A0A061IE06_CRIGR Loading...

Cytochrome P450 26C1

AlphaFold DB , UniProt , Accession A0A061IE06, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100755258, Length 518 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	48.1	Very low	57.5	Low	238 Å²	238	130.3 Å²	130.3	100%	1.172	72%	0.716	S	S	*	*				0	141.9	0	-88.5	173.2	145.5	0	0	108.4
2	L	50.3	Low	59.2	Low	171 Å²	171	129.4 Å²	129.4	90%	0.895	71%	0.709	S	S	*	*			trans	82.3	83.1	175.4	-65	120.9	0	0	0	118.6
3	S	48.6	Very low	61.1	Low	110 Å²	110	122.6 Å²	122.6	77%	0.769	69%	0.687	S	S	*	*	S	Bend	trans	-140.9	17.8	154.1	73.9	0	0	0	0	114.2
4	W	52.8	Low	62.7	Low	219 Å²	219	117.9 Å²	117.9	83%	0.83	67%	0.671	S	S	*	*	S	Bend	trans	-116.9	5	-177.7	-76	68.9	0	0	0	114	S7	W4-S7 PolarHBondContact O-OG 3Å
5	G	50.7	Low	64.3	Low	52 Å²	52	113.3 Å²	113.3	54%	0.536	65%	0.653	S	S	.	*	S	Bend	trans	-89.7	-23.3	-171.6	0	0	0	0	0	116.6
6	L	53.6	Low	65.8	Low	159 Å²	159	108.6 Å²	108.6	83%	0.832	64%	0.637	S	S	*	*	H	α-helix	trans	-91.6	-9.6	-175.1	-86	140.2	0	0	0	114.1	S10	L6-S10 PolarHBondContact O-OG 2.8Å
7	S	60.1	Low	67.2	Low	57 Å²	57	107.2 Å²	107.2	40%	0.399	63%	0.63	S	S	.	*	H	α-helix	trans	-82.1	-34.2	179.8	51.4	0	0	0	0	112.8	W4 S10 M11	W4-S7 PolarHBondContact O-OG 3Å; S7-S10 PolarHBondContact O-OG 3.42Å; S7-S10 VanDerWaalsContact O-OG 3.06Å; S7-M11 VanDerWaalsContact O-CB 3.24Å; S7-M11 WeakPolarHBondContact O-CB 3.3Å; S7-M11 WeakPolarHBondContact O-CG 3.46Å; S7-M11 PolarHBondContact O-N 2.83Å
8	C	58.2	Low	68.5	Low	80 Å²	80	104.5 Å²	104.5	54%	0.541	62%	0.622	S	S	.	*	H	α-helix	trans	-72.9	-39.3	-179	-69.6	0	0	0	0	113.2	M11 L12	C8-M11 PolarHBondContact O-N 3.16Å; C8-L12 WeakPolarHBondContact O-CB 3.26Å; C8-L12 WeakPolarHBondContact O-CG 3.27Å; C8-L12 PolarHBondContact O-N 2.83Å
9	L	63.6	Low	69.8	Low	132 Å²	132	105.8 Å²	105.8	69%	0.691	63%	0.625	S	S	*	*	H	α-helix	trans	-68.9	-37.9	179	-82.8	157.1	0	0	0	112.6	G13	L9-G13 PolarHBondContact O-N 2.9Å
10	S	73.7	Confident	71	Confident	73 Å²	73	106.6 Å²	106.6	51%	0.51	63%	0.625	S	S	.	*	H	α-helix	trans	-71	-37.9	174.7	51.9	0	0	0	0	112	L6 S7 G13 A14	L6-S10 PolarHBondContact O-OG 2.8Å; S7-S10 PolarHBondContact O-OG 3.42Å; S7-S10 VanDerWaalsContact O-OG 3.06Å; S10-G13 PolarHBondContact O-N 3.29Å; S10-A14 WeakPolarHBondContact O-CB 3.32Å; S10-A14 PolarHBondContact O-N 3.23Å
11	M	72.6	Confident	72	Confident	142 Å²	142	104.9 Å²	104.9	70%	0.7	62%	0.619	S	S	*	*	H	α-helix	trans	-63.3	-43.2	171	-75.2	-101.7	154.7	0	0	112.4	S7 C8 A14 A15	S7-M11 VanDerWaalsContact O-CB 3.24Å; S7-M11 WeakPolarHBondContact O-CB 3.3Å; S7-M11 WeakPolarHBondContact O-CG 3.46Å; S7-M11 PolarHBondContact O-N 2.83Å; C8-M11 PolarHBondContact O-N 3.16Å; M11-A14 PolarHBondContact O-N 3.01Å; M11-A15 VanDerWaalsContact O-CB 3.29Å; M11-A15 WeakPolarHBondContact O-CB 3.49Å; M11-A15 PolarHBondContact O-N 3.27Å
12	L	78.4	Confident	74.1	Confident	120 Å²	120	95.8 Å²	95.8	63%	0.628	58%	0.581	S	S	*	*	H	α-helix	trans	-66.9	-39	176	-74.4	167	0	0	0	112	C8 A15 G16	C8-L12 WeakPolarHBondContact O-CB 3.26Å; C8-L12 WeakPolarHBondContact O-CG 3.27Å; C8-L12 PolarHBondContact O-N 2.83Å; L12-A15 PolarHBondContact O-N 2.79Å; L12-G16 PolarHBondContact O-N 3.44Å
13	G	83.1	Confident	76.1	Confident	41 Å²	41	89.5 Å²	89.5	42%	0.423	56%	0.558	S	S	.	*	H	α-helix	trans	-64.2	-44.2	173.9	0	0	0	0	0	112.5	L9 S10 G16 T17	L9-G13 PolarHBondContact O-N 2.9Å; S10-G13 PolarHBondContact O-N 3.29Å; G13-G16 PolarHBondContact O-N 3.29Å; G13-T17 WeakPolarHBondContact O-CG2 3.49Å; G13-T17 PolarHBondContact O-N 2.91Å; G13-T17 PolarHBondContact O-OG1 2.94Å
14	A	84.2	Confident	78.2	Confident	57 Å²	57	88.8 Å²	88.8	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-39.2	175.3	0	0	0	0	0	112.4	S10 M11 T17 A18	S10-A14 WeakPolarHBondContact O-CB 3.32Å; S10-A14 PolarHBondContact O-N 3.23Å; M11-A14 PolarHBondContact O-N 3.01Å; A14-T17 WeakPolarHBondContact CA-OG1 3.37Å; A14-T17 PolarHBondContact O-OG1 3.49Å; A14-T17 VanDerWaalsContact O-OG1 3.04Å; A14-A18 WeakPolarHBondContact O-CB 3.24Å; A14-A18 PolarHBondContact O-N 2.96Å
15	A	85.9	Confident	80.2	Confident	49 Å²	49	84 Å²	84	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-42	172.5	0	0	0	0	0	111.2	M11 L12 A18 L19	M11-A15 VanDerWaalsContact O-CB 3.29Å; M11-A15 WeakPolarHBondContact O-CB 3.49Å; M11-A15 PolarHBondContact O-N 3.27Å; L12-A15 PolarHBondContact O-N 2.79Å; A15-A18 PolarHBondContact O-N 3.31Å; A15-L19 WeakPolarHBondContact O-CB 3.4Å; A15-L19 VanDerWaalsContact O-CG 3.23Å; A15-L19 WeakPolarHBondContact O-CG 3.38Å; A15-L19 PolarHBondContact O-N 2.98Å
16	G	89.2	Confident	82.1	Confident	38 Å²	38	86.2 Å²	86.2	39%	0.392	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.6	0	0	0	0	0	113.1	L12 G13 L19 L20	L12-G16 PolarHBondContact O-N 3.44Å; G13-G16 PolarHBondContact O-N 3.29Å; G16-L19 PolarHBondContact O-N 3.22Å; G16-L20 WeakPolarHBondContact O-CB 3.46Å; G16-L20 PolarHBondContact O-N 3.43Å
17	T	90.1	Very high	83.9	Confident	85 Å²	85	80.1 Å²	80.1	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-67.9	-38.8	175.9	53.3	0	0	0	0	112	G13 A14 L20 C21	G13-T17 WeakPolarHBondContact O-CG2 3.49Å; G13-T17 PolarHBondContact O-N 2.91Å; G13-T17 PolarHBondContact O-OG1 2.94Å; A14-T17 WeakPolarHBondContact CA-OG1 3.37Å; A14-T17 PolarHBondContact O-OG1 3.49Å; A14-T17 VanDerWaalsContact O-OG1 3.04Å; T17-L20 PolarHBondContact O-N 3.25Å; T17-C21 WeakPolarHBondContact O-CB 3.38Å; T17-C21 PolarHBondContact O-N 3.09Å; T17-C21 PolarHBondContact O-SG 3.08Å
18	A	90.3	Very high	85.5	Confident	58 Å²	58	81.9 Å²	81.9	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-43.5	174.3	0	0	0	0	0	111.9	A14 A15 C21 A22	A14-A18 WeakPolarHBondContact O-CB 3.24Å; A14-A18 PolarHBondContact O-N 2.96Å; A15-A18 PolarHBondContact O-N 3.31Å; A18-C21 PolarHBondContact O-N 3.09Å; A18-A22 VanDerWaalsContact O-CB 3.28Å; A18-A22 WeakPolarHBondContact O-CB 3.38Å; A18-A22 PolarHBondContact O-N 2.91Å
19	L	92.4	Very high	87.1	Confident	129 Å²	129	80 Å²	80	68%	0.675	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-40.5	175.5	-73.5	170.7	0	0	0	112	A15 G16 A22 G23	A15-L19 WeakPolarHBondContact O-CB 3.4Å; A15-L19 VanDerWaalsContact O-CG 3.23Å; A15-L19 WeakPolarHBondContact O-CG 3.38Å; A15-L19 PolarHBondContact O-N 2.98Å; G16-L19 PolarHBondContact O-N 3.22Å; L19-A22 PolarHBondContact O-N 3.12Å; L19-G23 PolarHBondContact O-N 3.01Å
20	L	93.4	Very high	88.4	Confident	122 Å²	122	76.7 Å²	76.7	64%	0.639	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-49.6	175.2	-171.3	101.7	0	0	0	111.3	G16 T17 A22 G23 V24	G16-L20 WeakPolarHBondContact O-CB 3.46Å; G16-L20 PolarHBondContact O-N 3.43Å; T17-L20 PolarHBondContact O-N 3.25Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.5Å; L20-G23 PolarHBondContact O-N 3.05Å; L20-G23 VanDerWaalsContact O-N 3.15Å; L20-V24 WeakPolarHBondContact O-CG2 3.13Å; L20-V24 PolarHBondContact O-N 2.93Å
21	C	93.6	Very high	89.3	Confident	71 Å²	71	78.5 Å²	78.5	48%	0.48	49%	0.493	S	S	.	.	H	α-helix	trans	-59.4	-43.6	176.8	-73.5	0	0	0	0	111.4	T17 A18 G23 V24 L25	T17-C21 WeakPolarHBondContact O-CB 3.38Å; T17-C21 PolarHBondContact O-N 3.09Å; T17-C21 PolarHBondContact O-SG 3.08Å; A18-C21 PolarHBondContact O-N 3.09Å; C21-G23 VanDerWaalsContact C-N 3.34Å; C21-G23 PolarHBondContact O-N 3.49Å; C21-V24 PolarHBondContact O-N 3.23Å; C21-L25 WeakPolarHBondContact O-CB 3.23Å; C21-L25 VanDerWaalsContact O-CG 3.29Å; C21-L25 WeakPolarHBondContact O-CG 3.22Å; C21-L25 PolarHBondContact O-N 3.31Å
22	A	91.4	Very high	90.2	Very high	46 Å²	46	76.6 Å²	76.6	38%	0.38	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-43.6	174.6	0	0	0	0	0	111.4	A18 L19 L20 L25 L26	A18-A22 VanDerWaalsContact O-CB 3.28Å; A18-A22 WeakPolarHBondContact O-CB 3.38Å; A18-A22 PolarHBondContact O-N 2.91Å; L19-A22 PolarHBondContact O-N 3.12Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.5Å; A22-L25 PolarHBondContact O-N 3.25Å; A22-L26 WeakPolarHBondContact O-CB 3.42Å; A22-L26 WeakPolarHBondContact O-CG 3.13Å; A22-L26 PolarHBondContact O-N 3.37Å
23	G	92.2	Very high	90.9	Very high	40 Å²	40	71.9 Å²	71.9	41%	0.412	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-44.7	176.1	0	0	0	0	0	113.2	L19 L20 C21 L26 G27	L19-G23 PolarHBondContact O-N 3.01Å; L20-G23 PolarHBondContact O-N 3.05Å; L20-G23 VanDerWaalsContact O-N 3.15Å; C21-G23 VanDerWaalsContact C-N 3.34Å; C21-G23 PolarHBondContact O-N 3.49Å; G23-L26 PolarHBondContact O-N 3.4Å; G23-G27 PolarHBondContact O-N 3.44Å
24	V	93.8	Very high	91.2	Very high	95 Å²	95	73.3 Å²	73.3	58%	0.576	46%	0.459	S	S	*	.	H	α-helix	trans	-64.4	-45.2	176.8	173	0	0	0	0	111.1	L20 C21 L26 G27 L28	L20-V24 WeakPolarHBondContact O-CG2 3.13Å; L20-V24 PolarHBondContact O-N 2.93Å; C21-V24 PolarHBondContact O-N 3.23Å; V24-L26 PolarHBondContact O-N 3.1Å; V24-G27 PolarHBondContact O-N 2.7Å; V24-L28 WeakPolarHBondContact O-CB 3.29Å; V24-L28 PolarHBondContact O-N 2.78Å
25	L	93.1	Very high	91.5	Very high	117 Å²	117	74.7 Å²	74.7	61%	0.613	46%	0.459	S	S	*	.	H	α-helix	trans	-63.1	-40.9	177.7	-73.3	172.6	0	0	0	111.9	C21 A22 L28 A29	C21-L25 WeakPolarHBondContact O-CB 3.23Å; C21-L25 VanDerWaalsContact O-CG 3.29Å; C21-L25 WeakPolarHBondContact O-CG 3.22Å; C21-L25 PolarHBondContact O-N 3.31Å; A22-L25 PolarHBondContact O-N 3.25Å; L25-L28 PolarHBondContact O-N 3.25Å; L25-A29 VanDerWaalsContact O-CB 3.24Å; L25-A29 WeakPolarHBondContact O-CB 3.34Å; L25-A29 PolarHBondContact O-N 2.9Å
26	L	91.1	Very high	91.8	Very high	99 Å²	99	79.6 Å²	79.6	52%	0.518	47%	0.467	S	S	.	.	H	α-helix	trans	-63.5	-44.5	174.6	-75.3	168.7	0	0	0	111.5	A22 G23 V24 A29 Q30 W56	A22-L26 WeakPolarHBondContact O-CB 3.42Å; A22-L26 WeakPolarHBondContact O-CG 3.13Å; A22-L26 PolarHBondContact O-N 3.37Å; G23-L26 PolarHBondContact O-N 3.4Å; V24-L26 PolarHBondContact O-N 3.1Å; L26-A29 PolarHBondContact O-N 2.09Å; L26-Q30 WeakPolarHBondContact O-CB 3.48Å; L26-Q30 PolarHBondContact O-N 3.29Å; L26-W56 HydrophobicContact CD2-CZ3 4.41Å
27	G	91.6	Very high	91.9	Very high	32 Å²	32	78.9 Å²	78.9	33%	0.33	45%	0.452	S	S	.	.	H	α-helix	trans	-62	-44.3	175.9	0	0	0	0	0	112.5	G23 V24 Q30 N31	G23-G27 PolarHBondContact O-N 3.44Å; V24-G27 PolarHBondContact O-N 2.7Å; G27-Q30 PolarHBondContact O-N 3.14Å; G27-N31 WeakPolarHBondContact O-CB 3.38Å; G27-N31 PolarHBondContact O-N 3.03Å; G27-N31 PolarHBondContact O-ND2 3.16Å
28	L	93.5	Very high	91.7	Very high	93 Å²	93	77.9 Å²	77.9	49%	0.487	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-45.9	175.6	-178.6	63.9	0	0	0	111.4	V24 L25 Q30 N31 L32	V24-L28 WeakPolarHBondContact O-CB 3.29Å; V24-L28 PolarHBondContact O-N 2.78Å; L25-L28 PolarHBondContact O-N 3.25Å; L28-Q30 VanDerWaalsContact C-N 3.31Å; L28-Q30 PolarHBondContact O-N 3.01Å; L28-N31 PolarHBondContact O-N 2.82Å; L28-L32 HydrophobicContact CD1-CD1 4.21Å; L28-L32 HydrophobicContact CD1-CG 4.17Å; L28-L32 HydrophobicContact CG-CD1 3.97Å; L28-L32 HydrophobicContact CG-CG 4.33Å; L28-L32 WeakPolarHBondContact O-CB 3.43Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.48Å
29	A	92.4	Very high	91.7	Very high	40 Å²	40	81 Å²	81	33%	0.331	45%	0.454	S	S	.	.	H	α-helix	trans	-59.7	-42	177.4	0	0	0	0	0	111.6	L25 L26 W33 P57	L25-A29 VanDerWaalsContact O-CB 3.24Å; L25-A29 WeakPolarHBondContact O-CB 3.34Å; L25-A29 PolarHBondContact O-N 2.9Å; L26-A29 PolarHBondContact O-N 2.09Å; A29-W33 WeakPolarHBondContact O-CB 3.41Å; A29-W33 PolarHBondContact O-N 3.09Å; A29-P57 HydrophobicContact CB-CG 4.24Å
30	Q	91.1	Very high	91.5	Very high	63 Å²	63	76.8 Å²	76.8	29%	0.294	44%	0.435	S	S	.	.	H	α-helix	trans	-66.4	-40	176.8	-170	63	23.8	0	0	112.4	L26 G27 L28 W33 T34 G55	L26-Q30 WeakPolarHBondContact O-CB 3.48Å; L26-Q30 PolarHBondContact O-N 3.29Å; G27-Q30 PolarHBondContact O-N 3.14Å; L28-Q30 VanDerWaalsContact C-N 3.31Å; L28-Q30 PolarHBondContact O-N 3.01Å; Q30-W33 PolarHBondContact O-N 3.17Å; Q30-T34 WeakPolarHBondContact O-CB 3.35Å; Q30-T34 PolarHBondContact O-N 2.93Å; Q30-T34 PolarHBondContact O-OG1 3.16Å; Q30-G55 PolarHBondContact NE2-O 2.8Å
31	N	91.3	Very high	91.4	Very high	112 Å²	112	78.2 Å²	78.2	60%	0.599	43%	0.432	S	S	*	.	H	α-helix	trans	-66.4	-46.7	175.8	-80.5	-46.6	0	0	0	111.8	G27 L28 W33 T34 L35	G27-N31 WeakPolarHBondContact O-CB 3.38Å; G27-N31 PolarHBondContact O-N 3.03Å; G27-N31 PolarHBondContact O-ND2 3.16Å; L28-N31 PolarHBondContact O-N 2.82Å; N31-W33 VanDerWaalsContact C-N 3.29Å; N31-W33 PolarHBondContact O-N 3.26Å; N31-T34 PolarHBondContact O-N 3.33Å; N31-L35 VanDerWaalsContact O-CB 3.3Å; N31-L35 WeakPolarHBondContact O-CB 3.35Å; N31-L35 PolarHBondContact O-N 3.21Å
32	L	93.3	Very high	91.4	Very high	101 Å²	101	76.9 Å²	76.9	53%	0.529	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-37.6	175.9	-70.4	175.7	0	0	0	111.8	L28 L35 R36	L28-L32 HydrophobicContact CD1-CD1 4.21Å; L28-L32 HydrophobicContact CD1-CG 4.17Å; L28-L32 HydrophobicContact CG-CD1 3.97Å; L28-L32 HydrophobicContact CG-CG 4.33Å; L28-L32 WeakPolarHBondContact O-CB 3.43Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.48Å; L32-L35 PolarHBondContact O-N 3.35Å; L32-R36 VanDerWaalsContact O-CB 3.27Å; L32-R36 WeakPolarHBondContact O-CB 3.25Å; L32-R36 PolarHBondContact O-N 3.25Å
33	W	92.7	Very high	91.3	Very high	21 Å²	21	80.3 Å²	80.3	8%	0.08	44%	0.438	C	S	.	.	H	α-helix	trans	-63.4	-46.3	174.5	-177.6	-113.4	0	0	0	111.9	A29 Q30 N31 R36 W37 M54 G55 P57 F58 H87	A29-W33 WeakPolarHBondContact O-CB 3.41Å; A29-W33 PolarHBondContact O-N 3.09Å; Q30-W33 PolarHBondContact O-N 3.17Å; N31-W33 VanDerWaalsContact C-N 3.29Å; N31-W33 PolarHBondContact O-N 3.26Å; W33-R36 PolarHBondContact O-N 3.32Å; W33-W37 AromaticContact CD2-CD1 3.91Å; W33-W37 AromaticContact CD2-NE1 3.35Å; W33-W37 AromaticContact CE2-CD1 3.75Å; W33-W37 AromaticContact CE2-NE1 3.05Å; W33-W37 AromaticContact CE3-NE1 3.7Å; W33-W37 AromaticContact CH2-CE2 3.87Å; W33-W37 AromaticContact CH2-CZ2 3.63Å; W33-W37 HydrophobicContact CH2-CZ2 3.63Å; W33-W37 AromaticContact CH2-NE1 3.48Å; W33-W37 AromaticContact CZ2-CE2 3.86Å; W33-W37 AromaticContact CZ2-CZ2 3.99Å; W33-W37 HydrophobicContact CZ2-CZ2 3.99Å; W33-W37 AromaticContact CZ2-NE1 3.12Å; W33-W37 HydrophobicContact CZ3-CZ2 4.09Å; W33-W37 AromaticContact CZ3-NE1 3.76Å; W33-W37 AromaticContact NE1-CD1 3.86Å; W33-W37 AromaticContact NE1-NE1 3.6Å; W33-W37 PolarHBondContact O-N 3.12Å; W33-M54 PolarHBondContact NE1-O 3.47Å; W33-G55 PolarHBondContact NE1-O 3.46Å; W33-P57 HydrophobicContact CB-CB 4.33Å; W33-P57 HydrophobicContact CB-CG 3.92Å; W33-P57 HydrophobicContact CD2-CB 4.09Å; W33-P57 HydrophobicContact CD2-CG 4.46Å; W33-P57 HydrophobicContact CE3-CB 4.08Å; W33-P57 HydrophobicContact CG-CB 4.23Å; W33-P57 HydrophobicContact CG-CG 4.08Å; W33-F58 VanDerWaalsContact CH2-N 3.29Å; W33-H87 AromaticContact CH2-CE1 3.78Å; W33-H87 AromaticContact CH2-NE2 3.55Å; W33-H87 AromaticContact CZ2-CD2 3.78Å; W33-H87 AromaticContact CZ2-CE1 3.87Å; W33-H87 AromaticContact CZ2-CG 3.96Å; W33-H87 AromaticContact CZ2-NE2 3.74Å
34	T	88.8	Confident	91.4	Very high	71 Å²	71	82.9 Å²	82.9	44%	0.436	46%	0.456	S	S	.	.	H	α-helix	trans	-62.9	-47.9	176.7	-55.5	0	0	0	0	110.2	Q30 N31 R36 W37 T38	Q30-T34 WeakPolarHBondContact O-CB 3.35Å; Q30-T34 PolarHBondContact O-N 2.93Å; Q30-T34 PolarHBondContact O-OG1 3.16Å; N31-T34 PolarHBondContact O-N 3.33Å; T34-R36 PolarHBondContact O-N 3.16Å; T34-W37 PolarHBondContact O-N 3.5Å; T34-W37 VanDerWaalsContact O-N 3.17Å; T34-T38 PolarHBondContact O-N 3.38Å; T34-T38 PolarHBondContact O-OG1 2.88Å
35	L	91.2	Very high	91.3	Very high	87 Å²	87	79.9 Å²	79.9	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-56.4	-49.2	178.5	-177.4	62.5	0	0	0	111.4	N31 L32 W37 T38 L39	N31-L35 VanDerWaalsContact O-CB 3.3Å; N31-L35 WeakPolarHBondContact O-CB 3.35Å; N31-L35 PolarHBondContact O-N 3.21Å; L32-L35 PolarHBondContact O-N 3.35Å; L35-W37 VanDerWaalsContact C-N 3.27Å; L35-W37 PolarHBondContact O-N 3.01Å; L35-T38 WeakPolarHBondContact CA-OG1 3.43Å; L35-T38 PolarHBondContact O-N 3.35Å; L35-T38 PolarHBondContact O-OG1 3.18Å; L35-L39 HydrophobicContact CD1-CD1 4.16Å; L35-L39 HydrophobicContact CD1-CG 4.14Å; L35-L39 HydrophobicContact CG-CD1 3.92Å; L35-L39 HydrophobicContact CG-CG 4.31Å; L35-L39 WeakPolarHBondContact O-CB 3.46Å; L35-L39 VanDerWaalsContact O-CG 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.34Å; L35-L39 PolarHBondContact O-N 2.96Å
36	R	92.1	Very high	91.3	Very high	152 Å²	152	81.3 Å²	81.3	57%	0.574	45%	0.453	S	S	*	.	H	α-helix	trans	-50.5	-47.4	176.9	173.3	-178.5	176.7	78.7	1.8	111.6	L32 W33 T34 L39 S40	L32-R36 VanDerWaalsContact O-CB 3.27Å; L32-R36 WeakPolarHBondContact O-CB 3.25Å; L32-R36 PolarHBondContact O-N 3.25Å; W33-R36 PolarHBondContact O-N 3.32Å; T34-R36 PolarHBondContact O-N 3.16Å; R36-L39 PolarHBondContact O-N 3.41Å; R36-S40 PolarHBondContact O-N 2.92Å; R36-S40 VanDerWaalsContact O-N 3.16Å
37	W	89.9	Confident	91.6	Very high	22 Å²	22	78.6 Å²	78.6	8%	0.083	44%	0.439	C	S	.	.	H	α-helix	trans	-77.4	-33.3	-177	-64.6	120.9	0	0	0	113	W33 T34 L35 L39 S40 M54 H87 P92 W401	W33-W37 AromaticContact CD2-CD1 3.91Å; W33-W37 AromaticContact CD2-NE1 3.35Å; W33-W37 AromaticContact CE2-CD1 3.75Å; W33-W37 AromaticContact CE2-NE1 3.05Å; W33-W37 AromaticContact CE3-NE1 3.7Å; W33-W37 AromaticContact CH2-CE2 3.87Å; W33-W37 AromaticContact CH2-CZ2 3.63Å; W33-W37 HydrophobicContact CH2-CZ2 3.63Å; W33-W37 AromaticContact CH2-NE1 3.48Å; W33-W37 AromaticContact CZ2-CE2 3.86Å; W33-W37 AromaticContact CZ2-CZ2 3.99Å; W33-W37 HydrophobicContact CZ2-CZ2 3.99Å; W33-W37 AromaticContact CZ2-NE1 3.12Å; W33-W37 HydrophobicContact CZ3-CZ2 4.09Å; W33-W37 AromaticContact CZ3-NE1 3.76Å; W33-W37 AromaticContact NE1-CD1 3.86Å; W33-W37 AromaticContact NE1-NE1 3.6Å; W33-W37 PolarHBondContact O-N 3.12Å; T34-W37 PolarHBondContact O-N 3.5Å; T34-W37 VanDerWaalsContact O-N 3.17Å; L35-W37 VanDerWaalsContact C-N 3.27Å; L35-W37 PolarHBondContact O-N 3.01Å; W37-L39 VanDerWaalsContact C-N 3.3Å; W37-L39 PolarHBondContact O-N 3.38Å; W37-S40 WeakPolarHBondContact CA-OG 3.35Å; W37-S40 PolarHBondContact O-N 2.59Å; W37-S40 PolarHBondContact O-OG 2.97Å; W37-M54 HydrophobicContact CB-CE 4.41Å; W37-M54 HydrophobicContact CB-CG 4.04Å; W37-M54 HydrophobicContact CD2-CE 3.55Å; W37-M54 HydrophobicContact CE3-CE 3.97Å; W37-M54 HydrophobicContact CG-CB 4.31Å; W37-M54 HydrophobicContact CG-CE 3.74Å; W37-M54 HydrophobicContact CG-CG 3.87Å; W37-M54 HydrophobicContact CZ2-CE 4.32Å; W37-H87 AromaticContact CZ2-CD2 3.53Å; W37-H87 AromaticContact CZ2-NE2 3.54Å; W37-P92 HydrophobicContact CE3-CB 4.34Å; W37-P92 HydrophobicContact CH2-CB 4.08Å; W37-P92 HydrophobicContact CH2-CG 3.86Å; W37-P92 HydrophobicContact CZ3-CB 3.86Å; W37-P92 HydrophobicContact CZ3-CG 3.68Å; W37-W401 HydrophobicContact CE3-CZ2 4.09Å
38	T	86.6	Confident	91.8	Very high	64 Å²	64	80.8 Å²	80.8	39%	0.393	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-36.1	168.9	30.8	0	0	0	0	112.7	T34 L35 S40 R41	T34-T38 PolarHBondContact O-N 3.38Å; T34-T38 PolarHBondContact O-OG1 2.88Å; L35-T38 WeakPolarHBondContact CA-OG1 3.43Å; L35-T38 PolarHBondContact O-N 3.35Å; L35-T38 PolarHBondContact O-OG1 3.18Å; T38-S40 VanDerWaalsContact C-N 3.27Å; T38-S40 PolarHBondContact O-N 3.32Å; T38-R41 WeakPolarHBondContact O-CB 3.35Å; T38-R41 WeakPolarHBondContact O-CD 3.43Å; T38-R41 WeakPolarHBondContact O-CG 3.28Å; T38-R41 PolarHBondContact O-N 3.34Å
39	L	89.5	Confident	91.8	Very high	125 Å²	125	77.5 Å²	77.5	65%	0.654	43%	0.43	S	S	*	.	H	α-helix	trans	-72.1	-21.2	176.4	-70	176	0	0	0	113	L35 R36 W37 R41	L35-L39 HydrophobicContact CD1-CD1 4.16Å; L35-L39 HydrophobicContact CD1-CG 4.14Å; L35-L39 HydrophobicContact CG-CD1 3.92Å; L35-L39 HydrophobicContact CG-CG 4.31Å; L35-L39 WeakPolarHBondContact O-CB 3.46Å; L35-L39 VanDerWaalsContact O-CG 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.34Å; L35-L39 PolarHBondContact O-N 2.96Å; R36-L39 PolarHBondContact O-N 3.41Å; W37-L39 VanDerWaalsContact C-N 3.3Å; W37-L39 PolarHBondContact O-N 3.38Å; L39-R41 PolarHBondContact O-N 3.32Å
40	S	88.1	Confident	92	Very high	39 Å²	39	75.6 Å²	75.6	27%	0.273	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	4	175.6	69.8	0	0	0	0	114.7	R36 W37 T38 W401	R36-S40 PolarHBondContact O-N 2.92Å; R36-S40 VanDerWaalsContact O-N 3.16Å; W37-S40 WeakPolarHBondContact CA-OG 3.35Å; W37-S40 PolarHBondContact O-N 2.59Å; W37-S40 PolarHBondContact O-OG 2.97Å; T38-S40 VanDerWaalsContact C-N 3.27Å; T38-S40 PolarHBondContact O-N 3.32Å; S40-W401 VanDerWaalsContact OG-CZ2 3.31Å; S40-W401 WeakPolarHBondContact OG-CZ2 3.41Å
41	R	91.8	Very high	92.3	Very high	153 Å²	153	78.8 Å²	78.8	58%	0.577	43%	0.427	S	S	*	.	S	Bend	trans	-62.5	151.2	166.7	75.8	-176.4	177.7	163.5	-1.9	110	T38 L39 P43 L49	T38-R41 WeakPolarHBondContact O-CB 3.35Å; T38-R41 WeakPolarHBondContact O-CD 3.43Å; T38-R41 WeakPolarHBondContact O-CG 3.28Å; T38-R41 PolarHBondContact O-N 3.34Å; L39-R41 PolarHBondContact O-N 3.32Å; R41-P43 VanDerWaalsContact O-CD 3.3Å; R41-P43 WeakPolarHBondContact O-CD 3.39Å; R41-L49 HydrophobicContact CB-CD1 4.25Å; R41-L49 HydrophobicContact CB-CD2 4.47Å; R41-L49 HydrophobicContact CB-CG 4.21Å
42	D	93.2	Very high	92.4	Very high	43 Å²	43	74.4 Å²	74.4	23%	0.23	41%	0.409	C	S	.	.			trans	-73.2	115.9	167.3	-166.3	-27	0	0	0	109.1	A44 S45 T389 Q396	D42-A44 PolarHBondContact O-N 3.3Å; D42-A44 WeakPolarHBondContact OD1-CB 3.41Å; D42-A44 PolarHBondContact OD1-N 3.06Å; D42-S45 PolarHBondContact O-N 3.14Å; D42-T389 HydrophobicContact CB-CG2 3.76Å; D42-T389 WeakPolarHBondContact OD2-CB 3.37Å; D42-T389 WeakPolarHBondContact OD2-CG2 3.36Å; D42-T389 PolarHBondContact OD2-OG1 3.26Å; D42-Q396 PolarHBondContact O-NE2 3.19Å
43	P	90.9	Very high	92.4	Very high	117 Å²	117	71.5 Å²	71.5	76%	0.76	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-18.3	179.8	30.4	-35.7	0	0	0	112.7	R41 S45	R41-P43 VanDerWaalsContact O-CD 3.3Å; R41-P43 WeakPolarHBondContact O-CD 3.39Å; P43-S45 VanDerWaalsContact C-N 3.26Å
44	A	92.9	Very high	92.5	Very high	94 Å²	94	71.3 Å²	71.3	78%	0.777	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.7	176.5	0	0	0	0	0	112.7	D42	D42-A44 PolarHBondContact O-N 3.3Å; D42-A44 WeakPolarHBondContact OD1-CB 3.41Å; D42-A44 PolarHBondContact OD1-N 3.06Å
45	S	92.6	Very high	92.6	Very high	33 Å²	33	68.3 Å²	68.3	23%	0.231	38%	0.38	C	S	.	.			trans	-99	131.2	177.1	-173.4	0	0	0	0	111.3	D42 P43 L47	D42-S45 PolarHBondContact O-N 3.14Å; P43-S45 VanDerWaalsContact C-N 3.26Å; S45-L47 VanDerWaalsContact C-N 3.27Å; S45-L47 PolarHBondContact OG-N 3.15Å
46	T	93.8	Very high	92.6	Very high	147 Å²	147	70.8 Å²	70.8	90%	0.902	38%	0.384	S	S	*	.			trans	-78	-12.8	173.6	53.5	0	0	0	0	113
47	L	96.3	Very high	92.4	Very high	42 Å²	42	64.8 Å²	64.8	22%	0.22	37%	0.365	C	S	.	.	S	Bend	trans	-78.6	150.5	-177.7	-61.6	176.1	0	0	0	111.6	S45 E391 Q396	S45-L47 VanDerWaalsContact C-N 3.27Å; S45-L47 PolarHBondContact OG-N 3.15Å; L47-E391 HydrophobicContact CD1-CB 3.71Å; L47-E391 HydrophobicContact CD1-CG 3.46Å; L47-E391 VanDerWaalsContact CD1-CG 3.46Å; L47-Q396 HydrophobicContact CB-CB 4.17Å; L47-Q396 WeakPolarHBondContact O-CG 3.3Å; L47-Q396 PolarHBondContact O-NE2 2.97Å
48	P	95	Very high	91.9	Very high	77 Å²	77	71.9 Å²	71.9	50%	0.5	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-75.8	161	173.7	31.2	-33.3	0	0	0	111.9	Y395 Q396	P48-Y395 HydrophobicContact CG-CD1 4.01Å; P48-Y395 HydrophobicContact CG-CE1 4.28Å; P48-Y395 WeakPolarHBondContact O-CA 3.46Å; P48-Q396 WeakPolarHBondContact O-CG 3.42Å; P48-Q396 PolarHBondContact O-N 3.42Å
49	L	95.4	Very high	91.9	Very high	24 Å²	24	73.3 Å²	73.3	13%	0.126	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-65	152.9	164.1	-70.7	171.8	0	0	0	110.1	R41 Y395 Q396 P398	R41-L49 HydrophobicContact CB-CD1 4.25Å; R41-L49 HydrophobicContact CB-CD2 4.47Å; R41-L49 HydrophobicContact CB-CG 4.21Å; L49-Y395 WeakPolarHBondContact O-CD1 3.28Å; L49-Q396 HydrophobicContact CD2-CG 4.17Å; L49-P398 HydrophobicContact CD2-CG 3.31Å
