A0A3Q0KMI7_SCHMA Loading...

CRIM domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMI7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 759 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	41.3	Very low	65.4	Low	238 Å²	238	95.5 Å²	95.5	100%	1.172	55%	0.55	S	S	*	.				0	139.4	0	-75	137.2	65.5	0	0	107.8
2	V	47.6	Very low	66.5	Low	126 Å²	126	95.3 Å²	95.3	76%	0.764	55%	0.545	S	S	*	.			trans	-74.4	122.4	159	178.3	0	0	0	0	105.3	T4	V2-T4 PolarHBondContact O-N 2.92Å; V2-T4 VanDerWaalsContact O-N 3.12Å
3	S	52.2	Low	67.6	Low	83 Å²	83	100.4 Å²	100.4	58%	0.58	55%	0.552	S	S	*	*			trans	-64.1	109	176.5	43.9	0	0	0	0	109	D5	S3-D5 WeakPolarHBondContact CB-OD2 3.21Å; S3-D5 PolarHBondContact O-N 2.91Å; S3-D5 VanDerWaalsContact O-N 3.15Å
4	T	59.5	Low	68.8	Low	89 Å²	89	97.6 Å²	97.6	55%	0.546	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	15	179.5	44.5	0	0	0	0	113	V2 S6 T9 I10	V2-T4 PolarHBondContact O-N 2.92Å; V2-T4 VanDerWaalsContact O-N 3.12Å; T4-S6 PolarHBondContact O-N 2.89Å; T4-T9 HydrophobicContact CG2-CG2 4.47Å; T4-I10 WeakPolarHBondContact O-CG1 3.45Å
5	D	65.9	Low	69.7	Low	138 Å²	138	97.1 Å²	97.1	74%	0.738	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-5.2	-171.4	-46.9	-39.1	0	0	0	112.9	S3	S3-D5 WeakPolarHBondContact CB-OD2 3.21Å; S3-D5 PolarHBondContact O-N 2.91Å; S3-D5 VanDerWaalsContact O-N 3.15Å
6	S	73.3	Confident	70.4	Confident	62 Å²	62	96.9 Å²	96.9	43%	0.434	52%	0.524	S	S	.	.	S	Bend	trans	-78.6	122.9	171.6	176.7	0	0	0	0	110.8	T4 A8 T9 I10	T4-S6 PolarHBondContact O-N 2.89Å; S6-A8 PolarHBondContact O-N 3.29Å; S6-A8 VanDerWaalsContact O-N 3.16Å; S6-T9 WeakPolarHBondContact O-CA 3.5Å; S6-T9 WeakPolarHBondContact O-CB 3.49Å; S6-T9 PolarHBondContact O-N 2.74Å; S6-I10 PolarHBondContact O-N 3.46Å; S6-I10 VanDerWaalsContact O-N 3.08Å
7	K	71.8	Confident	71.2	Confident	59 Å²	59	94.4 Å²	94.4	26%	0.257	52%	0.515	S	S	.	.	H	α-helix	trans	-43.8	-45.6	173.7	179.9	-176.3	172.1	-163.1	0	112.3	T9 I10 L11 D39 E43	K7-T9 PolarHBondContact O-N 3.49Å; K7-I10 PolarHBondContact O-N 3.23Å; K7-L11 HydrophobicContact CG-CD1 4.03Å; K7-L11 WeakPolarHBondContact O-CD1 3.32Å; K7-L11 WeakPolarHBondContact O-CG 3.43Å; K7-L11 PolarHBondContact O-N 3.01Å; K7-D39 PolarHBondContact NZ-O 3.2Å; K7-D39 VanDerWaalsContact NZ-O 3.11Å; K7-E43 IonicContact NZ-OE1 3.52Å; K7-E43 PolarHBondContact NZ-OE1 3.43Å
8	A	72.9	Confident	72	Confident	57 Å²	57	96.2 Å²	96.2	47%	0.471	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-36.9	177.8	0	0	0	0	0	113.1	S6 N12	S6-A8 PolarHBondContact O-N 3.29Å; S6-A8 VanDerWaalsContact O-N 3.16Å; A8-N12 WeakPolarHBondContact O-CB 3.21Å; A8-N12 PolarHBondContact O-N 3.34Å
9	T	73.7	Confident	72.4	Confident	60 Å²	60	92.5 Å²	92.5	37%	0.368	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-40.2	177.1	-51.7	0	0	0	0	111.7	T4 S6 K7 N12 Y13	T4-T9 HydrophobicContact CG2-CG2 4.47Å; S6-T9 WeakPolarHBondContact O-CA 3.5Å; S6-T9 WeakPolarHBondContact O-CB 3.49Å; S6-T9 PolarHBondContact O-N 2.74Å; K7-T9 PolarHBondContact O-N 3.49Å; T9-N12 PolarHBondContact O-N 3.05Å; T9-Y13 WeakPolarHBondContact O-CB 3.49Å; T9-Y13 PolarHBondContact O-N 3.05Å
10	I	81.5	Confident	72.9	Confident	87 Å²	87	93.3 Å²	93.3	45%	0.446	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-48	175.9	-60.4	174.6	0	0	0	110.3	T4 S6 K7 N12 Y13 V14	T4-I10 WeakPolarHBondContact O-CG1 3.45Å; S6-I10 PolarHBondContact O-N 3.46Å; S6-I10 VanDerWaalsContact O-N 3.08Å; K7-I10 PolarHBondContact O-N 3.23Å; I10-N12 VanDerWaalsContact C-N 3.35Å; I10-N12 PolarHBondContact O-N 3.43Å; I10-Y13 WeakPolarHBondContact O-CB 3.37Å; I10-Y13 PolarHBondContact O-N 2.85Å; I10-V14 HydrophobicContact CG2-CG2 4.42Å; I10-V14 WeakPolarHBondContact O-CG2 3.33Å; I10-V14 PolarHBondContact O-N 3.22Å
11	L	79.3	Confident	73.2	Confident	52 Å²	52	91.8 Å²	91.8	27%	0.272	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-39.6	-179.9	-67.8	160.4	0	0	0	112.3	K7 Y13 V14 R15 I42	K7-L11 HydrophobicContact CG-CD1 4.03Å; K7-L11 WeakPolarHBondContact O-CD1 3.32Å; K7-L11 WeakPolarHBondContact O-CG 3.43Å; K7-L11 PolarHBondContact O-N 3.01Å; L11-Y13 VanDerWaalsContact C-N 3.33Å; L11-V14 PolarHBondContact O-N 2.86Å; L11-R15 WeakPolarHBondContact O-CB 3.25Å; L11-R15 WeakPolarHBondContact O-CG 3.34Å; L11-R15 PolarHBondContact O-N 3.37Å; L11-I42 HydrophobicContact CD1-CD1 3.79Å; L11-I42 HydrophobicContact CD1-CG1 4.32Å; L11-I42 HydrophobicContact CD1-CG2 3.62Å; L11-I42 HydrophobicContact CD2-CG2 4.43Å
12	N	78.8	Confident	75.2	Confident	92 Å²	92	82.2 Å²	82.2	49%	0.492	47%	0.474	S	S	.	.	H	α-helix	trans	-68.4	-34.4	176.2	-155.9	33.7	0	0	0	111.9	A8 T9 I10 N16	A8-N12 WeakPolarHBondContact O-CB 3.21Å; A8-N12 PolarHBondContact O-N 3.34Å; T9-N12 PolarHBondContact O-N 3.05Å; I10-N12 VanDerWaalsContact C-N 3.35Å; I10-N12 PolarHBondContact O-N 3.43Å; N12-N16 WeakPolarHBondContact O-CB 3.2Å; N12-N16 VanDerWaalsContact O-CG 3.23Å; N12-N16 PolarHBondContact O-N 2.97Å; N12-N16 PolarHBondContact O-ND2 3.03Å
13	Y	81	Confident	76.7	Confident	162 Å²	162	84.1 Å²	84.1	64%	0.635	48%	0.48	S	S	*	.	H	α-helix	trans	-64.3	-48.1	171.5	-176.6	-102.5	0	0	0	111.6	T9 I10 L11 R15 N16 C17	T9-Y13 WeakPolarHBondContact O-CB 3.49Å; T9-Y13 PolarHBondContact O-N 3.05Å; I10-Y13 WeakPolarHBondContact O-CB 3.37Å; I10-Y13 PolarHBondContact O-N 2.85Å; L11-Y13 VanDerWaalsContact C-N 3.33Å; Y13-R15 PolarHBondContact O-N 3.06Å; Y13-N16 PolarHBondContact O-N 2.67Å; Y13-C17 PolarHBondContact O-N 3.37Å; Y13-C17 PolarHBondContact O-SG 3.35Å; Y13-C17 VanDerWaalsContact O-SG 3.36Å
14	V	84.4	Confident	77.9	Confident	61 Å²	61	82.9 Å²	82.9	37%	0.37	47%	0.471	S	S	.	.	H	α-helix	trans	-59.9	-46.5	176.7	171.4	0	0	0	0	111.5	I10 L11 N16 C17 F18	I10-V14 HydrophobicContact CG2-CG2 4.42Å; I10-V14 WeakPolarHBondContact O-CG2 3.33Å; I10-V14 PolarHBondContact O-N 3.22Å; L11-V14 PolarHBondContact O-N 2.86Å; V14-N16 VanDerWaalsContact C-N 3.34Å; V14-N16 PolarHBondContact O-N 2.83Å; V14-C17 PolarHBondContact O-N 3.13Å; V14-F18 HydrophobicContact CG1-CD2 3.7Å; V14-F18 HydrophobicContact CG1-CE2 3.65Å; V14-F18 WeakPolarHBondContact O-CD2 3.32Å; V14-F18 PolarHBondContact O-N 2.74Å
15	R	82.5	Confident	78.5	Confident	91 Å²	91	79.8 Å²	79.8	34%	0.343	46%	0.457	S	S	.	.	H	α-helix	trans	-56.8	-46.2	174.6	-76.5	179.7	173	160.5	-3.9	111.8	L11 Y13 F18 A19 L31	L11-R15 WeakPolarHBondContact O-CB 3.25Å; L11-R15 WeakPolarHBondContact O-CG 3.34Å; L11-R15 PolarHBondContact O-N 3.37Å; Y13-R15 PolarHBondContact O-N 3.06Å; R15-F18 PolarHBondContact O-N 3.16Å; R15-A19 VanDerWaalsContact O-CB 3.3Å; R15-A19 WeakPolarHBondContact O-CB 3.49Å; R15-A19 PolarHBondContact O-N 3.21Å; R15-L31 HydrophobicContact CB-CD1 4.27Å; R15-L31 HydrophobicContact CG-CD1 4.43Å; R15-L31 HydrophobicContact CG-CD2 4.02Å; R15-L31 WeakPolarHBondContact O-CD1 3.41Å
16	N	81.1	Confident	79.1	Confident	93 Å²	93	76.8 Å²	76.8	50%	0.497	44%	0.438	S	S	.	.	H	α-helix	trans	-64.5	-40.7	177	-73.2	-21.8	0	0	0	112.1	N12 Y13 V14 A19 S20	N12-N16 WeakPolarHBondContact O-CB 3.2Å; N12-N16 VanDerWaalsContact O-CG 3.23Å; N12-N16 PolarHBondContact O-N 2.97Å; N12-N16 PolarHBondContact O-ND2 3.03Å; Y13-N16 PolarHBondContact O-N 2.67Å; V14-N16 VanDerWaalsContact C-N 3.34Å; V14-N16 PolarHBondContact O-N 2.83Å; N16-A19 PolarHBondContact O-N 2.99Å; N16-S20 WeakPolarHBondContact O-CB 3.37Å; N16-S20 PolarHBondContact O-N 3.36Å; N16-S20 PolarHBondContact O-OG 3.05Å
17	C	84.3	Confident	79.1	Confident	55 Å²	55	75 Å²	75	37%	0.372	42%	0.424	S	S	.	.	H	α-helix	trans	-62.1	-43.3	176.7	-73	0	0	0	0	112.7	Y13 V14 G21	Y13-C17 PolarHBondContact O-N 3.37Å; Y13-C17 PolarHBondContact O-SG 3.35Å; Y13-C17 VanDerWaalsContact O-SG 3.36Å; V14-C17 PolarHBondContact O-N 3.13Å; C17-G21 WeakPolarHBondContact O-CA 3.38Å; C17-G21 PolarHBondContact O-N 3.28Å
18	F	84.8	Confident	79.3	Confident	126 Å²	126	77.2 Å²	77.2	55%	0.553	44%	0.436	S	S	*	.	H	α-helix	trans	-69.2	-40.6	175	-79.6	-69.2	0	0	0	112.4	V14 R15 D22 C27 L31	V14-F18 HydrophobicContact CG1-CD2 3.7Å; V14-F18 HydrophobicContact CG1-CE2 3.65Å; V14-F18 WeakPolarHBondContact O-CD2 3.32Å; V14-F18 PolarHBondContact O-N 2.74Å; R15-F18 PolarHBondContact O-N 3.16Å; F18-D22 WeakPolarHBondContact O-CB 3.27Å; F18-D22 PolarHBondContact O-N 2.59Å; F18-C27 HydrophobicContact CB-CB 4.28Å; F18-C27 WeakPolarHBondContact O-CB 3.45Å; F18-L31 HydrophobicContact CB-CD1 4.32Å
19	A	80.7	Confident	79.4	Confident	26 Å²	26	81.7 Å²	81.7	22%	0.215	45%	0.445	C	S	.	.	H	α-helix	trans	-66.6	-38.7	177.7	0	0	0	0	0	113.1	R15 N16 E28 L31	R15-A19 VanDerWaalsContact O-CB 3.3Å; R15-A19 WeakPolarHBondContact O-CB 3.49Å; R15-A19 PolarHBondContact O-N 3.21Å; N16-A19 PolarHBondContact O-N 2.99Å; A19-E28 HydrophobicContact CB-CG 4.34Å; A19-L31 HydrophobicContact CB-CD1 4.33Å
20	S	80.7	Confident	79.6	Confident	108 Å²	108	82.8 Å²	82.8	76%	0.755	45%	0.448	S	S	*	.	H	α-helix	trans	-89.5	-13.2	-179.7	69.6	0	0	0	0	114.7	N16	N16-S20 WeakPolarHBondContact O-CB 3.37Å; N16-S20 PolarHBondContact O-N 3.36Å; N16-S20 PolarHBondContact O-OG 3.05Å
21	G	79.2	Confident	79.2	Confident	63 Å²	63	81.1 Å²	81.1	65%	0.649	44%	0.44	S	S	*	.	H	α-helix	trans	-99.9	-13.1	-178.4	0	0	0	0	0	114.5	C17	C17-G21 WeakPolarHBondContact O-CA 3.38Å; C17-G21 PolarHBondContact O-N 3.28Å
22	D	83.5	Confident	78.5	Confident	36 Å²	36	83 Å²	83	19%	0.193	45%	0.45	C	S	.	.			trans	-93.9	108.7	177	175.6	30.3	0	0	0	111	F18 S24 G25 F26 C27	F18-D22 WeakPolarHBondContact O-CB 3.27Å; F18-D22 PolarHBondContact O-N 2.59Å; D22-S24 VanDerWaalsContact C-N 3.26Å; D22-S24 PolarHBondContact O-N 3.23Å; D22-S24 WeakPolarHBondContact OD1-CA 3.42Å; D22-S24 VanDerWaalsContact OD1-CB 3.29Å; D22-S24 WeakPolarHBondContact OD1-CB 3.13Å; D22-S24 PolarHBondContact OD1-N 3.45Å; D22-S24 PolarHBondContact OD1-OG 2.9Å; D22-S24 PolarHBondContact OD2-OG 3.47Å; D22-G25 PolarHBondContact OD2-N 2.86Å; D22-F26 WeakPolarHBondContact OD2-CA 3.26Å; D22-F26 WeakPolarHBondContact OD2-CB 3.49Å; D22-F26 PolarHBondContact OD2-N 2.84Å; D22-C27 HydrophobicContact CB-CB 3.82Å; D22-C27 WeakPolarHBondContact OD2-CB 3.19Å; D22-C27 PolarHBondContact OD2-N 3.44Å
23	D	79.5	Confident	77.7	Confident	167 Å²	167	87.6 Å²	87.6	89%	0.893	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-19	174.7	59.3	-6.6	0	0	0	113.1	G25	D23-G25 VanDerWaalsContact C-N 3.34Å
24	S	77.4	Confident	76.7	Confident	57 Å²	57	83.3 Å²	83.3	40%	0.399	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.5	-178.8	82.3	0	0	0	0	114.4	D22 F26 R64	D22-S24 VanDerWaalsContact C-N 3.26Å; D22-S24 PolarHBondContact O-N 3.23Å; D22-S24 WeakPolarHBondContact OD1-CA 3.42Å; D22-S24 VanDerWaalsContact OD1-CB 3.29Å; D22-S24 WeakPolarHBondContact OD1-CB 3.13Å; D22-S24 PolarHBondContact OD1-N 3.45Å; D22-S24 PolarHBondContact OD1-OG 2.9Å; D22-S24 PolarHBondContact OD2-OG 3.47Å; S24-F26 PolarHBondContact O-N 2.87Å; S24-F26 VanDerWaalsContact O-N 3.13Å; S24-F26 WeakPolarHBondContact OG-CB 3.4Å; S24-R64 PolarHBondContact OG-NH2 3.48Å; S24-R64 VanDerWaalsContact OG-NH2 3.13Å
25	G	73	Confident	75.4	Confident	24 Å²	24	87.5 Å²	87.5	25%	0.247	47%	0.469	C	S	.	.	S	Bend	trans	62.6	14.4	-178.9	0	0	0	0	0	114.6	D22 D23 K29	D22-G25 PolarHBondContact OD2-N 2.86Å; D23-G25 VanDerWaalsContact C-N 3.34Å; G25-K29 PolarHBondContact O-N 2.64Å
26	F	77.1	Confident	74.2	Confident	75 Å²	75	90.3 Å²	90.3	33%	0.329	49%	0.491	S	S	.	.	H	α-helix	trans	-74	-44.7	179.2	175.7	-101.1	0	0	0	111.2	D22 S24 E28 K29 L30 F62	D22-F26 WeakPolarHBondContact OD2-CA 3.26Å; D22-F26 WeakPolarHBondContact OD2-CB 3.49Å; D22-F26 PolarHBondContact OD2-N 2.84Å; S24-F26 PolarHBondContact O-N 2.87Å; S24-F26 VanDerWaalsContact O-N 3.13Å; S24-F26 WeakPolarHBondContact OG-CB 3.4Å; F26-E28 VanDerWaalsContact C-N 3.32Å; F26-E28 PolarHBondContact O-N 2.91Å; F26-K29 PolarHBondContact O-N 2.68Å; F26-K29 VanDerWaalsContact O-N 3.13Å; F26-L30 HydrophobicContact CE1-CD1 4.46Å; F26-L30 HydrophobicContact CZ-CD1 4.18Å; F26-L30 WeakPolarHBondContact O-CB 3.26Å; F26-L30 PolarHBondContact O-N 3.28Å; F26-F62 HydrophobicContact CD2-CE2 4.18Å; F26-F62 AromaticContact CD2-CZ 3.83Å; F26-F62 HydrophobicContact CD2-CZ 3.83Å; F26-F62 AromaticContact CE2-CE2 3.88Å; F26-F62 HydrophobicContact CE2-CE2 3.88Å; F26-F62 AromaticContact CE2-CZ 3.78Å; F26-F62 HydrophobicContact CE2-CZ 3.78Å
27	C	74.5	Confident	73	Confident	23 Å²	23	87.8 Å²	87.8	16%	0.155	48%	0.479	C	S	.	.	H	α-helix	trans	-61.4	-38	176.9	-70.2	0	0	0	0	111.6	F18 D22 L30 L31	F18-C27 HydrophobicContact CB-CB 4.28Å; F18-C27 WeakPolarHBondContact O-CB 3.45Å; D22-C27 HydrophobicContact CB-CB 3.82Å; D22-C27 WeakPolarHBondContact OD2-CB 3.19Å; D22-C27 PolarHBondContact OD2-N 3.44Å; C27-L30 PolarHBondContact O-N 3.38Å; C27-L31 WeakPolarHBondContact O-CB 3.29Å; C27-L31 WeakPolarHBondContact O-CG 3.35Å; C27-L31 PolarHBondContact O-N 2.88Å
28	E	75.5	Confident	72	Confident	107 Å²	107	88.6 Å²	88.6	50%	0.5	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-43.9	172.7	-69	-158.6	145.1	0	0	112.2	A19 F26 N32	A19-E28 HydrophobicContact CB-CG 4.34Å; F26-E28 VanDerWaalsContact C-N 3.32Å; F26-E28 PolarHBondContact O-N 2.91Å; E28-N32 WeakPolarHBondContact O-CB 3.33Å; E28-N32 PolarHBondContact O-N 2.72Å; E28-N32 PolarHBondContact O-ND2 3.17Å
29	K	75.4	Confident	70.9	Confident	151 Å²	151	87.8 Å²	87.8	66%	0.657	48%	0.484	S	S	*	.	H	α-helix	trans	-66	-40	177.3	-74	178.2	178.8	176.5	0	112.2	G25 F26 K33	G25-K29 PolarHBondContact O-N 2.64Å; F26-K29 PolarHBondContact O-N 2.68Å; F26-K29 VanDerWaalsContact O-N 3.13Å; K29-K33 PolarHBondContact O-N 2.93Å
30	L	76.7	Confident	70	Confident	82 Å²	82	94 Å²	94	43%	0.429	51%	0.508	S	S	.	.	H	α-helix	trans	-67	-52	178.3	-160.9	84.3	0	0	0	110.6	F26 C27 N32 K33	F26-L30 HydrophobicContact CE1-CD1 4.46Å; F26-L30 HydrophobicContact CZ-CD1 4.18Å; F26-L30 WeakPolarHBondContact O-CB 3.26Å; F26-L30 PolarHBondContact O-N 3.28Å; C27-L30 PolarHBondContact O-N 3.38Å; L30-N32 PolarHBondContact O-N 3.27Å; L30-K33 PolarHBondContact O-N 3.33Å
31	L	73.1	Confident	69.1	Low	53 Å²	53	92 Å²	92	28%	0.277	49%	0.487	S	S	.	.	H	α-helix	trans	-68.6	-32.4	-176.7	-66.7	173.4	0	0	0	112.8	R15 F18 A19 C27 K33 V34	R15-L31 HydrophobicContact CB-CD1 4.27Å; R15-L31 HydrophobicContact CG-CD1 4.43Å; R15-L31 HydrophobicContact CG-CD2 4.02Å; R15-L31 WeakPolarHBondContact O-CD1 3.41Å; F18-L31 HydrophobicContact CB-CD1 4.32Å; A19-L31 HydrophobicContact CB-CD1 4.33Å; C27-L31 WeakPolarHBondContact O-CB 3.29Å; C27-L31 WeakPolarHBondContact O-CG 3.35Å; C27-L31 PolarHBondContact O-N 2.88Å; L31-K33 VanDerWaalsContact C-N 3.32Å; L31-K33 PolarHBondContact O-N 3.39Å; L31-V34 PolarHBondContact O-N 2.9Å
32	N	66.4	Low	68.2	Low	92 Å²	92	89.9 Å²	89.9	49%	0.492	46%	0.461	S	S	.	.	H	α-helix	trans	-72.5	-20.9	175	-83.4	-63.4	0	0	0	114.2	E28 L30	E28-N32 WeakPolarHBondContact O-CB 3.33Å; E28-N32 PolarHBondContact O-N 2.72Å; E28-N32 PolarHBondContact O-ND2 3.17Å; L30-N32 PolarHBondContact O-N 3.27Å
33	K	61.1	Low	67.1	Low	188 Å²	188	94.4 Å²	94.4	82%	0.817	48%	0.48	S	S	*	.	H	α-helix	trans	-75.3	-27.8	171.6	-80.8	-174.3	173.7	-173.3	0	112.3	K29 L30 L31 K35	K29-K33 PolarHBondContact O-N 2.93Å; L30-K33 PolarHBondContact O-N 3.33Å; L31-K33 VanDerWaalsContact C-N 3.32Å; L31-K33 PolarHBondContact O-N 3.39Å; K33-K35 PolarHBondContact O-N 3.43Å
34	V	59.5	Low	66.3	Low	71 Å²	71	88.3 Å²	88.3	43%	0.43	45%	0.451	S	S	.	.			trans	-101.6	59.3	-176.1	-162	0	0	0	0	110.7	L31 V37	L31-V34 PolarHBondContact O-N 2.9Å; V34-V37 HydrophobicContact CG1-CG2 3.35Å
35	K	56.8	Low	65.4	Low	149 Å²	149	89.7 Å²	89.7	65%	0.648	45%	0.453	S	S	*	.			trans	-77.3	-26.5	-176.5	-90.8	179.2	178	177.8	0	114.7	K33	K33-K35 PolarHBondContact O-N 3.43Å
36	D	57.8	Low	64.8	Low	150 Å²	150	94.6 Å²	94.6	80%	0.802	47%	0.473	S	S	*	.			trans	-111	103.3	176.6	-56.4	-50.1	0	0	0	108
37	V	56.8	Low	64	Low	41 Å²	41	94.2 Å²	94.2	25%	0.248	48%	0.48	C	S	.	.			trans	-125.7	118.5	165.1	-167.5	0	0	0	0	107	V34 E41 I42	V34-V37 HydrophobicContact CG1-CG2 3.35Å; V37-E41 HydrophobicContact CG1-CB 3.84Å; V37-I42 HydrophobicContact CG1-CD1 4.17Å; V37-I42 HydrophobicContact CG1-CG1 3.63Å
38	T	61.7	Low	62.9	Low	71 Å²	71	96.3 Å²	96.3	44%	0.436	51%	0.505	S	S	.	.			trans	-72.8	154.5	176.3	59.7	0	0	0	0	111	E40 E41 I42	T38-E40 PolarHBondContact O-N 3.15Å; T38-E40 VanDerWaalsContact O-N 3.16Å; T38-E41 WeakPolarHBondContact CB-OE2 3.36Å; T38-E41 PolarHBondContact N-OE2 3.41Å; T38-E41 PolarHBondContact O-N 3.08Å; T38-E41 VanDerWaalsContact OG1-CD 3.31Å; T38-E41 WeakPolarHBondContact OG1-CG 3.27Å; T38-E41 PolarHBondContact OG1-N 3.38Å; T38-E41 PolarHBondContact OG1-OE2 3.13Å; T38-I42 WeakPolarHBondContact O-CG1 3.36Å; T38-I42 PolarHBondContact O-N 3.27Å
39	D	61.6	Low	61.9	Low	109 Å²	109	98.1 Å²	98.1	58%	0.583	51%	0.514	S	S	*	.	H	α-helix	trans	-58.6	-27.9	175.7	-81	-48.3	0	0	0	112.5	K7 I42 E43	K7-D39 PolarHBondContact NZ-O 3.2Å; K7-D39 VanDerWaalsContact NZ-O 3.11Å; D39-I42 PolarHBondContact O-N 3.05Å; D39-E43 WeakPolarHBondContact O-CG 3.16Å; D39-E43 PolarHBondContact O-N 3.4Å; D39-E43 VanDerWaalsContact O-N 3.13Å
40	E	63.2	Low	60.4	Low	157 Å²	157	95.6 Å²	95.6	73%	0.734	50%	0.501	S	S	*	.	H	α-helix	trans	-68.2	-47.8	177.2	-61	175.9	-170.9	0	0	112.3	T38 I42 E43 S44	T38-E40 PolarHBondContact O-N 3.15Å; T38-E40 VanDerWaalsContact O-N 3.16Å; E40-I42 PolarHBondContact O-N 3.06Å; E40-E43 PolarHBondContact O-N 3.05Å; E40-E43 VanDerWaalsContact O-N 3.09Å; E40-S44 PolarHBondContact O-N 3.22Å
41	E	60.4	Low	58.9	Low	67 Å²	67	101.3 Å²	101.3	31%	0.313	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-36.8	174.3	-73.4	161	132.8	0	0	111.3	V37 T38 E43 S44 I45	V37-E41 HydrophobicContact CG1-CB 3.84Å; T38-E41 WeakPolarHBondContact CB-OE2 3.36Å; T38-E41 PolarHBondContact N-OE2 3.41Å; T38-E41 PolarHBondContact O-N 3.08Å; T38-E41 VanDerWaalsContact OG1-CD 3.31Å; T38-E41 WeakPolarHBondContact OG1-CG 3.27Å; T38-E41 PolarHBondContact OG1-N 3.38Å; T38-E41 PolarHBondContact OG1-OE2 3.13Å; E41-E43 PolarHBondContact O-N 3.18Å; E41-S44 PolarHBondContact O-N 2.93Å; E41-I45 VanDerWaalsContact O-CG1 3.27Å; E41-I45 WeakPolarHBondContact O-CG1 3.47Å; E41-I45 PolarHBondContact O-N 2.96Å
42	I	60.9	Low	57.6	Low	18 Å²	18	104.6 Å²	104.6	9%	0.092	54%	0.54	C	S	.	.	H	α-helix	trans	-66.9	-35.9	175.9	-59.3	159	0	0	0	111.3	L11 V37 T38 D39 E40 I45 L46	L11-I42 HydrophobicContact CD1-CD1 3.79Å; L11-I42 HydrophobicContact CD1-CG1 4.32Å; L11-I42 HydrophobicContact CD1-CG2 3.62Å; L11-I42 HydrophobicContact CD2-CG2 4.43Å; V37-I42 HydrophobicContact CG1-CD1 4.17Å; V37-I42 HydrophobicContact CG1-CG1 3.63Å; T38-I42 WeakPolarHBondContact O-CG1 3.36Å; T38-I42 PolarHBondContact O-N 3.27Å; D39-I42 PolarHBondContact O-N 3.05Å; E40-I42 PolarHBondContact O-N 3.06Å; I42-I45 PolarHBondContact O-N 3.49Å; I42-L46 HydrophobicContact CG2-CD1 3.92Å; I42-L46 HydrophobicContact CG2-CG 4.43Å; I42-L46 WeakPolarHBondContact O-CB 3.06Å; I42-L46 VanDerWaalsContact O-CG 3.26Å; I42-L46 WeakPolarHBondContact O-CG 3.5Å; I42-L46 PolarHBondContact O-N 3.05Å
43	E	59.8	Low	56.5	Low	130 Å²	130	108.9 Å²	108.9	61%	0.607	56%	0.557	S	S	*	*	H	α-helix	trans	-67.8	-36.6	172.6	-65.4	-164.1	163	0	0	112.2	K7 D39 E40 E41 L46 S47	K7-E43 IonicContact NZ-OE1 3.52Å; K7-E43 PolarHBondContact NZ-OE1 3.43Å; D39-E43 WeakPolarHBondContact O-CG 3.16Å; D39-E43 PolarHBondContact O-N 3.4Å; D39-E43 VanDerWaalsContact O-N 3.13Å; E40-E43 PolarHBondContact O-N 3.05Å; E40-E43 VanDerWaalsContact O-N 3.09Å; E41-E43 PolarHBondContact O-N 3.18Å; E43-L46 PolarHBondContact O-N 3.31Å; E43-S47 WeakPolarHBondContact O-CB 3.43Å; E43-S47 PolarHBondContact O-N 2.95Å; E43-S47 PolarHBondContact O-OG 3.46Å
44	S	63.5	Low	55.7	Low	40 Å²	40	106.3 Å²	106.3	28%	0.28	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-34	175.4	-166.3	0	0	0	0	113.2	E40 E41 S47 Q49 Y50	E40-S44 PolarHBondContact O-N 3.22Å; E41-S44 PolarHBondContact O-N 2.93Å; S44-S47 PolarHBondContact O-OG 2.79Å; S44-S47 VanDerWaalsContact O-OG 3.06Å; S44-Q49 PolarHBondContact O-N 3.4Å; S44-Y50 PolarHBondContact O-N 3.33Å
45	I	59.5	Low	55.3	Low	86 Å²	86	107.9 Å²	107.9	44%	0.441	57%	0.567	S	S	.	*	H	α-helix	trans	-68.1	-43.9	172	-68	162.3	0	0	0	110.7	E41 I42 G48 Y50	E41-I45 VanDerWaalsContact O-CG1 3.27Å; E41-I45 WeakPolarHBondContact O-CG1 3.47Å; E41-I45 PolarHBondContact O-N 2.96Å; I42-I45 PolarHBondContact O-N 3.49Å; I45-G48 PolarHBondContact O-N 3.27Å; I45-Y50 HydrophobicContact CG1-CD1 3.94Å; I45-Y50 HydrophobicContact CG1-CD2 4.03Å; I45-Y50 HydrophobicContact CG1-CG 3.61Å
46	L	59.2	Low	54.8	Low	126 Å²	126	105 Å²	105	66%	0.66	56%	0.558	S	S	*	*	H	α-helix	trans	-74.6	-23.1	-179.4	-69.3	170.2	0	0	0	113.6	I42 E43 G48	I42-L46 HydrophobicContact CG2-CD1 3.92Å; I42-L46 HydrophobicContact CG2-CG 4.43Å; I42-L46 WeakPolarHBondContact O-CB 3.06Å; I42-L46 VanDerWaalsContact O-CG 3.26Å; I42-L46 WeakPolarHBondContact O-CG 3.5Å; I42-L46 PolarHBondContact O-N 3.05Å; E43-L46 PolarHBondContact O-N 3.31Å; L46-G48 PolarHBondContact O-N 2.89Å
47	S	61.5	Low	54.7	Low	67 Å²	67	103 Å²	103	47%	0.469	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	-3.1	174.1	72.1	0	0	0	0	113.7	E43 S44 Q49	E43-S47 WeakPolarHBondContact O-CB 3.43Å; E43-S47 PolarHBondContact O-N 2.95Å; E43-S47 PolarHBondContact O-OG 3.46Å; S44-S47 PolarHBondContact O-OG 2.79Å; S44-S47 VanDerWaalsContact O-OG 3.06Å; S47-Q49 VanDerWaalsContact C-N 3.26Å; S47-Q49 PolarHBondContact O-N 3.48Å
48	G	50.3	Low	54.5	Low	67 Å²	67	107.4 Å²	107.4	69%	0.691	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.4	14.6	-178.4	0	0	0	0	0	114.3	I45 L46	I45-G48 PolarHBondContact O-N 3.27Å; L46-G48 PolarHBondContact O-N 2.89Å
49	Q	54.7	Low	53.9	Low	146 Å²	146	106.5 Å²	106.5	68%	0.682	57%	0.57	S	S	*	*			trans	-97.6	-6.2	-179.4	-67.9	-175.2	-34.1	0	0	113.7	S44 S47 F51	S44-Q49 PolarHBondContact O-N 3.4Å; S47-Q49 VanDerWaalsContact C-N 3.26Å; S47-Q49 PolarHBondContact O-N 3.48Å; Q49-F51 PolarHBondContact O-N 3.34Å
50	Y	45	Very low	53.5	Low	97 Å²	97	109 Å²	109	38%	0.38	58%	0.584	S	S	.	*			trans	-85.8	105.9	-178.8	-146.6	-91.1	0	0	0	112.8	S44 I45 N52	S44-Y50 PolarHBondContact O-N 3.33Å; I45-Y50 HydrophobicContact CG1-CD1 3.94Å; I45-Y50 HydrophobicContact CG1-CD2 4.03Å; I45-Y50 HydrophobicContact CG1-CG 3.61Å; Y50-N52 WeakPolarHBondContact CE1-OD1 3.34Å
51	F	43.5	Very low	53	Low	203 Å²	203	108.9 Å²	108.9	89%	0.89	59%	0.588	S	S	*	*			trans	-84.5	110.2	164.5	-77.9	-97.3	0	0	0	109.2	Q49	Q49-F51 PolarHBondContact O-N 3.34Å
52	N	46.2	Very low	52.2	Low	121 Å²	121	110.4 Å²	110.4	65%	0.647	59%	0.594	S	S	*	*			trans	-87.7	136.4	163.1	-99.1	-42.5	0	0	0	109.9	Y50 V54	Y50-N52 WeakPolarHBondContact CE1-OD1 3.34Å; N52-V54 PolarHBondContact O-N 3.15Å
53	E	43.4	Very low	51.5	Low	183 Å²	183	118.3 Å²	118.3	86%	0.855	62%	0.624	S	S	*	*			trans	-60.5	127.1	171.8	-164.8	165.8	-146.2	0	0	109	V55	E53-V55 PolarHBondContact O-N 3.24Å
54	V	45.5	Very low	50.6	Low	134 Å²	134	120 Å²	120	81%	0.812	62%	0.624	S	S	*	*			trans	-64.1	114.4	-177.3	176.9	0	0	0	0	108	N52 N56	N52-V54 PolarHBondContact O-N 3.15Å; V54-N56 PolarHBondContact O-N 2.92Å
55	V	51.1	Low	49.5	Very low	104 Å²	104	125.6 Å²	125.6	63%	0.63	65%	0.646	S	S	*	*			trans	-58.4	110.8	175.4	176	0	0	0	0	107.8	E53 T57	E53-V55 PolarHBondContact O-N 3.24Å; V55-T57 PolarHBondContact O-N 3.21Å
56	N	46	Very low	48.3	Very low	88 Å²	88	126.7 Å²	126.7	47%	0.471	66%	0.662	S	S	.	*			trans	-67	106.5	-176.6	-172.6	9.5	0	0	0	109.9	V54 D58 S59	V54-N56 PolarHBondContact O-N 2.92Å; N56-D58 PolarHBondContact O-N 3.23Å; N56-D58 WeakPolarHBondContact OD1-CA 3.2Å; N56-D58 VanDerWaalsContact OD1-CB 3.29Å; N56-D58 WeakPolarHBondContact OD1-CB 3.45Å; N56-D58 PolarHBondContact OD1-N 3.13Å; N56-S59 PolarHBondContact O-N 3.32Å; N56-S59 PolarHBondContact O-OG 3.36Å
57	T	54.5	Low	47.5	Very low	108 Å²	108	125.9 Å²	125.9	66%	0.663	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-13.6	173.7	46.6	0	0	0	0	112.8	V55	V55-T57 PolarHBondContact O-N 3.21Å
58	D	52.7	Low	46.2	Very low	134 Å²	134	131.7 Å²	131.7	72%	0.717	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	22.9	-178.8	-43.9	-21.4	0	0	0	111.5	N56	N56-D58 PolarHBondContact O-N 3.23Å; N56-D58 WeakPolarHBondContact OD1-CA 3.2Å; N56-D58 VanDerWaalsContact OD1-CB 3.29Å; N56-D58 WeakPolarHBondContact OD1-CB 3.45Å; N56-D58 PolarHBondContact OD1-N 3.13Å
59	S	49.4	Very low	45.6	Very low	51 Å²	51	135.1 Å²	135.1	36%	0.357	70%	0.695	S	S	.	*			trans	-86.3	131.2	173.3	53.7	0	0	0	0	111.4	N56 D61 F62	N56-S59 PolarHBondContact O-N 3.32Å; N56-S59 PolarHBondContact O-OG 3.36Å; S59-D61 PolarHBondContact O-N 3.26Å; S59-F62 PolarHBondContact O-N 3.5Å; S59-F62 VanDerWaalsContact O-N 3.11Å
60	D	53.5	Low	44.7	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-15.4	-176.5	-67.8	-48.3	0	0	0	114.9	F62	D60-F62 VanDerWaalsContact C-N 3.33Å; D60-F62 PolarHBondContact O-N 2.85Å
61	D	52	Low	43.9	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-4.2	178.8	-70.6	-39.8	0	0	0	114.1	S59 Y63	S59-D61 PolarHBondContact O-N 3.26Å; D61-Y63 PolarHBondContact O-N 3.34Å
62	F	43.7	Very low	43.7	Very low	98 Å²	98	133.6 Å²	133.6	43%	0.43	72%	0.716	S	S	.	*			trans	-92.2	72.2	-171	-158.5	-99.3	0	0	0	115.1	F26 S59 D60 R64	F26-F62 HydrophobicContact CD2-CE2 4.18Å; F26-F62 AromaticContact CD2-CZ 3.83Å; F26-F62 HydrophobicContact CD2-CZ 3.83Å; F26-F62 AromaticContact CE2-CE2 3.88Å; F26-F62 HydrophobicContact CE2-CE2 3.88Å; F26-F62 AromaticContact CE2-CZ 3.78Å; F26-F62 HydrophobicContact CE2-CZ 3.78Å; S59-F62 PolarHBondContact O-N 3.5Å; S59-F62 VanDerWaalsContact O-N 3.11Å; D60-F62 VanDerWaalsContact C-N 3.33Å; D60-F62 PolarHBondContact O-N 2.85Å; F62-R64 HydrophobicContact CE1-CG 3.89Å; F62-R64 PolarHBondContact O-N 3.14Å
63	Y	45.7	Very low	43.1	Very low	184 Å²	184	133.2 Å²	133.2	72%	0.722	72%	0.72	S	S	*	*			trans	-77.5	110.1	173	-81.8	-93.2	0	0	0	113.4	D61	D61-Y63 PolarHBondContact O-N 3.34Å
64	R	42.7	Very low	42.9	Very low	165 Å²	165	130 Å²	130	62%	0.623	72%	0.717	S	S	*	*			trans	-96.4	125.9	161.5	-91.4	-176.2	160.9	-175.5	-7.5	110.2	S24 F62	S24-R64 PolarHBondContact OG-NH2 3.48Å; S24-R64 VanDerWaalsContact OG-NH2 3.13Å; F62-R64 HydrophobicContact CE1-CG 3.89Å; F62-R64 PolarHBondContact O-N 3.14Å
65	H	39.2	Very low	42.9	Very low	158 Å²	158	131.5 Å²	131.5	73%	0.731	72%	0.715	S	S	*	*			trans	-106.6	118.5	-179.1	-81.1	-67.8	0	0	0	113.2
66	S	34.4	Very low	42.6	Very low	110 Å²	110	132 Å²	132	77%	0.769	71%	0.714	S	S	*	*			trans	68.3	160.4	146.5	-78.7	0	0	0	0	120.9
67	P	42.1	Very low	42.6	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	72%	0.723	S	S	*	*			cis	-138.4	-171.2	-31.3	35	-14.9	0	0	0	114.3
68	E	35.3	Very low	42.3	Very low	189 Å²	189	132.4 Å²	132.4	88%	0.883	72%	0.717	S	S	*	*			trans	83.2	79	162.6	-59.7	-170.2	143.9	0	0	120.3
69	C	36.9	Very low	42.3	Very low	139 Å²	139	128.1 Å²	128.1	94%	0.939	70%	0.697	S	S	*	*				-155.5	163.1	126	-148	0	0	0	0	111.4
70	A	35.3	Very low	42.2	Very low	94 Å²	94	128.3 Å²	128.3	78%	0.777	70%	0.702	S	S	*	*			trans	-76.6	151.8	-162.1	0	0	0	0	0	116.2	V72	A70-V72 PolarHBondContact O-N 3.02Å
71	F	29.7	Very low	42	Very low	196 Å²	196	127.5 Å²	127.5	86%	0.86	69%	0.691	S	S	*	*			trans	-73.7	114.5	-170.3	-151.6	-93.4	0	0	0	113.1	P73	F71-P73 HydrophobicContact CE1-CB 4.31Å
72	V	38	Very low	41.9	Very low	124 Å²	124	126.8 Å²	126.8	75%	0.752	68%	0.678	S	S	*	*			trans	-117.3	116.7	158.4	178.1	0	0	0	0	106.9	A70 C74	A70-V72 PolarHBondContact O-N 3.02Å; V72-C74 PolarHBondContact O-N 3.26Å; V72-C74 VanDerWaalsContact O-N 3.12Å
73	P	33.9	Very low	42.4	Very low	112 Å²	112	125.5 Å²	125.5	73%	0.727	68%	0.681	S	S	*	*			trans	-72.7	107.5	176.9	29.3	-31.3	0	0	0	108.6	F71	F71-P73 HydrophobicContact CE1-CB 4.31Å
74	C	38.4	Very low	42.6	Very low	117 Å²	117	120.1 Å²	120.1	79%	0.791	67%	0.67	S	S	*	*			trans	-120.7	133.6	171.4	-154.3	0	0	0	0	108.6	V72	V72-C74 PolarHBondContact O-N 3.26Å; V72-C74 VanDerWaalsContact O-N 3.12Å
75	E	45.7	Very low	43.2	Very low	165 Å²	165	116 Å²	116	77%	0.771	66%	0.66	S	S	*	*			trans	-45	139.9	-173.9	-58.7	-82.7	133.9	0	0	112.9
76	D	45.2	Very low	43.9	Very low	113 Å²	113	112.5 Å²	112.5	60%	0.604	65%	0.646	S	S	*	*			trans	-49	124	178.8	-84.8	-51.6	0	0	0	111.6	L78 S79 A80	D76-L78 HydrophobicContact CB-CB 4.48Å; D76-L78 PolarHBondContact O-N 3.3Å; D76-L78 VanDerWaalsContact O-N 3.12Å; D76-S79 WeakPolarHBondContact O-CA 3.18Å; D76-S79 WeakPolarHBondContact O-CB 3.17Å; D76-S79 PolarHBondContact O-N 3.1Å; D76-S79 PolarHBondContact O-OG 2.79Å; D76-A80 PolarHBondContact O-N 3.39Å
77	P	46.7	Very low	44.7	Very low	101 Å²	101	110.4 Å²	110.4	66%	0.656	63%	0.632	S	S	*	*	H	α-helix	trans	-63.1	-20.1	170.4	25.8	-32.9	0	0	0	111.6	A80 F81	P77-A80 PolarHBondContact O-N 3.36Å; P77-F81 PolarHBondContact O-N 3.01Å
78	L	46.8	Very low	44.9	Very low	104 Å²	104	111.6 Å²	111.6	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-70.8	-32.7	166.7	-68.4	177.5	0	0	0	112.8	D76 A80 F81 Y82	D76-L78 HydrophobicContact CB-CB 4.48Å; D76-L78 PolarHBondContact O-N 3.3Å; D76-L78 VanDerWaalsContact O-N 3.12Å; L78-A80 PolarHBondContact O-N 2.85Å; L78-F81 PolarHBondContact O-N 3.18Å; L78-Y82 HydrophobicContact CB-CD2 4.09Å; L78-Y82 HydrophobicContact CB-CE2 4.14Å; L78-Y82 WeakPolarHBondContact O-CB 3.36Å; L78-Y82 WeakPolarHBondContact O-CD2 3.44Å; L78-Y82 PolarHBondContact O-N 3.21Å
79	S	53.1	Low	45.6	Very low	44 Å²	44	108.2 Å²	108.2	31%	0.308	61%	0.61	S	S	.	*	H	α-helix	trans	-66	-31	173.5	84.8	0	0	0	0	111.3	D76 S83	D76-S79 WeakPolarHBondContact O-CA 3.18Å; D76-S79 WeakPolarHBondContact O-CB 3.17Å; D76-S79 PolarHBondContact O-N 3.1Å; D76-S79 PolarHBondContact O-OG 2.79Å; S79-S83 WeakPolarHBondContact O-CA 3.11Å; S79-S83 WeakPolarHBondContact O-CB 3.22Å; S79-S83 PolarHBondContact O-N 2.87Å; S79-S83 PolarHBondContact O-OG 3.22Å
80	A	48.2	Very low	46.3	Very low	55 Å²	55	107.2 Å²	107.2	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-69.4	-39.9	172.1	0	0	0	0	0	112.5	D76 P77 L78 S84	D76-A80 PolarHBondContact O-N 3.39Å; P77-A80 PolarHBondContact O-N 3.36Å; L78-A80 PolarHBondContact O-N 2.85Å; A80-S84 VanDerWaalsContact O-CB 3.31Å; A80-S84 WeakPolarHBondContact O-CB 3.48Å; A80-S84 PolarHBondContact O-N 3.21Å; A80-S84 PolarHBondContact O-OG 3.19Å
81	F	48.7	Very low	46.9	Very low	145 Å²	145	105.9 Å²	105.9	64%	0.636	58%	0.58	S	S	*	*	H	α-helix	trans	-70.6	-44.5	174	-97.2	-90	0	0	0	112.8	P77 L78 S84 I85	P77-F81 PolarHBondContact O-N 3.01Å; L78-F81 PolarHBondContact O-N 3.18Å; F81-S84 CarbonylContact O-C 3.57Å; F81-S84 WeakPolarHBondContact O-CB 3.35Å; F81-S84 PolarHBondContact O-N 3.13Å; F81-I85 WeakPolarHBondContact O-CB 3.42Å; F81-I85 VanDerWaalsContact O-CG1 3.31Å; F81-I85 WeakPolarHBondContact O-CG1 3.41Å; F81-I85 PolarHBondContact O-N 3.21Å
82	Y	50.9	Low	47.7	Very low	140 Å²	140	100.7 Å²	100.7	55%	0.549	56%	0.559	S	S	.	*	H	α-helix	trans	-68.4	-32.8	174.2	-74.4	-64.4	0	0	0	112.2	L78 S84 I85 N86	L78-Y82 HydrophobicContact CB-CD2 4.09Å; L78-Y82 HydrophobicContact CB-CE2 4.14Å; L78-Y82 WeakPolarHBondContact O-CB 3.36Å; L78-Y82 WeakPolarHBondContact O-CD2 3.44Å; L78-Y82 PolarHBondContact O-N 3.21Å; Y82-S84 VanDerWaalsContact C-N 3.35Å; Y82-I85 PolarHBondContact O-N 2.9Å; Y82-N86 WeakPolarHBondContact O-CB 3.29Å; Y82-N86 PolarHBondContact O-N 3.18Å; Y82-N86 PolarHBondContact O-ND2 3.31Å; Y82-N86 PolarHBondContact O-OD1 3.11Å
83	S	53.3	Low	48.3	Very low	71 Å²	71	102.9 Å²	102.9	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-68.3	-36	169.8	-63.1	0	0	0	0	111.5	S79 S87	S79-S83 WeakPolarHBondContact O-CA 3.11Å; S79-S83 WeakPolarHBondContact O-CB 3.22Å; S79-S83 PolarHBondContact O-N 2.87Å; S79-S83 PolarHBondContact O-OG 3.22Å; S83-S87 VanDerWaalsContact O-CB 3.22Å; S83-S87 WeakPolarHBondContact O-CB 3.32Å; S83-S87 PolarHBondContact O-N 2.91Å; S83-S87 PolarHBondContact O-OG 3.01Å
84	S	49.8	Very low	48.9	Very low	71 Å²	71	102.2 Å²	102.2	50%	0.497	56%	0.559	S	S	.	*	H	α-helix	trans	-68.4	-37.9	174	-60.4	0	0	0	0	112	A80 F81 Y82 S87 F88	A80-S84 VanDerWaalsContact O-CB 3.31Å; A80-S84 WeakPolarHBondContact O-CB 3.48Å; A80-S84 PolarHBondContact O-N 3.21Å; A80-S84 PolarHBondContact O-OG 3.19Å; F81-S84 CarbonylContact O-C 3.57Å; F81-S84 WeakPolarHBondContact O-CB 3.35Å; F81-S84 PolarHBondContact O-N 3.13Å; Y82-S84 VanDerWaalsContact C-N 3.35Å; S84-S87 PolarHBondContact O-OG 2.9Å; S84-F88 WeakPolarHBondContact O-CB 3.46Å; S84-F88 PolarHBondContact O-N 2.88Å
85	I	56.3	Low	49.1	Very low	80 Å²	80	100 Å²	100	41%	0.41	55%	0.545	S	S	.	.	H	α-helix	trans	-74.5	-44.5	177	-68.9	165.9	0	0	0	111.1	F81 Y82 F88 E89	F81-I85 WeakPolarHBondContact O-CB 3.42Å; F81-I85 VanDerWaalsContact O-CG1 3.31Å; F81-I85 WeakPolarHBondContact O-CG1 3.41Å; F81-I85 PolarHBondContact O-N 3.21Å; Y82-I85 PolarHBondContact O-N 2.9Å; I85-F88 CarbonylContact O-C 3.54Å; I85-F88 WeakPolarHBondContact O-CA 3.42Å; I85-F88 VanDerWaalsContact O-CB 3.25Å; I85-F88 WeakPolarHBondContact O-CB 3.49Å; I85-F88 PolarHBondContact O-N 3.13Å; I85-E89 PolarHBondContact O-N 3.05Å
86	N	52.6	Low	48.9	Very low	83 Å²	83	99 Å²	99	44%	0.444	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-39.6	177.7	-67	-13.4	0	0	0	111.4	Y82 F88 E89 D90	Y82-N86 WeakPolarHBondContact O-CB 3.29Å; Y82-N86 PolarHBondContact O-N 3.18Å; Y82-N86 PolarHBondContact O-ND2 3.31Å; Y82-N86 PolarHBondContact O-OD1 3.11Å; N86-F88 PolarHBondContact O-N 2.88Å; N86-E89 PolarHBondContact O-N 2.74Å; N86-D90 WeakPolarHBondContact O-CB 3.36Å; N86-D90 PolarHBondContact O-N 2.69Å
87	S	50.8	Low	48.7	Very low	66 Å²	66	98.5 Å²	98.5	46%	0.462	55%	0.549	S	S	.	.	H	α-helix	trans	-69.3	-22.5	170.6	60.9	0	0	0	0	112.8	S83 S84 S91	S83-S87 VanDerWaalsContact O-CB 3.22Å; S83-S87 WeakPolarHBondContact O-CB 3.32Å; S83-S87 PolarHBondContact O-N 2.91Å; S83-S87 PolarHBondContact O-OG 3.01Å; S84-S87 PolarHBondContact O-OG 2.9Å; S87-S91 WeakPolarHBondContact O-CB 3.19Å; S87-S91 PolarHBondContact O-N 2.65Å; S87-S91 PolarHBondContact O-OG 3.09Å
88	F	47.9	Very low	48.6	Very low	135 Å²	135	102.1 Å²	102.1	59%	0.592	56%	0.557	S	S	*	*	H	α-helix	trans	-72.9	-42.5	167.1	-140.2	-112.9	0	0	0	111.9	S84 I85 N86 S91 Q92	S84-F88 WeakPolarHBondContact O-CB 3.46Å; S84-F88 PolarHBondContact O-N 2.88Å; I85-F88 CarbonylContact O-C 3.54Å; I85-F88 WeakPolarHBondContact O-CA 3.42Å; I85-F88 VanDerWaalsContact O-CB 3.25Å; I85-F88 WeakPolarHBondContact O-CB 3.49Å; I85-F88 PolarHBondContact O-N 3.13Å; N86-F88 PolarHBondContact O-N 2.88Å; F88-S91 CarbonylContact O-C 3.49Å; F88-S91 PolarHBondContact O-N 2.86Å; F88-Q92 HydrophobicContact CD1-CG 4.1Å; F88-Q92 VanDerWaalsContact CE1-NE2 3.32Å; F88-Q92 WeakPolarHBondContact O-CB 3.07Å; F88-Q92 WeakPolarHBondContact O-CG 3.43Å; F88-Q92 PolarHBondContact O-N 2.9Å
89	E	49.8	Very low	48.5	Very low	118 Å²	118	105.5 Å²	105.5	55%	0.551	57%	0.567	S	S	*	*	H	α-helix	trans	-69.8	-41.6	-180	-69.8	-161.6	145.6	0	0	112.5	I85 N86 S91 Q92 Q93	I85-E89 PolarHBondContact O-N 3.05Å; N86-E89 PolarHBondContact O-N 2.74Å; E89-S91 PolarHBondContact O-N 3.49Å; E89-Q92 PolarHBondContact O-N 2.61Å; E89-Q93 PolarHBondContact O-N 3.29Å; E89-Q93 VanDerWaalsContact O-N 3.15Å
90	D	51	Low	48.3	Very low	118 Å²	118	113.1 Å²	113.1	63%	0.631	60%	0.595	S	S	*	*	H	α-helix	trans	-64.6	-29	170.9	-76	-27.7	0	0	0	112	N86 S94	N86-D90 WeakPolarHBondContact O-CB 3.36Å; N86-D90 PolarHBondContact O-N 2.69Å; D90-S94 PolarHBondContact O-OG 3.39Å
91	S	48.5	Very low	48.1	Very low	65 Å²	65	117 Å²	117	46%	0.455	61%	0.608	S	S	.	*	H	α-helix	trans	-82.2	-25.2	173.5	-61.5	0	0	0	0	113.8	S87 F88 E89 S94 S95	S87-S91 WeakPolarHBondContact O-CB 3.19Å; S87-S91 PolarHBondContact O-N 2.65Å; S87-S91 PolarHBondContact O-OG 3.09Å; F88-S91 CarbonylContact O-C 3.49Å; F88-S91 PolarHBondContact O-N 2.86Å; E89-S91 PolarHBondContact O-N 3.49Å; S91-S94 PolarHBondContact O-N 2.95Å; S91-S94 PolarHBondContact O-OG 3.3Å; S91-S95 WeakPolarHBondContact O-CB 3.2Å; S91-S95 PolarHBondContact O-N 3.04Å; S91-S95 PolarHBondContact O-OG 3.21Å
92	Q	46.6	Very low	48	Very low	88 Å²	88	114.2 Å²	114.2	41%	0.411	61%	0.612	S	S	.	*	H	α-helix	trans	-73.5	-35.9	175.8	-72.7	-102.3	13	0	0	111	F88 E89 S94 S95	F88-Q92 HydrophobicContact CD1-CG 4.1Å; F88-Q92 VanDerWaalsContact CE1-NE2 3.32Å; F88-Q92 WeakPolarHBondContact O-CB 3.07Å; F88-Q92 WeakPolarHBondContact O-CG 3.43Å; F88-Q92 PolarHBondContact O-N 2.9Å; E89-Q92 PolarHBondContact O-N 2.61Å; Q92-S94 PolarHBondContact O-N 3.07Å; Q92-S95 PolarHBondContact O-N 2.92Å
93	Q	50.1	Low	47.8	Very low	170 Å²	170	111.6 Å²	111.6	79%	0.794	61%	0.614	S	S	*	*	H	α-helix	trans	-67.6	-17.8	174.9	-67	-171.8	31.2	0	0	113.6	E89	E89-Q93 PolarHBondContact O-N 3.29Å; E89-Q93 VanDerWaalsContact O-N 3.15Å
94	S	46.7	Very low	47.4	Very low	97 Å²	97	116.5 Å²	116.5	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-104.8	-9.3	179	55.6	0	0	0	0	115.2	D90 S91 Q92	D90-S94 PolarHBondContact O-OG 3.39Å; S91-S94 PolarHBondContact O-N 2.95Å; S91-S94 PolarHBondContact O-OG 3.3Å; Q92-S94 PolarHBondContact O-N 3.07Å
95	S	42.6	Very low	47.7	Very low	71 Å²	71	120.3 Å²	120.3	50%	0.497	65%	0.648	S	S	.	*	H	α-helix	trans	-109.1	-9.8	-175.1	54	0	0	0	0	115.7	S91 Q92 S97	S91-S95 WeakPolarHBondContact O-CB 3.2Å; S91-S95 PolarHBondContact O-N 3.04Å; S91-S95 PolarHBondContact O-OG 3.21Å; Q92-S95 PolarHBondContact O-N 2.92Å; S95-S97 VanDerWaalsContact C-N 3.28Å; S95-S97 PolarHBondContact O-N 3.46Å
96	L	41.8	Very low	48	Very low	144 Å²	144	126.6 Å²	126.6	75%	0.754	67%	0.667	S	S	*	*			trans	-77.4	63.6	178.3	-77.8	164.6	0	0	0	114.2
97	S	40.5	Very low	48.4	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	69%	0.688	S	S	*	*			trans	-112.7	21.7	170.3	65.4	0	0	0	0	114.2	S95 K99	S95-S97 VanDerWaalsContact C-N 3.28Å; S95-S97 PolarHBondContact O-N 3.46Å; S97-K99 VanDerWaalsContact C-N 3.28Å; S97-K99 PolarHBondContact O-N 2.74Å
98	H	44.9	Very low	49.1	Very low	177 Å²	177	132.7 Å²	132.7	82%	0.819	69%	0.688	S	S	*	*			trans	-71.9	82.4	170.2	-74.4	2.6	0	0	0	111.7	K100	H98-K100 PolarHBondContact O-N 2.87Å
99	K	45.3	Very low	50.3	Low	176 Å²	176	129 Å²	129	77%	0.765	68%	0.678	S	S	*	*			trans	-54.1	96.3	169.4	-112.1	177.5	177.1	172.2	0	110.5	S97 N101	S97-K99 VanDerWaalsContact C-N 3.28Å; S97-K99 PolarHBondContact O-N 2.74Å; K99-N101 PolarHBondContact O-N 3.41Å
100	K	48.7	Very low	51.3	Low	203 Å²	203	127.3 Å²	127.3	88%	0.883	69%	0.685	S	S	*	*			trans	-68.3	76.1	164.3	-72.6	-177	178.4	176.2	0	109.4	H98 A102	H98-K100 PolarHBondContact O-N 2.87Å; K100-A102 PolarHBondContact O-N 2.87Å
101	N	43.5	Very low	52.4	Low	136 Å²	136	129.7 Å²	129.7	73%	0.727	69%	0.692	S	S	*	*			trans	-74.3	70.5	175.7	-76	-9.8	0	0	0	110.6	K99 S103	K99-N101 PolarHBondContact O-N 3.41Å; N101-S103 PolarHBondContact O-N 3.33Å; N101-S103 VanDerWaalsContact O-N 3.11Å
102	A	47.3	Very low	53.6	Low	87 Å²	87	130.5 Å²	130.5	72%	0.719	69%	0.689	S	S	*	*			trans	-76.3	94.4	172.1	0	0	0	0	0	110.5	K100	K100-A102 PolarHBondContact O-N 2.87Å
