	0	0	0	113.8	D366	D366-S368 PolarHBondContact O-N 3.09Å
369	T	43.2	Very low	67.6	Low	110 Å²	110	121.2 Å²	121.2	68%	0.675	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-99.2	-6	-178.1	48	0	0	0	0	115.2	D366 R367 Y371	D366-T369 PolarHBondContact O-N 2.6Å; D366-T369 PolarHBondContact O-OG1 3.11Å; D366-T369 VanDerWaalsContact O-OG1 3.12Å; R367-T369 PolarHBondContact O-N 2.56Å; T369-Y371 VanDerWaalsContact C-N 3.3Å; T369-Y371 PolarHBondContact O-N 3.02Å
370	S	39	Very low	65.7	Low	83 Å²	83	129.2 Å²	129.2	58%	0.58	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	11.7	-176.9	61.6	0	0	0	0	115.4	R367	R367-S370 PolarHBondContact O-OG 2.95Å
371	Y	41.9	Very low	63.5	Low	207 Å²	207	131.5 Å²	131.5	81%	0.812	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	12.2	175.8	-78.3	-79.7	0	0	0	113.9	T369	T369-Y371 VanDerWaalsContact C-N 3.3Å; T369-Y371 PolarHBondContact O-N 3.02Å
372	L	37.7	Very low	61.1	Low	168 Å²	168	128 Å²	128	88%	0.88	61%	0.612	S	S	*	*			trans	-125.9	22.2	179.3	-72.5	173.8	0	0	0	114.4
373	Q	34.3	Very low	58.2	Low	252 Å²	252	139.5 Å²	139.5	100%	1.178	67%	0.666	S	S	*	*			trans	-121.4	0	159.9	-75.9	-173.6	-20.7	0	0	108.4

Retrieved 373 of 373 residues in 140.6 ms (Link to these results)

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