50	P	96.4	Very high	92	Very high	1 Å²	1	67.6 Å²	67.6	1%	0.006	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-51	145.1	171.6	-27.2	34.9	0	0	0	112.1	V83 K85 I94 Y395 Q396 I397	P50-V83 HydrophobicContact CB-CG1 4.17Å; P50-V83 HydrophobicContact CG-CG1 3.98Å; P50-K85 HydrophobicContact CB-CB 4.4Å; P50-K85 WeakPolarHBondContact O-CD 3.23Å; P50-K85 VanDerWaalsContact O-CE 3.31Å; P50-K85 WeakPolarHBondContact O-CE 3.38Å; P50-K85 VanDerWaalsContact O-CG 3.31Å; P50-K85 WeakPolarHBondContact O-CG 3.35Å; P50-I94 HydrophobicContact CG-CD1 4.27Å; P50-I94 HydrophobicContact CG-CG1 4.34Å; P50-I94 HydrophobicContact CG-CG2 4.11Å; P50-Y395 VanDerWaalsContact CA-CD1 3.45Å; P50-Y395 HydrophobicContact CB-CD1 4.47Å; P50-Y395 HydrophobicContact CB-CG 4.25Å; P50-Y395 HydrophobicContact CG-CG 4.11Å; P50-Q396 WeakPolarHBondContact CD-O 3.24Å; P50-I397 HydrophobicContact CG-CD1 3.98Å
51	K	95.8	Very high	92.3	Very high	129 Å²	129	66.1 Å²	66.1	56%	0.561	36%	0.361	S	S	*	.	S	Bend	trans	-59.6	156	169.5	-65.5	179.5	-176.3	176.2	0	109.7	Y80 F84 K85 Y395	K51-Y80 HydrophobicContact CB-CD1 4.04Å; K51-Y80 HydrophobicContact CB-CG 4.44Å; K51-F84 CarbonylContact O-C 3.49Å; K51-F84 WeakPolarHBondContact O-CA 3.36Å; K51-F84 VanDerWaalsContact O-CB 3.25Å; K51-F84 WeakPolarHBondContact O-CB 3.49Å; K51-K85 PolarHBondContact O-N 2.88Å; K51-Y395 HydrophobicContact CG-CE1 4.4Å
52	G	94.7	Very high	92.1	Very high	21 Å²	21	59.6 Å²	59.6	22%	0.216	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	137.6	178.7	179	0	0	0	0	0	113.4	K85	G52-K85 CarbonylContact C-O 3.56Å; G52-K85 WeakPolarHBondContact CA-O 3.34Å; G52-K85 WeakPolarHBondContact O-CE 3.39Å
53	S	93.3	Very high	91.8	Very high	40 Å²	40	62.4 Å²	62.4	28%	0.28	35%	0.353	S	S	.	.			trans	-114.4	130.5	-172.6	-179.1	0	0	0	0	111.4	G55 K85 T86	S53-G55 PolarHBondContact O-N 3.22Å; S53-G55 PolarHBondContact OG-N 3.31Å; S53-G55 VanDerWaalsContact OG-N 3.09Å; S53-K85 PolarHBondContact N-O 2.89Å; S53-T86 VanDerWaalsContact O-CA 3.3Å; S53-T86 WeakPolarHBondContact O-CA 3.37Å
54	M	93.4	Very high	91.6	Very high	16 Å²	16	60.8 Å²	60.8	8%	0.079	34%	0.335	C	S	.	.			trans	-85.3	4.9	170.2	-56.1	-57.6	-73.5	0	0	112.2	W33 W37 G60 K85 H87 P92 W401	W33-M54 PolarHBondContact NE1-O 3.47Å; W37-M54 HydrophobicContact CB-CE 4.41Å; W37-M54 HydrophobicContact CB-CG 4.04Å; W37-M54 HydrophobicContact CD2-CE 3.55Å; W37-M54 HydrophobicContact CE3-CE 3.97Å; W37-M54 HydrophobicContact CG-CB 4.31Å; W37-M54 HydrophobicContact CG-CE 3.74Å; W37-M54 HydrophobicContact CG-CG 3.87Å; W37-M54 HydrophobicContact CZ2-CE 4.32Å; M54-G60 VanDerWaalsContact O-CA 3.3Å; M54-G60 WeakPolarHBondContact O-CA 3.47Å; M54-K85 HydrophobicContact SD-CB 4.34Å; M54-K85 HydrophobicContact SD-CD 3.9Å; M54-K85 HydrophobicContact SD-CG 4.07Å; M54-H87 HydrophobicContact CB-CB 4.44Å; M54-H87 HydrophobicContact CE-CB 4.03Å; M54-H87 WeakPolarHBondContact O-CB 3.24Å; M54-P92 HydrophobicContact CE-CB 3.64Å; M54-W401 HydrophobicContact CE-CH2 3.96Å; M54-W401 HydrophobicContact CE-CZ3 4.26Å; M54-W401 HydrophobicContact SD-CH2 4.26Å; M54-W401 HydrophobicContact SD-CZ3 4.47Å
55	G	92.3	Very high	91.3	Very high	9 Å²	9	58.5 Å²	58.5	9%	0.093	31%	0.306	C	S	.	.			trans	57.5	-151	178.6	0	0	0	0	0	114.5	Q30 W33 S53 G60	Q30-G55 PolarHBondContact NE2-O 2.8Å; W33-G55 PolarHBondContact NE1-O 3.46Å; S53-G55 PolarHBondContact O-N 3.22Å; S53-G55 PolarHBondContact OG-N 3.31Å; S53-G55 VanDerWaalsContact OG-N 3.09Å; G55-G60 WeakPolarHBondContact CA-O 3.31Å
56	W	90.7	Very high	90.8	Very high	139 Å²	139	62.3 Å²	62.3	53%	0.527	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-76.3	154.5	178.5	-72.9	98.7	0	0	0	111.7	L26 F58 G60	L26-W56 HydrophobicContact CD2-CZ3 4.41Å; W56-F58 PolarHBondContact O-N 3.44Å; W56-G60 PolarHBondContact N-O 2.93Å; W56-G60 VanDerWaalsContact N-O 3.1Å; W56-G60 VanDerWaalsContact O-CA 3.26Å; W56-G60 WeakPolarHBondContact O-CA 3.38Å; W56-G60 PolarHBondContact O-N 3.29Å
57	P	87.9	Confident	90.4	Very high	26 Å²	26	61.4 Å²	61.4	17%	0.169	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	134.9	175.3	-23.2	34	0	0	0	111.6	A29 W33 L59	A29-P57 HydrophobicContact CB-CG 4.24Å; W33-P57 HydrophobicContact CB-CB 4.33Å; W33-P57 HydrophobicContact CB-CG 3.92Å; W33-P57 HydrophobicContact CD2-CB 4.09Å; W33-P57 HydrophobicContact CD2-CG 4.46Å; W33-P57 HydrophobicContact CE3-CB 4.08Å; W33-P57 HydrophobicContact CG-CB 4.23Å; W33-P57 HydrophobicContact CG-CG 4.08Å; P57-L59 PolarHBondContact O-N 2.98Å
58	F	80	Confident	89.7	Confident	170 Å²	170	63.1 Å²	63.1	75%	0.746	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	-51.2	-177.4	-49.8	-81.2	0	0	0	115.7	W33 W56 G60 H87	W33-F58 VanDerWaalsContact CH2-N 3.29Å; W56-F58 PolarHBondContact O-N 3.44Å; F58-G60 VanDerWaalsContact C-N 3.34Å; F58-H87 PolarHBondContact O-CE1 3.21Å
59	L	86.3	Confident	89	Confident	95 Å²	95	61.1 Å²	61.1	50%	0.497	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-30.2	-178.3	-65.8	175.4	0	0	0	112.5	P57 E61 T62 L63	P57-L59 PolarHBondContact O-N 2.98Å; L59-E61 PolarHBondContact O-N 3.48Å; L59-T62 WeakPolarHBondContact O-CB 3.3Å; L59-T62 PolarHBondContact O-N 3.48Å; L59-T62 VanDerWaalsContact O-N 3.12Å; L59-T62 PolarHBondContact O-OG1 2.94Å; L59-L63 HydrophobicContact CD1-CD1 4.09Å
60	G	92.1	Very high	87.9	Confident	4 Å²	4	63.4 Å²	63.4	4%	0.041	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	58.3	-129.4	-173.1	0	0	0	0	0	112.1	M54 G55 W56 F58 H87	M54-G60 VanDerWaalsContact O-CA 3.3Å; M54-G60 WeakPolarHBondContact O-CA 3.47Å; G55-G60 WeakPolarHBondContact CA-O 3.31Å; W56-G60 PolarHBondContact N-O 2.93Å; W56-G60 VanDerWaalsContact N-O 3.1Å; W56-G60 VanDerWaalsContact O-CA 3.26Å; W56-G60 WeakPolarHBondContact O-CA 3.38Å; W56-G60 PolarHBondContact O-N 3.29Å; F58-G60 VanDerWaalsContact C-N 3.34Å; G60-H87 WeakPolarHBondContact CA-O 3.49Å
61	E	92.9	Very high	87.3	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.037	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	12.4	174.2	-63	-163.2	89.6	0	0	112.8	L59 L63 H64 W65 F72 R76 T86 H87 L88	L59-E61 PolarHBondContact O-N 3.48Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.07Å; E61-H64 WeakPolarHBondContact O-CB 2.93Å; E61-H64 PolarHBondContact O-N 3Å; E61-H64 VanDerWaalsContact O-N 3.1Å; E61-W65 PolarHBondContact O-N 3.33Å; E61-F72 HydrophobicContact CB-CE2 3.83Å; E61-F72 HydrophobicContact CB-CZ 3.72Å; E61-F72 HydrophobicContact CG-CZ 4.48Å; E61-R76 IonicContact OE1-CZ 3.37Å; E61-R76 IonicContact OE1-NE 3.86Å; E61-R76 PolarHBondContact OE1-NE 3.12Å; E61-R76 VanDerWaalsContact OE1-NE 3.14Å; E61-R76 IonicContact OE1-NH2 2.72Å; E61-R76 PolarHBondContact OE1-NH2 2.99Å; E61-R76 IonicContact OE2-NE 3.78Å; E61-T86 WeakPolarHBondContact OE2-CB 3.47Å; E61-T86 PolarHBondContact OE2-OG1 3.39Å; E61-H87 PolarHBondContact N-O 3.03Å; E61-L88 HydrophobicContact CB-CD2 4.3Å
62	T	88.6	Confident	87	Confident	16 Å²	16	66.4 Å²	66.4	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-57	-41.3	-173.8	-51.4	0	0	0	0	112.6	L59 W65 L66 L89	L59-T62 WeakPolarHBondContact O-CB 3.3Å; L59-T62 PolarHBondContact O-N 3.48Å; L59-T62 VanDerWaalsContact O-N 3.12Å; L59-T62 PolarHBondContact O-OG1 2.94Å; T62-W65 HydrophobicContact CG2-CE3 4.42Å; T62-W65 WeakPolarHBondContact O-CB 3.43Å; T62-W65 PolarHBondContact O-N 2.9Å; T62-L66 HydrophobicContact CG2-CD1 4.37Å; T62-L66 WeakPolarHBondContact O-CG 3.45Å; T62-L66 PolarHBondContact O-N 3.47Å; T62-L89 HydrophobicContact CG2-CD2 3.7Å; T62-L89 HydrophobicContact CG2-CG 4.4Å; T62-L89 PolarHBondContact OG1-N 2.78Å
63	L	86.3	Confident	86.7	Confident	103 Å²	103	66.2 Å²	66.2	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-66.5	-42.7	177.4	-66.6	176.9	0	0	0	112.2	L59 E61 W65 L66 V67	L59-L63 HydrophobicContact CD1-CD1 4.09Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.07Å; L63-W65 VanDerWaalsContact C-N 3.25Å; L63-W65 PolarHBondContact O-N 3.33Å; L63-L66 PolarHBondContact O-N 2.85Å; L63-V67 WeakPolarHBondContact O-CG2 3.26Å; L63-V67 PolarHBondContact O-N 3.47Å
64	H	87.1	Confident	86.4	Confident	83 Å²	83	66 Å²	66	38%	0.384	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-38.7	174.7	-64.6	134.3	0	0	0	111.5	E61 V67 Q68 F72	E61-H64 WeakPolarHBondContact O-CB 2.93Å; E61-H64 PolarHBondContact O-N 3Å; E61-H64 VanDerWaalsContact O-N 3.1Å; H64-V67 PolarHBondContact O-N 2.95Å; H64-Q68 VanDerWaalsContact O-CB 3.24Å; H64-Q68 WeakPolarHBondContact O-CB 3.23Å; H64-Q68 WeakPolarHBondContact O-CG 3.37Å; H64-Q68 PolarHBondContact O-N 2.76Å; H64-F72 HydrophobicContact CB-CD2 4.16Å; H64-F72 HydrophobicContact CB-CE2 3.94Å
65	W	86.9	Confident	86.3	Confident	46 Å²	46	67.3 Å²	67.3	17%	0.174	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-43.6	175.8	173	67.6	0	0	0	112.2	E61 T62 L63 G69 F72 H73 L88 L89 V491	E61-W65 PolarHBondContact O-N 3.33Å; T62-W65 HydrophobicContact CG2-CE3 4.42Å; T62-W65 WeakPolarHBondContact O-CB 3.43Å; T62-W65 PolarHBondContact O-N 2.9Å; L63-W65 VanDerWaalsContact C-N 3.25Å; L63-W65 PolarHBondContact O-N 3.33Å; W65-G69 WeakPolarHBondContact O-CA 3.06Å; W65-G69 PolarHBondContact O-N 2.05Å; W65-F72 VanDerWaalsContact CA-CD2 3.47Å; W65-F72 HydrophobicContact CB-CD1 4.16Å; W65-F72 HydrophobicContact CB-CD2 3.86Å; W65-F72 HydrophobicContact CB-CE1 4.29Å; W65-F72 HydrophobicContact CB-CE2 3.98Å; W65-F72 HydrophobicContact CB-CG 3.95Å; W65-F72 HydrophobicContact CB-CZ 4.21Å; W65-F72 AromaticContact CD1-CD1 3.65Å; W65-F72 AromaticContact CD1-CG 3.83Å; W65-F72 HydrophobicContact CG-CD1 4.28Å; W65-F72 HydrophobicContact CG-CG 4.32Å; W65-H73 AromaticContact CD1-CE1 3.73Å; W65-H73 AromaticContact NE1-CE1 3.46Å; W65-H73 PolarHBondContact NE1-CE1 3.46Å; W65-L88 HydrophobicContact CB-CD2 3.69Å; W65-L88 HydrophobicContact CG-CD2 4.04Å; W65-L89 HydrophobicContact CZ3-CD2 4.39Å; W65-V491 HydrophobicContact CZ2-CG1 4.24Å
66	L	82.4	Confident	86.4	Confident	112 Å²	112	68.2 Å²	68.2	59%	0.586	35%	0.346	S	S	*	.	H	α-helix	trans	-64.2	-40	176.1	-70.3	171.9	0	0	0	112.5	T62 L63	T62-L66 HydrophobicContact CG2-CD1 4.37Å; T62-L66 WeakPolarHBondContact O-CG 3.45Å; T62-L66 PolarHBondContact O-N 3.47Å; L63-L66 PolarHBondContact O-N 2.85Å
67	V	84.1	Confident	86.5	Confident	128 Å²	128	62.8 Å²	62.8	78%	0.776	33%	0.326	S	S	*	.	H	α-helix	trans	-76.5	-42.6	-178.9	173.5	0	0	0	0	112.3	L63 H64	L63-V67 WeakPolarHBondContact O-CG2 3.26Å; L63-V67 PolarHBondContact O-N 3.47Å; H64-V67 PolarHBondContact O-N 2.95Å
68	Q	82.9	Confident	86.6	Confident	78 Å²	78	69.4 Å²	69.4	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-85.4	-15.9	-176.4	-65.4	-175.8	-4.5	0	0	113.6	H64 S70 R71 F72	H64-Q68 VanDerWaalsContact O-CB 3.24Å; H64-Q68 WeakPolarHBondContact O-CB 3.23Å; H64-Q68 WeakPolarHBondContact O-CG 3.37Å; H64-Q68 PolarHBondContact O-N 2.76Å; Q68-S70 PolarHBondContact O-N 2.74Å; Q68-R71 PolarHBondContact O-N 3.16Å; Q68-R71 VanDerWaalsContact O-N 3.11Å; Q68-F72 HydrophobicContact CB-CB 4.08Å
69	G	80.2	Confident	87.3	Confident	35 Å²	35	70.3 Å²	70.3	36%	0.361	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	-123.9	178.3	0	0	0	0	0	112.6	W65 R71 F72	W65-G69 WeakPolarHBondContact O-CA 3.06Å; W65-G69 PolarHBondContact O-N 2.05Å; G69-R71 VanDerWaalsContact C-N 3.27Å; G69-R71 PolarHBondContact O-N 2.81Å; G69-F72 WeakPolarHBondContact O-CB 3.41Å; G69-F72 PolarHBondContact O-N 3.01Å
70	S	71.5	Confident	87.7	Confident	73 Å²	73	68 Å²	68	51%	0.51	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-31	-178.9	55.6	0	0	0	0	113.4	Q68 F72	Q68-S70 PolarHBondContact O-N 2.74Å; S70-F72 VanDerWaalsContact C-N 3.26Å; S70-F72 PolarHBondContact O-N 3.33Å
71	R	84.1	Confident	87.8	Confident	192 Å²	192	69.3 Å²	69.3	73%	0.725	35%	0.352	S	S	*	.	H	α-helix	trans	-73.1	-15.3	-178.9	-65	-175.7	176.9	177.2	-0.8	114	Q68 G69 H73 S74 S75	Q68-R71 PolarHBondContact O-N 3.16Å; Q68-R71 VanDerWaalsContact O-N 3.11Å; G69-R71 VanDerWaalsContact C-N 3.27Å; G69-R71 PolarHBondContact O-N 2.81Å; R71-H73 VanDerWaalsContact C-N 3.34Å; R71-H73 PolarHBondContact O-N 2.95Å; R71-S74 WeakPolarHBondContact CA-OG 3.3Å; R71-S74 PolarHBondContact O-OG 2.87Å; R71-S75 WeakPolarHBondContact O-CB 3.44Å; R71-S75 PolarHBondContact O-N 3.43Å; R71-S75 VanDerWaalsContact O-N 3.11Å; R71-S75 PolarHBondContact O-OG 3.12Å
72	F	89.6	Confident	87.8	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-57.8	-49.3	178.6	178.8	-94.3	0	0	0	111	E61 H64 W65 Q68 G69 S70 S75 R76 L88	E61-F72 HydrophobicContact CB-CE2 3.83Å; E61-F72 HydrophobicContact CB-CZ 3.72Å; E61-F72 HydrophobicContact CG-CZ 4.48Å; H64-F72 HydrophobicContact CB-CD2 4.16Å; H64-F72 HydrophobicContact CB-CE2 3.94Å; W65-F72 VanDerWaalsContact CA-CD2 3.47Å; W65-F72 HydrophobicContact CB-CD1 4.16Å; W65-F72 HydrophobicContact CB-CD2 3.86Å; W65-F72 HydrophobicContact CB-CE1 4.29Å; W65-F72 HydrophobicContact CB-CE2 3.98Å; W65-F72 HydrophobicContact CB-CG 3.95Å; W65-F72 HydrophobicContact CB-CZ 4.21Å; W65-F72 AromaticContact CD1-CD1 3.65Å; W65-F72 AromaticContact CD1-CG 3.83Å; W65-F72 HydrophobicContact CG-CD1 4.28Å; W65-F72 HydrophobicContact CG-CG 4.32Å; Q68-F72 HydrophobicContact CB-CB 4.08Å; G69-F72 WeakPolarHBondContact O-CB 3.41Å; G69-F72 PolarHBondContact O-N 3.01Å; S70-F72 VanDerWaalsContact C-N 3.26Å; S70-F72 PolarHBondContact O-N 3.33Å; F72-S75 PolarHBondContact O-OG 3.15Å; F72-R76 VanDerWaalsContact CE2-NE 3.25Å; F72-R76 WeakPolarHBondContact O-CD 3.46Å; F72-R76 PolarHBondContact O-N 3.31Å; F72-L88 HydrophobicContact CE1-CD1 4.32Å; F72-L88 HydrophobicContact CE1-CD2 4.26Å; F72-L88 HydrophobicContact CZ-CD2 4.1Å
73	H	88.4	Confident	88.1	Confident	17 Å²	17	70.5 Å²	70.5	8%	0.079	36%	0.359	C	S	.	.	H	α-helix	trans	-74.1	-38.9	-174.8	-62	104.3	0	0	0	112.7	W65 R71 R77	W65-H73 AromaticContact CD1-CE1 3.73Å; W65-H73 AromaticContact NE1-CE1 3.46Å; W65-H73 PolarHBondContact NE1-CE1 3.46Å; R71-H73 VanDerWaalsContact C-N 3.34Å; R71-H73 PolarHBondContact O-N 2.95Å; H73-R77 WeakPolarHBondContact O-CB 3.23Å; H73-R77 PolarHBondContact O-N 3.12Å
74	S	87.8	Confident	88.6	Confident	37 Å²	37	65.6 Å²	65.6	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-47.8	177.8	56.9	0	0	0	0	111.5	R71 R76 R77 E78	R71-S74 WeakPolarHBondContact CA-OG 3.3Å; R71-S74 PolarHBondContact O-OG 2.87Å; S74-R76 VanDerWaalsContact C-N 3.34Å; S74-R76 PolarHBondContact O-N 2.9Å; S74-R77 WeakPolarHBondContact O-CB 3.3Å; S74-R77 PolarHBondContact O-N 3.27Å; S74-E78 PolarHBondContact O-N 2.99Å
75	S	91.3	Very high	89	Confident	43 Å²	43	63.1 Å²	63.1	30%	0.301	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-38.5	179.1	59.2	0	0	0	0	113.8	R71 F72 R79	R71-S75 WeakPolarHBondContact O-CB 3.44Å; R71-S75 PolarHBondContact O-N 3.43Å; R71-S75 VanDerWaalsContact O-N 3.11Å; R71-S75 PolarHBondContact O-OG 3.12Å; F72-S75 PolarHBondContact O-OG 3.15Å; S75-R79 WeakPolarHBondContact O-CB 3.19Å; S75-R79 PolarHBondContact O-N 2.83Å
76	R	93.7	Very high	89.4	Confident	27 Å²	27	61 Å²	61	10%	0.102	31%	0.314	C	S	.	.	H	α-helix	trans	-71.1	-36.5	174.5	-84.5	85.8	-173.9	146	-6.9	111.8	E61 F72 S74 R79 Y80 F84	E61-R76 IonicContact OE1-CZ 3.37Å; E61-R76 IonicContact OE1-NE 3.86Å; E61-R76 PolarHBondContact OE1-NE 3.12Å; E61-R76 VanDerWaalsContact OE1-NE 3.14Å; E61-R76 IonicContact OE1-NH2 2.72Å; E61-R76 PolarHBondContact OE1-NH2 2.99Å; E61-R76 IonicContact OE2-NE 3.78Å; F72-R76 VanDerWaalsContact CE2-NE 3.25Å; F72-R76 WeakPolarHBondContact O-CD 3.46Å; F72-R76 PolarHBondContact O-N 3.31Å; S74-R76 VanDerWaalsContact C-N 3.34Å; S74-R76 PolarHBondContact O-N 2.9Å; R76-R79 PolarHBondContact O-N 2.72Å; R76-Y80 HydrophobicContact CB-CD2 3.99Å; R76-Y80 HydrophobicContact CB-CE2 4.37Å; R76-Y80 HydrophobicContact CG-CD2 4Å; R76-Y80 HydrophobicContact CG-CE2 3.9Å; R76-Y80 WeakPolarHBondContact O-CB 3.41Å; R76-Y80 WeakPolarHBondContact O-CD2 3.46Å; R76-Y80 PolarHBondContact O-N 2.96Å; R76-F84 HydrophobicContact CB-CD1 4.37Å; R76-F84 HydrophobicContact CB-CD2 3.99Å; R76-F84 HydrophobicContact CB-CE1 3.91Å; R76-F84 HydrophobicContact CB-CE2 3.51Å; R76-F84 HydrophobicContact CB-CG 4.41Å; R76-F84 HydrophobicContact CB-CZ 3.45Å; R76-F84 VanDerWaalsContact CB-CZ 3.45Å; R76-F84 HydrophobicContact CG-CD2 4.41Å; R76-F84 HydrophobicContact CG-CE2 3.97Å; R76-F84 HydrophobicContact CG-CZ 4.34Å
77	R	91.9	Very high	90	Very high	26 Å²	26	55.9 Å²	55.9	10%	0.098	29%	0.287	C	S	.	.	H	α-helix	trans	-63.6	-45.1	177.5	-161.7	-166.6	-38.6	166	17.3	111	H73 S74 R79 G81 F84 D409 E412	H73-R77 WeakPolarHBondContact O-CB 3.23Å; H73-R77 PolarHBondContact O-N 3.12Å; S74-R77 WeakPolarHBondContact O-CB 3.3Å; S74-R77 PolarHBondContact O-N 3.27Å; R77-R79 VanDerWaalsContact C-N 3.28Å; R77-R79 PolarHBondContact O-N 3.04Å; R77-G81 WeakPolarHBondContact CA-O 3.4Å; R77-G81 CarbonylContact O-C 3.53Å; R77-G81 VanDerWaalsContact O-CA 3.22Å; R77-G81 WeakPolarHBondContact O-CA 3.48Å; R77-G81 PolarHBondContact O-N 2.95Å; R77-F84 HydrophobicContact CB-CE1 4.42Å; R77-D409 IonicContact CZ-OD1 2.8Å; R77-D409 VanDerWaalsContact NH1-CA 3.26Å; R77-D409 VanDerWaalsContact NH1-CB 3.26Å; R77-D409 PolarHBondContact NH1-O 2.8Å; R77-D409 VanDerWaalsContact NH1-O 3.12Å; R77-D409 VanDerWaalsContact NH2-CB 3.31Å; R77-D409 IonicContact NH2-OD1 3.17Å; R77-D409 PolarHBondContact NH2-OD1 2.81Å; R77-D409 IonicContact NH2-OD2 3.54Å; R77-E412 IonicContact CZ-OE2 3.99Å; R77-E412 IonicContact NH1-OE2 3.51Å; R77-E412 PolarHBondContact NH1-OE2 3.08Å; R77-E412 IonicContact NH2-OE2 3.72Å; R77-E412 PolarHBondContact NH2-OE2 3.16Å
78	E	91.6	Very high	90.2	Very high	164 Å²	164	50.2 Å²	50.2	77%	0.766	25%	0.252	S	S	*	.	H	α-helix	trans	-60	-39.4	174.6	-73.6	167.5	-157.9	0	0	111.8	S74	S74-E78 PolarHBondContact O-N 2.99Å
79	R	94.4	Very high	90.3	Very high	189 Å²	189	52.1 Å²	52.1	71%	0.713	27%	0.265	S	S	*	.	H	α-helix	trans	-79.7	-38.1	-177.6	-171.9	174.1	178.3	177.2	0.2	114.5	S75 R76 R77	S75-R79 WeakPolarHBondContact O-CB 3.19Å; S75-R79 PolarHBondContact O-N 2.83Å; R76-R79 PolarHBondContact O-N 2.72Å; R77-R79 VanDerWaalsContact C-N 3.28Å; R77-R79 PolarHBondContact O-N 3.04Å
80	Y	94.5	Very high	90.5	Very high	47 Å²	47	52.8 Å²	52.8	18%	0.184	27%	0.272	C	S	.	.	H	α-helix	trans	-117	-11.2	-167.6	-57	-54.7	0	0	0	114	K51 R76 F84	K51-Y80 HydrophobicContact CB-CD1 4.04Å; K51-Y80 HydrophobicContact CB-CG 4.44Å; R76-Y80 HydrophobicContact CB-CD2 3.99Å; R76-Y80 HydrophobicContact CB-CE2 4.37Å; R76-Y80 HydrophobicContact CG-CD2 4Å; R76-Y80 HydrophobicContact CG-CE2 3.9Å; R76-Y80 WeakPolarHBondContact O-CB 3.41Å; R76-Y80 WeakPolarHBondContact O-CD2 3.46Å; R76-Y80 PolarHBondContact O-N 2.96Å; Y80-F84 HydrophobicContact CD2-CB 4.35Å; Y80-F84 HydrophobicContact CG-CB 4.34Å
81	G	92.7	Very high	91.2	Very high	32 Å²	32	56 Å²	56	33%	0.33	27%	0.273	S	S	.	.			trans	94.5	-167.4	-177.8	0	0	0	0	0	113.8	R77 V83	R77-G81 WeakPolarHBondContact CA-O 3.4Å; R77-G81 CarbonylContact O-C 3.53Å; R77-G81 VanDerWaalsContact O-CA 3.22Å; R77-G81 WeakPolarHBondContact O-CA 3.48Å; R77-G81 PolarHBondContact O-N 2.95Å; G81-V83 VanDerWaalsContact C-N 3.31Å; G81-V83 PolarHBondContact O-N 3.18Å
82	T	92.9	Very high	91.6	Very high	46 Å²	46	48 Å²	48	28%	0.282	25%	0.245	S	C	.	.	S	Bend	trans	-71.2	-20.8	-174.3	34.1	0	0	0	0	114.8	S97 D393	T82-S97 WeakPolarHBondContact CA-OG 3.4Å; T82-S97 WeakPolarHBondContact CB-O 3.31Å; T82-S97 PolarHBondContact O-N 2.79Å; T82-S97 PolarHBondContact O-OG 2.88Å; T82-S97 VanDerWaalsContact O-OG 3.06Å; T82-D393 PolarHBondContact OG1-OD2 3.28Å; T82-D393 VanDerWaalsContact OG1-OD2 3.06Å
83	V	96.6	Very high	91.9	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	113.2	178.6	-177.2	0	0	0	0	108.9	P50 G81 I94 R95 N101 L392 D393 Y395 I397	P50-V83 HydrophobicContact CB-CG1 4.17Å; P50-V83 HydrophobicContact CG-CG1 3.98Å; G81-V83 VanDerWaalsContact C-N 3.31Å; G81-V83 PolarHBondContact O-N 3.18Å; V83-I94 HydrophobicContact CG1-CG2 3.92Å; V83-R95 WeakPolarHBondContact CA-O 3.39Å; V83-N101 HydrophobicContact CG2-CB 4.47Å; V83-N101 WeakPolarHBondContact CG2-ND2 3.24Å; V83-L392 HydrophobicContact CG1-CD2 4.46Å; V83-L392 HydrophobicContact CG2-CD2 4.23Å; V83-L392 HydrophobicContact CG2-CG 4.41Å; V83-D393 HydrophobicContact CB-CB 4.35Å; V83-D393 HydrophobicContact CG2-CB 3.73Å; V83-Y395 HydrophobicContact CB-CD2 4.43Å; V83-Y395 HydrophobicContact CG1-CD2 4.36Å; V83-I397 HydrophobicContact CG1-CD1 4.25Å
84	F	96.5	Very high	92.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	151.8	-179.9	70.1	-96.2	0	0	0	112.5	K51 R76 R77 Y80 T86 I94 R95	K51-F84 CarbonylContact O-C 3.49Å; K51-F84 WeakPolarHBondContact O-CA 3.36Å; K51-F84 VanDerWaalsContact O-CB 3.25Å; K51-F84 WeakPolarHBondContact O-CB 3.49Å; R76-F84 HydrophobicContact CB-CD1 4.37Å; R76-F84 HydrophobicContact CB-CD2 3.99Å; R76-F84 HydrophobicContact CB-CE1 3.91Å; R76-F84 HydrophobicContact CB-CE2 3.51Å; R76-F84 HydrophobicContact CB-CG 4.41Å; R76-F84 HydrophobicContact CB-CZ 3.45Å; R76-F84 VanDerWaalsContact CB-CZ 3.45Å; R76-F84 HydrophobicContact CG-CD2 4.41Å; R76-F84 HydrophobicContact CG-CE2 3.97Å; R76-F84 HydrophobicContact CG-CZ 4.34Å; R77-F84 HydrophobicContact CB-CE1 4.42Å; Y80-F84 HydrophobicContact CD2-CB 4.35Å; Y80-F84 HydrophobicContact CG-CB 4.34Å; F84-T86 HydrophobicContact CE2-CG2 4.45Å; F84-I94 CarbonylContact O-C 3.56Å; F84-I94 WeakPolarHBondContact O-CA 3.35Å; F84-R95 HydrophobicContact CD1-CB 4Å; F84-R95 HydrophobicContact CD1-CG 4.4Å; F84-R95 HydrophobicContact CD2-CB 4.1Å; F84-R95 HydrophobicContact CE1-CB 3.59Å; F84-R95 HydrophobicContact CE1-CG 3.6Å; F84-R95 HydrophobicContact CE2-CB 3.68Å; F84-R95 HydrophobicContact CE2-CG 4.29Å; F84-R95 HydrophobicContact CG-CB 4.24Å; F84-R95 HydrophobicContact CZ-CB 3.42Å; F84-R95 VanDerWaalsContact CZ-CB 3.42Å; F84-R95 HydrophobicContact CZ-CG 3.54Å; F84-R95 PolarHBondContact N-O 2.95Å; F84-R95 VanDerWaalsContact N-O 3.11Å; F84-R95 PolarHBondContact O-N 3.34Å
85	K	96.1	Very high	92.7	Very high	31 Å²	31	46 Å²	46	14%	0.135	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	145.6	175.5	69.4	-179.2	177.9	168.9	0	111.8	P50 K51 G52 S53 M54 V93 I94 W401	P50-K85 HydrophobicContact CB-CB 4.4Å; P50-K85 WeakPolarHBondContact O-CD 3.23Å; P50-K85 VanDerWaalsContact O-CE 3.31Å; P50-K85 WeakPolarHBondContact O-CE 3.38Å; P50-K85 VanDerWaalsContact O-CG 3.31Å; P50-K85 WeakPolarHBondContact O-CG 3.35Å; K51-K85 PolarHBondContact O-N 2.88Å; G52-K85 CarbonylContact C-O 3.56Å; G52-K85 WeakPolarHBondContact CA-O 3.34Å; G52-K85 WeakPolarHBondContact O-CE 3.39Å; S53-K85 PolarHBondContact N-O 2.89Å; M54-K85 HydrophobicContact SD-CB 4.34Å; M54-K85 HydrophobicContact SD-CD 3.9Å; M54-K85 HydrophobicContact SD-CG 4.07Å; K85-V93 CarbonylContact C-O 3.49Å; K85-V93 WeakPolarHBondContact CA-O 3.39Å; K85-I94 HydrophobicContact CB-CG1 4.4Å; K85-W401 HydrophobicContact CB-CZ3 4.14Å; K85-W401 HydrophobicContact CD-CH2 4.47Å
86	T	95.2	Very high	92.9	Very high	2 Å²	2	44 Å²	44	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	175	170.2	-171.4	0	0	0	0	110.4	S53 E61 F84 L88 V93	S53-T86 VanDerWaalsContact O-CA 3.3Å; S53-T86 WeakPolarHBondContact O-CA 3.37Å; E61-T86 WeakPolarHBondContact OE2-CB 3.47Å; E61-T86 PolarHBondContact OE2-OG1 3.39Å; F84-T86 HydrophobicContact CE2-CG2 4.45Å; T86-L88 HydrophobicContact CG2-CD1 3.94Å; T86-L88 HydrophobicContact CG2-CG 3.91Å; T86-V93 HydrophobicContact CG2-CB 4.21Å; T86-V93 PolarHBondContact N-O 3.34Å; T86-V93 PolarHBondContact O-N 3.2Å; T86-V93 VanDerWaalsContact O-O 3.09Å
87	H	93.7	Very high	93	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.019	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	110.2	174	-170.5	-81.9	0	0	0	109.4	W33 W37 M54 F58 G60 E61 G90 R91	W33-H87 AromaticContact CH2-CE1 3.78Å; W33-H87 AromaticContact CH2-NE2 3.55Å; W33-H87 AromaticContact CZ2-CD2 3.78Å; W33-H87 AromaticContact CZ2-CE1 3.87Å; W33-H87 AromaticContact CZ2-CG 3.96Å; W33-H87 AromaticContact CZ2-NE2 3.74Å; W37-H87 AromaticContact CZ2-CD2 3.53Å; W37-H87 AromaticContact CZ2-NE2 3.54Å; M54-H87 HydrophobicContact CB-CB 4.44Å; M54-H87 HydrophobicContact CE-CB 4.03Å; M54-H87 WeakPolarHBondContact O-CB 3.24Å; F58-H87 PolarHBondContact O-CE1 3.21Å; G60-H87 WeakPolarHBondContact CA-O 3.49Å; E61-H87 PolarHBondContact N-O 3.03Å; H87-G90 VanDerWaalsContact CE1-CA 3.48Å; H87-G90 WeakPolarHBondContact CE1-CA 3.22Å; H87-R91 CarbonylContact C-O 3.51Å; H87-R91 WeakPolarHBondContact CA-O 3.34Å