103	S	45.6	Very low	54.7	Low	86 Å²	86	129.5 Å²	129.5	60%	0.601	69%	0.688	S	S	*	*			trans	34.1	94.3	148	60	0	0	0	0	119.2	N101	N101-S103 PolarHBondContact O-N 3.33Å; N101-S103 VanDerWaalsContact O-N 3.11Å
104	N	45.5	Very low	55.7	Low	174 Å²	174	125.5 Å²	125.5	93%	0.93	67%	0.672	S	S	*	*			trans	-119.7	66.8	139.8	-92.3	-34.7	0	0	0	108	R106	N104-R106 PolarHBondContact O-N 2.92Å
105	I	56.4	Low	57	Low	151 Å²	151	129 Å²	129	77%	0.774	68%	0.675	S	S	*	*			trans	-80.7	107.2	-178.2	-60.5	174.8	0	0	0	108.4	Q107	I105-Q107 PolarHBondContact O-N 3.4Å
106	R	61.4	Low	58.3	Low	211 Å²	211	133.6 Å²	133.6	80%	0.796	68%	0.683	S	S	*	*			trans	-60	125.5	166.7	-170.8	-179.5	-172.2	-170.6	1.2	108.1	N104 L108	N104-R106 PolarHBondContact O-N 2.92Å; R106-L108 PolarHBondContact O-N 2.87Å
107	Q	61.3	Low	59.6	Low	191 Å²	191	134.4 Å²	134.4	89%	0.893	68%	0.681	S	S	*	*			trans	-61.8	111.9	171.8	-71.9	-179.3	-10.7	0	0	108.6	I105	I105-Q107 PolarHBondContact O-N 3.4Å
108	L	66.3	Low	61	Low	87 Å²	87	133 Å²	133	46%	0.455	67%	0.669	S	S	.	*			trans	-89.8	145.9	172	-67.8	172.2	0	0	0	109	R106 E112 V113	R106-L108 PolarHBondContact O-N 2.87Å; L108-E112 HydrophobicContact CB-CB 4.21Å; L108-V113 HydrophobicContact CB-CG2 4.17Å
109	S	72.9	Confident	61.9	Low	56 Å²	56	129.2 Å²	129.2	39%	0.392	66%	0.662	S	S	.	*			trans	-69.7	158.2	176.1	62.6	0	0	0	0	111.6	E111 E112 V113	S109-E111 PolarHBondContact O-N 3.24Å; S109-E112 WeakPolarHBondContact CB-OE2 3.34Å; S109-E112 PolarHBondContact N-OE2 2.82Å; S109-E112 WeakPolarHBondContact O-CB 3.36Å; S109-E112 PolarHBondContact O-N 3.44Å; S109-E112 VanDerWaalsContact OG-CD 3.31Å; S109-E112 VanDerWaalsContact OG-CG 3.32Å; S109-E112 WeakPolarHBondContact OG-CG 3.33Å; S109-E112 PolarHBondContact OG-OE2 3.12Å; S109-V113 WeakPolarHBondContact O-CG2 3.42Å; S109-V113 PolarHBondContact O-N 3.43Å
110	A	70.5	Confident	62.9	Low	83 Å²	83	129 Å²	129	69%	0.686	66%	0.662	S	S	*	*	H	α-helix	trans	-57.7	-36.2	-178.8	0	0	0	0	0	112.9	V113 D114	A110-V113 PolarHBondContact O-N 3.45Å; A110-D114 PolarHBondContact O-N 3.42Å
111	E	73.5	Confident	63.3	Low	168 Å²	168	125 Å²	125	79%	0.785	66%	0.656	S	S	*	*	H	α-helix	trans	-67.7	-34.2	176.7	-62.4	-178.6	157.1	0	0	112.7	S109 K115	S109-E111 PolarHBondContact O-N 3.24Å; E111-K115 PolarHBondContact O-N 3.26Å
112	E	74.3	Confident	64.1	Low	83 Å²	83	125.3 Å²	125.3	39%	0.388	66%	0.657	S	S	.	*	H	α-helix	trans	-70.3	-38.7	172.9	-70.8	167.5	123.5	0	0	111.1	L108 S109 K115 Y116	L108-E112 HydrophobicContact CB-CB 4.21Å; S109-E112 WeakPolarHBondContact CB-OE2 3.34Å; S109-E112 PolarHBondContact N-OE2 2.82Å; S109-E112 WeakPolarHBondContact O-CB 3.36Å; S109-E112 PolarHBondContact O-N 3.44Å; S109-E112 VanDerWaalsContact OG-CD 3.31Å; S109-E112 VanDerWaalsContact OG-CG 3.32Å; S109-E112 WeakPolarHBondContact OG-CG 3.33Å; S109-E112 PolarHBondContact OG-OE2 3.12Å; E112-K115 PolarHBondContact O-N 3.22Å; E112-Y116 WeakPolarHBondContact O-CD2 3.44Å; E112-Y116 PolarHBondContact O-N 3.4Å
113	V	69	Low	64.4	Low	67 Å²	67	126.6 Å²	126.6	41%	0.406	66%	0.655	S	S	.	*	H	α-helix	trans	-65	-48	177.8	176.7	0	0	0	0	111.4	L108 S109 A110 K115 Y116 F117	L108-V113 HydrophobicContact CB-CG2 4.17Å; S109-V113 WeakPolarHBondContact O-CG2 3.42Å; S109-V113 PolarHBondContact O-N 3.43Å; A110-V113 PolarHBondContact O-N 3.45Å; V113-K115 PolarHBondContact O-N 3.3Å; V113-Y116 PolarHBondContact O-N 2.69Å; V113-Y116 VanDerWaalsContact O-N 3.13Å; V113-F117 HydrophobicContact CG1-CD2 4.44Å; V113-F117 PolarHBondContact O-N 2.99Å
114	D	71	Confident	64.5	Low	85 Å²	85	132.8 Å²	132.8	46%	0.455	67%	0.665	S	S	.	*	H	α-helix	trans	-63.4	-24.1	178.3	-113.2	-21.5	0	0	0	112.5	A110 F117 P118 S119	A110-D114 PolarHBondContact O-N 3.42Å; D114-F117 CarbonylContact O-C 3.57Å; D114-P118 WeakPolarHBondContact O-CA 3.33Å; D114-S119 WeakPolarHBondContact OD1-CB 3.34Å; D114-S119 PolarHBondContact OD1-N 2.78Å; D114-S119 PolarHBondContact OD1-OG 2.63Å
115	K	75.7	Confident	64.6	Low	171 Å²	171	130.2 Å²	130.2	74%	0.743	66%	0.656	S	S	*	*	H	α-helix	trans	-72.9	-34.5	174.8	-171.8	178.1	-179.4	-179.2	0	113.1	E111 E112 V113	E111-K115 PolarHBondContact O-N 3.26Å; E112-K115 PolarHBondContact O-N 3.22Å; V113-K115 PolarHBondContact O-N 3.3Å
116	Y	68.1	Low	64.2	Low	168 Å²	168	129.9 Å²	129.9	66%	0.659	66%	0.656	S	S	*	*	H	α-helix	trans	-89.7	-29.5	177	-71.8	-70.5	0	0	0	112.9	E112 V113	E112-Y116 WeakPolarHBondContact O-CD2 3.44Å; E112-Y116 PolarHBondContact O-N 3.4Å; V113-Y116 PolarHBondContact O-N 2.69Å; V113-Y116 VanDerWaalsContact O-N 3.13Å
117	F	69.6	Low	63.3	Low	160 Å²	160	128.8 Å²	128.8	70%	0.702	66%	0.657	S	S	*	*	S	Bend	trans	-129.4	67.9	-178.1	-60.3	-82.5	0	0	0	110.3	V113 D114 S119	V113-F117 HydrophobicContact CG1-CD2 4.44Å; V113-F117 PolarHBondContact O-N 2.99Å; D114-F117 CarbonylContact O-C 3.57Å; F117-S119 PolarHBondContact O-N 2.93Å
118	P	70.5	Confident	62.4	Low	73 Å²	73	125.6 Å²	125.6	47%	0.474	65%	0.653	S	S	.	*			trans	-57.7	117.3	-177.8	22.9	-33.7	0	0	0	110.5	D114 K120	D114-P118 WeakPolarHBondContact O-CA 3.33Å; P118-K120 PolarHBondContact O-N 3.28Å
119	S	62.9	Low	61.1	Low	97 Å²	97	128 Å²	128	68%	0.678	67%	0.666	S	S	*	*	S	Bend	trans	-66.9	9.3	-174.2	45.5	0	0	0	0	115.2	D114 F117	D114-S119 WeakPolarHBondContact OD1-CB 3.34Å; D114-S119 PolarHBondContact OD1-N 2.78Å; D114-S119 PolarHBondContact OD1-OG 2.63Å; F117-S119 PolarHBondContact O-N 2.93Å
120	K	65.8	Low	59.9	Low	173 Å²	173	132 Å²	132	75%	0.752	69%	0.688	S	S	*	*	S	Bend	trans	-131	122.9	168.5	-66.1	176.7	-176.1	171.9	0	109.1	P118 I122	P118-K120 PolarHBondContact O-N 3.28Å; K120-I122 PolarHBondContact O-N 3.46Å
121	P	58.6	Low	58.2	Low	118 Å²	118	132.8 Å²	132.8	77%	0.766	70%	0.695	S	S	*	*			trans	-63.4	132.1	179.5	26.2	-33.7	0	0	0	110.4	V123	P121-V123 PolarHBondContact O-N 2.9Å
122	I	59.1	Low	56.8	Low	143 Å²	143	133 Å²	133	73%	0.733	70%	0.701	S	S	*	*			trans	-67.7	98.2	174.4	-61.8	171.1	0	0	0	108	K120 R124	K120-I122 PolarHBondContact O-N 3.46Å; I122-R124 PolarHBondContact O-N 3.41Å
123	V	54.2	Low	55.4	Low	113 Å²	113	139.3 Å²	139.3	69%	0.685	73%	0.727	S	S	*	*			trans	-66.4	100.2	174.3	-176.2	0	0	0	0	108.2	P121 T125	P121-V123 PolarHBondContact O-N 2.9Å; V123-T125 VanDerWaalsContact C-N 3.3Å; V123-T125 HydrophobicContact CG1-CG2 3.85Å; V123-T125 PolarHBondContact O-N 2.83Å
124	R	48.1	Very low	54.6	Low	216 Å²	216	141.4 Å²	141.4	82%	0.815	75%	0.745	S	S	*	*			trans	-70.7	86.9	172.9	-70.9	-176.2	178.3	167.6	-0.1	109.6	I122 N126	I122-R124 PolarHBondContact O-N 3.41Å; R124-N126 PolarHBondContact O-N 3.48Å
125	T	46.4	Very low	54.4	Low	121 Å²	121	146.3 Å²	146.3	74%	0.742	77%	0.765	S	S	*	*			trans	-74.5	65.6	173.8	57.2	0	0	0	0	111.3	V123 K127	V123-T125 VanDerWaalsContact C-N 3.3Å; V123-T125 HydrophobicContact CG1-CG2 3.85Å; V123-T125 PolarHBondContact O-N 2.83Å; T125-K127 PolarHBondContact O-N 2.86Å
126	N	48.4	Very low	54.4	Low	143 Å²	143	143.2 Å²	143.2	77%	0.765	75%	0.751	S	S	*	*			trans	-85.8	108.3	170.6	-71.4	2.8	0	0	0	108.4	R124	R124-N126 PolarHBondContact O-N 3.48Å
127	K	43.7	Very low	55.2	Low	189 Å²	189	138.2 Å²	138.2	82%	0.822	74%	0.741	S	S	*	*			trans	-60.1	143.2	173.4	-81.1	179.8	172.7	179.5	0	110.4	T125 D129	T125-K127 PolarHBondContact O-N 2.86Å; K127-D129 PolarHBondContact O-N 2.83Å
128	P	41	Very low	55.7	Low	124 Å²	124	133.4 Å²	133.4	81%	0.805	74%	0.736	S	S	*	*			trans	-87.8	110.1	-179.3	33.5	-30.9	0	0	0	110.7
129	D	40	Very low	56.1	Low	138 Å²	138	135.8 Å²	135.8	74%	0.738	74%	0.744	S	S	*	*			trans	-127	140.7	166	-79.7	-55.5	0	0	0	109.9	K127	K127-D129 PolarHBondContact O-N 2.83Å
130	T	47.6	Very low	56.9	Low	138 Å²	138	134.3 Å²	134.3	85%	0.847	73%	0.731	S	S	*	*	S	Bend	trans	65.4	82.2	173.9	53.2	0	0	0	0	119.3
131	A	34.4	Very low	57.6	Low	101 Å²	101	129.7 Å²	129.7	84%	0.835	71%	0.714	S	S	*	*				48.7	87.5	121.4	0	0	0	0	0	120.5
132	L	43.5	Very low	58.4	Low	173 Å²	173	126.5 Å²	126.5	91%	0.906	70%	0.698	S	S	*	*			trans	-134.9	131.8	138.3	-95.6	161.4	0	0	0	107.2	S134	L132-S134 PolarHBondContact O-N 2.89Å
133	K	46.6	Very low	59.3	Low	214 Å²	214	123.9 Å²	123.9	93%	0.93	69%	0.685	S	S	*	*			trans	-69.3	102.9	-179.5	-73.8	-179.2	179.1	176.7	0	108.5
134	S	51.1	Low	60.4	Low	112 Å²	112	121.6 Å²	121.6	78%	0.783	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-61	136.5	-168.4	54.5	0	0	0	0	113.1	L132	L132-S134 PolarHBondContact O-N 2.89Å
135	E	66.7	Low	61.7	Low	187 Å²	187	117.7 Å²	117.7	87%	0.874	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-55.2	148.6	172.8	-64.8	168.1	122	0	0	111.6
136	K	76	Confident	62.5	Low	107 Å²	107	113.3 Å²	113.3	47%	0.465	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-61.6	139.6	176.5	-63.3	176.4	-170.8	171.8	0	109	T140 L141 E144	K136-T140 HydrophobicContact CB-CG2 4.13Å; K136-T140 HydrophobicContact CD-CG2 4.45Å; K136-T140 HydrophobicContact CG-CG2 4.46Å; K136-L141 HydrophobicContact CB-CD2 3.85Å; K136-L141 HydrophobicContact CB-CG 3.88Å; K136-L141 HydrophobicContact CD-CD2 4.03Å; K136-E144 WeakPolarHBondContact CD-OE2 3.33Å; K136-E144 WeakPolarHBondContact CE-OE2 3.21Å; K136-E144 IonicContact NZ-OE1 2.64Å; K136-E144 PolarHBondContact NZ-OE1 3.18Å; K136-E144 IonicContact NZ-OE2 3.16Å; K136-E144 PolarHBondContact NZ-OE2 2.98Å
137	S	84.1	Confident	63.4	Low	63 Å²	63	113.2 Å²	113.2	44%	0.441	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-59.3	152.2	178.5	82.3	0	0	0	0	111.2	L139 T140 L141	S137-L139 PolarHBondContact O-N 3.44Å; S137-L139 VanDerWaalsContact O-N 3.16Å; S137-T140 CarbonylContact O-C 3.58Å; S137-T140 WeakPolarHBondContact O-CA 3.38Å; S137-T140 VanDerWaalsContact O-CB 3.32Å; S137-T140 WeakPolarHBondContact O-CB 3.46Å; S137-T140 PolarHBondContact O-N 2.88Å; S137-T140 WeakPolarHBondContact OG-CB 3.34Å; S137-T140 PolarHBondContact OG-N 2.85Å; S137-T140 PolarHBondContact OG-OG1 2.79Å; S137-L141 PolarHBondContact O-N 3.43Å
138	G	81.2	Confident	64.2	Low	58 Å²	58	110.8 Å²	110.8	60%	0.598	62%	0.622	S	S	*	*	H	α-helix	trans	-55	-35.3	177.9	0	0	0	0	0	113.4	L141 A142	G138-L141 PolarHBondContact O-N 2.89Å; G138-A142 WeakPolarHBondContact O-CB 3.25Å; G138-A142 PolarHBondContact O-N 3.06Å
139	L	78.9	Confident	65.1	Low	124 Å²	124	107.9 Å²	107.9	65%	0.649	61%	0.605	S	S	*	*	H	α-helix	trans	-67.9	-40.1	172.4	-178.9	64.3	0	0	0	112.2	S137 A142 L143	S137-L139 PolarHBondContact O-N 3.44Å; S137-L139 VanDerWaalsContact O-N 3.16Å; L139-A142 PolarHBondContact O-N 3.24Å; L139-L143 HydrophobicContact CD1-CD1 4.26Å; L139-L143 HydrophobicContact CD1-CG 4.33Å; L139-L143 HydrophobicContact CG-CD1 4.04Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.35Å; L139-L143 PolarHBondContact O-N 2.89Å
140	T	79.6	Confident	65.9	Low	66 Å²	66	102.1 Å²	102.1	41%	0.405	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-42.5	174.8	-51.2	0	0	0	0	111	K136 S137 L143 E144	K136-T140 HydrophobicContact CB-CG2 4.13Å; K136-T140 HydrophobicContact CD-CG2 4.45Å; K136-T140 HydrophobicContact CG-CG2 4.46Å; S137-T140 CarbonylContact O-C 3.58Å; S137-T140 WeakPolarHBondContact O-CA 3.38Å; S137-T140 VanDerWaalsContact O-CB 3.32Å; S137-T140 WeakPolarHBondContact O-CB 3.46Å; S137-T140 PolarHBondContact O-N 2.88Å; S137-T140 WeakPolarHBondContact OG-CB 3.34Å; S137-T140 PolarHBondContact OG-N 2.85Å; S137-T140 PolarHBondContact OG-OG1 2.79Å; T140-L143 PolarHBondContact O-N 2.96Å; T140-E144 WeakPolarHBondContact O-CB 3.27Å; T140-E144 PolarHBondContact O-N 3.01Å
141	L	79.7	Confident	66.2	Low	76 Å²	76	98.9 Å²	98.9	40%	0.398	55%	0.552	S	S	.	*	H	α-helix	trans	-64	-44.8	175.7	-70.2	171.2	0	0	0	111.3	K136 S137 G138 E144 Q145	K136-L141 HydrophobicContact CB-CD2 3.85Å; K136-L141 HydrophobicContact CB-CG 3.88Å; K136-L141 HydrophobicContact CD-CD2 4.03Å; S137-L141 PolarHBondContact O-N 3.43Å; G138-L141 PolarHBondContact O-N 2.89Å; L141-E144 PolarHBondContact O-N 2.72Å; L141-Q145 WeakPolarHBondContact O-CB 3.45Å; L141-Q145 VanDerWaalsContact O-CG 3.29Å; L141-Q145 WeakPolarHBondContact O-CG 3.46Å; L141-Q145 PolarHBondContact O-N 3.08Å
142	A	76.9	Confident	67.1	Low	50 Å²	50	97.9 Å²	97.9	41%	0.413	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-44.1	175.6	0	0	0	0	0	112.3	G138 L139 E144 Q145 A146	G138-A142 WeakPolarHBondContact O-CB 3.25Å; G138-A142 PolarHBondContact O-N 3.06Å; L139-A142 PolarHBondContact O-N 3.24Å; A142-E144 VanDerWaalsContact C-N 3.32Å; A142-E144 PolarHBondContact O-N 3.47Å; A142-Q145 PolarHBondContact O-N 2.86Å; A142-A146 VanDerWaalsContact O-CB 3.26Å; A142-A146 WeakPolarHBondContact O-CB 3.36Å; A142-A146 PolarHBondContact O-N 2.89Å
143	L	76.7	Confident	67.5	Low	89 Å²	89	98 Å²	98	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-31.2	176	-72.8	171.2	0	0	0	112.9	L139 T140 K147	L139-L143 HydrophobicContact CD1-CD1 4.26Å; L139-L143 HydrophobicContact CD1-CG 4.33Å; L139-L143 HydrophobicContact CG-CD1 4.04Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.35Å; L139-L143 PolarHBondContact O-N 2.89Å; T140-L143 PolarHBondContact O-N 2.96Å; L143-K147 WeakPolarHBondContact O-CB 3.44Å; L143-K147 VanDerWaalsContact O-CG 3.27Å; L143-K147 WeakPolarHBondContact O-CG 3.3Å; L143-K147 PolarHBondContact O-N 2.9Å
144	E	77.8	Confident	67.8	Low	65 Å²	65	92.7 Å²	92.7	30%	0.304	50%	0.5	S	S	.	.	H	α-helix	trans	-76.3	-42.8	175.8	-171.7	173.4	-151.9	0	0	111.2	K136 T140 L141 A142 A146 K147 L148	K136-E144 WeakPolarHBondContact CD-OE2 3.33Å; K136-E144 WeakPolarHBondContact CE-OE2 3.21Å; K136-E144 IonicContact NZ-OE1 2.64Å; K136-E144 PolarHBondContact NZ-OE1 3.18Å; K136-E144 IonicContact NZ-OE2 3.16Å; K136-E144 PolarHBondContact NZ-OE2 2.98Å; T140-E144 WeakPolarHBondContact O-CB 3.27Å; T140-E144 PolarHBondContact O-N 3.01Å; L141-E144 PolarHBondContact O-N 2.72Å; A142-E144 VanDerWaalsContact C-N 3.32Å; A142-E144 PolarHBondContact O-N 3.47Å; E144-A146 PolarHBondContact O-N 3.27Å; E144-K147 CarbonylContact O-C 3.48Å; E144-K147 PolarHBondContact O-N 3.01Å; E144-K147 VanDerWaalsContact O-N 3.14Å; E144-L148 HydrophobicContact CG-CD1 3.91Å; E144-L148 HydrophobicContact CG-CG 4.35Å; E144-L148 WeakPolarHBondContact O-CB 3.45Å; E144-L148 VanDerWaalsContact O-CG 3.27Å; E144-L148 WeakPolarHBondContact O-CG 3.34Å; E144-L148 PolarHBondContact O-N 3.41Å
145	Q	74.8	Confident	68	Low	133 Å²	133	89 Å²	89	62%	0.621	47%	0.471	S	S	*	.	H	α-helix	trans	-59	-44.4	171.1	-75.8	172.6	-19.9	0	0	111.4	L141 A142 K147 L148 S149	L141-Q145 WeakPolarHBondContact O-CB 3.45Å; L141-Q145 VanDerWaalsContact O-CG 3.29Å; L141-Q145 WeakPolarHBondContact O-CG 3.46Å; L141-Q145 PolarHBondContact O-N 3.08Å; A142-Q145 PolarHBondContact O-N 2.86Å; Q145-K147 VanDerWaalsContact C-N 3.26Å; Q145-K147 PolarHBondContact O-N 2.89Å; Q145-L148 PolarHBondContact O-N 2.96Å; Q145-S149 WeakPolarHBondContact O-CB 3.3Å; Q145-S149 PolarHBondContact O-N 3.49Å; Q145-S149 PolarHBondContact O-OG 3.44Å
146	A	65.1	Low	67.8	Low	30 Å²	30	88 Å²	88	25%	0.248	46%	0.464	C	S	.	.	H	α-helix	trans	-67.9	-22.4	176.7	0	0	0	0	0	113.7	A142 E144 S149 H151 L152	A142-A146 VanDerWaalsContact O-CB 3.26Å; A142-A146 WeakPolarHBondContact O-CB 3.36Å; A142-A146 PolarHBondContact O-N 2.89Å; E144-A146 PolarHBondContact O-N 3.27Å; A146-S149 PolarHBondContact O-OG 2.88Å; A146-H151 PolarHBondContact O-N 3.34Å; A146-L152 HydrophobicContact CB-CD1 3.39Å; A146-L152 WeakPolarHBondContact O-CD1 3.46Å; A146-L152 PolarHBondContact O-N 2.91Å; A146-L152 VanDerWaalsContact O-N 3.13Å
147	K	66.9	Low	67.2	Low	140 Å²	140	86.3 Å²	86.3	61%	0.609	46%	0.46	S	S	*	.	H	α-helix	trans	-81.4	-43.1	169.5	-78.1	174.6	179.4	-179.4	0	112.1	L143 E144 Q145 G150 L152	L143-K147 WeakPolarHBondContact O-CB 3.44Å; L143-K147 VanDerWaalsContact O-CG 3.27Å; L143-K147 WeakPolarHBondContact O-CG 3.3Å; L143-K147 PolarHBondContact O-N 2.9Å; E144-K147 CarbonylContact O-C 3.48Å; E144-K147 PolarHBondContact O-N 3.01Å; E144-K147 VanDerWaalsContact O-N 3.14Å; Q145-K147 VanDerWaalsContact C-N 3.26Å; Q145-K147 PolarHBondContact O-N 2.89Å; K147-G150 PolarHBondContact O-N 2.88Å; K147-G150 VanDerWaalsContact O-N 3.13Å; K147-L152 HydrophobicContact CG-CB 4.34Å; K147-L152 HydrophobicContact CG-CD1 4.47Å; K147-L152 HydrophobicContact CG-CD2 4.01Å
148	L	60.4	Low	66.6	Low	139 Å²	139	83.8 Å²	83.8	73%	0.728	44%	0.441	S	S	*	.	H	α-helix	trans	-69.2	-35.2	-178.8	-73.9	170.6	0	0	0	112.5	E144 Q145 G150	E144-L148 HydrophobicContact CG-CD1 3.91Å; E144-L148 HydrophobicContact CG-CG 4.35Å; E144-L148 WeakPolarHBondContact O-CB 3.45Å; E144-L148 VanDerWaalsContact O-CG 3.27Å; E144-L148 WeakPolarHBondContact O-CG 3.34Å; E144-L148 PolarHBondContact O-N 3.41Å; Q145-L148 PolarHBondContact O-N 2.96Å; L148-G150 PolarHBondContact O-N 3.47Å
149	S	58.7	Low	66.1	Low	63 Å²	63	83.3 Å²	83.3	44%	0.441	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-6.2	171.4	63.6	0	0	0	0	113.5	Q145 A146 H151 R154	Q145-S149 WeakPolarHBondContact O-CB 3.3Å; Q145-S149 PolarHBondContact O-N 3.49Å; Q145-S149 PolarHBondContact O-OG 3.44Å; A146-S149 PolarHBondContact O-OG 2.88Å; S149-H151 PolarHBondContact O-N 2.8Å; S149-H151 WeakPolarHBondContact OG-CB 3.42Å; S149-H151 PolarHBondContact OG-N 2.88Å; S149-R154 PolarHBondContact O-NH1 2.97Å
150	G	56.6	Low	66	Low	16 Å²	16	83.1 Å²	83.1	17%	0.165	43%	0.428	C	S	.	.	S	Bend	trans	74.1	-1.7	-174.7	0	0	0	0	0	114.3	K147 L148 L152 K153 R154	K147-G150 PolarHBondContact O-N 2.88Å; K147-G150 VanDerWaalsContact O-N 3.13Å; L148-G150 PolarHBondContact O-N 3.47Å; G150-L152 VanDerWaalsContact C-N 3.27Å; G150-L152 PolarHBondContact O-N 3.01Å; G150-K153 PolarHBondContact O-N 2.88Å; G150-R154 PolarHBondContact O-N 3.06Å
151	H	54.6	Low	65.9	Low	70 Å²	70	81.2 Å²	81.2	32%	0.324	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-34.6	-173.7	-162.1	-25.1	0	0	0	112.8	A146 S149	A146-H151 PolarHBondContact O-N 3.34Å; S149-H151 PolarHBondContact O-N 2.8Å; S149-H151 WeakPolarHBondContact OG-CB 3.42Å; S149-H151 PolarHBondContact OG-N 2.88Å
152	L	52.4	Low	65.9	Low	81 Å²	81	78.9 Å²	78.9	42%	0.424	41%	0.406	S	S	.	.	H	α-helix	trans	-71.7	-21.2	173.6	-96.7	86.2	0	0	0	115	A146 K147 G150	A146-L152 HydrophobicContact CB-CD1 3.39Å; A146-L152 WeakPolarHBondContact O-CD1 3.46Å; A146-L152 PolarHBondContact O-N 2.91Å; A146-L152 VanDerWaalsContact O-N 3.13Å; K147-L152 HydrophobicContact CG-CB 4.34Å; K147-L152 HydrophobicContact CG-CD1 4.47Å; K147-L152 HydrophobicContact CG-CD2 4.01Å; G150-L152 VanDerWaalsContact C-N 3.27Å; G150-L152 PolarHBondContact O-N 3.01Å
153	K	52.9	Low	66.1	Low	174 Å²	174	82.2 Å²	82.2	76%	0.757	42%	0.416	S	S	*	.	H	α-helix	trans	-80.4	-49	174.3	-83.2	-170	171.8	-170	0	110.7	G150 N155 K156	G150-K153 PolarHBondContact O-N 2.88Å; K153-N155 VanDerWaalsContact C-N 3.28Å; K153-N155 PolarHBondContact O-N 3.27Å; K153-K156 PolarHBondContact O-N 2.8Å; K153-K156 VanDerWaalsContact O-N 3.15Å
154	R	52.1	Low	66.2	Low	104 Å²	104	81.3 Å²	81.3	39%	0.392	41%	0.407	S	S	.	.	H	α-helix	trans	-58.8	-35.9	-173.1	-62.5	-171.3	-172.8	93.6	6.4	113.4	S149 G150 K156 L247	S149-R154 PolarHBondContact O-NH1 2.97Å; G150-R154 PolarHBondContact O-N 3.06Å; R154-K156 VanDerWaalsContact C-N 3.3Å; R154-K156 PolarHBondContact O-N 3.25Å; R154-L247 HydrophobicContact CG-CD2 3.82Å
155	N	56.4	Low	66.3	Low	33 Å²	33	78.8 Å²	78.8	18%	0.176	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-20.6	-178.2	-105.8	-45.8	0	0	0	113.9	K153 L157 F158 S159 W227 N231	K153-N155 VanDerWaalsContact C-N 3.28Å; K153-N155 PolarHBondContact O-N 3.27Å; N155-L157 PolarHBondContact O-N 3.39Å; N155-F158 PolarHBondContact O-N 2.89Å; N155-S159 WeakPolarHBondContact O-CB 3.27Å; N155-S159 PolarHBondContact O-N 3.16Å; N155-S159 PolarHBondContact O-OG 3.49Å; N155-W227 PolarHBondContact OD1-NE1 3.41Å; N155-N231 PolarHBondContact ND2-OD1 3.07Å; N155-N231 PolarHBondContact OD1-ND2 2.85Å; N155-N231 PolarHBondContact OD1-OD1 3.37Å
156	K	63.1	Low	66.4	Low	167 Å²	167	72.6 Å²	72.6	73%	0.726	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-37.3	-168.5	-85.4	-157.2	170.4	-159.2	0	115.8	K153 R154	K153-K156 PolarHBondContact O-N 2.8Å; K153-K156 VanDerWaalsContact O-N 3.15Å; R154-K156 VanDerWaalsContact C-N 3.3Å; R154-K156 PolarHBondContact O-N 3.25Å
157	L	63.2	Low	66.6	Low	71 Å²	71	75.4 Å²	75.4	37%	0.372	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33.6	-177.9	-92.8	82.5	0	0	0	113.3	N155 L250	N155-L157 PolarHBondContact O-N 3.39Å; L157-L250 HydrophobicContact CD2-CB 4.22Å; L157-L250 WeakPolarHBondContact CD2-O 3.31Å
158	F	70.6	Confident	66.1	Low	11 Å²	11	73.9 Å²	73.9	5%	0.048	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-3	-172.5	-55.8	-73.3	0	0	0	113.8	N155 D160 F161 L226 W227 F230 L255	N155-F158 PolarHBondContact O-N 2.89Å; F158-D160 PolarHBondContact O-N 2.74Å; F158-F161 HydrophobicContact CB-CD2 4.44Å; F158-F161 HydrophobicContact CD1-CD2 4.22Å; F158-F161 HydrophobicContact CD1-CE2 4.34Å; F158-F161 PolarHBondContact O-N 3.06Å; F158-L226 HydrophobicContact CD1-CB 4.11Å; F158-L226 HydrophobicContact CD1-CD1 4.42Å; F158-L226 HydrophobicContact CE1-CB 4.1Å; F158-L226 HydrophobicContact CE1-CD1 3.67Å; F158-L226 HydrophobicContact CG-CB 4.35Å; F158-L226 HydrophobicContact CZ-CB 4.34Å; F158-L226 HydrophobicContact CZ-CD1 3.85Å; F158-W227 HydrophobicContact CB-CB 3.82Å; F158-W227 HydrophobicContact CB-CG 4.42Å; F158-W227 VanDerWaalsContact O-CD1 3.26Å; F158-F230 AromaticContact CD2-CD2 3.79Å; F158-F230 HydrophobicContact CD2-CD2 3.79Å; F158-F230 AromaticContact CD2-CE2 3.8Å; F158-F230 HydrophobicContact CD2-CE2 3.8Å; F158-F230 HydrophobicContact CE2-CD2 4.02Å; F158-F230 AromaticContact CE2-CE2 3.52Å; F158-F230 HydrophobicContact CE2-CE2 3.52Å; F158-F230 HydrophobicContact CZ-CE2 4.42Å; F158-L255 HydrophobicContact CE1-CD2 4.17Å; F158-L255 HydrophobicContact CE1-CG 4.46Å
159	S	71	Confident	65.8	Low	47 Å²	47	71.4 Å²	71.4	33%	0.329	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-56	-36	179.8	-71.3	0	0	0	0	113.3	N155 F161 A162	N155-S159 WeakPolarHBondContact O-CB 3.27Å; N155-S159 PolarHBondContact O-N 3.16Å; N155-S159 PolarHBondContact O-OG 3.49Å; S159-F161 PolarHBondContact O-N 3.37Å; S159-A162 WeakPolarHBondContact O-CB 3.42Å; S159-A162 PolarHBondContact O-N 3.49Å
160	D	76.3	Confident	65.4	Low	120 Å²	120	72.5 Å²	72.5	64%	0.642	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-67	-21.7	-177.7	-69.3	3.9	0	0	0	112	F158	F158-D160 PolarHBondContact O-N 2.74Å
161	F	77.8	Confident	64.7	Low	27 Å²	27	74.1 Å²	74.1	12%	0.118	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-82	-14.4	174.8	-59.3	-79.5	0	0	0	113.8	F158 S159 I163 Y164 Q220 L224 L255	F158-F161 HydrophobicContact CB-CD2 4.44Å; F158-F161 HydrophobicContact CD1-CD2 4.22Å; F158-F161 HydrophobicContact CD1-CE2 4.34Å; F158-F161 PolarHBondContact O-N 3.06Å; S159-F161 PolarHBondContact O-N 3.37Å; F161-I163 PolarHBondContact O-N 3.31Å; F161-I163 VanDerWaalsContact O-N 3.15Å; F161-Y164 HydrophobicContact CB-CD2 4.29Å; F161-Y164 HydrophobicContact CD1-CD2 4.15Å; F161-Y164 HydrophobicContact CD1-CE2 4.08Å; F161-Y164 WeakPolarHBondContact O-CB 3.49Å; F161-Y164 WeakPolarHBondContact O-CD2 3.33Å; F161-Y164 PolarHBondContact O-N 2.84Å; F161-Q220 HydrophobicContact CD1-CB 4.41Å; F161-Q220 HydrophobicContact CE1-CG 4.5Å; F161-L224 HydrophobicContact CB-CB 4.46Å; F161-L255 HydrophobicContact CE1-CD1 4.31Å; F161-L255 HydrophobicContact CE2-CD1 3.73Å; F161-L255 HydrophobicContact CZ-CD1 3.42Å; F161-L255 VanDerWaalsContact CZ-CD1 3.42Å
162	A	80.1	Confident	63.9	Low	27 Å²	27	77.4 Å²	77.4	22%	0.223	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-61	-24.6	177.4	0	0	0	0	0	112.9	S159 Y164 D165 W227	S159-A162 WeakPolarHBondContact O-CB 3.42Å; S159-A162 PolarHBondContact O-N 3.49Å; A162-Y164 PolarHBondContact O-N 2.86Å; A162-D165 WeakPolarHBondContact O-CB 3.45Å; A162-D165 PolarHBondContact O-N 2.85Å; A162-D165 VanDerWaalsContact O-N 3.13Å; A162-W227 HydrophobicContact CB-CD2 3.9Å; A162-W227 VanDerWaalsContact CB-CE2 3.49Å; A162-W227 HydrophobicContact CB-CE3 4.34Å; A162-W227 HydrophobicContact CB-CG 4.46Å; A162-W227 HydrophobicContact CB-CH2 4.08Å; A162-W227 HydrophobicContact CB-CZ2 3.61Å; A162-W227 HydrophobicContact CB-CZ3 4.41Å
163	I	80	Confident	63.3	Low	120 Å²	120	80.6 Å²	80.6	62%	0.615	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-62.3	-22.9	176.9	-56	173.7	0	0	0	111.9	F161	F161-I163 PolarHBondContact O-N 3.31Å; F161-I163 VanDerWaalsContact O-N 3.15Å
164	Y	79.5	Confident	62.7	Low	70 Å²	70	79.6 Å²	79.6	28%	0.275	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-88.5	-4.3	179.8	-57.7	-63.1	0	0	0	113.8	F161 A162 A166 P212 R213 T216 Q220	F161-Y164 HydrophobicContact CB-CD2 4.29Å; F161-Y164 HydrophobicContact CD1-CD2 4.15Å; F161-Y164 HydrophobicContact CD1-CE2 4.08Å; F161-Y164 WeakPolarHBondContact O-CB 3.49Å; F161-Y164 WeakPolarHBondContact O-CD2 3.33Å; F161-Y164 PolarHBondContact O-N 2.84Å; A162-Y164 PolarHBondContact O-N 2.86Å; Y164-A166 PolarHBondContact O-N 2.84Å; Y164-P212 WeakPolarHBondContact O-CA 3.38Å; Y164-R213 PolarHBondContact O-N 2.86Å; Y164-T216 HydrophobicContact CD1-CG2 3.74Å; Y164-T216 HydrophobicContact CG-CG2 3.96Å; Y164-Q220 HydrophobicContact CD2-CB 3.94Å; Y164-Q220 HydrophobicContact CD2-CG 4.13Å; Y164-Q220 HydrophobicContact CE1-CG 4.34Å; Y164-Q220 HydrophobicContact CE2-CB 4.09Å; Y164-Q220 HydrophobicContact CE2-CG 3.74Å; Y164-Q220 HydrophobicContact CG-CB 4.28Å; Y164-Q220 PolarHBondContact OH-NE2 3.43Å
165	D	80.6	Confident	61.8	Low	11 Å²	11	86 Å²	86	6%	0.059	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-74.4	116.5	176.1	-164.4	-19.9	0	0	0	111.1	A162 R167 L224	A162-D165 WeakPolarHBondContact O-CB 3.45Å; A162-D165 PolarHBondContact O-N 2.85Å; A162-D165 VanDerWaalsContact O-N 3.13Å; D165-R167 PolarHBondContact O-N 2.87Å; D165-R167 WeakPolarHBondContact OD1-CB 3.26Å; D165-R167 WeakPolarHBondContact OD1-CG 3.43Å; D165-R167 PolarHBondContact OD1-N 2.91Å; D165-R167 IonicContact OD1-NE 3.17Å; D165-R167 PolarHBondContact OD1-NE 2.82Å; D165-R167 VanDerWaalsContact OD1-NE 3.13Å; D165-R167 IonicContact OD2-CZ 2.74Å; D165-R167 VanDerWaalsContact OD2-CZ 3.23Å; D165-R167 IonicContact OD2-NE 2.72Å; D165-R167 PolarHBondContact OD2-NE 3.15Å; D165-R167 IonicContact OD2-NH2 3.86Å; D165-R167 PolarHBondContact OD2-NH2 3.32Å; D165-L224 HydrophobicContact CB-CD1 3.77Å
166	A	75.4	Confident	61	Low	3 Å²	3	90.4 Å²	90.4	3%	0.025	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-68.3	-23.6	176.9	0	0	0	0	0	112.4	Y164 S168 T169 Q211	Y164-A166 PolarHBondContact O-N 2.84Å; A166-S168 PolarHBondContact O-N 2.79Å; A166-T169 PolarHBondContact O-N 2.87Å; A166-T169 PolarHBondContact O-OG1 3.35Å; A166-Q211 HydrophobicContact CB-CG 4.16Å; A166-Q211 WeakPolarHBondContact CB-O 3.4Å; A166-Q211 PolarHBondContact N-O 3.37Å
167	R	69.4	Low	59.8	Low	89 Å²	89	87.7 Å²	87.7	34%	0.336	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-58.4	-34.8	-179.4	-61.9	179.1	-63.1	174.8	3.6	112.1	D165 T169 L170 Q211 E232	D165-R167 PolarHBondContact O-N 2.87Å; D165-R167 WeakPolarHBondContact OD1-CB 3.26Å; D165-R167 WeakPolarHBondContact OD1-CG 3.43Å; D165-R167 PolarHBondContact OD1-N 2.91Å; D165-R167 IonicContact OD1-NE 3.17Å; D165-R167 PolarHBondContact OD1-NE 2.82Å; D165-R167 VanDerWaalsContact OD1-NE 3.13Å; D165-R167 IonicContact OD2-CZ 2.74Å; D165-R167 VanDerWaalsContact OD2-CZ 3.23Å; D165-R167 IonicContact OD2-NE 2.72Å; D165-R167 PolarHBondContact OD2-NE 3.15Å; D165-R167 IonicContact OD2-NH2 3.86Å; D165-R167 PolarHBondContact OD2-NH2 3.32Å; R167-T169 PolarHBondContact O-N 2.94Å; R167-L170 PolarHBondContact O-N 3.3Å; R167-Q211 HydrophobicContact CG-CB 4.27Å; R167-E232 IonicContact CZ-OE1 2.65Å; R167-E232 IonicContact NH1-OE1 3.7Å; R167-E232 PolarHBondContact NH1-OE1 2.86Å; R167-E232 IonicContact NH2-OE1 3.23Å
168	S	57.6	Low	58.6	Low	108 Å²	108	90.5 Å²	90.5	76%	0.755	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-70.3	-14.9	177.3	-172.4	0	0	0	0	113.8	A166	A166-S168 PolarHBondContact O-N 2.79Å
169	T	54.4	Low	57.2	Low	88 Å²	88	96 Å²	96	54%	0.54	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-89.8	-10	174.9	64.2	0	0	0	0	113.1	A166 R167 G171	A166-T169 PolarHBondContact O-N 2.87Å; A166-T169 PolarHBondContact O-OG1 3.35Å; R167-T169 PolarHBondContact O-N 2.94Å; T169-G171 PolarHBondContact O-N 2.8Å
170	L	50.1	Low	55.9	Low	86 Å²	86	102.9 Å²	102.9	45%	0.45	55%	0.552	S	S	.	*			trans	-80.7	59.7	178.2	-141.9	75	0	0	0	111.6	R167 T172 L190	R167-L170 PolarHBondContact O-N 3.3Å; L170-T172 PolarHBondContact O-N 2.77Å; L170-L190 HydrophobicContact CD1-CD2 4.22Å
171	G	40.6	Very low	54	Low	49 Å²	49	105.3 Å²	105.3	51%	0.505	56%	0.557	S	S	.	*			trans	-67.6	86.5	-178.2	0	0	0	0	0	114.1	T169 N173	T169-G171 PolarHBondContact O-N 2.8Å; G171-N173 VanDerWaalsContact C-N 3.25Å; G171-N173 PolarHBondContact O-N 3.29Å; G171-N173 PolarHBondContact O-ND2 2.97Å
172	T	39.1	Very low	52.2	Low	139 Å²	139	110.1 Å²	110.1	85%	0.853	59%	0.591	S	S	*	*	S	Bend	trans	64.7	1	146.7	-20.9	0	0	0	0	118.5	L170	L170-T172 PolarHBondContact O-N 2.77Å
173	N	38.4	Very low	50.3	Low	148 Å²	148	114.9 Å²	114.9	79%	0.791	61%	0.612	S	S	*	*			trans	-134	1.4	-171.8	-72.5	-77.5	0	0	0	117.1	G171	G171-N173 VanDerWaalsContact C-N 3.25Å; G171-N173 PolarHBondContact O-N 3.29Å; G171-N173 PolarHBondContact O-ND2 2.97Å
174	Q	41.1	Very low	48.4	Very low	153 Å²	153	114.2 Å²	114.2	72%	0.715	63%	0.625	S	S	*	*	S	Bend	trans	-108.2	119.2	167.6	-76.4	-178.1	-12.5	0	0	109.5	V176	Q174-V176 PolarHBondContact O-N 3.04Å
175	R	33.8	Very low	46.7	Very low	238 Å²	238	118.3 Å²	118.3	90%	0.898	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-59.1	134.2	168.6	-76.1	-175.7	177.4	-175	-1	108.2	P177	R175-P177 WeakPolarHBondContact O-CD 3.08Å
176	V	38.6	Very low	45.1	Very low	126 Å²	126	122.9 Å²	122.9	76%	0.764	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-51.5	121.4	162	178.6	0	0	0	0	107.6	Q174 D178	Q174-V176 PolarHBondContact O-N 3.04Å; V176-D178 PolarHBondContact O-N 2.76Å
177	P	37.7	Very low	44	Very low	111 Å²	111	128 Å²	128	72%	0.721	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.1	128	170.5	-18.9	32.5	0	0	0	108.7	R175 S179	R175-P177 WeakPolarHBondContact O-CD 3.08Å; P177-S179 PolarHBondContact O-N 2.72Å
178	D	39.2	Very low	43.2	Very low	129 Å²	129	128.3 Å²	128.3	69%	0.69	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55.1	134	174.9	-91.1	-41.5	0	0	0	109.9	V176 R180	V176-D178 PolarHBondContact O-N 2.76Å; D178-R180 PolarHBondContact O-N 3.26Å
179	S	41.5	Very low	43.1	Very low	126 Å²	126	125 Å²	125	88%	0.881	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	31.8	-168.4	51.7	0	0	0	0	115.5	P177	P177-S179 PolarHBondContact O-N 2.72Å
180	R	42.2	Very low	43.6	Very low	193 Å²	193	123.2 Å²	123.2	73%	0.728	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-10.6	-176.4	-84.5	-176.8	-81.8	-167.4	-5.2	115.7	D178	D178-R180 PolarHBondContact O-N 3.26Å
181	F	38	Very low	44.6	Very low	171 Å²	171	122.3 Å²	122.3	75%	0.75	67%	0.674	S	S	*	*			trans	-138.9	122.2	173.9	-62.4	-78.2	0	0	0	111.1	D183	F181-D183 VanDerWaalsContact C-N 3.28Å; F181-D183 PolarHBondContact O-N 2.87Å
182	P	39.5	Very low	46.6	Very low	128 Å²	128	125.1 Å²	125.1	83%	0.831	67%	0.674	S	S	*	*			trans	-80	79.6	170.3	33.1	-32.1	0	0	0	109	A184	P182-A184 PolarHBondContact O-N 3.16Å
183	D	39.3	Very low	48.8	Very low	126 Å²	126	118.6 Å²	118.6	67%	0.674	63%	0.634	S	S	*	*			trans	-58.2	125.7	172.7	-83.4	-30.5	0	0	0	109.8	F181 N185	F181-D183 VanDerWaalsContact C-N 3.28Å; F181-D183 PolarHBondContact O-N 2.87Å; D183-N185 PolarHBondContact O-N 3.23Å
184	A	41.6	Very low	51	Low	106 Å²	106	113 Å²	113	88%	0.876	60%	0.604	S	S	*	*	S	Bend	trans	-73.1	26.1	-169.4	0	0	0	0	0	114.9	P182	P182-A184 PolarHBondContact O-N 3.16Å
185	N	43.3	Very low	53.1	Low	157 Å²	157	105.7 Å²	105.7	84%	0.84	57%	0.57	S	S	*	*			trans	-133.9	41	179.3	-88.1	-35.4	0	0	0	111.1	D183 D187	D183-N185 PolarHBondContact O-N 3.23Å; N185-D187 PolarHBondContact O-N 2.75Å
186	V	46.5	Very low	55.4	Low	107 Å²	107	97.6 Å²	97.6	65%	0.648	54%	0.54	S	S	*	.			trans	-67.3	112.8	163.3	-179.7	0	0	0	0	107.5
187	D	51.5	Low	57.5	Low	111 Å²	111	91.7 Å²	91.7	59%	0.594	50%	0.504	S	S	*	.			trans	-49.7	128.8	172.9	-92.7	-40.6	0	0	0	109.3	N185 S189 L190	N185-D187 PolarHBondContact O-N 2.75Å; D187-S189 WeakPolarHBondContact CB-OG 3.45Å; D187-S189 PolarHBondContact O-N 3.32Å; D187-L190 PolarHBondContact O-N 3.2Å
188	P	52.8	Low	59.3	Low	95 Å²	95	87.9 Å²	87.9	62%	0.617	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-62.8	-6.7	-176.4	24.5	-33.9	0	0	0	113.4	L214	P188-L214 WeakPolarHBondContact O-CD2 3.29Å
189	S	56	Low	60.7	Low	39 Å²	39	87.1 Å²	87.1	27%	0.273	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-75.7	-14.2	174.3	60.9	0	0	0	0	115.9	D187	D187-S189 WeakPolarHBondContact CB-OG 3.45Å; D187-S189 PolarHBondContact O-N 3.32Å
190	L	65.1	Low	62	Low	50 Å²	50	81.6 Å²	81.6	26%	0.262	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-111.7	20.9	-174.2	-68.5	173.4	0	0	0	113.1	L170 D187 Q192 Q211	L170-L190 HydrophobicContact CD1-CD2 4.22Å; D187-L190 PolarHBondContact O-N 3.2Å; L190-Q192 PolarHBondContact O-N 3.26Å; L190-Q211 PolarHBondContact O-NE2 2.72Å
191	R	72	Confident	62.9	Low	66 Å²	66	80 Å²	80	25%	0.249	42%	0.417	C	S	.	.			trans	-66.5	118.9	-177.6	-168.2	169.7	-169.7	-145.3	-1.9	112	F193 Y292 E293 F294	R191-F193 HydrophobicContact CB-CE2 4.15Å; R191-F193 HydrophobicContact CB-CZ 4.35Å; R191-F193 HydrophobicContact CG-CE1 4.27Å; R191-F193 HydrophobicContact CG-CE2 4.04Å; R191-F193 HydrophobicContact CG-CZ 3.91Å; R191-Y292 PolarHBondContact NH1-O 3.11Å; R191-E293 PolarHBondContact NH2-O 3.28Å; R191-F294 PolarHBondContact NH1-O 3.41Å; R191-F294 PolarHBondContact NH2-O 2.83Å
192	Q	82	Confident	64	Low	109 Å²	109	74.1 Å²	74.1	51%	0.509	40%	0.404	S	S	.	.			trans	-86.7	136	172.7	-169.7	173.5	48.2	0	0	110.3	L190 K209	L190-Q192 PolarHBondContact O-N 3.26Å; Q192-K209 HydrophobicContact CG-CB 4.23Å
193	F	85.1	Confident	65.3	Low	1 Å²	1	69.2 Å²	69.2	0%	0.004	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144.1	176.2	-60.6	-87.3	0	0	0	110	R191 K209 V210 P212 F221 I289 F294 K295 F297	R191-F193 HydrophobicContact CB-CE2 4.15Å; R191-F193 HydrophobicContact CB-CZ 4.35Å; R191-F193 HydrophobicContact CG-CE1 4.27Å; R191-F193 HydrophobicContact CG-CE2 4.04Å; R191-F193 HydrophobicContact CG-CZ 3.91Å; F193-K209 CarbonylContact O-C 3.58Å; F193-K209 WeakPolarHBondContact O-CA 3.47Å; F193-V210 PolarHBondContact N-O 3.25Å; F193-V210 PolarHBondContact O-N 3.45Å; F193-P212 HydrophobicContact CD2-CG 3.73Å; F193-P212 HydrophobicContact CE2-CG 3.64Å; F193-F221 HydrophobicContact CB-CE2 4.08Å; F193-F221 HydrophobicContact CB-CZ 3.78Å; F193-F221 HydrophobicContact CD2-CE2 4.05Å; F193-F221 HydrophobicContact CD2-CZ 4.44Å; F193-F221 HydrophobicContact CG-CE2 4.31Å; F193-F221 HydrophobicContact CG-CZ 4.25Å; F193-I289 HydrophobicContact CE1-CG1 4.49Å; F193-I289 HydrophobicContact CE2-CG1 4.36Å; F193-I289 HydrophobicContact CE2-CG2 4.36Å; F193-I289 HydrophobicContact CZ-CG1 4.21Å; F193-F294 WeakPolarHBondContact CD1-O 3.38Å; F193-F294 WeakPolarHBondContact CE1-O 3.49Å; F193-K295 WeakPolarHBondContact CA-O 3.48Å; F193-F297 HydrophobicContact CB-CD2 4.39Å; F193-F297 HydrophobicContact CB-CE2 4.32Å; F193-F297 HydrophobicContact CD1-CD2 4.25Å; F193-F297 AromaticContact CD1-CE2 3.42Å; F193-F297 HydrophobicContact CD1-CE2 3.42Å; F193-F297 VanDerWaalsContact CD1-CE2 3.42Å; F193-F297 HydrophobicContact CD1-CZ 4.22Å; F193-F297 AromaticContact CE1-CE2 3.89Å; F193-F297 HydrophobicContact CE1-CE2 3.89Å; F193-F297 HydrophobicContact CE1-CZ 4.31Å; F193-F297 HydrophobicContact CG-CE2 4.09Å
194	N	84.6	Confident	66.7	Low	31 Å²	31	65.6 Å²	65.6	17%	0.166	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.5	175.6	-170.3	21.2	0	0	0	109.5	W196 K295 S296 F297	N194-W196 PolarHBondContact ND2-NE1 2.65Å; N194-K295 PolarHBondContact N-O 2.94Å; N194-S296 CarbonylContact O-C 3.52Å; N194-S296 VanDerWaalsContact O-CA 3.3Å; N194-S296 WeakPolarHBondContact O-CA 3.45Å; N194-F297 PolarHBondContact O-N 2.81Å
195	V	85	Confident	68.2	Low	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122	-177.8	-168.1	0	0	0	0	110.3	S207 I208 V210 F221 T225 L260 F297 L299	V195-S207 CarbonylContact O-C 3.56Å; V195-S207 WeakPolarHBondContact O-CA 3.02Å; V195-I208 PolarHBondContact N-O 3.21Å; V195-I208 PolarHBondContact O-N 2.76Å; V195-V210 HydrophobicContact CG2-CG2 4.22Å; V195-F221 HydrophobicContact CG2-CE1 3.57Å; V195-F221 HydrophobicContact CG2-CE2 4.46Å; V195-F221 HydrophobicContact CG2-CZ 3.36Å; V195-T225 HydrophobicContact CB-CG2 3.89Å; V195-T225 HydrophobicContact CG1-CG2 3.86Å; V195-T225 HydrophobicContact CG2-CG2 4.29Å; V195-L260 HydrophobicContact CG1-CD1 4.03Å; V195-F297 WeakPolarHBondContact CA-O 3.32Å; V195-L299 HydrophobicContact CG1-CB 4.17Å
196	W	82.9	Confident	69.7	Low	68 Å²	68	60.3 Å²	60.3	26%	0.258	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.2	178	-66	85.4	0	0	0	110.9	N194 W198 T206 F263 T265 F297 L299	N194-W196 PolarHBondContact ND2-NE1 2.65Å; W196-W198 PolarHBondContact O-N 2.68Å; W196-T206 WeakPolarHBondContact CA-O 3.34Å; W196-F263 AromaticContact CD1-CD1 3.35Å; W196-F263 AromaticContact CD1-CE1 3.65Å; W196-F263 HydrophobicContact CD2-CE1 4.14Å; W196-F263 AromaticContact CE2-CE1 3.93Å; W196-F263 AromaticContact CG-CD1 3.99Å; W196-F263 HydrophobicContact CG-CD1 3.99Å; W196-F263 AromaticContact CG-CE1 3.98Å; W196-F263 HydrophobicContact CG-CE1 3.98Å; W196-F263 AromaticContact NE1-CD1 3.58Å; W196-F263 AromaticContact NE1-CE1 3.6Å; W196-T265 HydrophobicContact CZ2-CG2 4.46Å; W196-F297 PolarHBondContact N-O 3.41Å; W196-L299 PolarHBondContact O-N 3Å
197	L	82.8	Confident	71.5	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	73.3	171.2	-62.5	-174.9	0	0	0	109.9	L200 F203 R205 T206 I208 Y229 L299	L197-L200 HydrophobicContact CB-CD1 4.02Å; L197-L200 HydrophobicContact CD2-CD1 3.87Å; L197-F203 HydrophobicContact CD1-CB 4.33Å; L197-F203 HydrophobicContact CD1-CD1 4.09Å; L197-R205 WeakPolarHBondContact O-CA 3.25Å; L197-T206 PolarHBondContact N-O 3.15Å; L197-I208 HydrophobicContact CD1-CD1 4.15Å; L197-I208 HydrophobicContact CG-CD1 4.28Å; L197-Y229 HydrophobicContact CD1-CD1 4.49Å; L197-Y229 HydrophobicContact CD1-CD2 3.49Å; L197-Y229 VanDerWaalsContact CD1-CD2 3.49Å; L197-Y229 HydrophobicContact CD1-CE2 3.61Å; L197-Y229 HydrophobicContact CD1-CG 3.96Å; L197-L299 HydrophobicContact CD2-CB 4.38Å; L197-L299 HydrophobicContact CD2-CD2 3.7Å
198	W	73.9	Confident	73	Confident	30 Å²	30	52.4 Å²	52.4	11%	0.114	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-45.4	-164.2	-168	-97.2	0	0	0	114.3	W196 R205 F263 V276 A298 L299	W196-W198 PolarHBondContact O-N 2.68Å; W198-R205 PolarHBondContact O-NE 3.27Å; W198-R205 VanDerWaalsContact O-NE 3.16Å; W198-F263 HydrophobicContact CE3-CE2 4.38Å; W198-F263 HydrophobicContact CE3-CZ 4.26Å; W198-F263 HydrophobicContact CZ3-CE2 4.21Å; W198-F263 AromaticContact CZ3-CZ 3.85Å; W198-F263 HydrophobicContact CZ3-CZ 3.85Å; W198-V276 HydrophobicContact CB-CG2 4.24Å; W198-V276 HydrophobicContact CD2-CG2 3.79Å; W198-V276 HydrophobicContact CG-CG2 3.49Å; W198-V276 VanDerWaalsContact CG-CG2 3.49Å; W198-A298 HydrophobicContact CB-CB 4.03Å; W198-L299 PolarHBondContact N-O 2.81Å; W198-L299 VanDerWaalsContact N-O 3.15Å
199	R	69.3	Low	74.5	Confident	113 Å²	113	53.9 Å²	53.9	43%	0.426	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	64.6	-175.6	-79.8	172.6	-173.8	166.4	2.6	110.6	E274 L299 V300 E301	R199-E274 IonicContact CZ-OE2 3.52Å; R199-E274 IonicContact NE-OE2 3.9Å; R199-E274 IonicContact NH2-OE2 2.63Å; R199-E274 PolarHBondContact NH2-OE2 3.16Å; R199-L299 PolarHBondContact N-O 3.26Å; R199-V300 HydrophobicContact CB-CG1 4.14Å; R199-V300 HydrophobicContact CB-CG2 4.49Å; R199-E301 WeakPolarHBondContact O-CB 3.44Å; R199-E301 PolarHBondContact O-N 2.97Å
200	L	69.9	Low	75.9	Confident	11 Å²	11	52 Å²	52	6%	0.058	24%	0.244	C	C	.	.			trans	-107.7	132.7	165.3	-64.2	87.4	0	0	0	109	L197 G202 F203 L226 F254 L258 L299	L197-L200 HydrophobicContact CB-CD1 4.02Å; L197-L200 HydrophobicContact CD2-CD1 3.87Å; L200-G202 PolarHBondContact O-N 3.4Å; L200-F203 HydrophobicContact CB-CB 4.16Å; L200-F203 HydrophobicContact CB-CD2 3.65Å; L200-F203 HydrophobicContact CB-CE2 4.43Å; L200-F203 HydrophobicContact CB-CG 4.18Å; L200-F203 HydrophobicContact CD2-CD2 4.26Å; L200-F203 HydrophobicContact CD2-CE2 4.43Å; L200-F203 PolarHBondContact O-N 2.78Å; L200-L226 HydrophobicContact CD2-CD2 4.39Å; L200-F254 HydrophobicContact CD2-CE1 4.46Å; L200-F254 HydrophobicContact CD2-CZ 4.25Å; L200-L258 HydrophobicContact CD2-CD1 4.27Å; L200-L258 HydrophobicContact CD2-CD2 3.58Å; L200-L258 HydrophobicContact CG-CD2 3.94Å; L200-L299 HydrophobicContact CD1-CB 3.98Å; L200-L299 HydrophobicContact CD1-CD2 4.07Å; L200-L299 HydrophobicContact CD1-CG 3.97Å; L200-L299 WeakPolarHBondContact CD1-O 3.27Å; L200-L299 HydrophobicContact CD2-CD2 3.95Å; L200-L299 HydrophobicContact CD2-CG 4.37Å
201	R	61.1	Low	76.8	Confident	159 Å²	159	51.2 Å²	51.2	60%	0.6	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	126.8	176.1	-69.9	171.7	179.9	-166.8	0.9	110.1	F203 E301	R201-F203 WeakPolarHBondContact O-CD2 3.41Å; R201-E301 VanDerWaalsContact CB-OE2 3.3Å; R201-E301 WeakPolarHBondContact CB-OE2 3.4Å; R201-E301 WeakPolarHBondContact CG-OE2 3.33Å; R201-E301 PolarHBondContact N-OE2 2.9Å
202	G	59.7	Low	77.4	Confident	47 Å²	47	48 Å²	48	49%	0.485	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	1.1	177.4	0	0	0	0	0	116.1	L200 P244	L200-G202 PolarHBondContact O-N 3.4Å; G202-P244 WeakPolarHBondContact O-CB 3.3Å; G202-P244 WeakPolarHBondContact O-CG 3.48Å
203	F	67	Low	77.4	Confident	25 Å²	25	49.4 Å²	49.4	11%	0.11	23%	0.227	C	C	.	.			trans	-109.8	140.2	176.6	-65.8	-99.7	0	0	0	111.5	L197 L200 R201 Y229 F230 P244 F254	L197-F203 HydrophobicContact CD1-CB 4.33Å; L197-F203 HydrophobicContact CD1-CD1 4.09Å; L200-F203 HydrophobicContact CB-CB 4.16Å; L200-F203 HydrophobicContact CB-CD2 3.65Å; L200-F203 HydrophobicContact CB-CE2 4.43Å; L200-F203 HydrophobicContact CB-CG 4.18Å; L200-F203 HydrophobicContact CD2-CD2 4.26Å; L200-F203 HydrophobicContact CD2-CE2 4.43Å; L200-F203 PolarHBondContact O-N 2.78Å; R201-F203 WeakPolarHBondContact O-CD2 3.41Å; F203-Y229 AromaticContact CD1-CD1 3.89Å; F203-Y229 HydrophobicContact CD1-CD1 3.89Å; F203-Y229 AromaticContact CD1-CE1 3.43Å; F203-Y229 HydrophobicContact CD1-CE1 3.43Å; F203-Y229 VanDerWaalsContact CD1-CE1 3.43Å; F203-Y229 AromaticContact CD1-CZ 3.89Å; F203-Y229 AromaticContact CE1-CD1 3.71Å; F203-Y229 HydrophobicContact CE1-CD1 3.71Å; F203-Y229 AromaticContact CE1-CE1 3.55Å; F203-Y229 HydrophobicContact CE1-CE1 3.55Å; F203-F230 HydrophobicContact CE1-CE1 4.2Å; F203-F230 AromaticContact CE1-CZ 3.86Å; F203-F230 HydrophobicContact CE1-CZ 3.86Å; F203-F230 AromaticContact CZ-CZ 3.87Å; F203-F230 HydrophobicContact CZ-CZ 3.87Å; F203-P244 HydrophobicContact CE1-CG 4.4Å; F203-F254 HydrophobicContact CE2-CZ 4.49Å
204	P	69.5	Low	77	Confident	50 Å²	50	53.9 Å²	53.9	33%	0.325	25%	0.251	S	S	.	.			trans	-70.8	146.7	170.8	31	-34.7	0	0	0	111.1	T206 Y229	P204-T206 HydrophobicContact CB-CG2 4.14Å; P204-T206 HydrophobicContact CG-CG2 3.95Å; P204-T206 PolarHBondContact O-N 3.27Å; P204-T206 PolarHBondContact O-OG1 2.9Å; P204-Y229 VanDerWaalsContact CD-OH 3.26Å; P204-Y229 WeakPolarHBondContact CD-OH 3.48Å; P204-Y229 WeakPolarHBondContact CG-OH 3.35Å
205	R	71.6	Confident	76.8	Confident	122 Å²	122	55.2 Å²	55.2	46%	0.46	27%	0.272	S	S	.	.	S	Bend	trans	-63.5	96.7	172.3	-75.9	-172.1	178	169.8	4.5	110	L197 W198 E274	L197-R205 WeakPolarHBondContact O-CA 3.25Å; W198-R205 PolarHBondContact O-NE 3.27Å; W198-R205 VanDerWaalsContact O-NE 3.16Å; R205-E274 IonicContact CZ-OE1 3.66Å; R205-E274 IonicContact NH1-OE1 3.58Å; R205-E274 PolarHBondContact NH1-OE1 3.1Å; R205-E274 IonicContact NH2-OE1 2.72Å; R205-E274 PolarHBondContact NH2-OE1 3.47Å
206	T	75.8	Confident	76.7	Confident	31 Å²	31	55.3 Å²	55.3	19%	0.19	27%	0.272	C	S	.	.			trans	-135.1	152.3	-174.9	45.7	0	0	0	0	109.7	W196 L197 P204 F233	W196-T206 WeakPolarHBondContact CA-O 3.34Å; L197-T206 PolarHBondContact N-O 3.15Å; P204-T206 HydrophobicContact CB-CG2 4.14Å; P204-T206 HydrophobicContact CG-CG2 3.95Å; P204-T206 PolarHBondContact O-N 3.27Å; P204-T206 PolarHBondContact O-OG1 2.9Å; T206-F233 HydrophobicContact CG2-CE1 4.23Å
207	S	83.6	Confident	76.9	Confident	49 Å²	49	53.6 Å²	53.6	34%	0.343	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.6	178.8	50.8	0	0	0	0	111.5	V195	V195-S207 CarbonylContact O-C 3.56Å; V195-S207 WeakPolarHBondContact O-CA 3.02Å
208	I	83.3	Confident	77	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.8	-175.2	-45.1	-178.1	0	0	0	108.8	V195 L197 V210 T225 Q228 Y229 F233	V195-I208 PolarHBondContact N-O 3.21Å; V195-I208 PolarHBondContact O-N 2.76Å; L197-I208 HydrophobicContact CD1-CD1 4.15Å; L197-I208 HydrophobicContact CG-CD1 4.28Å; I208-V210 HydrophobicContact CB-CG2 4.38Å; I208-V210 HydrophobicContact CG2-CG2 3.93Å; I208-T225 HydrophobicContact CD1-CG2 4Å; I208-Q228 HydrophobicContact CG2-CB 4.19Å; I208-Q228 HydrophobicContact CG2-CG 3.75Å; I208-Y229 HydrophobicContact CD1-CD2 3.64Å; I208-Y229 HydrophobicContact CD1-CG 4Å; I208-Y229 HydrophobicContact CG1-CD2 4.48Å; I208-F233 HydrophobicContact CD1-CE2 4.35Å; I208-F233 HydrophobicContact CG1-CE2 3.98Å; I208-F233 HydrophobicContact CG1-CZ 4.47Å
209	K	84.5	Confident	77.6	Confident	127 Å²	127	55.1 Å²	55.1	55%	0.552	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	98	180	-62.7	-175.2	-178.4	179.8	0	110.5	Q192 F193 Q228	Q192-K209 HydrophobicContact CG-CB 4.23Å; F193-K209 CarbonylContact O-C 3.58Å; F193-K209 WeakPolarHBondContact O-CA 3.47Å; K209-Q228 PolarHBondContact O-NE2 3.16Å; K209-Q228 PolarHBondContact O-OE1 3.23Å
210	V	84.6	Confident	78.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.9	-173.6	-173.5	0	0	0	0	110.4	F193 V195 I208 F221 L224 T225	F193-V210 PolarHBondContact N-O 3.25Å; F193-V210 PolarHBondContact O-N 3.45Å; V195-V210 HydrophobicContact CG2-CG2 4.22Å; I208-V210 HydrophobicContact CB-CG2 4.38Å; I208-V210 HydrophobicContact CG2-CG2 3.93Å; V210-F221 HydrophobicContact CB-CE2 3.85Å; V210-F221 HydrophobicContact CB-CZ 4.3Å; V210-F221 HydrophobicContact CG1-CD2 4.08Å; V210-F221 HydrophobicContact CG1-CE2 3.72Å; V210-L224 HydrophobicContact CG1-CD2 3.57Å; V210-L224 HydrophobicContact CG1-CG 3.75Å; V210-T225 HydrophobicContact CG2-CG2 4.12Å
211	Q	84	Confident	79.3	Confident	32 Å²	32	51.3 Å²	51.3	15%	0.15	27%	0.265	C	S	.	.			trans	-123.2	88.1	178.7	-162.2	-177.6	16.4	0	0	110.4	A166 R167 L190	A166-Q211 HydrophobicContact CB-CG 4.16Å; A166-Q211 WeakPolarHBondContact CB-O 3.4Å; A166-Q211 PolarHBondContact N-O 3.37Å; R167-Q211 HydrophobicContact CG-CB 4.27Å; L190-Q211 PolarHBondContact O-NE2 2.72Å
212	P	85	Confident	80.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-79.3	152.5	-177.4	32.9	-34.8	0	0	0	112.4	Y164 F193 T216 F221 L224 I289	Y164-P212 WeakPolarHBondContact O-CA 3.38Å; F193-P212 HydrophobicContact CD2-CG 3.73Å; F193-P212 HydrophobicContact CE2-CG 3.64Å; P212-T216 HydrophobicContact CB-CG2 4.17Å; P212-T216 WeakPolarHBondContact CB-OG1 3.39Å; P212-F221 HydrophobicContact CB-CD2 3.93Å; P212-F221 HydrophobicContact CB-CE2 4.49Å; P212-F221 HydrophobicContact CG-CD2 3.75Å; P212-F221 HydrophobicContact CG-CE2 3.91Å; P212-L224 HydrophobicContact CB-CD2 4.24Å; P212-I289 HydrophobicContact CB-CG2 4.33Å; P212-I289 HydrophobicContact CG-CG2 3.86Å
213	R	82.3	Confident	81.8	Confident	137 Å²	137	41.6 Å²	41.6	52%	0.517	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-70.8	152.5	172.1	-168.5	173.4	-177.4	177.7	0.6	112.2	Y164 G215 T216 H290	Y164-R213 PolarHBondContact O-N 2.86Å; R213-G215 PolarHBondContact O-N 3.37Å; R213-T216 HydrophobicContact CB-CG2 4.36Å; R213-T216 WeakPolarHBondContact O-CG2 3.15Å; R213-T216 PolarHBondContact O-N 2.65Å; R213-T216 PolarHBondContact O-OG1 3.23Å; R213-H290 PolarHBondContact O-CE1 3.27Å
214	L	77.4	Confident	82.6	Confident	96 Å²	96	40.4 Å²	40.4	50%	0.503	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	134.5	172.2	-70.6	-179.2	0	0	0	112.1	P188	P188-L214 WeakPolarHBondContact O-CD2 3.29Å
215	G	79	Confident	83.4	Confident	58 Å²	58	38 Å²	38	60%	0.598	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.7	1.6	177.4	0	0	0	0	0	115.8	R213	R213-G215 PolarHBondContact O-N 3.37Å
216	T	83.5	Confident	83.9	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	17%	0.171	C	C	.	.			trans	-65	133.6	174.2	47.7	0	0	0	0	112.7	Y164 P212 R213 P288 I289	Y164-T216 HydrophobicContact CD1-CG2 3.74Å; Y164-T216 HydrophobicContact CG-CG2 3.96Å; P212-T216 HydrophobicContact CB-CG2 4.17Å; P212-T216 WeakPolarHBondContact CB-OG1 3.39Å; R213-T216 HydrophobicContact CB-CG2 4.36Å; R213-T216 WeakPolarHBondContact O-CG2 3.15Å; R213-T216 PolarHBondContact O-N 2.65Å; R213-T216 PolarHBondContact O-OG1 3.23Å; T216-P288 CarbonylContact O-C 3.54Å; T216-P288 VanDerWaalsContact O-CA 3.22Å; T216-P288 WeakPolarHBondContact O-CA 3.24Å; T216-I289 PolarHBondContact O-N 3.32Å; T216-I289 WeakPolarHBondContact OG1-CG2 3.09Å
217	T	87	Confident	84.2	Confident	33 Å²	33	33.1 Å²	33.1	20%	0.202	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-74.8	158.8	172.6	66.2	0	0	0	0	111.5	Q219 Q220 F221 D287	T217-Q219 PolarHBondContact O-N 3.24Å; T217-Q220 PolarHBondContact O-N 2.88Å; T217-Q220 VanDerWaalsContact O-N 3.09Å; T217-Q220 WeakPolarHBondContact OG1-CG 3.22Å; T217-Q220 PolarHBondContact OG1-N 3.36Å; T217-F221 WeakPolarHBondContact O-CB 3.31Å; T217-F221 PolarHBondContact O-N 2.92Å; T217-D287 CarbonylContact C-O 3.55Å; T217-D287 VanDerWaalsContact CA-O 3.26Å; T217-D287 WeakPolarHBondContact CA-O 3.5Å
218	V	86	Confident	84.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-55.9	-38.6	173.3	171.3	0	0	0	0	111.1	Q220 F221 V222 L260 L283 E284 L285 D287 I289 Y292	V218-Q220 PolarHBondContact O-N 3.07Å; V218-F221 PolarHBondContact O-N 3.33Å; V218-V222 HydrophobicContact CG1-CG2 4.46Å; V218-V222 WeakPolarHBondContact O-CG2 3.27Å; V218-V222 PolarHBondContact O-N 3.18Å; V218-L260 HydrophobicContact CG1-CB 4.1Å; V218-L260 HydrophobicContact CG1-CD2 4.12Å; V218-L283 HydrophobicContact CG1-CB 4.44Å; V218-L283 HydrophobicContact CG2-CB 4.43Å; V218-E284 WeakPolarHBondContact CB-O 3.42Å; V218-E284 WeakPolarHBondContact CG2-O 3.36Å; V218-L285 HydrophobicContact CG1-CD2 4.36Å; V218-L285 PolarHBondContact N-O 2.93Å; V218-D287 PolarHBondContact N-O 2.66Å; V218-I289 HydrophobicContact CG2-CD1 4.07Å; V218-Y292 HydrophobicContact CG2-CE2 4.16Å
219	Q	85.6	Confident	83.9	Confident	64 Å²	64	31.8 Å²	31.8	30%	0.299	16%	0.159	S	C	.	.	H	α-helix	trans	-59.5	-46.4	174.1	-171.9	-174.4	1.8	0	0	112.4	T217 F221 V222 G223 L285	T217-Q219 PolarHBondContact O-N 3.24Å; Q219-F221 VanDerWaalsContact C-N 3.33Å; Q219-V222 PolarHBondContact O-N 2.72Å; Q219-G223 PolarHBondContact O-N 3.43Å; Q219-L285 HydrophobicContact CB-CB 4.35Å; Q219-L285 PolarHBondContact N-O 3.49Å
220	Q	87	Confident	83.4	Confident	43 Å²	43	26.8 Å²	26.8	20%	0.201	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-37.6	177.6	-70.1	164.2	-7.8	0	0	111.7	F161 Y164 T217 V218 G223 L224	F161-Q220 HydrophobicContact CD1-CB 4.41Å; F161-Q220 HydrophobicContact CE1-CG 4.5Å; Y164-Q220 HydrophobicContact CD2-CB 3.94Å; Y164-Q220 HydrophobicContact CD2-CG 4.13Å; Y164-Q220 HydrophobicContact CE1-CG 4.34Å; Y164-Q220 HydrophobicContact CE2-CB 4.09Å; Y164-Q220 HydrophobicContact CE2-CG 3.74Å; Y164-Q220 HydrophobicContact CG-CB 4.28Å; Y164-Q220 PolarHBondContact OH-NE2 3.43Å; T217-Q220 PolarHBondContact O-N 2.88Å; T217-Q220 VanDerWaalsContact O-N 3.09Å; T217-Q220 WeakPolarHBondContact OG1-CG 3.22Å; T217-Q220 PolarHBondContact OG1-N 3.36Å; V218-Q220 PolarHBondContact O-N 3.07Å; Q220-G223 PolarHBondContact O-N 3.41Å; Q220-L224 WeakPolarHBondContact O-CB 3.49Å; Q220-L224 PolarHBondContact O-N 2.82Å
221	F	87.8	Confident	82.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-40.6	176	176.9	-103.2	0	0	0	112.6	F193 V195 V210 P212 T217 V218 Q219 L224 T225 L260 I289 F297	F193-F221 HydrophobicContact CB-CE2 4.08Å; F193-F221 HydrophobicContact CB-CZ 3.78Å; F193-F221 HydrophobicContact CD2-CE2 4.05Å; F193-F221 HydrophobicContact CD2-CZ 4.44Å; F193-F221 HydrophobicContact CG-CE2 4.31Å; F193-F221 HydrophobicContact CG-CZ 4.25Å; V195-F221 HydrophobicContact CG2-CE1 3.57Å; V195-F221 HydrophobicContact CG2-CE2 4.46Å; V195-F221 HydrophobicContact CG2-CZ 3.36Å; V210-F221 HydrophobicContact CB-CE2 3.85Å; V210-F221 HydrophobicContact CB-CZ 4.3Å; V210-F221 HydrophobicContact CG1-CD2 4.08Å; V210-F221 HydrophobicContact CG1-CE2 3.72Å; P212-F221 HydrophobicContact CB-CD2 3.93Å; P212-F221 HydrophobicContact CB-CE2 4.49Å; P212-F221 HydrophobicContact CG-CD2 3.75Å; P212-F221 HydrophobicContact CG-CE2 3.91Å; T217-F221 WeakPolarHBondContact O-CB 3.31Å; T217-F221 PolarHBondContact O-N 2.92Å; V218-F221 PolarHBondContact O-N 3.33Å; Q219-F221 VanDerWaalsContact C-N 3.33Å; F221-L224 PolarHBondContact O-N 2.94Å; F221-T225 WeakPolarHBondContact O-CB 3.38Å; F221-T225 PolarHBondContact O-N 2.98Å; F221-T225 PolarHBondContact O-OG1 3.02Å; F221-L260 HydrophobicContact CD1-CD2 3.79Å; F221-L260 HydrophobicContact CE1-CD1 4.36Å; F221-L260 HydrophobicContact CE1-CD2 3.76Å; F221-I289 HydrophobicContact CB-CB 4.35Å; F221-I289 HydrophobicContact CB-CG1 4.43Å; F221-I289 HydrophobicContact CD1-CD1 3.78Å; F221-I289 HydrophobicContact CD1-CG1 4Å; F221-I289 HydrophobicContact CD2-CG1 4.11Å; F221-I289 HydrophobicContact CD2-CG2 4.4Å; F221-I289 HydrophobicContact CE1-CD1 4Å; F221-I289 HydrophobicContact CE1-CG1 4.24Å; F221-I289 HydrophobicContact CE2-CG1 4.33Å; F221-I289 HydrophobicContact CG-CB 4.34Å; F221-I289 HydrophobicContact CG-CD1 4.18Å; F221-I289 HydrophobicContact CG-CG1 3.92Å; F221-I289 HydrophobicContact CZ-CG1 4.39Å; F221-F297 HydrophobicContact CE1-CD2 4.14Å; F221-F297 HydrophobicContact CZ-CD2 4.31Å
222	V	86.8	Confident	82.2	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-65.1	-43.6	173.4	172.5	0	0	0	0	110.9	V218 Q219 L224 T225 L226 L255 L258 L299	V218-V222 HydrophobicContact CG1-CG2 4.46Å; V218-V222 WeakPolarHBondContact O-CG2 3.27Å; V218-V222 PolarHBondContact O-N 3.18Å; Q219-V222 PolarHBondContact O-N 2.72Å; V222-L224 PolarHBondContact O-N 2.8Å; V222-T225 WeakPolarHBondContact O-CB 3.4Å; V222-T225 PolarHBondContact O-N 3.31Å; V222-L226 PolarHBondContact O-N 3.06Å; V222-L255 HydrophobicContact CG1-CD2 3.89Å; V222-L258 HydrophobicContact CG1-CB 4.02Å; V222-L258 HydrophobicContact CG1-CD1 3.52Å; V222-L258 HydrophobicContact CG1-CG 4.43Å; V222-L299 HydrophobicContact CB-CD1 4.48Å; V222-L299 HydrophobicContact CG1-CD1 3.88Å; V222-L299 HydrophobicContact CG1-CD2 4.31Å; V222-L299 HydrophobicContact CG2-CD1 3.78Å
223	G	85.6	Confident	81	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-42.1	174.1	0	0	0	0	0	113.1	Q219 Q220 L226 W227	Q219-G223 PolarHBondContact O-N 3.43Å; Q220-G223 PolarHBondContact O-N 3.41Å; G223-L226 PolarHBondContact O-N 3.41Å; G223-W227 WeakPolarHBondContact O-CB 3.29Å; G223-W227 PolarHBondContact O-N 3.26Å
224	L	85	Confident	79.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-39.2	174.3	176.6	63.6	0	0	0	112	F161 D165 V210 P212 Q220 F221 V222 W227 Q228	F161-L224 HydrophobicContact CB-CB 4.46Å; D165-L224 HydrophobicContact CB-CD1 3.77Å; V210-L224 HydrophobicContact CG1-CD2 3.57Å; V210-L224 HydrophobicContact CG1-CG 3.75Å; P212-L224 HydrophobicContact CB-CD2 4.24Å; Q220-L224 WeakPolarHBondContact O-CB 3.49Å; Q220-L224 PolarHBondContact O-N 2.82Å; F221-L224 PolarHBondContact O-N 2.94Å; V222-L224 PolarHBondContact O-N 2.8Å; L224-W227 HydrophobicContact CD1-CE3 3.92Å; L224-W227 HydrophobicContact CD1-CZ3 4.47Å; L224-W227 PolarHBondContact O-N 3.28Å; L224-Q228 WeakPolarHBondContact O-CB 3.31Å; L224-Q228 PolarHBondContact O-N 3.46Å
225	T	85.1	Confident	78.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-45.2	176	-56.2	0	0	0	0	111.1	V195 I208 V210 F221 V222 Q228 Y229	V195-T225 HydrophobicContact CB-CG2 3.89Å; V195-T225 HydrophobicContact CG1-CG2 3.86Å; V195-T225 HydrophobicContact CG2-CG2 4.29Å; I208-T225 HydrophobicContact CD1-CG2 4Å; V210-T225 HydrophobicContact CG2-CG2 4.12Å; F221-T225 WeakPolarHBondContact O-CB 3.38Å; F221-T225 PolarHBondContact O-N 2.98Å; F221-T225 PolarHBondContact O-OG1 3.02Å; V222-T225 WeakPolarHBondContact O-CB 3.4Å; V222-T225 PolarHBondContact O-N 3.31Å; T225-Q228 PolarHBondContact O-N 3.44Å; T225-Y229 PolarHBondContact O-N 3.36Å
226	L	82.1	Confident	76.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68	-40.7	176.2	-66.9	175.4	0	0	0	112	F158 L200 V222 G223 Q228 Y229 F230 F254 L255 L258	F158-L226 HydrophobicContact CD1-CB 4.11Å; F158-L226 HydrophobicContact CD1-CD1 4.42Å; F158-L226 HydrophobicContact CE1-CB 4.1Å; F158-L226 HydrophobicContact CE1-CD1 3.67Å; F158-L226 HydrophobicContact CG-CB 4.35Å; F158-L226 HydrophobicContact CZ-CB 4.34Å; F158-L226 HydrophobicContact CZ-CD1 3.85Å; L200-L226 HydrophobicContact CD2-CD2 4.39Å; V222-L226 PolarHBondContact O-N 3.06Å; G223-L226 PolarHBondContact O-N 3.41Å; L226-Q228 VanDerWaalsContact C-N 3.32Å; L226-Q228 PolarHBondContact O-N 2.81Å; L226-Y229 WeakPolarHBondContact O-CB 3.32Å; L226-Y229 PolarHBondContact O-N 2.72Å; L226-F230 HydrophobicContact CB-CE2 4.42Å; L226-F230 WeakPolarHBondContact O-CD2 3.31Å; L226-F230 PolarHBondContact O-N 2.92Å; L226-F254 HydrophobicContact CD1-CD1 4.31Å; L226-F254 HydrophobicContact CD1-CE1 4.13Å; L226-L255 HydrophobicContact CD1-CD2 3.94Å; L226-L258 HydrophobicContact CD1-CD1 3.85Å
227	W	82.6	Confident	74.6	Confident	49 Å²	49	39.7 Å²	39.7	19%	0.186	21%	0.213	C	C	.	.	H	α-helix	trans	-57.7	-45.6	173.3	-179.8	78.3	0	0	0	111.7	N155 F158 A162 G223 L224 F230 N231	N155-W227 PolarHBondContact OD1-NE1 3.41Å; F158-W227 HydrophobicContact CB-CB 3.82Å; F158-W227 HydrophobicContact CB-CG 4.42Å; F158-W227 VanDerWaalsContact O-CD1 3.26Å; A162-W227 HydrophobicContact CB-CD2 3.9Å; A162-W227 VanDerWaalsContact CB-CE2 3.49Å; A162-W227 HydrophobicContact CB-CE3 4.34Å; A162-W227 HydrophobicContact CB-CG 4.46Å; A162-W227 HydrophobicContact CB-CH2 4.08Å; A162-W227 HydrophobicContact CB-CZ2 3.61Å; A162-W227 HydrophobicContact CB-CZ3 4.41Å; G223-W227 WeakPolarHBondContact O-CB 3.29Å; G223-W227 PolarHBondContact O-N 3.26Å; L224-W227 HydrophobicContact CD1-CE3 3.92Å; L224-W227 HydrophobicContact CD1-CZ3 4.47Å; L224-W227 PolarHBondContact O-N 3.28Å; W227-F230 PolarHBondContact O-N 3.01Å; W227-N231 PolarHBondContact NE1-ND2 2.79Å; W227-N231 VanDerWaalsContact NE1-ND2 3.18Å; W227-N231 PolarHBondContact O-N 3.03Å; W227-N231 PolarHBondContact O-ND2 3.46Å
228	Q	82.2	Confident	72.5	Confident	3 Å²	3	43.5 Å²	43.5	1%	0.014	24%	0.236	C	C	.	.	H	α-helix	trans	-65.5	-42.6	177.5	-174.1	172.7	-20.6	0	0	111.1	I208 K209 L224 T225 L226 F230 N231 E232	I208-Q228 HydrophobicContact CG2-CB 4.19Å; I208-Q228 HydrophobicContact CG2-CG 3.75Å; K209-Q228 PolarHBondContact O-NE2 3.16Å; K209-Q228 PolarHBondContact O-OE1 3.23Å; L224-Q228 WeakPolarHBondContact O-CB 3.31Å; L224-Q228 PolarHBondContact O-N 3.46Å; T225-Q228 PolarHBondContact O-N 3.44Å; L226-Q228 VanDerWaalsContact C-N 3.32Å; L226-Q228 PolarHBondContact O-N 2.81Å; Q228-F230 PolarHBondContact O-N 3.35Å; Q228-N231 PolarHBondContact O-N 2.64Å; Q228-E232 HydrophobicContact CG-CG 4.09Å; Q228-E232 VanDerWaalsContact CG-OE1 3.25Å; Q228-E232 WeakPolarHBondContact CG-OE1 3.22Å; Q228-E232 WeakPolarHBondContact CG-OE2 3.48Å; Q228-E232 VanDerWaalsContact NE2-CD 3.27Å; Q228-E232 PolarHBondContact NE2-OE1 2.65Å; Q228-E232 PolarHBondContact NE2-OE2 3.47Å; Q228-E232 WeakPolarHBondContact O-CB 3.25Å; Q228-E232 PolarHBondContact O-N 2.9Å
229	Y	79.6	Confident	70.3	Confident	21 Å²	21	49 Å²	49	8%	0.082	27%	0.265	C	S	.	.	H	α-helix	trans	-53.4	-51.9	173.9	-176.5	-105.1	0	0	0	112.1	L197 F203 P204 I208 T225 L226 N231 E232 F233	L197-Y229 HydrophobicContact CD1-CD1 4.49Å; L197-Y229 HydrophobicContact CD1-CD2 3.49Å; L197-Y229 VanDerWaalsContact CD1-CD2 3.49Å; L197-Y229 HydrophobicContact CD1-CE2 3.61Å; L197-Y229 HydrophobicContact CD1-CG 3.96Å; F203-Y229 AromaticContact CD1-CD1 3.89Å; F203-Y229 HydrophobicContact CD1-CD1 3.89Å; F203-Y229 AromaticContact CD1-CE1 3.43Å; F203-Y229 HydrophobicContact CD1-CE1 3.43Å; F203-Y229 VanDerWaalsContact CD1-CE1 3.43Å; F203-Y229 AromaticContact CD1-CZ 3.89Å; F203-Y229 AromaticContact CE1-CD1 3.71Å; F203-Y229 HydrophobicContact CE1-CD1 3.71Å; F203-Y229 AromaticContact CE1-CE1 3.55Å; F203-Y229 HydrophobicContact CE1-CE1 3.55Å; P204-Y229 VanDerWaalsContact CD-OH 3.26Å; P204-Y229 WeakPolarHBondContact CD-OH 3.48Å; P204-Y229 WeakPolarHBondContact CG-OH 3.35Å; I208-Y229 HydrophobicContact CD1-CD2 3.64Å; I208-Y229 HydrophobicContact CD1-CG 4Å; I208-Y229 HydrophobicContact CG1-CD2 4.48Å; T225-Y229 PolarHBondContact O-N 3.36Å; L226-Y229 WeakPolarHBondContact O-CB 3.32Å; L226-Y229 PolarHBondContact O-N 2.72Å; Y229-N231 PolarHBondContact O-N 3.1Å; Y229-E232 PolarHBondContact O-N 3.25Å; Y229-F233 HydrophobicContact CD2-CB 4.1Å; Y229-F233 AromaticContact CD2-CD2 3.39Å; Y229-F233 HydrophobicContact CD2-CD2 3.39Å; Y229-F233 AromaticContact CD2-CE2 3.94Å; Y229-F233 HydrophobicContact CD2-CE2 3.94Å; Y229-F233 AromaticContact CD2-CG 3.79Å; Y229-F233 HydrophobicContact CD2-CG 3.79Å; Y229-F233 HydrophobicContact CE2-CB 3.79Å; Y229-F233 HydrophobicContact CE2-CD1 4.19Å; Y229-F233 AromaticContact CE2-CD2 3.74Å; Y229-F233 HydrophobicContact CE2-CD2 3.74Å; Y229-F233 HydrophobicContact CE2-CE2 4.38Å; Y229-F233 AromaticContact CE2-CG 3.62Å; Y229-F233 HydrophobicContact CE2-CG 3.62Å; Y229-F233 HydrophobicContact CG-CD2 4.23Å; Y229-F233 WeakPolarHBondContact O-CB 3.35Å; Y229-F233 PolarHBondContact O-N 2.65Å
230	F	73.8	Confident	68	Low	22 Å²	22	52 Å²	52	10%	0.096	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-20	-176.5	-74	-57.7	0	0	0	114.2	F158 F203 L226 W227 Q228 S234 L247 L250	F158-F230 AromaticContact CD2-CD2 3.79Å; F158-F230 HydrophobicContact CD2-CD2 3.79Å; F158-F230 AromaticContact CD2-CE2 3.8Å; F158-F230 HydrophobicContact CD2-CE2 3.8Å; F158-F230 HydrophobicContact CE2-CD2 4.02Å; F158-F230 AromaticContact CE2-CE2 3.52Å; F158-F230 HydrophobicContact CE2-CE2 3.52Å; F158-F230 HydrophobicContact CZ-CE2 4.42Å; F203-F230 HydrophobicContact CE1-CE1 4.2Å; F203-F230 AromaticContact CE1-CZ 3.86Å; F203-F230 HydrophobicContact CE1-CZ 3.86Å; F203-F230 AromaticContact CZ-CZ 3.87Å; F203-F230 HydrophobicContact CZ-CZ 3.87Å; L226-F230 HydrophobicContact CB-CE2 4.42Å; L226-F230 WeakPolarHBondContact O-CD2 3.31Å; L226-F230 PolarHBondContact O-N 2.92Å; W227-F230 PolarHBondContact O-N 3.01Å; Q228-F230 PolarHBondContact O-N 3.35Å; F230-S234 WeakPolarHBondContact O-CB 3.47Å; F230-L247 HydrophobicContact CE1-CD1 3.97Å; F230-L247 HydrophobicContact CE1-CD2 4.12Å; F230-L247 HydrophobicContact CE1-CG 4.37Å; F230-L247 HydrophobicContact CZ-CD1 4.23Å; F230-L247 HydrophobicContact CZ-CG 4.48Å; F230-L250 HydrophobicContact CZ-CD1 4.41Å
231	N	72.2	Confident	66	Low	41 Å²	41	55.6 Å²	55.6	22%	0.219	32%	0.318	C	S	.	.	H	α-helix	trans	-95	-33.5	175.8	-70.1	-64.9	0	0	0	113.1	N155 W227 Q228 Y229	N155-N231 PolarHBondContact ND2-OD1 3.07Å; N155-N231 PolarHBondContact OD1-ND2 2.85Å; N155-N231 PolarHBondContact OD1-OD1 3.37Å; W227-N231 PolarHBondContact NE1-ND2 2.79Å; W227-N231 VanDerWaalsContact NE1-ND2 3.18Å; W227-N231 PolarHBondContact O-N 3.03Å; W227-N231 PolarHBondContact O-ND2 3.46Å; Q228-N231 PolarHBondContact O-N 2.64Å; Y229-N231 PolarHBondContact O-N 3.1Å
232	E	70.3	Confident	64	Low	75 Å²	75	61.7 Å²	61.7	35%	0.35	35%	0.35	S	S	.	.	H	α-helix	trans	-87.5	-35.3	-177.9	-69.7	177.1	-177.5	0	0	113.2	R167 Q228 Y229 T235	R167-E232 IonicContact CZ-OE1 2.65Å; R167-E232 IonicContact NH1-OE1 3.7Å; R167-E232 PolarHBondContact NH1-OE1 2.86Å; R167-E232 IonicContact NH2-OE1 3.23Å; Q228-E232 HydrophobicContact CG-CG 4.09Å; Q228-E232 VanDerWaalsContact CG-OE1 3.25Å; Q228-E232 WeakPolarHBondContact CG-OE1 3.22Å; Q228-E232 WeakPolarHBondContact CG-OE2 3.48Å; Q228-E232 VanDerWaalsContact NE2-CD 3.27Å; Q228-E232 PolarHBondContact NE2-OE1 2.65Å; Q228-E232 PolarHBondContact NE2-OE2 3.47Å; Q228-E232 WeakPolarHBondContact O-CB 3.25Å; Q228-E232 PolarHBondContact O-N 2.9Å; Y229-E232 PolarHBondContact O-N 3.25Å; E232-T235 PolarHBondContact O-OG1 2.75Å
233	F	60.5	Low	61.8	Low	70 Å²	70	64.7 Å²	64.7	31%	0.307	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.8	-177.4	-64.5	-95.9	0	0	0	113.4	T206 I208 Y229 T235 S236	T206-F233 HydrophobicContact CG2-CE1 4.23Å; I208-F233 HydrophobicContact CD1-CE2 4.35Å; I208-F233 HydrophobicContact CG1-CE2 3.98Å; I208-F233 HydrophobicContact CG1-CZ 4.47Å; Y229-F233 HydrophobicContact CD2-CB 4.1Å; Y229-F233 AromaticContact CD2-CD2 3.39Å; Y229-F233 HydrophobicContact CD2-CD2 3.39Å; Y229-F233 AromaticContact CD2-CE2 3.94Å; Y229-F233 HydrophobicContact CD2-CE2 3.94Å; Y229-F233 AromaticContact CD2-CG 3.79Å; Y229-F233 HydrophobicContact CD2-CG 3.79Å; Y229-F233 HydrophobicContact CE2-CB 3.79Å; Y229-F233 HydrophobicContact CE2-CD1 4.19Å; Y229-F233 AromaticContact CE2-CD2 3.74Å; Y229-F233 HydrophobicContact CE2-CD2 3.74Å; Y229-F233 HydrophobicContact CE2-CE2 4.38Å; Y229-F233 AromaticContact CE2-CG 3.62Å; Y229-F233 HydrophobicContact CE2-CG 3.62Å; Y229-F233 HydrophobicContact CG-CD2 4.23Å; Y229-F233 WeakPolarHBondContact O-CB 3.35Å; Y229-F233 PolarHBondContact O-N 2.65Å; F233-T235 VanDerWaalsContact C-N 3.26Å; F233-S236 PolarHBondContact O-OG 2.98Å
234	S	54.2	Low	60.1	Low	61 Å²	61	66 Å²	66	43%	0.427	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.9	170.1	-170.7	0	0	0	0	113.3	F230	F230-S234 WeakPolarHBondContact O-CB 3.47Å
235	T	47.6	Very low	58.2	Low	103 Å²	103	73.1 Å²	73.1	63%	0.632	43%	0.427	S	S	*	.	S	Bend	trans	-108.8	-4	-177.4	49.3	0	0	0	0	115	E232 F233	E232-T235 PolarHBondContact O-OG1 2.75Å; F233-T235 VanDerWaalsContact C-N 3.26Å
236	S	42.7	Very low	56.5	Low	69 Å²	69	78.6 Å²	78.6	48%	0.483	45%	0.452	S	S	.	.			trans	-87	113.5	173.7	52.1	0	0	0	0	110.8	F233 V238	F233-S236 PolarHBondContact O-OG 2.98Å; S236-V238 PolarHBondContact O-N 2.8Å
237	D	42	Very low	55.1	Low	177 Å²	177	80.8 Å²	80.8	95%	0.947	46%	0.464	S	S	*	.			trans	-68.5	46.9	175.4	-82.8	-45.5	0	0	0	113.3
238	V	44	Very low	53.6	Low	113 Å²	113	86.2 Å²	86.2	69%	0.685	50%	0.497	S	S	*	.	S	Bend	trans	-118.2	104.4	179.6	-169.5	0	0	0	0	109.2	S236	S236-V238 PolarHBondContact O-N 2.8Å
239	D	38.7	Very low	52.2	Low	115 Å²	115	91.5 Å²	91.5	62%	0.615	53%	0.525	S	S	*	.			trans	49.2	94.5	171.4	-72.3	-28.8	0	0	0	117.8	T241 L242	D239-T241 PolarHBondContact O-N 3.43Å; D239-L242 PolarHBondContact O-N 2.88Å
240	S	37.7	Very low	51.2	Low	127 Å²	127	91.8 Å²	91.8	89%	0.888	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	16.2	167.7	-56.5	0	0	0	0	115.5
241	T	44.5	Very low	50.6	Low	119 Å²	119	96.3 Å²	96.3	73%	0.73	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-12.7	177.1	56.6	0	0	0	0	113	D239	D239-T241 PolarHBondContact O-N 3.43Å
242	L	46.5	Very low	50.1	Low	127 Å²	127	100.7 Å²	100.7	67%	0.665	57%	0.572	S	S	*	*	S	Bend	trans	-107.3	3.6	-179.1	-77.6	161.7	0	0	0	114.3	D239	D239-L242 PolarHBondContact O-N 2.88Å
243	A	40.7	Very low	49.8	Very low	65 Å²	65	100 Å²	100	54%	0.537	58%	0.575	S	S	.	*	S	Bend	trans	-63.6	134.2	172.4	0	0	0	0	0	110.3	T245	A243-T245 PolarHBondContact O-N 2.88Å
244	P	49.7	Very low	50.3	Low	28 Å²	28	97.4 Å²	97.4	18%	0.182	56%	0.564	C	S	.	*			trans	-65	109.9	-177	-7.7	16.9	0	0	0	110.4	G202 F203 Q246 L247	G202-P244 WeakPolarHBondContact O-CB 3.3Å; G202-P244 WeakPolarHBondContact O-CG 3.48Å; F203-P244 HydrophobicContact CE1-CG 4.4Å; P244-Q246 PolarHBondContact O-N 2.8Å; P244-L247 HydrophobicContact CB-CD1 3.73Å; P244-L247 HydrophobicContact CG-CD1 3.8Å; P244-L247 WeakPolarHBondContact O-CD1 3.49Å; P244-L247 PolarHBondContact O-N 2.9Å
245	T	45.4	Very low	51.2	Low	149 Å²	149	94.8 Å²	94.8	91%	0.914	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	3.6	178.5	13.6	0	0	0	0	113.8	A243	A243-T245 PolarHBondContact O-N 2.88Å
246	Q	50.1	Low	52.4	Low	116 Å²	116	93.3 Å²	93.3	54%	0.542	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	29.4	177.4	-66.3	-167.6	-86.2	0	0	113.5	P244 D248 D249	P244-Q246 PolarHBondContact O-N 2.8Å; Q246-D248 PolarHBondContact O-N 3.25Å; Q246-D249 PolarHBondContact NE2-OD2 3.38Å; Q246-D249 PolarHBondContact O-N 2.9Å
247	L	52.9	Low	53.9	Low	47 Å²	47	93.4 Å²	93.4	25%	0.246	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-63.7	-22.5	173.3	-111.6	74.6	0	0	0	113.7	R154 F230 P244 D249 L250	R154-L247 HydrophobicContact CG-CD2 3.82Å; F230-L247 HydrophobicContact CE1-CD1 3.97Å; F230-L247 HydrophobicContact CE1-CD2 4.12Å; F230-L247 HydrophobicContact CE1-CG 4.37Å; F230-L247 HydrophobicContact CZ-CD1 4.23Å; F230-L247 HydrophobicContact CZ-CG 4.48Å; P244-L247 HydrophobicContact CB-CD1 3.73Å; P244-L247 HydrophobicContact CG-CD1 3.8Å; P244-L247 WeakPolarHBondContact O-CD1 3.49Å; P244-L247 PolarHBondContact O-N 2.9Å; L247-D249 VanDerWaalsContact C-N 3.35Å; L247-L250 HydrophobicContact CD1-CD1 4.45Å; L247-L250 HydrophobicContact CG-CD1 4.01Å
248	D	49.8	Very low	55.7	Low	163 Å²	163	85 Å²	85	87%	0.872	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-81	-10.4	179.7	-69.5	-38	0	0	0	113.4	Q246	Q246-D248 PolarHBondContact O-N 3.25Å
249	D	53.7	Low	57.4	Low	113 Å²	113	79.7 Å²	79.7	60%	0.604	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-93.1	3.7	176.3	-70.3	-31.1	0	0	0	113.1	Q246 L247 D251	Q246-D249 PolarHBondContact NE2-OD2 3.38Å; Q246-D249 PolarHBondContact O-N 2.9Å; L247-D249 VanDerWaalsContact C-N 3.35Å; D249-D251 PolarHBondContact O-N 3.03Å
250	L	59.2	Low	59.5	Low	28 Å²	28	74.2 Å²	74.2	15%	0.147	42%	0.417	C	S	.	.			trans	-82.9	94	-177.8	-66.2	172.8	0	0	0	110.8	L157 F230 L247 F254	L157-L250 HydrophobicContact CD2-CB 4.22Å; L157-L250 WeakPolarHBondContact CD2-O 3.31Å; F230-L250 HydrophobicContact CZ-CD1 4.41Å; L247-L250 HydrophobicContact CD1-CD1 4.45Å; L247-L250 HydrophobicContact CG-CD1 4.01Å; L250-F254 HydrophobicContact CD2-CB 4.32Å; L250-F254 HydrophobicContact CD2-CD1 3.62Å; L250-F254 HydrophobicContact CD2-CD2 3.74Å; L250-F254 HydrophobicContact CD2-CE1 3.71Å; L250-F254 HydrophobicContact CD2-CE2 3.85Å; L250-F254 HydrophobicContact CD2-CG 3.62Å; L250-F254 HydrophobicContact CD2-CZ 3.83Å
251	D	61.3	Low	61.5	Low	117 Å²	117	69.6 Å²	69.6	63%	0.626	38%	0.381	S	S	*	.			trans	-83.5	163.7	168	-104.8	-21.9	0	0	0	112.1	D249 S253 F254	D249-D251 PolarHBondContact O-N 3.03Å; D251-S253 PolarHBondContact O-N 3.16Å; D251-F254 WeakPolarHBondContact O-CB 3.21Å; D251-F254 PolarHBondContact O-N 3.46Å
252	E	60	Low	63.2	Low	133 Å²	133	64.8 Å²	64.8	62%	0.621	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-26.9	167.8	-70.2	-68.9	164.3	0	0	113	F254	E252-F254 PolarHBondContact O-N 3.07Å
253	S	64.6	Low	64.4	Low	59 Å²	59	60.2 Å²	60.2	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-18.9	175.6	69.7	0	0	0	0	113.8	D251 L255 N256 R257	D251-S253 PolarHBondContact O-N 3.16Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.47Å; S253-N256 WeakPolarHBondContact O-CB 3.22Å; S253-N256 PolarHBondContact O-N 3.2Å; S253-N256 VanDerWaalsContact O-N 3.1Å; S253-R257 PolarHBondContact O-N 2.89Å
254	F	70.9	Confident	65.7	Low	17 Å²	17	62.6 Å²	62.6	8%	0.075	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-39.9	-178.3	-175	-106.2	0	0	0	112.1	L200 F203 L226 L250 D251 E252 N256 R257 L258	L200-F254 HydrophobicContact CD2-CE1 4.46Å; L200-F254 HydrophobicContact CD2-CZ 4.25Å; F203-F254 HydrophobicContact CE2-CZ 4.49Å; L226-F254 HydrophobicContact CD1-CD1 4.31Å; L226-F254 HydrophobicContact CD1-CE1 4.13Å; L250-F254 HydrophobicContact CD2-CB 4.32Å; L250-F254 HydrophobicContact CD2-CD1 3.62Å; L250-F254 HydrophobicContact CD2-CD2 3.74Å; L250-F254 HydrophobicContact CD2-CE1 3.71Å; L250-F254 HydrophobicContact CD2-CE2 3.85Å; L250-F254 HydrophobicContact CD2-CG 3.62Å; L250-F254 HydrophobicContact CD2-CZ 3.83Å; D251-F254 WeakPolarHBondContact O-CB 3.21Å; D251-F254 PolarHBondContact O-N 3.46Å; E252-F254 PolarHBondContact O-N 3.07Å; F254-N256 VanDerWaalsContact C-N 3.26Å; F254-N256 PolarHBondContact O-N 2.99Å; F254-R257 CarbonylContact O-C 3.46Å; F254-R257 WeakPolarHBondContact O-CA 3.34Å; F254-R257 WeakPolarHBondContact O-CB 3.31Å; F254-R257 PolarHBondContact O-N 3.15Å; F254-L258 HydrophobicContact CD1-CD1 4.03Å; F254-L258 HydrophobicContact CD1-CG 4.49Å; F254-L258 HydrophobicContact CE1-CD1 3.75Å; F254-L258 HydrophobicContact CE1-CD2 4.3Å; F254-L258 HydrophobicContact CE1-CG 4.25Å; F254-L258 HydrophobicContact CZ-CD1 4.46Å; F254-L258 HydrophobicContact CZ-CD2 4.2Å; F254-L258 PolarHBondContact O-N 3.5Å
255	L	73.9	Confident	66.1	Low	6 Å²	6	63.9 Å²	63.9	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-37.5	175.5	-70.1	172.9	0	0	0	112.3	F158 F161 V222 L226 S253 R257 L258	F158-L255 HydrophobicContact CE1-CD2 4.17Å; F158-L255 HydrophobicContact CE1-CG 4.46Å; F161-L255 HydrophobicContact CE1-CD1 4.31Å; F161-L255 HydrophobicContact CE2-CD1 3.73Å; F161-L255 HydrophobicContact CZ-CD1 3.42Å; F161-L255 VanDerWaalsContact CZ-CD1 3.42Å; V222-L255 HydrophobicContact CG1-CD2 3.89Å; L226-L255 HydrophobicContact CD1-CD2 3.94Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.47Å; L255-R257 VanDerWaalsContact C-N 3.26Å; L255-R257 PolarHBondContact O-N 2.99Å; L255-L258 PolarHBondContact O-N 2.89Å; L255-L258 VanDerWaalsContact O-N 3.12Å
256	N	71.7	Confident	66.5	Low	72 Å²	72	61.4 Å²	61.4	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-73.9	-19.4	177.5	-60.8	-33.1	0	0	0	112.8	S253 F254 L258	S253-N256 WeakPolarHBondContact O-CB 3.22Å; S253-N256 PolarHBondContact O-N 3.2Å; S253-N256 VanDerWaalsContact O-N 3.1Å; F254-N256 VanDerWaalsContact C-N 3.26Å; F254-N256 PolarHBondContact O-N 2.99Å; N256-L258 VanDerWaalsContact C-N 3.32Å
257	R	74.7	Confident	66.5	Low	70 Å²	70	63.1 Å²	63.1	26%	0.264	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-4.2	170.4	-63.8	179.3	61	-148.6	-13.2	112.6	S253 F254 L255 E301 R302	S253-R257 PolarHBondContact O-N 2.89Å; F254-R257 CarbonylContact O-C 3.46Å; F254-R257 WeakPolarHBondContact O-CA 3.34Å; F254-R257 WeakPolarHBondContact O-CB 3.31Å; F254-R257 PolarHBondContact O-N 3.15Å; L255-R257 VanDerWaalsContact C-N 3.26Å; L255-R257 PolarHBondContact O-N 2.99Å; R257-E301 IonicContact CZ-OE1 2.88Å; R257-E301 IonicContact NH1-OE1 2.69Å; R257-E301 IonicContact NH2-OE1 2.74Å; R257-E301 PolarHBondContact NH2-OE1 3.13Å; R257-E301 CarbonylContact O-C 3.6Å; R257-R302 WeakPolarHBondContact O-CA 3.46Å; R257-R302 WeakPolarHBondContact O-CB 3.26Å; R257-R302 PolarHBondContact O-N 3.45Å
258	L	79.4	Confident	66	Low	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138.9	176.2	-64.6	173.5	0	0	0	111.4	L200 V222 L226 F254 L255 N256 L299 E301	L200-L258 HydrophobicContact CD2-CD1 4.27Å; L200-L258 HydrophobicContact CD2-CD2 3.58Å; L200-L258 HydrophobicContact CG-CD2 3.94Å; V222-L258 HydrophobicContact CG1-CB 4.02Å; V222-L258 HydrophobicContact CG1-CD1 3.52Å; V222-L258 HydrophobicContact CG1-CG 4.43Å; L226-L258 HydrophobicContact CD1-CD1 3.85Å; F254-L258 HydrophobicContact CD1-CD1 4.03Å; F254-L258 HydrophobicContact CD1-CG 4.49Å; F254-L258 HydrophobicContact CE1-CD1 3.75Å; F254-L258 HydrophobicContact CE1-CD2 4.3Å; F254-L258 HydrophobicContact CE1-CG 4.25Å; F254-L258 HydrophobicContact CZ-CD1 4.46Å; F254-L258 HydrophobicContact CZ-CD2 4.2Å; F254-L258 PolarHBondContact O-N 3.5Å; L255-L258 PolarHBondContact O-N 2.89Å; L255-L258 VanDerWaalsContact O-N 3.12Å; N256-L258 VanDerWaalsContact C-N 3.32Å; L258-L299 HydrophobicContact CB-CD1 4.07Å; L258-L299 HydrophobicContact CD1-CD2 4.26Å; L258-L299 HydrophobicContact CD2-CG 4.45Å; L258-E301 HydrophobicContact CD2-CB 4.33Å
259	A	79.9	Confident	65.9	Low	2 Å²	2	66 Å²	66	2%	0.017	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.6	171.5	0	0	0	0	0	108.9	P282 V300 R302	A259-P282 HydrophobicContact CB-CB 3.71Å; A259-V300 PolarHBondContact N-O 2.98Å; A259-V300 PolarHBondContact O-N 3.09Å; A259-R302 HydrophobicContact CB-CG 3.75Å
260	L	82.6	Confident	65.7	Low	1 Å²	1	71.7 Å²	71.7	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.4	166.5	-163.3	71.7	0	0	0	107.7	V195 V218 F221 L283 I289 F297 L299	V195-L260 HydrophobicContact CG1-CD1 4.03Å; V218-L260 HydrophobicContact CG1-CB 4.1Å; V218-L260 HydrophobicContact CG1-CD2 4.12Å; F221-L260 HydrophobicContact CD1-CD2 3.79Å; F221-L260 HydrophobicContact CE1-CD1 4.36Å; F221-L260 HydrophobicContact CE1-CD2 3.76Å; L260-L283 HydrophobicContact CB-CB 4.37Å; L260-L283 HydrophobicContact CB-CD1 3.9Å; L260-L283 HydrophobicContact CD2-CD1 3.68Å; L260-L283 HydrophobicContact CG-CD1 3.74Å; L260-L283 WeakPolarHBondContact O-CB 3.33Å; L260-L283 WeakPolarHBondContact O-CD1 3.26Å; L260-L283 VanDerWaalsContact O-CG 3.27Å; L260-L283 WeakPolarHBondContact O-CG 3.26Å; L260-L283 PolarHBondContact O-N 3.2Å; L260-I289 HydrophobicContact CD2-CD1 3.68Å; L260-F297 HydrophobicContact CD1-CB 3.63Å; L260-F297 HydrophobicContact CD1-CG 4.27Å; L260-F297 HydrophobicContact CD2-CB 4.22Å; L260-F297 HydrophobicContact CD2-CD1 4.16Å; L260-F297 HydrophobicContact CD2-CD2 4.12Å; L260-F297 HydrophobicContact CD2-CG 3.93Å; L260-F297 HydrophobicContact CG-CB 3.84Å; L260-F297 HydrophobicContact CG-CD1 4.22Å; L260-F297 HydrophobicContact CG-CG 4.02Å; L260-L299 HydrophobicContact CD1-CD1 4.02Å