88	L	89.4	Confident	92.9	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.1	-175.5	-65.1	176.8	0	0	0	109.8	E61 W65 F72 T86 G90 R91	E61-L88 HydrophobicContact CB-CD2 4.3Å; W65-L88 HydrophobicContact CB-CD2 3.69Å; W65-L88 HydrophobicContact CG-CD2 4.04Å; F72-L88 HydrophobicContact CE1-CD1 4.32Å; F72-L88 HydrophobicContact CE1-CD2 4.26Å; F72-L88 HydrophobicContact CZ-CD2 4.1Å; T86-L88 HydrophobicContact CG2-CD1 3.94Å; T86-L88 HydrophobicContact CG2-CG 3.91Å; L88-G90 VanDerWaalsContact C-N 3.25Å; L88-G90 PolarHBondContact O-N 2.93Å; L88-R91 PolarHBondContact N-O 3.27Å; L88-R91 PolarHBondContact O-N 2.8Å
89	L	84.2	Confident	92.9	Very high	119 Å²	119	34.8 Å²	34.8	62%	0.623	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	43.1	175.4	-55.9	173	0	0	0	112.9	T62 W65 R91	T62-L89 HydrophobicContact CG2-CD2 3.7Å; T62-L89 HydrophobicContact CG2-CG 4.4Å; T62-L89 PolarHBondContact OG1-N 2.78Å; W65-L89 HydrophobicContact CZ3-CD2 4.39Å; L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.08Å
90	G	84.4	Confident	92.7	Very high	49 Å²	49	29.9 Å²	29.9	51%	0.505	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	8.7	177.9	0	0	0	0	0	115.1	H87 L88	H87-G90 VanDerWaalsContact CE1-CA 3.48Å; H87-G90 WeakPolarHBondContact CE1-CA 3.22Å; L88-G90 VanDerWaalsContact C-N 3.25Å; L88-G90 PolarHBondContact O-N 2.93Å
91	R	87.1	Confident	92.7	Very high	141 Å²	141	28.6 Å²	28.6	53%	0.532	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.4	-177.3	-65.6	-172.9	175.3	-172.4	-0.8	113	H87 L88 L89	H87-R91 CarbonylContact C-O 3.51Å; H87-R91 WeakPolarHBondContact CA-O 3.34Å; L88-R91 PolarHBondContact N-O 3.27Å; L88-R91 PolarHBondContact O-N 2.8Å; L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.08Å
92	P	92.6	Very high	92.8	Very high	22 Å²	22	27.1 Å²	27.1	14%	0.143	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	128.2	168.9	33.2	-35.9	0	0	0	109.7	W37 M54 W401 S402	W37-P92 HydrophobicContact CE3-CB 4.34Å; W37-P92 HydrophobicContact CH2-CB 4.08Å; W37-P92 HydrophobicContact CH2-CG 3.86Å; W37-P92 HydrophobicContact CZ3-CB 3.86Å; W37-P92 HydrophobicContact CZ3-CG 3.68Å; M54-P92 HydrophobicContact CE-CB 3.64Å; P92-W401 HydrophobicContact CB-CD2 3.89Å; P92-W401 HydrophobicContact CB-CE3 3.67Å; P92-W401 HydrophobicContact CB-CH2 4.09Å; P92-W401 HydrophobicContact CB-CZ2 4.28Å; P92-W401 HydrophobicContact CB-CZ3 3.78Å; P92-W401 HydrophobicContact CG-CD2 4.15Å; P92-W401 HydrophobicContact CG-CE3 4.39Å; P92-W401 HydrophobicContact CG-CG 4.39Å; P92-S402 WeakPolarHBondContact O-CB 3.14Å; P92-S402 PolarHBondContact O-N 3.4Å
93	V	94.4	Very high	92.9	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.4	-177.9	-178.5	0	0	0	0	109.5	K85 T86 Y383 S402 M404	K85-V93 CarbonylContact C-O 3.49Å; K85-V93 WeakPolarHBondContact CA-O 3.39Å; T86-V93 HydrophobicContact CG2-CB 4.21Å; T86-V93 PolarHBondContact N-O 3.34Å; T86-V93 PolarHBondContact O-N 3.2Å; T86-V93 VanDerWaalsContact O-O 3.09Å; V93-Y383 HydrophobicContact CG1-CE1 4.39Å; V93-S402 CarbonylContact C-O 3.47Å; V93-S402 VanDerWaalsContact CA-O 3.31Å; V93-S402 WeakPolarHBondContact CA-O 3.36Å; V93-M404 HydrophobicContact CG1-CB 3.79Å
94	I	96.8	Very high	92.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	116.6	167.6	-62.8	161.6	0	0	0	108.1	P50 V83 F84 K85 V96 I397 W401 S402 V403 M404	P50-I94 HydrophobicContact CG-CD1 4.27Å; P50-I94 HydrophobicContact CG-CG1 4.34Å; P50-I94 HydrophobicContact CG-CG2 4.11Å; V83-I94 HydrophobicContact CG1-CG2 3.92Å; F84-I94 CarbonylContact O-C 3.56Å; F84-I94 WeakPolarHBondContact O-CA 3.35Å; K85-I94 HydrophobicContact CB-CG1 4.4Å; I94-V96 HydrophobicContact CG2-CG2 4Å; I94-I397 HydrophobicContact CD1-CB 4.44Å; I94-I397 HydrophobicContact CD1-CD1 3.88Å; I94-I397 HydrophobicContact CD1-CG2 3.85Å; I94-I397 HydrophobicContact CG2-CD1 4.01Å; I94-W401 HydrophobicContact CD1-CD2 4.47Å; I94-W401 HydrophobicContact CD1-CE3 3.78Å; I94-W401 HydrophobicContact CD1-CZ3 4.38Å; I94-W401 HydrophobicContact CG1-CE3 3.79Å; I94-W401 HydrophobicContact CG1-CZ3 4.14Å; I94-S402 PolarHBondContact N-O 2.8Å; I94-V403 HydrophobicContact CB-CG2 4.21Å; I94-V403 CarbonylContact O-C 3.49Å; I94-V403 VanDerWaalsContact O-CA 3.29Å; I94-V403 WeakPolarHBondContact O-CA 3.41Å; I94-M404 PolarHBondContact O-N 2.91Å
95	R	95.9	Very high	92.9	Very high	7 Å²	7	32.1 Å²	32.1	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.5	173.7	-169.4	71.9	176.6	137.5	-13.6	108.7	V83 F84 M404 Y405 S406 D409	V83-R95 WeakPolarHBondContact CA-O 3.39Å; F84-R95 HydrophobicContact CD1-CB 4Å; F84-R95 HydrophobicContact CD1-CG 4.4Å; F84-R95 HydrophobicContact CD2-CB 4.1Å; F84-R95 HydrophobicContact CE1-CB 3.59Å; F84-R95 HydrophobicContact CE1-CG 3.6Å; F84-R95 HydrophobicContact CE2-CB 3.68Å; F84-R95 HydrophobicContact CE2-CG 4.29Å; F84-R95 HydrophobicContact CG-CB 4.24Å; F84-R95 HydrophobicContact CZ-CB 3.42Å; F84-R95 VanDerWaalsContact CZ-CB 3.42Å; F84-R95 HydrophobicContact CZ-CG 3.54Å; F84-R95 PolarHBondContact N-O 2.95Å; F84-R95 VanDerWaalsContact N-O 3.11Å; F84-R95 PolarHBondContact O-N 3.34Å; R95-M404 VanDerWaalsContact NH1-CG 3.27Å; R95-M404 PolarHBondContact NH1-O 3.48Å; R95-M404 PolarHBondContact NH1-SD 2.97Å; R95-Y405 VanDerWaalsContact NH1-C 3.29Å; R95-Y405 PolarHBondContact NH1-O 3.16Å; R95-S406 PolarHBondContact NH2-OG 3.27Å; R95-D409 IonicContact CZ-OD2 2.97Å; R95-D409 IonicContact NE-OD2 3.8Å; R95-D409 PolarHBondContact NE-OD2 3.25Å; R95-D409 IonicContact NH2-OD2 3.75Å; R95-D409 PolarHBondContact NH2-OD2 3.42Å; R95-D409 VanDerWaalsContact NH2-OD2 3.09Å
96	V	96.6	Very high	92.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.5	-177.9	179.2	0	0	0	0	110	I94 N101 V102 I105 L392 V403 M404 Y405 S406	I94-V96 HydrophobicContact CG2-CG2 4Å; V96-N101 HydrophobicContact CG1-CB 3.6Å; V96-V102 HydrophobicContact CG1-CG2 4.3Å; V96-I105 HydrophobicContact CG1-CG1 4.2Å; V96-L392 HydrophobicContact CB-CD2 4.49Å; V96-L392 HydrophobicContact CG1-CD2 3.85Å; V96-L392 HydrophobicContact CG2-CD2 3.73Å; V96-V403 HydrophobicContact CB-CG1 4.33Å; V96-V403 HydrophobicContact CG2-CG1 3.68Å; V96-M404 PolarHBondContact N-O 3.44Å; V96-Y405 CarbonylContact O-C 3.49Å; V96-Y405 VanDerWaalsContact O-CA 3.31Å; V96-Y405 WeakPolarHBondContact O-CA 3.49Å; V96-S406 PolarHBondContact O-N 3.45Å
97	S	94.5	Very high	92.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.181	C	C	.	.			trans	-139.4	167.5	175.3	58.2	0	0	0	0	110.6	T82 N101	T82-S97 WeakPolarHBondContact CA-OG 3.4Å; T82-S97 WeakPolarHBondContact CB-O 3.31Å; T82-S97 PolarHBondContact O-N 2.79Å; T82-S97 PolarHBondContact O-OG 2.88Å; T82-S97 VanDerWaalsContact O-OG 3.06Å; S97-N101 PolarHBondContact O-ND2 3.28Å
98	G	91.1	Very high	92.9	Very high	16 Å²	16	34.3 Å²	34.3	17%	0.165	18%	0.18	C	C	.	.	S	Bend	trans	92.1	142.1	-177.2	0	0	0	0	0	112.2	E100 N101 V102 T410	G98-E100 PolarHBondContact O-N 2.94Å; G98-N101 PolarHBondContact O-N 3.27Å; G98-V102 WeakPolarHBondContact O-CB 3.37Å; G98-V102 WeakPolarHBondContact O-CG2 3.43Å; G98-V102 PolarHBondContact O-N 3.42Å; G98-T410 PolarHBondContact N-OG1 3.43Å
99	A	90.6	Very high	93.2	Very high	8 Å²	8	34.5 Å²	34.5	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-58.5	-48.3	-166.8	0	0	0	0	0	113.4	R103 F443 H444	A99-R103 WeakPolarHBondContact O-CB 3.38Å; A99-R103 PolarHBondContact O-N 2.81Å; A99-F443 HydrophobicContact CB-CB 4.02Å; A99-H444 VanDerWaalsContact CB-CE1 3.48Å; A99-H444 WeakPolarHBondContact CB-CE1 3.31Å; A99-H444 VanDerWaalsContact CB-ND1 3.33Å; A99-H444 WeakPolarHBondContact CB-ND1 3.32Å
100	E	90.9	Very high	93.6	Very high	85 Å²	85	31 Å²	31	40%	0.397	16%	0.162	S	C	.	.	H	α-helix	trans	-67.9	-39.8	-178.4	-68.8	-50.9	128.7	0	0	112.9	G98 R103 T104	G98-E100 PolarHBondContact O-N 2.94Å; E100-R103 WeakPolarHBondContact O-CB 3.32Å; E100-R103 PolarHBondContact O-N 2.91Å; E100-R103 IonicContact OE2-NH1 2.84Å; E100-T104 PolarHBondContact O-N 2.86Å; E100-T104 PolarHBondContact O-OG1 3.42Å
101	N	94.4	Very high	94	Very high	21 Å²	21	36 Å²	36	11%	0.112	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-47.6	178.1	-69.6	-29.8	0	0	0	110.8	V83 V96 S97 G98 R103 T104 I105 L392 D393	V83-N101 HydrophobicContact CG2-CB 4.47Å; V83-N101 WeakPolarHBondContact CG2-ND2 3.24Å; V96-N101 HydrophobicContact CG1-CB 3.6Å; S97-N101 PolarHBondContact O-ND2 3.28Å; G98-N101 PolarHBondContact O-N 3.27Å; N101-R103 VanDerWaalsContact C-N 3.34Å; N101-R103 PolarHBondContact O-N 3.27Å; N101-T104 WeakPolarHBondContact O-CB 3.23Å; N101-T104 PolarHBondContact O-N 3.35Å; N101-I105 WeakPolarHBondContact O-CG1 3.35Å; N101-I105 PolarHBondContact O-N 2.99Å; N101-L392 HydrophobicContact CB-CD1 4.16Å; N101-L392 HydrophobicContact CB-CD2 4.44Å; N101-L392 HydrophobicContact CB-CG 4.38Å; N101-D393 PolarHBondContact ND2-OD2 3.37Å
102	V	95.3	Very high	94.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.2	-37.3	177.8	176	0	0	0	0	111.5	V96 G98 T104 I105 L106 Y405 T410 I446	V96-V102 HydrophobicContact CG1-CG2 4.3Å; G98-V102 WeakPolarHBondContact O-CB 3.37Å; G98-V102 WeakPolarHBondContact O-CG2 3.43Å; G98-V102 PolarHBondContact O-N 3.42Å; V102-T104 VanDerWaalsContact C-N 3.32Å; V102-T104 PolarHBondContact O-N 2.89Å; V102-I105 PolarHBondContact O-N 3.44Å; V102-L106 HydrophobicContact CG1-CD1 3.55Å; V102-L106 HydrophobicContact CG1-CG 3.96Å; V102-L106 WeakPolarHBondContact O-CB 3.39Å; V102-L106 WeakPolarHBondContact O-CG 3.43Å; V102-L106 PolarHBondContact O-N 3.45Å; V102-Y405 HydrophobicContact CG1-CD2 3.9Å; V102-Y405 HydrophobicContact CG1-CG 4.36Å; V102-T410 WeakPolarHBondContact CG2-OG1 3.44Å; V102-I446 HydrophobicContact CB-CD1 4.32Å; V102-I446 HydrophobicContact CG1-CD1 3.43Å; V102-I446 VanDerWaalsContact CG1-CD1 3.43Å
103	R	94.6	Very high	94.6	Very high	105 Å²	105	28.7 Å²	28.7	40%	0.396	14%	0.135	S	C	.	.	H	α-helix	trans	-54.6	-48	171.8	175	174.6	-179	-86.8	-3.7	111.3	A99 E100 N101 I105 L106 L107 F443	A99-R103 WeakPolarHBondContact O-CB 3.38Å; A99-R103 PolarHBondContact O-N 2.81Å; E100-R103 WeakPolarHBondContact O-CB 3.32Å; E100-R103 PolarHBondContact O-N 2.91Å; E100-R103 IonicContact OE2-NH1 2.84Å; N101-R103 VanDerWaalsContact C-N 3.34Å; N101-R103 PolarHBondContact O-N 3.27Å; R103-I105 VanDerWaalsContact C-N 3.34Å; R103-I105 PolarHBondContact O-N 3.36Å; R103-L106 PolarHBondContact O-N 3.09Å; R103-L107 HydrophobicContact CG-CD1 3.64Å; R103-L107 HydrophobicContact CG-CG 4.21Å; R103-L107 VanDerWaalsContact O-CB 3.3Å; R103-L107 WeakPolarHBondContact O-CB 3.3Å; R103-L107 WeakPolarHBondContact O-CG 3.3Å; R103-L107 PolarHBondContact O-N 3.38Å; R103-F443 HydrophobicContact CB-CB 4.07Å; R103-F443 HydrophobicContact CB-CD1 3.77Å; R103-F443 HydrophobicContact CB-CD2 3.78Å; R103-F443 HydrophobicContact CB-CE1 4.12Å; R103-F443 HydrophobicContact CB-CE2 4.12Å; R103-F443 HydrophobicContact CB-CG 3.59Å; R103-F443 HydrophobicContact CB-CZ 4.28Å; R103-F443 HydrophobicContact CG-CD1 4.3Å; R103-F443 HydrophobicContact CG-CD2 3.61Å; R103-F443 HydrophobicContact CG-CE1 4.29Å; R103-F443 HydrophobicContact CG-CE2 3.59Å; R103-F443 HydrophobicContact CG-CG 3.98Å; R103-F443 HydrophobicContact CG-CZ 3.94Å
104	T	95.6	Very high	94.7	Very high	48 Å²	48	34 Å²	34	29%	0.294	16%	0.155	S	C	.	.	H	α-helix	trans	-60.3	-43.5	179.2	-60.5	0	0	0	0	111.7	E100 N101 V102 G108 L112 F390 L392	E100-T104 PolarHBondContact O-N 2.86Å; E100-T104 PolarHBondContact O-OG1 3.42Å; N101-T104 WeakPolarHBondContact O-CB 3.23Å; N101-T104 PolarHBondContact O-N 3.35Å; V102-T104 VanDerWaalsContact C-N 3.32Å; V102-T104 PolarHBondContact O-N 2.89Å; T104-G108 WeakPolarHBondContact O-CA 3.32Å; T104-G108 PolarHBondContact O-N 2.88Å; T104-L112 HydrophobicContact CG2-CD1 4.12Å; T104-F390 HydrophobicContact CG2-CE2 4.48Å; T104-L392 HydrophobicContact CG2-CD1 3.95Å
105	I	96.6	Very high	94.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.3	-50.1	176.7	-61	-55.7	0	0	0	111.5	V96 N101 V102 R103 G108 V113 R384 F390 L392 V403 Y405	V96-I105 HydrophobicContact CG1-CG1 4.2Å; N101-I105 WeakPolarHBondContact O-CG1 3.35Å; N101-I105 PolarHBondContact O-N 2.99Å; V102-I105 PolarHBondContact O-N 3.44Å; R103-I105 VanDerWaalsContact C-N 3.34Å; R103-I105 PolarHBondContact O-N 3.36Å; I105-G108 PolarHBondContact O-N 2.73Å; I105-V113 HydrophobicContact CD1-CG1 4.47Å; I105-V113 HydrophobicContact CG2-CG2 4.23Å; I105-V113 VanDerWaalsContact O-CG2 3.29Å; I105-V113 WeakPolarHBondContact O-CG2 3.5Å; I105-R384 HydrophobicContact CG2-CG 4.03Å; I105-F390 HydrophobicContact CD1-CE2 3.88Å; I105-F390 HydrophobicContact CD1-CZ 3.46Å; I105-F390 VanDerWaalsContact CD1-CZ 3.46Å; I105-L392 HydrophobicContact CD1-CD2 4.11Å; I105-L392 HydrophobicContact CG1-CD2 4.45Å; I105-V403 HydrophobicContact CD1-CG1 3.97Å; I105-V403 HydrophobicContact CG1-CG1 4.19Å; I105-V403 HydrophobicContact CG2-CG1 4.38Å; I105-Y405 HydrophobicContact CG2-CD1 4.17Å
106	L	95.6	Very high	94.2	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-40.1	-173.9	-69.2	177.3	0	0	0	112.8	V102 R103 Y405 F443 I446	V102-L106 HydrophobicContact CG1-CD1 3.55Å; V102-L106 HydrophobicContact CG1-CG 3.96Å; V102-L106 WeakPolarHBondContact O-CB 3.39Å; V102-L106 WeakPolarHBondContact O-CG 3.43Å; V102-L106 PolarHBondContact O-N 3.45Å; R103-L106 PolarHBondContact O-N 3.09Å; L106-Y405 HydrophobicContact CD1-CE2 4.5Å; L106-Y405 HydrophobicContact CD2-CD1 4.18Å; L106-Y405 HydrophobicContact CD2-CD2 4.25Å; L106-Y405 HydrophobicContact CD2-CE1 3.78Å; L106-Y405 HydrophobicContact CD2-CE2 3.85Å; L106-Y405 HydrophobicContact CD2-CG 4.4Å; L106-F443 HydrophobicContact CB-CE1 4.19Å; L106-F443 HydrophobicContact CD1-CD1 4.26Å; L106-F443 HydrophobicContact CD1-CE1 3.96Å; L106-I446 HydrophobicContact CD1-CD1 4.37Å
107	L	95.2	Very high	93.8	Very high	82 Å²	82	39.3 Å²	39.3	43%	0.429	18%	0.179	S	C	.	.	H	α-helix	trans	-75.8	-16.7	173.8	-62.1	-176.7	0	0	0	112.4	R103 E109 F443	R103-L107 HydrophobicContact CG-CD1 3.64Å; R103-L107 HydrophobicContact CG-CG 4.21Å; R103-L107 VanDerWaalsContact O-CB 3.3Å; R103-L107 WeakPolarHBondContact O-CB 3.3Å; R103-L107 WeakPolarHBondContact O-CG 3.3Å; R103-L107 PolarHBondContact O-N 3.38Å; L107-E109 VanDerWaalsContact C-N 3.31Å; L107-F443 HydrophobicContact CD1-CE2 4.34Å; L107-F443 HydrophobicContact CD1-CZ 4.24Å; L107-F443 HydrophobicContact CD2-CZ 3.98Å; L107-F443 HydrophobicContact CG-CZ 3.96Å
108	G	95.1	Very high	93.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	0.4	176.1	0	0	0	0	0	115	T104 I105 H110 R111 L112 V113	T104-G108 WeakPolarHBondContact O-CA 3.32Å; T104-G108 PolarHBondContact O-N 2.88Å; I105-G108 PolarHBondContact O-N 2.73Å; G108-H110 PolarHBondContact O-N 3.22Å; G108-R111 PolarHBondContact O-N 2.8Å; G108-L112 PolarHBondContact O-N 3.01Å; G108-V113 PolarHBondContact O-N 2.73Å; G108-V113 VanDerWaalsContact O-N 3.15Å
109	E	95	Very high	93.5	Very high	13 Å²	13	46.8 Å²	46.8	6%	0.061	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-55.4	137.4	178.3	-174.2	77.7	-165.5	0	0	111.4	L107 R111 V113 S115 R384 A452 R453	L107-E109 VanDerWaalsContact C-N 3.31Å; E109-R111 PolarHBondContact O-N 2.97Å; E109-V113 CarbonylContact C-O 3.47Å; E109-V113 WeakPolarHBondContact CA-O 3.42Å; E109-S115 PolarHBondContact OE1-N 3.48Å; E109-S115 PolarHBondContact OE2-N 3.43Å; E109-R384 WeakPolarHBondContact OE2-CD 3.29Å; E109-R384 IonicContact OE2-CZ 2.76Å; E109-R384 IonicContact OE2-NE 3.38Å; E109-R384 PolarHBondContact OE2-NE 3.34Å; E109-R384 IonicContact OE2-NH2 3.76Å; E109-A452 HydrophobicContact CB-CB 4.24Å; E109-A452 HydrophobicContact CG-CB 4.24Å; E109-R453 HydrophobicContact CG-CG 3.8Å; E109-R453 IonicContact OE1-CZ 3.86Å; E109-R453 IonicContact OE1-NE 2.79Å; E109-R453 PolarHBondContact OE1-NE 2.81Å; E109-R453 IonicContact OE1-NH2 2.72Å; E109-R453 PolarHBondContact OE1-NH2 3.16Å
110	H	92.5	Very high	93.5	Very high	46 Å²	46	46.5 Å²	46.5	21%	0.213	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	-8.3	-174.8	-46.9	-52.1	0	0	0	115.6	G108 V113 V134 G135 H138	G108-H110 PolarHBondContact O-N 3.22Å; H110-V113 PolarHBondContact N-O 3.11Å; H110-V134 WeakPolarHBondContact ND1-CG1 3.34Å; H110-G135 PolarHBondContact CE1-N 3.24Å; H110-G135 PolarHBondContact ND1-N 2.93Å; H110-G135 VanDerWaalsContact ND1-N 3.17Å; H110-H138 AromaticContact CE1-ND1 3.61Å; H110-H138 AromaticContact NE2-CE1 3.9Å; H110-H138 AromaticContact NE2-ND1 3.15Å; H110-H138 PolarHBondContact NE2-ND1 3.01Å; H110-H138 VanDerWaalsContact NE2-ND1 3.15Å
111	R	94.3	Very high	93.5	Very high	152 Å²	152	42.6 Å²	42.6	57%	0.574	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118	-56.8	179.7	-176.6	-177.9	68.1	173.9	0.2	113.3	G108 E109	G108-R111 PolarHBondContact O-N 2.8Å; E109-R111 PolarHBondContact O-N 2.97Å
112	L	96.1	Very high	93.4	Very high	11 Å²	11	45 Å²	45	6%	0.058	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-39.2	178.1	-57.5	-175.6	0	0	0	110.8	T104 G108 L387 R388 F390	T104-L112 HydrophobicContact CG2-CD1 4.12Å; G108-L112 PolarHBondContact O-N 3.01Å; L112-L387 PolarHBondContact O-N 3.2Å; L112-R388 HydrophobicContact CD2-CG 4.39Å; L112-R388 VanDerWaalsContact CD2-NE 3.34Å; L112-F390 HydrophobicContact CB-CD1 4.21Å; L112-F390 HydrophobicContact CB-CE1 4.31Å; L112-F390 HydrophobicContact CD1-CD2 4.16Å; L112-F390 HydrophobicContact CD1-CE2 4.47Å; L112-F390 HydrophobicContact CD1-CG 4.3Å; L112-F390 HydrophobicContact CD2-CB 4.21Å; L112-F390 HydrophobicContact CD2-CG 4.38Å
113	V	96.6	Very high	93.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	160.8	-172.7	-62.3	0	0	0	0	111.8	I105 G108 E109 H110 R384 T385 F390	I105-V113 HydrophobicContact CD1-CG1 4.47Å; I105-V113 HydrophobicContact CG2-CG2 4.23Å; I105-V113 VanDerWaalsContact O-CG2 3.29Å; I105-V113 WeakPolarHBondContact O-CG2 3.5Å; G108-V113 PolarHBondContact O-N 2.73Å; G108-V113 VanDerWaalsContact O-N 3.15Å; E109-V113 CarbonylContact C-O 3.47Å; E109-V113 WeakPolarHBondContact CA-O 3.42Å; H110-V113 PolarHBondContact N-O 3.11Å; V113-R384 HydrophobicContact CB-CB 3.98Å; V113-R384 HydrophobicContact CB-CG 4.37Å; V113-R384 HydrophobicContact CG1-CB 4.33Å; V113-R384 HydrophobicContact CG2-CB 4.31Å; V113-R384 HydrophobicContact CG2-CG 4.15Å; V113-T385 CarbonylContact C-O 3.6Å; V113-T385 VanDerWaalsContact CA-O 3.27Å; V113-T385 WeakPolarHBondContact CA-O 3.4Å; V113-F390 HydrophobicContact CG1-CE1 4.15Å; V113-F390 HydrophobicContact CG1-CZ 4.39Å
114	R	94.8	Very high	93.1	Very high	119 Å²	119	42.8 Å²	42.8	45%	0.449	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.6	167.1	64	175	176	-163.1	2.1	111.1	Q116 V134 R384 T385 L387	R114-Q116 PolarHBondContact O-N 2.97Å; R114-V134 HydrophobicContact CB-CG1 4.27Å; R114-R384 CarbonylContact O-C 3.54Å; R114-R384 WeakPolarHBondContact O-CA 3.48Å; R114-R384 WeakPolarHBondContact O-CD 3.31Å; R114-T385 PolarHBondContact N-O 2.74Å; R114-T385 PolarHBondContact O-N 2.89Å; R114-L387 HydrophobicContact CB-CD1 4.32Å; R114-L387 HydrophobicContact CB-CD2 4.18Å; R114-L387 HydrophobicContact CB-CG 4.42Å; R114-L387 HydrophobicContact CG-CD2 3.8Å; R114-L387 HydrophobicContact CG-CG 4.4Å
115	S	93	Very high	92.9	Very high	18 Å²	18	40.7 Å²	40.7	13%	0.126	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-47.2	133.2	168.2	-163.6	0	0	0	0	111.5	E109 W117	E109-S115 PolarHBondContact OE1-N 3.48Å; E109-S115 PolarHBondContact OE2-N 3.43Å; S115-W117 PolarHBondContact OG-NE1 3.42Å
116	Q	90.3	Very high	92.6	Very high	32 Å²	32	41 Å²	41	15%	0.15	19%	0.189	C	C	.	.			trans	-119.3	122.2	178.7	-177.1	-179.9	41.5	0	0	109.3	R114 Y383 T385 S402	R114-Q116 PolarHBondContact O-N 2.97Å; Q116-Y383 PolarHBondContact N-O 3.24Å; Q116-T385 PolarHBondContact NE2-OG1 2.91Å; Q116-S402 VanDerWaalsContact CD-OG 3.24Å; Q116-S402 PolarHBondContact NE2-OG 3.22Å; Q116-S402 PolarHBondContact OE1-OG 3.14Å
117	W	88.9	Confident	92.1	Very high	67 Å²	67	45 Å²	45	25%	0.254	22%	0.217	S	C	.	.			trans	-123.1	152.7	173	-75.1	94.1	0	0	0	110.3	S115 A121 L131 F222 F295	S115-W117 PolarHBondContact OG-NE1 3.42Å; W117-A121 HydrophobicContact CE3-CB 4.15Å; W117-L131 HydrophobicContact CH2-CD2 4.31Å; W117-L131 HydrophobicContact CZ2-CD2 3.45Å; W117-L131 VanDerWaalsContact CZ2-CD2 3.45Å; W117-F222 HydrophobicContact CZ3-CE1 4.41Å; W117-F222 AromaticContact CZ3-CZ 3.97Å; W117-F222 HydrophobicContact CZ3-CZ 3.97Å; W117-F295 HydrophobicContact CH2-CE1 4.35Å; W117-F295 HydrophobicContact CH2-CZ 4.33Å; W117-F295 HydrophobicContact CZ3-CZ 4.41Å
118	P	88.1	Confident	91.7	Very high	45 Å²	45	44 Å²	44	29%	0.292	21%	0.21	S	C	.	.			trans	-60.9	151.9	171.4	-19.5	31.3	0	0	0	111.6	S120 A121 H122 F222	P118-S120 VanDerWaalsContact C-N 3.28Å; P118-S120 PolarHBondContact O-N 3.33Å; P118-A121 WeakPolarHBondContact O-CB 3.45Å; P118-A121 PolarHBondContact O-N 2.8Å; P118-H122 PolarHBondContact O-CD2 3.25Å; P118-H122 VanDerWaalsContact O-CD2 3.28Å; P118-H122 PolarHBondContact O-N 3.18Å; P118-F222 HydrophobicContact CG-CD1 3.61Å; P118-F222 HydrophobicContact CG-CE1 3.92Å
119	Q	89.6	Confident	91.5	Very high	128 Å²	128	44.1 Å²	44.1	60%	0.598	21%	0.211	S	C	*	.	H	α-helix	trans	-62	-36.6	177.3	-175.8	176.9	3.6	0	0	112.3	A121 H122 I123 P225	Q119-A121 VanDerWaalsContact C-N 3.34Å; Q119-A121 PolarHBondContact O-N 3.35Å; Q119-H122 PolarHBondContact O-N 2.87Å; Q119-I123 HydrophobicContact CG-CD1 4.07Å; Q119-I123 WeakPolarHBondContact O-CG1 3.43Å; Q119-I123 PolarHBondContact O-N 3.47Å; Q119-P225 HydrophobicContact CB-CB 4.08Å; Q119-P225 HydrophobicContact CG-CB 4.17Å
120	S	91.3	Very high	91.3	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-45.1	173.6	33.6	0	0	0	0	112	P118 H122 I123 L124 L221 S223	P118-S120 VanDerWaalsContact C-N 3.28Å; P118-S120 PolarHBondContact O-N 3.33Å; S120-H122 VanDerWaalsContact C-N 3.34Å; S120-H122 PolarHBondContact O-N 3.36Å; S120-I123 PolarHBondContact O-N 3.01Å; S120-L124 WeakPolarHBondContact O-CB 3.37Å; S120-L124 VanDerWaalsContact O-CG 3.29Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 3.47Å; S120-L221 PolarHBondContact OG-O 3.29Å; S120-S223 VanDerWaalsContact CB-O 3.28Å; S120-S223 WeakPolarHBondContact CB-O 3.28Å; S120-S223 PolarHBondContact OG-O 3.45Å
121	A	91.5	Very high	91	Very high	3 Å²	3	44.5 Å²	44.5	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-40.8	175.7	0	0	0	0	0	112.7	W117 P118 Q119 L124 L125 L221	W117-A121 HydrophobicContact CE3-CB 4.15Å; P118-A121 WeakPolarHBondContact O-CB 3.45Å; P118-A121 PolarHBondContact O-N 2.8Å; Q119-A121 VanDerWaalsContact C-N 3.34Å; Q119-A121 PolarHBondContact O-N 3.35Å; A121-L124 PolarHBondContact O-N 3.08Å; A121-L125 WeakPolarHBondContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CG 3.35Å; A121-L125 PolarHBondContact O-N 2.76Å; A121-L221 HydrophobicContact CB-CB 4.39Å; A121-L221 HydrophobicContact CB-CD2 4.23Å; A121-L221 PolarHBondContact N-O 3.04Å; A121-L221 VanDerWaalsContact N-O 3.14Å
122	H	90.9	Very high	90.6	Very high	73 Å²	73	38.2 Å²	38.2	34%	0.338	20%	0.197	S	C	.	.	H	α-helix	trans	-64	-39.2	175.6	-73.5	-70.1	0	0	0	112.9	P118 Q119 S120 G126	P118-H122 PolarHBondContact O-CD2 3.25Å; P118-H122 VanDerWaalsContact O-CD2 3.28Å; P118-H122 PolarHBondContact O-N 3.18Å; Q119-H122 PolarHBondContact O-N 2.87Å; S120-H122 VanDerWaalsContact C-N 3.34Å; S120-H122 PolarHBondContact O-N 3.36Å; H122-G126 CarbonylContact O-C 3.52Å; H122-G126 WeakPolarHBondContact O-CA 3.13Å; H122-G126 PolarHBondContact O-N 2.99Å; H122-G126 VanDerWaalsContact O-N 3.11Å
123	I	92.1	Very high	90.3	Very high	57 Å²	57	38.2 Å²	38.2	29%	0.292	20%	0.198	S	C	.	.	H	α-helix	trans	-67	-40.8	177.5	-67	164.7	0	0	0	111	Q119 S120 L233 I237 R240	Q119-I123 HydrophobicContact CG-CD1 4.07Å; Q119-I123 WeakPolarHBondContact O-CG1 3.43Å; Q119-I123 PolarHBondContact O-N 3.47Å; S120-I123 PolarHBondContact O-N 3.01Å; I123-L233 HydrophobicContact CB-CD1 4.23Å; I123-L233 HydrophobicContact CD1-CD1 4.38Å; I123-L233 HydrophobicContact CD1-CD2 3.96Å; I123-L233 HydrophobicContact CG2-CD1 4Å; I123-I237 HydrophobicContact CG2-CD1 4.25Å; I123-I237 HydrophobicContact CG2-CG1 4.33Å; I123-R240 PolarHBondContact O-NH1 3.27Å