261	H	79.9	Confident	65.2	Low	29 Å²	29	74.3 Å²	74.3	13%	0.134	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	154.3	172.4	-75.3	-96.6	0	0	0	109.8	V276 F297 A298	H261-V276 HydrophobicContact CB-CG1 3.71Å; H261-F297 CarbonylContact O-C 3.54Å; H261-F297 VanDerWaalsContact O-CA 3.27Å; H261-F297 WeakPolarHBondContact O-CA 3.44Å; H261-F297 WeakPolarHBondContact O-CB 3.46Å; H261-A298 HydrophobicContact CB-CB 4.49Å; H261-A298 PolarHBondContact N-O 2.79Å; H261-A298 PolarHBondContact O-N 3.38Å
262	M	79.7	Confident	64.6	Low	18 Å²	18	76.2 Å²	76.2	9%	0.089	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	145	164.1	-71	161.9	41.7	0	0	109.7	F280 F294	M262-F280 HydrophobicContact CE-CB 4.43Å; M262-F280 HydrophobicContact CE-CD1 3.89Å; M262-F280 HydrophobicContact CE-CD2 3.6Å; M262-F280 HydrophobicContact CE-CE1 4.01Å; M262-F280 HydrophobicContact CE-CE2 3.71Å; M262-F280 HydrophobicContact CE-CG 3.69Å; M262-F280 HydrophobicContact CE-CZ 3.92Å; M262-F280 HydrophobicContact SD-CB 4.07Å; M262-F280 HydrophobicContact SD-CD1 3.79Å; M262-F280 HydrophobicContact SD-CD2 4.31Å; M262-F280 HydrophobicContact SD-CE1 4.34Å; M262-F280 HydrophobicContact SD-CG 3.78Å; M262-F294 HydrophobicContact CE-CD1 4.11Å; M262-F294 HydrophobicContact CE-CD2 4.25Å; M262-F294 HydrophobicContact CE-CE1 3.51Å; M262-F294 HydrophobicContact CE-CE2 3.67Å; M262-F294 HydrophobicContact CE-CG 4.46Å; M262-F294 HydrophobicContact CE-CZ 3.27Å; M262-F294 HydrophobicContact CG-CD2 3.69Å; M262-F294 HydrophobicContact CG-CE2 3.9Å; M262-F294 HydrophobicContact CG-CG 4.06Å; M262-F294 HydrophobicContact CG-CZ 4.42Å; M262-F294 HydrophobicContact SD-CD2 3.83Å; M262-F294 HydrophobicContact SD-CE1 4.32Å; M262-F294 HydrophobicContact SD-CE2 3.36Å; M262-F294 WeakPolarHBondContact SD-CE2 3.4Å; M262-F294 HydrophobicContact SD-CG 4.49Å; M262-F294 HydrophobicContact SD-CZ 3.66Å
263	F	73.3	Confident	64.2	Low	32 Å²	32	74.3 Å²	74.3	14%	0.14	37%	0.374	C	S	.	.			trans	-140.4	112.3	176	-172.8	-119.2	0	0	0	108.4	W196 W198 T265 D275 V276 S296 A298	W196-F263 AromaticContact CD1-CD1 3.35Å; W196-F263 AromaticContact CD1-CE1 3.65Å; W196-F263 HydrophobicContact CD2-CE1 4.14Å; W196-F263 AromaticContact CE2-CE1 3.93Å; W196-F263 AromaticContact CG-CD1 3.99Å; W196-F263 HydrophobicContact CG-CD1 3.99Å; W196-F263 AromaticContact CG-CE1 3.98Å; W196-F263 HydrophobicContact CG-CE1 3.98Å; W196-F263 AromaticContact NE1-CD1 3.58Å; W196-F263 AromaticContact NE1-CE1 3.6Å; W198-F263 HydrophobicContact CE3-CE2 4.38Å; W198-F263 HydrophobicContact CE3-CZ 4.26Å; W198-F263 HydrophobicContact CZ3-CE2 4.21Å; W198-F263 AromaticContact CZ3-CZ 3.85Å; W198-F263 HydrophobicContact CZ3-CZ 3.85Å; F263-T265 HydrophobicContact CD1-CG2 3.5Å; F263-T265 HydrophobicContact CE1-CG2 3.54Å; F263-T265 PolarHBondContact O-N 3.01Å; F263-D275 WeakPolarHBondContact CD2-O 3.42Å; F263-D275 WeakPolarHBondContact CE2-O 3.49Å; F263-V276 HydrophobicContact CD2-CG2 4.3Å; F263-S296 PolarHBondContact N-O 2.72Å; F263-S296 CarbonylContact O-C 3.54Å; F263-S296 WeakPolarHBondContact O-CB 3.17Å; F263-A298 HydrophobicContact CB-CB 3.93Å; F263-A298 HydrophobicContact CD2-CB 4.32Å; F263-A298 HydrophobicContact CG-CB 4.2Å
264	D	66.6	Low	63.6	Low	114 Å²	114	75.3 Å²	75.3	61%	0.61	37%	0.372	S	S	*	.			trans	-85	92.2	-177.7	-162.1	10.9	0	0	0	110	L266	D264-L266 PolarHBondContact O-N 3.34Å; D264-L266 VanDerWaalsContact OD2-CD1 3.29Å; D264-L266 WeakPolarHBondContact OD2-CD1 3.17Å
265	T	59	Low	62.8	Low	56 Å²	56	80.1 Å²	80.1	34%	0.344	40%	0.398	S	S	.	.			trans	-76.6	67.1	170.7	56.9	0	0	0	0	109.8	W196 F263 D267 S296	W196-T265 HydrophobicContact CZ2-CG2 4.46Å; F263-T265 HydrophobicContact CD1-CG2 3.5Å; F263-T265 HydrophobicContact CE1-CG2 3.54Å; F263-T265 PolarHBondContact O-N 3.01Å; T265-D267 PolarHBondContact O-N 3.24Å; T265-S296 WeakPolarHBondContact CG2-OG 3.45Å; T265-S296 WeakPolarHBondContact OG1-CB 3.3Å; T265-S296 PolarHBondContact OG1-OG 3.38Å
266	L	53.1	Low	62.1	Low	97 Å²	97	80.1 Å²	80.1	51%	0.508	40%	0.399	S	S	.	.			trans	-83.6	91	167	-92.3	174.9	0	0	0	108.9	D264 D268	D264-L266 PolarHBondContact O-N 3.34Å; D264-L266 VanDerWaalsContact OD2-CD1 3.29Å; D264-L266 WeakPolarHBondContact OD2-CD1 3.17Å; L266-D268 PolarHBondContact O-N 2.86Å
267	D	50.3	Low	61.5	Low	151 Å²	151	79.1 Å²	79.1	81%	0.807	39%	0.393	S	S	*	.			trans	25.3	8.3	148.9	-52.6	-31.7	0	0	0	122.8	T265 E269	T265-D267 PolarHBondContact O-N 3.24Å; D267-E269 PolarHBondContact O-N 3.02Å; D267-E269 VanDerWaalsContact O-N 3.1Å
268	D	42.9	Very low	60.7	Low	100 Å²	100	80.1 Å²	80.1	54%	0.535	41%	0.411	S	S	.	.			trans	-80.4	87.1	171.9	-81	8.9	0	0	0	107.5	L266 Y270 R351	L266-D268 PolarHBondContact O-N 2.86Å; D268-Y270 PolarHBondContact O-N 3.34Å; D268-R351 IonicContact OD2-CZ 2.68Å; D268-R351 IonicContact OD2-NH1 3.45Å; D268-R351 PolarHBondContact OD2-NH1 3.4Å; D268-R351 IonicContact OD2-NH2 3.36Å; D268-R351 PolarHBondContact OD2-NH2 3.02Å
269	E	47.6	Very low	59.7	Low	171 Å²	171	87.6 Å²	87.6	80%	0.799	45%	0.446	S	S	*	.	S	Bend	trans	-48.8	137.4	155.3	-65.1	-178.6	152.4	0	0	108.1	D267	D267-E269 PolarHBondContact O-N 3.02Å; D267-E269 VanDerWaalsContact O-N 3.1Å
270	Y	49.3	Very low	58.8	Low	233 Å²	233	92.1 Å²	92.1	91%	0.914	47%	0.465	S	S	*	.	S	Bend	trans	83.9	42.8	-174	-50.8	-79	0	0	0	118.9	D268	D268-Y270 PolarHBondContact O-N 3.34Å
271	D	48.2	Very low	58.2	Low	83 Å²	83	96.8 Å²	96.8	44%	0.444	50%	0.496	S	S	.	.			trans	-131.5	117.1	156	-147.3	-27.6	0	0	0	114.2	N273 Y348	D271-N273 VanDerWaalsContact C-N 3.35Å; D271-N273 VanDerWaalsContact OD1-CB 3.3Å; D271-N273 WeakPolarHBondContact OD1-CB 3.06Å; D271-N273 PolarHBondContact OD1-N 3.39Å; D271-N273 PolarHBondContact OD1-ND2 3.49Å; D271-Y348 PolarHBondContact OD1-OH 3.35Å; D271-Y348 PolarHBondContact OD2-OH 2.94Å
272	D	49.9	Very low	58	Low	157 Å²	157	97.6 Å²	97.6	84%	0.84	50%	0.504	S	S	*	.			trans	-86.8	-0.6	175.2	-80.2	-48.8	0	0	0	112.9
273	N	50.9	Low	57.9	Low	92 Å²	92	97.1 Å²	97.1	49%	0.492	50%	0.501	S	S	.	.	S	Bend	trans	-103.3	100.1	-167.9	-58.9	-81.2	0	0	0	114.5	D271 D275	D271-N273 VanDerWaalsContact C-N 3.35Å; D271-N273 VanDerWaalsContact OD1-CB 3.3Å; D271-N273 WeakPolarHBondContact OD1-CB 3.06Å; D271-N273 PolarHBondContact OD1-N 3.39Å; D271-N273 PolarHBondContact OD1-ND2 3.49Å; N273-D275 VanDerWaalsContact C-N 3.27Å; N273-D275 PolarHBondContact O-N 2.83Å
274	E	52.3	Low	58.2	Low	81 Å²	81	101.6 Å²	101.6	38%	0.379	52%	0.522	S	S	.	.				50	3.7	129.2	-62.4	-90.5	128.1	0	0	122.5	R199 R205 V276	R199-E274 IonicContact CZ-OE2 3.52Å; R199-E274 IonicContact NE-OE2 3.9Å; R199-E274 IonicContact NH2-OE2 2.63Å; R199-E274 PolarHBondContact NH2-OE2 3.16Å; R205-E274 IonicContact CZ-OE1 3.66Å; R205-E274 IonicContact NH1-OE1 3.58Å; R205-E274 PolarHBondContact NH1-OE1 3.1Å; R205-E274 IonicContact NH2-OE1 2.72Å; R205-E274 PolarHBondContact NH2-OE1 3.47Å; E274-V276 PolarHBondContact O-N 3.14Å
275	D	54.7	Low	58.8	Low	118 Å²	118	97.6 Å²	97.6	63%	0.631	50%	0.501	S	S	*	.			trans	-77.8	60.1	-178.6	-81.7	-4.5	0	0	0	113.3	F263 N273 D277	F263-D275 WeakPolarHBondContact CD2-O 3.42Å; F263-D275 WeakPolarHBondContact CE2-O 3.49Å; N273-D275 VanDerWaalsContact C-N 3.27Å; N273-D275 PolarHBondContact O-N 2.83Å; D275-D277 PolarHBondContact O-N 3.47Å
276	V	57.6	Low	59.8	Low	6 Å²	6	101 Å²	101	4%	0.036	52%	0.517	C	S	.	.			trans	-69.6	119.9	151	172.8	0	0	0	0	107.5	W198 H261 F263 E274 S278 A298 V300	W198-V276 HydrophobicContact CB-CG2 4.24Å; W198-V276 HydrophobicContact CD2-CG2 3.79Å; W198-V276 HydrophobicContact CG-CG2 3.49Å; W198-V276 VanDerWaalsContact CG-CG2 3.49Å; H261-V276 HydrophobicContact CB-CG1 3.71Å; F263-V276 HydrophobicContact CD2-CG2 4.3Å; E274-V276 PolarHBondContact O-N 3.14Å; V276-S278 VanDerWaalsContact C-N 3.26Å; V276-S278 PolarHBondContact O-N 3.29Å; V276-S278 PolarHBondContact O-OG 2.78Å; V276-A298 HydrophobicContact CG1-CB 4.28Å; V276-A298 HydrophobicContact CG2-CB 3.72Å; V276-V300 HydrophobicContact CG1-CG2 4.43Å
277	D	59.8	Low	61.2	Low	51 Å²	51	97.4 Å²	97.4	27%	0.273	50%	0.499	S	S	.	.			trans	-66.8	83	-169.2	-157	-5.1	0	0	0	111.5	D275 E279 F280	D275-D277 PolarHBondContact O-N 3.47Å; D277-E279 PolarHBondContact O-N 2.86Å; D277-F280 PolarHBondContact O-N 2.75Å; D277-F280 WeakPolarHBondContact OD2-CD2 3.46Å
278	S	58.6	Low	62.8	Low	90 Å²	90	92.9 Å²	92.9	63%	0.629	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.3	-170.2	-61.1	0	0	0	0	112.4	V276	V276-S278 VanDerWaalsContact C-N 3.26Å; V276-S278 PolarHBondContact O-N 3.29Å; V276-S278 PolarHBondContact O-OG 2.78Å
279	E	57.7	Low	64.7	Low	158 Å²	158	88.1 Å²	88.1	74%	0.738	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-23.3	169.7	-60.2	-164.8	175.4	0	0	111.5	D277	D277-E279 PolarHBondContact O-N 2.86Å
280	F	61.5	Low	66.4	Low	97 Å²	97	82.1 Å²	82.1	43%	0.425	42%	0.423	S	S	.	.	S	Bend	trans	-92.4	134.5	175.1	-76.1	-85.2	0	0	0	112.8	M262 D277	M262-F280 HydrophobicContact CE-CB 4.43Å; M262-F280 HydrophobicContact CE-CD1 3.89Å; M262-F280 HydrophobicContact CE-CD2 3.6Å; M262-F280 HydrophobicContact CE-CE1 4.01Å; M262-F280 HydrophobicContact CE-CE2 3.71Å; M262-F280 HydrophobicContact CE-CG 3.69Å; M262-F280 HydrophobicContact CE-CZ 3.92Å; M262-F280 HydrophobicContact SD-CB 4.07Å; M262-F280 HydrophobicContact SD-CD1 3.79Å; M262-F280 HydrophobicContact SD-CD2 4.31Å; M262-F280 HydrophobicContact SD-CE1 4.34Å; M262-F280 HydrophobicContact SD-CG 3.78Å; D277-F280 PolarHBondContact O-N 2.75Å; D277-F280 WeakPolarHBondContact OD2-CD2 3.46Å
281	P	69.5	Low	67.9	Low	99 Å²	99	76.8 Å²	76.8	64%	0.643	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-64	148.7	174	28.3	-34.3	0	0	0	110.6	L283	P281-L283 PolarHBondContact O-N 3.22Å
282	P	75.7	Confident	69.3	Low	46 Å²	46	74.7 Å²	74.7	30%	0.299	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-62.7	138.6	176.3	28.2	-35.8	0	0	0	110.6	A259	A259-P282 HydrophobicContact CB-CB 3.71Å
283	L	78.5	Confident	70.5	Confident	8 Å²	8	75.3 Å²	75.3	4%	0.042	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-59	142.1	-172.7	-59.7	161.6	0	0	0	111.4	V218 L260 P281 L285 Y292 F297	V218-L283 HydrophobicContact CG1-CB 4.44Å; V218-L283 HydrophobicContact CG2-CB 4.43Å; L260-L283 HydrophobicContact CB-CB 4.37Å; L260-L283 HydrophobicContact CB-CD1 3.9Å; L260-L283 HydrophobicContact CD2-CD1 3.68Å; L260-L283 HydrophobicContact CG-CD1 3.74Å; L260-L283 WeakPolarHBondContact O-CB 3.33Å; L260-L283 WeakPolarHBondContact O-CD1 3.26Å; L260-L283 VanDerWaalsContact O-CG 3.27Å; L260-L283 WeakPolarHBondContact O-CG 3.26Å; L260-L283 PolarHBondContact O-N 3.2Å; P281-L283 PolarHBondContact O-N 3.22Å; L283-L285 PolarHBondContact O-N 3.23Å; L283-Y292 HydrophobicContact CB-CE2 4.36Å; L283-Y292 HydrophobicContact CD2-CD1 3.36Å; L283-Y292 HydrophobicContact CD2-CD2 3.99Å; L283-Y292 HydrophobicContact CD2-CE1 3.18Å; L283-Y292 HydrophobicContact CD2-CE2 3.84Å; L283-Y292 HydrophobicContact CD2-CG 3.75Å; L283-Y292 VanDerWaalsContact CD2-CZ 3.43Å; L283-F297 HydrophobicContact CD1-CD1 3.67Å; L283-F297 HydrophobicContact CD1-CE1 3.58Å; L283-F297 HydrophobicContact CD1-CZ 4.48Å
284	E	78.7	Confident	71.8	Confident	125 Å²	125	75 Å²	75	58%	0.584	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-69.7	126.7	-178.5	-69.2	-167.5	-171.8	0	0	111.2	V218 N286 D287	V218-E284 WeakPolarHBondContact CB-O 3.42Å; V218-E284 WeakPolarHBondContact CG2-O 3.36Å; E284-N286 PolarHBondContact O-N 3.39Å; E284-N286 VanDerWaalsContact O-N 3.08Å; E284-D287 HydrophobicContact CB-CB 4.3Å; E284-D287 PolarHBondContact O-N 3.36Å; E284-D287 VanDerWaalsContact O-N 3.07Å
285	L	78.4	Confident	73	Confident	30 Å²	30	78.7 Å²	78.7	16%	0.157	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.7	-176	-67.3	176.3	0	0	0	113.7	V218 Q219 L283	V218-L285 HydrophobicContact CG1-CD2 4.36Å; V218-L285 PolarHBondContact N-O 2.93Å; Q219-L285 HydrophobicContact CB-CB 4.35Å; Q219-L285 PolarHBondContact N-O 3.49Å; L283-L285 PolarHBondContact O-N 3.23Å
286	N	80	Confident	74.4	Confident	128 Å²	128	73.5 Å²	73.5	68%	0.684	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-16.9	-178.2	-63.5	-29.6	0	0	0	113.7	E284	E284-N286 PolarHBondContact O-N 3.39Å; E284-N286 VanDerWaalsContact O-N 3.08Å
287	D	84.1	Confident	75.8	Confident	22 Å²	22	73.2 Å²	73.2	12%	0.118	37%	0.369	C	S	.	.	S	Bend	trans	-69.4	148.9	-179.3	-97.5	-33.1	0	0	0	111.1	T217 V218 E284 I289 K291 Y292	T217-D287 CarbonylContact C-O 3.55Å; T217-D287 VanDerWaalsContact CA-O 3.26Å; T217-D287 WeakPolarHBondContact CA-O 3.5Å; V218-D287 PolarHBondContact N-O 2.66Å; E284-D287 HydrophobicContact CB-CB 4.3Å; E284-D287 PolarHBondContact O-N 3.36Å; E284-D287 VanDerWaalsContact O-N 3.07Å; D287-I289 PolarHBondContact O-N 2.77Å; D287-K291 HydrophobicContact CB-CD 4.15Å; D287-K291 VanDerWaalsContact CG-CD 3.45Å; D287-K291 VanDerWaalsContact OD1-CD 3.29Å; D287-K291 WeakPolarHBondContact OD1-CD 3.41Å; D287-K291 IonicContact OD1-NZ 2.68Å; D287-K291 PolarHBondContact OD1-NZ 3.08Å; D287-K291 WeakPolarHBondContact OD2-CD 3.29Å; D287-K291 IonicContact OD2-NZ 3.13Å; D287-K291 PolarHBondContact OD2-NZ 2.77Å; D287-Y292 HydrophobicContact CB-CE2 3.72Å; D287-Y292 PolarHBondContact OD2-OH 3.32Å
288	P	83.5	Confident	76.9	Confident	55 Å²	55	70.8 Å²	70.8	36%	0.357	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-70.3	130.2	170	27.2	-28.9	0	0	0	109.9	T216 H290 K291	T216-P288 CarbonylContact O-C 3.54Å; T216-P288 VanDerWaalsContact O-CA 3.22Å; T216-P288 WeakPolarHBondContact O-CA 3.24Å; P288-H290 PolarHBondContact O-N 2.88Å; P288-K291 HydrophobicContact CG-CB 4.22Å; P288-K291 WeakPolarHBondContact O-CB 3.36Å; P288-K291 PolarHBondContact O-N 3.36Å
289	I	83.1	Confident	78.1	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-56.7	-30.8	-177	-170.5	65.1	0	0	0	112.6	F193 P212 T216 V218 F221 L260 D287 K291 Y292 F297	F193-I289 HydrophobicContact CE1-CG1 4.49Å; F193-I289 HydrophobicContact CE2-CG1 4.36Å; F193-I289 HydrophobicContact CE2-CG2 4.36Å; F193-I289 HydrophobicContact CZ-CG1 4.21Å; P212-I289 HydrophobicContact CB-CG2 4.33Å; P212-I289 HydrophobicContact CG-CG2 3.86Å; T216-I289 PolarHBondContact O-N 3.32Å; T216-I289 WeakPolarHBondContact OG1-CG2 3.09Å; V218-I289 HydrophobicContact CG2-CD1 4.07Å; F221-I289 HydrophobicContact CB-CB 4.35Å; F221-I289 HydrophobicContact CB-CG1 4.43Å; F221-I289 HydrophobicContact CD1-CD1 3.78Å; F221-I289 HydrophobicContact CD1-CG1 4Å; F221-I289 HydrophobicContact CD2-CG1 4.11Å; F221-I289 HydrophobicContact CD2-CG2 4.4Å; F221-I289 HydrophobicContact CE1-CD1 4Å; F221-I289 HydrophobicContact CE1-CG1 4.24Å; F221-I289 HydrophobicContact CE2-CG1 4.33Å; F221-I289 HydrophobicContact CG-CB 4.34Å; F221-I289 HydrophobicContact CG-CD1 4.18Å; F221-I289 HydrophobicContact CG-CG1 3.92Å; F221-I289 HydrophobicContact CZ-CG1 4.39Å; L260-I289 HydrophobicContact CD2-CD1 3.68Å; D287-I289 PolarHBondContact O-N 2.77Å; I289-K291 PolarHBondContact O-N 2.87Å; I289-Y292 PolarHBondContact O-N 3.5Å; I289-Y292 VanDerWaalsContact O-N 3.08Å; I289-F297 HydrophobicContact CD1-CD2 4.45Å; I289-F297 HydrophobicContact CD1-CE2 3.71Å; I289-F297 HydrophobicContact CD1-CZ 3.84Å; I289-F297 HydrophobicContact CG1-CE2 4.24Å
290	H	82.1	Confident	79.1	Confident	45 Å²	45	59.9 Å²	59.9	21%	0.208	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-67.1	-12.8	177.6	-62.1	82.2	0	0	0	114.4	R213 P288 Y292	R213-H290 PolarHBondContact O-CE1 3.27Å; P288-H290 PolarHBondContact O-N 2.88Å; H290-Y292 PolarHBondContact O-N 2.85Å
291	K	81.3	Confident	80	Confident	122 Å²	122	56.2 Å²	56.2	53%	0.53	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-65	-25.5	169.4	-174	-174.7	-179.9	-174.8	0	112.1	D287 P288 I289	D287-K291 HydrophobicContact CB-CD 4.15Å; D287-K291 VanDerWaalsContact CG-CD 3.45Å; D287-K291 VanDerWaalsContact OD1-CD 3.29Å; D287-K291 WeakPolarHBondContact OD1-CD 3.41Å; D287-K291 IonicContact OD1-NZ 2.68Å; D287-K291 PolarHBondContact OD1-NZ 3.08Å; D287-K291 WeakPolarHBondContact OD2-CD 3.29Å; D287-K291 IonicContact OD2-NZ 3.13Å; D287-K291 PolarHBondContact OD2-NZ 2.77Å; P288-K291 HydrophobicContact CG-CB 4.22Å; P288-K291 WeakPolarHBondContact O-CB 3.36Å; P288-K291 PolarHBondContact O-N 3.36Å; I289-K291 PolarHBondContact O-N 2.87Å
292	Y	78.4	Confident	79.8	Confident	38 Å²	38	55.6 Å²	55.6	15%	0.149	27%	0.266	C	S	.	.			trans	-99.4	111.5	-172.7	-62.9	-72.2	0	0	0	110.2	R191 V218 L283 D287 I289 H290 F294	R191-Y292 PolarHBondContact NH1-O 3.11Å; V218-Y292 HydrophobicContact CG2-CE2 4.16Å; L283-Y292 HydrophobicContact CB-CE2 4.36Å; L283-Y292 HydrophobicContact CD2-CD1 3.36Å; L283-Y292 HydrophobicContact CD2-CD2 3.99Å; L283-Y292 HydrophobicContact CD2-CE1 3.18Å; L283-Y292 HydrophobicContact CD2-CE2 3.84Å; L283-Y292 HydrophobicContact CD2-CG 3.75Å; L283-Y292 VanDerWaalsContact CD2-CZ 3.43Å; D287-Y292 HydrophobicContact CB-CE2 3.72Å; D287-Y292 PolarHBondContact OD2-OH 3.32Å; I289-Y292 PolarHBondContact O-N 3.5Å; I289-Y292 VanDerWaalsContact O-N 3.08Å; H290-Y292 PolarHBondContact O-N 2.85Å; Y292-F294 PolarHBondContact O-N 3.24Å
293	E	74.1	Confident	78.9	Confident	171 Å²	171	56.9 Å²	56.9	80%	0.799	27%	0.273	S	S	*	.			trans	-75	12.7	-174.6	-66.4	-171.3	174.8	0	0	114.3	R191	R191-E293 PolarHBondContact NH2-O 3.28Å
294	F	77.3	Confident	77.3	Confident	86 Å²	86	63 Å²	63	38%	0.377	30%	0.301	S	S	.	.			trans	-83.1	148	177.4	-55.2	-72.9	0	0	0	113	R191 F193 M262 Y292 F297	R191-F294 PolarHBondContact NH1-O 3.41Å; R191-F294 PolarHBondContact NH2-O 2.83Å; F193-F294 WeakPolarHBondContact CD1-O 3.38Å; F193-F294 WeakPolarHBondContact CE1-O 3.49Å; M262-F294 HydrophobicContact CE-CD1 4.11Å; M262-F294 HydrophobicContact CE-CD2 4.25Å; M262-F294 HydrophobicContact CE-CE1 3.51Å; M262-F294 HydrophobicContact CE-CE2 3.67Å; M262-F294 HydrophobicContact CE-CG 4.46Å; M262-F294 HydrophobicContact CE-CZ 3.27Å; M262-F294 HydrophobicContact CG-CD2 3.69Å; M262-F294 HydrophobicContact CG-CE2 3.9Å; M262-F294 HydrophobicContact CG-CG 4.06Å; M262-F294 HydrophobicContact CG-CZ 4.42Å; M262-F294 HydrophobicContact SD-CD2 3.83Å; M262-F294 HydrophobicContact SD-CE1 4.32Å; M262-F294 HydrophobicContact SD-CE2 3.36Å; M262-F294 WeakPolarHBondContact SD-CE2 3.4Å; M262-F294 HydrophobicContact SD-CG 4.49Å; M262-F294 HydrophobicContact SD-CZ 3.66Å; Y292-F294 PolarHBondContact O-N 3.24Å; F294-F297 HydrophobicContact CB-CE1 3.9Å; F294-F297 HydrophobicContact CB-CZ 4.13Å; F294-F297 HydrophobicContact CD2-CE1 4.46Å
295	K	79.1	Confident	75.3	Confident	158 Å²	158	61.7 Å²	61.7	69%	0.687	30%	0.302	S	S	*	.	S	Bend	trans	-92.3	-26	176.4	-65.1	180	-177.5	174.5	0	112.9	F193 N194	F193-K295 WeakPolarHBondContact CA-O 3.48Å; N194-K295 PolarHBondContact N-O 2.94Å
296	S	83.3	Confident	73.2	Confident	8 Å²	8	65.2 Å²	65.2	6%	0.056	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.6	-171.9	-70.8	0	0	0	0	110.8	N194 F263 T265	N194-S296 CarbonylContact O-C 3.52Å; N194-S296 VanDerWaalsContact O-CA 3.3Å; N194-S296 WeakPolarHBondContact O-CA 3.45Å; F263-S296 PolarHBondContact N-O 2.72Å; F263-S296 CarbonylContact O-C 3.54Å; F263-S296 WeakPolarHBondContact O-CB 3.17Å; T265-S296 WeakPolarHBondContact CG2-OG 3.45Å; T265-S296 WeakPolarHBondContact OG1-CB 3.3Å; T265-S296 PolarHBondContact OG1-OG 3.38Å
297	F	86.1	Confident	71.3	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.1	-179.7	-61.9	-67.6	0	0	0	111.2	F193 N194 V195 W196 F221 L260 H261 L283 I289 F294	F193-F297 HydrophobicContact CB-CD2 4.39Å; F193-F297 HydrophobicContact CB-CE2 4.32Å; F193-F297 HydrophobicContact CD1-CD2 4.25Å; F193-F297 AromaticContact CD1-CE2 3.42Å; F193-F297 HydrophobicContact CD1-CE2 3.42Å; F193-F297 VanDerWaalsContact CD1-CE2 3.42Å; F193-F297 HydrophobicContact CD1-CZ 4.22Å; F193-F297 AromaticContact CE1-CE2 3.89Å; F193-F297 HydrophobicContact CE1-CE2 3.89Å; F193-F297 HydrophobicContact CE1-CZ 4.31Å; F193-F297 HydrophobicContact CG-CE2 4.09Å; N194-F297 PolarHBondContact O-N 2.81Å; V195-F297 WeakPolarHBondContact CA-O 3.32Å; W196-F297 PolarHBondContact N-O 3.41Å; F221-F297 HydrophobicContact CE1-CD2 4.14Å; F221-F297 HydrophobicContact CZ-CD2 4.31Å; L260-F297 HydrophobicContact CD1-CB 3.63Å; L260-F297 HydrophobicContact CD1-CG 4.27Å; L260-F297 HydrophobicContact CD2-CB 4.22Å; L260-F297 HydrophobicContact CD2-CD1 4.16Å; L260-F297 HydrophobicContact CD2-CD2 4.12Å; L260-F297 HydrophobicContact CD2-CG 3.93Å; L260-F297 HydrophobicContact CG-CB 3.84Å; L260-F297 HydrophobicContact CG-CD1 4.22Å; L260-F297 HydrophobicContact CG-CG 4.02Å; H261-F297 CarbonylContact O-C 3.54Å; H261-F297 VanDerWaalsContact O-CA 3.27Å; H261-F297 WeakPolarHBondContact O-CA 3.44Å; H261-F297 WeakPolarHBondContact O-CB 3.46Å; L283-F297 HydrophobicContact CD1-CD1 3.67Å; L283-F297 HydrophobicContact CD1-CE1 3.58Å; L283-F297 HydrophobicContact CD1-CZ 4.48Å; I289-F297 HydrophobicContact CD1-CD2 4.45Å; I289-F297 HydrophobicContact CD1-CE2 3.71Å; I289-F297 HydrophobicContact CD1-CZ 3.84Å; I289-F297 HydrophobicContact CG1-CE2 4.24Å; F294-F297 HydrophobicContact CB-CE1 3.9Å; F294-F297 HydrophobicContact CB-CZ 4.13Å; F294-F297 HydrophobicContact CD2-CE1 4.46Å
298	A	83.1	Confident	69	Low	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	172.6	0	0	0	0	0	110.5	W198 H261 F263 V276	W198-A298 HydrophobicContact CB-CB 4.03Å; H261-A298 HydrophobicContact CB-CB 4.49Å; H261-A298 PolarHBondContact N-O 2.79Å; H261-A298 PolarHBondContact O-N 3.38Å; F263-A298 HydrophobicContact CB-CB 3.93Å; F263-A298 HydrophobicContact CD2-CB 4.32Å; F263-A298 HydrophobicContact CG-CB 4.2Å; V276-A298 HydrophobicContact CG1-CB 4.28Å; V276-A298 HydrophobicContact CG2-CB 3.72Å
299	L	83.7	Confident	66.9	Low	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123.3	176.2	-165.4	65.5	0	0	0	109.8	V195 W196 L197 W198 R199 L200 V222 L258 L260	V195-L299 HydrophobicContact CG1-CB 4.17Å; W196-L299 PolarHBondContact O-N 3Å; L197-L299 HydrophobicContact CD2-CB 4.38Å; L197-L299 HydrophobicContact CD2-CD2 3.7Å; W198-L299 PolarHBondContact N-O 2.81Å; W198-L299 VanDerWaalsContact N-O 3.15Å; R199-L299 PolarHBondContact N-O 3.26Å; L200-L299 HydrophobicContact CD1-CB 3.98Å; L200-L299 HydrophobicContact CD1-CD2 4.07Å; L200-L299 HydrophobicContact CD1-CG 3.97Å; L200-L299 WeakPolarHBondContact CD1-O 3.27Å; L200-L299 HydrophobicContact CD2-CD2 3.95Å; L200-L299 HydrophobicContact CD2-CG 4.37Å; V222-L299 HydrophobicContact CB-CD1 4.48Å; V222-L299 HydrophobicContact CG1-CD1 3.88Å; V222-L299 HydrophobicContact CG1-CD2 4.31Å; V222-L299 HydrophobicContact CG2-CD1 3.78Å; L258-L299 HydrophobicContact CB-CD1 4.07Å; L258-L299 HydrophobicContact CD1-CD2 4.26Å; L258-L299 HydrophobicContact CD2-CG 4.45Å; L260-L299 HydrophobicContact CD1-CD1 4.02Å
300	V	80.5	Confident	64.8	Low	19 Å²	19	82.8 Å²	82.8	12%	0.115	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.7	-172.8	178.5	0	0	0	0	109.8	R199 A259 V276 R302	R199-V300 HydrophobicContact CB-CG1 4.14Å; R199-V300 HydrophobicContact CB-CG2 4.49Å; A259-V300 PolarHBondContact N-O 2.98Å; A259-V300 PolarHBondContact O-N 3.09Å; V276-V300 HydrophobicContact CG1-CG2 4.43Å; V300-R302 PolarHBondContact O-N 2.5Å
301	E	78.8	Confident	62.7	Low	21 Å²	21	85.8 Å²	85.8	10%	0.098	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.7	175.9	-169.7	-176.7	160.7	0	0	111	R199 R201 R257 L258 V303	R199-E301 WeakPolarHBondContact O-CB 3.44Å; R199-E301 PolarHBondContact O-N 2.97Å; R201-E301 VanDerWaalsContact CB-OE2 3.3Å; R201-E301 WeakPolarHBondContact CB-OE2 3.4Å; R201-E301 WeakPolarHBondContact CG-OE2 3.33Å; R201-E301 PolarHBondContact N-OE2 2.9Å; R257-E301 IonicContact CZ-OE1 2.88Å; R257-E301 IonicContact NH1-OE1 2.69Å; R257-E301 IonicContact NH2-OE1 2.74Å; R257-E301 PolarHBondContact NH2-OE1 3.13Å; R257-E301 CarbonylContact O-C 3.6Å; L258-E301 HydrophobicContact CD2-CB 4.33Å; E301-V303 PolarHBondContact O-N 2.79Å
302	R	66	Low	60.7	Low	86 Å²	86	88.9 Å²	88.9	33%	0.325	45%	0.453	S	S	.	.			trans	-64	100.7	162.4	-58.2	178.6	170.7	159.1	0.9	108	R257 A259 V300 Q304	R257-R302 WeakPolarHBondContact O-CA 3.46Å; R257-R302 WeakPolarHBondContact O-CB 3.26Å; R257-R302 PolarHBondContact O-N 3.45Å; A259-R302 HydrophobicContact CB-CG 3.75Å; V300-R302 PolarHBondContact O-N 2.5Å; R302-Q304 VanDerWaalsContact C-N 3.29Å; R302-Q304 PolarHBondContact O-N 3.05Å
303	V	56.7	Low	58.9	Low	72 Å²	72	95.8 Å²	95.8	44%	0.436	48%	0.483	S	S	.	.			trans	-67.8	94	162	-175.1	0	0	0	0	107.1	E301 T305	E301-V303 PolarHBondContact O-N 2.79Å; V303-T305 HydrophobicContact CG1-CG2 4.18Å; V303-T305 PolarHBondContact O-N 3.21Å
304	Q	45.8	Very low	57.3	Low	137 Å²	137	96.2 Å²	96.2	64%	0.64	49%	0.485	S	S	*	.			trans	-66.7	87	160.5	-69.9	-175	11.5	0	0	107.3	R302	R302-Q304 VanDerWaalsContact C-N 3.29Å; R302-Q304 PolarHBondContact O-N 3.05Å
305	T	36.3	Very low	56	Low	98 Å²	98	96 Å²	96	60%	0.601	49%	0.487	S	S	*	.			trans	-61.2	127.4	159.1	32.1	0	0	0	0	107.4	V303 L307	V303-T305 HydrophobicContact CG1-CG2 4.18Å; V303-T305 PolarHBondContact O-N 3.21Å; T305-L307 PolarHBondContact O-N 3.3Å
306	P	34.8	Very low	55	Low	104 Å²	104	91.9 Å²	91.9	68%	0.675	48%	0.478	S	S	*	.			trans	-51.6	138	178	-28.4	35.8	0	0	0	111.4	E308 E309	P306-E308 PolarHBondContact O-N 2.87Å; P306-E309 PolarHBondContact O-N 3.19Å
307	L	38.2	Very low	54.2	Low	165 Å²	165	96 Å²	96	86%	0.864	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	4.7	-165.7	-167.2	58.1	0	0	0	114.8	T305	T305-L307 PolarHBondContact O-N 3.3Å
308	E	37.8	Very low	53.6	Low	177 Å²	177	97.9 Å²	97.9	83%	0.827	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-15.1	-171.1	-60.3	-170.9	153.9	0	0	114.1	P306	P306-E308 PolarHBondContact O-N 2.87Å
309	E	38.5	Very low	53.5	Low	176 Å²	176	103.2 Å²	103.2	82%	0.822	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-10.9	175.3	-65.5	-168.7	153.1	0	0	114.1	P306 S311	P306-E309 PolarHBondContact O-N 3.19Å; E309-S311 VanDerWaalsContact C-N 3.25Å; E309-S311 PolarHBondContact O-N 2.96Å
310	A	39.1	Very low	53.4	Low	56 Å²	56	103.2 Å²	103.2	46%	0.463	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-74.7	-7	-178.7	0	0	0	0	0	114.7	K312	A310-K312 PolarHBondContact O-N 2.86Å
311	S	38.4	Very low	53.5	Low	108 Å²	108	103.1 Å²	103.1	76%	0.755	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-72.2	6.4	178.8	59	0	0	0	0	114.7	E309	E309-S311 VanDerWaalsContact C-N 3.25Å; E309-S311 PolarHBondContact O-N 2.96Å
312	K	38.5	Very low	53.7	Low	187 Å²	187	102.1 Å²	102.1	81%	0.813	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-133.2	36.2	-175.3	-95.3	-175.9	178.2	174.7	0	115.7	A310	A310-K312 PolarHBondContact O-N 2.86Å
313	K	41.1	Very low	54.3	Low	183 Å²	183	99.9 Å²	99.9	80%	0.796	52%	0.524	S	S	*	.			trans	-179.2	77.1	147.1	-102.9	171.1	-176.5	-172.7	0	108.9	I315	K313-I315 VanDerWaalsContact C-N 3.31Å; K313-I315 PolarHBondContact O-N 2.85Å
314	E	40.7	Very low	55.2	Low	179 Å²	179	97.6 Å²	97.6	84%	0.836	51%	0.509	S	S	*	.			trans	-66.3	99	160.3	-168.8	172.1	-141.3	0	0	106.5	S316	E314-S316 VanDerWaalsContact C-N 3.33Å; E314-S316 PolarHBondContact O-N 2.94Å
315	I	50.6	Low	56.3	Low	82 Å²	82	96 Å²	96	42%	0.421	52%	0.518	S	S	.	.			trans	-71.9	95.9	-177.5	-57.3	178.2	0	0	0	106.8	K313 H317 P334	K313-I315 VanDerWaalsContact C-N 3.31Å; K313-I315 PolarHBondContact O-N 2.85Å; I315-H317 VanDerWaalsContact C-N 3.33Å; I315-H317 PolarHBondContact O-CD2 3.32Å; I315-H317 PolarHBondContact O-N 3.26Å; I315-P334 HydrophobicContact CG2-CB 3.28Å
316	S	57	Low	57.9	Low	71 Å²	71	98.4 Å²	98.4	50%	0.497	52%	0.523	S	S	.	.			trans	-60.3	94.2	179.2	-59.8	0	0	0	0	109.9	E314 V318 S335	E314-S316 VanDerWaalsContact C-N 3.33Å; E314-S316 PolarHBondContact O-N 2.94Å; S316-V318 VanDerWaalsContact O-CG2 3.25Å; S316-V318 WeakPolarHBondContact O-CG2 3.47Å; S316-V318 PolarHBondContact O-N 3.41Å; S316-S335 WeakPolarHBondContact O-CB 3.48Å; S316-S335 PolarHBondContact O-N 3.25Å
317	H	66.9	Low	59.7	Low	96 Å²	96	94.6 Å²	94.6	44%	0.444	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	127.6	170.6	-71.1	-79.5	0	0	0	109.1	I315 R332 F333	I315-H317 VanDerWaalsContact C-N 3.33Å; I315-H317 PolarHBondContact O-CD2 3.32Å; I315-H317 PolarHBondContact O-N 3.26Å; H317-R332 HydrophobicContact CB-CG 3.92Å; H317-R332 VanDerWaalsContact CB-NE 3.31Å; H317-F333 CarbonylContact C-O 3.48Å; H317-F333 WeakPolarHBondContact CA-O 3.19Å
318	V	74.3	Confident	61.8	Low	39 Å²	39	92.1 Å²	92.1	24%	0.236	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141.7	-178.4	-151.5	0	0	0	0	110.2	S316 F333 I399 L405	S316-V318 VanDerWaalsContact O-CG2 3.25Å; S316-V318 WeakPolarHBondContact O-CG2 3.47Å; S316-V318 PolarHBondContact O-N 3.41Å; V318-F333 PolarHBondContact N-O 3.03Å; V318-F333 PolarHBondContact O-N 2.93Å; V318-F333 VanDerWaalsContact O-N 3.07Å; V318-I399 HydrophobicContact CG2-CD1 3.68Å; V318-L405 HydrophobicContact CB-CD1 3.85Å; V318-L405 HydrophobicContact CG1-CD1 3.24Å
319	L	80	Confident	63.8	Low	112 Å²	112	84 Å²	84	59%	0.586	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.4	175.6	-69.7	85.1	0	0	0	108.8	V330	L319-V330 HydrophobicContact CB-CG1 4.28Å; L319-V330 HydrophobicContact CD2-CG1 3.96Å
320	V	81.6	Confident	65.9	Low	0 Å²	0	78.7 Å²	78.7	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.9	178.3	177.3	0	0	0	0	108.1	I322 V330 L331 F333 V342 L395 L405 F407	V320-I322 HydrophobicContact CG1-CD1 4.47Å; V320-I322 HydrophobicContact CG1-CG1 4.08Å; V320-V330 WeakPolarHBondContact O-CA 3.44Å; V320-L331 PolarHBondContact N-O 3.29Å; V320-L331 PolarHBondContact O-N 2.7Å; V320-F333 HydrophobicContact CB-CD2 3.93Å; V320-F333 HydrophobicContact CB-CE2 4.19Å; V320-F333 HydrophobicContact CG2-CD2 3.76Å; V320-F333 HydrophobicContact CG2-CE2 4.46Å; V320-V342 HydrophobicContact CG1-CG1 3.97Å; V320-L395 HydrophobicContact CG2-CD1 3.84Å; V320-L395 HydrophobicContact CG2-CD2 3.9Å; V320-L405 HydrophobicContact CG2-CB 4.45Å; V320-F407 HydrophobicContact CG1-CD2 3.44Å; V320-F407 VanDerWaalsContact CG1-CD2 3.44Å; V320-F407 HydrophobicContact CG1-CE2 3.55Å
321	T	83.3	Confident	67.9	Low	17 Å²	17	76.9 Å²	76.9	10%	0.104	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.6	179.4	-56.3	0	0	0	0	110	H323 M328 V330 L405 H406 F407	T321-H323 WeakPolarHBondContact CG2-NE2 3.12Å; T321-M328 HydrophobicContact CG2-CB 4.33Å; T321-M328 HydrophobicContact CG2-SD 4.36Å; T321-V330 HydrophobicContact CG2-CG2 4.2Å; T321-L405 PolarHBondContact N-O 2.87Å; T321-H406 CarbonylContact O-C 3.58Å; T321-H406 VanDerWaalsContact O-CA 3.3Å; T321-H406 WeakPolarHBondContact O-CA 3.32Å; T321-F407 PolarHBondContact O-N 3.39Å
322	I	82.9	Confident	69.9	Low	0 Å²	0	79.4 Å²	79.4	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	107.2	-177.4	-53.5	178.3	0	0	0	109.1	V320 M324 M328 S329 L331 V342 A346 L362 F407 L409	V320-I322 HydrophobicContact CG1-CD1 4.47Å; V320-I322 HydrophobicContact CG1-CG1 4.08Å; I322-M324 HydrophobicContact CG2-CE 3.96Å; I322-M324 HydrophobicContact CG2-CG 4.4Å; I322-M328 CarbonylContact O-C 3.56Å; I322-M328 WeakPolarHBondContact O-CA 3.35Å; I322-S329 PolarHBondContact N-O 3.14Å; I322-S329 PolarHBondContact O-N 3.49Å; I322-L331 HydrophobicContact CD1-CD1 3.92Å; I322-V342 HydrophobicContact CD1-CG1 3.7Å; I322-A346 HydrophobicContact CD1-CB 3.45Å; I322-A346 VanDerWaalsContact CD1-CB 3.45Å; I322-A346 HydrophobicContact CG2-CB 4.35Å; I322-L362 HydrophobicContact CG2-CD2 4.15Å; I322-F407 CarbonylContact C-O 3.51Å; I322-F407 WeakPolarHBondContact CA-O 3.29Å; I322-L409 HydrophobicContact CG2-CB 3.97Å
323	H	77.8	Confident	71.9	Confident	39 Å²	39	70.5 Å²	70.5	18%	0.181	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	139.7	177.1	-63.4	-92	0	0	0	109.8	T321 W365 H406 F407 L408 L409	T321-H323 WeakPolarHBondContact CG2-NE2 3.12Å; H323-W365 HydrophobicContact CB-CE3 3.74Å; H323-W365 HydrophobicContact CB-CH2 4.44Å; H323-W365 HydrophobicContact CB-CZ3 3.53Å; H323-W365 AromaticContact CD2-CD2 3.92Å; H323-W365 AromaticContact CD2-CE3 3.64Å; H323-W365 AromaticContact CG-CE3 3.57Å; H323-W365 AromaticContact CG-CZ3 3.55Å; H323-W365 AromaticContact ND1-CZ3 3.93Å; H323-H406 AromaticContact NE2-CE1 3.43Å; H323-H406 PolarHBondContact NE2-CE1 2.88Å; H323-H406 AromaticContact NE2-CG 3.36Å; H323-H406 AromaticContact NE2-ND1 2.5Å; H323-H406 PolarHBondContact NE2-ND1 2.98Å; H323-F407 PolarHBondContact N-O 2.69Å; H323-L408 HydrophobicContact CB-CD1 4.17Å; H323-L408 WeakPolarHBondContact O-CA 3.49Å; H323-L409 PolarHBondContact O-N 3.2Å
324	M	75.9	Confident	73.8	Confident	24 Å²	24	63.2 Å²	63.2	12%	0.118	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	166.8	175.3	-32.2	-175.1	-167.9	0	0	109.6	I322 Q326 G327 A346 R350 L352 L409	I322-M324 HydrophobicContact CG2-CE 3.96Å; I322-M324 HydrophobicContact CG2-CG 4.4Å; M324-Q326 PolarHBondContact O-N 3.06Å; M324-G327 PolarHBondContact N-O 3.12Å; M324-G327 VanDerWaalsContact N-O 3.11Å; M324-G327 PolarHBondContact O-N 3.38Å; M324-A346 HydrophobicContact CE-CB 4.23Å; M324-R350 HydrophobicContact CE-CG 4.13Å; M324-R350 PolarHBondContact SD-NH1 3.49Å; M324-L352 HydrophobicContact SD-CD1 4.02Å; M324-L409 HydrophobicContact CB-CB 4.37Å; M324-L409 HydrophobicContact CE-CD2 3.92Å; M324-L409 HydrophobicContact CG-CB 3.74Å; M324-L409 HydrophobicContact CG-CD2 4.19Å; M324-L409 HydrophobicContact SD-CB 4.11Å; M324-L409 HydrophobicContact SD-CD2 3.4Å; M324-L409 WeakPolarHBondContact SD-CD2 3.37Å; M324-L409 HydrophobicContact SD-CG 4.38Å
325	A	67.8	Low	75.3	Confident	102 Å²	102	56.1 Å²	56.1	84%	0.843	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.8	176.5	0	0	0	0	0	115.2
326	Q	69.9	Low	76.5	Confident	150 Å²	150	57 Å²	57	70%	0.701	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	16	176.1	-65.5	174.8	-22.4	0	0	112.7	M324	M324-Q326 PolarHBondContact O-N 3.06Å
327	G	74.2	Confident	77.6	Confident	23 Å²	23	54.5 Å²	54.5	24%	0.237	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.5	-173	-177.3	0	0	0	0	0	113.6	M324 R350	M324-G327 PolarHBondContact N-O 3.12Å; M324-G327 VanDerWaalsContact N-O 3.11Å; M324-G327 PolarHBondContact O-N 3.38Å; G327-R350 PolarHBondContact O-NH1 3.01Å; G327-R350 PolarHBondContact O-NH2 3.45Å
328	M	81	Confident	78.4	Confident	114 Å²	114	52 Å²	52	56%	0.562	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	147	-174.1	72.3	179.8	75.7	0	0	114.6	T321 I322 R350	T321-M328 HydrophobicContact CG2-CB 4.33Å; T321-M328 HydrophobicContact CG2-SD 4.36Å; I322-M328 CarbonylContact O-C 3.56Å; I322-M328 WeakPolarHBondContact O-CA 3.35Å; M328-R350 PolarHBondContact O-NH2 2.9Å
329	S	79.4	Confident	78.7	Confident	7 Å²	7	50.2 Å²	50.2	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.2	174.8	-175	0	0	0	0	108.8	I322	I322-S329 PolarHBondContact N-O 3.14Å; I322-S329 PolarHBondContact O-N 3.49Å
330	V	83.3	Confident	78.8	Confident	63 Å²	63	47.2 Å²	47.2	38%	0.382	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.1	176.5	-176	0	0	0	0	108.2	L319 V320 T321 R349	L319-V330 HydrophobicContact CB-CG1 4.28Å; L319-V330 HydrophobicContact CD2-CG1 3.96Å; V320-V330 WeakPolarHBondContact O-CA 3.44Å; T321-V330 HydrophobicContact CG2-CG2 4.2Å; V330-R349 PolarHBondContact O-NH1 3.16Å
331	L	80.7	Confident	78.8	Confident	19 Å²	19	49.6 Å²	49.6	10%	0.099	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.7	-174.8	-75.5	170.5	0	0	0	110.4	V320 I322 F333 R345 A346	V320-L331 PolarHBondContact N-O 3.29Å; V320-L331 PolarHBondContact O-N 2.7Å; I322-L331 HydrophobicContact CD1-CD1 3.92Å; L331-F333 HydrophobicContact CB-CD2 4.07Å; L331-F333 HydrophobicContact CB-CE2 3.34Å; L331-F333 HydrophobicContact CB-CZ 3.94Å; L331-F333 HydrophobicContact CD1-CE2 3.97Å; L331-F333 HydrophobicContact CD1-CZ 3.9Å; L331-F333 HydrophobicContact CG-CE2 4.27Å; L331-F333 HydrophobicContact CG-CZ 4.48Å; L331-R345 HydrophobicContact CD1-CB 4.27Å; L331-A346 HydrophobicContact CD1-CB 4.23Å
332	R	81.6	Confident	78.8	Confident	160 Å²	160	48.8 Å²	48.8	60%	0.604	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.7	178.8	-168.8	175.8	-176.6	-168.7	-1.9	110.2	H317	H317-R332 HydrophobicContact CB-CG 3.92Å; H317-R332 VanDerWaalsContact CB-NE 3.31Å
333	F	80	Confident	78.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.7	179.4	-66.1	-82.8	0	0	0	111	H317 V318 V320 L331 T337 V342 R345 L395	H317-F333 CarbonylContact C-O 3.48Å; H317-F333 WeakPolarHBondContact CA-O 3.19Å; V318-F333 PolarHBondContact N-O 3.03Å; V318-F333 PolarHBondContact O-N 2.93Å; V318-F333 VanDerWaalsContact O-N 3.07Å; V320-F333 HydrophobicContact CB-CD2 3.93Å; V320-F333 HydrophobicContact CB-CE2 4.19Å; V320-F333 HydrophobicContact CG2-CD2 3.76Å; V320-F333 HydrophobicContact CG2-CE2 4.46Å; L331-F333 HydrophobicContact CB-CD2 4.07Å; L331-F333 HydrophobicContact CB-CE2 3.34Å; L331-F333 HydrophobicContact CB-CZ 3.94Å; L331-F333 HydrophobicContact CD1-CE2 3.97Å; L331-F333 HydrophobicContact CD1-CZ 3.9Å; L331-F333 HydrophobicContact CG-CE2 4.27Å; L331-F333 HydrophobicContact CG-CZ 4.48Å; F333-T337 HydrophobicContact CD1-CG2 3.81Å; F333-T337 HydrophobicContact CE1-CG2 4.42Å; F333-T337 HydrophobicContact CG-CG2 4.49Å; F333-V342 HydrophobicContact CD1-CG2 4.16Å; F333-V342 HydrophobicContact CD2-CG2 4.01Å; F333-V342 HydrophobicContact CE1-CB 4.46Å; F333-V342 HydrophobicContact CE1-CG2 4.03Å; F333-V342 HydrophobicContact CE2-CB 4.16Å; F333-V342 HydrophobicContact CE2-CG1 3.82Å; F333-V342 HydrophobicContact CE2-CG2 3.88Å; F333-V342 HydrophobicContact CG-CG2 4.13Å; F333-V342 HydrophobicContact CZ-CB 4.02Å; F333-V342 HydrophobicContact CZ-CG1 4.06Å; F333-V342 HydrophobicContact CZ-CG2 3.91Å; F333-R345 HydrophobicContact CE1-CB 4.13Å; F333-R345 HydrophobicContact CE1-CG 4.13Å; F333-R345 HydrophobicContact CZ-CB 3.94Å; F333-R345 HydrophobicContact CZ-CG 4.43Å; F333-L395 HydrophobicContact CB-CD1 3.43Å; F333-L395 VanDerWaalsContact CB-CD1 3.43Å; F333-L395 HydrophobicContact CD2-CD1 4.32Å; F333-L395 HydrophobicContact CG-CD1 4.05Å
334	P	80.6	Confident	79.2	Confident	31 Å²	31	54 Å²	54	20%	0.201	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	146.8	166.4	28.9	-31.8	0	0	0	110.5	I315 D336 T337	I315-P334 HydrophobicContact CG2-CB 3.28Å; P334-D336 VanDerWaalsContact CB-OD1 3.31Å; P334-D336 WeakPolarHBondContact CB-OD1 3.4Å; P334-D336 WeakPolarHBondContact CG-OD1 3.34Å; P334-D336 PolarHBondContact O-N 3.16Å; P334-T337 VanDerWaalsContact CD-OG1 3.22Å; P334-T337 WeakPolarHBondContact CD-OG1 3.44Å; P334-T337 VanDerWaalsContact CG-OG1 3.27Å; P334-T337 WeakPolarHBondContact CG-OG1 3.27Å; P334-T337 WeakPolarHBondContact O-CB 3.46Å; P334-T337 PolarHBondContact O-N 3.11Å; P334-T337 PolarHBondContact O-OG1 3.49Å
335	S	72.2	Confident	79.4	Confident	30 Å²	30	58.7 Å²	58.7	21%	0.21	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.5	-170.5	53.9	0	0	0	0	115.6	S316 S396	S316-S335 WeakPolarHBondContact O-CB 3.48Å; S316-S335 PolarHBondContact O-N 3.25Å; S335-S396 WeakPolarHBondContact O-CA 3.24Å; S335-S396 VanDerWaalsContact O-CB 3.29Å; S335-S396 WeakPolarHBondContact O-CB 3.38Å; S335-S396 PolarHBondContact O-N 3.26Å
336	D	77.1	Confident	80.1	Confident	99 Å²	99	53.9 Å²	53.9	53%	0.529	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.8	176.7	56.1	-7.4	0	0	0	114.1	P334	P334-D336 VanDerWaalsContact CB-OD1 3.31Å; P334-D336 WeakPolarHBondContact CB-OD1 3.4Å; P334-D336 WeakPolarHBondContact CG-OD1 3.34Å; P334-D336 PolarHBondContact O-N 3.16Å
337	T	79.4	Confident	80.7	Confident	19 Å²	19	47 Å²	47	12%	0.117	25%	0.245	C	C	.	.			trans	-66.3	133.6	-177.3	-54.5	0	0	0	0	112.2	F333 P334 T341 V342 P394 L395	F333-T337 HydrophobicContact CD1-CG2 3.81Å; F333-T337 HydrophobicContact CE1-CG2 4.42Å; F333-T337 HydrophobicContact CG-CG2 4.49Å; P334-T337 VanDerWaalsContact CD-OG1 3.22Å; P334-T337 WeakPolarHBondContact CD-OG1 3.44Å; P334-T337 VanDerWaalsContact CG-OG1 3.27Å; P334-T337 WeakPolarHBondContact CG-OG1 3.27Å; P334-T337 WeakPolarHBondContact O-CB 3.46Å; P334-T337 PolarHBondContact O-N 3.11Å; P334-T337 PolarHBondContact O-OG1 3.49Å; T337-T341 HydrophobicContact CG2-CG2 3.92Å; T337-V342 HydrophobicContact CG2-CG2 4.34Å; T337-P394 CarbonylContact O-C 3.45Å; T337-P394 VanDerWaalsContact O-CA 3.31Å; T337-P394 WeakPolarHBondContact O-CA 3.36Å; T337-L395 WeakPolarHBondContact O-CG 3.33Å; T337-L395 PolarHBondContact O-N 2.91Å
338	C	82.6	Confident	81	Confident	45 Å²	45	51 Å²	51	30%	0.304	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-73.1	149.4	173.5	-61.7	0	0	0	0	112.7	S340 T341 V342	C338-S340 PolarHBondContact O-N 3.06Å; C338-T341 PolarHBondContact O-N 3.25Å; C338-T341 VanDerWaalsContact O-N 3.12Å; C338-V342 PolarHBondContact O-N 3.15Å
339	L	81.7	Confident	80.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.1	-24.1	177.7	-76.8	-177.8	0	0	0	114.3	V342 L343 L362 L389 L391 K393 L395 F398 F407	L339-V342 HydrophobicContact CD2-CB 4.35Å; L339-V342 HydrophobicContact CD2-CG2 4.3Å; L339-V342 WeakPolarHBondContact O-CB 3.44Å; L339-V342 PolarHBondContact O-N 2.96Å; L339-L343 WeakPolarHBondContact O-CB 3.5Å; L339-L343 PolarHBondContact O-N 3.34Å; L339-L362 HydrophobicContact CB-CD1 4.49Å; L339-L362 HydrophobicContact CD2-CD1 4.23Å; L339-L389 HydrophobicContact CD1-CB 4.08Å; L339-L389 HydrophobicContact CD1-CD1 4.15Å; L339-L389 HydrophobicContact CD1-CD2 3.95Å; L339-L389 HydrophobicContact CD1-CG 4.32Å; L339-L391 HydrophobicContact CB-CD2 4.24Å; L339-L391 PolarHBondContact N-O 3.32Å; L339-K393 PolarHBondContact N-O 3.44Å; L339-L395 HydrophobicContact CD2-CD2 3.92Å; L339-F398 HydrophobicContact CD1-CD2 4.48Å; L339-F398 HydrophobicContact CD1-CE1 4.49Å; L339-F398 HydrophobicContact CD1-CE2 3.47Å; L339-F398 VanDerWaalsContact CD1-CE2 3.47Å; L339-F398 HydrophobicContact CD1-CZ 3.5Å; L339-F398 VanDerWaalsContact CD1-CZ 3.5Å; L339-F398 HydrophobicContact CD2-CE2 4.45Å; L339-F398 HydrophobicContact CG-CE2 3.96Å; L339-F398 HydrophobicContact CG-CZ 4.46Å; L339-F407 HydrophobicContact CD1-CE1 4.42Å; L339-F407 HydrophobicContact CD2-CE1 4.01Å; L339-F407 HydrophobicContact CD2-CE2 3.97Å; L339-F407 HydrophobicContact CD2-CZ 3.63Å
340	S	82	Confident	80.5	Confident	50 Å²	50	54.2 Å²	54.2	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-55.3	-50.4	169.6	51.5	0	0	0	0	112.4	C338 V342 L343 E344 L391	C338-S340 PolarHBondContact O-N 3.06Å; S340-V342 VanDerWaalsContact C-N 3.28Å; S340-V342 PolarHBondContact O-N 3.06Å; S340-L343 WeakPolarHBondContact O-CB 3.4Å; S340-L343 PolarHBondContact O-N 3.03Å; S340-E344 WeakPolarHBondContact O-CB 3.21Å; S340-E344 PolarHBondContact O-N 2.96Å; S340-L391 PolarHBondContact N-O 3.34Å
341	T	81.9	Confident	79.8	Confident	50 Å²	50	60.3 Å²	60.3	31%	0.307	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-29.4	178.2	-49	0	0	0	0	111.9	T337 C338 R345	T337-T341 HydrophobicContact CG2-CG2 3.92Å; C338-T341 PolarHBondContact O-N 3.25Å; C338-T341 VanDerWaalsContact O-N 3.12Å; T341-R345 WeakPolarHBondContact O-CB 3.42Å; T341-R345 PolarHBondContact O-N 3.46Å
342	V	83.6	Confident	79.4	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-46.8	172.7	177.6	0	0	0	0	111	V320 I322 F333 T337 C338 L339 S340 A346 L362 L395	V320-V342 HydrophobicContact CG1-CG1 3.97Å; I322-V342 HydrophobicContact CD1-CG1 3.7Å; F333-V342 HydrophobicContact CD1-CG2 4.16Å; F333-V342 HydrophobicContact CD2-CG2 4.01Å; F333-V342 HydrophobicContact CE1-CB 4.46Å; F333-V342 HydrophobicContact CE1-CG2 4.03Å; F333-V342 HydrophobicContact CE2-CB 4.16Å; F333-V342 HydrophobicContact CE2-CG1 3.82Å; F333-V342 HydrophobicContact CE2-CG2 3.88Å; F333-V342 HydrophobicContact CG-CG2 4.13Å; F333-V342 HydrophobicContact CZ-CB 4.02Å; F333-V342 HydrophobicContact CZ-CG1 4.06Å; F333-V342 HydrophobicContact CZ-CG2 3.91Å; T337-V342 HydrophobicContact CG2-CG2 4.34Å; C338-V342 PolarHBondContact O-N 3.15Å; L339-V342 HydrophobicContact CD2-CB 4.35Å; L339-V342 HydrophobicContact CD2-CG2 4.3Å; L339-V342 WeakPolarHBondContact O-CB 3.44Å; L339-V342 PolarHBondContact O-N 2.96Å; S340-V342 VanDerWaalsContact C-N 3.28Å; S340-V342 PolarHBondContact O-N 3.06Å; V342-A346 VanDerWaalsContact O-CB 3.29Å; V342-A346 WeakPolarHBondContact O-CB 3.39Å; V342-A346 PolarHBondContact O-N 3.12Å; V342-L362 HydrophobicContact CB-CD1 4.22Å; V342-L362 HydrophobicContact CG1-CD1 3.97Å; V342-L395 HydrophobicContact CG2-CD1 4.05Å; V342-L395 HydrophobicContact CG2-CD2 4.27Å; V342-L395 HydrophobicContact CG2-CG 4.3Å
343	L	84.1	Confident	78.7	Confident	21 Å²	21	62.6 Å²	62.6	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-47.8	175.3	170.1	61	0	0	0	111.6	L339 S340 A346 V347 Y360 L362 L391 L409	L339-L343 WeakPolarHBondContact O-CB 3.5Å; L339-L343 PolarHBondContact O-N 3.34Å; S340-L343 WeakPolarHBondContact O-CB 3.4Å; S340-L343 PolarHBondContact O-N 3.03Å; L343-A346 WeakPolarHBondContact O-CB 3.47Å; L343-A346 PolarHBondContact O-N 3.49Å; L343-V347 HydrophobicContact CD1-CG2 4.18Å; L343-V347 WeakPolarHBondContact O-CG2 3.41Å; L343-V347 PolarHBondContact O-N 3.12Å; L343-Y360 WeakPolarHBondContact CD2-O 3.44Å; L343-L362 HydrophobicContact CB-CD1 3.93Å; L343-L362 HydrophobicContact CB-CG 4.04Å; L343-L362 HydrophobicContact CD1-CD2 4.43Å; L343-L362 HydrophobicContact CD1-CG 4.23Å; L343-L391 HydrophobicContact CB-CD2 4.49Å; L343-L391 HydrophobicContact CD2-CD1 4.07Å; L343-L391 HydrophobicContact CD2-CD2 3.98Å; L343-L409 HydrophobicContact CD1-CD1 3.3Å
344	E	83.2	Confident	78.1	Confident	126 Å²	126	68 Å²	68	59%	0.589	31%	0.31	S	S	*	.	H	α-helix	trans	-60.5	-51.9	-179.4	-175.3	172.7	-150.1	0	0	111.9	S340 A346 V347 Y348	S340-E344 WeakPolarHBondContact O-CB 3.21Å; S340-E344 PolarHBondContact O-N 2.96Å; E344-A346 VanDerWaalsContact C-N 3.26Å; E344-A346 PolarHBondContact O-N 2.8Å; E344-V347 PolarHBondContact O-N 3.22Å; E344-Y348 WeakPolarHBondContact O-CB 3.34Å; E344-Y348 PolarHBondContact O-N 3.23Å
345	R	81.4	Confident	76.9	Confident	124 Å²	124	75 Å²	75	47%	0.468	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-33.8	174.5	-78.4	-155.8	-177.7	150.6	-6.7	113	L331 F333 T341 R349	L331-R345 HydrophobicContact CD1-CB 4.27Å; F333-R345 HydrophobicContact CE1-CB 4.13Å; F333-R345 HydrophobicContact CE1-CG 4.13Å; F333-R345 HydrophobicContact CZ-CB 3.94Å; F333-R345 HydrophobicContact CZ-CG 4.43Å; T341-R345 WeakPolarHBondContact O-CB 3.42Å; T341-R345 PolarHBondContact O-N 3.46Å; R345-R349 VanDerWaalsContact O-CB 3.24Å; R345-R349 WeakPolarHBondContact O-CB 3.41Å; R345-R349 PolarHBondContact O-N 2.76Å
346	A	83	Confident	75.7	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-39.4	177.3	0	0	0	0	0	112.6	I322 M324 L331 V342 L343 E344	I322-A346 HydrophobicContact CD1-CB 3.45Å; I322-A346 VanDerWaalsContact CD1-CB 3.45Å; I322-A346 HydrophobicContact CG2-CB 4.35Å; M324-A346 HydrophobicContact CE-CB 4.23Å; L331-A346 HydrophobicContact CD1-CB 4.23Å; V342-A346 VanDerWaalsContact O-CB 3.29Å; V342-A346 WeakPolarHBondContact O-CB 3.39Å; V342-A346 PolarHBondContact O-N 3.12Å; L343-A346 WeakPolarHBondContact O-CB 3.47Å; L343-A346 PolarHBondContact O-N 3.49Å; E344-A346 VanDerWaalsContact C-N 3.26Å; E344-A346 PolarHBondContact O-N 2.8Å
347	V	81.4	Confident	74.7	Confident	5 Å²	5	74.9 Å²	74.9	3%	0.03	37%	0.366	C	S	.	.	H	α-helix	trans	-71.8	-47.4	176.6	167.8	0	0	0	0	110.9	L343 E344 R350 R351 L352 Q354 Y360 L409	L343-V347 HydrophobicContact CD1-CG2 4.18Å; L343-V347 WeakPolarHBondContact O-CG2 3.41Å; L343-V347 PolarHBondContact O-N 3.12Å; E344-V347 PolarHBondContact O-N 3.22Å; V347-R350 CarbonylContact O-C 3.57Å; V347-R350 PolarHBondContact O-N 3Å; V347-R351 PolarHBondContact O-N 2.81Å; V347-L352 HydrophobicContact CG1-CB 3.99Å; V347-L352 HydrophobicContact CG2-CD1 4.28Å; V347-L352 PolarHBondContact O-N 3.35Å; V347-L352 VanDerWaalsContact O-N 3.09Å; V347-Q354 HydrophobicContact CG1-CG 3.74Å; V347-Y360 HydrophobicContact CG2-CD2 4.04Å; V347-Y360 HydrophobicContact CG2-CG 4.03Å; V347-L409 HydrophobicContact CG2-CD2 4.44Å
348	Y	80.2	Confident	74	Confident	108 Å²	108	77.5 Å²	77.5	42%	0.424	37%	0.374	S	S	.	.	H	α-helix	trans	-60.7	-53.1	179.5	173.3	-99.6	0	0	0	112	D271 E344 R350 R351	D271-Y348 PolarHBondContact OD1-OH 3.35Å; D271-Y348 PolarHBondContact OD2-OH 2.94Å; E344-Y348 WeakPolarHBondContact O-CB 3.34Å; E344-Y348 PolarHBondContact O-N 3.23Å; Y348-R350 PolarHBondContact O-N 3.3Å; Y348-R351 PolarHBondContact O-N 2.85Å
349	R	78.1	Confident	73.5	Confident	128 Å²	128	77.4 Å²	77.4	48%	0.483	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22	178.7	-173.1	175.7	-174.2	-163.2	20.5	113.5	V330 R345	V330-R349 PolarHBondContact O-NH1 3.16Å; R345-R349 VanDerWaalsContact O-CB 3.24Å; R345-R349 WeakPolarHBondContact O-CB 3.41Å; R345-R349 PolarHBondContact O-N 2.76Å
350	R	71.3	Confident	73.4	Confident	61 Å²	61	79 Å²	79	23%	0.23	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	7.1	176.9	-72.5	-145.4	177	162	-7.3	114.8	M324 G327 M328 V347 Y348 L352	M324-R350 HydrophobicContact CE-CG 4.13Å; M324-R350 PolarHBondContact SD-NH1 3.49Å; G327-R350 PolarHBondContact O-NH1 3.01Å; G327-R350 PolarHBondContact O-NH2 3.45Å; M328-R350 PolarHBondContact O-NH2 2.9Å; V347-R350 CarbonylContact O-C 3.57Å; V347-R350 PolarHBondContact O-N 3Å; Y348-R350 PolarHBondContact O-N 3.3Å; R350-L352 HydrophobicContact CB-CD1 4.28Å; R350-L352 HydrophobicContact CB-CD2 3.86Å; R350-L352 HydrophobicContact CB-CG 3.73Å; R350-L352 PolarHBondContact O-N 3Å; R350-L352 VanDerWaalsContact O-N 3.12Å
351	R	70.6	Confident	73.3	Confident	191 Å²	191	80 Å²	80	72%	0.721	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	39.5	-178.5	-59.1	-175.5	176.4	-170.4	-2.7	112	D268 V347 Y348	D268-R351 IonicContact OD2-CZ 2.68Å; D268-R351 IonicContact OD2-NH1 3.45Å; D268-R351 PolarHBondContact OD2-NH1 3.4Å; D268-R351 IonicContact OD2-NH2 3.36Å; D268-R351 PolarHBondContact OD2-NH2 3.02Å; V347-R351 PolarHBondContact O-N 2.81Å; Y348-R351 PolarHBondContact O-N 2.85Å
352	L	71.2	Confident	73.3	Confident	28 Å²	28	77.7 Å²	77.7	15%	0.147	37%	0.365	C	S	.	.			trans	-74.3	136	-174.7	-53.8	176.1	0	0	0	111.3	M324 V347 R350 Q354 Y360 L409	M324-L352 HydrophobicContact SD-CD1 4.02Å; V347-L352 HydrophobicContact CG1-CB 3.99Å; V347-L352 HydrophobicContact CG2-CD1 4.28Å; V347-L352 PolarHBondContact O-N 3.35Å; V347-L352 VanDerWaalsContact O-N 3.09Å; R350-L352 HydrophobicContact CB-CD1 4.28Å; R350-L352 HydrophobicContact CB-CD2 3.86Å; R350-L352 HydrophobicContact CB-CG 3.73Å; R350-L352 PolarHBondContact O-N 3Å; R350-L352 VanDerWaalsContact O-N 3.12Å; L352-Q354 PolarHBondContact O-N 3.41Å; L352-Q354 VanDerWaalsContact O-N 3.15Å; L352-Y360 HydrophobicContact CB-CE1 4.24Å; L352-Y360 HydrophobicContact CB-CE2 4.18Å; L352-Y360 HydrophobicContact CD1-CD1 4.33Å; L352-Y360 HydrophobicContact CD1-CE1 3.95Å; L352-L409 HydrophobicContact CD1-CD2 3.4Å
353	R	67.4	Low	73	Confident	198 Å²	198	80.4 Å²	80.4	75%	0.747	38%	0.378	S	S	*	.			trans	-67.5	108.6	-175.6	-68.8	-176.2	171.6	-156.7	-3.6	112.5	Y358 Y360	R353-Y358 WeakPolarHBondContact O-CB 3.47Å; R353-Y360 WeakPolarHBondContact O-CE2 3.34Å; R353-Y360 PolarHBondContact O-OH 3.07Å
354	Q	66.9	Low	72.6	Confident	115 Å²	115	82 Å²	82	54%	0.537	39%	0.386	S	S	.	.			trans	-90.4	-18.6	174.5	-65.9	-179.2	-18.8	0	0	114.3	V347 L352 Y360	V347-Q354 HydrophobicContact CG1-CG 3.74Å; L352-Q354 PolarHBondContact O-N 3.41Å; L352-Q354 VanDerWaalsContact O-N 3.15Å; Q354-Y360 HydrophobicContact CG-CD2 4.48Å; Q354-Y360 HydrophobicContact CG-CE2 4.35Å
355	H	54.5	Low	72.1	Confident	176 Å²	176	80.7 Å²	80.7	82%	0.815	38%	0.376	S	S	*	.	S	Bend	trans	-77.9	138.6	-177.8	-56.2	-59.3	0	0	0	112.9	Y358	H355-Y358 WeakPolarHBondContact O-CD2 3.42Å
356	G	47.5	Very low	71.3	Confident	71 Å²	71	78.9 Å²	78.9	73%	0.732	38%	0.38	S	S	*	.	S	Bend	trans	86.4	49.5	170.9	0	0	0	0	0	115.4	Y358	G356-Y358 PolarHBondContact O-N 3.44Å
357	G	57.2	Low	70	Confident	56 Å²	56	85.2 Å²	85.2	58%	0.577	40%	0.404	S	S	*	.	S	Bend	trans	85.1	0.5	171.7	0	0	0	0	0	115.8	A359 S413	G357-A359 PolarHBondContact O-N 3.27Å; G357-S413 WeakPolarHBondContact O-CB 3.35Å; G357-S413 PolarHBondContact O-OG 3.37Å; G357-S413 VanDerWaalsContact O-OG 3.07Å
358	Y	64	Low	68.1	Low	74 Å²	74	90.7 Å²	90.7	29%	0.29	43%	0.433	S	S	.	.			trans	-90.5	90.7	178.6	-58	-59.4	0	0	0	111.7	R353 H355 G356 R411	R353-Y358 WeakPolarHBondContact O-CB 3.47Å; H355-Y358 WeakPolarHBondContact O-CD2 3.42Å; G356-Y358 PolarHBondContact O-N 3.44Å; Y358-R411 VanDerWaalsContact CD1-NE 3.27Å; Y358-R411 VanDerWaalsContact CE1-CZ 3.4Å; Y358-R411 VanDerWaalsContact CE2-NH2 3.27Å
359	A	72.6	Confident	66.1	Low	44 Å²	44	91.7 Å²	91.7	36%	0.364	45%	0.451	S	S	.	.			trans	-83.4	159.8	165.6	0	0	0	0	0	110.8	G357 E412	G357-A359 PolarHBondContact O-N 3.27Å; A359-E412 HydrophobicContact CB-CB 4.07Å; A359-E412 HydrophobicContact CB-CG 4.19Å; A359-E412 PolarHBondContact O-N 2.99Å
360	Y	78.8	Confident	64.1	Low	32 Å²	32	91 Å²	91	13%	0.125	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	141.7	174.3	-63.7	-91.2	0	0	0	108.7	L343 V347 L352 R353 Q354 L409 V410 R411	L343-Y360 WeakPolarHBondContact CD2-O 3.44Å; V347-Y360 HydrophobicContact CG2-CD2 4.04Å; V347-Y360 HydrophobicContact CG2-CG 4.03Å; L352-Y360 HydrophobicContact CB-CE1 4.24Å; L352-Y360 HydrophobicContact CB-CE2 4.18Å; L352-Y360 HydrophobicContact CD1-CD1 4.33Å; L352-Y360 HydrophobicContact CD1-CE1 3.95Å; R353-Y360 WeakPolarHBondContact O-CE2 3.34Å; R353-Y360 PolarHBondContact O-OH 3.07Å; Q354-Y360 HydrophobicContact CG-CD2 4.48Å; Q354-Y360 HydrophobicContact CG-CE2 4.35Å; Y360-L409 HydrophobicContact CD1-CD2 3.92Å; Y360-L409 HydrophobicContact CD1-CG 4.17Å; Y360-V410 WeakPolarHBondContact CA-O 3.45Å; Y360-R411 HydrophobicContact CD1-CB 4.01Å; Y360-R411 HydrophobicContact CD1-CG 4.17Å; Y360-R411 HydrophobicContact CE1-CB 3.83Å; Y360-R411 HydrophobicContact CE1-CG 3.7Å
361	R	79.8	Confident	62.5	Low	72 Å²	72	97 Å²	97	27%	0.272	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.4	172.5	64.4	167.1	-176.7	-94.3	-0.5	111	E363 V410 E412	R361-E363 IonicContact CZ-OE1 3.66Å; R361-E363 IonicContact NE-OE1 3.82Å; R361-E363 PolarHBondContact NE-OE1 3.13Å; R361-E363 IonicContact NH2-OE1 2.73Å; R361-E363 PolarHBondContact NH2-OE1 3.13Å; R361-V410 HydrophobicContact CG-CB 4.07Å; R361-V410 PolarHBondContact N-O 3.43Å; R361-V410 PolarHBondContact O-N 3.21Å; R361-E412 VanDerWaalsContact CD-OE1 3.24Å; R361-E412 WeakPolarHBondContact CD-OE1 3.42Å; R361-E412 HydrophobicContact CG-CG 4.16Å; R361-E412 IonicContact CZ-OE1 2.77Å; R361-E412 IonicContact NE-OE1 2.72Å; R361-E412 IonicContact NH1-OE1 3.53Å; R361-E412 PolarHBondContact NH1-OE1 3.33Å
362	L	81.7	Confident	60.9	Low	1 Å²	1	96.8 Å²	96.8	1%	0.005	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140.3	167	-63.9	174.6	0	0	0	109.7	I322 L339 V342 L343 L389 F407 L408 L409	I322-L362 HydrophobicContact CG2-CD2 4.15Å; L339-L362 HydrophobicContact CB-CD1 4.49Å; L339-L362 HydrophobicContact CD2-CD1 4.23Å; V342-L362 HydrophobicContact CB-CD1 4.22Å; V342-L362 HydrophobicContact CG1-CD1 3.97Å; L343-L362 HydrophobicContact CB-CD1 3.93Å; L343-L362 HydrophobicContact CB-CG 4.04Å; L343-L362 HydrophobicContact CD1-CD2 4.43Å; L343-L362 HydrophobicContact CD1-CG 4.23Å; L362-L389 HydrophobicContact CB-CD1 3.97Å; L362-F407 HydrophobicContact CD2-CB 4.12Å; L362-L408 CarbonylContact C-O 3.6Å; L362-L408 WeakPolarHBondContact CA-O 3.4Å; L362-L409 HydrophobicContact CD2-CD1 3.78Å
363	E	78.8	Confident	59	Low	58 Å²	58	102.5 Å²	102.5	27%	0.271	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	158.8	167	-68	178.2	-175.2	0	0	109.4	R361 F407 L408 V410	R361-E363 IonicContact CZ-OE1 3.66Å; R361-E363 IonicContact NE-OE1 3.82Å; R361-E363 PolarHBondContact NE-OE1 3.13Å; R361-E363 IonicContact NH2-OE1 2.73Å; R361-E363 PolarHBondContact NH2-OE1 3.13Å; E363-F407 CarbonylContact O-C 3.58Å; E363-F407 WeakPolarHBondContact O-CA 3.33Å; E363-L408 HydrophobicContact CB-CB 4.34Å; E363-L408 PolarHBondContact N-O 3.49Å; E363-L408 PolarHBondContact O-N 2.69Å; E363-V410 HydrophobicContact CG-CG2 4.11Å
364	L	75.5	Confident	57.3	Low	55 Å²	55	99.7 Å²	99.7	29%	0.288	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136.1	174.5	-82	159.1	0	0	0	110.2	L383 L389 F398 F407	L364-L383 HydrophobicContact CD1-CD2 4.17Å; L364-L389 HydrophobicContact CD1-CD2 4.16Å; L364-L389 HydrophobicContact CG-CD1 4.2Å; L364-L389 HydrophobicContact CG-CD2 4.02Å; L364-L389 HydrophobicContact CG-CG 4.38Å; L364-F398 HydrophobicContact CD2-CD1 4.23Å; L364-F398 HydrophobicContact CD2-CE1 4.21Å; L364-F407 HydrophobicContact CD2-CD1 4.39Å; L364-F407 HydrophobicContact CD2-CE1 4.02Å
365	W	72.4	Confident	55.6	Low	98 Å²	98	101.4 Å²	101.4	37%	0.371	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-66.9	132.4	172.3	-174.9	-97.7	0	0	0	110.8	H323 R367 H406 L408	H323-W365 HydrophobicContact CB-CE3 3.74Å; H323-W365 HydrophobicContact CB-CH2 4.44Å; H323-W365 HydrophobicContact CB-CZ3 3.53Å; H323-W365 AromaticContact CD2-CD2 3.92Å; H323-W365 AromaticContact CD2-CE3 3.64Å; H323-W365 AromaticContact CG-CE3 3.57Å; H323-W365 AromaticContact CG-CZ3 3.55Å; H323-W365 AromaticContact ND1-CZ3 3.93Å; W365-R367 PolarHBondContact O-N 3.26Å; W365-H406 HydrophobicContact CB-CB 3.5Å; W365-H406 WeakPolarHBondContact CB-O 3.48Å; W365-H406 HydrophobicContact CG-CB 3.96Å; W365-H406 PolarHBondContact N-O 3.47Å; W365-L408 HydrophobicContact CE3-CB 4.48Å; W365-L408 HydrophobicContact CZ3-CD1 4.24Å
366	P	63.7	Low	54.9	Low	85 Å²	85	100.2 Å²	100.2	55%	0.552	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-58.2	131	177	-24.5	34.4	0	0	0	112
367	R	55.8	Low	54.1	Low	134 Å²	134	107.1 Å²	107.1	51%	0.506	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-77.8	137.3	168.2	-79	-172.8	164.2	172.6	-1.8	109.9	W365 T369 G402 P404	W365-R367 PolarHBondContact O-N 3.26Å; R367-T369 PolarHBondContact O-N 2.79Å; R367-T369 VanDerWaalsContact O-N 3.15Å; R367-G402 PolarHBondContact NH2-O 3.18Å; R367-P404 HydrophobicContact CG-CG 4.07Å
368	N	41.5	Very low	53	Low	119 Å²	119	108.4 Å²	108.4	64%	0.636	55%	0.546	S	S	*	.			trans	-67.1	108	166.1	-167.6	-30.2	0	0	0	108.7	D370	N368-D370 PolarHBondContact O-N 3.11Å; N368-D370 VanDerWaalsContact O-N 3.14Å
369	T	37.9	Very low	51.3	Low	129 Å²	129	111.6 Å²	111.6	79%	0.791	57%	0.568	S	S	*	*			trans	-87.3	62.4	-170	41.1	0	0	0	0	113.2	R367	R367-T369 PolarHBondContact O-N 2.79Å; R367-T369 VanDerWaalsContact O-N 3.15Å
370	D	36.9	Very low	49.5	Very low	115 Å²	115	117.7 Å²	117.7	62%	0.615	60%	0.595	S	S	*	*	S	Bend	trans	-121.1	4.3	177.4	-85.2	-27.3	0	0	0	114.7	N368	N368-D370 PolarHBondContact O-N 3.11Å; N368-D370 VanDerWaalsContact O-N 3.14Å
371	Q	37.5	Very low	47.2	Very low	187 Å²	187	123.2 Å²	123.2	87%	0.874	62%	0.624	S	S	*	*	S	Bend	trans	-129.6	12.4	-175.1	-69.1	-164.2	-4.7	0	0	117.6
372	Q	37.6	Very low	45	Very low	186 Å²	186	126.5 Å²	126.5	87%	0.869	65%	0.647	S	S	*	*			trans	-135.5	71.1	167.2	-79.4	-165.5	-26.5	0	0	112.1
373	N	30.2	Very low	43	Very low	148 Å²	148	130.8 Å²	130.8	79%	0.791	67%	0.669	S	S	*	*			trans	-108.2	138.2	155.2	-149.2	-5.9	0	0	0	108
374	N	32.9	Very low	40.9	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	69%	0.686	S	S	*	*	S	Bend	trans	84.7	115.8	-169.2	-48.5	-45.2	0	0	0	116.8
375	N	31.2	Very low	39.4	Very low	151 Å²	151	139.3 Å²	139.3	81%	0.807	71%	0.709	S	S	*	*			trans	67.5	86	158.7	-55.8	-25.8	0	0	0	118.9
376	I	40.3	Very low	37.9	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	72%	0.719	S	S	*	*				-155.3	115.4	117.1	-88.3	135.7	0	0	0	107.9
377	K	29.9	Very low	37.2	Very low	216 Å²	216	138.8 Å²	138.8	94%	0.939	71%	0.713	S	S	*	*			trans	-98.1	85.8	167.6	-75.3	-178.3	178.2	177.3	0	109
378	S	33.7	Very low	37.2	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	72%	0.72	S	S	*	*			trans	-172.5	130.3	159.1	36.3	0	0	0	0	113.1
379	N	28.4	Very low	38.2	Very low	141 Å²	141	133.7 Å²	133.7	75%	0.754	69%	0.692	S	S	*	*			trans	51.3	78.8	144.7	-53.5	-8.7	0	0	0	118.4
380	N	34.8	Very low	39.4	Very low	172 Å²	172	131.2 Å²	131.2	92%	0.92	67%	0.674	S	S	*	*			trans	-151.2	85.8	137.1	-94.9	-36.2	0	0	0	109.7
381	I	31.4	Very low	40.9	Very low	147 Å²	147	128.3 Å²	128.3	75%	0.754	66%	0.658	S	S	*	*			trans	-74.1	136.5	175.4	-69.3	166.1	0	0	0	108.4
382	L	33.9	Very low	42.3	Very low	141 Å²	141	123.1 Å²	123.1	74%	0.738	64%	0.643	S	S	*	*			trans	64.4	74.4	168.4	-64.8	162.5	0	0	0	118
383	L	39.9	Very low	44.1	Very low	92 Å²	92	117.1 Å²	117.1	48%	0.482	61%	0.613	S	S	.	*				-104.1	106.8	123.2	-100.5	82.8	0	0	0	107	L364	L364-L383 HydrophobicContact CD1-CD2 4.17Å
384	N	34.1	Very low	46.5	Very low	117 Å²	117	112 Å²	112	63%	0.626	59%	0.588	S	S	*	*			trans	-68.8	138	-179.1	-157.3	1.3	0	0	0	108.7	N386 S387	N384-N386 PolarHBondContact O-N 2.93Å; N384-S387 WeakPolarHBondContact O-CB 3.36Å; N384-S387 PolarHBondContact O-N 2.96Å; N384-S387 PolarHBondContact O-OG 3.12Å; N384-S387 VanDerWaalsContact O-OG 3.06Å
385	K	43.4	Very low	48.6	Very low	174 Å²	174	105.4 Å²	105.4	76%	0.757	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-7.7	-162	-69.3	-178.7	177.7	179.1	0	116
386	N	41.7	Very low	50.7	Low	109 Å²	109	100.7 Å²	100.7	58%	0.583	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	13.7	176.7	-59	-13.6	0	0	0	112.8	N384 Q388	N384-N386 PolarHBondContact O-N 2.93Å; N386-Q388 PolarHBondContact O-N 3.09Å
387	S	48.5	Very low	52.5	Low	63 Å²	63	97.9 Å²	97.9	44%	0.441	51%	0.512	S	S	.	.			trans	-74.2	111.3	-177.3	64.5	0	0	0	0	111.1	N384 L389	N384-S387 WeakPolarHBondContact O-CB 3.36Å; N384-S387 PolarHBondContact O-N 2.96Å; N384-S387 PolarHBondContact O-OG 3.12Å; N384-S387 VanDerWaalsContact O-OG 3.06Å; S387-L389 PolarHBondContact O-N 3.1Å
388	Q	54.7	Low	54.6	Low	136 Å²	136	87.7 Å²	87.7	64%	0.636	47%	0.468	S	S	*	.			trans	-32.6	125.9	162.5	-178.9	178.1	6	0	0	110.7	N386 D390	N386-Q388 PolarHBondContact O-N 3.09Å; Q388-D390 PolarHBondContact O-N 2.82Å; Q388-D390 VanDerWaalsContact O-N 3.11Å
389	L	63.8	Low	56.6	Low	11 Å²	11	87.4 Å²	87.4	6%	0.058	46%	0.459	C	S	.	.			trans	-59.4	120.7	175.8	-87	170.3	0	0	0	108.9	L339 L362 L364 S387 L391 F398 F407	L339-L389 HydrophobicContact CD1-CB 4.08Å; L339-L389 HydrophobicContact CD1-CD1 4.15Å; L339-L389 HydrophobicContact CD1-CD2 3.95Å; L339-L389 HydrophobicContact CD1-CG 4.32Å; L362-L389 HydrophobicContact CB-CD1 3.97Å; L364-L389 HydrophobicContact CD1-CD2 4.16Å; L364-L389 HydrophobicContact CG-CD1 4.2Å; L364-L389 HydrophobicContact CG-CD2 4.02Å; L364-L389 HydrophobicContact CG-CG 4.38Å; S387-L389 PolarHBondContact O-N 3.1Å; L389-L391 PolarHBondContact O-N 3.04Å; L389-F398 HydrophobicContact CD2-CE1 3.6Å; L389-F398 HydrophobicContact CD2-CZ 3.57Å; L389-F407 HydrophobicContact CD1-CD1 3.52Å; L389-F407 HydrophobicContact CD1-CE1 3.76Å
390	D	63.4	Low	58.6	Low	76 Å²	76	85 Å²	85	41%	0.406	46%	0.459	S	S	.	.			trans	-63.1	102.7	174.5	177.3	3.1	0	0	0	109	Q388 S392 K393	Q388-D390 PolarHBondContact O-N 2.82Å; Q388-D390 VanDerWaalsContact O-N 3.11Å; D390-S392 VanDerWaalsContact CG-OG 3.23Å; D390-S392 PolarHBondContact O-N 2.98Å; D390-S392 VanDerWaalsContact O-N 3.09Å; D390-S392 WeakPolarHBondContact OD1-CB 3.38Å; D390-S392 PolarHBondContact OD1-N 2.82Å; D390-S392 VanDerWaalsContact OD1-N 3.11Å; D390-S392 PolarHBondContact OD1-OG 2.79Å; D390-S392 PolarHBondContact OD2-OG 2.85Å; D390-K393 HydrophobicContact CB-CD 4.09Å; D390-K393 HydrophobicContact CB-CG 4.03Å; D390-K393 WeakPolarHBondContact O-CB 3.43Å; D390-K393 PolarHBondContact O-N 3.15Å; D390-K393 WeakPolarHBondContact OD2-CE 3.33Å
391	L	67.5	Low	60.3	Low	54 Å²	54	79.5 Å²	79.5	28%	0.283	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.4	-175.2	-66	172.2	0	0	0	112.6	L339 S340 L343 L389 K393	L339-L391 HydrophobicContact CB-CD2 4.24Å; L339-L391 PolarHBondContact N-O 3.32Å; S340-L391 PolarHBondContact N-O 3.34Å; L343-L391 HydrophobicContact CB-CD2 4.49Å; L343-L391 HydrophobicContact CD2-CD1 4.07Å; L343-L391 HydrophobicContact CD2-CD2 3.98Å; L389-L391 PolarHBondContact O-N 3.04Å; L391-K393 VanDerWaalsContact C-N 3.32Å
392	S	67.7	Low	62	Low	79 Å²	79	74.6 Å²	74.6	55%	0.552	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-13.9	174.8	76.4	0	0	0	0	113.7	D390	D390-S392 VanDerWaalsContact CG-OG 3.23Å; D390-S392 PolarHBondContact O-N 2.98Å; D390-S392 VanDerWaalsContact O-N 3.09Å; D390-S392 WeakPolarHBondContact OD1-CB 3.38Å; D390-S392 PolarHBondContact OD1-N 2.82Å; D390-S392 VanDerWaalsContact OD1-N 3.11Å; D390-S392 PolarHBondContact OD1-OG 2.79Å; D390-S392 PolarHBondContact OD2-OG 2.85Å
393	K	74.1	Confident	63.6	Low	59 Å²	59	70.2 Å²	70.2	26%	0.257	40%	0.4	S	S	.	.	S	Bend	trans	-77.1	133.9	-177.4	-68.5	-173.3	178.2	-177.2	0	112	L339 D390 L391 Y397 F398	L339-K393 PolarHBondContact N-O 3.44Å; D390-K393 HydrophobicContact CB-CD 4.09Å; D390-K393 HydrophobicContact CB-CG 4.03Å; D390-K393 WeakPolarHBondContact O-CB 3.43Å; D390-K393 PolarHBondContact O-N 3.15Å; D390-K393 WeakPolarHBondContact OD2-CE 3.33Å; L391-K393 VanDerWaalsContact C-N 3.32Å; K393-Y397 HydrophobicContact CD-CD1 3.8Å; K393-Y397 HydrophobicContact CD-CE1 3.84Å; K393-Y397 HydrophobicContact CD-CG 4.23Å; K393-Y397 PolarHBondContact NZ-OH 3.09Å; K393-F398 HydrophobicContact CB-CE2 4.1Å
394	P	80.4	Confident	65.2	Low	41 Å²	41	67.3 Å²	67.3	27%	0.266	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-74.6	154.9	173.7	31.8	-35.9	0	0	0	111.8	T337 S396 Y397	T337-P394 CarbonylContact O-C 3.45Å; T337-P394 VanDerWaalsContact O-CA 3.31Å; T337-P394 WeakPolarHBondContact O-CA 3.36Å; P394-S396 WeakPolarHBondContact CG-OG 3.43Å; P394-S396 PolarHBondContact O-N 3.38Å; P394-S396 VanDerWaalsContact O-N 3.15Å; P394-Y397 VanDerWaalsContact O-CB 3.31Å; P394-Y397 WeakPolarHBondContact O-CB 3.47Å; P394-Y397 PolarHBondContact O-N 3.11Å
395	L	77.3	Confident	67.3	Low	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-56.5	-29.5	175.7	-71.1	169.8	0	0	0	113	V320 F333 T337 L339 V342 Y397 F398 I399 L405 F407	V320-L395 HydrophobicContact CG2-CD1 3.84Å; V320-L395 HydrophobicContact CG2-CD2 3.9Å; F333-L395 HydrophobicContact CB-CD1 3.43Å; F333-L395 VanDerWaalsContact CB-CD1 3.43Å; F333-L395 HydrophobicContact CD2-CD1 4.32Å; F333-L395 HydrophobicContact CG-CD1 4.05Å; T337-L395 WeakPolarHBondContact O-CG 3.33Å; T337-L395 PolarHBondContact O-N 2.91Å; L339-L395 HydrophobicContact CD2-CD2 3.92Å; V342-L395 HydrophobicContact CG2-CD1 4.05Å; V342-L395 HydrophobicContact CG2-CD2 4.27Å; V342-L395 HydrophobicContact CG2-CG 4.3Å; L395-Y397 PolarHBondContact O-N 2.94Å; L395-F398 PolarHBondContact O-N 2.6Å; L395-I399 WeakPolarHBondContact O-CG1 3.39Å; L395-I399 PolarHBondContact O-N 2.78Å; L395-I399 VanDerWaalsContact O-N 3.07Å; L395-L405 HydrophobicContact CD2-CD2 4.1Å; L395-F407 HydrophobicContact CD2-CE2 4.15Å; L395-F407 HydrophobicContact CD2-CZ 4.32Å
396	S	76	Confident	69	Low	52 Å²	52	57.6 Å²	57.6	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-55.1	-30.9	173	59.8	0	0	0	0	113.6	S335 P394 A400	S335-S396 WeakPolarHBondContact O-CA 3.24Å; S335-S396 VanDerWaalsContact O-CB 3.29Å; S335-S396 WeakPolarHBondContact O-CB 3.38Å; S335-S396 PolarHBondContact O-N 3.26Å; P394-S396 WeakPolarHBondContact CG-OG 3.43Å; P394-S396 PolarHBondContact O-N 3.38Å; P394-S396 VanDerWaalsContact O-N 3.15Å; S396-A400 WeakPolarHBondContact O-CB 3.27Å; S396-A400 PolarHBondContact O-N 3.05Å
397	Y	77.9	Confident	71	Confident	92 Å²	92	52.4 Å²	52.4	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-41	174	179	-99.4	0	0	0	111.8	K393 P394 L395 A401	K393-Y397 HydrophobicContact CD-CD1 3.8Å; K393-Y397 HydrophobicContact CD-CE1 3.84Å; K393-Y397 HydrophobicContact CD-CG 4.23Å; K393-Y397 PolarHBondContact NZ-OH 3.09Å; P394-Y397 VanDerWaalsContact O-CB 3.31Å; P394-Y397 WeakPolarHBondContact O-CB 3.47Å; P394-Y397 PolarHBondContact O-N 3.11Å; L395-Y397 PolarHBondContact O-N 2.94Å; Y397-A401 WeakPolarHBondContact O-CB 3.21Å; Y397-A401 PolarHBondContact O-N 3.11Å
398	F	75	Confident	72.6	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-72.4	-37.3	179.7	-63.7	-86.7	0	0	0	111.7	L339 L364 L389 K393 L395 A401 G402 L403 L405 F407	L339-F398 HydrophobicContact CD1-CD2 4.48Å; L339-F398 HydrophobicContact CD1-CE1 4.49Å; L339-F398 HydrophobicContact CD1-CE2 3.47Å; L339-F398 VanDerWaalsContact CD1-CE2 3.47Å; L339-F398 HydrophobicContact CD1-CZ 3.5Å; L339-F398 VanDerWaalsContact CD1-CZ 3.5Å; L339-F398 HydrophobicContact CD2-CE2 4.45Å; L339-F398 HydrophobicContact CG-CE2 3.96Å; L339-F398 HydrophobicContact CG-CZ 4.46Å; L364-F398 HydrophobicContact CD2-CD1 4.23Å; L364-F398 HydrophobicContact CD2-CE1 4.21Å; L389-F398 HydrophobicContact CD2-CE1 3.6Å; L389-F398 HydrophobicContact CD2-CZ 3.57Å; K393-F398 HydrophobicContact CB-CE2 4.1Å; L395-F398 PolarHBondContact O-N 2.6Å; F398-A401 PolarHBondContact O-N 3.27Å; F398-G402 PolarHBondContact O-N 3.16Å; F398-G402 VanDerWaalsContact O-N 3.16Å; F398-L403 HydrophobicContact CB-CB 4.39Å; F398-L403 HydrophobicContact CD1-CB 4.3Å; F398-L403 HydrophobicContact CD1-CD1 3.8Å; F398-L403 HydrophobicContact CE1-CD1 4.27Å; F398-L403 PolarHBondContact O-N 3.19Å; F398-L405 HydrophobicContact CB-CD2 3.74Å; F398-F407 HydrophobicContact CD1-CE1 4.41Å; F398-F407 HydrophobicContact CD1-CZ 4.47Å; F398-F407 HydrophobicContact CE1-CE1 4.4Å; F398-F407 HydrophobicContact CG-CZ 4.42Å
399	I	74.2	Confident	73.9	Confident	77 Å²	77	46.1 Å²	46.1	40%	0.395	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-47.7	173.4	-61	159.8	0	0	0	110.1	V318 L395 A401 G402 L405	V318-I399 HydrophobicContact CG2-CD1 3.68Å; L395-I399 WeakPolarHBondContact O-CG1 3.39Å; L395-I399 PolarHBondContact O-N 2.78Å; L395-I399 VanDerWaalsContact O-N 3.07Å; I399-A401 VanDerWaalsContact C-N 3.34Å; I399-A401 PolarHBondContact O-N 2.85Å; I399-G402 PolarHBondContact O-N 3.08Å; I399-L405 HydrophobicContact CG1-CD1 4.1Å
400	A	71.7	Confident	74.6	Confident	92 Å²	92	47.2 Å²	47.2	76%	0.76	29%	0.285	S	S	*	.	H	α-helix	trans	-66.1	-33.7	177.8	0	0	0	0	0	113.2	S396 G402	S396-A400 WeakPolarHBondContact O-CB 3.27Å; S396-A400 PolarHBondContact O-N 3.05Å; A400-G402 PolarHBondContact O-N 3.12Å
401	A	68.8	Low	75.2	Confident	55 Å²	55	47.8 Å²	47.8	46%	0.455	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.1	172.3	0	0	0	0	0	113.5	Y397 F398 I399 L403	Y397-A401 WeakPolarHBondContact O-CB 3.21Å; Y397-A401 PolarHBondContact O-N 3.11Å; F398-A401 PolarHBondContact O-N 3.27Å; I399-A401 VanDerWaalsContact C-N 3.34Å; I399-A401 PolarHBondContact O-N 2.85Å; A401-L403 HydrophobicContact CB-CD1 3.93Å; A401-L403 HydrophobicContact CB-CG 3.92Å; A401-L403 PolarHBondContact O-N 2.94Å
402	G	68	Low	75.1	Confident	45 Å²	45	48 Å²	48	46%	0.464	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	28.5	-176.5	0	0	0	0	0	113.3	R367 F398 I399 A400	R367-G402 PolarHBondContact NH2-O 3.18Å; F398-G402 PolarHBondContact O-N 3.16Å; F398-G402 VanDerWaalsContact O-N 3.16Å; I399-G402 PolarHBondContact O-N 3.08Å; A400-G402 PolarHBondContact O-N 3.12Å
403	L	67.7	Low	74.5	Confident	49 Å²	49	48.5 Å²	48.5	26%	0.257	29%	0.285	S	S	.	.			trans	-83.7	152.4	178.9	-72.4	174.1	0	0	0	110.9	F398 A401	F398-L403 HydrophobicContact CB-CB 4.39Å; F398-L403 HydrophobicContact CD1-CB 4.3Å; F398-L403 HydrophobicContact CD1-CD1 3.8Å; F398-L403 HydrophobicContact CE1-CD1 4.27Å; F398-L403 PolarHBondContact O-N 3.19Å; A401-L403 HydrophobicContact CB-CD1 3.93Å; A401-L403 HydrophobicContact CB-CG 3.92Å; A401-L403 PolarHBondContact O-N 2.94Å
404	P	72.9	Confident	73.1	Confident	31 Å²	31	48.1 Å²	48.1	20%	0.201	29%	0.29	C	S	.	.			trans	-75.4	137.4	179.6	33	-25.9	0	0	0	108.7	R367 H406	R367-P404 HydrophobicContact CG-CG 4.07Å; P404-H406 PolarHBondContact O-N 3.43Å
405	L	78.9	Confident	71	Confident	19 Å²	19	56.5 Å²	56.5	10%	0.099	32%	0.316	C	S	.	.	S	Bend	trans	-80.9	49	176.8	-63.9	175.9	0	0	0	111.6	V318 V320 T321 L395 F398 I399 F407	V318-L405 HydrophobicContact CB-CD1 3.85Å; V318-L405 HydrophobicContact CG1-CD1 3.24Å; V320-L405 HydrophobicContact CG2-CB 4.45Å; T321-L405 PolarHBondContact N-O 2.87Å; L395-L405 HydrophobicContact CD2-CD2 4.1Å; F398-L405 HydrophobicContact CB-CD2 3.74Å; I399-L405 HydrophobicContact CG1-CD1 4.1Å; L405-F407 HydrophobicContact CD2-CE2 4.47Å; L405-F407 HydrophobicContact CD2-CZ 4.4Å
406	H	79.8	Confident	68.8	Low	68 Å²	68	61.3 Å²	61.3	32%	0.315	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119	178.6	-71.1	-122.5	0	0	0	107.2	T321 H323 W365 P404	T321-H406 CarbonylContact O-C 3.58Å; T321-H406 VanDerWaalsContact O-CA 3.3Å; T321-H406 WeakPolarHBondContact O-CA 3.32Å; H323-H406 AromaticContact NE2-CE1 3.43Å; H323-H406 PolarHBondContact NE2-CE1 2.88Å; H323-H406 AromaticContact NE2-CG 3.36Å; H323-H406 AromaticContact NE2-ND1 2.5Å; H323-H406 PolarHBondContact NE2-ND1 2.98Å; W365-H406 HydrophobicContact CB-CB 3.5Å; W365-H406 WeakPolarHBondContact CB-O 3.48Å; W365-H406 HydrophobicContact CG-CB 3.96Å; W365-H406 PolarHBondContact N-O 3.47Å; P404-H406 PolarHBondContact O-N 3.43Å
407	F	83.1	Confident	66.6	Low	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	151.5	-179.8	-57.9	-74.9	0	0	0	110.2	V320 T321 I322 H323 L339 L362 E363 L364 L389 L395 F398 L405	V320-F407 HydrophobicContact CG1-CD2 3.44Å; V320-F407 VanDerWaalsContact CG1-CD2 3.44Å; V320-F407 HydrophobicContact CG1-CE2 3.55Å; T321-F407 PolarHBondContact O-N 3.39Å; I322-F407 CarbonylContact C-O 3.51Å; I322-F407 WeakPolarHBondContact CA-O 3.29Å; H323-F407 PolarHBondContact N-O 2.69Å; L339-F407 HydrophobicContact CD1-CE1 4.42Å; L339-F407 HydrophobicContact CD2-CE1 4.01Å; L339-F407 HydrophobicContact CD2-CE2 3.97Å; L339-F407 HydrophobicContact CD2-CZ 3.63Å; L362-F407 HydrophobicContact CD2-CB 4.12Å; E363-F407 CarbonylContact O-C 3.58Å; E363-F407 WeakPolarHBondContact O-CA 3.33Å; L364-F407 HydrophobicContact CD2-CD1 4.39Å; L364-F407 HydrophobicContact CD2-CE1 4.02Å; L389-F407 HydrophobicContact CD1-CD1 3.52Å; L389-F407 HydrophobicContact CD1-CE1 3.76Å; L395-F407 HydrophobicContact CD2-CE2 4.15Å; L395-F407 HydrophobicContact CD2-CZ 4.32Å; F398-F407 HydrophobicContact CD1-CE1 4.41Å; F398-F407 HydrophobicContact CD1-CZ 4.47Å; F398-F407 HydrophobicContact CE1-CE1 4.4Å; F398-F407 HydrophobicContact CG-CZ 4.42Å; L405-F407 HydrophobicContact CD2-CE2 4.47Å; L405-F407 HydrophobicContact CD2-CZ 4.4Å
408	L	81.4	Confident	64.3	Low	52 Å²	52	66.5 Å²	66.5	27%	0.272	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.2	170.4	179	68.5	0	0	0	108.5	H323 L362 E363 W365 V410	H323-L408 HydrophobicContact CB-CD1 4.17Å; H323-L408 WeakPolarHBondContact O-CA 3.49Å; L362-L408 CarbonylContact C-O 3.6Å; L362-L408 WeakPolarHBondContact CA-O 3.4Å; E363-L408 HydrophobicContact CB-CB 4.34Å; E363-L408 PolarHBondContact N-O 3.49Å; E363-L408 PolarHBondContact O-N 2.69Å; W365-L408 HydrophobicContact CE3-CB 4.48Å; W365-L408 HydrophobicContact CZ3-CD1 4.24Å; L408-V410 HydrophobicContact CD2-CG2 3.78Å; L408-V410 HydrophobicContact CG-CG2 3.86Å
409	L	83.4	Confident	62.1	Low	14 Å²	14	69.8 Å²	69.8	7%	0.073	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114.4	170.3	-168.2	75.6	0	0	0	109.5	I322 H323 M324 L343 V347 L352 Y360 L362	I322-L409 HydrophobicContact CG2-CB 3.97Å; H323-L409 PolarHBondContact O-N 3.2Å; M324-L409 HydrophobicContact CB-CB 4.37Å; M324-L409 HydrophobicContact CE-CD2 3.92Å; M324-L409 HydrophobicContact CG-CB 3.74Å; M324-L409 HydrophobicContact CG-CD2 4.19Å; M324-L409 HydrophobicContact SD-CB 4.11Å; M324-L409 HydrophobicContact SD-CD2 3.4Å; M324-L409 WeakPolarHBondContact SD-CD2 3.37Å; M324-L409 HydrophobicContact SD-CG 4.38Å; L343-L409 HydrophobicContact CD1-CD1 3.3Å; V347-L409 HydrophobicContact CG2-CD2 4.44Å; L352-L409 HydrophobicContact CD1-CD2 3.4Å; Y360-L409 HydrophobicContact CD1-CD2 3.92Å; Y360-L409 HydrophobicContact CD1-CG 4.17Å; L362-L409 HydrophobicContact CD2-CD1 3.78Å
410	V	77.1	Confident	60.4	Low	34 Å²	34	73 Å²	73	21%	0.206	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.8	177.4	-176.8	0	0	0	0	109.6	Y360 R361 E363 L408	Y360-V410 WeakPolarHBondContact CA-O 3.45Å; R361-V410 HydrophobicContact CG-CB 4.07Å; R361-V410 PolarHBondContact N-O 3.43Å; R361-V410 PolarHBondContact O-N 3.21Å; E363-V410 HydrophobicContact CG-CG2 4.11Å; L408-V410 HydrophobicContact CD2-CG2 3.78Å; L408-V410 HydrophobicContact CG-CG2 3.86Å
411	R	75.7	Confident	58.4	Low	88 Å²	88	72.9 Å²	72.9	33%	0.332	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	114.6	174.6	-172.9	-173	-164.9	-161.9	6.6	109.4	Y358 Y360	Y358-R411 VanDerWaalsContact CD1-NE 3.27Å; Y358-R411 VanDerWaalsContact CE1-CZ 3.4Å; Y358-R411 VanDerWaalsContact CE2-NH2 3.27Å; Y360-R411 HydrophobicContact CD1-CB 4.01Å; Y360-R411 HydrophobicContact CD1-CG 4.17Å; Y360-R411 HydrophobicContact CE1-CB 3.83Å; Y360-R411 HydrophobicContact CE1-CG 3.7Å
412	E	65.7	Low	56.6	Low	60 Å²	60	78.4 Å²	78.4	28%	0.28	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	152.7	173.1	-40.8	-158.3	122.2	0	0	109.6	A359 R361 S414	A359-E412 HydrophobicContact CB-CB 4.07Å; A359-E412 HydrophobicContact CB-CG 4.19Å; A359-E412 PolarHBondContact O-N 2.99Å; R361-E412 VanDerWaalsContact CD-OE1 3.24Å; R361-E412 WeakPolarHBondContact CD-OE1 3.42Å; R361-E412 HydrophobicContact CG-CG 4.16Å; R361-E412 IonicContact CZ-OE1 2.77Å; R361-E412 IonicContact NE-OE1 2.72Å; R361-E412 IonicContact NH1-OE1 3.53Å; R361-E412 PolarHBondContact NH1-OE1 3.33Å; E412-S414 PolarHBondContact O-N 2.87Å
413	S	54.8	Low	54.9	Low	88 Å²	88	83.4 Å²	83.4	62%	0.615	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	20.6	-177.2	-44.1	0	0	0	0	115.2	G357 R415	G357-S413 WeakPolarHBondContact O-CB 3.35Å; G357-S413 PolarHBondContact O-OG 3.37Å; G357-S413 VanDerWaalsContact O-OG 3.07Å; S413-R415 PolarHBondContact O-N 3.23Å
414	S	44.8	Very low	53.3	Low	52 Å²	52	88.2 Å²	88.2	36%	0.364	48%	0.48	S	S	.	.			trans	-62	109.9	169.6	-174.6	0	0	0	0	109.2	E412 C416	E412-S414 PolarHBondContact O-N 2.87Å; S414-C416 PolarHBondContact O-N 3.44Å
415	R	36.5	Very low	51.4	Low	216 Å²	216	93.8 Å²	93.8	82%	0.815	51%	0.509	S	S	*	.			trans	-64.9	74.2	162	-70.9	-167.7	-176.4	-164.4	2.3	109.5	S413 D417	S413-R415 PolarHBondContact O-N 3.23Å; R415-D417 VanDerWaalsContact C-N 3.31Å; R415-D417 PolarHBondContact O-N 3.36Å