124	L	93.3	Very high	89.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-81.5	-41.4	-172.8	-71	179.3	0	0	0	113.6	S120 A121 L217 N220 L221 L233 I237 R240	S120-L124 WeakPolarHBondContact O-CB 3.37Å; S120-L124 VanDerWaalsContact O-CG 3.29Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 3.47Å; A121-L124 PolarHBondContact O-N 3.08Å; L124-L217 HydrophobicContact CB-CD1 3.9Å; L124-L217 HydrophobicContact CD1-CD1 4.38Å; L124-L217 HydrophobicContact CD2-CD1 3.99Å; L124-L217 HydrophobicContact CG-CD1 4.3Å; L124-N220 HydrophobicContact CD1-CB 4.24Å; L124-N220 WeakPolarHBondContact CD1-O 3.33Å; L124-L221 HydrophobicContact CB-CD2 3.73Å; L124-L221 HydrophobicContact CD1-CD2 4.05Å; L124-L233 HydrophobicContact CD1-CD1 4.29Å; L124-L233 HydrophobicContact CD2-CD1 4.08Å; L124-L233 HydrophobicContact CG-CD1 3.96Å; L124-I237 HydrophobicContact CD2-CG1 3.85Å; L124-I237 VanDerWaalsContact CD2-N 3.29Å; L124-R240 WeakPolarHBondContact O-CD 3.14Å
125	L	91.4	Very high	89.7	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-82.7	-26.3	178.7	-62.9	175.9	0	0	0	112.5	A121 T129 L131 L221 V291 F295	A121-L125 WeakPolarHBondContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CG 3.35Å; A121-L125 PolarHBondContact O-N 2.76Å; L125-T129 HydrophobicContact CB-CG2 4.2Å; L125-T129 VanDerWaalsContact O-CG2 3.29Å; L125-T129 WeakPolarHBondContact O-CG2 3.35Å; L125-L131 HydrophobicContact CD1-CD1 3.77Å; L125-L221 HydrophobicContact CD1-CD2 4.22Å; L125-L221 HydrophobicContact CD2-CD2 3.99Å; L125-L221 HydrophobicContact CG-CD2 3.73Å; L125-V291 HydrophobicContact CD2-CG1 4.04Å; L125-F295 HydrophobicContact CD1-CD1 4.09Å; L125-F295 HydrophobicContact CD1-CE1 4.15Å; L125-F295 HydrophobicContact CD2-CB 4.21Å; L125-F295 HydrophobicContact CD2-CD1 4.38Å; L125-F295 HydrophobicContact CD2-CG 4.14Å
126	G	88.9	Confident	89.6	Confident	6 Å²	6	40.5 Å²	40.5	6%	0.062	22%	0.221	C	C	.	.			trans	99.8	167.3	-177.6	0	0	0	0	0	113.9	H122 T129 E288	H122-G126 CarbonylContact O-C 3.52Å; H122-G126 WeakPolarHBondContact O-CA 3.13Å; H122-G126 PolarHBondContact O-N 2.99Å; H122-G126 VanDerWaalsContact O-N 3.11Å; G126-T129 PolarHBondContact O-OG1 3.49Å; G126-E288 VanDerWaalsContact C-OE2 3.26Å; G126-E288 WeakPolarHBondContact CA-OE2 3.28Å
127	S	85.5	Confident	89.7	Confident	86 Å²	86	42.3 Å²	42.3	60%	0.601	24%	0.236	S	C	*	.	S	Bend	trans	-89.4	-16.3	-172.7	70.3	0	0	0	0	113.7	T129 E288	S127-T129 VanDerWaalsContact C-N 3.33Å; S127-T129 PolarHBondContact O-N 2.74Å; S127-E288 PolarHBondContact N-OE2 2.96Å
128	H	86.6	Confident	89.9	Confident	63 Å²	63	39.2 Å²	39.2	29%	0.292	22%	0.224	S	C	.	.	S	Bend	trans	-97.1	33.6	179.8	-56.6	-93.4	0	0	0	111.7	R141 E285 E288	H128-R141 VanDerWaalsContact CA-CZ 3.47Å; H128-R141 PolarHBondContact ND1-NH2 3.4Å; H128-R141 VanDerWaalsContact ND1-NH2 3.17Å; H128-R141 VanDerWaalsContact O-CZ 3.25Å; H128-R141 PolarHBondContact O-NH1 3.17Å; H128-E285 HydrophobicContact CB-CB 4.46Å; H128-E285 HydrophobicContact CB-CG 3.76Å; H128-E285 IonicContact CG-OE1 2.74Å; H128-E285 IonicContact ND1-OE1 2.85Å; H128-E285 PolarHBondContact ND1-OE1 2.85Å; H128-E285 VanDerWaalsContact ND1-OE1 3.17Å; H128-E288 VanDerWaalsContact CA-OE2 3.29Å; H128-E288 WeakPolarHBondContact CA-OE2 3.47Å; H128-E288 WeakPolarHBondContact CB-OE2 3.46Å; H128-E288 IonicContact CD2-OE1 3.26Å; H128-E288 IonicContact CD2-OE2 3.73Å; H128-E288 PolarHBondContact CD2-OE2 3.01Å; H128-E288 IonicContact CG-OE2 3.18Å; H128-E288 PolarHBondContact N-OE2 2.87Å
129	T	91	Very high	90.1	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	23%	0.233	C	C	.	.	S	Bend	trans	-102.6	153.1	178	56.6	0	0	0	0	111.5	L125 G126 S127 L131 G132 A133 E288 E292	L125-T129 HydrophobicContact CB-CG2 4.2Å; L125-T129 VanDerWaalsContact O-CG2 3.29Å; L125-T129 WeakPolarHBondContact O-CG2 3.35Å; G126-T129 PolarHBondContact O-OG1 3.49Å; S127-T129 VanDerWaalsContact C-N 3.33Å; S127-T129 PolarHBondContact O-N 2.74Å; T129-L131 PolarHBondContact O-N 3.05Å; T129-G132 PolarHBondContact O-N 2.61Å; T129-G132 PolarHBondContact OG1-N 3.33Å; T129-G132 VanDerWaalsContact OG1-N 3.11Å; T129-A133 WeakPolarHBondContact O-CB 3.36Å; T129-A133 PolarHBondContact O-N 2.78Å; T129-E288 HydrophobicContact CG2-CB 4.22Å; T129-E292 HydrophobicContact CG2-CB 4.23Å
130	L	90.7	Very high	90.2	Very high	23 Å²	23	40.8 Å²	40.8	12%	0.12	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.6	170.9	-171.1	71.1	0	0	0	111.1	H138 R141 R142 L145 E292 R453 L456	L130-H138 WeakPolarHBondContact CD1-CD2 3.49Å; L130-R141 HydrophobicContact CD1-CB 4.09Å; L130-R142 HydrophobicContact CD1-CB 3.7Å; L130-R142 HydrophobicContact CD1-CG 4.34Å; L130-L145 HydrophobicContact CB-CD1 3.91Å; L130-L145 HydrophobicContact CD2-CD1 4.17Å; L130-L145 HydrophobicContact CG-CD1 4.43Å; L130-E292 WeakPolarHBondContact CA-OE1 3.26Å; L130-E292 VanDerWaalsContact CB-OE1 3.26Å; L130-E292 WeakPolarHBondContact CB-OE1 3.33Å; L130-E292 WeakPolarHBondContact CB-OE2 3.5Å; L130-E292 VanDerWaalsContact N-CD 3.25Å; L130-E292 PolarHBondContact N-OE1 3.15Å; L130-E292 PolarHBondContact N-OE2 3.43Å; L130-R453 PolarHBondContact O-NH1 3.33Å; L130-L456 HydrophobicContact CD2-CD1 3.75Å; L130-L456 HydrophobicContact CD2-CG 4.46Å
131	L	87.1	Confident	90.3	Very high	44 Å²	44	42.8 Å²	42.8	23%	0.23	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-42.9	175.2	-71.8	164.5	0	0	0	112.7	W117 L125 T129 E292 F295	W117-L131 HydrophobicContact CH2-CD2 4.31Å; W117-L131 HydrophobicContact CZ2-CD2 3.45Å; W117-L131 VanDerWaalsContact CZ2-CD2 3.45Å; L125-L131 HydrophobicContact CD1-CD1 3.77Å; T129-L131 PolarHBondContact O-N 3.05Å; L131-E292 HydrophobicContact CD1-CG 4.29Å; L131-E292 VanDerWaalsContact CG-OE1 3.29Å; L131-E292 WeakPolarHBondContact CG-OE1 3.44Å; L131-E292 PolarHBondContact N-OE1 3.02Å; L131-F295 HydrophobicContact CD1-CD1 3.69Å; L131-F295 HydrophobicContact CD1-CE1 3.64Å
132	G	85	Confident	90.4	Very high	20 Å²	20	45 Å²	45	21%	0.206	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-30.9	-179.4	0	0	0	0	0	114.4	T129	T129-G132 PolarHBondContact O-N 2.61Å; T129-G132 PolarHBondContact OG1-N 3.33Å; T129-G132 VanDerWaalsContact OG1-N 3.11Å
133	A	89.8	Confident	90.5	Very high	10 Å²	10	48 Å²	48	8%	0.083	25%	0.249	C	C	.	.			trans	-72	149.6	-176.1	0	0	0	0	0	112.8	T129 P137 H138 R453	T129-A133 WeakPolarHBondContact O-CB 3.36Å; T129-A133 PolarHBondContact O-N 2.78Å; A133-P137 HydrophobicContact CB-CB 4.27Å; A133-H138 HydrophobicContact CB-CB 3.93Å; A133-R453 VanDerWaalsContact O-CZ 3.28Å; A133-R453 PolarHBondContact O-NH1 3.32Å; A133-R453 PolarHBondContact O-NH2 3.2Å
134	V	88.8	Confident	90.6	Very high	61 Å²	61	45.9 Å²	45.9	37%	0.37	24%	0.239	S	C	.	.			trans	-138.6	147.4	176.2	-173.1	0	0	0	0	109.4	H110 R114 P137	H110-V134 WeakPolarHBondContact ND1-CG1 3.34Å; R114-V134 HydrophobicContact CB-CG1 4.27Å; V134-P137 WeakPolarHBondContact O-CD 3.47Å
135	G	90.4	Very high	90.6	Very high	18 Å²	18	46.4 Å²	46.4	19%	0.186	24%	0.241	C	C	.	.	S	Bend	trans	72.5	-132.7	175.4	0	0	0	0	0	112.4	H110 H138 R139	H110-G135 PolarHBondContact CE1-N 3.24Å; H110-G135 PolarHBondContact ND1-N 2.93Å; H110-G135 VanDerWaalsContact ND1-N 3.17Å; G135-H138 WeakPolarHBondContact O-CB 3.25Å; G135-H138 PolarHBondContact O-N 3.43Å; G135-R139 PolarHBondContact O-N 3.02Å; G135-R139 VanDerWaalsContact O-N 3.12Å
136	E	91.4	Very high	90.7	Very high	107 Å²	107	48.2 Å²	48.2	50%	0.5	26%	0.257	S	S	.	.	H	α-helix	trans	-65.3	-45.9	-177.7	-161.8	55.7	-133.8	0	0	113.6	H138 R139 Q140	E136-H138 PolarHBondContact O-N 2.74Å; E136-H138 VanDerWaalsContact O-N 3.12Å; E136-R139 PolarHBondContact O-N 3.49Å; E136-R139 IonicContact OE1-NE 3.23Å; E136-R139 IonicContact OE2-CZ 3.72Å; E136-R139 IonicContact OE2-NE 2.73Å; E136-R139 PolarHBondContact OE2-NE 2.98Å; E136-R139 IonicContact OE2-NH2 3Å; E136-R139 PolarHBondContact OE2-NH2 3.35Å; E136-Q140 PolarHBondContact O-N 3.06Å
137	P	90.9	Very high	90.8	Very high	70 Å²	70	53.5 Å²	53.5	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-53	-36.9	172.8	-29	34.7	0	0	0	113.6	A133 V134 R141	A133-P137 HydrophobicContact CB-CB 4.27Å; V134-P137 WeakPolarHBondContact O-CD 3.47Å; P137-R141 WeakPolarHBondContact O-CB 3.3Å; P137-R141 VanDerWaalsContact O-CG 3.32Å; P137-R141 WeakPolarHBondContact O-CG 3.34Å; P137-R141 PolarHBondContact O-N 3.28Å; P137-R141 VanDerWaalsContact O-N 3.08Å
138	H	93.5	Very high	91.1	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-45.3	175.9	170.2	-110.2	0	0	0	112	H110 L130 A133 G135 E136 Q140 R142 A452 R453	H110-H138 AromaticContact CE1-ND1 3.61Å; H110-H138 AromaticContact NE2-CE1 3.9Å; H110-H138 AromaticContact NE2-ND1 3.15Å; H110-H138 PolarHBondContact NE2-ND1 3.01Å; H110-H138 VanDerWaalsContact NE2-ND1 3.15Å; L130-H138 WeakPolarHBondContact CD1-CD2 3.49Å; A133-H138 HydrophobicContact CB-CB 3.93Å; G135-H138 WeakPolarHBondContact O-CB 3.25Å; G135-H138 PolarHBondContact O-N 3.43Å; E136-H138 PolarHBondContact O-N 2.74Å; E136-H138 VanDerWaalsContact O-N 3.12Å; H138-Q140 PolarHBondContact O-N 3.08Å; H138-R142 WeakPolarHBondContact O-CB 3.35Å; H138-R142 PolarHBondContact O-N 2.92Å; H138-A452 PolarHBondContact CE1-O 3.35Å; H138-A452 VanDerWaalsContact CE1-O 3.27Å; H138-R453 PolarHBondContact CD2-NH1 2.84Å; H138-R453 WeakPolarHBondContact NE2-CD 3.39Å; H138-R453 PolarHBondContact NE2-NH1 3.46Å; H138-R453 VanDerWaalsContact NE2-NH1 3.16Å
139	R	92.4	Very high	91.4	Very high	129 Å²	129	48 Å²	48	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-60.8	-45.2	178.7	-76.7	-170.2	-79.2	-103.1	3	111.9	G135 E136 R142 K143	G135-R139 PolarHBondContact O-N 3.02Å; G135-R139 VanDerWaalsContact O-N 3.12Å; E136-R139 PolarHBondContact O-N 3.49Å; E136-R139 IonicContact OE1-NE 3.23Å; E136-R139 IonicContact OE2-CZ 3.72Å; E136-R139 IonicContact OE2-NE 2.73Å; E136-R139 PolarHBondContact OE2-NE 2.98Å; E136-R139 IonicContact OE2-NH2 3Å; E136-R139 PolarHBondContact OE2-NH2 3.35Å; R139-R142 PolarHBondContact O-N 3.17Å; R139-K143 PolarHBondContact O-N 2.91Å
140	Q	91.9	Very high	91.5	Very high	77 Å²	77	49.2 Å²	49.2	36%	0.36	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-51.8	179	-171.2	-173.9	-0.1	0	0	111.7	E136 H138 R142 K143 V144 H279	E136-Q140 PolarHBondContact O-N 3.06Å; H138-Q140 PolarHBondContact O-N 3.08Å; Q140-R142 VanDerWaalsContact C-N 3.3Å; Q140-R142 PolarHBondContact O-N 2.77Å; Q140-K143 WeakPolarHBondContact O-CB 3.38Å; Q140-K143 PolarHBondContact O-N 3.22Å; Q140-K143 VanDerWaalsContact O-N 3.1Å; Q140-V144 PolarHBondContact O-N 3.2Å; Q140-V144 VanDerWaalsContact O-N 3.16Å; Q140-H279 PolarHBondContact NE2-CD2 3.13Å; Q140-H279 PolarHBondContact NE2-CE1 3.06Å; Q140-H279 PolarHBondContact NE2-ND1 3.45Å; Q140-H279 PolarHBondContact NE2-NE2 2.91Å
141	R	92.3	Very high	91.7	Very high	45 Å²	45	55.9 Å²	55.9	17%	0.17	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-41.3	176.1	-73.3	-177.3	-176.2	-73.8	-17.2	112	H128 L130 P137 K143 V144 L145 E285	H128-R141 VanDerWaalsContact CA-CZ 3.47Å; H128-R141 PolarHBondContact ND1-NH2 3.4Å; H128-R141 VanDerWaalsContact ND1-NH2 3.17Å; H128-R141 VanDerWaalsContact O-CZ 3.25Å; H128-R141 PolarHBondContact O-NH1 3.17Å; L130-R141 HydrophobicContact CD1-CB 4.09Å; P137-R141 WeakPolarHBondContact O-CB 3.3Å; P137-R141 VanDerWaalsContact O-CG 3.32Å; P137-R141 WeakPolarHBondContact O-CG 3.34Å; P137-R141 PolarHBondContact O-N 3.28Å; P137-R141 VanDerWaalsContact O-N 3.08Å; R141-K143 VanDerWaalsContact C-N 3.28Å; R141-K143 PolarHBondContact O-N 3.46Å; R141-V144 PolarHBondContact O-N 2.94Å; R141-L145 WeakPolarHBondContact O-CG 3.42Å; R141-L145 PolarHBondContact O-N 2.9Å; R141-E285 IonicContact CZ-OE1 2.96Å; R141-E285 IonicContact NH1-OE1 3.94Å; R141-E285 IonicContact NH2-OE1 3.68Å; R141-E285 PolarHBondContact NH2-OE1 2.85Å
142	R	94.6	Very high	91.9	Very high	49 Å²	49	57.9 Å²	57.9	19%	0.185	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-40.9	176.5	-167.3	176.5	176.5	83.7	3.7	111.6	L130 H138 R139 Q140 L145 A146 A452 S454 L456	L130-R142 HydrophobicContact CD1-CB 3.7Å; L130-R142 HydrophobicContact CD1-CG 4.34Å; H138-R142 WeakPolarHBondContact O-CB 3.35Å; H138-R142 PolarHBondContact O-N 2.92Å; R139-R142 PolarHBondContact O-N 3.17Å; Q140-R142 VanDerWaalsContact C-N 3.3Å; Q140-R142 PolarHBondContact O-N 2.77Å; R142-L145 PolarHBondContact O-N 2.71Å; R142-A146 VanDerWaalsContact O-CB 3.28Å; R142-A146 WeakPolarHBondContact O-CB 3.39Å; R142-A146 PolarHBondContact O-N 3.48Å; R142-A452 PolarHBondContact NE-O 2.95Å; R142-A452 PolarHBondContact NH1-O 2.9Å; R142-S454 VanDerWaalsContact CZ-O 3.27Å; R142-S454 PolarHBondContact NH1-O 3.07Å; R142-S454 PolarHBondContact NH2-O 3.46Å; R142-S454 PolarHBondContact NH2-OG 2.76Å; R142-L456 HydrophobicContact CG-CD1 4.15Å; R142-L456 HydrophobicContact CG-CD2 3.97Å; R142-L456 HydrophobicContact CG-CG 4.39Å
143	K	93.9	Very high	92.2	Very high	135 Å²	135	57.3 Å²	57.3	59%	0.587	28%	0.28	S	S	*	.	H	α-helix	trans	-63.1	-44.5	178.7	-166.2	-177.6	-178.6	-170.5	0	111.3	R139 Q140 R141 A146 L277	R139-K143 PolarHBondContact O-N 2.91Å; Q140-K143 WeakPolarHBondContact O-CB 3.38Å; Q140-K143 PolarHBondContact O-N 3.22Å; Q140-K143 VanDerWaalsContact O-N 3.1Å; R141-K143 VanDerWaalsContact C-N 3.28Å; R141-K143 PolarHBondContact O-N 3.46Å; K143-A146 PolarHBondContact O-N 3Å; K143-L277 HydrophobicContact CB-CD1 4.3Å; K143-L277 HydrophobicContact CD-CD1 3.92Å; K143-L277 HydrophobicContact CD-CD2 3.85Å; K143-L277 HydrophobicContact CG-CD1 3.99Å; K143-L277 VanDerWaalsContact NZ-CD2 3.3Å
144	V	92.9	Very high	92.4	Very high	13 Å²	13	57.2 Å²	57.2	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-53.9	175.1	175.7	0	0	0	0	110.7	Q140 R141 A146 R147 I270 S273 A274 L277	Q140-V144 PolarHBondContact O-N 3.2Å; Q140-V144 VanDerWaalsContact O-N 3.16Å; R141-V144 PolarHBondContact O-N 2.94Å; V144-A146 VanDerWaalsContact C-N 3.28Å; V144-A146 PolarHBondContact O-N 3.38Å; V144-R147 PolarHBondContact O-N 3.32Å; V144-I270 HydrophobicContact CG1-CG2 4.06Å; V144-S273 PolarHBondContact O-OG 3.32Å; V144-A274 HydrophobicContact CG1-CB 4.16Å; V144-A274 HydrophobicContact CG2-CB 4.45Å; V144-L277 HydrophobicContact CG2-CD1 3.73Å
145	L	93.3	Very high	92.5	Very high	11 Å²	11	58.3 Å²	58.3	6%	0.058	28%	0.279	C	S	.	.	H	α-helix	trans	-67	-26.2	-176.7	-68.2	173.6	0	0	0	113.2	L130 R141 R142 R147 V148 F149 I270 L456	L130-L145 HydrophobicContact CB-CD1 3.91Å; L130-L145 HydrophobicContact CD2-CD1 4.17Å; L130-L145 HydrophobicContact CG-CD1 4.43Å; R141-L145 WeakPolarHBondContact O-CG 3.42Å; R141-L145 PolarHBondContact O-N 2.9Å; R142-L145 PolarHBondContact O-N 2.71Å; L145-R147 PolarHBondContact O-N 2.87Å; L145-V148 WeakPolarHBondContact O-CB 3.4Å; L145-V148 PolarHBondContact O-N 2.94Å; L145-F149 VanDerWaalsContact O-CD2 3.32Å; L145-F149 WeakPolarHBondContact O-CD2 3.1Å; L145-I270 HydrophobicContact CD2-CD1 3.51Å; L145-I270 HydrophobicContact CD2-CG1 3.86Å; L145-L456 HydrophobicContact CB-CD1 3.69Å
146	A	93.4	Very high	92.5	Very high	42 Å²	42	62.1 Å²	62.1	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-60.5	-26.8	179.8	0	0	0	0	0	113	R142 K143 V144 V148 F149 S150 L456	R142-A146 VanDerWaalsContact O-CB 3.28Å; R142-A146 WeakPolarHBondContact O-CB 3.39Å; R142-A146 PolarHBondContact O-N 3.48Å; K143-A146 PolarHBondContact O-N 3Å; V144-A146 VanDerWaalsContact C-N 3.28Å; V144-A146 PolarHBondContact O-N 3.38Å; A146-V148 VanDerWaalsContact C-N 3.28Å; A146-V148 PolarHBondContact O-N 3.37Å; A146-F149 PolarHBondContact O-N 3.48Å; A146-F149 VanDerWaalsContact O-N 3.14Å; A146-S150 PolarHBondContact O-N 3.48Å; A146-L456 HydrophobicContact CB-CD2 4.21Å
147	R	91.8	Very high	92.6	Very high	118 Å²	118	57.1 Å²	57.1	45%	0.445	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-62.9	-35	178.7	-168.5	61.8	168.8	167.2	-0.7	112.5	V144 L145 F149 S150	V144-R147 PolarHBondContact O-N 3.32Å; L145-R147 PolarHBondContact O-N 2.87Å; R147-F149 PolarHBondContact O-N 3.3Å; R147-S150 VanDerWaalsContact O-CB 3.27Å; R147-S150 WeakPolarHBondContact O-CB 3.49Å; R147-S150 PolarHBondContact O-N 3Å; R147-S150 PolarHBondContact O-OG 3.31Å
148	V	91.9	Very high	92.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-58.2	-33.5	175.6	175.5	0	0	0	0	112	L145 A146 A153 F157 A266 L269 I270	L145-V148 WeakPolarHBondContact O-CB 3.4Å; L145-V148 PolarHBondContact O-N 2.94Å; A146-V148 VanDerWaalsContact C-N 3.28Å; A146-V148 PolarHBondContact O-N 3.37Å; V148-A153 VanDerWaalsContact O-CB 3.25Å; V148-A153 WeakPolarHBondContact O-CB 3.27Å; V148-F157 HydrophobicContact CG1-CE2 4.44Å; V148-F157 WeakPolarHBondContact O-CE2 3.17Å; V148-A266 HydrophobicContact CB-CB 4.26Å; V148-A266 HydrophobicContact CG1-CB 3.32Å; V148-A266 HydrophobicContact CG2-CB 3.93Å; V148-L269 HydrophobicContact CG2-CB 4.21Å; V148-I270 HydrophobicContact CG2-CD1 4.04Å; V148-I270 HydrophobicContact CG2-CG1 3.56Å
149	F	92.9	Very high	92.6	Very high	34 Å²	34	55.2 Å²	55.2	15%	0.149	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-104.6	16.4	-175.1	-52.6	-75.4	0	0	0	112.3	L145 A146 R147 L293 L456 L460	L145-F149 VanDerWaalsContact O-CD2 3.32Å; L145-F149 WeakPolarHBondContact O-CD2 3.1Å; A146-F149 PolarHBondContact O-N 3.48Å; A146-F149 VanDerWaalsContact O-N 3.14Å; R147-F149 PolarHBondContact O-N 3.3Å; F149-L293 HydrophobicContact CE2-CD2 4.25Å; F149-L293 HydrophobicContact CZ-CD2 3.71Å; F149-L456 WeakPolarHBondContact CB-O 3.36Å; F149-L456 HydrophobicContact CD2-CB 3.58Å; F149-L456 HydrophobicContact CE2-CB 3.71Å; F149-L456 HydrophobicContact CE2-CD1 4.4Å; F149-L456 HydrophobicContact CG-CB 4.33Å; F149-L456 WeakPolarHBondContact CG-O 3.42Å; F149-L460 HydrophobicContact CD1-CB 4.31Å; F149-L460 HydrophobicContact CD1-CD2 4.3Å; F149-L460 HydrophobicContact CE1-CD2 3.97Å
150	S	93.2	Very high	92.6	Very high	26 Å²	26	52.9 Å²	52.9	18%	0.182	24%	0.244	C	C	.	.	S	Bend	trans	-68.9	156.7	174.9	67.8	0	0	0	0	111.5	A146 R147 A153 L154	A146-S150 PolarHBondContact O-N 3.48Å; R147-S150 VanDerWaalsContact O-CB 3.27Å; R147-S150 WeakPolarHBondContact O-CB 3.49Å; R147-S150 PolarHBondContact O-N 3Å; R147-S150 PolarHBondContact O-OG 3.31Å; S150-A153 PolarHBondContact O-N 3.15Å; S150-A153 VanDerWaalsContact O-N 3.16Å; S150-L154 WeakPolarHBondContact O-CG 3.45Å; S150-L154 PolarHBondContact O-N 3Å
151	R	93.3	Very high	92.7	Very high	164 Å²	164	49.5 Å²	49.5	62%	0.619	23%	0.228	S	C	*	.	H	α-helix	trans	-54.5	-46.3	179.3	177.6	175.9	177.5	173.3	1.5	113.4	A153 L154 E155 L356	R151-A153 VanDerWaalsContact C-N 3.33Å; R151-A153 PolarHBondContact O-N 3.46Å; R151-L154 PolarHBondContact O-N 3.07Å; R151-E155 HydrophobicContact CG-CG 4.45Å; R151-E155 WeakPolarHBondContact CG-OE1 3.48Å; R151-E155 IonicContact CZ-OE1 3.95Å; R151-E155 IonicContact NE-OE1 2.95Å; R151-E155 PolarHBondContact NE-OE1 3.11Å; R151-E155 IonicContact NH2-OE1 3.93Å; R151-E155 WeakPolarHBondContact O-CG 3.34Å; R151-E155 PolarHBondContact O-N 3.36Å; R151-L356 HydrophobicContact CG-CD2 3.96Å
152	P	92.2	Very high	92.7	Very high	85 Å²	85	47.4 Å²	47.4	55%	0.552	22%	0.22	S	C	*	.	H	α-helix	trans	-61	-39.9	177	-24.3	35.3	0	0	0	113.1	E155 R156	P152-E155 PolarHBondContact O-N 2.88Å; P152-R156 PolarHBondContact O-N 3.48Å
153	A	91.7	Very high	92.6	Very high	9 Å²	9	50.2 Å²	50.2	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-43.9	176.6	0	0	0	0	0	111.5	V148 S150 R151 R156 F157 L269	V148-A153 VanDerWaalsContact O-CB 3.25Å; V148-A153 WeakPolarHBondContact O-CB 3.27Å; S150-A153 PolarHBondContact O-N 3.15Å; S150-A153 VanDerWaalsContact O-N 3.16Å; R151-A153 VanDerWaalsContact C-N 3.33Å; R151-A153 PolarHBondContact O-N 3.46Å; A153-R156 WeakPolarHBondContact O-CB 3.35Å; A153-R156 PolarHBondContact O-N 3.01Å; A153-F157 HydrophobicContact CB-CE2 4.09Å; A153-F157 HydrophobicContact CB-CZ 4.3Å; A153-F157 WeakPolarHBondContact O-CD2 3.13Å; A153-F157 VanDerWaalsContact O-CG 3.24Å; A153-F157 WeakPolarHBondContact O-CG 3.28Å; A153-F157 PolarHBondContact O-N 3.4Å; A153-L269 HydrophobicContact CB-CD1 3.64Å
154	L	93.1	Very high	92.6	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-42.7	176.2	-67.1	174	0	0	0	112.4	S150 R151 R156 F157 V158 L356 K459 L460	S150-L154 WeakPolarHBondContact O-CG 3.45Å; S150-L154 PolarHBondContact O-N 3Å; R151-L154 PolarHBondContact O-N 3.07Å; L154-R156 PolarHBondContact O-N 3.43Å; L154-F157 HydrophobicContact CD2-CD2 4.49Å; L154-F157 PolarHBondContact O-N 3.41Å; L154-V158 VanDerWaalsContact O-CG2 3.28Å; L154-V158 WeakPolarHBondContact O-CG2 3.31Å; L154-V158 PolarHBondContact O-N 3.4Å; L154-L356 HydrophobicContact CB-CD2 4.19Å; L154-K459 HydrophobicContact CD1-CB 3.58Å; L154-L460 HydrophobicContact CD2-CB 3.78Å; L154-L460 HydrophobicContact CD2-CD1 3.88Å; L154-L460 HydrophobicContact CD2-CG 4.42Å
155	E	92.3	Very high	92.7	Very high	83 Å²	83	44.3 Å²	44.3	39%	0.388	21%	0.208	S	C	.	.	H	α-helix	trans	-57.2	-33	176.1	-77	170.6	-178.2	0	0	111.8	R151 P152 P159 L356	R151-E155 HydrophobicContact CG-CG 4.45Å; R151-E155 WeakPolarHBondContact CG-OE1 3.48Å; R151-E155 IonicContact CZ-OE1 3.95Å; R151-E155 IonicContact NE-OE1 2.95Å; R151-E155 PolarHBondContact NE-OE1 3.11Å; R151-E155 IonicContact NH2-OE1 3.93Å; R151-E155 WeakPolarHBondContact O-CG 3.34Å; R151-E155 PolarHBondContact O-N 3.36Å; P152-E155 PolarHBondContact O-N 2.88Å; E155-P159 VanDerWaalsContact O-CD 3.31Å; E155-P159 WeakPolarHBondContact O-CD 3.46Å; E155-L356 HydrophobicContact CG-CB 3.79Å; E155-L356 HydrophobicContact CG-CD2 3.86Å
156	R	89.9	Confident	92.6	Very high	99 Å²	99	44 Å²	44	37%	0.374	21%	0.206	S	C	.	.	H	α-helix	trans	-77.9	-33.7	174.3	-167.9	170.3	-175.4	161.4	-6.2	113.8	P152 A153 L154 E262 P263 G264	P152-R156 PolarHBondContact O-N 3.48Å; A153-R156 WeakPolarHBondContact O-CB 3.35Å; A153-R156 PolarHBondContact O-N 3.01Å; L154-R156 PolarHBondContact O-N 3.43Å; R156-E262 VanDerWaalsContact NH1-CB 3.34Å; R156-E262 IonicContact NH1-OE2 3.58Å; R156-E262 PolarHBondContact NH1-OE2 3.09Å; R156-E262 PolarHBondContact NH2-O 2.91Å; R156-P263 PolarHBondContact NH1-O 2.9Å; R156-G264 VanDerWaalsContact CZ-CA 3.42Å; R156-G264 VanDerWaalsContact NH2-CA 3.32Å
157	F	92.3	Very high	92.5	Very high	1 Å²	1	49 Å²	49	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-76.6	-37.2	-179.6	-60.6	-26.9	0	0	0	113.1	V148 A153 L154 R160 L161 I196 L197 L269 L460	V148-F157 HydrophobicContact CG1-CE2 4.44Å; V148-F157 WeakPolarHBondContact O-CE2 3.17Å; A153-F157 HydrophobicContact CB-CE2 4.09Å; A153-F157 HydrophobicContact CB-CZ 4.3Å; A153-F157 WeakPolarHBondContact O-CD2 3.13Å; A153-F157 VanDerWaalsContact O-CG 3.24Å; A153-F157 WeakPolarHBondContact O-CG 3.28Å; A153-F157 PolarHBondContact O-N 3.4Å; L154-F157 HydrophobicContact CD2-CD2 4.49Å; L154-F157 PolarHBondContact O-N 3.41Å; F157-R160 PolarHBondContact O-N 2.95Å; F157-L161 HydrophobicContact CB-CD1 3.98Å; F157-L161 HydrophobicContact CB-CG 4.46Å; F157-L161 WeakPolarHBondContact O-CG 3.36Å; F157-L161 PolarHBondContact O-N 3.27Å; F157-I196 HydrophobicContact CB-CG2 4.29Å; F157-I196 HydrophobicContact CD1-CG2 3.9Å; F157-I196 HydrophobicContact CG-CG2 4.28Å; F157-L197 HydrophobicContact CD2-CD2 4.06Å; F157-L197 HydrophobicContact CE2-CD2 3.86Å; F157-L197 HydrophobicContact CZ-CD2 4.19Å; F157-L269 HydrophobicContact CZ-CD1 4.21Å; F157-L460 HydrophobicContact CD2-CD1 4.39Å
158	V	93.4	Very high	92.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-51.6	-50.5	-172.4	163.4	0	0	0	0	113.5	L154 R160 L161 Q162 L354 L356 L359 A463 L467	L154-V158 VanDerWaalsContact O-CG2 3.28Å; L154-V158 WeakPolarHBondContact O-CG2 3.31Å; L154-V158 PolarHBondContact O-N 3.4Å; V158-R160 VanDerWaalsContact C-N 3.33Å; V158-R160 PolarHBondContact O-N 3.21Å; V158-L161 PolarHBondContact O-N 2.88Å; V158-Q162 PolarHBondContact O-N 3.5Å; V158-L354 WeakPolarHBondContact CG1-O 3.31Å; V158-L356 HydrophobicContact CG2-CD1 4.18Å; V158-L359 HydrophobicContact CG1-CD1 3.98Å; V158-L359 HydrophobicContact CG2-CD1 4.22Å; V158-A463 HydrophobicContact CG2-CB 4.31Å; V158-L467 HydrophobicContact CG1-CD1 4.26Å; V158-L467 HydrophobicContact CG1-CD2 4.49Å