416	C	32.2	Very low	49.3	Very low	101 Å²	101	100 Å²	100	68%	0.682	54%	0.542	S	S	*	.			trans	-72.1	100.1	147.8	-67.1	0	0	0	0	104.6	S414 T418	S414-C416 PolarHBondContact O-N 3.44Å; C416-T418 VanDerWaalsContact C-N 3.33Å; C416-T418 PolarHBondContact O-N 3.11Å
417	D	29.4	Very low	47.4	Very low	139 Å²	139	105.3 Å²	105.3	74%	0.743	57%	0.571	S	S	*	*			trans	-56.5	102.5	169.6	-81.7	-41.4	0	0	0	107.9	R415 A419	R415-D417 VanDerWaalsContact C-N 3.31Å; R415-D417 PolarHBondContact O-N 3.36Å; D417-A419 PolarHBondContact O-N 2.87Å
418	T	29.3	Very low	45.1	Very low	114 Å²	114	114.4 Å²	114.4	70%	0.699	61%	0.613	S	S	*	*			trans	-59	102.8	148	-55.8	0	0	0	0	104.3	C416 L420	C416-T418 VanDerWaalsContact C-N 3.33Å; C416-T418 PolarHBondContact O-N 3.11Å; T418-L420 HydrophobicContact CG2-CD2 3.95Å; T418-L420 HydrophobicContact CG2-CG 3.98Å; T418-L420 PolarHBondContact O-N 3.34Å
419	A	29.6	Very low	42.6	Very low	72 Å²	72	116.6 Å²	116.6	60%	0.595	64%	0.639	S	S	*	*			trans	-67.1	72.8	167.8	0	0	0	0	0	108.1	D417 S421	D417-A419 PolarHBondContact O-N 2.87Å; A419-S421 PolarHBondContact O-N 2.93Å; A419-S421 VanDerWaalsContact O-N 3.17Å
420	L	37.3	Very low	40.3	Very low	143 Å²	143	122.4 Å²	122.4	75%	0.749	68%	0.675	S	S	*	*			trans	-55.1	118.1	156.3	-67.7	178.5	0	0	0	104.7	T418 D422	T418-L420 HydrophobicContact CG2-CD2 3.95Å; T418-L420 HydrophobicContact CG2-CG 3.98Å; T418-L420 PolarHBondContact O-N 3.34Å; L420-D422 PolarHBondContact O-N 3.16Å
421	S	30.6	Very low	38.1	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	71%	0.708	S	S	*	*			trans	-55.2	124.2	177.7	46	0	0	0	0	109.5	A419 Q423	A419-S421 PolarHBondContact O-N 2.93Å; A419-S421 VanDerWaalsContact O-N 3.17Å; S421-Q423 PolarHBondContact O-N 2.96Å
422	D	31	Very low	36.1	Very low	171 Å²	171	132.7 Å²	132.7	91%	0.914	73%	0.731	S	S	*	*			trans	-60.2	83.9	154.4	-67.4	-39.9	0	0	0	107.8	L420	L420-D422 PolarHBondContact O-N 3.16Å
423	Q	32.4	Very low	34.6	Very low	151 Å²	151	136.3 Å²	136.3	71%	0.706	75%	0.751	S	S	*	*			trans	-143.3	121.6	167.7	-105.8	-167.9	-17.2	0	0	108.5	S421	S421-Q423 PolarHBondContact O-N 2.96Å
424	N	33.5	Very low	33.3	Very low	149 Å²	149	140.8 Å²	140.8	80%	0.797	76%	0.762	S	S	*	*			trans	80.2	80	177.5	-43.9	-31.2	0	0	0	114.2
425	D	32.5	Very low	32.5	Very low	149 Å²	149	143.8 Å²	143.8	80%	0.797	78%	0.783	S	S	*	*				-47	160.9	126.6	-64.7	-62.2	0	0	0	110.6
426	D	35.4	Very low	32.3	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	79%	0.787	S	S	*	*			trans	71.1	89.1	178.8	-51.6	-31.4	0	0	0	116.5
427	I	40.3	Very low	32.1	Very low	178 Å²	178	146 Å²	146	91%	0.913	80%	0.8	S	S	*	*				-157.9	137.5	123.2	-96.5	147.8	0	0	0	110.1
428	E	33.9	Very low	32	Very low	192 Å²	192	143.2 Å²	143.2	90%	0.897	80%	0.796	S	S	*	*			trans	-83.7	165	-167.6	-157.7	171.2	-173.8	0	0	113.5
429	A	30.2	Very low	32	Very low	97 Å²	97	145.1 Å²	145.1	80%	0.802	80%	0.801	S	S	*	*			trans	-77	137.2	-164.2	0	0	0	0	0	116
430	T	34.3	Very low	31.9	Very low	136 Å²	136	148 Å²	148	83%	0.834	81%	0.807	S	S	*	*			trans	-135.8	136.8	151.5	48.9	0	0	0	0	112.4
431	K	31.1	Very low	31.6	Very low	209 Å²	209	147 Å²	147	91%	0.909	81%	0.807	S	S	*	*			trans	-77.8	121.6	-175.6	-63.3	164.5	177.5	171.1	0	112.6
432	T	34.5	Very low	31.9	Very low	130 Å²	130	147.6 Å²	147.6	80%	0.798	81%	0.807	S	S	*	*			trans	-159.4	88.6	156.8	1.7	0	0	0	0	108.3
433	L	32.5	Very low	32.2	Very low	135 Å²	135	145.6 Å²	145.6	71%	0.707	80%	0.795	S	S	*	*				65.3	90.8	89.7	-157.4	84	0	0	0	113.9	S435	L433-S435 PolarHBondContact O-N 2.72Å
434	E	28.6	Very low	32.6	Very low	183 Å²	183	141.3 Å²	141.3	86%	0.855	78%	0.775	S	S	*	*	S	Bend	trans	53.4	26.4	138	-55.7	-179.8	122	0	0	120.2
435	S	28.2	Very low	33.2	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	76%	0.761	S	S	*	*			trans	-128.3	51.5	-177.3	-166.4	0	0	0	0	115.4	L433	L433-S435 PolarHBondContact O-N 2.72Å
436	M	31.2	Very low	33.8	Very low	183 Å²	183	133.4 Å²	133.4	90%	0.901	74%	0.739	S	S	*	*			trans	-151.6	28	165.6	-126.9	169	65.2	0	0	114.6
437	L	29.2	Very low	34.3	Very low	180 Å²	180	130 Å²	130	94%	0.942	72%	0.718	S	S	*	*	S	Bend	trans	-105.7	56.9	171.7	-73.4	173.8	0	0	0	111.3
438	A	26.5	Very low	34.7	Very low	81 Å²	81	126 Å²	126	67%	0.669	70%	0.702	S	S	*	*			trans	-170.3	152.5	166.5	0	0	0	0	0	110.8
439	L	28.4	Very low	35.3	Very low	154 Å²	154	118.2 Å²	118.2	81%	0.806	67%	0.67	S	S	*	*			trans	68	127.2	-174.9	-77.2	54.7	0	0	0	113.6
440	D	29.1	Very low	36.4	Very low	132 Å²	132	114 Å²	114	71%	0.706	63%	0.634	S	S	*	*			cis	-134.5	124.5	8.8	-124.8	-36.8	0	0	0	111.8
441	T	30.7	Very low	37.6	Very low	122 Å²	122	112.9 Å²	112.9	75%	0.748	62%	0.619	S	S	*	*			trans	-113.2	52.5	-166.1	-35.3	0	0	0	0	112.5
442	T	35.5	Very low	39.2	Very low	103 Å²	103	107.7 Å²	107.7	63%	0.632	60%	0.601	S	S	*	*	S	Bend	trans	-133.2	-12.7	-173.1	57.8	0	0	0	0	116.3
443	L	38.5	Very low	40.9	Very low	128 Å²	128	106.4 Å²	106.4	67%	0.67	58%	0.582	S	S	*	*			trans	-133.9	138	173.1	-102.9	82.5	0	0	0	103.7
444	E	39.5	Very low	43.2	Very low	62 Å²	62	104.9 Å²	104.9	29%	0.29	57%	0.571	S	S	.	*			cis	173.3	114.8	47.8	-108.4	-84.4	170.7	0	0	109.7	V446 H447	E444-V446 WeakPolarHBondContact OE2-CA 3.47Å; E444-V446 VanDerWaalsContact OE2-CB 3.23Å; E444-V446 WeakPolarHBondContact OE2-CB 3.27Å; E444-V446 PolarHBondContact OE2-N 3.13Å; E444-V446 VanDerWaalsContact OE2-N 3.07Å; E444-H447 HydrophobicContact CB-CB 3.95Å; E444-H447 HydrophobicContact CG-CB 4.35Å; E444-H447 VanDerWaalsContact CG-CD2 3.44Å; E444-H447 WeakPolarHBondContact CG-CD2 3.48Å; E444-H447 IonicContact OE1-CE1 3.38Å; E444-H447 IonicContact OE1-ND1 2.76Å; E444-H447 IonicContact OE2-CG 2.64Å; E444-H447 PolarHBondContact OE2-N 3.12Å; E444-H447 IonicContact OE2-ND1 3.91Å
445	P	47.3	Very low	45.7	Very low	76 Å²	76	97.3 Å²	97.3	49%	0.494	54%	0.535	S	S	.	.	S	Bend	trans	-79.8	-25.1	166.7	-16.5	32	0	0	0	112.6	T448	P445-T448 PolarHBondContact O-OG1 2.86Å
446	V	44.6	Very low	48.2	Very low	56 Å²	56	96 Å²	96	34%	0.339	52%	0.516	S	S	.	.	S	Bend	trans	-76.8	-36.7	-172.6	-170.2	0	0	0	0	110.6	E444 T448 A449 L450 V742	E444-V446 WeakPolarHBondContact OE2-CA 3.47Å; E444-V446 VanDerWaalsContact OE2-CB 3.23Å; E444-V446 WeakPolarHBondContact OE2-CB 3.27Å; E444-V446 PolarHBondContact OE2-N 3.13Å; E444-V446 VanDerWaalsContact OE2-N 3.07Å; V446-T448 PolarHBondContact O-N 3.33Å; V446-T448 VanDerWaalsContact O-N 3.07Å; V446-A449 PolarHBondContact O-N 2.87Å; V446-L450 HydrophobicContact CG1-CD1 3.88Å; V446-L450 HydrophobicContact CG1-CG 4.24Å; V446-L450 WeakPolarHBondContact O-CG 3.43Å; V446-L450 PolarHBondContact O-N 3.3Å; V446-V742 HydrophobicContact CG1-CG2 4.19Å
447	H	46.6	Very low	50.6	Low	78 Å²	78	87.3 Å²	87.3	36%	0.361	47%	0.473	S	S	.	.	H	α-helix	trans	-55	-28.1	177	-77.5	-12	0	0	0	114.3	E444 A449 L450 H451	E444-H447 HydrophobicContact CB-CB 3.95Å; E444-H447 HydrophobicContact CG-CB 4.35Å; E444-H447 VanDerWaalsContact CG-CD2 3.44Å; E444-H447 WeakPolarHBondContact CG-CD2 3.48Å; E444-H447 IonicContact OE1-CE1 3.38Å; E444-H447 IonicContact OE1-ND1 2.76Å; E444-H447 IonicContact OE2-CG 2.64Å; E444-H447 PolarHBondContact OE2-N 3.12Å; E444-H447 IonicContact OE2-ND1 3.91Å; H447-A449 PolarHBondContact O-N 3.03Å; H447-L450 CarbonylContact O-C 3.53Å; H447-L450 WeakPolarHBondContact O-CA 3.34Å; H447-L450 PolarHBondContact O-N 2.82Å; H447-H451 PolarHBondContact O-N 2.85Å; H447-H451 PolarHBondContact O-ND1 2.96Å
448	T	48.3	Very low	53	Low	93 Å²	93	80.9 Å²	80.9	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-26.1	177.4	-28	0	0	0	0	113.6	P445 V446	P445-T448 PolarHBondContact O-OG1 2.86Å; V446-T448 PolarHBondContact O-N 3.33Å; V446-T448 VanDerWaalsContact O-N 3.07Å
449	A	47.1	Very low	55.6	Low	29 Å²	29	78.4 Å²	78.4	24%	0.24	42%	0.415	C	S	.	.	H	α-helix	trans	-87.6	-24.1	171.2	0	0	0	0	0	113.1	V446 H447 Q735 I738	V446-A449 PolarHBondContact O-N 2.87Å; H447-A449 PolarHBondContact O-N 3.03Å; A449-Q735 PolarHBondContact O-NE2 3.16Å; A449-Q735 VanDerWaalsContact O-NE2 3.15Å; A449-I738 HydrophobicContact CB-CG2 4.44Å
450	L	52.7	Low	57.7	Low	9 Å²	9	74.2 Å²	74.2	5%	0.047	39%	0.393	C	S	.	.	H	α-helix	trans	-91.3	-11.5	-178.2	-54.4	175.4	0	0	0	114.1	V446 H447 S474 I739 Y743	V446-L450 HydrophobicContact CG1-CD1 3.88Å; V446-L450 HydrophobicContact CG1-CG 4.24Å; V446-L450 WeakPolarHBondContact O-CG 3.43Å; V446-L450 PolarHBondContact O-N 3.3Å; H447-L450 CarbonylContact O-C 3.53Å; H447-L450 WeakPolarHBondContact O-CA 3.34Å; H447-L450 PolarHBondContact O-N 2.82Å; L450-S474 PolarHBondContact O-N 3.43Å; L450-S474 VanDerWaalsContact O-N 3.16Å; L450-I739 HydrophobicContact CD2-CB 4.31Å; L450-I739 HydrophobicContact CD2-CG1 3.64Å; L450-I739 HydrophobicContact CD2-CG2 4.45Å; L450-Y743 HydrophobicContact CD1-CE2 4.48Å; L450-Y743 HydrophobicContact CD2-CE2 4.48Å
451	H	59.5	Low	59.4	Low	112 Å²	112	75.5 Å²	75.5	52%	0.519	39%	0.392	S	S	.	.	S	Bend	trans	-58	147.9	174.4	-71.2	140.8	0	0	0	111.9	H447 R453	H447-H451 PolarHBondContact O-N 2.85Å; H447-H451 PolarHBondContact O-ND1 2.96Å; H451-R453 PolarHBondContact O-N 3.43Å; H451-R453 VanDerWaalsContact O-N 3.14Å
452	L	65.5	Low	60.9	Low	101 Å²	101	72.4 Å²	72.4	53%	0.529	39%	0.385	S	S	.	.			trans	-52	116	179.6	-176.1	72.9	0	0	0	111.5	N471 I472	L452-N471 HydrophobicContact CD1-CB 4.14Å; L452-I472 CarbonylContact C-O 3.54Å; L452-I472 VanDerWaalsContact CA-O 3.32Å; L452-I472 WeakPolarHBondContact CA-O 3.27Å
453	R	70.1	Confident	62	Low	103 Å²	103	72.8 Å²	72.8	39%	0.389	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.4	171.3	-67.2	-165.1	-169.7	156.2	1	111.2	H451 Y455 N471 I472	H451-R453 PolarHBondContact O-N 3.43Å; H451-R453 VanDerWaalsContact O-N 3.14Å; R453-Y455 HydrophobicContact CB-CD2 4.26Å; R453-Y455 HydrophobicContact CB-CE2 3.54Å; R453-Y455 WeakPolarHBondContact CD-OH 3.37Å; R453-N471 CarbonylContact O-C 3.56Å; R453-N471 WeakPolarHBondContact O-CA 3.3Å; R453-I472 PolarHBondContact N-O 3.07Å; R453-I472 PolarHBondContact O-N 2.93Å
454	Q	79.6	Confident	63	Low	102 Å²	102	67.8 Å²	67.8	48%	0.477	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.1	-178.1	-50.3	-171.5	-10.4	0	0	109.4	Q469 N471	Q454-Q469 VanDerWaalsContact CD-NE2 3.28Å; Q454-N471 WeakPolarHBondContact CB-OD1 3.33Å; Q454-N471 VanDerWaalsContact CG-OD1 3.26Å; Q454-N471 WeakPolarHBondContact CG-OD1 3.25Å
455	Y	81.3	Confident	64.1	Low	25 Å²	25	67 Å²	67	10%	0.098	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.2	-178.6	-66.4	-83.9	0	0	0	111	R453 L470 I472 R728 I732 Q735	R453-Y455 HydrophobicContact CB-CD2 4.26Å; R453-Y455 HydrophobicContact CB-CE2 3.54Å; R453-Y455 WeakPolarHBondContact CD-OH 3.37Å; Y455-L470 PolarHBondContact N-O 2.79Å; Y455-L470 PolarHBondContact O-N 3.37Å; Y455-I472 HydrophobicContact CD2-CD1 3.88Å; Y455-I472 HydrophobicContact CD2-CG1 4.41Å; Y455-I472 HydrophobicContact CE2-CD1 3.94Å; Y455-R728 HydrophobicContact CD1-CG 3.72Å; Y455-R728 HydrophobicContact CE1-CG 4.29Å; Y455-I732 HydrophobicContact CD1-CD1 3.93Å; Y455-I732 HydrophobicContact CD1-CG1 3.71Å; Y455-I732 HydrophobicContact CD2-CD1 4.3Å; Y455-I732 HydrophobicContact CD2-CG1 3.74Å; Y455-I732 HydrophobicContact CE1-CG1 3.89Å; Y455-I732 HydrophobicContact CE2-CG1 3.92Å; Y455-I732 HydrophobicContact CG-CD1 3.76Å; Y455-I732 HydrophobicContact CG-CG1 3.61Å; Y455-Q735 PolarHBondContact OH-OE1 2.91Å
456	Q	81.2	Confident	64.9	Low	86 Å²	86	67.6 Å²	67.6	40%	0.402	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.5	168.7	-65.8	175.5	11	0	0	109	K482 T724 R728	Q456-K482 VanDerWaalsContact CD-NZ 3.33Å; Q456-T724 PolarHBondContact O-OG1 3.07Å; Q456-R728 WeakPolarHBondContact O-CD 3.34Å; Q456-R728 PolarHBondContact O-NH1 2.75Å
457	V	81.8	Confident	66.3	Low	2 Å²	2	69.1 Å²	69.1	1%	0.012	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.5	-175.6	-60.4	0	0	0	0	110.2	V468 L470 F595 F722 T724 I732	V457-V468 HydrophobicContact CG2-CG2 3.75Å; V457-V468 PolarHBondContact N-O 3.2Å; V457-V468 VanDerWaalsContact N-O 3.07Å; V457-V468 WeakPolarHBondContact O-CG2 3.31Å; V457-V468 PolarHBondContact O-N 2.92Å; V457-L470 HydrophobicContact CG2-CB 3.76Å; V457-L470 HydrophobicContact CG2-CD2 4.39Å; V457-F595 HydrophobicContact CB-CE1 4.49Å; V457-F595 HydrophobicContact CG1-CE1 4.08Å; V457-F595 HydrophobicContact CG1-CZ 4.08Å; V457-F722 HydrophobicContact CB-CB 4.5Å; V457-F722 HydrophobicContact CB-CD1 4.37Å; V457-F722 HydrophobicContact CG2-CD1 3.56Å; V457-F722 HydrophobicContact CG2-CE1 4.07Å; V457-F722 HydrophobicContact CG2-CG 4.3Å; V457-T724 HydrophobicContact CG1-CG2 4.16Å; V457-I732 HydrophobicContact CG1-CD1 3.65Å
458	T	79.8	Confident	67.8	Low	44 Å²	44	65.4 Å²	65.4	27%	0.27	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.6	176.3	-52.6	0	0	0	0	109.3	P466 F722 E723	T458-P466 CarbonylContact C-O 3.47Å; T458-P466 WeakPolarHBondContact CA-O 3.38Å; T458-P466 HydrophobicContact CG2-CB 4.12Å; T458-P466 WeakPolarHBondContact CG2-O 3.48Å; T458-F722 CarbonylContact O-C 3.32Å; T458-F722 WeakPolarHBondContact O-CA 3.49Å; T458-E723 WeakPolarHBondContact CB-O 3.37Å; T458-E723 PolarHBondContact N-O 3.38Å; T458-E723 PolarHBondContact O-N 3.47Å; T458-E723 PolarHBondContact OG1-O 3.05Å
459	Y	80	Confident	69.5	Low	29 Å²	29	62.9 Å²	62.9	11%	0.114	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.3	175.9	-173	-122.7	0	0	0	111.1	K461 F464 P466 L720 C721 F722	Y459-K461 WeakPolarHBondContact CE1-O 3.47Å; Y459-K461 PolarHBondContact OH-O 3.44Å; Y459-F464 HydrophobicContact CD1-CB 4.04Å; Y459-P466 PolarHBondContact N-O 3.17Å; Y459-L720 HydrophobicContact CE2-CB 4.17Å; Y459-L720 HydrophobicContact CE2-CD2 4.05Å; Y459-L720 WeakPolarHBondContact OH-CD2 3.5Å; Y459-C721 WeakPolarHBondContact CD2-O 3.39Å; Y459-F722 AromaticContact CD2-CD1 3.71Å; Y459-F722 HydrophobicContact CD2-CD1 3.71Å; Y459-F722 AromaticContact CD2-CE1 3.46Å; Y459-F722 HydrophobicContact CD2-CE1 3.46Å; Y459-F722 VanDerWaalsContact CD2-CE1 3.46Å; Y459-F722 HydrophobicContact CD2-CG 4.43Å; Y459-F722 AromaticContact CD2-CZ 3.99Å; Y459-F722 HydrophobicContact CD2-CZ 3.99Å; Y459-F722 HydrophobicContact CE2-CE1 4.15Å; Y459-F722 HydrophobicContact CE2-CZ 4.22Å; Y459-F722 HydrophobicContact CG-CD1 4.49Å; Y459-F722 HydrophobicContact CG-CE1 4.32Å
460	L	73.2	Confident	71.3	Confident	66 Å²	66	61.5 Å²	61.5	35%	0.346	32%	0.316	S	S	.	.			trans	-90	-16.6	-169.7	-67.2	173.8	0	0	0	114.7	Q594 C721 E723	L460-Q594 HydrophobicContact CD1-CB 4.27Å; L460-Q594 VanDerWaalsContact CD1-CD 3.46Å; L460-Q594 HydrophobicContact CD1-CG 3.82Å; L460-C721 HydrophobicContact CB-CB 4.2Å; L460-C721 WeakPolarHBondContact CB-O 3.39Å; L460-C721 HydrophobicContact CD1-CB 4.25Å; L460-C721 PolarHBondContact N-O 3.39Å; L460-E723 HydrophobicContact CD1-CB 4.11Å; L460-E723 HydrophobicContact CD2-CB 3.87Å; L460-E723 HydrophobicContact CG-CB 4.08Å
461	K	65.4	Low	72.7	Confident	159 Å²	159	61.4 Å²	61.4	69%	0.691	32%	0.315	S	S	*	.	S	Bend	trans	-152.2	83.4	-167.6	-163.7	176.3	-178.2	179.9	0	115	Y459	Y459-K461 WeakPolarHBondContact CE1-O 3.47Å; Y459-K461 PolarHBondContact OH-O 3.44Å
462	G	61.6	Low	73.8	Confident	58 Å²	58	56.1 Å²	56.1	60%	0.598	29%	0.291	S	S	*	.	S	Bend	trans	166.7	-155.7	164.2	0	0	0	0	0	113.8
463	L	58.1	Low	74.4	Confident	110 Å²	110	52.1 Å²	52.1	58%	0.576	27%	0.272	S	S	*	.	S	Bend	trans	-83.4	-8.2	-172.8	-67.5	170.8	0	0	0	114.9	M491	L463-M491 HydrophobicContact CB-CE 4.24Å; L463-M491 HydrophobicContact CB-SD 4.28Å
464	F	60	Low	74.4	Confident	24 Å²	24	48.5 Å²	48.5	11%	0.105	26%	0.262	C	S	.	.	S	Bend	trans	-74.9	149.9	177.6	-81.1	-102.5	0	0	0	111.1	Y459 V468 M491 K492 I494	Y459-F464 HydrophobicContact CD1-CB 4.04Å; F464-V468 HydrophobicContact CB-CG1 3.85Å; F464-V468 HydrophobicContact CD1-CG1 4.06Å; F464-V468 HydrophobicContact CG-CG1 4.29Å; F464-M491 HydrophobicContact CE1-CB 4.2Å; F464-M491 HydrophobicContact CZ-CB 4.33Å; F464-K492 WeakPolarHBondContact CZ-O 3.37Å; F464-I494 HydrophobicContact CD2-CD1 4.09Å; F464-I494 HydrophobicContact CE2-CD1 3.46Å; F464-I494 VanDerWaalsContact CE2-CD1 3.46Å; F464-I494 HydrophobicContact CE2-CG1 3.65Å; F464-I494 HydrophobicContact CZ-CD1 4.12Å; F464-I494 HydrophobicContact CZ-CG1 3.87Å
465	P	61.8	Low	74.3	Confident	45 Å²	45	48 Å²	48	29%	0.292	26%	0.263	S	S	.	.			trans	-58.1	155.9	167.1	27.3	-34.3	0	0	0	110.4	E467 V468 Q481	P465-E467 VanDerWaalsContact C-N 3.3Å; P465-E467 PolarHBondContact O-N 3.12Å; P465-V468 WeakPolarHBondContact O-CG1 3.39Å; P465-Q481 HydrophobicContact CG-CB 4.43Å; P465-Q481 HydrophobicContact CG-CG 3.73Å
466	P	65.7	Low	74.2	Confident	89 Å²	89	49.7 Å²	49.7	58%	0.578	27%	0.272	S	S	*	.	S	Bend	trans	-59.4	-38.9	-170.8	21.1	-32.8	0	0	0	112.6	T458 Y459	T458-P466 CarbonylContact C-O 3.47Å; T458-P466 WeakPolarHBondContact CA-O 3.38Å; T458-P466 HydrophobicContact CG2-CB 4.12Å; T458-P466 WeakPolarHBondContact CG2-O 3.48Å; Y459-P466 PolarHBondContact N-O 3.17Å
467	E	73.1	Confident	74.3	Confident	88 Å²	88	45.7 Å²	45.7	41%	0.411	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.7	177	-165.8	-177.9	168.5	0	0	111.2	P465 K482	P465-E467 VanDerWaalsContact C-N 3.3Å; P465-E467 PolarHBondContact O-N 3.12Å; E467-K482 HydrophobicContact CG-CD 4.42Å; E467-K482 VanDerWaalsContact OE1-CD 3.26Å; E467-K482 WeakPolarHBondContact OE1-CD 3.45Å; E467-K482 WeakPolarHBondContact OE1-CE 3.3Å; E467-K482 IonicContact OE1-NZ 3.67Å; E467-K482 PolarHBondContact OE1-NZ 3.42Å
468	V	78.6	Confident	74.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	155.9	176.8	-59	0	0	0	0	111.6	V457 F464 P465 I479 E480 F722	V457-V468 HydrophobicContact CG2-CG2 3.75Å; V457-V468 PolarHBondContact N-O 3.2Å; V457-V468 VanDerWaalsContact N-O 3.07Å; V457-V468 WeakPolarHBondContact O-CG2 3.31Å; V457-V468 PolarHBondContact O-N 2.92Å; F464-V468 HydrophobicContact CB-CG1 3.85Å; F464-V468 HydrophobicContact CD1-CG1 4.06Å; F464-V468 HydrophobicContact CG-CG1 4.29Å; P465-V468 WeakPolarHBondContact O-CG1 3.39Å; V468-I479 HydrophobicContact CB-CG2 3.96Å; V468-I479 HydrophobicContact CG1-CG2 4.29Å; V468-I479 HydrophobicContact CG2-CG2 3.93Å; V468-E480 WeakPolarHBondContact CA-O 3.17Å; V468-F722 HydrophobicContact CG2-CD1 4.36Å; V468-F722 HydrophobicContact CG2-CE1 4.1Å
469	Q	82.5	Confident	74.6	Confident	39 Å²	39	46.1 Å²	46.1	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	115.5	171.6	-179.5	169.5	-35.3	0	0	109	Q454 N471 I479 E480	Q454-Q469 VanDerWaalsContact CD-NE2 3.28Å; Q469-N471 WeakPolarHBondContact CG-OD1 3.21Å; Q469-N471 PolarHBondContact NE2-OD1 3.22Å; Q469-I479 WeakPolarHBondContact O-CA 3.24Å; Q469-E480 HydrophobicContact CB-CB 4.47Å; Q469-E480 PolarHBondContact N-O 2.76Å; Q469-E480 PolarHBondContact O-N 3.46Å
470	L	84.9	Confident	74.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	105.5	177.2	-178.5	69.3	0	0	0	108.9	Y455 V457 I472 L477 I479 F595 I597 F722 I732	Y455-L470 PolarHBondContact N-O 2.79Å; Y455-L470 PolarHBondContact O-N 3.37Å; V457-L470 HydrophobicContact CG2-CB 3.76Å; V457-L470 HydrophobicContact CG2-CD2 4.39Å; L470-I472 HydrophobicContact CD2-CD1 4.04Å; L470-I472 HydrophobicContact CD2-CG1 4.34Å; L470-I472 HydrophobicContact CG-CD1 4.28Å; L470-I472 HydrophobicContact CG-CG1 4.04Å; L470-L477 HydrophobicContact CD1-CD1 4.01Å; L470-L477 HydrophobicContact CD1-CD2 3.77Å; L470-L477 HydrophobicContact CD1-CG 3.85Å; L470-I479 HydrophobicContact CD1-CG1 3.81Å; L470-F595 HydrophobicContact CD2-CE2 4.3Å; L470-F595 HydrophobicContact CD2-CZ 4.06Å; L470-I597 HydrophobicContact CD2-CD1 4.46Å; L470-F722 HydrophobicContact CD1-CZ 4.24Å; L470-I732 HydrophobicContact CD2-CD1 4.3Å; L470-I732 HydrophobicContact CD2-CG2 4.08Å
471	N	82.8	Confident	74.5	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.1	176.5	-60.7	-34.5	0	0	0	108.7	L452 R453 Q454 Q469 L477 K478 E480	L452-N471 HydrophobicContact CD1-CB 4.14Å; R453-N471 CarbonylContact O-C 3.56Å; R453-N471 WeakPolarHBondContact O-CA 3.3Å; Q454-N471 WeakPolarHBondContact CB-OD1 3.33Å; Q454-N471 VanDerWaalsContact CG-OD1 3.26Å; Q454-N471 WeakPolarHBondContact CG-OD1 3.25Å; Q469-N471 WeakPolarHBondContact CG-OD1 3.21Å; Q469-N471 PolarHBondContact NE2-OD1 3.22Å; N471-L477 WeakPolarHBondContact O-CA 3.43Å; N471-K478 HydrophobicContact CB-CB 4.19Å; N471-K478 WeakPolarHBondContact CB-O 3.45Å; N471-K478 PolarHBondContact N-O 2.91Å; N471-K478 PolarHBondContact O-N 3.29Å; N471-E480 PolarHBondContact ND2-OE2 3.37Å
472	I	82.7	Confident	74.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.4	-178.1	-55.5	174.8	0	0	0	108	L452 R453 Y455 L470 L477 I732 L736 I739	L452-I472 CarbonylContact C-O 3.54Å; L452-I472 VanDerWaalsContact CA-O 3.32Å; L452-I472 WeakPolarHBondContact CA-O 3.27Å; R453-I472 PolarHBondContact N-O 3.07Å; R453-I472 PolarHBondContact O-N 2.93Å; Y455-I472 HydrophobicContact CD2-CD1 3.88Å; Y455-I472 HydrophobicContact CD2-CG1 4.41Å; Y455-I472 HydrophobicContact CE2-CD1 3.94Å; L470-I472 HydrophobicContact CD2-CD1 4.04Å; L470-I472 HydrophobicContact CD2-CG1 4.34Å; L470-I472 HydrophobicContact CG-CD1 4.28Å; L470-I472 HydrophobicContact CG-CG1 4.04Å; I472-L477 HydrophobicContact CG1-CD1 4.29Å; I472-I732 HydrophobicContact CD1-CG1 4.39Å; I472-I732 HydrophobicContact CD1-CG2 3.83Å; I472-L736 HydrophobicContact CD1-CD1 4.18Å; I472-L736 HydrophobicContact CD1-CG 4.18Å; I472-L736 HydrophobicContact CG2-CD2 3.88Å; I472-L736 HydrophobicContact CG2-CG 4.3Å; I472-I739 HydrophobicContact CG2-CD1 3.59Å
473	S	78.1	Confident	73.9	Confident	18 Å²	18	50.5 Å²	50.5	13%	0.126	25%	0.246	C	C	.	.			trans	-119.8	175	173.9	72.9	0	0	0	0	111	N475 E476	S473-N475 PolarHBondContact O-N 3.03Å; S473-N475 PolarHBondContact OG-N 2.88Å; S473-E476 PolarHBondContact N-O 2.81Å; S473-E476 WeakPolarHBondContact OG-CG 3.32Å; S473-E476 PolarHBondContact OG-N 2.89Å; S473-E476 PolarHBondContact OG-O 3.19Å
474	S	71.1	Confident	73.5	Confident	27 Å²	27	48.1 Å²	48.1	19%	0.189	24%	0.238	C	C	.	.	S	Bend	trans	-56.5	-33.3	172.8	65	0	0	0	0	114	L450 Y743	L450-S474 PolarHBondContact O-N 3.43Å; L450-S474 VanDerWaalsContact O-N 3.16Å; S474-Y743 WeakPolarHBondContact CB-OH 3.48Å; S474-Y743 WeakPolarHBondContact O-CE2 3.48Å
475	N	75.8	Confident	73.1	Confident	90 Å²	90	55.5 Å²	55.5	48%	0.481	27%	0.27	S	S	.	.	S	Bend	trans	-110	-37.4	-168.6	-60.3	0.7	0	0	0	112.3	S473 Q497 I498	S473-N475 PolarHBondContact O-N 3.03Å; S473-N475 PolarHBondContact OG-N 2.88Å; N475-Q497 PolarHBondContact O-OE1 3.46Å; N475-I498 WeakPolarHBondContact O-CB 3.45Å; N475-I498 WeakPolarHBondContact O-CG2 3.41Å; N475-I498 PolarHBondContact O-N 3.5Å
476	E	80.2	Confident	72.7	Confident	62 Å²	62	61 Å²	61	29%	0.29	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.1	-175.1	60.6	168.8	-143.8	0	0	113.5	S473 I495 I496	S473-E476 PolarHBondContact N-O 2.81Å; S473-E476 WeakPolarHBondContact OG-CG 3.32Å; S473-E476 PolarHBondContact OG-N 2.89Å; S473-E476 PolarHBondContact OG-O 3.19Å; E476-I495 HydrophobicContact CB-CG2 4.11Å; E476-I495 WeakPolarHBondContact OE2-CG2 3.3Å; E476-I496 WeakPolarHBondContact CA-O 3.47Å
477	L	83.9	Confident	72.1	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.8	164.5	-179.3	142.2	0	0	0	108.3	L470 N471 I472 I479 I496 I501 I597 L736	L470-L477 HydrophobicContact CD1-CD1 4.01Å; L470-L477 HydrophobicContact CD1-CD2 3.77Å; L470-L477 HydrophobicContact CD1-CG 3.85Å; N471-L477 WeakPolarHBondContact O-CA 3.43Å; I472-L477 HydrophobicContact CG1-CD1 4.29Å; L477-I479 HydrophobicContact CD2-CD1 4.06Å; L477-I479 HydrophobicContact CD2-CG1 3.92Å; L477-I496 HydrophobicContact CD2-CD1 4.43Å; L477-I496 PolarHBondContact N-O 3.35Å; L477-I496 PolarHBondContact O-N 2.89Å; L477-I501 HydrophobicContact CB-CD1 3.81Å; L477-I501 HydrophobicContact CD1-CD1 3.98Å; L477-I501 HydrophobicContact CG-CD1 4.43Å; L477-I597 HydrophobicContact CD1-CD1 3.57Å; L477-L736 HydrophobicContact CD1-CD1 4.09Å; L477-L736 HydrophobicContact CD1-CD2 4.04Å
478	K	82.2	Confident	71.1	Confident	54 Å²	54	65 Å²	65	24%	0.235	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.9	-175	-176.5	-175.3	-162	-154.3	0	110.5	N471 E480 P493 I494 I495	N471-K478 HydrophobicContact CB-CB 4.19Å; N471-K478 WeakPolarHBondContact CB-O 3.45Å; N471-K478 PolarHBondContact N-O 2.91Å; N471-K478 PolarHBondContact O-N 3.29Å; K478-E480 HydrophobicContact CD-CG 4.15Å; K478-E480 WeakPolarHBondContact CE-OE1 3.37Å; K478-E480 HydrophobicContact CG-CG 3.92Å; K478-E480 IonicContact NZ-OE1 2.66Å; K478-E480 PolarHBondContact NZ-OE1 3.47Å; K478-P493 HydrophobicContact CG-CB 4.13Å; K478-I494 CarbonylContact C-O 3.53Å; K478-I494 VanDerWaalsContact CA-O 3.3Å; K478-I494 WeakPolarHBondContact CA-O 3.47Å; K478-I495 HydrophobicContact CB-CG1 4.47Å; K478-I495 HydrophobicContact CD-CG1 4.48Å; K478-I495 HydrophobicContact CG-CG1 3.99Å
479	I	84	Confident	70.1	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	117.8	-179.3	-53.7	164.2	0	0	0	108.3	V468 Q469 L470 L477 P493 I494 L720 F722	V468-I479 HydrophobicContact CB-CG2 3.96Å; V468-I479 HydrophobicContact CG1-CG2 4.29Å; V468-I479 HydrophobicContact CG2-CG2 3.93Å; Q469-I479 WeakPolarHBondContact O-CA 3.24Å; L470-I479 HydrophobicContact CD1-CG1 3.81Å; L477-I479 HydrophobicContact CD2-CD1 4.06Å; L477-I479 HydrophobicContact CD2-CG1 3.92Å; I479-P493 VanDerWaalsContact O-CA 3.23Å; I479-P493 WeakPolarHBondContact O-CA 3.44Å; I479-P493 WeakPolarHBondContact O-CB 3.42Å; I479-I494 HydrophobicContact CB-CB 4.24Å; I479-I494 HydrophobicContact CD1-CB 4.27Å; I479-I494 HydrophobicContact CD1-CD1 4.49Å; I479-I494 HydrophobicContact CD1-CG2 4.36Å; I479-I494 PolarHBondContact N-O 3.41Å; I479-I494 PolarHBondContact O-N 2.88Å; I479-I494 VanDerWaalsContact O-N 3.09Å; I479-L720 HydrophobicContact CD1-CD1 3.57Å; I479-F722 HydrophobicContact CD1-CE1 4.44Å; I479-F722 HydrophobicContact CD1-CZ 3.86Å; I479-F722 HydrophobicContact CG1-CZ 4.45Å
480	E	79.1	Confident	69	Low	53 Å²	53	78.4 Å²	78.4	25%	0.248	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	153.1	-175.2	-51.5	-163	118.9	0	0	112	V468 Q469 N471 K478 P493	V468-E480 WeakPolarHBondContact CA-O 3.17Å; Q469-E480 HydrophobicContact CB-CB 4.47Å; Q469-E480 PolarHBondContact N-O 2.76Å; Q469-E480 PolarHBondContact O-N 3.46Å; N471-E480 PolarHBondContact ND2-OE2 3.37Å; K478-E480 HydrophobicContact CD-CG 4.15Å; K478-E480 WeakPolarHBondContact CE-OE1 3.37Å; K478-E480 HydrophobicContact CG-CG 3.92Å; K478-E480 IonicContact NZ-OE1 2.66Å; K478-E480 PolarHBondContact NZ-OE1 3.47Å; E480-P493 HydrophobicContact CG-CB 4Å
481	Q	72	Confident	67.9	Low	38 Å²	38	81.9 Å²	81.9	18%	0.178	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.5	171.4	173.3	174.8	-0.7	0	0	109.9	P465 R483	P465-Q481 HydrophobicContact CG-CB 4.43Å; P465-Q481 HydrophobicContact CG-CG 3.73Å; Q481-R483 PolarHBondContact O-N 2.86Å
482	K	60.4	Low	67.2	Low	80 Å²	80	89.3 Å²	89.3	35%	0.348	42%	0.421	S	S	.	.			trans	-62.3	134.3	171.2	-171.2	174.4	174	-177.1	0	109.4	Q456 E467	Q456-K482 VanDerWaalsContact CD-NZ 3.33Å; E467-K482 HydrophobicContact CG-CD 4.42Å; E467-K482 VanDerWaalsContact OE1-CD 3.26Å; E467-K482 WeakPolarHBondContact OE1-CD 3.45Å; E467-K482 WeakPolarHBondContact OE1-CE 3.3Å; E467-K482 IonicContact OE1-NZ 3.67Å; E467-K482 PolarHBondContact OE1-NZ 3.42Å
483	R	55.2	Low	66.8	Low	234 Å²	234	91.9 Å²	91.9	88%	0.883	44%	0.438	S	S	*	.	S	Bend	trans	-5.6	114.9	-171.1	-84	-174.7	172	122	-2.6	115	Q481 K485	Q481-R483 PolarHBondContact O-N 2.86Å; R483-K485 PolarHBondContact O-N 3.23Å
484	P	50.2	Low	66.9	Low	60 Å²	60	93.2 Å²	93.2	39%	0.39	44%	0.443	S	S	.	.			trans	-56.9	128.8	177.6	24.8	-33.6	0	0	0	110	S488 L490	P484-S488 VanDerWaalsContact CA-OG 3.29Å; P484-S488 WeakPolarHBondContact CA-OG 3.21Å; P484-S488 WeakPolarHBondContact CB-OG 3.21Å; P484-L490 HydrophobicContact CG-CD1 4.11Å
485	K	51.6	Low	67.3	Low	179 Å²	179	96.1 Å²	96.1	78%	0.778	46%	0.456	S	S	*	.			trans	-55.9	142.9	161.7	-66.1	-175.8	-179.6	-177.8	0	107.2	R483 F487 S488	R483-K485 PolarHBondContact O-N 3.23Å; K485-F487 PolarHBondContact O-N 2.9Å; K485-S488 PolarHBondContact N-OG 3.28Å; K485-S488 VanDerWaalsContact N-OG 3.14Å; K485-S488 PolarHBondContact O-N 3.26Å; K485-S488 PolarHBondContact O-OG 3.23Å
486	L	52.3	Low	67.6	Low	159 Å²	159	92.4 Å²	92.4	83%	0.832	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.8	130.6	169.5	-68.3	162.4	0	0	0	108.2
487	F	54.4	Low	67.6	Low	214 Å²	214	94.3 Å²	94.3	94%	0.939	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	6.4	-174.1	-40.7	-69.5	0	0	0	118.7	K485	K485-F487 PolarHBondContact O-N 2.9Å
488	S	52	Low	67.4	Low	47 Å²	47	94.6 Å²	94.6	33%	0.329	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-93.5	132.6	171.7	59.1	0	0	0	0	113.5	P484 K485 L490	P484-S488 VanDerWaalsContact CA-OG 3.29Å; P484-S488 WeakPolarHBondContact CA-OG 3.21Å; P484-S488 WeakPolarHBondContact CB-OG 3.21Å; K485-S488 PolarHBondContact N-OG 3.28Å; K485-S488 VanDerWaalsContact N-OG 3.14Å; K485-S488 PolarHBondContact O-N 3.26Å; K485-S488 PolarHBondContact O-OG 3.23Å; S488-L490 PolarHBondContact O-N 3.4Å
489	K	56.6	Low	67.1	Low	185 Å²	185	95.5 Å²	95.5	80%	0.804	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-68.4	122.2	-179	-175.7	177.2	-177.7	177.4	0	110.4	M491	K489-M491 PolarHBondContact O-N 3.4Å
490	L	58.7	Low	66.9	Low	136 Å²	136	95.8 Å²	95.8	71%	0.712	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-61.2	116.4	179.2	-163	76.1	0	0	0	110.6	P484 S488	P484-L490 HydrophobicContact CG-CD1 4.11Å; S488-L490 PolarHBondContact O-N 3.4Å
491	M	62.3	Low	67	Low	73 Å²	73	93.3 Å²	93.3	36%	0.36	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-85.3	138.6	173.4	-69.7	-134.6	159.5	0	0	111	L463 F464 K489	L463-M491 HydrophobicContact CB-CE 4.24Å; L463-M491 HydrophobicContact CB-SD 4.28Å; F464-M491 HydrophobicContact CE1-CB 4.2Å; F464-M491 HydrophobicContact CZ-CB 4.33Å; K489-M491 PolarHBondContact O-N 3.4Å
492	K	68.5	Low	67.2	Low	163 Å²	163	91.5 Å²	91.5	71%	0.709	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64.9	137.1	172.8	-69.1	-175.5	178.1	-176.5	0	109.2	F464	F464-K492 WeakPolarHBondContact CZ-O 3.37Å
493	P	74.6	Confident	68.2	Low	55 Å²	55	88.2 Å²	88.2	36%	0.357	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-65	143.4	179.1	29.5	-36.4	0	0	0	111	K478 I479 E480	K478-P493 HydrophobicContact CG-CB 4.13Å; I479-P493 VanDerWaalsContact O-CA 3.23Å; I479-P493 WeakPolarHBondContact O-CA 3.44Å; I479-P493 WeakPolarHBondContact O-CB 3.42Å; E480-P493 HydrophobicContact CG-CB 4Å
494	I	78.9	Confident	69.5	Low	47 Å²	47	77.2 Å²	77.2	24%	0.241	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.1	168.8	-62.2	169.6	0	0	0	106.9	F464 K478 I479 I496	F464-I494 HydrophobicContact CD2-CD1 4.09Å; F464-I494 HydrophobicContact CE2-CD1 3.46Å; F464-I494 VanDerWaalsContact CE2-CD1 3.46Å; F464-I494 HydrophobicContact CE2-CG1 3.65Å; F464-I494 HydrophobicContact CZ-CD1 4.12Å; F464-I494 HydrophobicContact CZ-CG1 3.87Å; K478-I494 CarbonylContact C-O 3.53Å; K478-I494 VanDerWaalsContact CA-O 3.3Å; K478-I494 WeakPolarHBondContact CA-O 3.47Å; I479-I494 HydrophobicContact CB-CB 4.24Å; I479-I494 HydrophobicContact CD1-CB 4.27Å; I479-I494 HydrophobicContact CD1-CD1 4.49Å; I479-I494 HydrophobicContact CD1-CG2 4.36Å; I479-I494 PolarHBondContact N-O 3.41Å; I479-I494 PolarHBondContact O-N 2.88Å; I479-I494 VanDerWaalsContact O-N 3.09Å; I494-I496 HydrophobicContact CG2-CD1 4.17Å; I494-I496 HydrophobicContact CG2-CG1 3.93Å
495	I	81.1	Confident	71.1	Confident	88 Å²	88	78 Å²	78	45%	0.451	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.7	174.5	-60.5	168.5	0	0	0	107.6	E476 K478	E476-I495 HydrophobicContact CB-CG2 4.11Å; E476-I495 WeakPolarHBondContact OE2-CG2 3.3Å; K478-I495 HydrophobicContact CB-CG1 4.47Å; K478-I495 HydrophobicContact CD-CG1 4.48Å; K478-I495 HydrophobicContact CG-CG1 3.99Å
496	I	80.6	Confident	72.6	Confident	12 Å²	12	71.4 Å²	71.4	6%	0.062	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.2	176.6	-58.5	177.6	0	0	0	107.6	E476 L477 I494 A500 I501 Y599 L720	E476-I496 WeakPolarHBondContact CA-O 3.47Å; L477-I496 HydrophobicContact CD2-CD1 4.43Å; L477-I496 PolarHBondContact N-O 3.35Å; L477-I496 PolarHBondContact O-N 2.89Å; I494-I496 HydrophobicContact CG2-CD1 4.17Å; I494-I496 HydrophobicContact CG2-CG1 3.93Å; I496-A500 HydrophobicContact CG2-CB 4.11Å; I496-I501 HydrophobicContact CG2-CD1 4.21Å; I496-I501 HydrophobicContact CG2-CG1 3.72Å; I496-Y599 HydrophobicContact CD1-CD1 4.18Å; I496-Y599 HydrophobicContact CD1-CD2 4Å; I496-Y599 HydrophobicContact CD1-CE1 4.35Å; I496-Y599 HydrophobicContact CD1-CE2 4.17Å; I496-Y599 HydrophobicContact CD1-CG 4.01Å; I496-Y599 HydrophobicContact CG2-CD2 4.35Å; I496-Y599 HydrophobicContact CG2-CG 4.49Å; I496-L720 HydrophobicContact CD1-CD1 3.68Å
497	Q	80.4	Confident	73.8	Confident	102 Å²	102	66.7 Å²	66.7	48%	0.477	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	140.1	173.2	-67.4	-64.4	-28.4	0	0	110.1	N475 N499 A500	N475-Q497 PolarHBondContact O-OE1 3.46Å; Q497-N499 PolarHBondContact O-N 3.4Å; Q497-N499 VanDerWaalsContact O-N 3.16Å; Q497-A500 WeakPolarHBondContact O-CB 3.39Å; Q497-A500 PolarHBondContact O-N 2.98Å
498	I	80.3	Confident	74.1	Confident	6 Å²	6	62.2 Å²	62.2	3%	0.031	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-57.5	-34.3	-176.4	-169.2	59.6	0	0	0	112.7	N475 A500 I501 I739 L740	N475-I498 WeakPolarHBondContact O-CB 3.45Å; N475-I498 WeakPolarHBondContact O-CG2 3.41Å; N475-I498 PolarHBondContact O-N 3.5Å; I498-A500 PolarHBondContact O-N 2.99Å; I498-I501 HydrophobicContact CD1-CB 4.49Å; I498-I501 HydrophobicContact CD1-CD1 4.12Å; I498-I501 WeakPolarHBondContact O-CB 3.42Å; I498-I501 PolarHBondContact O-N 3.31Å; I498-I739 HydrophobicContact CD1-CB 4.38Å; I498-I739 HydrophobicContact CD1-CG2 3.55Å; I498-I739 HydrophobicContact CG1-CG2 3.56Å; I498-L740 HydrophobicContact CD1-CD2 4.08Å; I498-L740 HydrophobicContact CD1-CG 4.49Å; I498-L740 HydrophobicContact CG1-CD2 4.5Å
499	N	76.2	Confident	73.6	Confident	73 Å²	73	64.3 Å²	64.3	39%	0.39	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.8	-28.6	176.4	-65.9	-7.4	0	0	0	113.2	Q497 Y603 S747	Q497-N499 PolarHBondContact O-N 3.4Å; Q497-N499 VanDerWaalsContact O-N 3.16Å; N499-Y603 HydrophobicContact CB-CD1 4.38Å; N499-Y603 HydrophobicContact CB-CE1 4.04Å; N499-Y603 WeakPolarHBondContact O-CE2 3.17Å; N499-S747 WeakPolarHBondContact O-CB 3.3Å; N499-S747 PolarHBondContact O-OG 3.43Å
500	A	78.9	Confident	72.4	Confident	8 Å²	8	58.7 Å²	58.7	7%	0.066	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-81.3	-14.1	177.4	0	0	0	0	0	112.9	I496 Q497 I498 Y599 I600 Y603	I496-A500 HydrophobicContact CG2-CB 4.11Å; Q497-A500 WeakPolarHBondContact O-CB 3.39Å; Q497-A500 PolarHBondContact O-N 2.98Å; I498-A500 PolarHBondContact O-N 2.99Å; A500-Y599 CarbonylContact O-C 3.58Å; A500-Y599 WeakPolarHBondContact O-CA 3.45Å; A500-Y599 WeakPolarHBondContact O-CB 3.4Å; A500-I600 PolarHBondContact O-N 2.91Å; A500-Y603 HydrophobicContact CB-CG 4.3Å
501	I	81.1	Confident	70.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.8	179.1	-56.1	-177.1	0	0	0	109.2	L477 I496 I498 I597 L740 S745	L477-I501 HydrophobicContact CB-CD1 3.81Å; L477-I501 HydrophobicContact CD1-CD1 3.98Å; L477-I501 HydrophobicContact CG-CD1 4.43Å; I496-I501 HydrophobicContact CG2-CD1 4.21Å; I496-I501 HydrophobicContact CG2-CG1 3.72Å; I498-I501 HydrophobicContact CD1-CB 4.49Å; I498-I501 HydrophobicContact CD1-CD1 4.12Å; I498-I501 WeakPolarHBondContact O-CB 3.42Å; I498-I501 PolarHBondContact O-N 3.31Å; I501-I597 HydrophobicContact CD1-CG2 4.45Å; I501-I597 HydrophobicContact CG2-CG2 3.91Å; I501-L740 HydrophobicContact CB-CD2 4.11Å; I501-L740 HydrophobicContact CG2-CD1 4.04Å; I501-L740 HydrophobicContact CG2-CD2 4.16Å; I501-L740 WeakPolarHBondContact O-CD2 3.32Å; I501-S745 PolarHBondContact O-OG 3.42Å
502	A	77.7	Confident	69.2	Low	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-44.8	-174.5	0	0	0	0	0	112.6	V598 F717 R748 Y751	A502-V598 HydrophobicContact CB-CB 4.41Å; A502-V598 HydrophobicContact CB-CG1 4.26Å; A502-V598 PolarHBondContact N-O 2.84Å; A502-F717 HydrophobicContact CB-CD1 3.81Å; A502-F717 HydrophobicContact CB-CE1 3.59Å; A502-R748 WeakPolarHBondContact O-CA 3.49Å; A502-R748 VanDerWaalsContact O-CB 3.3Å; A502-R748 WeakPolarHBondContact O-CB 3.5Å; A502-R748 WeakPolarHBondContact O-CG 3.29Å; A502-Y751 HydrophobicContact CB-CG 4.11Å
503	D	80.5	Confident	67.2	Low	11 Å²	11	63 Å²	63	6%	0.059	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	159	-178.4	-156.7	-0.3	0	0	0	112.1	V598 Y751 R755	D503-V598 HydrophobicContact CB-CB 4.23Å; D503-V598 HydrophobicContact CB-CG2 4.22Å; D503-V598 PolarHBondContact N-O 3.41Å; D503-V598 PolarHBondContact O-N 2.86Å; D503-Y751 HydrophobicContact CB-CD1 3.68Å; D503-Y751 HydrophobicContact CB-CE1 3.56Å; D503-Y751 VanDerWaalsContact OD2-CE1 3.27Å; D503-Y751 WeakPolarHBondContact OD2-CE1 3.33Å; D503-R755 IonicContact OD2-NH1 3.08Å; D503-R755 PolarHBondContact OD2-NH1 3.19Å; D503-R755 VanDerWaalsContact OD2-NH1 3.16Å
504	C	83.1	Confident	64.9	Low	4 Å²	4	66.1 Å²	66.1	3%	0.027	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	104.5	173.1	-170.2	0	0	0	0	109.9	R596 L736 N737	C504-R596 CarbonylContact C-O 3.56Å; C504-R596 VanDerWaalsContact CA-O 3.32Å; C504-R596 WeakPolarHBondContact CA-O 3.46Å; C504-L736 HydrophobicContact CB-CB 3.93Å; C504-L736 HydrophobicContact CB-CD1 4.1Å; C504-N737 PolarHBondContact O-ND2 3.47Å
505	E	82.7	Confident	62.3	Low	75 Å²	75	66.9 Å²	66.9	35%	0.35	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.4	-169.5	-173.8	166.5	-165.1	0	0	111.8	F595 R596 R755	E505-F595 WeakPolarHBondContact O-CA 3.39Å; E505-R596 PolarHBondContact N-O 3.43Å; E505-R596 PolarHBondContact O-N 2.86Å; E505-R755 VanDerWaalsContact CD-NH2 3.31Å; E505-R755 IonicContact OE1-CZ 2.65Å; E505-R755 IonicContact OE1-NH1 3.7Å; E505-R755 IonicContact OE1-NH2 3.46Å; E505-R755 PolarHBondContact OE1-NH2 3.14Å; E505-R755 IonicContact OE2-CZ 3.71Å; E505-R755 IonicContact OE2-NH1 3.35Å; E505-R755 PolarHBondContact OE2-NH1 2.73Å; E505-R755 IonicContact OE2-NH2 4Å; E505-R755 PolarHBondContact OE2-NH2 3.23Å; E505-R755 VanDerWaalsContact OE2-NH2 3.08Å
506	L	82.9	Confident	59.9	Low	41 Å²	41	70.9 Å²	70.9	22%	0.215	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.9	173.2	-142.6	86.1	0	0	0	108.9	T508 T593 F595 A729	L506-T508 PolarHBondContact O-N 3.02Å; L506-T593 HydrophobicContact CD1-CG2 4.2Å; L506-T593 HydrophobicContact CD2-CG2 4.37Å; L506-T593 HydrophobicContact CG-CG2 4.29Å; L506-F595 HydrophobicContact CD1-CB 4.19Å; L506-A729 HydrophobicContact CD1-CB 3.73Å
507	I	77.9	Confident	57.4	Low	61 Å²	61	78.2 Å²	78.2	31%	0.313	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	101.9	177.4	-55.5	176.4	0	0	0	107.7	S509 Q594 R596	I507-S509 PolarHBondContact O-N 3.28Å; I507-Q594 HydrophobicContact CB-CB 4.14Å; I507-Q594 HydrophobicContact CD1-CB 4.15Å; I507-Q594 PolarHBondContact N-O 3.15Å; I507-R596 HydrophobicContact CD1-CB 4.19Å; I507-R596 HydrophobicContact CG1-CB 4.33Å
508	T	61.1	Low	55	Low	119 Å²	119	81.1 Å²	81.1	73%	0.73	48%	0.476	S	S	*	.			trans	-66.6	128.2	168.9	44.5	0	0	0	0	109.5	L506 G510	L506-T508 PolarHBondContact O-N 3.02Å; T508-G510 PolarHBondContact O-N 3.06Å
509	S	42.4	Very low	52.5	Low	92 Å²	92	87.6 Å²	87.6	64%	0.643	50%	0.504	S	S	*	.			trans	-76.4	73.6	175.8	59.8	0	0	0	0	110.2	I507 Y511	I507-S509 PolarHBondContact O-N 3.28Å; S509-Y511 PolarHBondContact O-N 3.18Å; S509-Y511 VanDerWaalsContact O-N 3.14Å
510	G	30.5	Very low	50.1	Low	66 Å²	66	87.7 Å²	87.7	68%	0.68	51%	0.509	S	S	*	.			trans	-64.9	109.4	169.9	0	0	0	0	0	109.8	T508 S512	T508-G510 PolarHBondContact O-N 3.06Å; G510-S512 PolarHBondContact O-N 2.74Å
511	Y	27.7	Very low	47.7	Very low	215 Å²	215	92 Å²	92	84%	0.843	54%	0.538	S	S	*	.			trans	-68.9	78.9	170.6	-63.2	-86.4	0	0	0	109.7	S509	S509-Y511 PolarHBondContact O-N 3.18Å; S509-Y511 VanDerWaalsContact O-N 3.14Å
512	S	27	Very low	45.1	Very low	108 Å²	108	100.2 Å²	100.2	76%	0.755	58%	0.578	S	S	*	*			trans	-98.2	108.1	170.9	-167.3	0	0	0	0	109.7	G510 C514	G510-S512 PolarHBondContact O-N 2.74Å; S512-C514 PolarHBondContact O-N 2.72Å; S512-C514 VanDerWaalsContact O-N 3.1Å
513	T	25.3	Very low	42.9	Very low	140 Å²	140	107.9 Å²	107.9	86%	0.859	62%	0.618	S	S	*	*			trans	-83.6	72	-177.2	42.7	0	0	0	0	112.4
514	C	25.9	Very low	40.4	Very low	121 Å²	121	112.5 Å²	112.5	82%	0.818	65%	0.647	S	S	*	*			trans	-161.9	128.9	150.7	-96.5	0	0	0	0	107.5	S512	S512-C514 PolarHBondContact O-N 2.72Å; S512-C514 VanDerWaalsContact O-N 3.1Å
515	G	25.7	Very low	37.7	Very low	62 Å²	62	119.1 Å²	119.1	64%	0.639	68%	0.681	S	S	*	*			cis	102.9	115.2	22.9	0	0	0	0	0	108.7
516	I	30.4	Very low	35.3	Very low	172 Å²	172	121.2 Å²	121.2	88%	0.882	70%	0.7	S	S	*	*			trans	83.2	120.4	175.2	-54.7	167.3	0	0	0	114.8
517	M	28.4	Very low	32.7	Very low	167 Å²	167	125.3 Å²	125.3	82%	0.823	73%	0.726	S	S	*	*			trans	-62.3	153.8	167	-62.1	133.9	54.9	0	0	110.4
518	D	28.4	Very low	30.6	Very low	163 Å²	163	126.7 Å²	126.7	87%	0.872	74%	0.742	S	S	*	*				-163.3	149	128	-100.1	-29.8	0	0	0	113.5
519	K	27.8	Very low	29.3	Very low	142 Å²	142	127.7 Å²	127.7	62%	0.617	75%	0.748	S	S	*	*			trans	-97.1	154.7	174.8	-117.8	-169	162.9	-170	0	110	N709	K519-N709 PolarHBondContact NZ-O 3.2Å
520	P	27.1	Very low	28.8	Very low	75 Å²	75	130.1 Å²	130.1	49%	0.487	75%	0.753	S	S	.	*			trans	-97.2	141	-156.7	36	-35.3	0	0	0	115.1	N711	P520-N711 HydrophobicContact CG-CB 4.1Å; P520-N711 PolarHBondContact O-ND2 2.94Å
521	S	27.7	Very low	28.7	Very low	97 Å²	97	134 Å²	134	68%	0.678	76%	0.764	S	S	*	*			trans	-167.1	138.4	143.5	57.6	0	0	0	0	113.4
522	M	27.4	Very low	28.7	Very low	173 Å²	173	129.7 Å²	129.7	85%	0.852	76%	0.76	S	S	*	*			trans	58.2	104.9	141.1	-70.8	-74.5	176.4	0	0	118.9
523	I	31.1	Very low	29	Very low	162 Å²	162	130.6 Å²	130.6	83%	0.831	76%	0.761	S	S	*	*				178.9	143.7	103.7	-89.2	151.7	0	0	0	111.3
524	T	27.5	Very low	29.4	Very low	108 Å²	108	129.8 Å²	129.8	66%	0.663	76%	0.757	S	S	*	*			trans	-78.7	150.4	178.9	44.6	0	0	0	0	114.6
525	N	27.4	Very low	29.6	Very low	142 Å²	142	130.3 Å²	130.3	76%	0.759	76%	0.756	S	S	*	*			trans	70	151	161.7	-46.8	-25.3	0	0	0	114.2
526	T	31.7	Very low	29.9	Very low	120 Å²	120	135 Å²	135	74%	0.736	77%	0.767	S	S	*	*			cis	-162.7	130.1	26.7	-30	0	0	0	0	110.9
527	T	29.2	Very low	30	Very low	126 Å²	126	131.4 Å²	131.4	77%	0.773	76%	0.763	S	S	*	*			trans	53.9	145.7	138.5	-47.9	0	0	0	0	124.5
528	S	32.2	Very low	30.4	Very low	91 Å²	91	129.9 Å²	129.9	64%	0.636	76%	0.763	S	S	*	*			trans	79	110.6	151.9	49.6	0	0	0	0	122.8
529	T	34.6	Very low	30.6	Very low	139 Å²	139	129 Å²	129	85%	0.853	76%	0.759	S	S	*	*				-164.7	96.4	114.1	40.4	0	0	0	0	108
530	N	31.3	Very low	31	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	76%	0.763	S	S	*	*				56	100.5	88.5	-77.3	3.8	0	0	0	116.8
531	T	29.5	Very low	31.4	Very low	147 Å²	147	130.8 Å²	130.8	90%	0.902	77%	0.77	S	S	*	*				-153.1	134.7	122.2	19.9	0	0	0	0	110.7
532	T	28	Very low	31.7	Very low	125 Å²	125	132.6 Å²	132.6	77%	0.767	77%	0.773	S	S	*	*			trans	-154.4	178.9	177.5	-31.2	0	0	0	0	106.7
533	T	33.7	Very low	32	Very low	127 Å²	127	129.9 Å²	129.9	78%	0.779	77%	0.771	S	S	*	*			trans	78.4	139	-174.5	76.1	0	0	0	0	113.8
534	T	32.3	Very low	32	Very low	124 Å²	124	127.1 Å²	127.1	76%	0.761	77%	0.765	S	S	*	*			cis	-158.2	143.6	-2.6	2.5	0	0	0	0	109.7
535	T	31.2	Very low	32.4	Very low	132 Å²	132	128.6 Å²	128.6	81%	0.81	77%	0.768	S	S	*	*			trans	-120.5	127.6	160.1	40.5	0	0	0	0	109.2
536	N	30.9	Very low	32.6	Very low	160 Å²	160	128.3 Å²	128.3	86%	0.856	77%	0.767	S	S	*	*			trans	-167.6	144.7	166.6	-105.8	-23.6	0	0	0	110.3
537	A	33.7	Very low	32.6	Very low	97 Å²	97	130.8 Å²	130.8	80%	0.802	77%	0.77	S	S	*	*			trans	66.2	141.9	-174.1	0	0	0	0	0	114.5
538	T	35.2	Very low	32.9	Very low	134 Å²	134	132 Å²	132	82%	0.822	77%	0.765	S	S	*	*			cis	-135.1	152.6	17.8	35.9	0	0	0	0	114
539	N	34.2	Very low	32.8	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	77%	0.765	S	S	*	*			trans	-73	145.4	167.7	-59.1	-32.9	0	0	0	111.5
540	N	35.1	Very low	32.8	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	76%	0.761	S	S	*	*				166.5	121.1	108.3	-88.3	-25.1	0	0	0	114.3
541	N	35.6	Very low	32.6	Very low	121 Å²	121	137 Å²	137	65%	0.647	77%	0.765	S	S	*	*			trans	62.4	107.8	130.3	-54.4	-15.8	0	0	0	122.6
542	N	34	Very low	32.7	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	77%	0.766	S	S	*	*				69.8	125.4	117.2	-57.8	-10.1	0	0	0	122.4
543	S	34.1	Very low	32.8	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	76%	0.761	S	S	*	*			trans	60.2	152.6	136.7	61.3	0	0	0	0	119.7
544	S	30.2	Very low	32.9	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	76%	0.761	S	S	*	*			cis	-174.7	178.7	-20.8	-168.2	0	0	0	0	105.7
545	I	35.3	Very low	32.9	Very low	139 Å²	139	137.6 Å²	137.6	71%	0.713	76%	0.758	S	S	*	*			trans	74.3	108.1	156.5	-69.9	159.3	0	0	0	117.7
546	D	32.6	Very low	33	Very low	137 Å²	137	138 Å²	138	73%	0.733	76%	0.755	S	S	*	*				60.5	118.7	121.1	-49.5	-27.2	0	0	0	123.8
547	E	31.5	Very low	33.1	Very low	171 Å²	171	138.7 Å²	138.7	80%	0.799	75%	0.751	S	S	*	*				80.7	162.2	121.9	-144	-178.4	-156.8	0	0	121.7
548	F	34.7	Very low	32.9	Very low	152 Å²	152	139 Å²	139	67%	0.667	74%	0.743	S	S	*	*			trans	76.8	91.2	170	-81.6	-94.6	0	0	0	122
549	N	30.9	Very low	32.8	Very low	122 Å²	122	140.2 Å²	140.2	65%	0.652	75%	0.745	S	S	*	*				66.8	142.7	107.1	-88.4	-50.4	0	0	0	124.4
550	Q	34.5	Very low	32.5	Very low	164 Å²	164	140.8 Å²	140.8	77%	0.766	75%	0.747	S	S	*	*			trans	78.4	92.2	146.6	-71.2	176.7	45.7	0	0	122.1
551	K	27.9	Very low	32.3	Very low	193 Å²	193	142.9 Å²	142.9	84%	0.839	76%	0.758	S	S	*	*				47.9	107.5	102.8	-169.8	-174.9	-171.8	-179.7	0	118.1
552	F	31.2	Very low	31.8	Very low	213 Å²	213	142.6 Å²	142.6	93%	0.934	77%	0.765	S	S	*	*			trans	-143.1	163.7	143	-107.5	-77.9	0	0	0	112.5
553	S	30.3	Very low	31.7	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	77%	0.77	S	S	*	*			trans	-111.6	-178.4	-154.4	52.8	0	0	0	0	115.1
554	S	34.8	Very low	31.4	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	77%	0.768	S	S	*	*			trans	95.2	147.9	157.3	83.7	0	0	0	0	117.3
555	V	34	Very low	31.3	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.715	78%	0.777	S	S	*	*			cis	-178	149.1	-34	125.6	0	0	0	0	108.1
556	N	32.6	Very low	30.9	Very low	140 Å²	140	149.6 Å²	149.6	75%	0.749	78%	0.779	S	S	*	*			trans	65.2	157.9	170.2	-65.1	-22.5	0	0	0	116.9
557	K	33.4	Very low	30.9	Very low	175 Å²	175	149.8 Å²	149.8	76%	0.761	78%	0.778	S	S	*	*			cis	-157.9	155.8	-12	-125.9	-178.8	173.9	-177	0	109.9
558	T	29.2	Very low	30.8	Very low	104 Å²	104	151.1 Å²	151.1	64%	0.638	78%	0.782	S	S	*	*			trans	9.1	133	149.6	56	0	0	0	0	120.7
559	D	32.1	Very low	30.6	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	79%	0.787	S	S	*	*				-173.7	153.3	103.1	-88	-24.1	0	0	0	113.6
560	N	27.8	Very low	30.6	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	79%	0.794	S	S	*	*			trans	-85.3	150.2	177.8	-66.2	-44.7	0	0	0	111.6
561	L	32.6	Very low	30.4	Very low	176 Å²	176	149.1 Å²	149.1	92%	0.921	80%	0.795	S	S	*	*			trans	-169.6	131.7	141.7	-106.5	149.2	0	0	0	112.6
562	S	23.8	Very low	30.5	Very low	115 Å²	115	149.3 Å²	149.3	80%	0.804	80%	0.796	S	S	*	*			trans	-90.3	149	175.1	-40.1	0	0	0	0	111.6
563	S	32.3	Very low	30.4	Very low	118 Å²	118	145.4 Å²	145.4	83%	0.825	79%	0.79	S	S	*	*			trans	-168.7	144.9	142.2	-137.9	0	0	0	0	112.9
564	D	27.8	Very low	30.5	Very low	145 Å²	145	150.1 Å²	150.1	78%	0.775	80%	0.799	S	S	*	*			trans	-71.9	152	176.7	-56	-75.7	0	0	0	113.2
565	Y	29.2	Very low	30.2	Very low	229 Å²	229	152.1 Å²	152.1	90%	0.898	80%	0.801	S	S	*	*			trans	-146.6	112.9	151.2	-106.5	-80.4	0	0	0	111.8
566	I	26.5	Very low	30	Very low	150 Å²	150	156.3 Å²	156.3	77%	0.769	81%	0.809	S	S	*	*			trans	-80.3	140.9	161.3	-63.6	171.6	0	0	0	107.9
567	I	32.7	Very low	29.9	Very low	140 Å²	140	157.9 Å²	157.9	72%	0.718	81%	0.812	S	S	*	*			trans	176.8	119.6	137.4	-90	150.8	0	0	0	111.8
568	K	29.2	Very low	29.7	Very low	200 Å²	200	157 Å²	157	87%	0.87	81%	0.81	S	S	*	*			trans	21.7	134.4	146.5	-52.4	175	178.2	177.8	0	120.8
569	G	30.6	Very low	29.7	Very low	75 Å²	75	159.2 Å²	159.2	77%	0.773	82%	0.816	S	S	*	*			trans	170.8	77.5	155.1	0	0	0	0	0	119.6
570	N	30.6	Very low	29.7	Very low	148 Å²	148	156.3 Å²	156.3	79%	0.791	80%	0.804	S	S	*	*			trans	39.9	120.9	149.6	-67.8	-5.5	0	0	0	123.3
571	H	29.2	Very low	29.8	Very low	173 Å²	173	154.2 Å²	154.2	80%	0.801	80%	0.797	S	S	*	*			trans	40.8	108.6	133.7	-66.1	-83	0	0	0	120.6
572	K	31.6	Very low	29.7	Very low	197 Å²	197	154.7 Å²	154.7	86%	0.857	80%	0.795	S	S	*	*				-150.9	119.6	127	-114	169.2	-173.6	176.5	0	110.9
573	T	28.6	Very low	30	Very low	130 Å²	130	157.7 Å²	157.7	80%	0.798	80%	0.797	S	S	*	*			trans	-70.8	129.6	173.4	40.2	0	0	0	0	110.5
574	F	32	Very low	29.9	Very low	194 Å²	194	157.4 Å²	157.4	85%	0.851	80%	0.795	S	S	*	*			trans	-122	119.6	166.2	-112.5	-86.5	0	0	0	109.3	K576	F574-K576 PolarHBondContact O-N 2.9Å
575	N	28.5	Very low	30.1	Very low	152 Å²	152	155.9 Å²	155.9	81%	0.813	80%	0.795	S	S	*	*			trans	-62.5	126.1	174.9	-80.8	-20.6	0	0	0	109.9
576	K	30.4	Very low	30.2	Very low	206 Å²	206	153.9 Å²	153.9	90%	0.896	79%	0.791	S	S	*	*			trans	-108.3	109.6	163.4	-150.1	176.1	-173.1	-176.2	0	106.9	F574 H578	F574-K576 PolarHBondContact O-N 2.9Å; K576-H578 PolarHBondContact O-N 2.9Å; K576-H578 VanDerWaalsContact O-N 3.16Å
577	H	29.9	Very low	30.5	Very low	173 Å²	173	149.9 Å²	149.9	80%	0.801	78%	0.776	S	S	*	*			trans	-60.9	117.6	177.9	-83	-87.6	0	0	0	109.7	I579	H577-I579 PolarHBondContact O-N 3.06Å
578	H	28.6	Very low	30.6	Very low	156 Å²	156	153.2 Å²	153.2	72%	0.722	79%	0.786	S	S	*	*			trans	-83.5	111.3	171.1	-163.6	-86	0	0	0	108.4	K576 T580	K576-H578 PolarHBondContact O-N 2.9Å; K576-H578 VanDerWaalsContact O-N 3.16Å; H578-T580 PolarHBondContact ND1-OG1 2.87Å; H578-T580 PolarHBondContact O-N 3.33Å; H578-T580 VanDerWaalsContact O-N 3.16Å
579	I	30.1	Very low	31.2	Very low	150 Å²	150	148.3 Å²	148.3	77%	0.769	77%	0.773	S	S	*	*			trans	-79.3	93.5	167.6	-63.3	174.3	0	0	0	106	H577 T581	H577-I579 PolarHBondContact O-N 3.06Å; I579-T581 PolarHBondContact O-N 2.84Å
580	T	31	Very low	32	Very low	98 Å²	98	148.4 Å²	148.4	60%	0.601	76%	0.762	S	S	*	*			trans	-81.7	97	177.6	-42	0	0	0	0	109.3	H578 E582	H578-T580 PolarHBondContact ND1-OG1 2.87Å; H578-T580 PolarHBondContact O-N 3.33Å; H578-T580 VanDerWaalsContact O-N 3.16Å; T580-E582 PolarHBondContact O-N 3.41Å
581	T	31.3	Very low	33.4	Very low	113 Å²	113	147.1 Å²	147.1	69%	0.693	75%	0.75	S	S	*	*			trans	-69.1	110.4	166.9	-47.7	0	0	0	0	108.3	I579 Q583	I579-T581 PolarHBondContact O-N 2.84Å; T581-Q583 PolarHBondContact O-N 3.19Å
582	E	29.5	Very low	35.6	Very low	187 Å²	187	145.3 Å²	145.3	87%	0.874	74%	0.74	S	S	*	*			trans	-69.6	88.2	178.5	-72.3	-167.6	147	0	0	111.6	T580	T580-E582 PolarHBondContact O-N 3.41Å
583	Q	29.8	Very low	37.9	Very low	178 Å²	178	136.9 Å²	136.9	83%	0.832	71%	0.705	S	S	*	*			trans	-104.8	85.7	155.7	-73.5	-167.4	-4.6	0	0	109.2	T581	T581-Q583 PolarHBondContact O-N 3.19Å
584	S	30.9	Very low	40.6	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	69%	0.685	S	S	*	*			trans	-112.9	70.9	168.9	-167.7	0	0	0	0	110.4
585	S	31.1	Very low	43.2	Very low	112 Å²	112	125.3 Å²	125.3	78%	0.783	65%	0.645	S	S	*	*			trans	-99.5	66.8	174.8	-64.5	0	0	0	0	110.4
586	K	31.2	Very low	46	Very low	187 Å²	187	121.7 Å²	121.7	81%	0.813	62%	0.62	S	S	*	*			trans	-169.5	59.7	169	-105.8	154.1	-171	-175.6	0	112.8
587	S	34.8	Very low	48.6	Very low	66 Å²	66	111.9 Å²	111.9	46%	0.462	58%	0.577	S	S	.	*			trans	-165.4	100	160.8	177.8	0	0	0	0	110.6	V589	S587-V589 PolarHBondContact O-N 3.33Å; S587-V589 WeakPolarHBondContact OG-CG2 3.49Å; S587-V589 PolarHBondContact OG-N 3.26Å
588	F	34.3	Very low	51.2	Low	210 Å²	210	103.6 Å²	103.6	92%	0.921	54%	0.539	S	S	*	.			trans	-89.5	36.1	168	-109.4	-81.2	0	0	0	111.5
589	V	40.8	Very low	53.9	Low	98 Å²	98	98.3 Å²	98.3	59%	0.594	51%	0.513	S	S	*	.			trans	-66.9	142.8	166.9	177.2	0	0	0	0	108.4	S587 H591	S587-V589 PolarHBondContact O-N 3.33Å; S587-V589 WeakPolarHBondContact OG-CG2 3.49Å; S587-V589 PolarHBondContact OG-N 3.26Å; V589-H591 PolarHBondContact O-CD2 3.48Å; V589-H591 PolarHBondContact O-N 3.03Å
590	S	48.1	Very low	56.3	Low	77 Å²	77	91.2 Å²	91.2	54%	0.538	48%	0.477	S	S	.	.			trans	-70.1	67.4	-169.7	175.8	0	0	0	0	113.7	K592 Q725	S590-K592 PolarHBondContact O-N 3.22Å; S590-K592 VanDerWaalsContact O-N 3.16Å; S590-Q725 PolarHBondContact OG-NE2 2.77Å
591	H	60.3	Low	58.3	Low	120 Å²	120	88.4 Å²	88.4	56%	0.556	46%	0.46	S	S	*	.			trans	-64.9	113.5	172.6	-64	-70.8	0	0	0	109.9	V589 W726	V589-H591 PolarHBondContact O-CD2 3.48Å; V589-H591 PolarHBondContact O-N 3.03Å; H591-W726 PolarHBondContact O-N 3.07Å
592	K	74.4	Confident	60.1	Low	136 Å²	136	87.1 Å²	87.1	59%	0.591	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	133.8	166	-61.7	-176.8	-176.8	178.2	0	108.2	S590 E723 T724	S590-K592 PolarHBondContact O-N 3.22Å; S590-K592 VanDerWaalsContact O-N 3.16Å; K592-E723 HydrophobicContact CB-CG 3.91Å; K592-E723 WeakPolarHBondContact CB-OE1 3.13Å; K592-E723 HydrophobicContact CD-CG 4.15Å; K592-E723 WeakPolarHBondContact CD-OE1 3.23Å; K592-E723 IonicContact NZ-OE1 3.75Å; K592-T724 CarbonylContact C-O 3.42Å; K592-T724 WeakPolarHBondContact CA-O 3.42Å
593	T	80.7	Confident	62	Low	20 Å²	20	79.5 Å²	79.5	12%	0.123	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	155.8	173.7	-157.6	0	0	0	0	109.4	L506 E723 T724 W726 A729	L506-T593 HydrophobicContact CD1-CG2 4.2Å; L506-T593 HydrophobicContact CD2-CG2 4.37Å; L506-T593 HydrophobicContact CG-CG2 4.29Å; T593-E723 WeakPolarHBondContact O-CA 3.44Å; T593-T724 PolarHBondContact N-O 3.42Å; T593-T724 PolarHBondContact O-N 3.45Å; T593-T724 VanDerWaalsContact O-O 3.09Å; T593-W726 HydrophobicContact CG2-CB 4.26Å; T593-W726 HydrophobicContact CG2-CG 4.48Å; T593-A729 HydrophobicContact CG2-CB 3.24Å
594	Q	85.8	Confident	63.7	Low	81 Å²	81	77.4 Å²	77.4	38%	0.379	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	144.1	175.2	-58.4	-172.8	-0.4	0	0	109.6	L460 I507 F722 E723	L460-Q594 HydrophobicContact CD1-CB 4.27Å; L460-Q594 VanDerWaalsContact CD1-CD 3.46Å; L460-Q594 HydrophobicContact CD1-CG 3.82Å; I507-Q594 HydrophobicContact CB-CB 4.14Å; I507-Q594 HydrophobicContact CD1-CB 4.15Å; I507-Q594 PolarHBondContact N-O 3.15Å; Q594-F722 CarbonylContact C-O 3.44Å; Q594-F722 WeakPolarHBondContact CA-O 2.9Å; Q594-E723 HydrophobicContact CG-CB 4.31Å; Q594-E723 HydrophobicContact CG-CG 4.45Å
595	F	86.1	Confident	65.5	Low	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	155	172.3	72.7	-87.1	0	0	0	110.3	V457 L470 E505 L506 I597 F722 T724 A729 I732	V457-F595 HydrophobicContact CB-CE1 4.49Å; V457-F595 HydrophobicContact CG1-CE1 4.08Å; V457-F595 HydrophobicContact CG1-CZ 4.08Å; L470-F595 HydrophobicContact CD2-CE2 4.3Å; L470-F595 HydrophobicContact CD2-CZ 4.06Å; E505-F595 WeakPolarHBondContact O-CA 3.39Å; L506-F595 HydrophobicContact CD1-CB 4.19Å; F595-I597 HydrophobicContact CD2-CG1 4.35Å; F595-I597 HydrophobicContact CE2-CD1 4.21Å; F595-I597 HydrophobicContact CE2-CG1 4.16Å; F595-F722 HydrophobicContact CD1-CB 3.9Å; F595-F722 HydrophobicContact CD2-CB 4.39Å; F595-F722 HydrophobicContact CD2-CD2 4.22Å; F595-F722 HydrophobicContact CE1-CB 3.39Å; F595-F722 HydrophobicContact CE1-CG 4.24Å; F595-F722 HydrophobicContact CE2-CB 3.92Å; F595-F722 AromaticContact CE2-CD2 3.59Å; F595-F722 HydrophobicContact CE2-CD2 3.59Å; F595-F722 HydrophobicContact CE2-CE2 4.38Å; F595-F722 HydrophobicContact CE2-CG 4.01Å; F595-F722 HydrophobicContact CG-CB 4.38Å; F595-F722 HydrophobicContact CZ-CB 3.39Å; F595-F722 AromaticContact CZ-CD2 3.82Å; F595-F722 HydrophobicContact CZ-CD2 3.82Å; F595-F722 AromaticContact CZ-CG 3.73Å; F595-F722 HydrophobicContact CZ-CG 3.73Å; F595-F722 PolarHBondContact N-O 2.98Å; F595-F722 PolarHBondContact O-N 3.06Å; F595-T724 HydrophobicContact CD1-CG2 4.17Å; F595-T724 HydrophobicContact CE1-CG2 3.77Å; F595-A729 HydrophobicContact CB-CB 4.45Å; F595-A729 HydrophobicContact CD1-CB 3.78Å; F595-A729 HydrophobicContact CE1-CB 4.46Å; F595-A729 HydrophobicContact CG-CB 4.41Å; F595-I732 HydrophobicContact CD2-CG2 4.25Å; F595-I732 HydrophobicContact CE1-CD1 4.01Å; F595-I732 HydrophobicContact CE2-CG2 3.62Å; F595-I732 HydrophobicContact CZ-CD1 3.76Å; F595-I732 HydrophobicContact CZ-CG2 3.93Å
596	R	86.4	Confident	67.1	Low	75 Å²	75	74.6 Å²	74.6	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.9	-174.5	162.6	172.7	-73.9	-170.6	-11.3	110.6	C504 E505 I507 V598 Q719 L720	C504-R596 CarbonylContact C-O 3.56Å; C504-R596 VanDerWaalsContact CA-O 3.32Å; C504-R596 WeakPolarHBondContact CA-O 3.46Å; E505-R596 PolarHBondContact N-O 3.43Å; E505-R596 PolarHBondContact O-N 2.86Å; I507-R596 HydrophobicContact CD1-CB 4.19Å; I507-R596 HydrophobicContact CG1-CB 4.33Å; R596-V598 HydrophobicContact CG-CG2 3.92Å; R596-Q719 HydrophobicContact CG-CB 4.42Å; R596-Q719 VanDerWaalsContact NH2-OE1 3.07Å; R596-L720 CarbonylContact C-O 3.54Å; R596-L720 VanDerWaalsContact CA-O 3.27Å; R596-L720 WeakPolarHBondContact CA-O 3.49Å
597	I	86.4	Confident	68.7	Low	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.9	168	-52.6	-175.7	0	0	0	108.1	L470 L477 I501 F595 Q719 L720 F722 L736	L470-I597 HydrophobicContact CD2-CD1 4.46Å; L477-I597 HydrophobicContact CD1-CD1 3.57Å; I501-I597 HydrophobicContact CD1-CG2 4.45Å; I501-I597 HydrophobicContact CG2-CG2 3.91Å; F595-I597 HydrophobicContact CD2-CG1 4.35Å; F595-I597 HydrophobicContact CE2-CD1 4.21Å; F595-I597 HydrophobicContact CE2-CG1 4.16Å; I597-Q719 WeakPolarHBondContact O-CA 3.39Å; I597-L720 HydrophobicContact CB-CB 4.41Å; I597-L720 PolarHBondContact N-O 3.01Å; I597-L720 PolarHBondContact O-N 3.18Å; I597-F722 HydrophobicContact CD1-CD2 4.39Å; I597-F722 HydrophobicContact CD1-CE2 3.77Å; I597-F722 HydrophobicContact CG1-CD2 4.34Å; I597-F722 HydrophobicContact CG1-CE2 3.98Å; I597-L736 HydrophobicContact CD1-CD1 3.74Å; I597-L736 HydrophobicContact CG1-CD1 4.25Å
598	V	83.8	Confident	70.3	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.8	178.1	-170.3	0	0	0	0	108.8	A502 D503 R596 F717 H718 Q719 Y751	A502-V598 HydrophobicContact CB-CB 4.41Å; A502-V598 HydrophobicContact CB-CG1 4.26Å; A502-V598 PolarHBondContact N-O 2.84Å; D503-V598 HydrophobicContact CB-CB 4.23Å; D503-V598 HydrophobicContact CB-CG2 4.22Å; D503-V598 PolarHBondContact N-O 3.41Å; D503-V598 PolarHBondContact O-N 2.86Å; R596-V598 HydrophobicContact CG-CG2 3.92Å; V598-F717 HydrophobicContact CG1-CB 3.7Å; V598-F717 HydrophobicContact CG1-CD1 3.93Å; V598-F717 HydrophobicContact CG1-CG 4.1Å; V598-H718 WeakPolarHBondContact CA-O 3.33Å; V598-Q719 HydrophobicContact CG1-CG 4.46Å; V598-Q719 HydrophobicContact CG2-CG 4.4Å; V598-Y751 HydrophobicContact CG1-CD2 4.16Å; V598-Y751 HydrophobicContact CG1-CE2 3.89Å
599	Y	85.1	Confident	72.3	Confident	45 Å²	45	66 Å²	66	18%	0.176	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	157.9	-177.8	75.2	-77.4	0	0	0	112.5	I496 A500 P601 H718 L720	I496-Y599 HydrophobicContact CD1-CD1 4.18Å; I496-Y599 HydrophobicContact CD1-CD2 4Å; I496-Y599 HydrophobicContact CD1-CE1 4.35Å; I496-Y599 HydrophobicContact CD1-CE2 4.17Å; I496-Y599 HydrophobicContact CD1-CG 4.01Å; I496-Y599 HydrophobicContact CG2-CD2 4.35Å; I496-Y599 HydrophobicContact CG2-CG 4.49Å; A500-Y599 CarbonylContact O-C 3.58Å; A500-Y599 WeakPolarHBondContact O-CA 3.45Å; A500-Y599 WeakPolarHBondContact O-CB 3.4Å; Y599-P601 HydrophobicContact CE2-CB 4.16Å; Y599-H718 HydrophobicContact CD1-CB 4.08Å; Y599-H718 WeakPolarHBondContact CD1-O 3.42Å; Y599-H718 HydrophobicContact CE1-CB 3.52Å; Y599-H718 HydrophobicContact CE2-CB 4.13Å; Y599-H718 PolarHBondContact N-O 3.39Å; Y599-H718 PolarHBondContact O-N 2.94Å; Y599-L720 HydrophobicContact CD1-CD1 4.49Å; Y599-L720 HydrophobicContact CD1-CG 4.09Å; Y599-L720 HydrophobicContact CE1-CD1 4.31Å; Y599-L720 HydrophobicContact CE1-CD2 3.9Å; Y599-L720 HydrophobicContact CE1-CG 3.69Å
600	I	80.7	Confident	73.6	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.313	C	S	.	.			trans	-97.8	115.8	172.9	-58.9	178.4	0	0	0	108.3	A500 I610 L716 F717	A500-I600 PolarHBondContact O-N 2.91Å; I600-I610 HydrophobicContact CD1-CD1 3.75Å; I600-L716 HydrophobicContact CD1-CD2 3.82Å; I600-L716 HydrophobicContact CD1-CG 4.33Å; I600-L716 HydrophobicContact CG1-CD2 4.35Å; I600-L716 HydrophobicContact CG1-CG 4.37Å; I600-L716 HydrophobicContact CG2-CD1 4.39Å; I600-L716 HydrophobicContact CG2-CG 4.13Å; I600-F717 HydrophobicContact CD1-CD1 4.3Å; I600-F717 HydrophobicContact CD1-CE1 3.62Å; I600-F717 HydrophobicContact CD1-CZ 4.11Å; I600-F717 HydrophobicContact CG1-CD1 3.65Å; I600-F717 HydrophobicContact CG1-CE1 3.48Å; I600-F717 VanDerWaalsContact CG1-CE1 3.48Å; I600-F717 HydrophobicContact CG1-CZ 4.34Å
601	P	73.2	Confident	74.6	Confident	38 Å²	38	60.2 Å²	60.2	25%	0.247	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	146.7	171.2	31.8	-34.9	0	0	0	110	Y599 Y603 L716 H718	Y599-P601 HydrophobicContact CE2-CB 4.16Å; P601-Y603 VanDerWaalsContact C-N 3.3Å; P601-Y603 PolarHBondContact O-N 2.85Å; P601-L716 WeakPolarHBondContact CD-O 3.34Å; P601-H718 WeakPolarHBondContact CG-ND1 3.29Å
602	N	68.8	Low	74.9	Confident	86 Å²	86	57.2 Å²	57.2	46%	0.46	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	42.6	-179.8	-53.8	-24.3	0	0	0	113.5	D604 S605 H606	N602-D604 PolarHBondContact O-N 3.37Å; N602-D604 VanDerWaalsContact O-N 3.12Å; N602-S605 WeakPolarHBondContact O-CB 3.42Å; N602-S605 PolarHBondContact O-N 3.43Å; N602-H606 PolarHBondContact O-N 3.41Å
603	Y	69.3	Low	74.6	Confident	28 Å²	28	54.5 Å²	54.5	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-45.9	-43.3	179	177.7	-92.9	0	0	0	113.3	N499 A500 P601 S605 H606 S607 I610 Q746 S747	N499-Y603 HydrophobicContact CB-CD1 4.38Å; N499-Y603 HydrophobicContact CB-CE1 4.04Å; N499-Y603 WeakPolarHBondContact O-CE2 3.17Å; A500-Y603 HydrophobicContact CB-CG 4.3Å; P601-Y603 VanDerWaalsContact C-N 3.3Å; P601-Y603 PolarHBondContact O-N 2.85Å; Y603-S605 PolarHBondContact O-N 3.13Å; Y603-S605 VanDerWaalsContact O-N 3.16Å; Y603-H606 CarbonylContact O-C 3.55Å; Y603-H606 WeakPolarHBondContact O-CA 3.43Å; Y603-H606 PolarHBondContact O-N 2.74Å; Y603-S607 PolarHBondContact O-N 3.48Å; Y603-I610 HydrophobicContact CD2-CD1 3.7Å; Y603-I610 HydrophobicContact CE2-CD1 3.57Å; Y603-Q746 PolarHBondContact OH-OE1 3.09Å; Y603-S747 VanDerWaalsContact CD2-OG 3.26Å; Y603-S747 WeakPolarHBondContact CD2-OG 3.42Å; Y603-S747 WeakPolarHBondContact CE2-OG 3.23Å
604	D	66.4	Low	73.8	Confident	134 Å²	134	55 Å²	55	72%	0.717	29%	0.287	S	S	*	.	H	α-helix	trans	-61.8	-23.4	179.7	-54.8	-30.1	0	0	0	113.9	N602 S607	N602-D604 PolarHBondContact O-N 3.37Å; N602-D604 VanDerWaalsContact O-N 3.12Å; D604-S607 PolarHBondContact O-OG 2.91Å
605	S	67.3	Low	72.7	Confident	98 Å²	98	55.6 Å²	55.6	69%	0.685	30%	0.296	S	S	*	.	H	α-helix	trans	-86.4	-12.6	174.3	-53.3	0	0	0	0	113.3	N602 Y603	N602-S605 WeakPolarHBondContact O-CB 3.42Å; N602-S605 PolarHBondContact O-N 3.43Å; Y603-S605 PolarHBondContact O-N 3.13Å; Y603-S605 VanDerWaalsContact O-N 3.16Å
606	H	65.2	Low	71.3	Confident	67 Å²	67	60.5 Å²	60.5	31%	0.31	33%	0.326	S	S	.	.	H	α-helix	trans	-112.4	-12.1	-179.4	-70.8	-65.9	0	0	0	113.3	N602 Y603 D608 W609 I610	N602-H606 PolarHBondContact O-N 3.41Å; Y603-H606 CarbonylContact O-C 3.55Å; Y603-H606 WeakPolarHBondContact O-CA 3.43Å; Y603-H606 PolarHBondContact O-N 2.74Å; H606-D608 PolarHBondContact O-N 3.23Å; H606-W609 CarbonylContact O-C 3.49Å; H606-W609 WeakPolarHBondContact O-CA 3.38Å; H606-W609 WeakPolarHBondContact O-CB 3.42Å; H606-W609 PolarHBondContact O-N 3.26Å; H606-I610 HydrophobicContact CB-CD1 3.99Å; H606-I610 HydrophobicContact CB-CG1 4.23Å; H606-I610 WeakPolarHBondContact O-CB 3.44Å; H606-I610 VanDerWaalsContact O-CG1 3.27Å; H606-I610 WeakPolarHBondContact O-CG1 3.28Å; H606-I610 PolarHBondContact O-N 3.34Å
607	S	65.2	Low	69.4	Low	32 Å²	32	60.3 Å²	60.3	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-47.9	-46.3	-176.7	53.5	0	0	0	0	114.7	Y603 D604 I610 T611	Y603-S607 PolarHBondContact O-N 3.48Å; D604-S607 PolarHBondContact O-OG 2.91Å; S607-I610 PolarHBondContact O-N 2.96Å; S607-T611 WeakPolarHBondContact O-CB 3.5Å; S607-T611 PolarHBondContact O-N 2.61Å; S607-T611 PolarHBondContact O-OG1 3.13Å
608	D	68.5	Low	66.9	Low	139 Å²	139	67.6 Å²	67.6	74%	0.743	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-43.2	177.1	-70.9	-20.5	0	0	0	111.9	H606 T611 S612	H606-D608 PolarHBondContact O-N 3.23Å; D608-T611 PolarHBondContact O-N 2.95Å; D608-S612 WeakPolarHBondContact O-CB 3.12Å; D608-S612 PolarHBondContact O-N 2.76Å
609	W	76.5	Confident	64.5	Low	110 Å²	110	70.9 Å²	70.9	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-40.2	176.3	176.3	89.5	0	0	0	111.4	H606 S612 Q613 L716 L750	H606-W609 CarbonylContact O-C 3.49Å; H606-W609 WeakPolarHBondContact O-CA 3.38Å; H606-W609 WeakPolarHBondContact O-CB 3.42Å; H606-W609 PolarHBondContact O-N 3.26Å; W609-S612 WeakPolarHBondContact O-CB 3.17Å; W609-S612 PolarHBondContact O-N 3.38Å; W609-Q613 HydrophobicContact CD2-CG 4.06Å; W609-Q613 HydrophobicContact CE3-CG 4.26Å; W609-Q613 HydrophobicContact CH2-CG 3.83Å; W609-Q613 HydrophobicContact CZ2-CG 3.6Å; W609-Q613 HydrophobicContact CZ3-CG 4.13Å; W609-Q613 WeakPolarHBondContact O-CG 3.38Å; W609-Q613 PolarHBondContact O-N 2.75Å; W609-L716 HydrophobicContact CH2-CD2 4.16Å; W609-L716 HydrophobicContact CZ3-CD1 4.36Å; W609-L716 HydrophobicContact CZ3-CD2 3.57Å; W609-L750 HydrophobicContact CZ3-CD1 4.07Å
610	I	66.6	Low	62	Low	0 Å²	0	76.9 Å²	76.9	0%	0	44%	0.441	C	S	.	.	H	α-helix	trans	-59.3	-48.5	175.9	-72.1	175.1	0	0	0	110.1	I600 Y603 H606 S607 S612 Q613 L614 Q746 L750	I600-I610 HydrophobicContact CD1-CD1 3.75Å; Y603-I610 HydrophobicContact CD2-CD1 3.7Å; Y603-I610 HydrophobicContact CE2-CD1 3.57Å; H606-I610 HydrophobicContact CB-CD1 3.99Å; H606-I610 HydrophobicContact CB-CG1 4.23Å; H606-I610 WeakPolarHBondContact O-CB 3.44Å; H606-I610 VanDerWaalsContact O-CG1 3.27Å; H606-I610 WeakPolarHBondContact O-CG1 3.28Å; H606-I610 PolarHBondContact O-N 3.34Å; S607-I610 PolarHBondContact O-N 2.96Å; I610-S612 VanDerWaalsContact C-N 3.33Å; I610-S612 PolarHBondContact O-N 2.91Å; I610-Q613 PolarHBondContact O-N 2.89Å; I610-L614 HydrophobicContact CG2-CD1 4.16Å; I610-L614 WeakPolarHBondContact O-CG 3.48Å; I610-L614 PolarHBondContact O-N 2.89Å; I610-L614 VanDerWaalsContact O-N 3.13Å; I610-Q746 HydrophobicContact CG2-CB 3.59Å; I610-L750 HydrophobicContact CB-CD1 3.79Å; I610-L750 HydrophobicContact CD1-CD1 4.38Å; I610-L750 HydrophobicContact CG1-CD1 3.55Å; I610-L750 HydrophobicContact CG2-CD1 3.58Å; I610-L750 HydrophobicContact CG2-CG 4.17Å
611	T	69.6	Low	59.5	Low	55 Å²	55	80.6 Å²	80.6	34%	0.337	48%	0.479	S	S	.	.	H	α-helix	trans	-64.4	-37.3	177.1	-57.3	0	0	0	0	111.7	S607 D608 T615 Q746	S607-T611 WeakPolarHBondContact O-CB 3.5Å; S607-T611 PolarHBondContact O-N 2.61Å; S607-T611 PolarHBondContact O-OG1 3.13Å; D608-T611 PolarHBondContact O-N 2.95Å; T611-T615 WeakPolarHBondContact O-CB 3.44Å; T611-T615 WeakPolarHBondContact O-CG2 3.49Å; T611-T615 PolarHBondContact O-N 2.83Å; T611-T615 PolarHBondContact O-OG1 3.47Å; T611-Q746 PolarHBondContact OG1-NE2 3.13Å; T611-Q746 PolarHBondContact OG1-OE1 3.36Å
612	S	67.8	Low	57.5	Low	57 Å²	57	82.4 Å²	82.4	40%	0.399	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-43.5	174.9	-178.9	0	0	0	0	112.7	D608 W609 I610 T615 T616	D608-S612 WeakPolarHBondContact O-CB 3.12Å; D608-S612 PolarHBondContact O-N 2.76Å; W609-S612 WeakPolarHBondContact O-CB 3.17Å; W609-S612 PolarHBondContact O-N 3.38Å; I610-S612 VanDerWaalsContact C-N 3.33Å; I610-S612 PolarHBondContact O-N 2.91Å; S612-T615 WeakPolarHBondContact CA-OG1 3.26Å; S612-T615 PolarHBondContact O-N 2.78Å; S612-T615 PolarHBondContact O-OG1 2.91Å; S612-T615 VanDerWaalsContact O-OG1 3.13Å; S612-T616 WeakPolarHBondContact O-CG2 3.44Å; S612-T616 PolarHBondContact O-N 3.24Å; S612-T616 PolarHBondContact O-OG1 3.41Å
613	Q	67	Low	55.7	Low	79 Å²	79	82.5 Å²	82.5	37%	0.369	53%	0.527	S	S	.	.	H	α-helix	trans	-62.4	-46.3	176.2	-68.1	-55.4	-67.5	0	0	111.6	W609 I610 T615 T616 L750	W609-Q613 HydrophobicContact CD2-CG 4.06Å; W609-Q613 HydrophobicContact CE3-CG 4.26Å; W609-Q613 HydrophobicContact CH2-CG 3.83Å; W609-Q613 HydrophobicContact CZ2-CG 3.6Å; W609-Q613 HydrophobicContact CZ3-CG 4.13Å; W609-Q613 WeakPolarHBondContact O-CG 3.38Å; W609-Q613 PolarHBondContact O-N 2.75Å; I610-Q613 PolarHBondContact O-N 2.89Å; Q613-T615 VanDerWaalsContact C-N 3.33Å; Q613-T615 PolarHBondContact O-N 3.48Å; Q613-T616 PolarHBondContact O-N 2.8Å; Q613-T616 PolarHBondContact O-OG1 2.84Å; Q613-L750 HydrophobicContact CB-CD2 3.8Å
614	L	64.7	Low	53.8	Low	31 Å²	31	85 Å²	85	16%	0.162	56%	0.561	C	S	.	*	H	α-helix	trans	-65.3	-31.1	-179.9	-68.7	168.6	0	0	0	113.7	I610 S617 Q746 Q749 L750	I610-L614 HydrophobicContact CG2-CD1 4.16Å; I610-L614 WeakPolarHBondContact O-CG 3.48Å; I610-L614 PolarHBondContact O-N 2.89Å; I610-L614 VanDerWaalsContact O-N 3.13Å; L614-S617 PolarHBondContact O-OG 3.36Å; L614-Q746 HydrophobicContact CD1-CB 3.87Å; L614-Q746 HydrophobicContact CD1-CG 4.21Å; L614-Q749 HydrophobicContact CD1-CB 4.3Å; L614-Q749 HydrophobicContact CD2-CB 3.73Å; L614-L750 HydrophobicContact CD1-CG 4.34Å; L614-L750 HydrophobicContact CD2-CD2 3.78Å; L614-L750 HydrophobicContact CD2-CG 4.14Å; L614-L750 HydrophobicContact CG-CD2 3.79Å; L614-L750 HydrophobicContact CG-CG 4.09Å
615	T	62.4	Low	52.1	Low	93 Å²	93	90.2 Å²	90.2	57%	0.571	57%	0.571	S	S	*	*	H	α-helix	trans	-81.6	-23.7	-179.4	45.4	0	0	0	0	114.1	T611 S612 Q613 S617	T611-T615 WeakPolarHBondContact O-CB 3.44Å; T611-T615 WeakPolarHBondContact O-CG2 3.49Å; T611-T615 PolarHBondContact O-N 2.83Å; T611-T615 PolarHBondContact O-OG1 3.47Å; S612-T615 WeakPolarHBondContact CA-OG1 3.26Å; S612-T615 PolarHBondContact O-N 2.78Å; S612-T615 PolarHBondContact O-OG1 2.91Å; S612-T615 VanDerWaalsContact O-OG1 3.13Å; Q613-T615 VanDerWaalsContact C-N 3.33Å; Q613-T615 PolarHBondContact O-N 3.48Å; T615-S617 VanDerWaalsContact C-N 3.34Å; T615-S617 PolarHBondContact O-N 3.02Å
616	T	55.6	Low	50.4	Low	102 Å²	102	90.5 Å²	90.5	63%	0.626	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-12.7	-177.2	52.4	0	0	0	0	115.4	S612 Q613	S612-T616 WeakPolarHBondContact O-CG2 3.44Å; S612-T616 PolarHBondContact O-N 3.24Å; S612-T616 PolarHBondContact O-OG1 3.41Å; Q613-T616 PolarHBondContact O-N 2.8Å; Q613-T616 PolarHBondContact O-OG1 2.84Å
617	S	46.8	Very low	49	Very low	71 Å²	71	92.1 Å²	92.1	50%	0.497	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	3.1	-176.9	43.3	0	0	0	0	116.2	L614 T615 Q753	L614-S617 PolarHBondContact O-OG 3.36Å; T615-S617 VanDerWaalsContact C-N 3.34Å; T615-S617 PolarHBondContact O-N 3.02Å; S617-Q753 PolarHBondContact OG-NE2 3.26Å
618	I	35.4	Very low	47.3	Very low	153 Å²	153	96.7 Å²	96.7	79%	0.785	62%	0.618	S	S	*	*			trans	-112	77.2	-179.7	-51.6	178.8	0	0	0	109.9
619	G	31.8	Very low	45.7	Very low	70 Å²	70	97.2 Å²	97.2	72%	0.722	63%	0.627	S	S	*	*			trans	-151.4	89.2	-178	0	0	0	0	0	112
620	I	33.7	Very low	43.4	Very low	170 Å²	170	97.8 Å²	97.8	87%	0.872	65%	0.647	S	S	*	*			trans	-62.9	132.4	-173	-67.6	166.7	0	0	0	111.7	G622	I620-G622 PolarHBondContact O-N 2.92Å
621	G	28	Very low	41.8	Very low	79 Å²	79	101.5 Å²	101.5	81%	0.814	69%	0.686	S	S	*	*			trans	-70.1	121.8	169.5	0	0	0	0	0	112
622	G	31.7	Very low	40.1	Very low	77 Å²	77	108 Å²	108	79%	0.794	71%	0.713	S	S	*	*			trans	-138.6	111.5	170.5	0	0	0	0	0	109.9	I620	I620-G622 PolarHBondContact O-N 2.92Å
623	G	30	Very low	38.5	Very low	88 Å²	88	114.5 Å²	114.5	91%	0.907	74%	0.737	S	S	*	*			trans	-82.6	147.1	-177.5	0	0	0	0	0	113.3
624	G	30.7	Very low	36.8	Very low	81 Å²	81	119 Å²	119	84%	0.835	76%	0.758	S	S	*	*			trans	171.9	93.4	173.5	0	0	0	0	0	113.8
625	R	29.7	Very low	35.2	Very low	242 Å²	242	122.6 Å²	122.6	91%	0.913	78%	0.783	S	S	*	*			trans	-76.4	134.3	167.9	-76.9	162.9	62.7	179.7	0.5	109.6
626	S	32.6	Very low	33.9	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	80%	0.795	S	S	*	*				171.9	154.5	113.7	-76	0	0	0	0	115.3
627	S	33.9	Very low	32.7	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	80%	0.801	S	S	*	*			trans	57.7	92.2	154	57.1	0	0	0	0	121
628	T	29.7	Very low	32	Very low	127 Å²	127	133.3 Å²	133.3	78%	0.779	82%	0.819	S	S	*	*				19.8	123.6	117.5	56.3	0	0	0	0	119.7
629	T	34.5	Very low	31.9	Very low	151 Å²	151	132.3 Å²	132.3	93%	0.926	82%	0.819	S	S	*	*				-167.4	157.2	116.1	13.4	0	0	0	0	112.2
630	S	30	Very low	32.3	Very low	121 Å²	121	134.2 Å²	134.2	85%	0.846	82%	0.819	S	S	*	*			trans	-90.2	145.2	-171.3	51	0	0	0	0	114.4
631	G	32.9	Very low	32.4	Very low	79 Å²	79	132 Å²	132	81%	0.814	82%	0.815	S	S	*	*			trans	-161	126.5	166.5	0	0	0	0	0	111.8
632	Q	32.3	Very low	32.5	Very low	192 Å²	192	133.4 Å²	133.4	90%	0.897	81%	0.813	S	S	*	*			trans	-84.6	147.3	-177.5	-59.5	168.4	-48.6	0	0	112
633	Q	34.3	Very low	32.6	Very low	192 Å²	192	135.8 Å²	135.8	90%	0.897	82%	0.817	S	S	*	*				-170.7	156.5	121.5	-102.2	167.8	15.2	0	0	113.6
634	Q	31.2	Very low	32.7	Very low	175 Å²	175	137.6 Å²	137.6	82%	0.818	81%	0.811	S	S	*	*			trans	-75.8	164.5	-152.2	-70.9	161.5	-60.4	0	0	118.7
635	P	32.6	Very low	32.5	Very low	105 Å²	105	138.5 Å²	138.5	68%	0.682	81%	0.805	S	S	*	*			trans	-105.7	162.5	166.7	40.2	-32.8	0	0	0	114.6
636	H	34.9	Very low	32.7	Very low	178 Å²	178	133.5 Å²	133.5	82%	0.824	80%	0.801	S	S	*	*			trans	-135.6	110.1	158.6	-67.7	-85.8	0	0	0	106.7
637	I	30.6	Very low	32.4	Very low	148 Å²	148	135.6 Å²	135.6	76%	0.759	80%	0.803	S	S	*	*				57.3	100.2	74.5	-54.6	177.5	0	0	0	113.6
638	L	30.8	Very low	32.2	Very low	166 Å²	166	137 Å²	137	87%	0.869	81%	0.807	S	S	*	*				-158.1	147.1	116	-149.5	62.4	0	0	0	111.7
639	V	33.3	Very low	32.1	Very low	131 Å²	131	136 Å²	136	79%	0.794	80%	0.801	S	S	*	*			trans	-129.7	153.2	-172.6	157.4	0	0	0	0	107.8
640	P	40.4	Very low	32.1	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	80%	0.797	S	S	*	*			trans	-87.2	-169	-160.7	37.4	-37.9	0	0	0	113.5
641	P	36.9	Very low	32.1	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	80%	0.799	S	S	*	*				-146.1	170.6	119	37.8	-22.4	0	0	0	116.8
642	S	28.8	Very low	32.1	Very low	109 Å²	109	137.9 Å²	137.9	76%	0.762	79%	0.791	S	S	*	*			trans	-67.9	157.1	173.5	51	0	0	0	0	115.8
643	S	35.3	Very low	32.1	Very low	127 Å²	127	136.9 Å²	136.9	89%	0.888	79%	0.786	S	S	*	*			trans	-148	155.7	162.3	-80.5	0	0	0	0	112.5
644	T	31.1	Very low	32.2	Very low	127 Å²	127	134.5 Å²	134.5	78%	0.779	78%	0.78	S	S	*	*			trans	-114.1	148.4	-160.1	-36.1	0	0	0	0	113.4
645	S	27.5	Very low	32.1	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	78%	0.78	S	S	*	*			trans	37.4	134.3	151.2	62.4	0	0	0	0	122.3
646	T	32.3	Very low	32.4	Very low	137 Å²	137	133.2 Å²	133.2	84%	0.84	78%	0.777	S	S	*	*			trans	-161.7	147.5	131.5	-75.1	0	0	0	0	110.8
647	I	26.3	Very low	32.1	Very low	149 Å²	149	132.9 Å²	132.9	76%	0.764	78%	0.776	S	S	*	*			trans	-91.2	140	179.6	-63.2	159.7	0	0	0	110.5
648	V	31	Very low	32	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	77%	0.769	S	S	*	*			trans	-141.9	129.9	154.3	-177.1	0	0	0	0	110.5
649	T	27.9	Very low	32.1	Very low	106 Å²	106	128.8 Å²	128.8	65%	0.65	76%	0.764	S	S	*	*			trans	-104.2	145.5	171.1	46.5	0	0	0	0	111.1
650	C	34.5	Very low	31.9	Very low	127 Å²	127	129.7 Å²	129.7	86%	0.858	77%	0.765	S	S	*	*			trans	-128.9	133.8	165.1	-62.1	0	0	0	0	110.6
651	F	29.6	Very low	31.8	Very low	202 Å²	202	129.1 Å²	129.1	89%	0.886	76%	0.761	S	S	*	*			trans	-96.9	162.6	-176.3	-89.5	-103.2	0	0	0	112.7
652	G	32.7	Very low	31.4	Very low	62 Å²	62	129.8 Å²	129.8	64%	0.639	76%	0.758	S	S	*	*			trans	170.8	102.9	158.7	0	0	0	0	0	108.8
653	Q	32.9	Very low	31.3	Very low	170 Å²	170	130.7 Å²	130.7	79%	0.794	75%	0.753	S	S	*	*				65.4	123.4	75.6	-68.8	-171.4	-70.6	0	0	111.5
654	D	34.6	Very low	31	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	75%	0.749	S	S	*	*			cis	-144.9	171.6	20	-83.6	-49.6	0	0	0	116.1
655	L	30.8	Very low	30.9	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	75%	0.746	S	S	*	*			trans	-96	-165.1	-179.8	-106.1	84	0	0	0	111.1
656	P	37.3	Very low	31.2	Very low	93 Å²	93	131.8 Å²	131.8	60%	0.604	74%	0.743	S	S	*	*				-143.4	-171.4	-52	41.4	-23.4	0	0	0	115.1
657	E	28.6	Very low	31.2	Very low	172 Å²	172	130.6 Å²	130.6	80%	0.804	74%	0.735	S	S	*	*			trans	71.4	162.6	142.2	-126.1	168.4	173.5	0	0	117.2
658	V	30.1	Very low	31.5	Very low	102 Å²	102	130.6 Å²	130.6	62%	0.618	74%	0.737	S	S	*	*			cis	-154.4	149.1	19.9	-161.9	0	0	0	0	111.1
659	T	33.2	Very low	31.7	Very low	125 Å²	125	128 Å²	128	77%	0.767	73%	0.729	S	S	*	*			trans	55.8	159.1	153.3	45.7	0	0	0	0	121.2
660	N	28.3	Very low	32	Very low	151 Å²	151	130.4 Å²	130.4	81%	0.807	74%	0.738	S	S	*	*			cis	176	170.9	-31.4	-124	-4.5	0	0	0	105
661	P	37.3	Very low	31.9	Very low	97 Å²	97	128.5 Å²	128.5	63%	0.63	73%	0.725	S	S	*	*			trans	-103	168.8	-158.2	40	-36.4	0	0	0	114.9
662	N	28.3	Very low	32.1	Very low	138 Å²	138	125.2 Å²	125.2	74%	0.738	72%	0.717	S	S	*	*				166.9	137	128.5	-94.8	-29.5	0	0	0	118.6
663	I	28.1	Very low	32.3	Very low	128 Å²	128	127.6 Å²	127.6	66%	0.656	72%	0.719	S	S	*	*			trans	71.8	150.9	138.9	-48.8	157.4	0	0	0	120.6
664	F	28.9	Very low	32.4	Very low	182 Å²	182	126.3 Å²	126.3	80%	0.798	72%	0.718	S	S	*	*			trans	89.6	99.6	169.1	-69.2	-71	0	0	0	115.9
665	S	29.5	Very low	32.4	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	72%	0.719	S	S	*	*				94	148	71.9	73.5	0	0	0	0	111.6
666	S	32.3	Very low	32.4	Very low	91 Å²	91	124.6 Å²	124.6	64%	0.636	71%	0.712	S	S	*	*			cis	-164.6	172.1	19.1	56.3	0	0	0	0	111.6
667	T	32.8	Very low	32.3	Very low	111 Å²	111	129.6 Å²	129.6	68%	0.681	73%	0.73	S	S	*	*			trans	59.7	143.9	148.4	48.2	0	0	0	0	119.4