159	P	91.4	Very high	92.8	Very high	30 Å²	30	44.4 Å²	44.4	20%	0.195	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-41.4	178.5	-27	36.7	0	0	0	113.1	E155 Q162 R163 D353	E155-P159 VanDerWaalsContact O-CD 3.31Å; E155-P159 WeakPolarHBondContact O-CD 3.46Å; P159-Q162 PolarHBondContact O-N 3.44Å; P159-R163 WeakPolarHBondContact O-CG 3.48Å; P159-R163 PolarHBondContact O-N 3.11Å; P159-R163 VanDerWaalsContact O-N 3.09Å; P159-D353 HydrophobicContact CB-CB 3.82Å; P159-D353 HydrophobicContact CG-CB 4.35Å
160	R	92.2	Very high	92.8	Very high	81 Å²	81	44.1 Å²	44.1	31%	0.306	20%	0.198	S	C	.	.	H	α-helix	trans	-67.3	-39.3	179.4	-61	174.9	68.7	-169.5	-0.1	111.4	F157 V158 A164 R195 I196 G264	F157-R160 PolarHBondContact O-N 2.95Å; V158-R160 VanDerWaalsContact C-N 3.33Å; V158-R160 PolarHBondContact O-N 3.21Å; R160-A164 PolarHBondContact O-N 3.31Å; R160-R195 PolarHBondContact NH2-O 3.25Å; R160-I196 HydrophobicContact CB-CD1 3.89Å; R160-I196 HydrophobicContact CB-CG1 4.09Å; R160-I196 HydrophobicContact CB-CG2 4.14Å; R160-G264 PolarHBondContact NH1-O 2.86Å
161	L	94.3	Very high	92.8	Very high	6 Å²	6	45 Å²	45	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-45.8	175.7	-67.6	165.4	0	0	0	110.7	F157 V158 R163 A164 L165 M192 I196 L460 V464 L467	F157-L161 HydrophobicContact CB-CD1 3.98Å; F157-L161 HydrophobicContact CB-CG 4.46Å; F157-L161 WeakPolarHBondContact O-CG 3.36Å; F157-L161 PolarHBondContact O-N 3.27Å; V158-L161 PolarHBondContact O-N 2.88Å; L161-R163 PolarHBondContact O-N 3.33Å; L161-A164 PolarHBondContact O-N 3.25Å; L161-L165 WeakPolarHBondContact O-CB 3.14Å; L161-L165 WeakPolarHBondContact O-CD1 3.2Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.17Å; L161-L165 PolarHBondContact O-N 3.03Å; L161-M192 HydrophobicContact CD2-CB 4.17Å; L161-M192 HydrophobicContact CD2-CG 4.24Å; L161-M192 HydrophobicContact CD2-SD 3.64Å; L161-I196 HydrophobicContact CD2-CD1 3.74Å; L161-I196 HydrophobicContact CG-CD1 4.15Å; L161-L460 HydrophobicContact CD1-CD1 3.57Å; L161-V464 HydrophobicContact CD1-CG2 4.03Å; L161-V464 HydrophobicContact CD2-CG2 4.08Å; L161-L467 HydrophobicContact CB-CD1 3.97Å
162	Q	93.8	Very high	92.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-45.8	179.8	-172.1	174.9	3.9	0	0	112	V158 P159 A164 L165 R166 L467 E471	V158-Q162 PolarHBondContact O-N 3.5Å; P159-Q162 PolarHBondContact O-N 3.44Å; Q162-A164 VanDerWaalsContact C-N 3.33Å; Q162-A164 PolarHBondContact O-N 3.45Å; Q162-L165 PolarHBondContact O-N 3.29Å; Q162-R166 VanDerWaalsContact O-CB 3.3Å; Q162-R166 WeakPolarHBondContact O-CB 3.34Å; Q162-R166 PolarHBondContact O-N 3.05Å; Q162-L467 HydrophobicContact CB-CD1 4.23Å; Q162-L467 HydrophobicContact CB-CD2 3.86Å; Q162-L467 HydrophobicContact CG-CD2 3.91Å; Q162-E471 HydrophobicContact CG-CG 4.32Å; Q162-E471 VanDerWaalsContact CG-OE1 3.24Å; Q162-E471 WeakPolarHBondContact CG-OE1 3.42Å; Q162-E471 PolarHBondContact NE2-OE1 2.99Å
163	R	91.6	Very high	93	Very high	108 Å²	108	34.7 Å²	34.7	41%	0.408	16%	0.158	S	C	.	.	H	α-helix	trans	-60.4	-42.4	176.8	-68.4	-179.9	-140.6	152.3	2.8	112.2	P159 L161 R166 R167 D353	P159-R163 WeakPolarHBondContact O-CG 3.48Å; P159-R163 PolarHBondContact O-N 3.11Å; P159-R163 VanDerWaalsContact O-N 3.09Å; L161-R163 PolarHBondContact O-N 3.33Å; R163-R166 PolarHBondContact O-N 3.46Å; R163-R167 WeakPolarHBondContact O-CB 3.24Å; R163-R167 PolarHBondContact O-N 3.24Å; R163-D353 IonicContact CZ-OD2 3.92Å; R163-D353 VanDerWaalsContact CZ-OD2 3.23Å; R163-D353 IonicContact NE-OD1 2.58Å; R163-D353 IonicContact NE-OD2 3.44Å; R163-D353 PolarHBondContact NE-OD2 2.93Å; R163-D353 IonicContact NH2-OD2 2.88Å; R163-D353 PolarHBondContact NH2-OD2 3.4Å
164	A	93	Very high	93	Very high	23 Å²	23	37.2 Å²	37.2	19%	0.19	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-44.5	176.2	0	0	0	0	0	111.8	R160 L161 Q162 E168 L188 M192	R160-A164 PolarHBondContact O-N 3.31Å; L161-A164 PolarHBondContact O-N 3.25Å; Q162-A164 VanDerWaalsContact C-N 3.33Å; Q162-A164 PolarHBondContact O-N 3.45Å; A164-E168 WeakPolarHBondContact O-CB 3.19Å; A164-E168 PolarHBondContact O-N 3.34Å; A164-E168 VanDerWaalsContact O-N 3.11Å; A164-L188 HydrophobicContact CB-CD1 4.43Å; A164-M192 HydrophobicContact CB-CG 3.84Å; A164-M192 HydrophobicContact CB-SD 4.2Å
165	L	95.3	Very high	93.1	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-48.5	177	-72.7	160.9	0	0	0	111.9	L161 Q162 R167 E168 V169 L188 M192 V464 L467 L468 E471	L161-L165 WeakPolarHBondContact O-CB 3.14Å; L161-L165 WeakPolarHBondContact O-CD1 3.2Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.17Å; L161-L165 PolarHBondContact O-N 3.03Å; Q162-L165 PolarHBondContact O-N 3.29Å; L165-R167 VanDerWaalsContact C-N 3.35Å; L165-R167 PolarHBondContact O-N 3.34Å; L165-E168 PolarHBondContact O-N 2.84Å; L165-E168 VanDerWaalsContact O-N 3.16Å; L165-V169 WeakPolarHBondContact O-CG2 3.24Å; L165-V169 PolarHBondContact O-N 3.35Å; L165-L188 HydrophobicContact CD2-CD2 3.63Å; L165-M192 HydrophobicContact CG-SD 4.26Å; L165-V464 HydrophobicContact CD1-CG1 4.44Å; L165-L467 HydrophobicContact CD1-CB 3.46Å; L165-L467 VanDerWaalsContact CD1-CB 3.46Å; L165-L467 HydrophobicContact CD1-CD1 4.24Å; L165-L468 HydrophobicContact CD2-CB 4.03Å; L165-L468 HydrophobicContact CD2-CD1 3.92Å; L165-L468 HydrophobicContact CD2-CG 4.44Å; L165-E471 HydrophobicContact CB-CG 4.43Å
166	R	92	Very high	93	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-47.5	178.1	-176.2	-177.7	-59.5	162.5	3.6	111.6	Q162 R163 E168 V169 R170 E351 E471	Q162-R166 VanDerWaalsContact O-CB 3.3Å; Q162-R166 WeakPolarHBondContact O-CB 3.34Å; Q162-R166 PolarHBondContact O-N 3.05Å; R163-R166 PolarHBondContact O-N 3.46Å; R166-E168 VanDerWaalsContact C-N 3.3Å; R166-E168 PolarHBondContact O-N 2.91Å; R166-V169 PolarHBondContact O-N 2.73Å; R166-R170 WeakPolarHBondContact O-CB 3.4Å; R166-R170 VanDerWaalsContact O-CG 3.3Å; R166-R170 WeakPolarHBondContact O-CG 3.34Å; R166-R170 PolarHBondContact O-N 3.49Å; R166-E351 WeakPolarHBondContact CD-OE2 3.42Å; R166-E351 IonicContact CZ-OE2 3.41Å; R166-E351 IonicContact NE-OE2 3.81Å; R166-E351 PolarHBondContact NE-OE2 3.45Å; R166-E351 PolarHBondContact NH1-O 2.85Å; R166-E351 IonicContact NH1-OE2 2.71Å; R166-E471 HydrophobicContact CB-CG 4.3Å; R166-E471 WeakPolarHBondContact CB-OE2 3.42Å; R166-E471 VanDerWaalsContact CG-OE2 3.3Å; R166-E471 WeakPolarHBondContact CG-OE2 3.21Å; R166-E471 IonicContact CZ-OE1 3.71Å; R166-E471 IonicContact NE-OE1 2.9Å; R166-E471 PolarHBondContact NE-OE1 3.12Å; R166-E471 IonicContact NE-OE2 2.71Å; R166-E471 PolarHBondContact NE-OE2 2.89Å; R166-E471 IonicContact NH2-OE1 3.62Å; R166-E471 PolarHBondContact NH2-OE1 3.5Å
167	R	91.6	Very high	93.3	Very high	146 Å²	146	44.4 Å²	44.4	55%	0.551	22%	0.221	S	C	*	.	H	α-helix	trans	-60.7	-40.9	177.6	-178.1	175.9	174.8	-175.1	-3.5	111.7	R163 L165 S171	R163-R167 WeakPolarHBondContact O-CB 3.24Å; R163-R167 PolarHBondContact O-N 3.24Å; L165-R167 VanDerWaalsContact C-N 3.35Å; L165-R167 PolarHBondContact O-N 3.34Å; R167-S171 PolarHBondContact O-N 2.97Å
168	E	94.4	Very high	93.5	Very high	23 Å²	23	47.4 Å²	47.4	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-70.1	-45.2	179.4	-167.3	71.2	-148	0	0	112	A164 L165 R166 R170 S171 W172 L188 R191	A164-E168 WeakPolarHBondContact O-CB 3.19Å; A164-E168 PolarHBondContact O-N 3.34Å; A164-E168 VanDerWaalsContact O-N 3.11Å; L165-E168 PolarHBondContact O-N 2.84Å; L165-E168 VanDerWaalsContact O-N 3.16Å; R166-E168 VanDerWaalsContact C-N 3.3Å; R166-E168 PolarHBondContact O-N 2.91Å; E168-R170 VanDerWaalsContact C-N 3.28Å; E168-R170 PolarHBondContact O-N 2.87Å; E168-S171 PolarHBondContact O-N 3.26Å; E168-S171 VanDerWaalsContact O-N 3.08Å; E168-S171 PolarHBondContact O-OG 2.9Å; E168-W172 HydrophobicContact CG-CZ2 3.59Å; E168-W172 VanDerWaalsContact O-CD1 3.3Å; E168-W172 VanDerWaalsContact O-CG 3.32Å; E168-W172 PolarHBondContact O-N 3.4Å; E168-W172 PolarHBondContact OE1-NE1 2.84Å; E168-L188 HydrophobicContact CB-CD1 3.82Å; E168-L188 HydrophobicContact CB-CD2 4.05Å; E168-L188 HydrophobicContact CB-CG 4.42Å; E168-L188 HydrophobicContact CG-CB 4.17Å; E168-L188 HydrophobicContact CG-CD1 3.99Å; E168-L188 HydrophobicContact CG-CD2 3.87Å; E168-L188 HydrophobicContact CG-CG 4.2Å; E168-R191 IonicContact OE2-CZ 3.28Å; E168-R191 IonicContact OE2-NH1 3.75Å; E168-R191 PolarHBondContact OE2-NH1 3Å
169	V	94.5	Very high	93.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-39.8	176	174.1	0	0	0	0	111.1	L165 R166 W172 C173 L468 E471 L472 T475 A476	L165-V169 WeakPolarHBondContact O-CG2 3.24Å; L165-V169 PolarHBondContact O-N 3.35Å; R166-V169 PolarHBondContact O-N 2.73Å; V169-W172 HydrophobicContact CG2-CE3 4.33Å; V169-W172 HydrophobicContact CG2-CZ3 4.19Å; V169-W172 PolarHBondContact O-N 2.86Å; V169-C173 PolarHBondContact O-N 2.94Å; V169-C173 VanDerWaalsContact O-N 3.16Å; V169-C173 PolarHBondContact O-SG 3Å; V169-L468 HydrophobicContact CG2-CD1 4.11Å; V169-E471 HydrophobicContact CG2-CB 4.36Å; V169-L472 HydrophobicContact CG1-CD2 4.32Å; V169-L472 HydrophobicContact CG2-CD2 4.15Å; V169-L472 HydrophobicContact CG2-CG 4.34Å; V169-T475 HydrophobicContact CG1-CG2 4.05Å; V169-A476 HydrophobicContact CG1-CB 4.22Å
170	R	92.6	Very high	94	Very high	27 Å²	27	49 Å²	49	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-37.6	174.1	-73.5	176.2	179.5	172.5	2.4	112.6	R166 E168 W172 C173 A174 E351 T475	R166-R170 WeakPolarHBondContact O-CB 3.4Å; R166-R170 VanDerWaalsContact O-CG 3.3Å; R166-R170 WeakPolarHBondContact O-CG 3.34Å; R166-R170 PolarHBondContact O-N 3.49Å; E168-R170 VanDerWaalsContact C-N 3.28Å; E168-R170 PolarHBondContact O-N 2.87Å; R170-W172 VanDerWaalsContact C-N 3.29Å; R170-W172 PolarHBondContact O-N 2.56Å; R170-C173 PolarHBondContact O-N 3.44Å; R170-A174 PolarHBondContact O-N 3.19Å; R170-A174 VanDerWaalsContact O-N 3.12Å; R170-E351 IonicContact CZ-OE2 3.47Å; R170-E351 IonicContact NH2-OE1 3.34Å; R170-E351 IonicContact NH2-OE2 3.09Å; R170-E351 PolarHBondContact NH2-OE2 3.4Å; R170-T475 HydrophobicContact CG-CG2 3.95Å
171	S	93.5	Very high	94.2	Very high	46 Å²	46	45.1 Å²	45.1	32%	0.322	24%	0.239	S	C	.	.	H	α-helix	trans	-66.7	-34.5	177	78.9	0	0	0	0	111.4	R167 E168 A174 A175	R167-S171 PolarHBondContact O-N 2.97Å; E168-S171 PolarHBondContact O-N 3.26Å; E168-S171 VanDerWaalsContact O-N 3.08Å; E168-S171 PolarHBondContact O-OG 2.9Å; S171-A174 PolarHBondContact O-N 3.46Å; S171-A175 PolarHBondContact O-N 3.09Å
172	W	95.6	Very high	94.3	Very high	8 Å²	8	45.9 Å²	45.9	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-41.7	173.5	-59.1	-12.4	0	0	0	112	E168 V169 R170 A174 A175 V179 A184 I309 L472 F504	E168-W172 HydrophobicContact CG-CZ2 3.59Å; E168-W172 VanDerWaalsContact O-CD1 3.3Å; E168-W172 VanDerWaalsContact O-CG 3.32Å; E168-W172 PolarHBondContact O-N 3.4Å; E168-W172 PolarHBondContact OE1-NE1 2.84Å; V169-W172 HydrophobicContact CG2-CE3 4.33Å; V169-W172 HydrophobicContact CG2-CZ3 4.19Å; V169-W172 PolarHBondContact O-N 2.86Å; R170-W172 VanDerWaalsContact C-N 3.29Å; R170-W172 PolarHBondContact O-N 2.56Å; W172-A174 PolarHBondContact O-N 3.03Å; W172-A175 VanDerWaalsContact O-CB 3.25Å; W172-A175 WeakPolarHBondContact O-CB 3.19Å; W172-A175 PolarHBondContact O-N 3.39Å; W172-A175 VanDerWaalsContact O-N 3.16Å; W172-V179 HydrophobicContact CB-CG2 4.13Å; W172-V179 HydrophobicContact CG-CG1 4.16Å; W172-V179 HydrophobicContact CG-CG2 4.35Å; W172-A184 HydrophobicContact CZ2-CB 3.89Å; W172-I309 HydrophobicContact CH2-CD1 4.03Å; W172-I309 HydrophobicContact CZ3-CD1 3.82Å; W172-L472 HydrophobicContact CZ3-CD2 4.25Å; W172-F504 HydrophobicContact CB-CB 4.14Å; W172-F504 HydrophobicContact CB-CD1 4.33Å; W172-F504 HydrophobicContact CB-CD2 3.79Å; W172-F504 HydrophobicContact CB-CE2 4.24Å; W172-F504 HydrophobicContact CB-CG 3.83Å; W172-F504 HydrophobicContact CD2-CE2 4.38Å; W172-F504 HydrophobicContact CD2-CZ 4.32Å; W172-F504 HydrophobicContact CE3-CD1 4.28Å; W172-F504 AromaticContact CE3-CE1 3.7Å; W172-F504 HydrophobicContact CE3-CE1 3.7Å; W172-F504 HydrophobicContact CE3-CE2 4.08Å; W172-F504 AromaticContact CE3-CZ 3.58Å; W172-F504 HydrophobicContact CE3-CZ 3.58Å; W172-F504 HydrophobicContact CG-CD2 4.49Å; W172-F504 HydrophobicContact CG-CE2 4.49Å; W172-F504 HydrophobicContact CZ3-CE1 4.29Å; W172-F504 HydrophobicContact CZ3-CZ 4.1Å
173	C	94.2	Very high	94.4	Very high	23 Å²	23	47.5 Å²	47.5	16%	0.155	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-27	175.4	-60.7	0	0	0	0	113.1	V169 R170 A175 P506	V169-C173 PolarHBondContact O-N 2.94Å; V169-C173 VanDerWaalsContact O-N 3.16Å; V169-C173 PolarHBondContact O-SG 3Å; R170-C173 PolarHBondContact O-N 3.44Å; C173-A175 VanDerWaalsContact C-N 3.34Å; C173-P506 HydrophobicContact CB-CB 4.41Å
174	A	92.8	Very high	94.5	Very high	63 Å²	63	43.2 Å²	43.2	52%	0.521	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-3.4	177.3	0	0	0	0	0	113.2	R170 S171 W172	R170-A174 PolarHBondContact O-N 3.19Å; R170-A174 VanDerWaalsContact O-N 3.12Å; S171-A174 PolarHBondContact O-N 3.46Å; W172-A174 PolarHBondContact O-N 3.03Å
175	A	93.8	Very high	94.7	Very high	45 Å²	45	42.2 Å²	42.2	37%	0.372	24%	0.237	S	C	.	.			trans	-69	136.1	-179.3	0	0	0	0	0	110.8	S171 W172 C173 G177 V179	S171-A175 PolarHBondContact O-N 3.09Å; W172-A175 VanDerWaalsContact O-CB 3.25Å; W172-A175 WeakPolarHBondContact O-CB 3.19Å; W172-A175 PolarHBondContact O-N 3.39Å; W172-A175 VanDerWaalsContact O-N 3.16Å; C173-A175 VanDerWaalsContact C-N 3.34Å; A175-G177 PolarHBondContact O-N 2.92Å; A175-V179 HydrophobicContact CB-CG2 3.8Å
176	R	91.5	Very high	94.6	Very high	267 Å²	267	43.4 Å²	43.4	100%	1.008	24%	0.243	S	C	*	.	S	Bend	trans	-72.1	-10.5	178	-67.5	-174.7	178.3	-178.8	-1	114
177	G	95.6	Very high	94.6	Very high	29 Å²	29	45.1 Å²	45.1	30%	0.299	26%	0.258	S	S	.	.	S	Bend	trans	-154.3	-174.7	-172.2	0	0	0	0	0	111.5	A175 V179	A175-G177 PolarHBondContact O-N 2.92Å; G177-V179 PolarHBondContact O-N 3.06Å
178	P	96.9	Very high	94.7	Very high	64 Å²	64	38.4 Å²	38.4	42%	0.416	23%	0.233	S	C	.	.			trans	-67.8	136.3	-173.9	28.9	-34.2	0	0	0	111.4	A481 R501 L502 F503	P178-A481 HydrophobicContact CB-CB 3.52Å; P178-A481 HydrophobicContact CG-CB 4.39Å; P178-R501 HydrophobicContact CB-CB 4.44Å; P178-L502 CarbonylContact C-O 3.57Å; P178-L502 WeakPolarHBondContact CA-O 3.4Å; P178-F503 HydrophobicContact CB-CD1 4.29Å; P178-F503 HydrophobicContact CB-CE1 3.97Å; P178-F503 HydrophobicContact CB-CZ 4.08Å; P178-F503 HydrophobicContact CG-CE1 4.22Å; P178-F503 HydrophobicContact CG-CZ 4.24Å
179	V	97.6	Very high	94.7	Very high	19 Å²	19	37.4 Å²	37.4	12%	0.115	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.3	177.1	178.2	0	0	0	0	109.2	W172 A175 G177 V181 A184 R501 L502 F504	W172-V179 HydrophobicContact CB-CG2 4.13Å; W172-V179 HydrophobicContact CG-CG1 4.16Å; W172-V179 HydrophobicContact CG-CG2 4.35Å; A175-V179 HydrophobicContact CB-CG2 3.8Å; G177-V179 PolarHBondContact O-N 3.06Å; V179-V181 PolarHBondContact O-N 3.25Å; V179-V181 VanDerWaalsContact O-N 3.16Å; V179-A184 HydrophobicContact CG1-CB 4.02Å; V179-R501 WeakPolarHBondContact O-CA 3.43Å; V179-L502 PolarHBondContact N-O 3.22Å; V179-L502 PolarHBondContact O-N 2.8Å; V179-F504 HydrophobicContact CB-CD2 4.18Å; V179-F504 HydrophobicContact CB-CE2 4.07Å; V179-F504 HydrophobicContact CG1-CE2 4.48Å; V179-F504 HydrophobicContact CG2-CD2 4.15Å
180	A	97	Very high	94.7	Very high	45 Å²	45	37.5 Å²	37.5	37%	0.372	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	92.8	167.9	0	0	0	0	0	109.4	Y182 G183 A184 G499	A180-Y182 VanDerWaalsContact C-N 3.32Å; A180-Y182 PolarHBondContact O-N 2.95Å; A180-G183 PolarHBondContact O-N 2.94Å; A180-G183 VanDerWaalsContact O-N 3.12Å; A180-A184 PolarHBondContact O-N 3.49Å; A180-G499 CarbonylContact C-O 3.35Å
181	V	97.5	Very high	94.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-42.4	-168.8	174.5	0	0	0	0	112.3	V179 G183 A184 A185 T306 I309 G499 L500 L502 F504	V179-V181 PolarHBondContact O-N 3.25Å; V179-V181 VanDerWaalsContact O-N 3.16Å; V181-G183 PolarHBondContact O-N 2.97Å; V181-A184 PolarHBondContact O-N 3.17Å; V181-A185 VanDerWaalsContact O-CB 3.23Å; V181-A185 WeakPolarHBondContact O-CB 3.38Å; V181-A185 PolarHBondContact O-N 3.3Å; V181-T306 HydrophobicContact CG1-CG2 4.08Å; V181-I309 HydrophobicContact CG1-CB 4.44Å; V181-I309 HydrophobicContact CG1-CD1 3.5Å; V181-I309 HydrophobicContact CG1-CG2 4.42Å; V181-G499 PolarHBondContact N-O 2.79Å; V181-G499 VanDerWaalsContact N-O 3.12Å; V181-L500 HydrophobicContact CB-CB 4.26Å; V181-L500 HydrophobicContact CB-CD2 4.2Å; V181-L500 HydrophobicContact CB-CG 4.29Å; V181-L500 WeakPolarHBondContact CB-O 3.04Å; V181-L500 HydrophobicContact CG1-CD2 4.27Å; V181-L500 HydrophobicContact CG2-CD2 4.36Å; V181-L500 HydrophobicContact CG2-CG 4.28Å; V181-L500 VanDerWaalsContact CG2-O 3.26Å; V181-L500 WeakPolarHBondContact CG2-O 3.3Å; V181-L500 PolarHBondContact N-O 3.36Å; V181-L502 HydrophobicContact CG2-CB 4.17Å; V181-L502 HydrophobicContact CG2-CD1 3.62Å; V181-L502 HydrophobicContact CG2-CG 3.78Å; V181-F504 HydrophobicContact CG2-CE2 4.02Å; V181-F504 HydrophobicContact CG2-CZ 4.07Å
182	Y	96.2	Very high	94.6	Very high	22 Å²	22	36.4 Å²	36.4	9%	0.086	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-41.4	-179.5	-175.5	-124.2	0	0	0	112.1	A180 A185 K186 F299 A302 H495 G499	A180-Y182 VanDerWaalsContact C-N 3.32Å; A180-Y182 PolarHBondContact O-N 2.95Å; Y182-A185 PolarHBondContact O-N 2.96Å; Y182-K186 HydrophobicContact CE1-CD 4.19Å; Y182-K186 HydrophobicContact CE2-CG 4.48Å; Y182-K186 WeakPolarHBondContact O-CG 3.47Å; Y182-K186 PolarHBondContact O-N 2.89Å; Y182-F299 WeakPolarHBondContact OH-CD1 3.43Å; Y182-A302 HydrophobicContact CE2-CB 4.46Å; Y182-H495 HydrophobicContact CD1-CB 4.07Å; Y182-H495 HydrophobicContact CD2-CB 4Å; Y182-H495 HydrophobicContact CE1-CB 3.65Å; Y182-H495 AromaticContact CE1-CD2 3.82Å; Y182-H495 AromaticContact CE1-CG 3.81Å; Y182-H495 HydrophobicContact CE2-CB 3.57Å; Y182-H495 HydrophobicContact CG-CB 4.23Å; Y182-H495 AromaticContact CZ-CG 3.82Å; Y182-G499 WeakPolarHBondContact CB-O 3.48Å; Y182-G499 PolarHBondContact N-O 2.96Å
183	G	94.5	Very high	94.5	Very high	34 Å²	34	36.2 Å²	36.2	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-46.1	175.1	0	0	0	0	0	112	A180 V181 K186 A187	A180-G183 PolarHBondContact O-N 2.94Å; A180-G183 VanDerWaalsContact O-N 3.12Å; V181-G183 PolarHBondContact O-N 2.97Å; G183-K186 PolarHBondContact O-N 3.37Å; G183-A187 PolarHBondContact O-N 2.79Å; G183-A187 VanDerWaalsContact O-N 3.08Å
184	A	94.9	Very high	94.4	Very high	17 Å²	17	35.1 Å²	35.1	14%	0.14	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-41.4	176.7	0	0	0	0	0	112.2	W172 V179 A180 V181 K186 A187 L188	W172-A184 HydrophobicContact CZ2-CB 3.89Å; V179-A184 HydrophobicContact CG1-CB 4.02Å; A180-A184 PolarHBondContact O-N 3.49Å; V181-A184 PolarHBondContact O-N 3.17Å; A184-K186 PolarHBondContact O-N 2.84Å; A184-A187 PolarHBondContact O-N 2.97Å; A184-L188 WeakPolarHBondContact O-CB 3.31Å; A184-L188 PolarHBondContact O-N 3.33Å
185	A	95.9	Very high	94.2	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-37.3	176.9	0	0	0	0	0	112.4	V181 Y182 T189 A302	V181-A185 VanDerWaalsContact O-CB 3.23Å; V181-A185 WeakPolarHBondContact O-CB 3.38Å; V181-A185 PolarHBondContact O-N 3.3Å; Y182-A185 PolarHBondContact O-N 2.96Å; A185-T189 WeakPolarHBondContact O-CB 3.37Å; A185-T189 WeakPolarHBondContact O-CG2 3.34Å; A185-T189 PolarHBondContact O-N 3.26Å; A185-T189 PolarHBondContact O-OG1 2.84Å; A185-A302 HydrophobicContact CB-CB 4.02Å
186	K	93.8	Very high	93.9	Very high	27 Å²	27	33 Å²	33	12%	0.117	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-52	170.8	-76.4	-172.1	-63.3	157.5	0	110.9	Y182 G183 A184 L188 T189 F190 E215 F298 F299 A302	Y182-K186 HydrophobicContact CE1-CD 4.19Å; Y182-K186 HydrophobicContact CE2-CG 4.48Å; Y182-K186 WeakPolarHBondContact O-CG 3.47Å; Y182-K186 PolarHBondContact O-N 2.89Å; G183-K186 PolarHBondContact O-N 3.37Å; A184-K186 PolarHBondContact O-N 2.84Å; K186-L188 VanDerWaalsContact C-N 3.32Å; K186-L188 PolarHBondContact O-N 2.77Å; K186-T189 PolarHBondContact O-N 2.54Å; K186-T189 PolarHBondContact O-OG1 3.47Å; K186-F190 WeakPolarHBondContact O-CB 3.47Å; K186-F190 PolarHBondContact O-N 2.96Å; K186-E215 IonicContact NZ-OE1 2.66Å; K186-E215 PolarHBondContact NZ-OE1 3.29Å; K186-E215 IonicContact NZ-OE2 3.69Å; K186-E215 PolarHBondContact NZ-OE2 3.38Å; K186-F298 HydrophobicContact CB-CE2 3.75Å; K186-F298 HydrophobicContact CB-CZ 3.95Å; K186-F298 HydrophobicContact CD-CZ 4.19Å; K186-F298 HydrophobicContact CG-CE2 4.33Å; K186-F298 HydrophobicContact CG-CZ 4.24Å; K186-F298 WeakPolarHBondContact O-CE2 3.49Å; K186-F299 HydrophobicContact CD-CD1 4.28Å; K186-F299 HydrophobicContact CD-CE1 3.69Å; K186-F299 HydrophobicContact CD-CZ 4.32Å; K186-F299 HydrophobicContact CG-CE1 4.47Å; K186-A302 HydrophobicContact CB-CB 4.5Å; K186-A302 HydrophobicContact CG-CB 3.93Å
187	A	92.5	Very high	93.7	Very high	40 Å²	40	20.7 Å²	20.7	33%	0.331	13%	0.134	S	C	.	.	H	α-helix	trans	-58.4	-44.3	179.4	0	0	0	0	0	112	G183 A184 R191	G183-A187 PolarHBondContact O-N 2.79Å; G183-A187 VanDerWaalsContact O-N 3.08Å; A184-A187 PolarHBondContact O-N 2.97Å; A187-R191 VanDerWaalsContact O-CB 3.31Å; A187-R191 WeakPolarHBondContact O-CB 3.3Å; A187-R191 PolarHBondContact O-N 2.98Å
188	L	93.8	Very high	93.4	Very high	5 Å²	5	19.3 Å²	19.3	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-49.1	177.4	178	60.8	0	0	0	112.6	A164 L165 E168 A184 K186 R191 M192	A164-L188 HydrophobicContact CB-CD1 4.43Å; L165-L188 HydrophobicContact CD2-CD2 3.63Å; E168-L188 HydrophobicContact CB-CD1 3.82Å; E168-L188 HydrophobicContact CB-CD2 4.05Å; E168-L188 HydrophobicContact CB-CG 4.42Å; E168-L188 HydrophobicContact CG-CB 4.17Å; E168-L188 HydrophobicContact CG-CD1 3.99Å; E168-L188 HydrophobicContact CG-CD2 3.87Å; E168-L188 HydrophobicContact CG-CG 4.2Å; A184-L188 WeakPolarHBondContact O-CB 3.31Å; A184-L188 PolarHBondContact O-N 3.33Å; K186-L188 VanDerWaalsContact C-N 3.32Å; K186-L188 PolarHBondContact O-N 2.77Å; L188-R191 PolarHBondContact O-N 2.98Å; L188-M192 HydrophobicContact CD1-CG 4.22Å; L188-M192 HydrophobicContact CD1-SD 4.37Å; L188-M192 HydrophobicContact CG-CE 4.05Å; L188-M192 HydrophobicContact CG-SD 4.4Å; L188-M192 WeakPolarHBondContact O-CG 3.21Å; L188-M192 PolarHBondContact O-N 3.44Å
189	T	94.3	Very high	92.8	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-66.7	-38.2	-177.3	51.2	0	0	0	0	111.9	A185 K186 M192 A193 F298 T301 A302	A185-T189 WeakPolarHBondContact O-CB 3.37Å; A185-T189 WeakPolarHBondContact O-CG2 3.34Å; A185-T189 PolarHBondContact O-N 3.26Å; A185-T189 PolarHBondContact O-OG1 2.84Å; K186-T189 PolarHBondContact O-N 2.54Å; K186-T189 PolarHBondContact O-OG1 3.47Å; T189-M192 HydrophobicContact CG2-CE 4.08Å; T189-A193 WeakPolarHBondContact O-CB 3.17Å; T189-A193 PolarHBondContact O-N 2.91Å; T189-F298 PolarHBondContact OG1-O 3.26Å; T189-T301 HydrophobicContact CG2-CG2 3.81Å; T189-A302 HydrophobicContact CG2-CB 4.24Å
190	F	93.7	Very high	92.2	Very high	1 Å²	1	16.3 Å²	16.3	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-60.1	-50.8	170.4	-174.4	-93.5	0	0	0	111.5	K186 M192 A193 A194 L210 A211 F214 L294 F298	K186-F190 WeakPolarHBondContact O-CB 3.47Å; K186-F190 PolarHBondContact O-N 2.96Å; F190-M192 VanDerWaalsContact C-N 3.33Å; F190-M192 PolarHBondContact O-N 2.85Å; F190-A193 PolarHBondContact O-N 3.34Å; F190-A193 VanDerWaalsContact O-N 3.14Å; F190-A194 HydrophobicContact CD1-CB 4.45Å; F190-A194 HydrophobicContact CE1-CB 4.08Å; F190-A194 HydrophobicContact CZ-CB 4.44Å; F190-A194 WeakPolarHBondContact O-CB 3.29Å; F190-A194 PolarHBondContact O-N 3.42Å; F190-L210 HydrophobicContact CE1-CB 3.87Å; F190-L210 HydrophobicContact CE1-CD2 4.11Å; F190-L210 HydrophobicContact CE1-CG 4.12Å; F190-L210 HydrophobicContact CZ-CB 3.86Å; F190-L210 HydrophobicContact CZ-CD2 3.72Å; F190-L210 HydrophobicContact CZ-CG 3.62Å; F190-A211 HydrophobicContact CB-CB 4.14Å; F190-A211 HydrophobicContact CD1-CB 3.52Å; F190-A211 HydrophobicContact CD2-CB 4.34Å; F190-A211 HydrophobicContact CE1-CB 4.02Å; F190-A211 HydrophobicContact CG-CB 3.71Å; F190-F214 HydrophobicContact CD2-CB 4Å; F190-F214 HydrophobicContact CD2-CD1 4Å; F190-F214 HydrophobicContact CD2-CG 4.03Å; F190-F214 HydrophobicContact CE2-CB 3.5Å; F190-F214 HydrophobicContact CE2-CD1 4.09Å; F190-F214 HydrophobicContact CE2-CD2 4.19Å; F190-F214 AromaticContact CE2-CG 3.65Å; F190-F214 HydrophobicContact CE2-CG 3.65Å; F190-F214 HydrophobicContact CZ-CB 4.33Å; F190-L294 HydrophobicContact CD2-CD2 4.49Å; F190-L294 HydrophobicContact CE2-CD1 4.35Å; F190-L294 HydrophobicContact CE2-CD2 4.15Å; F190-F298 HydrophobicContact CB-CD2 3.69Å; F190-F298 HydrophobicContact CB-CE2 3.68Å; F190-F298 HydrophobicContact CD2-CD2 4.25Å; F190-F298 HydrophobicContact CD2-CE2 4.36Å; F190-F298 HydrophobicContact CG-CD2 4.48Å; F190-F298 HydrophobicContact CG-CE2 4.42Å
191	R	92.7	Very high	91.5	Very high	41 Å²	41	21.8 Å²	21.8	16%	0.155	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-44.6	180	-174.4	-170.1	-65.1	118.1	-3.8	111.8	E168 A187 L188 R195 E204	E168-R191 IonicContact OE2-CZ 3.28Å; E168-R191 IonicContact OE2-NH1 3.75Å; E168-R191 PolarHBondContact OE2-NH1 3Å; A187-R191 VanDerWaalsContact O-CB 3.31Å; A187-R191 WeakPolarHBondContact O-CB 3.3Å; A187-R191 PolarHBondContact O-N 2.98Å; L188-R191 PolarHBondContact O-N 2.98Å; R191-R195 WeakPolarHBondContact O-CB 3.41Å; R191-R195 PolarHBondContact O-N 3.35Å; R191-E204 IonicContact CZ-OE2 2.8Å; R191-E204 IonicContact NE-OE1 2.74Å; R191-E204 IonicContact NE-OE2 3.43Å; R191-E204 PolarHBondContact NE-OE2 3.06Å; R191-E204 IonicContact NH2-OE2 2.74Å; R191-E204 PolarHBondContact NH2-OE2 2.77Å
192	M	92.6	Very high	90.8	Very high	10 Å²	10	22.5 Å²	22.5	5%	0.049	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-47.3	175.4	-71.8	-171.5	-57.3	0	0	111.2	L161 A164 L165 L188 T189 F190 I196 V464	L161-M192 HydrophobicContact CD2-CB 4.17Å; L161-M192 HydrophobicContact CD2-CG 4.24Å; L161-M192 HydrophobicContact CD2-SD 3.64Å; A164-M192 HydrophobicContact CB-CG 3.84Å; A164-M192 HydrophobicContact CB-SD 4.2Å; L165-M192 HydrophobicContact CG-SD 4.26Å; L188-M192 HydrophobicContact CD1-CG 4.22Å; L188-M192 HydrophobicContact CD1-SD 4.37Å; L188-M192 HydrophobicContact CG-CE 4.05Å; L188-M192 HydrophobicContact CG-SD 4.4Å; L188-M192 WeakPolarHBondContact O-CG 3.21Å; L188-M192 PolarHBondContact O-N 3.44Å; T189-M192 HydrophobicContact CG2-CE 4.08Å; F190-M192 VanDerWaalsContact C-N 3.33Å; F190-M192 PolarHBondContact O-N 2.85Å; M192-I196 HydrophobicContact CB-CD1 4.14Å; M192-I196 HydrophobicContact CG-CD1 4.13Å; M192-I196 WeakPolarHBondContact O-CA 3.49Å; M192-I196 WeakPolarHBondContact O-CB 3.26Å; M192-I196 PolarHBondContact O-N 3.49Å; M192-V464 HydrophobicContact CE-CG1 4.06Å
193	A	92.7	Very high	90.3	Very high	3 Å²	3	25.1 Å²	25.1	3%	0.025	14%	0.14	C	C	.	.	I	π-helix	trans	-64.2	-46	-180	0	0	0	0	0	111.8	T189 F190 L197 L198 L294 A297	T189-A193 WeakPolarHBondContact O-CB 3.17Å; T189-A193 PolarHBondContact O-N 2.91Å; F190-A193 PolarHBondContact O-N 3.34Å; F190-A193 VanDerWaalsContact O-N 3.14Å; A193-L197 HydrophobicContact CB-CD1 4.2Å; A193-L197 CarbonylContact O-C 3.53Å; A193-L197 WeakPolarHBondContact O-CA 3.34Å; A193-L197 VanDerWaalsContact O-CB 3.27Å; A193-L197 WeakPolarHBondContact O-CB 3.38Å; A193-L197 PolarHBondContact O-N 3Å; A193-L197 VanDerWaalsContact O-N 3.09Å; A193-L198 PolarHBondContact O-N 3.04Å; A193-L294 HydrophobicContact CB-CD2 3.67Å; A193-A297 HydrophobicContact CB-CB 3.99Å
194	A	91.7	Very high	89.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	I	π-helix	trans	-62.3	-50.4	177.9	0	0	0	0	0	112.6	F190 L198 G199 L200 L202 L294	F190-A194 HydrophobicContact CD1-CB 4.45Å; F190-A194 HydrophobicContact CE1-CB 4.08Å; F190-A194 HydrophobicContact CZ-CB 4.44Å; F190-A194 WeakPolarHBondContact O-CB 3.29Å; F190-A194 PolarHBondContact O-N 3.42Å; A194-L198 CarbonylContact O-C 3.58Å; A194-L198 WeakPolarHBondContact O-CB 3.24Å; A194-G199 PolarHBondContact O-N 2.93Å; A194-G199 VanDerWaalsContact O-N 3.17Å; A194-L200 HydrophobicContact CB-CD1 4.13Å; A194-L200 WeakPolarHBondContact O-CB 3.35Å; A194-L200 PolarHBondContact O-N 2.81Å; A194-L202 HydrophobicContact CB-CD1 4.2Å; A194-L294 HydrophobicContact CB-CD2 4.46Å
195	R	89.4	Confident	89.5	Confident	55 Å²	55	30.3 Å²	30.3	21%	0.208	16%	0.159	C	C	.	.	I	π-helix	trans	-84.1	-35.7	-174.3	-64.4	-173.7	177.8	151.7	4.8	113.9	R160 R191 G199 L202 D203 E204	R160-R195 PolarHBondContact NH2-O 3.25Å; R191-R195 WeakPolarHBondContact O-CB 3.41Å; R191-R195 PolarHBondContact O-N 3.35Å; R195-G199 WeakPolarHBondContact O-CA 3.49Å; R195-L202 PolarHBondContact NE-O 2.94Å; R195-L202 PolarHBondContact NH2-O 3.45Å; R195-D203 PolarHBondContact NH2-O 2.93Å; R195-E204 IonicContact CZ-OE1 3.57Å; R195-E204 VanDerWaalsContact CZ-OE1 3.26Å; R195-E204 IonicContact NH1-OE1 2.66Å; R195-E204 PolarHBondContact NH1-OE1 2.75Å; R195-E204 IonicContact NH2-OE1 3.2Å; R195-E204 PolarHBondContact NH2-OE1 2.9Å; R195-E204 IonicContact NH2-OE2 3.32Å
196	I	88.1	Confident	89.1	Confident	9 Å²	9	34 Å²	34	5%	0.046	17%	0.172	C	C	.	.	I	π-helix	trans	-94.2	-46.1	-173.4	-54.3	170.4	0	0	0	111	F157 R160 L161 M192 D265	F157-I196 HydrophobicContact CB-CG2 4.29Å; F157-I196 HydrophobicContact CD1-CG2 3.9Å; F157-I196 HydrophobicContact CG-CG2 4.28Å; R160-I196 HydrophobicContact CB-CD1 3.89Å; R160-I196 HydrophobicContact CB-CG1 4.09Å; R160-I196 HydrophobicContact CB-CG2 4.14Å; L161-I196 HydrophobicContact CD2-CD1 3.74Å; L161-I196 HydrophobicContact CG-CD1 4.15Å; M192-I196 HydrophobicContact CB-CD1 4.14Å; M192-I196 HydrophobicContact CG-CD1 4.13Å; M192-I196 WeakPolarHBondContact O-CA 3.49Å; M192-I196 WeakPolarHBondContact O-CB 3.26Å; M192-I196 PolarHBondContact O-N 3.49Å; I196-D265 WeakPolarHBondContact O-CB 3.48Å
197	L	87.4	Confident	88.8	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.042	17%	0.168	C	C	.	.	I	π-helix	trans	-84.5	-43.1	-178.8	-54.4	179.3	0	0	0	111.9	F157 A193 D265 A266 L267 L460	F157-L197 HydrophobicContact CD2-CD2 4.06Å; F157-L197 HydrophobicContact CE2-CD2 3.86Å; F157-L197 HydrophobicContact CZ-CD2 4.19Å; A193-L197 HydrophobicContact CB-CD1 4.2Å; A193-L197 CarbonylContact O-C 3.53Å; A193-L197 WeakPolarHBondContact O-CA 3.34Å; A193-L197 VanDerWaalsContact O-CB 3.27Å; A193-L197 WeakPolarHBondContact O-CB 3.38Å; A193-L197 PolarHBondContact O-N 3Å; A193-L197 VanDerWaalsContact O-N 3.09Å; L197-D265 WeakPolarHBondContact O-CB 3.4Å; L197-A266 HydrophobicContact CB-CB 3.97Å; L197-A266 HydrophobicContact CD2-CB 4.48Å; L197-A266 WeakPolarHBondContact O-CA 3.03Å; L197-A266 WeakPolarHBondContact O-CB 3.19Å; L197-A266 PolarHBondContact O-N 3.48Å; L197-L267 PolarHBondContact O-N 3.11Å; L197-L460 HydrophobicContact CD1-CD2 4.12Å; L197-L460 HydrophobicContact CD2-CD2 4.02Å
198	L	87.7	Confident	88.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-91.8	-15.2	-179.8	-58.2	-171.8	0	0	0	113.6	A193 A194 L200 L247 K254 A290 L293 L294	A193-L198 PolarHBondContact O-N 3.04Å; A194-L198 CarbonylContact O-C 3.58Å; A194-L198 WeakPolarHBondContact O-CB 3.24Å; L198-L200 VanDerWaalsContact C-N 3.26Å; L198-L200 HydrophobicContact CB-CD1 4.31Å; L198-L200 HydrophobicContact CB-CD2 4.38Å; L198-L200 HydrophobicContact CB-CG 3.84Å; L198-L200 HydrophobicContact CD1-CD1 4.16Å; L198-L200 PolarHBondContact O-N 3.45Å; L198-L247 HydrophobicContact CD1-CD2 3.96Å; L198-K254 WeakPolarHBondContact O-CE 3.16Å; L198-K254 PolarHBondContact O-NZ 3.36Å; L198-A290 HydrophobicContact CD1-CB 3.99Å; L198-A290 HydrophobicContact CD2-CB 3.73Å; L198-L293 HydrophobicContact CD2-CD1 4.23Å; L198-L294 HydrophobicContact CD1-CD1 3.66Å; L198-L294 HydrophobicContact CD1-CD2 3.82Å; L198-L294 HydrophobicContact CD1-CG 3.64Å; L198-L294 HydrophobicContact CG-CD2 4.42Å; L198-L294 HydrophobicContact CG-CG 4.49Å
199	G	84.4	Confident	88.4	Confident	13 Å²	13	38.6 Å²	38.6	13%	0.134	19%	0.192	C	C	.	.			trans	70	21	-178.4	0	0	0	0	0	113.9	A194 R195 Q201 D265	A194-G199 PolarHBondContact O-N 2.93Å; A194-G199 VanDerWaalsContact O-N 3.17Å; R195-G199 WeakPolarHBondContact O-CA 3.49Å; G199-Q201 PolarHBondContact O-N 2.86Å; G199-D265 WeakPolarHBondContact CA-OD2 3.33Å
200	L	85.2	Confident	88.2	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	19%	0.192	C	C	.	.			trans	-69.1	126.1	-179.7	-56.7	-179.9	0	0	0	110.4	A194 L198 L202 L210 L247 A250	A194-L200 HydrophobicContact CB-CD1 4.13Å; A194-L200 WeakPolarHBondContact O-CB 3.35Å; A194-L200 PolarHBondContact O-N 2.81Å; L198-L200 VanDerWaalsContact C-N 3.26Å; L198-L200 HydrophobicContact CB-CD1 4.31Å; L198-L200 HydrophobicContact CB-CD2 4.38Å; L198-L200 HydrophobicContact CB-CG 3.84Å; L198-L200 HydrophobicContact CD1-CD1 4.16Å; L198-L200 PolarHBondContact O-N 3.45Å; L200-L202 HydrophobicContact CB-CD1 3.88Å; L200-L202 HydrophobicContact CB-CD2 4.48Å; L200-L202 HydrophobicContact CB-CG 3.8Å; L200-L202 HydrophobicContact CD1-CD1 4.05Å; L200-L202 PolarHBondContact O-N 3.05Å; L200-L210 HydrophobicContact CD1-CD2 4.24Å; L200-L247 HydrophobicContact CD1-CD2 4.36Å; L200-L247 HydrophobicContact CD2-CD2 4.38Å; L200-A250 HydrophobicContact CD2-CB 3.2Å
201	Q	82.3	Confident	88.1	Confident	160 Å²	160	39.1 Å²	39.1	75%	0.748	20%	0.197	S	C	*	.			trans	-85.3	84.2	174	-59.1	-60.4	-24.5	0	0	109.3	G199	G199-Q201 PolarHBondContact O-N 2.86Å
202	L	82.4	Confident	88	Confident	15 Å²	15	43 Å²	43	8%	0.079	22%	0.217	C	C	.	.			trans	-114	130.3	-178.6	-57.3	172.9	0	0	0	110	A194 R195 L200 R206 C207 L210	A194-L202 HydrophobicContact CB-CD1 4.2Å; R195-L202 PolarHBondContact NE-O 2.94Å; R195-L202 PolarHBondContact NH2-O 3.45Å; L200-L202 HydrophobicContact CB-CD1 3.88Å; L200-L202 HydrophobicContact CB-CD2 4.48Å; L200-L202 HydrophobicContact CB-CG 3.8Å; L200-L202 HydrophobicContact CD1-CD1 4.05Å; L200-L202 PolarHBondContact O-N 3.05Å; L202-R206 HydrophobicContact CB-CB 4.46Å; L202-R206 HydrophobicContact CD2-CB 4.25Å; L202-C207 HydrophobicContact CB-CB 4.21Å; L202-L210 HydrophobicContact CD1-CD2 3.78Å
203	D	87.4	Confident	88	Confident	77 Å²	77	43.1 Å²	43.1	41%	0.412	22%	0.218	S	C	.	.			trans	-64.9	174.3	162.6	60.5	52.1	0	0	0	111.3	R195 T205 R206 C207	R195-D203 PolarHBondContact NH2-O 2.93Å; D203-T205 VanDerWaalsContact C-N 3.34Å; D203-T205 PolarHBondContact O-N 3.27Å; D203-T205 PolarHBondContact OD1-N 3.38Å; D203-T205 PolarHBondContact OD1-OG1 3.05Å; D203-R206 WeakPolarHBondContact OD1-CB 3.45Å; D203-R206 WeakPolarHBondContact OD1-CG 3.22Å; D203-R206 PolarHBondContact OD1-N 3.16Å; D203-R206 WeakPolarHBondContact OD2-CD 3.49Å; D203-C207 WeakPolarHBondContact O-CB 3.3Å; D203-C207 PolarHBondContact O-N 2.98Å
204	E	84.2	Confident	87.9	Confident	65 Å²	65	43 Å²	43	30%	0.304	22%	0.216	S	C	.	.	H	α-helix	trans	-67	-33.7	-178	-69.3	-56.7	138.1	0	0	113	R191 R195 T208	R191-E204 IonicContact CZ-OE2 2.8Å; R191-E204 IonicContact NE-OE1 2.74Å; R191-E204 IonicContact NE-OE2 3.43Å; R191-E204 PolarHBondContact NE-OE2 3.06Å; R191-E204 IonicContact NH2-OE2 2.74Å; R191-E204 PolarHBondContact NH2-OE2 2.77Å; R195-E204 IonicContact CZ-OE1 3.57Å; R195-E204 VanDerWaalsContact CZ-OE1 3.26Å; R195-E204 IonicContact NH1-OE1 2.66Å; R195-E204 PolarHBondContact NH1-OE1 2.75Å; R195-E204 IonicContact NH2-OE1 3.2Å; R195-E204 PolarHBondContact NH2-OE1 2.9Å; R195-E204 IonicContact NH2-OE2 3.32Å; E204-T208 WeakPolarHBondContact O-CB 3.35Å; E204-T208 PolarHBondContact O-N 3.46Å; E204-T208 PolarHBondContact O-OG1 2.92Å
205	T	87.4	Confident	87.9	Confident	95 Å²	95	45.2 Å²	45.2	58%	0.583	23%	0.227	S	C	*	.	H	α-helix	trans	-66	-53.8	179.6	36.2	0	0	0	0	111.4	D203 C207 T208 E209	D203-T205 VanDerWaalsContact C-N 3.34Å; D203-T205 PolarHBondContact O-N 3.27Å; D203-T205 PolarHBondContact OD1-N 3.38Å; D203-T205 PolarHBondContact OD1-OG1 3.05Å; T205-C207 VanDerWaalsContact C-N 3.3Å; T205-C207 PolarHBondContact O-N 3.42Å; T205-T208 WeakPolarHBondContact O-CB 3.22Å; T205-T208 PolarHBondContact O-N 3.1Å; T205-T208 VanDerWaalsContact O-N 3.11Å; T205-E209 WeakPolarHBondContact O-CG 3.44Å; T205-E209 PolarHBondContact O-N 3.17Å
206	R	87.9	Confident	88.1	Confident	81 Å²	81	46.1 Å²	46.1	31%	0.306	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-37.2	176.5	-66.9	177.6	69.8	-174.6	5.6	111.8	L202 D203 T208 E209 L210	L202-R206 HydrophobicContact CB-CB 4.46Å; L202-R206 HydrophobicContact CD2-CB 4.25Å; D203-R206 WeakPolarHBondContact OD1-CB 3.45Å; D203-R206 WeakPolarHBondContact OD1-CG 3.22Å; D203-R206 PolarHBondContact OD1-N 3.16Å; D203-R206 WeakPolarHBondContact OD2-CD 3.49Å; R206-T208 VanDerWaalsContact C-N 3.31Å; R206-T208 PolarHBondContact O-N 3.3Å; R206-E209 PolarHBondContact O-N 3.13Å; R206-L210 VanDerWaalsContact O-CB 3.26Å; R206-L210 WeakPolarHBondContact O-CB 3.46Å; R206-L210 PolarHBondContact O-N 2.71Å
207	C	87.9	Confident	88.3	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.02	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-38.6	176.5	-170	0	0	0	0	111.7	L202 D203 T205 A211	L202-C207 HydrophobicContact CB-CB 4.21Å; D203-C207 WeakPolarHBondContact O-CB 3.3Å; D203-C207 PolarHBondContact O-N 2.98Å; T205-C207 VanDerWaalsContact C-N 3.3Å; T205-C207 PolarHBondContact O-N 3.42Å; C207-A211 VanDerWaalsContact O-CB 3.3Å; C207-A211 WeakPolarHBondContact O-CB 3Å; C207-A211 PolarHBondContact O-N 3.2Å
208	T	87.4	Confident	88.4	Confident	68 Å²	68	46 Å²	46	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-68.3	-46.3	176.9	-56.7	0	0	0	0	111.6	E204 T205 R206 L210 A211 Q212	E204-T208 WeakPolarHBondContact O-CB 3.35Å; E204-T208 PolarHBondContact O-N 3.46Å; E204-T208 PolarHBondContact O-OG1 2.92Å; T205-T208 WeakPolarHBondContact O-CB 3.22Å; T205-T208 PolarHBondContact O-N 3.1Å; T205-T208 VanDerWaalsContact O-N 3.11Å; R206-T208 VanDerWaalsContact C-N 3.31Å; R206-T208 PolarHBondContact O-N 3.3Å; T208-L210 VanDerWaalsContact C-N 3.34Å; T208-L210 PolarHBondContact O-N 3.29Å; T208-A211 WeakPolarHBondContact O-CB 3.43Å; T208-A211 PolarHBondContact O-N 3.4Å; T208-Q212 WeakPolarHBondContact O-CG 3.37Å; T208-Q212 PolarHBondContact O-N 2.94Å
209	E	89.1	Confident	88.5	Confident	96 Å²	96	52.3 Å²	52.3	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-44.5	175.7	-70.7	172.2	177.4	0	0	111.9	T205 R206 Q212 T213	T205-E209 WeakPolarHBondContact O-CG 3.44Å; T205-E209 PolarHBondContact O-N 3.17Å; R206-E209 PolarHBondContact O-N 3.13Å; E209-Q212 PolarHBondContact O-N 3.41Å; E209-T213 WeakPolarHBondContact O-CB 3.4Å; E209-T213 PolarHBondContact O-N 3.22Å; E209-T213 PolarHBondContact O-OG1 2.71Å
210	L	90.6	Very high	88.9	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-68.5	-35.9	178.7	-159.6	68.8	0	0	0	111.7	F190 L200 L202 R206 T208 T213 F214 L243 Y246	F190-L210 HydrophobicContact CE1-CB 3.87Å; F190-L210 HydrophobicContact CE1-CD2 4.11Å; F190-L210 HydrophobicContact CE1-CG 4.12Å; F190-L210 HydrophobicContact CZ-CB 3.86Å; F190-L210 HydrophobicContact CZ-CD2 3.72Å; F190-L210 HydrophobicContact CZ-CG 3.62Å; L200-L210 HydrophobicContact CD1-CD2 4.24Å; L202-L210 HydrophobicContact CD1-CD2 3.78Å; R206-L210 VanDerWaalsContact O-CB 3.26Å; R206-L210 WeakPolarHBondContact O-CB 3.46Å; R206-L210 PolarHBondContact O-N 2.71Å; T208-L210 VanDerWaalsContact C-N 3.34Å; T208-L210 PolarHBondContact O-N 3.29Å; L210-T213 PolarHBondContact O-N 2.91Å; L210-F214 VanDerWaalsContact O-CB 3.26Å; L210-F214 WeakPolarHBondContact O-CB 3.11Å; L210-F214 PolarHBondContact O-N 3.09Å; L210-L243 HydrophobicContact CD1-CD2 3.52Å; L210-L243 HydrophobicContact CD1-CG 4.44Å; L210-L243 HydrophobicContact CG-CD2 3.78Å; L210-Y246 HydrophobicContact CD1-CD2 3.34Å; L210-Y246 HydrophobicContact CD1-CE2 3.75Å; L210-Y246 HydrophobicContact CD1-CG 3.79Å
211	A	90.7	Very high	89.1	Confident	12 Å²	12	52.3 Å²	52.3	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-42.1	174.1	0	0	0	0	0	111.8	F190 C207 T208 F214 E215	F190-A211 HydrophobicContact CB-CB 4.14Å; F190-A211 HydrophobicContact CD1-CB 3.52Å; F190-A211 HydrophobicContact CD2-CB 4.34Å; F190-A211 HydrophobicContact CE1-CB 4.02Å; F190-A211 HydrophobicContact CG-CB 3.71Å; C207-A211 VanDerWaalsContact O-CB 3.3Å; C207-A211 WeakPolarHBondContact O-CB 3Å; C207-A211 PolarHBondContact O-N 3.2Å; T208-A211 WeakPolarHBondContact O-CB 3.43Å; T208-A211 PolarHBondContact O-N 3.4Å; A211-F214 PolarHBondContact O-N 2.91Å; A211-E215 WeakPolarHBondContact O-CB 3.4Å; A211-E215 PolarHBondContact O-N 2.83Å
212	Q	90.9	Very high	89.3	Confident	123 Å²	123	50.1 Å²	50.1	58%	0.575	25%	0.248	S	C	*	.	H	α-helix	trans	-65.1	-43.3	175.1	-70.8	174.1	-3.8	0	0	111.7	T208 E209 F214 E215 Q216	T208-Q212 WeakPolarHBondContact O-CG 3.37Å; T208-Q212 PolarHBondContact O-N 2.94Å; E209-Q212 PolarHBondContact O-N 3.41Å; Q212-F214 VanDerWaalsContact C-N 3.28Å; Q212-F214 PolarHBondContact O-N 3.12Å; Q212-E215 PolarHBondContact O-N 3.08Å; Q212-Q216 PolarHBondContact O-N 3.42Å
213	T	92.4	Very high	89.5	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-43.5	174.8	-54.7	0	0	0	0	110.4	E209 L210 Q216 L217 A239 Q242 L243	E209-T213 WeakPolarHBondContact O-CB 3.4Å; E209-T213 PolarHBondContact O-N 3.22Å; E209-T213 PolarHBondContact O-OG1 2.71Å; L210-T213 PolarHBondContact O-N 2.91Å; T213-Q216 PolarHBondContact O-N 3.37Å; T213-L217 PolarHBondContact O-N 3Å; T213-A239 HydrophobicContact CG2-CB 4.04Å; T213-A239 WeakPolarHBondContact CG2-O 3.12Å; T213-A239 WeakPolarHBondContact O-CB 3.34Å; T213-Q242 HydrophobicContact CG2-CB 4Å; T213-Q242 HydrophobicContact CG2-CG 4.05Å; T213-L243 HydrophobicContact CG2-CG 4Å
214	F	92.1	Very high	89.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-40.6	177.2	-166.4	-100.6	0	0	0	112.8	F190 L210 A211 Q212 Q216 L217 V218 L243 V291 L294 F295 F298	F190-F214 HydrophobicContact CD2-CB 4Å; F190-F214 HydrophobicContact CD2-CD1 4Å; F190-F214 HydrophobicContact CD2-CG 4.03Å; F190-F214 HydrophobicContact CE2-CB 3.5Å; F190-F214 HydrophobicContact CE2-CD1 4.09Å; F190-F214 HydrophobicContact CE2-CD2 4.19Å; F190-F214 AromaticContact CE2-CG 3.65Å; F190-F214 HydrophobicContact CE2-CG 3.65Å; F190-F214 HydrophobicContact CZ-CB 4.33Å; L210-F214 VanDerWaalsContact O-CB 3.26Å; L210-F214 WeakPolarHBondContact O-CB 3.11Å; L210-F214 PolarHBondContact O-N 3.09Å; A211-F214 PolarHBondContact O-N 2.91Å; Q212-F214 VanDerWaalsContact C-N 3.28Å; Q212-F214 PolarHBondContact O-N 3.12Å; F214-Q216 VanDerWaalsContact C-N 3.33Å; F214-Q216 PolarHBondContact O-N 2.92Å; F214-L217 HydrophobicContact CD2-CD2 4.3Å; F214-L217 HydrophobicContact CE2-CD2 4.04Å; F214-L217 WeakPolarHBondContact O-CB 3.37Å; F214-L217 PolarHBondContact O-N 2.87Å; F214-V218 HydrophobicContact CD1-CG2 4.05Å; F214-V218 HydrophobicContact CE1-CG2 3.57Å; F214-V218 HydrophobicContact CZ-CG2 3.87Å; F214-V218 WeakPolarHBondContact O-CG2 3.46Å; F214-V218 PolarHBondContact O-N 3.22Å; F214-L243 HydrophobicContact CB-CD2 4.29Å; F214-L243 HydrophobicContact CD2-CD1 3.72Å; F214-L243 HydrophobicContact CD2-CD2 4.07Å; F214-L243 HydrophobicContact CE2-CD1 4.44Å; F214-V291 HydrophobicContact CE2-CG1 4.42Å; F214-L294 HydrophobicContact CD2-CB 4.27Å; F214-L294 HydrophobicContact CD2-CD1 4.33Å; F214-L294 HydrophobicContact CE1-CB 4.27Å; F214-L294 HydrophobicContact CE2-CB 3.62Å; F214-L294 HydrophobicContact CE2-CD1 4.28Å; F214-L294 HydrophobicContact CZ-CB 3.65Å; F214-F295 VanDerWaalsContact CZ-CA 3.42Å; F214-F295 HydrophobicContact CZ-CB 3.89Å; F214-F295 VanDerWaalsContact CZ-N 3.28Å; F214-F298 HydrophobicContact CD1-CB 4.26Å; F214-F298 AromaticContact CD1-CD1 3.51Å; F214-F298 HydrophobicContact CD1-CD1 3.51Å; F214-F298 HydrophobicContact CD1-CD2 4.47Å; F214-F298 AromaticContact CD1-CE1 3.85Å; F214-F298 HydrophobicContact CD1-CE1 3.85Å; F214-F298 AromaticContact CD1-CG 3.87Å; F214-F298 HydrophobicContact CD1-CG 3.87Å; F214-F298 HydrophobicContact CD1-CZ 4.45Å; F214-F298 HydrophobicContact CE1-CB 3.76Å; F214-F298 AromaticContact CE1-CD1 3.57Å; F214-F298 HydrophobicContact CE1-CD1 3.57Å; F214-F298 HydrophobicContact CE1-CE1 4.34Å; F214-F298 AromaticContact CE1-CG 3.84Å; F214-F298 HydrophobicContact CE1-CG 3.84Å
215	E	91.8	Very high	89.8	Confident	47 Å²	47	52.5 Å²	52.5	22%	0.22	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-44.7	173.6	-178.5	154.5	-157.2	0	0	111.4	K186 A211 Q212 L217 V218 E219 F298 F299	K186-E215 IonicContact NZ-OE1 2.66Å; K186-E215 PolarHBondContact NZ-OE1 3.29Å; K186-E215 IonicContact NZ-OE2 3.69Å; K186-E215 PolarHBondContact NZ-OE2 3.38Å; A211-E215 WeakPolarHBondContact O-CB 3.4Å; A211-E215 PolarHBondContact O-N 2.83Å; Q212-E215 PolarHBondContact O-N 3.08Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.13Å; E215-V218 PolarHBondContact O-N 3.05Å; E215-V218 VanDerWaalsContact O-N 3.08Å; E215-E219 HydrophobicContact CG-CG 4.25Å; E215-E219 WeakPolarHBondContact O-CG 2.92Å; E215-E219 PolarHBondContact O-N 3.34Å; E215-F298 HydrophobicContact CB-CE1 4.33Å; E215-F298 HydrophobicContact CB-CZ 4.38Å; E215-F299 HydrophobicContact CG-CZ 4.49Å
216	Q	92.1	Very high	90	Very high	75 Å²	75	53.1 Å²	53.1	35%	0.35	27%	0.266	S	S	.	.	H	α-helix	trans	-59.7	-38.6	174.2	-177	178	-32.6	0	0	112.5	Q212 T213 F214 N220 K235 A239	Q212-Q216 PolarHBondContact O-N 3.42Å; T213-Q216 PolarHBondContact O-N 3.37Å; F214-Q216 VanDerWaalsContact C-N 3.33Å; F214-Q216 PolarHBondContact O-N 2.92Å; Q216-N220 PolarHBondContact O-ND2 3.34Å; Q216-K235 PolarHBondContact NE2-O 3.03Å; Q216-A239 HydrophobicContact CB-CB 4.19Å; Q216-A239 HydrophobicContact CG-CB 4.14Å
217	L	93.3	Very high	90.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-48.8	173.2	176	66.2	0	0	0	110.9	L124 T213 F214 E215 N220 L221 G236 A239 R240 L243 V291	L124-L217 HydrophobicContact CB-CD1 3.9Å; L124-L217 HydrophobicContact CD1-CD1 4.38Å; L124-L217 HydrophobicContact CD2-CD1 3.99Å; L124-L217 HydrophobicContact CG-CD1 4.3Å; T213-L217 PolarHBondContact O-N 3Å; F214-L217 HydrophobicContact CD2-CD2 4.3Å; F214-L217 HydrophobicContact CE2-CD2 4.04Å; F214-L217 WeakPolarHBondContact O-CB 3.37Å; F214-L217 PolarHBondContact O-N 2.87Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.13Å; L217-N220 PolarHBondContact O-N 3.09Å; L217-L221 PolarHBondContact O-N 2.72Å; L217-G236 WeakPolarHBondContact CD1-O 3.45Å; L217-A239 HydrophobicContact CB-CB 4.04Å; L217-R240 HydrophobicContact CD1-CB 3.83Å; L217-L243 HydrophobicContact CB-CD1 4.17Å; L217-L243 HydrophobicContact CD2-CD1 3.61Å; L217-L243 HydrophobicContact CG-CD1 4.47Å; L217-V291 HydrophobicContact CD2-CG1 3.89Å
218	V	90.1	Very high	90.6	Very high	15 Å²	15	55.4 Å²	55.4	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-72.2	-40.9	-172.2	177.8	0	0	0	0	112.9	F214 E215 N220 L221 F295 F299	F214-V218 HydrophobicContact CD1-CG2 4.05Å; F214-V218 HydrophobicContact CE1-CG2 3.57Å; F214-V218 HydrophobicContact CZ-CG2 3.87Å; F214-V218 WeakPolarHBondContact O-CG2 3.46Å; F214-V218 PolarHBondContact O-N 3.22Å; E215-V218 PolarHBondContact O-N 3.05Å; E215-V218 VanDerWaalsContact O-N 3.08Å; V218-N220 PolarHBondContact O-N 3.02Å; V218-L221 HydrophobicContact CB-CD1 4.33Å; V218-L221 HydrophobicContact CG1-CD1 3.98Å; V218-L221 HydrophobicContact CG2-CD1 4.41Å; V218-L221 WeakPolarHBondContact O-CB 3.32Å; V218-L221 PolarHBondContact O-N 3.32Å; V218-F295 HydrophobicContact CG1-CD2 4.38Å; V218-F295 HydrophobicContact CG1-CE2 4.13Å; V218-F295 HydrophobicContact CG2-CD2 3.98Å; V218-F299 HydrophobicContact CB-CD2 4.17Å; V218-F299 HydrophobicContact CB-CE2 3.49Å; V218-F299 VanDerWaalsContact CB-CE2 3.49Å; V218-F299 HydrophobicContact CB-CZ 4.44Å; V218-F299 HydrophobicContact CG1-CD2 3.45Å; V218-F299 VanDerWaalsContact CG1-CD2 3.45Å; V218-F299 HydrophobicContact CG1-CE2 3.12Å; V218-F299 HydrophobicContact CG1-CZ 4.13Å; V218-F299 HydrophobicContact CG2-CD2 4.32Å; V218-F299 HydrophobicContact CG2-CE2 3.93Å