668	D	33.3	Very low	32.4	Very low	150 Å²	150	126.5 Å²	126.5	80%	0.802	72%	0.719	S	S	*	*			cis	-173.3	167.9	-5.4	-104.5	-2.8	0	0	0	107.6
669	A	35.7	Very low	32.6	Very low	74 Å²	74	129.9 Å²	129.9	61%	0.612	73%	0.732	S	S	*	*			cis	-172.2	169.6	-16.4	0	0	0	0	0	109.7
670	N	33	Very low	32.3	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	73%	0.731	S	S	*	*			trans	66.8	150.8	162.4	-83.3	-13.5	0	0	0	119.6
671	C	31.8	Very low	32.5	Very low	88 Å²	88	129.6 Å²	129.6	60%	0.595	73%	0.731	S	S	*	*			cis	-166.9	136.5	-19.3	51.3	0	0	0	0	107.4
672	N	35.2	Very low	32.1	Very low	132 Å²	132	130.5 Å²	130.5	71%	0.706	74%	0.735	S	S	*	*				177.7	126.8	84.4	-80.2	-44.2	0	0	0	106.6
673	T	35.8	Very low	32.2	Very low	113 Å²	113	130 Å²	130	69%	0.693	74%	0.737	S	S	*	*				44.9	124.7	90.6	57.3	0	0	0	0	113.5
674	N	34.9	Very low	32.4	Very low	143 Å²	143	129 Å²	129	77%	0.765	74%	0.741	S	S	*	*			cis	-155.7	177.7	21.6	-96.3	-21.2	0	0	0	108.9
675	I	35.2	Very low	32.3	Very low	154 Å²	154	127.5 Å²	127.5	79%	0.79	74%	0.742	S	S	*	*			cis	-149.4	174.3	12.4	-140.1	158	0	0	0	111.6
676	T	30.9	Very low	32.3	Very low	112 Å²	112	131 Å²	131	69%	0.687	75%	0.749	S	S	*	*			trans	-100.7	155	-170.9	-38	0	0	0	0	114.5	N678	T676-N678 HydrophobicContact CG2-CB 4.33Å
677	M	35.7	Very low	32	Very low	197 Å²	197	131.8 Å²	131.8	97%	0.97	75%	0.754	S	S	*	*			trans	-154.8	138.2	130.8	-96.3	-72.9	-151.2	0	0	109.2
678	N	29.8	Very low	32	Very low	107 Å²	107	133 Å²	133	57%	0.572	76%	0.762	S	S	*	*			trans	-134.7	140	-161.5	168.3	18	0	0	0	110.2	T676 N680	T676-N678 HydrophobicContact CG2-CB 4.33Å; N678-N680 PolarHBondContact OD1-N 2.93Å
679	L	33.9	Very low	31.7	Very low	173 Å²	173	131.6 Å²	131.6	91%	0.906	76%	0.759	S	S	*	*			trans	-148.2	103.9	156.6	-114.8	115.2	0	0	0	111.4
680	N	27.3	Very low	31.4	Very low	139 Å²	139	134.8 Å²	134.8	74%	0.743	77%	0.765	S	S	*	*			trans	-85.7	146.3	170.1	-82.9	-27.9	0	0	0	111.4	N678	N678-N680 PolarHBondContact OD1-N 2.93Å
681	T	32.5	Very low	31.3	Very low	131 Å²	131	134.1 Å²	134.1	80%	0.804	76%	0.76	S	S	*	*			trans	-144.6	118	144.8	-29.7	0	0	0	0	112.5
682	T	29.5	Very low	30.9	Very low	117 Å²	117	136.6 Å²	136.6	72%	0.718	77%	0.773	S	S	*	*			trans	-37	160.6	151	32.7	0	0	0	0	113.8
683	T	30.3	Very low	30.6	Very low	128 Å²	128	135.7 Å²	135.7	79%	0.785	77%	0.772	S	S	*	*			cis	-162.2	-178.6	20.1	-6.9	0	0	0	0	107.3
684	S	32.3	Very low	30.2	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	78%	0.778	S	S	*	*			cis	-158.7	173.8	3.9	42.7	0	0	0	0	110.2
685	N	26.8	Very low	29.9	Very low	150 Å²	150	135 Å²	135	80%	0.802	78%	0.778	S	S	*	*			trans	-92	147.8	175.2	-67.4	-27.3	0	0	0	113.1
686	M	29.7	Very low	29.6	Very low	178 Å²	178	132.2 Å²	132.2	88%	0.877	77%	0.772	S	S	*	*			trans	-146.8	98.8	153.7	-101.4	-83.5	94.9	0	0	109.2
687	S	25.3	Very low	29.4	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	78%	0.775	S	S	*	*			trans	-99.2	130.9	170.5	-57.9	0	0	0	0	109.2
688	T	33.2	Very low	28.9	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	76%	0.763	S	S	*	*			trans	-130.8	119.1	159	28.9	0	0	0	0	109.5
689	T	27.8	Very low	28.8	Very low	120 Å²	120	131.3 Å²	131.3	74%	0.736	78%	0.777	S	S	*	*			trans	-72.5	152.4	171.5	49.3	0	0	0	0	110.3
690	N	29.4	Very low	28.5	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	77%	0.768	S	S	*	*				173.1	153	117	-88.3	-6	0	0	0	114.9
691	I	29.3	Very low	28.5	Very low	143 Å²	143	127.1 Å²	127.1	73%	0.733	76%	0.763	S	S	*	*			trans	78.2	92	159.3	-61	145.9	0	0	0	117.4
692	T	25.1	Very low	28.4	Very low	141 Å²	141	124.9 Å²	124.9	87%	0.865	75%	0.749	S	S	*	*			trans	-60.8	128.9	151.3	-48.5	0	0	0	0	111
693	T	29.1	Very low	28.5	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	75%	0.746	S	S	*	*			trans	-151.4	134.9	150.7	-4.7	0	0	0	0	112
694	S	25.4	Very low	28.3	Very low	116 Å²	116	125.5 Å²	125.5	81%	0.811	74%	0.742	S	S	*	*			trans	-44.4	132.3	-179.2	49.7	0	0	0	0	116.9
695	T	28.9	Very low	28.3	Very low	125 Å²	125	126.7 Å²	126.7	77%	0.767	74%	0.74	S	S	*	*			trans	-135.5	119.2	169.1	39.4	0	0	0	0	112.7
696	S	29.7	Very low	28.4	Very low	96 Å²	96	124 Å²	124	67%	0.671	73%	0.733	S	S	*	*			trans	38.8	116.3	133.5	62.8	0	0	0	0	118.9
697	T	26.2	Very low	28.4	Very low	122 Å²	122	121.1 Å²	121.1	75%	0.748	73%	0.73	S	S	*	*	S	Bend		51.2	113.2	75.9	-34.7	0	0	0	0	113.2
698	T	25.3	Very low	28.5	Very low	117 Å²	117	123.2 Å²	123.2	72%	0.718	73%	0.733	S	S	*	*			trans	43.6	111.7	159.3	55.5	0	0	0	0	118.9
699	N	27.8	Very low	28.3	Very low	159 Å²	159	122.5 Å²	122.5	85%	0.85	72%	0.724	S	S	*	*			trans	-163.1	104.4	134.9	-101.5	-33.9	0	0	0	112.7	T701	N699-T701 PolarHBondContact O-N 3.45Å
700	T	27.2	Very low	28.3	Very low	118 Å²	118	120.7 Å²	120.7	72%	0.724	72%	0.716	S	S	*	*			trans	-66.7	110.1	168.6	-44.9	0	0	0	0	109	V702	T700-V702 PolarHBondContact O-N 2.99Å
701	T	28.6	Very low	28.2	Very low	105 Å²	105	118.4 Å²	118.4	64%	0.644	70%	0.704	S	S	*	*			trans	-75.3	90.2	178	47.9	0	0	0	0	111.1	N699 I703	N699-T701 PolarHBondContact O-N 3.45Å; T701-I703 PolarHBondContact O-N 2.86Å
702	V	29.6	Very low	28	Very low	85 Å²	85	118.7 Å²	118.7	52%	0.515	71%	0.707	S	S	.	*			trans	-61.4	123.3	170.7	178.4	0	0	0	0	109.9	T700 N704	T700-V702 PolarHBondContact O-N 2.99Å; V702-N704 PolarHBondContact O-N 3.24Å; V702-N704 VanDerWaalsContact O-N 3.09Å
703	I	30.7	Very low	28.2	Very low	125 Å²	125	119.2 Å²	119.2	64%	0.641	71%	0.705	S	S	*	*			trans	-81.3	86.7	169.5	-58.6	179.5	0	0	0	108.2	T701 N705	T701-I703 PolarHBondContact O-N 2.86Å; I703-N705 PolarHBondContact O-N 2.66Å
704	N	27.2	Very low	28.4	Very low	133 Å²	133	119.9 Å²	119.9	71%	0.711	71%	0.714	S	S	*	*			trans	-71.5	92	168.6	-101	-5	0	0	0	109.9	V702 S706	V702-N704 PolarHBondContact O-N 3.24Å; V702-N704 VanDerWaalsContact O-N 3.09Å; N704-S706 PolarHBondContact O-N 2.9Å
705	N	32	Very low	29.9	Very low	130 Å²	130	118.3 Å²	118.3	70%	0.695	70%	0.703	S	S	*	*			trans	-87.9	79.1	161.2	-93	1.4	0	0	0	109.7	I703 S707	I703-N705 PolarHBondContact O-N 2.66Å; N705-S707 PolarHBondContact O-N 2.97Å
706	S	28.5	Very low	32	Very low	94 Å²	94	114 Å²	114	66%	0.657	68%	0.675	S	S	*	*			trans	-63.3	118.3	167.1	-69.3	0	0	0	0	110.3	N704	N704-S706 PolarHBondContact O-N 2.9Å
707	S	29.6	Very low	34.2	Very low	117 Å²	117	109.9 Å²	109.9	82%	0.818	65%	0.645	S	S	*	*			trans	-144.8	97.2	159.4	-77.9	0	0	0	0	108.3	N705 N709	N705-S707 PolarHBondContact O-N 2.97Å; S707-N709 PolarHBondContact O-N 2.94Å
708	N	27.8	Very low	36.7	Very low	152 Å²	152	108.3 Å²	108.3	81%	0.813	63%	0.629	S	S	*	*			trans	-58.6	127.9	-178.3	-66.7	-29.6	0	0	0	111
709	N	28.9	Very low	39.5	Very low	123 Å²	123	106.8 Å²	106.8	66%	0.658	61%	0.614	S	S	*	*				-174.1	103.4	126	-97	-21.7	0	0	0	111.4	K519 S707	K519-N709 PolarHBondContact NZ-O 3.2Å; S707-N709 PolarHBondContact O-N 2.94Å
710	S	27.4	Very low	42.1	Very low	81 Å²	81	99.5 Å²	99.5	57%	0.566	58%	0.575	S	S	*	*			trans	46.8	133.6	136.2	56.3	0	0	0	0	122
711	N	27.2	Very low	44.9	Very low	93 Å²	93	94.5 Å²	94.5	50%	0.497	55%	0.545	S	S	.	.			trans	90.5	95	152.3	-58.4	-8.1	0	0	0	118.9	P520	P520-N711 HydrophobicContact CG-CB 4.1Å; P520-N711 PolarHBondContact O-ND2 2.94Å
712	N	26.6	Very low	47.6	Very low	148 Å²	148	89.5 Å²	89.5	79%	0.791	51%	0.514	S	S	*	.	S	Bend	trans	80.5	132.6	145.1	-56.2	-9.1	0	0	0	118.7
713	N	29.4	Very low	50.2	Low	152 Å²	152	87.6 Å²	87.6	81%	0.813	50%	0.499	S	S	*	.			trans	60.4	82.2	-177.3	-61.6	-1.2	0	0	0	114.8	S715	N713-S715 PolarHBondContact O-N 3.45Å
714	S	33.4	Very low	52.7	Low	126 Å²	126	82.2 Å²	82.2	88%	0.881	47%	0.472	S	S	*	.			trans	-62.6	97.6	165.7	52.5	0	0	0	0	110.2	L716	S714-L716 PolarHBondContact O-N 3.3Å; S714-L716 VanDerWaalsContact O-N 3.13Å
715	S	57	Low	55.4	Low	84 Å²	84	80.2 Å²	80.2	59%	0.587	46%	0.459	S	S	*	.			trans	-66.5	111.5	-178.8	58.4	0	0	0	0	110.9	N713 F717	N713-S715 PolarHBondContact O-N 3.45Å; S715-F717 PolarHBondContact O-N 3.05Å; S715-F717 VanDerWaalsContact O-N 3.12Å; S715-F717 PolarHBondContact OG-O 2.95Å
716	L	72.1	Confident	57.6	Low	33 Å²	33	79.8 Å²	79.8	17%	0.173	45%	0.447	C	S	.	.	S	Bend	trans	-50	-35	170.3	-172	77.2	0	0	0	111.4	I600 P601 W609 S714	I600-L716 HydrophobicContact CD1-CD2 3.82Å; I600-L716 HydrophobicContact CD1-CG 4.33Å; I600-L716 HydrophobicContact CG1-CD2 4.35Å; I600-L716 HydrophobicContact CG1-CG 4.37Å; I600-L716 HydrophobicContact CG2-CD1 4.39Å; I600-L716 HydrophobicContact CG2-CG 4.13Å; P601-L716 WeakPolarHBondContact CD-O 3.34Å; W609-L716 HydrophobicContact CH2-CD2 4.16Å; W609-L716 HydrophobicContact CZ3-CD1 4.36Å; W609-L716 HydrophobicContact CZ3-CD2 3.57Å; S714-L716 PolarHBondContact O-N 3.3Å; S714-L716 VanDerWaalsContact O-N 3.13Å
717	F	75.8	Confident	59.8	Low	11 Å²	11	78.5 Å²	78.5	5%	0.048	44%	0.438	C	S	.	.			trans	-85.6	127.6	-179.5	-61.2	-75.7	0	0	0	112.7	A502 V598 I600 S715 L750 Y751	A502-F717 HydrophobicContact CB-CD1 3.81Å; A502-F717 HydrophobicContact CB-CE1 3.59Å; V598-F717 HydrophobicContact CG1-CB 3.7Å; V598-F717 HydrophobicContact CG1-CD1 3.93Å; V598-F717 HydrophobicContact CG1-CG 4.1Å; I600-F717 HydrophobicContact CD1-CD1 4.3Å; I600-F717 HydrophobicContact CD1-CE1 3.62Å; I600-F717 HydrophobicContact CD1-CZ 4.11Å; I600-F717 HydrophobicContact CG1-CD1 3.65Å; I600-F717 HydrophobicContact CG1-CE1 3.48Å; I600-F717 VanDerWaalsContact CG1-CE1 3.48Å; I600-F717 HydrophobicContact CG1-CZ 4.34Å; S715-F717 PolarHBondContact O-N 3.05Å; S715-F717 VanDerWaalsContact O-N 3.12Å; S715-F717 PolarHBondContact OG-O 2.95Å; F717-L750 HydrophobicContact CZ-CB 4.25Å; F717-Y751 AromaticContact CD1-CD2 3.91Å; F717-Y751 HydrophobicContact CD1-CD2 3.91Å; F717-Y751 AromaticContact CD2-CD2 3.83Å; F717-Y751 HydrophobicContact CD2-CD2 3.83Å; F717-Y751 HydrophobicContact CD2-CE2 4.47Å; F717-Y751 AromaticContact CE1-CD2 3.97Å; F717-Y751 HydrophobicContact CE1-CD2 3.97Å; F717-Y751 HydrophobicContact CE1-CG 4.28Å; F717-Y751 AromaticContact CE2-CD2 3.9Å; F717-Y751 HydrophobicContact CE2-CD2 3.9Å; F717-Y751 AromaticContact CG-CD2 3.84Å; F717-Y751 HydrophobicContact CG-CD2 3.84Å; F717-Y751 HydrophobicContact CG-CE2 4.39Å; F717-Y751 AromaticContact CZ-CD2 3.97Å; F717-Y751 HydrophobicContact CZ-CD2 3.97Å; F717-Y751 HydrophobicContact CZ-CG 4.32Å
718	H	79.5	Confident	62.2	Low	89 Å²	89	77.3 Å²	77.3	41%	0.412	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	158.5	169.8	-74.9	49.3	0	0	0	110.5	V598 Y599 P601	V598-H718 WeakPolarHBondContact CA-O 3.33Å; Y599-H718 HydrophobicContact CD1-CB 4.08Å; Y599-H718 WeakPolarHBondContact CD1-O 3.42Å; Y599-H718 HydrophobicContact CE1-CB 3.52Å; Y599-H718 HydrophobicContact CE2-CB 4.13Å; Y599-H718 PolarHBondContact N-O 3.39Å; Y599-H718 PolarHBondContact O-N 2.94Å; P601-H718 WeakPolarHBondContact CG-ND1 3.29Å
719	Q	83	Confident	64.8	Low	85 Å²	85	70.1 Å²	70.1	40%	0.397	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	115	-165.1	-67.3	169	-14.5	0	0	111.3	R596 I597 V598	R596-Q719 HydrophobicContact CG-CB 4.42Å; R596-Q719 VanDerWaalsContact NH2-OE1 3.07Å; I597-Q719 WeakPolarHBondContact O-CA 3.39Å; V598-Q719 HydrophobicContact CG1-CG 4.46Å; V598-Q719 HydrophobicContact CG2-CG 4.4Å
720	L	83.4	Confident	67.3	Low	6 Å²	6	69.2 Å²	69.2	3%	0.031	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	133.5	169.6	-57	179.8	0	0	0	108.8	Y459 I479 I496 R596 I597 Y599 F722	Y459-L720 HydrophobicContact CE2-CB 4.17Å; Y459-L720 HydrophobicContact CE2-CD2 4.05Å; Y459-L720 WeakPolarHBondContact OH-CD2 3.5Å; I479-L720 HydrophobicContact CD1-CD1 3.57Å; I496-L720 HydrophobicContact CD1-CD1 3.68Å; R596-L720 CarbonylContact C-O 3.54Å; R596-L720 VanDerWaalsContact CA-O 3.27Å; R596-L720 WeakPolarHBondContact CA-O 3.49Å; I597-L720 HydrophobicContact CB-CB 4.41Å; I597-L720 PolarHBondContact N-O 3.01Å; I597-L720 PolarHBondContact O-N 3.18Å; Y599-L720 HydrophobicContact CD1-CD1 4.49Å; Y599-L720 HydrophobicContact CD1-CG 4.09Å; Y599-L720 HydrophobicContact CE1-CD1 4.31Å; Y599-L720 HydrophobicContact CE1-CD2 3.9Å; Y599-L720 HydrophobicContact CE1-CG 3.69Å; L720-F722 HydrophobicContact CB-CD2 4.41Å; L720-F722 HydrophobicContact CB-CE2 3.56Å; L720-F722 HydrophobicContact CB-CZ 4Å; L720-F722 HydrophobicContact CD1-CE2 4.32Å; L720-F722 HydrophobicContact CD1-CZ 4.19Å
721	C	84.6	Confident	69.9	Low	13 Å²	13	67 Å²	67	9%	0.088	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.4	-178.9	-57.2	0	0	0	0	109.5	Y459 L460	Y459-C721 WeakPolarHBondContact CD2-O 3.39Å; L460-C721 HydrophobicContact CB-CB 4.2Å; L460-C721 WeakPolarHBondContact CB-O 3.39Å; L460-C721 HydrophobicContact CD1-CB 4.25Å; L460-C721 PolarHBondContact N-O 3.39Å
722	F	85.4	Confident	72.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.9	-175.7	-58.5	-89	0	0	0	110.8	V457 T458 Y459 V468 L470 I479 Q594 F595 I597 L720	V457-F722 HydrophobicContact CB-CB 4.5Å; V457-F722 HydrophobicContact CB-CD1 4.37Å; V457-F722 HydrophobicContact CG2-CD1 3.56Å; V457-F722 HydrophobicContact CG2-CE1 4.07Å; V457-F722 HydrophobicContact CG2-CG 4.3Å; T458-F722 CarbonylContact O-C 3.32Å; T458-F722 WeakPolarHBondContact O-CA 3.49Å; Y459-F722 AromaticContact CD2-CD1 3.71Å; Y459-F722 HydrophobicContact CD2-CD1 3.71Å; Y459-F722 AromaticContact CD2-CE1 3.46Å; Y459-F722 HydrophobicContact CD2-CE1 3.46Å; Y459-F722 VanDerWaalsContact CD2-CE1 3.46Å; Y459-F722 HydrophobicContact CD2-CG 4.43Å; Y459-F722 AromaticContact CD2-CZ 3.99Å; Y459-F722 HydrophobicContact CD2-CZ 3.99Å; Y459-F722 HydrophobicContact CE2-CE1 4.15Å; Y459-F722 HydrophobicContact CE2-CZ 4.22Å; Y459-F722 HydrophobicContact CG-CD1 4.49Å; Y459-F722 HydrophobicContact CG-CE1 4.32Å; V468-F722 HydrophobicContact CG2-CD1 4.36Å; V468-F722 HydrophobicContact CG2-CE1 4.1Å; L470-F722 HydrophobicContact CD1-CZ 4.24Å; I479-F722 HydrophobicContact CD1-CE1 4.44Å; I479-F722 HydrophobicContact CD1-CZ 3.86Å; I479-F722 HydrophobicContact CG1-CZ 4.45Å; Q594-F722 CarbonylContact C-O 3.44Å; Q594-F722 WeakPolarHBondContact CA-O 2.9Å; F595-F722 HydrophobicContact CD1-CB 3.9Å; F595-F722 HydrophobicContact CD2-CB 4.39Å; F595-F722 HydrophobicContact CD2-CD2 4.22Å; F595-F722 HydrophobicContact CE1-CB 3.39Å; F595-F722 HydrophobicContact CE1-CG 4.24Å; F595-F722 HydrophobicContact CE2-CB 3.92Å; F595-F722 AromaticContact CE2-CD2 3.59Å; F595-F722 HydrophobicContact CE2-CD2 3.59Å; F595-F722 HydrophobicContact CE2-CE2 4.38Å; F595-F722 HydrophobicContact CE2-CG 4.01Å; F595-F722 HydrophobicContact CG-CB 4.38Å; F595-F722 HydrophobicContact CZ-CB 3.39Å; F595-F722 AromaticContact CZ-CD2 3.82Å; F595-F722 HydrophobicContact CZ-CD2 3.82Å; F595-F722 AromaticContact CZ-CG 3.73Å; F595-F722 HydrophobicContact CZ-CG 3.73Å; F595-F722 PolarHBondContact N-O 2.98Å; F595-F722 PolarHBondContact O-N 3.06Å; I597-F722 HydrophobicContact CD1-CD2 4.39Å; I597-F722 HydrophobicContact CD1-CE2 3.77Å; I597-F722 HydrophobicContact CG1-CD2 4.34Å; I597-F722 HydrophobicContact CG1-CE2 3.98Å; L720-F722 HydrophobicContact CB-CD2 4.41Å; L720-F722 HydrophobicContact CB-CE2 3.56Å; L720-F722 HydrophobicContact CB-CZ 4Å; L720-F722 HydrophobicContact CD1-CE2 4.32Å; L720-F722 HydrophobicContact CD1-CZ 4.19Å
723	E	84.3	Confident	75.2	Confident	44 Å²	44	55.9 Å²	55.9	21%	0.206	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.5	175.4	178.6	-174	176.7	0	0	109.8	T458 L460 K592 T593 Q594	T458-E723 WeakPolarHBondContact CB-O 3.37Å; T458-E723 PolarHBondContact N-O 3.38Å; T458-E723 PolarHBondContact O-N 3.47Å; T458-E723 PolarHBondContact OG1-O 3.05Å; L460-E723 HydrophobicContact CD1-CB 4.11Å; L460-E723 HydrophobicContact CD2-CB 3.87Å; L460-E723 HydrophobicContact CG-CB 4.08Å; K592-E723 HydrophobicContact CB-CG 3.91Å; K592-E723 WeakPolarHBondContact CB-OE1 3.13Å; K592-E723 HydrophobicContact CD-CG 4.15Å; K592-E723 WeakPolarHBondContact CD-OE1 3.23Å; K592-E723 IonicContact NZ-OE1 3.75Å; T593-E723 WeakPolarHBondContact O-CA 3.44Å; Q594-E723 HydrophobicContact CG-CB 4.31Å; Q594-E723 HydrophobicContact CG-CG 4.45Å
724	T	83.9	Confident	77.6	Confident	12 Å²	12	51.7 Å²	51.7	7%	0.074	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	178.9	174.7	-164	0	0	0	0	110.3	Q456 V457 K592 T593 F595 R728 A729 I732	Q456-T724 PolarHBondContact O-OG1 3.07Å; V457-T724 HydrophobicContact CG1-CG2 4.16Å; K592-T724 CarbonylContact C-O 3.42Å; K592-T724 WeakPolarHBondContact CA-O 3.42Å; T593-T724 PolarHBondContact N-O 3.42Å; T593-T724 PolarHBondContact O-N 3.45Å; T593-T724 VanDerWaalsContact O-O 3.09Å; F595-T724 HydrophobicContact CD1-CG2 4.17Å; F595-T724 HydrophobicContact CE1-CG2 3.77Å; T724-R728 HydrophobicContact CG2-CB 4.01Å; T724-R728 HydrophobicContact CG2-CG 4.12Å; T724-R728 WeakPolarHBondContact OG1-CD 3.35Å; T724-A729 HydrophobicContact CG2-CB 3.65Å; T724-I732 HydrophobicContact CG2-CD1 4.45Å
725	Q	83.5	Confident	79.9	Confident	91 Å²	91	46 Å²	46	43%	0.425	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	142.1	175.5	-72.7	177.9	-28.7	0	0	110.9	S590 S727 R728 A729	S590-Q725 PolarHBondContact OG-NE2 2.77Å; Q725-S727 VanDerWaalsContact C-N 3.28Å; Q725-S727 PolarHBondContact O-N 2.73Å; Q725-S727 VanDerWaalsContact O-N 3.17Å; Q725-R728 WeakPolarHBondContact O-CA 3.38Å; Q725-R728 PolarHBondContact O-N 3.26Å; Q725-A729 PolarHBondContact O-N 3.48Å
726	W	78.4	Confident	81	Confident	121 Å²	121	42 Å²	42	46%	0.458	20%	0.201	S	C	.	.	H	α-helix	trans	-50	-44.7	-175.6	-175.4	94.2	0	0	0	114.2	H591 T593 R728 A729 R730	H591-W726 PolarHBondContact O-N 3.07Å; T593-W726 HydrophobicContact CG2-CB 4.26Å; T593-W726 HydrophobicContact CG2-CG 4.48Å; W726-R728 PolarHBondContact O-N 3.36Å; W726-A729 PolarHBondContact O-N 3.07Å; W726-R730 WeakPolarHBondContact O-CB 3.32Å; W726-R730 PolarHBondContact O-N 3.33Å
727	S	74.5	Confident	81.4	Confident	67 Å²	67	42.3 Å²	42.3	47%	0.469	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-39.9	176.8	52	0	0	0	0	113.2	Q725 A731	Q725-S727 VanDerWaalsContact C-N 3.28Å; Q725-S727 PolarHBondContact O-N 2.73Å; Q725-S727 VanDerWaalsContact O-N 3.17Å; S727-A731 WeakPolarHBondContact O-CB 3.21Å; S727-A731 PolarHBondContact O-N 2.81Å
728	R	80.9	Confident	81.5	Confident	93 Å²	93	45.1 Å²	45.1	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-73.1	-41.3	177.7	-174.7	177.1	-73.8	167.8	1.8	111.6	Y455 Q456 T724 Q725 W726 A731 I732	Y455-R728 HydrophobicContact CD1-CG 3.72Å; Y455-R728 HydrophobicContact CE1-CG 4.29Å; Q456-R728 WeakPolarHBondContact O-CD 3.34Å; Q456-R728 PolarHBondContact O-NH1 2.75Å; T724-R728 HydrophobicContact CG2-CB 4.01Å; T724-R728 HydrophobicContact CG2-CG 4.12Å; T724-R728 WeakPolarHBondContact OG1-CD 3.35Å; Q725-R728 WeakPolarHBondContact O-CA 3.38Å; Q725-R728 PolarHBondContact O-N 3.26Å; W726-R728 PolarHBondContact O-N 3.36Å; R728-A731 PolarHBondContact O-N 2.81Å; R728-I732 HydrophobicContact CG-CD1 4.07Å; R728-I732 WeakPolarHBondContact O-CD1 3.41Å; R728-I732 VanDerWaalsContact O-CG1 3.28Å; R728-I732 WeakPolarHBondContact O-CG1 3.47Å; R728-I732 PolarHBondContact O-N 2.92Å
729	A	82.6	Confident	81.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-45.3	176.2	0	0	0	0	0	110.9	L506 T593 F595 T724 Q725 W726 I732 C733	L506-A729 HydrophobicContact CD1-CB 3.73Å; T593-A729 HydrophobicContact CG2-CB 3.24Å; F595-A729 HydrophobicContact CB-CB 4.45Å; F595-A729 HydrophobicContact CD1-CB 3.78Å; F595-A729 HydrophobicContact CE1-CB 4.46Å; F595-A729 HydrophobicContact CG-CB 4.41Å; T724-A729 HydrophobicContact CG2-CB 3.65Å; Q725-A729 PolarHBondContact O-N 3.48Å; W726-A729 PolarHBondContact O-N 3.07Å; A729-I732 WeakPolarHBondContact O-CB 3.09Å; A729-I732 PolarHBondContact O-N 2.95Å; A729-C733 PolarHBondContact O-N 3.07Å; A729-C733 PolarHBondContact O-SG 3.18Å
730	R	81.1	Confident	81.1	Confident	105 Å²	105	36.9 Å²	36.9	40%	0.396	18%	0.18	S	C	.	.	H	α-helix	trans	-60.2	-46.8	175.3	-169	173.4	-168.7	118.3	9	111.9	W726 I732 C733 D734	W726-R730 WeakPolarHBondContact O-CB 3.32Å; W726-R730 PolarHBondContact O-N 3.33Å; R730-I732 VanDerWaalsContact C-N 3.27Å; R730-I732 PolarHBondContact O-N 2.81Å; R730-C733 PolarHBondContact O-N 3.49Å; R730-D734 WeakPolarHBondContact O-CB 3.46Å; R730-D734 PolarHBondContact O-N 3.12Å
731	A	80.6	Confident	80.7	Confident	33 Å²	33	42.5 Å²	42.5	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-33.1	176.2	0	0	0	0	0	113.6	S727 R728 Q735	S727-A731 WeakPolarHBondContact O-CB 3.21Å; S727-A731 PolarHBondContact O-N 2.81Å; R728-A731 PolarHBondContact O-N 2.81Å; A731-Q735 WeakPolarHBondContact O-CB 3.49Å; A731-Q735 PolarHBondContact O-N 2.91Å
732	I	82.9	Confident	80.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-46.9	174	-70.3	161.2	0	0	0	111	Y455 V457 L470 I472 F595 T724 R728 A729 R730 Q735 L736	Y455-I732 HydrophobicContact CD1-CD1 3.93Å; Y455-I732 HydrophobicContact CD1-CG1 3.71Å; Y455-I732 HydrophobicContact CD2-CD1 4.3Å; Y455-I732 HydrophobicContact CD2-CG1 3.74Å; Y455-I732 HydrophobicContact CE1-CG1 3.89Å; Y455-I732 HydrophobicContact CE2-CG1 3.92Å; Y455-I732 HydrophobicContact CG-CD1 3.76Å; Y455-I732 HydrophobicContact CG-CG1 3.61Å; V457-I732 HydrophobicContact CG1-CD1 3.65Å; L470-I732 HydrophobicContact CD2-CD1 4.3Å; L470-I732 HydrophobicContact CD2-CG2 4.08Å; I472-I732 HydrophobicContact CD1-CG1 4.39Å; I472-I732 HydrophobicContact CD1-CG2 3.83Å; F595-I732 HydrophobicContact CD2-CG2 4.25Å; F595-I732 HydrophobicContact CE1-CD1 4.01Å; F595-I732 HydrophobicContact CE2-CG2 3.62Å; F595-I732 HydrophobicContact CZ-CD1 3.76Å; F595-I732 HydrophobicContact CZ-CG2 3.93Å; T724-I732 HydrophobicContact CG2-CD1 4.45Å; R728-I732 HydrophobicContact CG-CD1 4.07Å; R728-I732 WeakPolarHBondContact O-CD1 3.41Å; R728-I732 VanDerWaalsContact O-CG1 3.28Å; R728-I732 WeakPolarHBondContact O-CG1 3.47Å; R728-I732 PolarHBondContact O-N 2.92Å; A729-I732 WeakPolarHBondContact O-CB 3.09Å; A729-I732 PolarHBondContact O-N 2.95Å; R730-I732 VanDerWaalsContact C-N 3.27Å; R730-I732 PolarHBondContact O-N 2.81Å; I732-Q735 PolarHBondContact O-N 2.9Å; I732-L736 HydrophobicContact CG2-CD1 3.96Å; I732-L736 WeakPolarHBondContact O-CB 3.41Å; I732-L736 PolarHBondContact O-N 2.85Å
733	C	83.8	Confident	79.2	Confident	8 Å²	8	49.5 Å²	49.5	5%	0.054	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-44.6	176.3	-69.6	0	0	0	0	111.7	A729 R730 L736 N737	A729-C733 PolarHBondContact O-N 3.07Å; A729-C733 PolarHBondContact O-SG 3.18Å; R730-C733 PolarHBondContact O-N 3.49Å; C733-L736 PolarHBondContact O-N 3.16Å; C733-N737 VanDerWaalsContact O-CB 3.31Å; C733-N737 WeakPolarHBondContact O-CB 3.32Å; C733-N737 PolarHBondContact O-N 2.88Å; C733-N737 PolarHBondContact O-ND2 3.32Å
734	D	80.1	Confident	78.2	Confident	65 Å²	65	53 Å²	53	35%	0.348	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-44.6	178.7	-67	-15.1	0	0	0	110.5	R730 N737 I738	R730-D734 WeakPolarHBondContact O-CB 3.46Å; R730-D734 PolarHBondContact O-N 3.12Å; D734-N737 PolarHBondContact O-N 2.82Å; D734-I738 WeakPolarHBondContact O-CD1 3.48Å; D734-I738 VanDerWaalsContact O-CG1 3.25Å; D734-I738 WeakPolarHBondContact O-CG1 3.44Å; D734-I738 PolarHBondContact O-N 2.96Å
735	Q	80.8	Confident	77.4	Confident	5 Å²	5	52.6 Å²	52.6	2%	0.023	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-46.6	176.2	-171.4	-175.5	7.6	0	0	112.2	A449 Y455 A731 I732 N737 I738 I739	A449-Q735 PolarHBondContact O-NE2 3.16Å; A449-Q735 VanDerWaalsContact O-NE2 3.15Å; Y455-Q735 PolarHBondContact OH-OE1 2.91Å; A731-Q735 WeakPolarHBondContact O-CB 3.49Å; A731-Q735 PolarHBondContact O-N 2.91Å; I732-Q735 PolarHBondContact O-N 2.9Å; Q735-N737 VanDerWaalsContact C-N 3.33Å; Q735-N737 PolarHBondContact O-N 2.87Å; Q735-I738 PolarHBondContact O-N 2.94Å; Q735-I739 HydrophobicContact CG-CD1 3.95Å; Q735-I739 VanDerWaalsContact O-CG1 3.29Å; Q735-I739 WeakPolarHBondContact O-CG1 3.32Å; Q735-I739 PolarHBondContact O-N 3.38Å
736	L	80.7	Confident	76.8	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-65.5	-36.5	179.1	-80.4	167	0	0	0	112.2	I472 L477 C504 I597 I732 C733 I739 L740	I472-L736 HydrophobicContact CD1-CD1 4.18Å; I472-L736 HydrophobicContact CD1-CG 4.18Å; I472-L736 HydrophobicContact CG2-CD2 3.88Å; I472-L736 HydrophobicContact CG2-CG 4.3Å; L477-L736 HydrophobicContact CD1-CD1 4.09Å; L477-L736 HydrophobicContact CD1-CD2 4.04Å; C504-L736 HydrophobicContact CB-CB 3.93Å; C504-L736 HydrophobicContact CB-CD1 4.1Å; I597-L736 HydrophobicContact CD1-CD1 3.74Å; I597-L736 HydrophobicContact CG1-CD1 4.25Å; I732-L736 HydrophobicContact CG2-CD1 3.96Å; I732-L736 WeakPolarHBondContact O-CB 3.41Å; I732-L736 PolarHBondContact O-N 2.85Å; C733-L736 PolarHBondContact O-N 3.16Å; L736-I739 PolarHBondContact O-N 2.83Å; L736-L740 WeakPolarHBondContact O-CB 3.5Å; L736-L740 WeakPolarHBondContact O-CG 3.5Å; L736-L740 PolarHBondContact O-N 3.16Å
737	N	80.8	Confident	76.6	Confident	40 Å²	40	45.4 Å²	45.4	21%	0.214	23%	0.225	C	C	.	.	H	α-helix	trans	-66.3	-41	174.5	-82.6	-61.5	0	0	0	112.1	C504 C733 D734 Q735 I739 L740 E741 R748	C504-N737 PolarHBondContact O-ND2 3.47Å; C733-N737 VanDerWaalsContact O-CB 3.31Å; C733-N737 WeakPolarHBondContact O-CB 3.32Å; C733-N737 PolarHBondContact O-N 2.88Å; C733-N737 PolarHBondContact O-ND2 3.32Å; D734-N737 PolarHBondContact O-N 2.82Å; Q735-N737 VanDerWaalsContact C-N 3.33Å; Q735-N737 PolarHBondContact O-N 2.87Å; N737-I739 PolarHBondContact O-N 3.31Å; N737-L740 PolarHBondContact O-N 2.86Å; N737-E741 VanDerWaalsContact O-CB 3.27Å; N737-E741 WeakPolarHBondContact O-CB 3.42Å; N737-E741 PolarHBondContact O-N 3.14Å; N737-R748 PolarHBondContact OD1-NH1 3.09Å; N737-R748 PolarHBondContact OD1-NH2 2.7Å
738	I	77.1	Confident	76.6	Confident	70 Å²	70	44.9 Å²	44.9	36%	0.359	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-46.5	173	-68.9	162.7	0	0	0	110.9	A449 D734 Q735 E741 V742	A449-I738 HydrophobicContact CB-CG2 4.44Å; D734-I738 WeakPolarHBondContact O-CD1 3.48Å; D734-I738 VanDerWaalsContact O-CG1 3.25Å; D734-I738 WeakPolarHBondContact O-CG1 3.44Å; D734-I738 PolarHBondContact O-N 2.96Å; Q735-I738 PolarHBondContact O-N 2.94Å; I738-E741 PolarHBondContact O-N 2.75Å; I738-V742 VanDerWaalsContact O-CG2 3.32Å; I738-V742 WeakPolarHBondContact O-CG2 3.44Å; I738-V742 PolarHBondContact O-N 3.27Å
739	I	77.9	Confident	76.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-47.1	178	-61.9	160.9	0	0	0	110.4	L450 I472 I498 Q735 L736 N737 E741 V742 Y743	L450-I739 HydrophobicContact CD2-CB 4.31Å; L450-I739 HydrophobicContact CD2-CG1 3.64Å; L450-I739 HydrophobicContact CD2-CG2 4.45Å; I472-I739 HydrophobicContact CG2-CD1 3.59Å; I498-I739 HydrophobicContact CD1-CB 4.38Å; I498-I739 HydrophobicContact CD1-CG2 3.55Å; I498-I739 HydrophobicContact CG1-CG2 3.56Å; Q735-I739 HydrophobicContact CG-CD1 3.95Å; Q735-I739 VanDerWaalsContact O-CG1 3.29Å; Q735-I739 WeakPolarHBondContact O-CG1 3.32Å; Q735-I739 PolarHBondContact O-N 3.38Å; L736-I739 PolarHBondContact O-N 2.83Å; N737-I739 PolarHBondContact O-N 3.31Å; I739-E741 VanDerWaalsContact C-N 3.31Å; I739-E741 PolarHBondContact O-N 3.28Å; I739-V742 PolarHBondContact O-N 2.81Å; I739-Y743 HydrophobicContact CG2-CD2 3.88Å; I739-Y743 HydrophobicContact CG2-CE2 4.23Å; I739-Y743 WeakPolarHBondContact O-CD2 3.45Å; I739-Y743 PolarHBondContact O-N 3.02Å
740	L	76.5	Confident	75.8	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-30.7	-179.4	-72.9	171.5	0	0	0	113.6	I498 I501 L736 N737 Q744	I498-L740 HydrophobicContact CD1-CD2 4.08Å; I498-L740 HydrophobicContact CD1-CG 4.49Å; I498-L740 HydrophobicContact CG1-CD2 4.5Å; I501-L740 HydrophobicContact CB-CD2 4.11Å; I501-L740 HydrophobicContact CG2-CD1 4.04Å; I501-L740 HydrophobicContact CG2-CD2 4.16Å; I501-L740 WeakPolarHBondContact O-CD2 3.32Å; L736-L740 WeakPolarHBondContact O-CB 3.5Å; L736-L740 WeakPolarHBondContact O-CG 3.5Å; L736-L740 PolarHBondContact O-N 3.16Å; N737-L740 PolarHBondContact O-N 2.86Å; L740-Q744 PolarHBondContact O-N 3.15Å
741	E	74.4	Confident	75.5	Confident	124 Å²	124	41.5 Å²	41.5	58%	0.579	20%	0.204	S	C	*	.	H	α-helix	trans	-72	-39.9	174.8	-171.4	170.5	-170.4	0	0	111.4	N737 I738 I739	N737-E741 VanDerWaalsContact O-CB 3.27Å; N737-E741 WeakPolarHBondContact O-CB 3.42Å; N737-E741 PolarHBondContact O-N 3.14Å; I738-E741 PolarHBondContact O-N 2.75Å; I739-E741 VanDerWaalsContact C-N 3.31Å; I739-E741 PolarHBondContact O-N 3.28Å
742	V	71.2	Confident	75.1	Confident	76 Å²	76	43.6 Å²	43.6	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-67.9	-40.6	176.1	170.6	0	0	0	0	112.5	V446 I738 I739	V446-V742 HydrophobicContact CG1-CG2 4.19Å; I738-V742 VanDerWaalsContact O-CG2 3.32Å; I738-V742 WeakPolarHBondContact O-CG2 3.44Å; I738-V742 PolarHBondContact O-N 3.27Å; I739-V742 PolarHBondContact O-N 2.81Å
743	Y	67.8	Low	74.7	Confident	84 Å²	84	46.6 Å²	46.6	33%	0.329	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.3	-173.2	-81.7	-92.3	0	0	0	115.3	L450 S474 I739 S745	L450-Y743 HydrophobicContact CD1-CE2 4.48Å; L450-Y743 HydrophobicContact CD2-CE2 4.48Å; S474-Y743 WeakPolarHBondContact CB-OH 3.48Å; S474-Y743 WeakPolarHBondContact O-CE2 3.48Å; I739-Y743 HydrophobicContact CG2-CD2 3.88Å; I739-Y743 HydrophobicContact CG2-CE2 4.23Å; I739-Y743 WeakPolarHBondContact O-CD2 3.45Å; I739-Y743 PolarHBondContact O-N 3.02Å; Y743-S745 PolarHBondContact O-N 3.31Å
744	Q	63.7	Low	73.9	Confident	118 Å²	118	50.2 Å²	50.2	55%	0.551	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.1	52.1	-178.9	-64	-166.9	1.7	0	0	114.4	L740 Q746	L740-Q744 PolarHBondContact O-N 3.15Å; Q744-Q746 PolarHBondContact O-N 3.06Å
745	S	67.2	Low	73.4	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.021	24%	0.236	C	C	.	.			trans	-61.9	129.2	-172.5	93.4	0	0	0	0	112.5	I501 Y743 S747 R748 Q749	I501-S745 PolarHBondContact O-OG 3.42Å; Y743-S745 PolarHBondContact O-N 3.31Å; S745-S747 PolarHBondContact O-N 3.23Å; S745-R748 WeakPolarHBondContact O-CB 3.26Å; S745-R748 PolarHBondContact O-N 2.84Å; S745-R748 VanDerWaalsContact OG-CB 3.3Å; S745-R748 WeakPolarHBondContact OG-CB 3.49Å; S745-R748 PolarHBondContact OG-N 2.64Å; S745-R748 VanDerWaalsContact OG-N 3.07Å; S745-Q749 PolarHBondContact O-N 2.87Å
746	Q	69.5	Low	72.5	Confident	60 Å²	60	54.2 Å²	54.2	28%	0.28	26%	0.262	S	S	.	.	H	α-helix	trans	-60.3	-32.3	176	-61.5	-177.9	-30.5	0	0	111.2	Y603 I610 T611 L614 Q744 R748 Q749 L750	Y603-Q746 PolarHBondContact OH-OE1 3.09Å; I610-Q746 HydrophobicContact CG2-CB 3.59Å; T611-Q746 PolarHBondContact OG1-NE2 3.13Å; T611-Q746 PolarHBondContact OG1-OE1 3.36Å; L614-Q746 HydrophobicContact CD1-CB 3.87Å; L614-Q746 HydrophobicContact CD1-CG 4.21Å; Q744-Q746 PolarHBondContact O-N 3.06Å; Q746-R748 VanDerWaalsContact C-N 3.33Å; Q746-R748 PolarHBondContact O-N 2.82Å; Q746-Q749 PolarHBondContact O-N 2.8Å; Q746-L750 PolarHBondContact O-N 2.84Å
747	S	74.1	Confident	71.4	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-56	-42.9	171.8	-63.5	0	0	0	0	112.7	N499 Y603 S745 Y751	N499-S747 WeakPolarHBondContact O-CB 3.3Å; N499-S747 PolarHBondContact O-OG 3.43Å; Y603-S747 VanDerWaalsContact CD2-OG 3.26Å; Y603-S747 WeakPolarHBondContact CD2-OG 3.42Å; Y603-S747 WeakPolarHBondContact CE2-OG 3.23Å; S745-S747 PolarHBondContact O-N 3.23Å; S747-Y751 WeakPolarHBondContact O-CB 3.36Å; S747-Y751 PolarHBondContact O-N 2.94Å
748	R	74.7	Confident	70	Confident	57 Å²	57	65.9 Å²	65.9	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-69	-41.6	176.8	-179.7	172.2	178.1	114	-10.5	111.4	A502 N737 S745 Q746 L750 Y751 M752	A502-R748 WeakPolarHBondContact O-CA 3.49Å; A502-R748 VanDerWaalsContact O-CB 3.3Å; A502-R748 WeakPolarHBondContact O-CB 3.5Å; A502-R748 WeakPolarHBondContact O-CG 3.29Å; N737-R748 PolarHBondContact OD1-NH1 3.09Å; N737-R748 PolarHBondContact OD1-NH2 2.7Å; S745-R748 WeakPolarHBondContact O-CB 3.26Å; S745-R748 PolarHBondContact O-N 2.84Å; S745-R748 VanDerWaalsContact OG-CB 3.3Å; S745-R748 WeakPolarHBondContact OG-CB 3.49Å; S745-R748 PolarHBondContact OG-N 2.64Å; S745-R748 VanDerWaalsContact OG-N 3.07Å; Q746-R748 VanDerWaalsContact C-N 3.33Å; Q746-R748 PolarHBondContact O-N 2.82Å; R748-L750 PolarHBondContact O-N 2.83Å; R748-Y751 PolarHBondContact O-N 2.97Å; R748-M752 HydrophobicContact CG-CG 4.36Å; R748-M752 WeakPolarHBondContact O-CB 3.26Å; R748-M752 VanDerWaalsContact O-CG 3.24Å; R748-M752 WeakPolarHBondContact O-CG 3.5Å; R748-M752 PolarHBondContact O-N 2.85Å
749	Q	73.9	Confident	68.2	Low	87 Å²	87	74.3 Å²	74.3	41%	0.407	35%	0.346	S	S	.	.	H	α-helix	trans	-59.4	-47.6	176.7	-64.7	-178.7	1.9	0	0	111.4	L614 S745 Q746 M752 Q753	L614-Q749 HydrophobicContact CD1-CB 4.3Å; L614-Q749 HydrophobicContact CD2-CB 3.73Å; S745-Q749 PolarHBondContact O-N 2.87Å; Q746-Q749 PolarHBondContact O-N 2.8Å; Q749-M752 PolarHBondContact O-N 2.85Å; Q749-Q753 WeakPolarHBondContact O-CB 3.36Å; Q749-Q753 PolarHBondContact O-N 2.93Å
750	L	73.5	Confident	67.7	Low	4 Å²	4	78 Å²	78	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-41.4	175.1	-78.3	-174.1	0	0	0	113.7	W609 I610 Q613 L614 F717 Q746 R748 M752 Q753 Q754	W609-L750 HydrophobicContact CZ3-CD1 4.07Å; I610-L750 HydrophobicContact CB-CD1 3.79Å; I610-L750 HydrophobicContact CD1-CD1 4.38Å; I610-L750 HydrophobicContact CG1-CD1 3.55Å; I610-L750 HydrophobicContact CG2-CD1 3.58Å; I610-L750 HydrophobicContact CG2-CG 4.17Å; Q613-L750 HydrophobicContact CB-CD2 3.8Å; L614-L750 HydrophobicContact CD1-CG 4.34Å; L614-L750 HydrophobicContact CD2-CD2 3.78Å; L614-L750 HydrophobicContact CD2-CG 4.14Å; L614-L750 HydrophobicContact CG-CD2 3.79Å; L614-L750 HydrophobicContact CG-CG 4.09Å; F717-L750 HydrophobicContact CZ-CB 4.25Å; Q746-L750 PolarHBondContact O-N 2.84Å; R748-L750 PolarHBondContact O-N 2.83Å; L750-M752 VanDerWaalsContact C-N 3.34Å; L750-Q753 PolarHBondContact O-N 3.5Å; L750-Q754 PolarHBondContact O-N 2.66Å
751	Y	74.2	Confident	67.2	Low	35 Å²	35	82.1 Å²	82.1	14%	0.137	38%	0.382	C	S	.	.	H	α-helix	trans	-65.1	-41.2	179.6	-176.1	-104.3	0	0	0	111.3	A502 D503 V598 F717 S747 R748 Q754 R755	A502-Y751 HydrophobicContact CB-CG 4.11Å; D503-Y751 HydrophobicContact CB-CD1 3.68Å; D503-Y751 HydrophobicContact CB-CE1 3.56Å; D503-Y751 VanDerWaalsContact OD2-CE1 3.27Å; D503-Y751 WeakPolarHBondContact OD2-CE1 3.33Å; V598-Y751 HydrophobicContact CG1-CD2 4.16Å; V598-Y751 HydrophobicContact CG1-CE2 3.89Å; F717-Y751 AromaticContact CD1-CD2 3.91Å; F717-Y751 HydrophobicContact CD1-CD2 3.91Å; F717-Y751 AromaticContact CD2-CD2 3.83Å; F717-Y751 HydrophobicContact CD2-CD2 3.83Å; F717-Y751 HydrophobicContact CD2-CE2 4.47Å; F717-Y751 AromaticContact CE1-CD2 3.97Å; F717-Y751 HydrophobicContact CE1-CD2 3.97Å; F717-Y751 HydrophobicContact CE1-CG 4.28Å; F717-Y751 AromaticContact CE2-CD2 3.9Å; F717-Y751 HydrophobicContact CE2-CD2 3.9Å; F717-Y751 AromaticContact CG-CD2 3.84Å; F717-Y751 HydrophobicContact CG-CD2 3.84Å; F717-Y751 HydrophobicContact CG-CE2 4.39Å; F717-Y751 AromaticContact CZ-CD2 3.97Å; F717-Y751 HydrophobicContact CZ-CD2 3.97Å; F717-Y751 HydrophobicContact CZ-CG 4.32Å; S747-Y751 WeakPolarHBondContact O-CB 3.36Å; S747-Y751 PolarHBondContact O-N 2.94Å; R748-Y751 PolarHBondContact O-N 2.97Å; Y751-Q754 PolarHBondContact O-N 2.71Å; Y751-R755 VanDerWaalsContact O-CB 3.26Å; Y751-R755 WeakPolarHBondContact O-CB 3.38Å; Y751-R755 PolarHBondContact O-N 3.17Å
752	M	73.5	Confident	66.8	Low	77 Å²	77	79.7 Å²	79.7	38%	0.379	37%	0.371	S	S	.	.	H	α-helix	trans	-63.4	-41.5	172.9	-69	-67.5	144	0	0	111.7	R748 Q749 L750 R755 S756	R748-M752 HydrophobicContact CG-CG 4.36Å; R748-M752 WeakPolarHBondContact O-CB 3.26Å; R748-M752 VanDerWaalsContact O-CG 3.24Å; R748-M752 WeakPolarHBondContact O-CG 3.5Å; R748-M752 PolarHBondContact O-N 2.85Å; Q749-M752 PolarHBondContact O-N 2.85Å; L750-M752 VanDerWaalsContact C-N 3.34Å; M752-R755 PolarHBondContact O-N 3.4Å; M752-S756 WeakPolarHBondContact O-CB 3Å; M752-S756 PolarHBondContact O-N 2.9Å; M752-S756 PolarHBondContact O-OG 3.21Å
753	Q	72.6	Confident	66.6	Low	64 Å²	64	79.9 Å²	79.9	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-64	-38.7	175.5	-169.2	177	19.9	0	0	112.6	S617 Q749 L750 S756 I757	S617-Q753 PolarHBondContact OG-NE2 3.26Å; Q749-Q753 WeakPolarHBondContact O-CB 3.36Å; Q749-Q753 PolarHBondContact O-N 2.93Å; L750-Q753 PolarHBondContact O-N 3.5Å; Q753-S756 PolarHBondContact O-OG 3.23Å; Q753-S756 VanDerWaalsContact O-OG 3.11Å; Q753-I757 WeakPolarHBondContact O-CD1 3.29Å; Q753-I757 VanDerWaalsContact O-CG1 3.26Å; Q753-I757 WeakPolarHBondContact O-CG1 3.15Å; Q753-I757 PolarHBondContact O-N 2.76Å
754	Q	68.6	Low	66.5	Low	84 Å²	84	79.7 Å²	79.7	39%	0.393	37%	0.368	S	S	.	.	H	α-helix	trans	-71.2	-36.9	173.6	-72.9	-169.8	5.2	0	0	112.3	L750 Y751 S756 I757	L750-Q754 PolarHBondContact O-N 2.66Å; Y751-Q754 PolarHBondContact O-N 2.71Å; Q754-S756 VanDerWaalsContact C-N 3.34Å; Q754-I757 PolarHBondContact O-N 2.96Å
755	R	69.2	Low	66.7	Low	74 Å²	74	77.1 Å²	77.1	28%	0.279	36%	0.356	S	S	.	.	H	α-helix	trans	-67.8	-33.9	177.4	-163.6	171.9	-179.5	155.4	7.6	111.3	D503 E505 Y751 M752 H758	D503-R755 IonicContact OD2-NH1 3.08Å; D503-R755 PolarHBondContact OD2-NH1 3.19Å; D503-R755 VanDerWaalsContact OD2-NH1 3.16Å; E505-R755 VanDerWaalsContact CD-NH2 3.31Å; E505-R755 IonicContact OE1-CZ 2.65Å; E505-R755 IonicContact OE1-NH1 3.7Å; E505-R755 IonicContact OE1-NH2 3.46Å; E505-R755 PolarHBondContact OE1-NH2 3.14Å; E505-R755 IonicContact OE2-CZ 3.71Å; E505-R755 IonicContact OE2-NH1 3.35Å; E505-R755 PolarHBondContact OE2-NH1 2.73Å; E505-R755 IonicContact OE2-NH2 4Å; E505-R755 PolarHBondContact OE2-NH2 3.23Å; E505-R755 VanDerWaalsContact OE2-NH2 3.08Å; Y751-R755 VanDerWaalsContact O-CB 3.26Å; Y751-R755 WeakPolarHBondContact O-CB 3.38Å; Y751-R755 PolarHBondContact O-N 3.17Å; M752-R755 PolarHBondContact O-N 3.4Å; R755-H758 PolarHBondContact O-N 3.41Å
756	S	61.4	Low	66.6	Low	80 Å²	80	82.4 Å²	82.4	56%	0.559	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.7	175.3	68.2	0	0	0	0	115	M752 Q753 Q754 H758	M752-S756 WeakPolarHBondContact O-CB 3Å; M752-S756 PolarHBondContact O-N 2.9Å; M752-S756 PolarHBondContact O-OG 3.21Å; Q753-S756 PolarHBondContact O-OG 3.23Å; Q753-S756 VanDerWaalsContact O-OG 3.11Å; Q754-S756 VanDerWaalsContact C-N 3.34Å; S756-H758 VanDerWaalsContact C-N 3.33Å
757	I	57.7	Low	66.4	Low	125 Å²	125	84.2 Å²	84.2	64%	0.641	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-12.8	169.4	-69.5	163.7	0	0	0	111.2	Q753 Q754	Q753-I757 WeakPolarHBondContact O-CD1 3.29Å; Q753-I757 VanDerWaalsContact O-CG1 3.26Å; Q753-I757 WeakPolarHBondContact O-CG1 3.15Å; Q753-I757 PolarHBondContact O-N 2.76Å; Q754-I757 PolarHBondContact O-N 2.96Å
758	H	51.5	Low	65.8	Low	160 Å²	160	91.2 Å²	91.2	74%	0.741	42%	0.42	S	S	*	.			trans	-107.8	7.6	-176.3	-101.7	-68	0	0	0	115	R755 S756	R755-H758 PolarHBondContact O-N 3.41Å; S756-H758 VanDerWaalsContact C-N 3.33Å
759	Y	38.7	Very low	65	Low	247 Å²	247	94.3 Å²	94.3	97%	0.969	44%	0.439	S	S	*	.			trans	-113	0	167.3	-87.1	-80.3	0	0	0	109.9

Retrieved 759 of 759 residues in 1440.4 ms (Link to these results)

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