219	E	89.5	Confident	90.7	Very high	131 Å²	131	56.7 Å²	56.7	61%	0.612	30%	0.296	S	S	*	.	H	α-helix	trans	-56.5	-25.5	175.6	-74.1	-178.2	161.7	0	0	112.3	E215	E215-E219 HydrophobicContact CG-CG 4.25Å; E215-E219 WeakPolarHBondContact O-CG 2.92Å; E215-E219 PolarHBondContact O-N 3.34Å
220	N	92.2	Very high	90.8	Very high	21 Å²	21	60.1 Å²	60.1	11%	0.112	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	1.8	-178.6	-68.8	-69.5	0	0	0	114.5	L124 Q216 L217 V218 F222 S223 G232	L124-N220 HydrophobicContact CD1-CB 4.24Å; L124-N220 WeakPolarHBondContact CD1-O 3.33Å; Q216-N220 PolarHBondContact O-ND2 3.34Å; L217-N220 PolarHBondContact O-N 3.09Å; V218-N220 PolarHBondContact O-N 3.02Å; N220-F222 PolarHBondContact O-N 3.46Å; N220-S223 WeakPolarHBondContact O-CB 3.31Å; N220-S223 PolarHBondContact O-N 3.37Å; N220-S223 PolarHBondContact O-OG 3.04Å; N220-S223 VanDerWaalsContact O-OG 3.14Å; N220-G232 VanDerWaalsContact CB-O 3.23Å; N220-G232 WeakPolarHBondContact CB-O 3.37Å; N220-G232 VanDerWaalsContact OD1-C 3.3Å; N220-G232 WeakPolarHBondContact OD1-CA 3.42Å; N220-G232 PolarHBondContact OD1-O 2.78Å; N220-G232 VanDerWaalsContact OD1-O 3.12Å
221	L	89.3	Confident	90.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.5	176.8	-71.8	175.4	0	0	0	114.1	S120 A121 L124 L125 L217 V218 F295	S120-L221 PolarHBondContact OG-O 3.29Å; A121-L221 HydrophobicContact CB-CB 4.39Å; A121-L221 HydrophobicContact CB-CD2 4.23Å; A121-L221 PolarHBondContact N-O 3.04Å; A121-L221 VanDerWaalsContact N-O 3.14Å; L124-L221 HydrophobicContact CB-CD2 3.73Å; L124-L221 HydrophobicContact CD1-CD2 4.05Å; L125-L221 HydrophobicContact CD1-CD2 4.22Å; L125-L221 HydrophobicContact CD2-CD2 3.99Å; L125-L221 HydrophobicContact CG-CD2 3.73Å; L217-L221 PolarHBondContact O-N 2.72Å; V218-L221 HydrophobicContact CB-CD1 4.33Å; V218-L221 HydrophobicContact CG1-CD1 3.98Å; V218-L221 HydrophobicContact CG2-CD1 4.41Å; V218-L221 WeakPolarHBondContact O-CB 3.32Å; V218-L221 PolarHBondContact O-N 3.32Å; L221-F295 HydrophobicContact CD1-CD2 3.68Å; L221-F295 HydrophobicContact CD1-CE2 3.2Å; L221-F295 HydrophobicContact CD1-CZ 3.77Å
222	F	85.9	Confident	91.1	Very high	114 Å²	114	61 Å²	61	50%	0.5	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	16	-179.5	-60.5	-85.3	0	0	0	112.4	W117 P118 N220 P492	W117-F222 HydrophobicContact CZ3-CE1 4.41Å; W117-F222 AromaticContact CZ3-CZ 3.97Å; W117-F222 HydrophobicContact CZ3-CZ 3.97Å; P118-F222 HydrophobicContact CG-CD1 3.61Å; P118-F222 HydrophobicContact CG-CE1 3.92Å; N220-F222 PolarHBondContact O-N 3.46Å; F222-P492 HydrophobicContact CE2-CB 4.36Å
223	S	88.4	Confident	91.3	Very high	22 Å²	22	55.4 Å²	55.4	15%	0.154	29%	0.293	C	S	.	.	S	Bend	trans	-69.7	165.6	176.3	77.6	0	0	0	0	111.8	S120 N220 L233	S120-S223 VanDerWaalsContact CB-O 3.28Å; S120-S223 WeakPolarHBondContact CB-O 3.28Å; S120-S223 PolarHBondContact OG-O 3.45Å; N220-S223 WeakPolarHBondContact O-CB 3.31Å; N220-S223 PolarHBondContact O-N 3.37Å; N220-S223 PolarHBondContact O-OG 3.04Å; N220-S223 VanDerWaalsContact O-OG 3.14Å; S223-L233 PolarHBondContact OG-N 3.22Å; S223-L233 VanDerWaalsContact OG-N 3.17Å
224	L	88.4	Confident	91.4	Very high	128 Å²	128	58.8 Å²	58.8	67%	0.67	30%	0.304	S	S	*	.			trans	-59.6	142.1	167.1	-66.2	176.2	0	0	0	110.2	L226	L224-L226 HydrophobicContact CB-CD1 4.41Å; L224-L226 HydrophobicContact CB-CG 4.38Å; L224-L226 HydrophobicContact CD1-CD1 4.44Å; L224-L226 PolarHBondContact O-N 2.98Å
225	P	89	Confident	91.6	Very high	57 Å²	57	63.9 Å²	63.9	37%	0.37	33%	0.326	S	S	.	.	S	Bend	trans	-80.6	51.3	-178.6	35.4	-37.1	0	0	0	111.5	Q119	Q119-P225 HydrophobicContact CB-CB 4.08Å; Q119-P225 HydrophobicContact CG-CB 4.17Å
226	L	91.6	Very high	91.8	Very high	107 Å²	107	61.6 Å²	61.6	56%	0.56	32%	0.316	S	S	*	.			trans	-117.6	114.8	-179.2	-64.2	175.8	0	0	0	108.6	L224 V228 S231	L224-L226 HydrophobicContact CB-CD1 4.41Å; L224-L226 HydrophobicContact CB-CG 4.38Å; L224-L226 HydrophobicContact CD1-CD1 4.44Å; L224-L226 PolarHBondContact O-N 2.98Å; L226-V228 PolarHBondContact O-N 3.45Å; L226-S231 WeakPolarHBondContact O-CB 3.47Å; L226-S231 PolarHBondContact O-OG 3.33Å
227	D	93.4	Very high	91.9	Very high	75 Å²	75	59.2 Å²	59.2	40%	0.401	31%	0.305	S	S	.	.			trans	-92.1	78.6	-177	-174.4	28.9	0	0	0	112	L233 R234	D227-L233 HydrophobicContact CB-CD2 4.09Å; D227-R234 WeakPolarHBondContact OD1-CB 3.34Å; D227-R234 IonicContact OD1-CZ 3.48Å; D227-R234 VanDerWaalsContact OD1-CZ 3.32Å; D227-R234 IonicContact OD1-NE 3.68Å; D227-R234 PolarHBondContact OD1-NE 3.31Å; D227-R234 IonicContact OD1-NH2 3.42Å; D227-R234 PolarHBondContact OD1-NH2 3.38Å; D227-R234 IonicContact OD2-CZ 2.8Å; D227-R234 IonicContact OD2-NE 3.44Å; D227-R234 IonicContact OD2-NH2 3.89Å; D227-R234 PolarHBondContact OD2-NH2 2.87Å
228	V	94.1	Very high	92	Very high	58 Å²	58	66.5 Å²	66.5	35%	0.352	33%	0.333	S	S	.	.			trans	-121.4	157.8	176.8	-62.5	0	0	0	0	111.3	L226 F230 S231 R234	L226-V228 PolarHBondContact O-N 3.45Å; V228-F230 HydrophobicContact CB-CZ 4.47Å; V228-F230 HydrophobicContact CG2-CD2 4.15Å; V228-F230 HydrophobicContact CG2-CE1 4.45Å; V228-F230 HydrophobicContact CG2-CE2 3.74Å; V228-F230 HydrophobicContact CG2-CZ 3.91Å; V228-F230 PolarHBondContact O-N 2.8Å; V228-S231 PolarHBondContact N-OG 3.24Å; V228-S231 VanDerWaalsContact O-CB 3.31Å; V228-S231 WeakPolarHBondContact O-CB 3.45Å; V228-S231 PolarHBondContact O-N 3.14Å; V228-S231 PolarHBondContact O-OG 3.33Å; V228-R234 WeakPolarHBondContact O-CB 3.48Å
229	P	90	Very high	92.3	Very high	94 Å²	94	65.9 Å²	65.9	61%	0.61	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.8	-167.6	-31.2	37	0	0	0	116.8
230	F	90.6	Very high	92.6	Very high	169 Å²	169	62 Å²	62	74%	0.741	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	0.1	-179.1	47.7	-95.4	0	0	0	113.6	V228	V228-F230 HydrophobicContact CB-CZ 4.47Å; V228-F230 HydrophobicContact CG2-CD2 4.15Å; V228-F230 HydrophobicContact CG2-CE1 4.45Å; V228-F230 HydrophobicContact CG2-CE2 3.74Å; V228-F230 HydrophobicContact CG2-CZ 3.91Å; V228-F230 PolarHBondContact O-N 2.8Å
231	S	93.6	Very high	92.7	Very high	14 Å²	14	64.1 Å²	64.1	10%	0.098	32%	0.32	C	S	.	.	S	Bend	trans	-69	152.4	179.8	65.5	0	0	0	0	112.4	L226 V228 L233 R234 K235	L226-S231 WeakPolarHBondContact O-CB 3.47Å; L226-S231 PolarHBondContact O-OG 3.33Å; V228-S231 PolarHBondContact N-OG 3.24Å; V228-S231 VanDerWaalsContact O-CB 3.31Å; V228-S231 WeakPolarHBondContact O-CB 3.45Å; V228-S231 PolarHBondContact O-N 3.14Å; V228-S231 PolarHBondContact O-OG 3.33Å; S231-L233 VanDerWaalsContact C-N 3.26Å; S231-L233 PolarHBondContact O-N 2.9Å; S231-R234 PolarHBondContact O-N 3.46Å; S231-R234 VanDerWaalsContact OG-CB 3.28Å; S231-R234 WeakPolarHBondContact OG-CB 3.22Å; S231-R234 PolarHBondContact OG-N 2.96Å; S231-K235 PolarHBondContact O-N 2.87Å
232	G	93.9	Very high	92.8	Very high	21 Å²	21	67.8 Å²	67.8	22%	0.216	34%	0.337	C	S	.	.	H	α-helix	trans	-58.7	-39.6	169	0	0	0	0	0	112.3	N220 R234 K235 G236	N220-G232 VanDerWaalsContact CB-O 3.23Å; N220-G232 WeakPolarHBondContact CB-O 3.37Å; N220-G232 VanDerWaalsContact OD1-C 3.3Å; N220-G232 WeakPolarHBondContact OD1-CA 3.42Å; N220-G232 PolarHBondContact OD1-O 2.78Å; N220-G232 VanDerWaalsContact OD1-O 3.12Å; G232-R234 PolarHBondContact O-N 3.1Å; G232-K235 WeakPolarHBondContact O-CB 3.37Å; G232-K235 PolarHBondContact O-N 2.69Å; G232-K235 VanDerWaalsContact O-N 3.16Å; G232-G236 PolarHBondContact O-N 2.96Å
233	L	94.9	Very high	93.1	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-45.9	179.5	-177.2	63	0	0	0	111.7	I123 L124 S223 D227 S231 K235 G236 I237	I123-L233 HydrophobicContact CB-CD1 4.23Å; I123-L233 HydrophobicContact CD1-CD1 4.38Å; I123-L233 HydrophobicContact CD1-CD2 3.96Å; I123-L233 HydrophobicContact CG2-CD1 4Å; L124-L233 HydrophobicContact CD1-CD1 4.29Å; L124-L233 HydrophobicContact CD2-CD1 4.08Å; L124-L233 HydrophobicContact CG-CD1 3.96Å; S223-L233 PolarHBondContact OG-N 3.22Å; S223-L233 VanDerWaalsContact OG-N 3.17Å; D227-L233 HydrophobicContact CB-CD2 4.09Å; S231-L233 VanDerWaalsContact C-N 3.26Å; S231-L233 PolarHBondContact O-N 2.9Å; L233-K235 VanDerWaalsContact C-N 3.33Å; L233-K235 PolarHBondContact O-N 2.95Å; L233-G236 PolarHBondContact O-N 2.96Å; L233-I237 HydrophobicContact CD1-CD1 4.34Å; L233-I237 HydrophobicContact CD1-CG1 4.42Å; L233-I237 HydrophobicContact CD2-CD1 4.5Å; L233-I237 HydrophobicContact CG-CD1 3.93Å; L233-I237 HydrophobicContact CG-CG1 4.44Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 2.95Å
234	R	95.8	Very high	93.3	Very high	82 Å²	82	62.2 Å²	62.2	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-40.8	176.3	179.7	60.9	64.3	132.5	-0	112	D227 V228 S231 G232 G236 I237 R238	D227-R234 WeakPolarHBondContact OD1-CB 3.34Å; D227-R234 IonicContact OD1-CZ 3.48Å; D227-R234 VanDerWaalsContact OD1-CZ 3.32Å; D227-R234 IonicContact OD1-NE 3.68Å; D227-R234 PolarHBondContact OD1-NE 3.31Å; D227-R234 IonicContact OD1-NH2 3.42Å; D227-R234 PolarHBondContact OD1-NH2 3.38Å; D227-R234 IonicContact OD2-CZ 2.8Å; D227-R234 IonicContact OD2-NE 3.44Å; D227-R234 IonicContact OD2-NH2 3.89Å; D227-R234 PolarHBondContact OD2-NH2 2.87Å; V228-R234 WeakPolarHBondContact O-CB 3.48Å; S231-R234 PolarHBondContact O-N 3.46Å; S231-R234 VanDerWaalsContact OG-CB 3.28Å; S231-R234 WeakPolarHBondContact OG-CB 3.22Å; S231-R234 PolarHBondContact OG-N 2.96Å; G232-R234 PolarHBondContact O-N 3.1Å; R234-G236 VanDerWaalsContact C-N 3.33Å; R234-I237 PolarHBondContact O-N 3.25Å; R234-R238 WeakPolarHBondContact O-CG 3.18Å; R234-R238 PolarHBondContact O-N 2.91Å
235	K	95.6	Very high	93.3	Very high	107 Å²	107	62.2 Å²	62.2	47%	0.465	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-41.6	175	-70.5	-178.9	-177.7	-176.6	0	111.6	Q216 S231 G232 L233 A239	Q216-K235 PolarHBondContact NE2-O 3.03Å; S231-K235 PolarHBondContact O-N 2.87Å; G232-K235 WeakPolarHBondContact O-CB 3.37Å; G232-K235 PolarHBondContact O-N 2.69Å; G232-K235 VanDerWaalsContact O-N 3.16Å; L233-K235 VanDerWaalsContact C-N 3.33Å; L233-K235 PolarHBondContact O-N 2.95Å; K235-A239 PolarHBondContact O-N 3.27Å; K235-A239 VanDerWaalsContact O-N 3.15Å
236	G	95.9	Very high	93.1	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-42.7	175	0	0	0	0	0	112.5	L217 G232 L233 R234 R238 A239 R240	L217-G236 WeakPolarHBondContact CD1-O 3.45Å; G232-G236 PolarHBondContact O-N 2.96Å; L233-G236 PolarHBondContact O-N 2.96Å; R234-G236 VanDerWaalsContact C-N 3.33Å; G236-R238 PolarHBondContact O-N 2.95Å; G236-A239 PolarHBondContact O-N 2.96Å; G236-R240 PolarHBondContact O-N 2.83Å
237	I	95.4	Very high	93	Very high	24 Å²	24	57 Å²	57	12%	0.123	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-46.5	178.2	-72.1	167.3	0	0	0	110.1	I123 L124 L233 R234 A239 R240 D241	I123-I237 HydrophobicContact CG2-CD1 4.25Å; I123-I237 HydrophobicContact CG2-CG1 4.33Å; L124-I237 HydrophobicContact CD2-CG1 3.85Å; L124-I237 VanDerWaalsContact CD2-N 3.29Å; L233-I237 HydrophobicContact CD1-CD1 4.34Å; L233-I237 HydrophobicContact CD1-CG1 4.42Å; L233-I237 HydrophobicContact CD2-CD1 4.5Å; L233-I237 HydrophobicContact CG-CD1 3.93Å; L233-I237 HydrophobicContact CG-CG1 4.44Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 2.95Å; R234-I237 PolarHBondContact O-N 3.25Å; I237-A239 VanDerWaalsContact C-N 3.33Å; I237-A239 PolarHBondContact O-N 3.31Å; I237-R240 WeakPolarHBondContact O-CB 3.37Å; I237-R240 PolarHBondContact O-N 3.43Å; I237-D241 PolarHBondContact O-N 3.14Å
238	R	95.4	Very high	92.8	Very high	154 Å²	154	56.5 Å²	56.5	58%	0.581	27%	0.27	S	S	*	.	H	α-helix	trans	-58.9	-44.1	176	-72.7	179.9	178.5	177.3	0.6	112.3	R234 G236 D241 Q242	R234-R238 WeakPolarHBondContact O-CG 3.18Å; R234-R238 PolarHBondContact O-N 2.91Å; G236-R238 PolarHBondContact O-N 2.95Å; R238-D241 PolarHBondContact O-N 2.92Å; R238-Q242 WeakPolarHBondContact O-CB 3.38Å; R238-Q242 PolarHBondContact O-N 3.05Å
239	A	95.5	Very high	92.1	Very high	1 Å²	1	60 Å²	60	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-42.4	177	0	0	0	0	0	112.2	T213 Q216 L217 K235 G236 I237 Q242 L243	T213-A239 HydrophobicContact CG2-CB 4.04Å; T213-A239 WeakPolarHBondContact CG2-O 3.12Å; T213-A239 WeakPolarHBondContact O-CB 3.34Å; Q216-A239 HydrophobicContact CB-CB 4.19Å; Q216-A239 HydrophobicContact CG-CB 4.14Å; L217-A239 HydrophobicContact CB-CB 4.04Å; K235-A239 PolarHBondContact O-N 3.27Å; K235-A239 VanDerWaalsContact O-N 3.15Å; G236-A239 PolarHBondContact O-N 2.96Å; I237-A239 VanDerWaalsContact C-N 3.33Å; I237-A239 PolarHBondContact O-N 3.31Å; A239-Q242 PolarHBondContact O-N 3.07Å; A239-L243 WeakPolarHBondContact O-CD1 3.39Å; A239-L243 VanDerWaalsContact O-CG 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.23Å; A239-L243 PolarHBondContact O-N 3.47Å
240	R	95.2	Very high	91.8	Very high	50 Å²	50	56.1 Å²	56.1	19%	0.189	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-48.4	173.8	-177.1	-161.2	66.8	-171.7	0.5	111.4	I123 L124 L217 G236 I237 Q242 L243 Y244	I123-R240 PolarHBondContact O-NH1 3.27Å; L124-R240 WeakPolarHBondContact O-CD 3.14Å; L217-R240 HydrophobicContact CD1-CB 3.83Å; G236-R240 PolarHBondContact O-N 2.83Å; I237-R240 WeakPolarHBondContact O-CB 3.37Å; I237-R240 PolarHBondContact O-N 3.43Å; R240-Q242 VanDerWaalsContact C-N 3.31Å; R240-Q242 PolarHBondContact O-N 3.04Å; R240-L243 WeakPolarHBondContact O-CB 3.37Å; R240-L243 PolarHBondContact O-N 2.81Å; R240-L243 VanDerWaalsContact O-N 3.17Å; R240-Y244 HydrophobicContact CG-CD1 4.38Å; R240-Y244 HydrophobicContact CG-CD2 4.32Å; R240-Y244 HydrophobicContact CG-CE1 3.97Å; R240-Y244 HydrophobicContact CG-CE2 3.87Å; R240-Y244 PolarHBondContact O-N 2.89Å
241	D	93.8	Very high	91.6	Very high	65 Å²	65	48.1 Å²	48.1	35%	0.348	22%	0.223	S	C	.	.	H	α-helix	trans	-65.5	-38.1	-176.3	-63.3	-14.6	0	0	0	110.9	I237 R238 Y244 Q245	I237-D241 PolarHBondContact O-N 3.14Å; R238-D241 PolarHBondContact O-N 2.92Å; D241-Y244 PolarHBondContact O-N 3.46Å; D241-Q245 WeakPolarHBondContact O-CG 3.38Å; D241-Q245 PolarHBondContact O-N 2.9Å
242	Q	92.4	Very high	91.3	Very high	78 Å²	78	49.6 Å²	49.6	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-45.2	171.4	-175.1	175.5	0.1	0	0	111.7	T213 R238 A239 R240 Y244 Q245 Y246	T213-Q242 HydrophobicContact CG2-CB 4Å; T213-Q242 HydrophobicContact CG2-CG 4.05Å; R238-Q242 WeakPolarHBondContact O-CB 3.38Å; R238-Q242 PolarHBondContact O-N 3.05Å; A239-Q242 PolarHBondContact O-N 3.07Å; R240-Q242 VanDerWaalsContact C-N 3.31Å; R240-Q242 PolarHBondContact O-N 3.04Å; Q242-Y244 VanDerWaalsContact C-N 3.29Å; Q242-Y244 PolarHBondContact O-N 3.08Å; Q242-Q245 WeakPolarHBondContact O-CB 3.39Å; Q242-Q245 PolarHBondContact O-N 3.18Å; Q242-Y246 HydrophobicContact CG-CE2 4.06Å; Q242-Y246 VanDerWaalsContact O-CD2 3.23Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.42Å
243	L	91.8	Very high	90.7	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-58.5	-40.7	174.8	-74.1	158.8	0	0	0	112	L210 T213 F214 L217 A239 R240 Q245 Y246 L247	L210-L243 HydrophobicContact CD1-CD2 3.52Å; L210-L243 HydrophobicContact CD1-CG 4.44Å; L210-L243 HydrophobicContact CG-CD2 3.78Å; T213-L243 HydrophobicContact CG2-CG 4Å; F214-L243 HydrophobicContact CB-CD2 4.29Å; F214-L243 HydrophobicContact CD2-CD1 3.72Å; F214-L243 HydrophobicContact CD2-CD2 4.07Å; F214-L243 HydrophobicContact CE2-CD1 4.44Å; L217-L243 HydrophobicContact CB-CD1 4.17Å; L217-L243 HydrophobicContact CD2-CD1 3.61Å; L217-L243 HydrophobicContact CG-CD1 4.47Å; A239-L243 WeakPolarHBondContact O-CD1 3.39Å; A239-L243 VanDerWaalsContact O-CG 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.23Å; A239-L243 PolarHBondContact O-N 3.47Å; R240-L243 WeakPolarHBondContact O-CB 3.37Å; R240-L243 PolarHBondContact O-N 2.81Å; R240-L243 VanDerWaalsContact O-N 3.17Å; L243-Q245 VanDerWaalsContact C-N 3.29Å; L243-Q245 PolarHBondContact O-N 2.91Å; L243-Y246 PolarHBondContact O-N 3.17Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 3.17Å; L243-L247 VanDerWaalsContact O-N 3.12Å
244	Y	92.6	Very high	90	Very high	16 Å²	16	54.5 Å²	54.5	6%	0.063	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-34.6	178.9	-75.8	-4.1	0	0	0	113	R240 D241 Q242 Y246 L247 D248 K287 E288 V291	R240-Y244 HydrophobicContact CG-CD1 4.38Å; R240-Y244 HydrophobicContact CG-CD2 4.32Å; R240-Y244 HydrophobicContact CG-CE1 3.97Å; R240-Y244 HydrophobicContact CG-CE2 3.87Å; R240-Y244 PolarHBondContact O-N 2.89Å; D241-Y244 PolarHBondContact O-N 3.46Å; Q242-Y244 VanDerWaalsContact C-N 3.29Å; Q242-Y244 PolarHBondContact O-N 3.08Å; Y244-Y246 PolarHBondContact O-N 3.29Å; Y244-L247 HydrophobicContact CD1-CD1 4.26Å; Y244-L247 PolarHBondContact O-N 3.42Å; Y244-D248 PolarHBondContact O-N 3.16Å; Y244-K287 HydrophobicContact CD1-CB 3.93Å; Y244-K287 HydrophobicContact CD1-CD 4.12Å; Y244-K287 HydrophobicContact CD1-CG 4.31Å; Y244-K287 HydrophobicContact CD2-CD 4.2Å; Y244-K287 HydrophobicContact CE1-CB 3.81Å; Y244-K287 HydrophobicContact CG-CD 3.89Å; Y244-E288 WeakPolarHBondContact OH-CG 3.34Å; Y244-V291 HydrophobicContact CD1-CG2 4.2Å; Y244-V291 HydrophobicContact CE1-CG2 3.74Å
245	Q	88.8	Confident	89.4	Confident	127 Å²	127	53.1 Å²	53.1	59%	0.593	25%	0.251	S	S	*	.	H	α-helix	trans	-62	-42.3	175.8	-69	171.1	-10.2	0	0	111.8	D241 Q242 L243 L247 D248	D241-Q245 WeakPolarHBondContact O-CG 3.38Å; D241-Q245 PolarHBondContact O-N 2.9Å; Q242-Q245 WeakPolarHBondContact O-CB 3.39Å; Q242-Q245 PolarHBondContact O-N 3.18Å; L243-Q245 VanDerWaalsContact C-N 3.29Å; L243-Q245 PolarHBondContact O-N 2.91Å; Q245-L247 VanDerWaalsContact C-N 3.31Å; Q245-L247 PolarHBondContact O-N 2.92Å; Q245-D248 PolarHBondContact O-N 2.91Å
246	Y	85	Confident	88.6	Confident	52 Å²	52	55.8 Å²	55.8	20%	0.204	27%	0.265	C	S	.	.	H	α-helix	trans	-68.6	-32	175.2	-69.8	-85.3	0	0	0	112.6	L210 Q242 L243 Y244	L210-Y246 HydrophobicContact CD1-CD2 3.34Å; L210-Y246 HydrophobicContact CD1-CE2 3.75Å; L210-Y246 HydrophobicContact CD1-CG 3.79Å; Q242-Y246 HydrophobicContact CG-CE2 4.06Å; Q242-Y246 VanDerWaalsContact O-CD2 3.23Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.42Å; L243-Y246 PolarHBondContact O-N 3.17Å; Y244-Y246 PolarHBondContact O-N 3.29Å
247	L	89.2	Confident	87.4	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-75.2	-28.5	178.6	-67.6	173.8	0	0	0	112.4	L198 L200 L243 Y244 Q245 A250 I251 K287 A290 V291	L198-L247 HydrophobicContact CD1-CD2 3.96Å; L200-L247 HydrophobicContact CD1-CD2 4.36Å; L200-L247 HydrophobicContact CD2-CD2 4.38Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 3.17Å; L243-L247 VanDerWaalsContact O-N 3.12Å; Y244-L247 HydrophobicContact CD1-CD1 4.26Å; Y244-L247 PolarHBondContact O-N 3.42Å; Q245-L247 VanDerWaalsContact C-N 3.31Å; Q245-L247 PolarHBondContact O-N 2.92Å; L247-A250 PolarHBondContact O-N 2.9Å; L247-I251 HydrophobicContact CB-CD1 4.12Å; L247-I251 VanDerWaalsContact O-CB 3.29Å; L247-I251 WeakPolarHBondContact O-CB 3.26Å; L247-I251 WeakPolarHBondContact O-CD1 3.41Å; L247-I251 WeakPolarHBondContact O-CG1 3.34Å; L247-I251 PolarHBondContact O-N 2.86Å; L247-K287 HydrophobicContact CB-CG 4.22Å; L247-A290 HydrophobicContact CD1-CB 3.98Å; L247-A290 HydrophobicContact CD2-CB 3.94Å; L247-V291 HydrophobicContact CD1-CG2 3.8Å
248	D	88.9	Confident	85.5	Confident	64 Å²	64	64.5 Å²	64.5	34%	0.342	31%	0.305	S	S	.	.	H	α-helix	trans	-56.2	-53	177.3	-86.8	-46.7	0	0	0	111.8	Y244 Q245 A250 I251 A252 K287	Y244-D248 PolarHBondContact O-N 3.16Å; Q245-D248 PolarHBondContact O-N 2.91Å; D248-A250 VanDerWaalsContact C-N 3.34Å; D248-A250 PolarHBondContact O-N 3.12Å; D248-I251 PolarHBondContact O-N 2.75Å; D248-A252 VanDerWaalsContact O-CB 3.27Å; D248-A252 WeakPolarHBondContact O-CB 3.38Å; D248-A252 PolarHBondContact O-N 3.32Å; D248-K287 WeakPolarHBondContact OD1-CE 3.24Å; D248-K287 IonicContact OD1-NZ 2.99Å; D248-K287 PolarHBondContact OD1-NZ 3.46Å; D248-K287 WeakPolarHBondContact OD2-CE 3.36Å; D248-K287 IonicContact OD2-NZ 3.69Å; D248-K287 PolarHBondContact OD2-NZ 3.04Å
249	E	80.9	Confident	83.4	Confident	131 Å²	131	66.1 Å²	66.1	61%	0.612	32%	0.32	S	S	*	.	H	α-helix	trans	-59.1	-46	-179.9	-65.1	176.8	177.5	0	0	111.4	A252 Q253	E249-A252 PolarHBondContact O-N 3.34Å; E249-Q253 PolarHBondContact O-N 2.82Å
250	A	82.1	Confident	81.2	Confident	13 Å²	13	68.6 Å²	68.6	11%	0.107	34%	0.34	C	S	.	.	H	α-helix	trans	-69.6	-37.8	-178.1	0	0	0	0	0	113.3	L200 L247 D248 K254	L200-A250 HydrophobicContact CD2-CB 3.2Å; L247-A250 PolarHBondContact O-N 2.9Å; D248-A250 VanDerWaalsContact C-N 3.34Å; D248-A250 PolarHBondContact O-N 3.12Å; A250-K254 WeakPolarHBondContact O-CD 3.47Å; A250-K254 VanDerWaalsContact O-CG 3.26Å; A250-K254 WeakPolarHBondContact O-CG 3.38Å; A250-K254 PolarHBondContact O-N 3Å
251	I	87.9	Confident	78.9	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	37%	0.372	C	S	.	.	H	α-helix	trans	-69.3	-44.1	176	-71.3	163.4	0	0	0	109.8	L247 D248 Q253 K254 L255 L267 V283 L286 K287	L247-I251 HydrophobicContact CB-CD1 4.12Å; L247-I251 VanDerWaalsContact O-CB 3.29Å; L247-I251 WeakPolarHBondContact O-CB 3.26Å; L247-I251 WeakPolarHBondContact O-CD1 3.41Å; L247-I251 WeakPolarHBondContact O-CG1 3.34Å; L247-I251 PolarHBondContact O-N 2.86Å; D248-I251 PolarHBondContact O-N 2.75Å; I251-Q253 VanDerWaalsContact C-N 3.34Å; I251-Q253 PolarHBondContact O-N 3.37Å; I251-K254 PolarHBondContact O-N 3.14Å; I251-L255 HydrophobicContact CG2-CD1 3.74Å; I251-L255 HydrophobicContact CG2-CG 4.19Å; I251-L255 WeakPolarHBondContact O-CG 3.2Å; I251-L255 PolarHBondContact O-N 2.81Å; I251-L267 HydrophobicContact CG1-CD2 3.82Å; I251-V283 HydrophobicContact CG2-CG1 4.26Å; I251-L286 HydrophobicContact CD1-CB 3.86Å; I251-L286 HydrophobicContact CG1-CB 4.28Å; I251-L286 HydrophobicContact CG2-CB 4.31Å; I251-L286 HydrophobicContact CG2-CD1 3.77Å; I251-K287 HydrophobicContact CD1-CB 4.35Å; I251-K287 HydrophobicContact CD1-CG 3.55Å
252	A	85.9	Confident	76.9	Confident	44 Å²	44	74.7 Å²	74.7	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-57.9	-46.9	178.5	0	0	0	0	0	111.3	D248 E249 K254 L255 H256	D248-A252 VanDerWaalsContact O-CB 3.27Å; D248-A252 WeakPolarHBondContact O-CB 3.38Å; D248-A252 PolarHBondContact O-N 3.32Å; E249-A252 PolarHBondContact O-N 3.34Å; A252-K254 VanDerWaalsContact C-N 3.35Å; A252-K254 PolarHBondContact O-N 3.38Å; A252-L255 PolarHBondContact O-N 3.41Å; A252-H256 PolarHBondContact O-N 3.04Å; A252-H256 PolarHBondContact O-ND1 3.32Å
253	Q	81.3	Confident	75.3	Confident	110 Å²	110	72.7 Å²	72.7	51%	0.514	38%	0.38	S	S	.	.	H	α-helix	trans	-57.1	-47.5	175.8	-177.1	177.8	-2	0	0	111.8	E249 I251 L255 H256 E257	E249-Q253 PolarHBondContact O-N 2.82Å; I251-Q253 VanDerWaalsContact C-N 3.34Å; I251-Q253 PolarHBondContact O-N 3.37Å; Q253-L255 VanDerWaalsContact C-N 3.34Å; Q253-L255 PolarHBondContact O-N 2.9Å; Q253-H256 PolarHBondContact O-N 3Å; Q253-E257 HydrophobicContact CG-CG 4.45Å; Q253-E257 VanDerWaalsContact CG-OE1 3.26Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.4Å; Q253-E257 PolarHBondContact NE2-OE1 3.44Å; Q253-E257 WeakPolarHBondContact O-CG 2.91Å; Q253-E257 PolarHBondContact O-N 3.34Å; Q253-E257 VanDerWaalsContact O-N 3.11Å
254	K	81.2	Confident	74.3	Confident	18 Å²	18	73.4 Å²	73.4	8%	0.078	39%	0.389	C	S	.	.	H	α-helix	trans	-65.8	-33	-178.5	-73.5	171.3	-177.4	-62.8	0	114.2	L198 A250 I251 A252 H256 D265 L267 I271	L198-K254 WeakPolarHBondContact O-CE 3.16Å; L198-K254 PolarHBondContact O-NZ 3.36Å; A250-K254 WeakPolarHBondContact O-CD 3.47Å; A250-K254 VanDerWaalsContact O-CG 3.26Å; A250-K254 WeakPolarHBondContact O-CG 3.38Å; A250-K254 PolarHBondContact O-N 3Å; I251-K254 PolarHBondContact O-N 3.14Å; A252-K254 VanDerWaalsContact C-N 3.35Å; A252-K254 PolarHBondContact O-N 3.38Å; K254-H256 VanDerWaalsContact C-N 3.33Å; K254-D265 IonicContact NZ-OD1 3.93Å; K254-D265 PolarHBondContact NZ-OD1 2.74Å; K254-D265 IonicContact NZ-OD2 3.76Å; K254-D265 PolarHBondContact NZ-OD2 2.82Å; K254-L267 HydrophobicContact CD-CB 4.05Å; K254-L267 HydrophobicContact CD-CD2 3.51Å; K254-L267 HydrophobicContact CD-CG 3.81Å; K254-I271 HydrophobicContact CB-CD1 4.28Å
255	L	82.6	Confident	73.9	Confident	54 Å²	54	73.4 Å²	73.4	28%	0.283	39%	0.39	S	S	.	.	H	α-helix	trans	-72.4	-27.8	176.9	-70.7	173.1	0	0	0	112	I251 A252 Q253 E258 I271 V283 L286	I251-L255 HydrophobicContact CG2-CD1 3.74Å; I251-L255 HydrophobicContact CG2-CG 4.19Å; I251-L255 WeakPolarHBondContact O-CG 3.2Å; I251-L255 PolarHBondContact O-N 2.81Å; A252-L255 PolarHBondContact O-N 3.41Å; Q253-L255 VanDerWaalsContact C-N 3.34Å; Q253-L255 PolarHBondContact O-N 2.9Å; L255-E258 VanDerWaalsContact O-CG 3.27Å; L255-E258 WeakPolarHBondContact O-CG 3.33Å; L255-I271 HydrophobicContact CD2-CD1 4.15Å; L255-V283 HydrophobicContact CD1-CG2 4.18Å; L255-L286 HydrophobicContact CD1-CD1 4.42Å; L255-L286 HydrophobicContact CD2-CD1 4.18Å
256	H	78.2	Confident	73.9	Confident	162 Å²	162	67.4 Å²	67.4	75%	0.75	36%	0.361	S	S	*	.	H	α-helix	trans	-83.2	-27.6	176.6	-72.6	76.7	0	0	0	113	A252 Q253 K254 E258	A252-H256 PolarHBondContact O-N 3.04Å; A252-H256 PolarHBondContact O-ND1 3.32Å; Q253-H256 PolarHBondContact O-N 3Å; K254-H256 VanDerWaalsContact C-N 3.33Å; H256-E258 PolarHBondContact O-N 3.06Å
257	E	70.9	Confident	74	Confident	81 Å²	81	64.9 Å²	64.9	38%	0.379	35%	0.352	S	S	.	.			trans	-76.2	41.7	179.4	-71.7	174.8	-179.4	0	0	113.3	Q253 Q259 A260	Q253-E257 HydrophobicContact CG-CG 4.45Å; Q253-E257 VanDerWaalsContact CG-OE1 3.26Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.4Å; Q253-E257 PolarHBondContact NE2-OE1 3.44Å; Q253-E257 WeakPolarHBondContact O-CG 2.91Å; Q253-E257 PolarHBondContact O-N 3.34Å; Q253-E257 VanDerWaalsContact O-N 3.11Å; E257-Q259 PolarHBondContact O-N 3.03Å; E257-A260 PolarHBondContact O-N 2.65Å
258	E	56	Low	74	Confident	127 Å²	127	65.4 Å²	65.4	59%	0.593	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-8.6	-170.2	-65.9	-158.4	124.8	0	0	115.7	L255 H256 R275	L255-E258 VanDerWaalsContact O-CG 3.27Å; L255-E258 WeakPolarHBondContact O-CG 3.33Å; H256-E258 PolarHBondContact O-N 3.06Å; E258-R275 IonicContact OE1-CZ 3.58Å; E258-R275 IonicContact OE1-NH1 2.71Å; E258-R275 IonicContact OE1-NH2 3.57Å; E258-R275 PolarHBondContact OE1-NH2 3.41Å
259	Q	50.7	Low	74	Confident	188 Å²	188	63.5 Å²	63.5	88%	0.879	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.2	28.1	-173.6	-72.5	164.8	-13.4	0	0	114.2	E257 A261	E257-Q259 PolarHBondContact O-N 3.03Å; Q259-A261 PolarHBondContact O-N 3.24Å
260	A	50.3	Low	74.5	Confident	52 Å²	52	57.3 Å²	57.3	43%	0.43	32%	0.315	S	S	.	.			trans	-65.3	120.5	163.4	0	0	0	0	0	108.9	E257 E262	E257-A260 PolarHBondContact O-N 2.65Å; A260-E262 PolarHBondContact O-N 3.2Å
261	A	46.2	Very low	74.9	Confident	106 Å²	106	57.2 Å²	57.2	88%	0.876	31%	0.312	S	S	*	.	S	Bend	trans	-55.3	-18.1	-167.7	0	0	0	0	0	115.3	Q259	Q259-A261 PolarHBondContact O-N 3.24Å
262	E	51.8	Low	74.9	Confident	138 Å²	138	59.2 Å²	59.2	65%	0.645	32%	0.323	S	S	*	.	S	Bend	trans	-153.4	134.4	165.1	-68.8	-163.8	159.6	0	0	114.7	R156 A260 G264	R156-E262 VanDerWaalsContact NH1-CB 3.34Å; R156-E262 IonicContact NH1-OE2 3.58Å; R156-E262 PolarHBondContact NH1-OE2 3.09Å; R156-E262 PolarHBondContact NH2-O 2.91Å; A260-E262 PolarHBondContact O-N 3.2Å; E262-G264 PolarHBondContact O-N 2.9Å
263	P	58.3	Low	75.2	Confident	35 Å²	35	57.5 Å²	57.5	23%	0.227	31%	0.308	C	S	.	.			trans	-58	115	177.1	-24.5	34.3	0	0	0	113.9	R156 H268 L269 N272	R156-P263 PolarHBondContact NH1-O 2.9Å; P263-H268 HydrophobicContact CB-CB 4.09Å; P263-H268 WeakPolarHBondContact CB-CD2 3.45Å; P263-H268 WeakPolarHBondContact CG-CD2 3.4Å; P263-L269 HydrophobicContact CB-CD2 3.81Å; P263-L269 HydrophobicContact CB-CG 4.16Å; P263-L269 HydrophobicContact CG-CD2 4.3Å; P263-N272 WeakPolarHBondContact CG-ND2 3.15Å
264	G	70.9	Confident	75.6	Confident	19 Å²	19	52.3 Å²	52.3	20%	0.196	28%	0.284	C	S	.	.			trans	-81.9	-20.1	-177.9	0	0	0	0	0	117.1	R156 R160 E262	R156-G264 VanDerWaalsContact CZ-CA 3.42Å; R156-G264 VanDerWaalsContact NH2-CA 3.32Å; R160-G264 PolarHBondContact NH1-O 2.86Å; E262-G264 PolarHBondContact O-N 2.9Å
265	D	85.6	Confident	76	Confident	16 Å²	16	56.1 Å²	56.1	9%	0.086	30%	0.298	C	S	.	.	S	Bend	trans	-145.2	168.2	-167.6	58.6	55.7	0	0	0	112.8	I196 L197 G199 K254 L267 H268 L269	I196-D265 WeakPolarHBondContact O-CB 3.48Å; L197-D265 WeakPolarHBondContact O-CB 3.4Å; G199-D265 WeakPolarHBondContact CA-OD2 3.33Å; K254-D265 IonicContact NZ-OD1 3.93Å; K254-D265 PolarHBondContact NZ-OD1 2.74Å; K254-D265 IonicContact NZ-OD2 3.76Å; K254-D265 PolarHBondContact NZ-OD2 2.82Å; D265-L267 VanDerWaalsContact C-N 3.33Å; D265-L267 PolarHBondContact O-N 3.3Å; D265-L267 PolarHBondContact OD1-N 3.48Å; D265-H268 PolarHBondContact O-N 3.37Å; D265-H268 PolarHBondContact OD1-N 3.41Å; D265-H268 VanDerWaalsContact OD1-N 3.12Å; D265-L269 WeakPolarHBondContact O-CG 3.3Å; D265-L269 PolarHBondContact O-N 2.93Å; D265-L269 VanDerWaalsContact O-N 3.15Å
266	A	87.6	Confident	76.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-38	-174.3	0	0	0	0	0	112.9	V148 L197 L269 I270 L293	V148-A266 HydrophobicContact CB-CB 4.26Å; V148-A266 HydrophobicContact CG1-CB 3.32Å; V148-A266 HydrophobicContact CG2-CB 3.93Å; L197-A266 HydrophobicContact CB-CB 3.97Å; L197-A266 HydrophobicContact CD2-CB 4.48Å; L197-A266 WeakPolarHBondContact O-CA 3.03Å; L197-A266 WeakPolarHBondContact O-CB 3.19Å; L197-A266 PolarHBondContact O-N 3.48Å; A266-L269 WeakPolarHBondContact O-CB 3.49Å; A266-L269 PolarHBondContact O-N 2.95Å; A266-I270 VanDerWaalsContact O-CG1 3.27Å; A266-I270 WeakPolarHBondContact O-CG1 3.45Å; A266-I270 PolarHBondContact O-N 3.04Å; A266-L293 HydrophobicContact CB-CD1 3.88Å
267	L	87.4	Confident	76.9	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-41	-176.5	-173.5	56.8	0	0	0	111.3	L197 I251 K254 D265 I270 I271 L286	L197-L267 PolarHBondContact O-N 3.11Å; I251-L267 HydrophobicContact CG1-CD2 3.82Å; K254-L267 HydrophobicContact CD-CB 4.05Å; K254-L267 HydrophobicContact CD-CD2 3.51Å; K254-L267 HydrophobicContact CD-CG 3.81Å; D265-L267 VanDerWaalsContact C-N 3.33Å; D265-L267 PolarHBondContact O-N 3.3Å; D265-L267 PolarHBondContact OD1-N 3.48Å; L267-I270 WeakPolarHBondContact O-CB 3.36Å; L267-I270 PolarHBondContact O-N 3.09Å; L267-I271 WeakPolarHBondContact O-CG1 3.49Å; L267-I271 PolarHBondContact O-N 3.3Å; L267-I271 VanDerWaalsContact O-N 3.1Å; L267-L286 HydrophobicContact CD1-CB 4.38Å; L267-L286 HydrophobicContact CD1-CD2 4.04Å
268	H	88.3	Confident	77.8	Confident	15 Å²	15	54.3 Å²	54.3	7%	0.069	31%	0.308	C	S	.	.	H	α-helix	trans	-66.7	-37.4	173.7	-163.2	109.3	0	0	0	111.6	P263 D265 I270 I271 N272	P263-H268 HydrophobicContact CB-CB 4.09Å; P263-H268 WeakPolarHBondContact CB-CD2 3.45Å; P263-H268 WeakPolarHBondContact CG-CD2 3.4Å; D265-H268 PolarHBondContact O-N 3.37Å; D265-H268 PolarHBondContact OD1-N 3.41Å; D265-H268 VanDerWaalsContact OD1-N 3.12Å; H268-I270 VanDerWaalsContact C-N 3.31Å; H268-I270 PolarHBondContact O-N 2.63Å; H268-I271 PolarHBondContact O-N 3.45Å; H268-N272 PolarHBondContact CD2-ND2 3.19Å; H268-N272 PolarHBondContact NE2-ND2 3.25Å; H268-N272 VanDerWaalsContact NE2-ND2 3.11Å; H268-N272 PolarHBondContact O-N 3Å
269	L	89.8	Confident	79.3	Confident	24 Å²	24	52 Å²	52	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-35.1	173.1	-69.8	172.5	0	0	0	113	V148 A153 F157 P263 D265 A266 S273	V148-L269 HydrophobicContact CG2-CB 4.21Å; A153-L269 HydrophobicContact CB-CD1 3.64Å; F157-L269 HydrophobicContact CZ-CD1 4.21Å; P263-L269 HydrophobicContact CB-CD2 3.81Å; P263-L269 HydrophobicContact CB-CG 4.16Å; P263-L269 HydrophobicContact CG-CD2 4.3Å; D265-L269 WeakPolarHBondContact O-CG 3.3Å; D265-L269 PolarHBondContact O-N 2.93Å; D265-L269 VanDerWaalsContact O-N 3.15Å; A266-L269 WeakPolarHBondContact O-CB 3.49Å; A266-L269 PolarHBondContact O-N 2.95Å; L269-S273 WeakPolarHBondContact O-CB 3.49Å; L269-S273 PolarHBondContact O-N 3.24Å
270	I	91.1	Very high	81	Confident	1 Å²	1	51 Å²	51	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-48	175.6	-72.9	168	0	0	0	110.7	V144 L145 V148 A266 L267 H268 N272 S273 A274 L281 L286 L293	V144-I270 HydrophobicContact CG1-CG2 4.06Å; L145-I270 HydrophobicContact CD2-CD1 3.51Å; L145-I270 HydrophobicContact CD2-CG1 3.86Å; V148-I270 HydrophobicContact CG2-CD1 4.04Å; V148-I270 HydrophobicContact CG2-CG1 3.56Å; A266-I270 VanDerWaalsContact O-CG1 3.27Å; A266-I270 WeakPolarHBondContact O-CG1 3.45Å; A266-I270 PolarHBondContact O-N 3.04Å; L267-I270 WeakPolarHBondContact O-CB 3.36Å; L267-I270 PolarHBondContact O-N 3.09Å; H268-I270 VanDerWaalsContact C-N 3.31Å; H268-I270 PolarHBondContact O-N 2.63Å; I270-N272 PolarHBondContact O-N 3.46Å; I270-S273 PolarHBondContact O-N 3.06Å; I270-A274 WeakPolarHBondContact O-CB 3.35Å; I270-A274 PolarHBondContact O-N 3.3Å; I270-L281 HydrophobicContact CG2-CD1 3.48Å; I270-L281 VanDerWaalsContact CG2-CD1 3.48Å; I270-L286 HydrophobicContact CG2-CD2 4.19Å; I270-L293 HydrophobicContact CD1-CD1 3.73Å
271	I	90.4	Very high	82.9	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-50.8	179	-67.5	163.9	0	0	0	110.1	K254 L255 L267 H268 A274 R275 L286	K254-I271 HydrophobicContact CB-CD1 4.28Å; L255-I271 HydrophobicContact CD2-CD1 4.15Å; L267-I271 WeakPolarHBondContact O-CG1 3.49Å; L267-I271 PolarHBondContact O-N 3.3Å; L267-I271 VanDerWaalsContact O-N 3.1Å; H268-I271 PolarHBondContact O-N 3.45Å; I271-A274 PolarHBondContact O-N 3.23Å; I271-R275 WeakPolarHBondContact O-CG 3.49Å; I271-R275 PolarHBondContact O-N 3.19Å; I271-L286 HydrophobicContact CD1-CD1 4.23Å; I271-L286 HydrophobicContact CD1-CD2 4.35Å; I271-L286 HydrophobicContact CG1-CD1 4.1Å; I271-L286 HydrophobicContact CG1-CD2 3.61Å
272	N	89.3	Confident	85.1	Confident	43 Å²	43	48 Å²	48	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-41.9	-178.5	-69.1	-4.3	0	0	0	112	P263 H268 I270 A274 R275 E276	P263-N272 WeakPolarHBondContact CG-ND2 3.15Å; H268-N272 PolarHBondContact CD2-ND2 3.19Å; H268-N272 PolarHBondContact NE2-ND2 3.25Å; H268-N272 VanDerWaalsContact NE2-ND2 3.11Å; H268-N272 PolarHBondContact O-N 3Å; I270-N272 PolarHBondContact O-N 3.46Å; N272-A274 VanDerWaalsContact C-N 3.27Å; N272-A274 PolarHBondContact O-N 3.06Å; N272-R275 PolarHBondContact O-N 3.24Å; N272-E276 WeakPolarHBondContact O-CG 3.46Å; N272-E276 PolarHBondContact O-N 3.43Å
273	S	90.7	Very high	87	Confident	8 Å²	8	44.4 Å²	44.4	6%	0.056	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-32.2	177.5	-174.2	0	0	0	0	112.7	V144 L269 I270 L277	V144-S273 PolarHBondContact O-OG 3.32Å; L269-S273 WeakPolarHBondContact O-CB 3.49Å; L269-S273 PolarHBondContact O-N 3.24Å; I270-S273 PolarHBondContact O-N 3.06Å; S273-L277 WeakPolarHBondContact O-CD1 3.46Å; S273-L277 VanDerWaalsContact O-CG 3.28Å; S273-L277 WeakPolarHBondContact O-CG 3.25Å; S273-L277 PolarHBondContact O-N 3.02Å
274	A	90.6	Very high	88.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-69.5	-46.5	174.4	0	0	0	0	0	111.1	V144 I270 I271 N272 E276 L277 G278 H279 L281	V144-A274 HydrophobicContact CG1-CB 4.16Å; V144-A274 HydrophobicContact CG2-CB 4.45Å; I270-A274 WeakPolarHBondContact O-CB 3.35Å; I270-A274 PolarHBondContact O-N 3.3Å; I271-A274 PolarHBondContact O-N 3.23Å; N272-A274 VanDerWaalsContact C-N 3.27Å; N272-A274 PolarHBondContact O-N 3.06Å; A274-E276 PolarHBondContact O-N 2.96Å; A274-L277 CarbonylContact O-C 3.51Å; A274-L277 WeakPolarHBondContact O-CA 3.45Å; A274-L277 PolarHBondContact O-N 3.29Å; A274-G278 PolarHBondContact O-N 3.41Å; A274-H279 CarbonylContact C-O 2.98Å; A274-H279 WeakPolarHBondContact CB-O 3.5Å; A274-H279 PolarHBondContact O-N 3.37Å; A274-L281 HydrophobicContact CB-CD1 3.67Å; A274-L281 HydrophobicContact CB-CD2 4.35Å; A274-L281 HydrophobicContact CB-CG 3.64Å
275	R	90.4	Very high	89.7	Confident	97 Å²	97	46.9 Å²	46.9	37%	0.366	25%	0.249	S	C	.	.	H	α-helix	trans	-57.4	-46	176.3	-73.7	173.2	170.2	-176.3	-11.2	111.9	E258 I271 N272 L277 G278 H279	E258-R275 IonicContact OE1-CZ 3.58Å; E258-R275 IonicContact OE1-NH1 2.71Å; E258-R275 IonicContact OE1-NH2 3.57Å; E258-R275 PolarHBondContact OE1-NH2 3.41Å; I271-R275 WeakPolarHBondContact O-CG 3.49Å; I271-R275 PolarHBondContact O-N 3.19Å; N272-R275 PolarHBondContact O-N 3.24Å; R275-L277 PolarHBondContact O-N 3.31Å; R275-G278 PolarHBondContact O-N 3.31Å; R275-H279 PolarHBondContact N-O 3.25Å
276	E	89.4	Confident	90	Very high	140 Å²	140	46.1 Å²	46.1	65%	0.654	25%	0.245	S	C	*	.	H	α-helix	trans	-59.4	-27.8	175.4	-75.4	174.4	-169.1	0	0	113.3	N272 A274 G278	N272-E276 WeakPolarHBondContact O-CG 3.46Å; N272-E276 PolarHBondContact O-N 3.43Å; A274-E276 PolarHBondContact O-N 2.96Å; E276-G278 VanDerWaalsContact C-N 3.34Å
277	L	90.6	Very high	90.3	Very high	52 Å²	52	47.2 Å²	47.2	27%	0.272	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	6.1	177.5	-67.7	172.8	0	0	0	113.2	K143 V144 S273 A274 R275 H279	K143-L277 HydrophobicContact CB-CD1 4.3Å; K143-L277 HydrophobicContact CD-CD1 3.92Å; K143-L277 HydrophobicContact CD-CD2 3.85Å; K143-L277 HydrophobicContact CG-CD1 3.99Å; K143-L277 VanDerWaalsContact NZ-CD2 3.3Å; V144-L277 HydrophobicContact CG2-CD1 3.73Å; S273-L277 WeakPolarHBondContact O-CD1 3.46Å; S273-L277 VanDerWaalsContact O-CG 3.28Å; S273-L277 WeakPolarHBondContact O-CG 3.25Å; S273-L277 PolarHBondContact O-N 3.02Å; A274-L277 CarbonylContact O-C 3.51Å; A274-L277 WeakPolarHBondContact O-CA 3.45Å; A274-L277 PolarHBondContact O-N 3.29Å; R275-L277 PolarHBondContact O-N 3.31Å; L277-H279 PolarHBondContact O-CD2 2.81Å; L277-H279 VanDerWaalsContact O-CD2 3.22Å; L277-H279 PolarHBondContact O-NE2 2.92Å
278	G	88.8	Confident	90.6	Very high	67 Å²	67	47.7 Å²	47.7	69%	0.691	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	26.5	179.7	0	0	0	0	0	113.8	A274 R275 E276	A274-G278 PolarHBondContact O-N 3.41Å; R275-G278 PolarHBondContact O-N 3.31Å; E276-G278 VanDerWaalsContact C-N 3.34Å
279	H	87.2	Confident	90.8	Very high	78 Å²	78	47.2 Å²	47.2	36%	0.361	25%	0.251	S	S	.	.			trans	-126	131.6	179	-59.7	-61.6	0	0	0	111.6	Q140 A274 R275 L277	Q140-H279 PolarHBondContact NE2-CD2 3.13Å; Q140-H279 PolarHBondContact NE2-CE1 3.06Å; Q140-H279 PolarHBondContact NE2-ND1 3.45Å; Q140-H279 PolarHBondContact NE2-NE2 2.91Å; A274-H279 CarbonylContact C-O 2.98Å; A274-H279 WeakPolarHBondContact CB-O 3.5Å; A274-H279 PolarHBondContact O-N 3.37Å; R275-H279 PolarHBondContact N-O 3.25Å; L277-H279 PolarHBondContact O-CD2 2.81Å; L277-H279 VanDerWaalsContact O-CD2 3.22Å; L277-H279 PolarHBondContact O-NE2 2.92Å
280	E	87.6	Confident	91	Very high	169 Å²	169	46.1 Å²	46.1	79%	0.79	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-97.3	123.9	167	-67.9	-170.7	161.3	0	0	109.2
281	L	89.8	Confident	91.1	Very high	39 Å²	39	46 Å²	46	20%	0.204	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-83.5	131.8	177.2	-64.3	173.3	0	0	0	109.4	I270 A274 E285 L286	I270-L281 HydrophobicContact CG2-CD1 3.48Å; I270-L281 VanDerWaalsContact CG2-CD1 3.48Å; A274-L281 HydrophobicContact CB-CD1 3.67Å; A274-L281 HydrophobicContact CB-CD2 4.35Å; A274-L281 HydrophobicContact CB-CG 3.64Å; L281-E285 HydrophobicContact CB-CB 4.31Å; L281-E285 HydrophobicContact CD2-CB 4.3Å; L281-L286 HydrophobicContact CB-CD2 3.95Å; L281-L286 HydrophobicContact CB-CG 4.01Å; L281-L286 HydrophobicContact CD1-CD2 3.71Å
282	S	92.3	Very high	91.1	Very high	56 Å²	56	46.2 Å²	46.2	39%	0.392	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-66.4	158.7	170.9	67.2	0	0	0	0	111.3	Q284 E285 L286	S282-Q284 PolarHBondContact O-N 3.42Å; S282-E285 PolarHBondContact N-OE2 3.1Å; S282-E285 WeakPolarHBondContact O-CB 3.3Å; S282-E285 PolarHBondContact O-N 3.36Å; S282-E285 VanDerWaalsContact OG-CG 3.27Å; S282-E285 WeakPolarHBondContact OG-CG 3.21Å; S282-E285 PolarHBondContact OG-N 2.8Å; S282-E285 PolarHBondContact OG-OE2 3.12Å; S282-L286 PolarHBondContact O-N 2.68Å
283	V	91.9	Very high	91.3	Very high	62 Å²	62	44.7 Å²	44.7	38%	0.376	24%	0.237	S	C	.	.	H	α-helix	trans	-54.6	-38.4	174.2	176	0	0	0	0	111.2	I251 L255 L286 K287	I251-V283 HydrophobicContact CG2-CG1 4.26Å; L255-V283 HydrophobicContact CD1-CG2 4.18Å; V283-L286 PolarHBondContact O-N 2.81Å; V283-K287 HydrophobicContact CG1-CD 4.48Å; V283-K287 WeakPolarHBondContact O-CG 3.4Å; V283-K287 PolarHBondContact O-N 3.47Å
284	Q	92.8	Very high	91.3	Very high	74 Å²	74	44.4 Å²	44.4	35%	0.346	24%	0.235	S	C	.	.	H	α-helix	trans	-64.2	-41.7	177	-175.3	58.1	24.6	0	0	112.2	S282 L286 K287 E288	S282-Q284 PolarHBondContact O-N 3.42Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 2.92Å; Q284-K287 WeakPolarHBondContact O-CB 3.29Å; Q284-K287 PolarHBondContact O-N 3.3Å; Q284-E288 PolarHBondContact NE2-OE1 3.37Å; Q284-E288 WeakPolarHBondContact O-CG 3.47Å; Q284-E288 PolarHBondContact O-N 2.93Å
285	E	92.5	Very high	91.4	Very high	31 Å²	31	45.9 Å²	45.9	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-35.3	176.2	-71.4	-179.2	118.8	0	0	112.7	H128 R141 L281 S282 S289	H128-E285 HydrophobicContact CB-CB 4.46Å; H128-E285 HydrophobicContact CB-CG 3.76Å; H128-E285 IonicContact CG-OE1 2.74Å; H128-E285 IonicContact ND1-OE1 2.85Å; H128-E285 PolarHBondContact ND1-OE1 2.85Å; H128-E285 VanDerWaalsContact ND1-OE1 3.17Å; R141-E285 IonicContact CZ-OE1 2.96Å; R141-E285 IonicContact NH1-OE1 3.94Å; R141-E285 IonicContact NH2-OE1 3.68Å; R141-E285 PolarHBondContact NH2-OE1 2.85Å; L281-E285 HydrophobicContact CB-CB 4.31Å; L281-E285 HydrophobicContact CD2-CB 4.3Å; S282-E285 PolarHBondContact N-OE2 3.1Å; S282-E285 WeakPolarHBondContact O-CB 3.3Å; S282-E285 PolarHBondContact O-N 3.36Å; S282-E285 VanDerWaalsContact OG-CG 3.27Å; S282-E285 WeakPolarHBondContact OG-CG 3.21Å; S282-E285 PolarHBondContact OG-N 2.8Å; S282-E285 PolarHBondContact OG-OE2 3.12Å; E285-S289 VanDerWaalsContact O-CB 3.31Å; E285-S289 WeakPolarHBondContact O-CB 3.39Å; E285-S289 PolarHBondContact O-N 3.36Å; E285-S289 PolarHBondContact O-OG 2.75Å
286	L	92.5	Very high	91.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-42.3	174.4	-67.9	173.5	0	0	0	111.5	I251 L255 L267 I270 I271 L281 S282 V283 Q284 S289 A290	I251-L286 HydrophobicContact CD1-CB 3.86Å; I251-L286 HydrophobicContact CG1-CB 4.28Å; I251-L286 HydrophobicContact CG2-CB 4.31Å; I251-L286 HydrophobicContact CG2-CD1 3.77Å; L255-L286 HydrophobicContact CD1-CD1 4.42Å; L255-L286 HydrophobicContact CD2-CD1 4.18Å; L267-L286 HydrophobicContact CD1-CB 4.38Å; L267-L286 HydrophobicContact CD1-CD2 4.04Å; I270-L286 HydrophobicContact CG2-CD2 4.19Å; I271-L286 HydrophobicContact CD1-CD1 4.23Å; I271-L286 HydrophobicContact CD1-CD2 4.35Å; I271-L286 HydrophobicContact CG1-CD1 4.1Å; I271-L286 HydrophobicContact CG1-CD2 3.61Å; L281-L286 HydrophobicContact CB-CD2 3.95Å; L281-L286 HydrophobicContact CB-CG 4.01Å; L281-L286 HydrophobicContact CD1-CD2 3.71Å; S282-L286 PolarHBondContact O-N 2.68Å; V283-L286 PolarHBondContact O-N 2.81Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 2.92Å; L286-S289 PolarHBondContact O-N 2.94Å; L286-A290 WeakPolarHBondContact O-CB 3.45Å; L286-A290 PolarHBondContact O-N 3.09Å
287	K	93.6	Very high	91.3	Very high	22 Å²	22	38 Å²	38	10%	0.096	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-48.8	173.5	-74.6	175.8	174.1	-179.5	0	112	Y244 L247 D248 I251 V283 Q284 S289 A290 V291	Y244-K287 HydrophobicContact CD1-CB 3.93Å; Y244-K287 HydrophobicContact CD1-CD 4.12Å; Y244-K287 HydrophobicContact CD1-CG 4.31Å; Y244-K287 HydrophobicContact CD2-CD 4.2Å; Y244-K287 HydrophobicContact CE1-CB 3.81Å; Y244-K287 HydrophobicContact CG-CD 3.89Å; L247-K287 HydrophobicContact CB-CG 4.22Å; D248-K287 WeakPolarHBondContact OD1-CE 3.24Å; D248-K287 IonicContact OD1-NZ 2.99Å; D248-K287 PolarHBondContact OD1-NZ 3.46Å; D248-K287 WeakPolarHBondContact OD2-CE 3.36Å; D248-K287 IonicContact OD2-NZ 3.69Å; D248-K287 PolarHBondContact OD2-NZ 3.04Å; I251-K287 HydrophobicContact CD1-CB 4.35Å; I251-K287 HydrophobicContact CD1-CG 3.55Å; V283-K287 HydrophobicContact CG1-CD 4.48Å; V283-K287 WeakPolarHBondContact O-CG 3.4Å; V283-K287 PolarHBondContact O-N 3.47Å; Q284-K287 WeakPolarHBondContact O-CB 3.29Å; Q284-K287 PolarHBondContact O-N 3.3Å; K287-S289 VanDerWaalsContact C-N 3.34Å; K287-S289 PolarHBondContact O-N 3.09Å; K287-A290 PolarHBondContact O-N 2.58Å; K287-V291 WeakPolarHBondContact O-CG2 3.49Å; K287-V291 PolarHBondContact O-N 2.86Å
288	E	93.7	Very high	91.2	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-39.9	179.3	-70.8	-178.2	-159.6	0	0	111.7	G126 S127 H128 T129 Y244 Q284 V291 E292	G126-E288 VanDerWaalsContact C-OE2 3.26Å; G126-E288 WeakPolarHBondContact CA-OE2 3.28Å; S127-E288 PolarHBondContact N-OE2 2.96Å; H128-E288 VanDerWaalsContact CA-OE2 3.29Å; H128-E288 WeakPolarHBondContact CA-OE2 3.47Å; H128-E288 WeakPolarHBondContact CB-OE2 3.46Å; H128-E288 IonicContact CD2-OE1 3.26Å; H128-E288 IonicContact CD2-OE2 3.73Å; H128-E288 PolarHBondContact CD2-OE2 3.01Å; H128-E288 IonicContact CG-OE2 3.18Å; H128-E288 PolarHBondContact N-OE2 2.87Å; T129-E288 HydrophobicContact CG2-CB 4.22Å; Y244-E288 WeakPolarHBondContact OH-CG 3.34Å; Q284-E288 PolarHBondContact NE2-OE1 3.37Å; Q284-E288 WeakPolarHBondContact O-CG 3.47Å; Q284-E288 PolarHBondContact O-N 2.93Å; E288-V291 PolarHBondContact O-N 3.48Å; E288-E292 VanDerWaalsContact O-CB 3.31Å; E288-E292 WeakPolarHBondContact O-CB 3.34Å; E288-E292 PolarHBondContact O-N 3.45Å
289	S	92.9	Very high	91.2	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-64.2	-40.4	174.5	-58.8	0	0	0	0	112.1	E285 L286 K287 E292 L293	E285-S289 VanDerWaalsContact O-CB 3.31Å; E285-S289 WeakPolarHBondContact O-CB 3.39Å; E285-S289 PolarHBondContact O-N 3.36Å; E285-S289 PolarHBondContact O-OG 2.75Å; L286-S289 PolarHBondContact O-N 2.94Å; K287-S289 VanDerWaalsContact C-N 3.34Å; K287-S289 PolarHBondContact O-N 3.09Å; S289-E292 PolarHBondContact O-N 3.35Å; S289-L293 WeakPolarHBondContact O-CG 3.21Å; S289-L293 PolarHBondContact O-N 2.86Å
290	A	92.5	Very high	91.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.5	-45.7	177	0	0	0	0	0	111.9	L198 L247 L286 K287 E292 L293 L294	L198-A290 HydrophobicContact CD1-CB 3.99Å; L198-A290 HydrophobicContact CD2-CB 3.73Å; L247-A290 HydrophobicContact CD1-CB 3.98Å; L247-A290 HydrophobicContact CD2-CB 3.94Å; L286-A290 WeakPolarHBondContact O-CB 3.45Å; L286-A290 PolarHBondContact O-N 3.09Å; K287-A290 PolarHBondContact O-N 2.58Å; A290-E292 VanDerWaalsContact C-N 3.34Å; A290-E292 PolarHBondContact O-N 3.48Å; A290-L293 PolarHBondContact O-N 2.92Å; A290-L294 WeakPolarHBondContact O-CG 3.32Å; A290-L294 PolarHBondContact O-N 2.89Å
291	V	93	Very high	91.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-40.2	174.9	170	0	0	0	0	111.3	L125 F214 L217 Y244 L247 K287 E288 L294 F295	L125-V291 HydrophobicContact CD2-CG1 4.04Å; F214-V291 HydrophobicContact CE2-CG1 4.42Å; L217-V291 HydrophobicContact CD2-CG1 3.89Å; Y244-V291 HydrophobicContact CD1-CG2 4.2Å; Y244-V291 HydrophobicContact CE1-CG2 3.74Å; L247-V291 HydrophobicContact CD1-CG2 3.8Å; K287-V291 WeakPolarHBondContact O-CG2 3.49Å; K287-V291 PolarHBondContact O-N 2.86Å; E288-V291 PolarHBondContact O-N 3.48Å; V291-L294 PolarHBondContact O-N 3.41Å; V291-F295 VanDerWaalsContact O-CB 3.32Å; V291-F295 WeakPolarHBondContact O-CB 3.09Å; V291-F295 PolarHBondContact O-N 3.18Å
292	E	92.2	Very high	92.2	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.065	13%	0.133	C	C	.	.	H	α-helix	trans	-62.2	-41.9	175.6	179	169.6	-131.9	0	0	112.2	T129 L130 L131 E288 S289 A290 F295 A296	T129-E292 HydrophobicContact CG2-CB 4.23Å; L130-E292 WeakPolarHBondContact CA-OE1 3.26Å; L130-E292 VanDerWaalsContact CB-OE1 3.26Å; L130-E292 WeakPolarHBondContact CB-OE1 3.33Å; L130-E292 WeakPolarHBondContact CB-OE2 3.5Å; L130-E292 VanDerWaalsContact N-CD 3.25Å; L130-E292 PolarHBondContact N-OE1 3.15Å; L130-E292 PolarHBondContact N-OE2 3.43Å; L131-E292 HydrophobicContact CD1-CG 4.29Å; L131-E292 VanDerWaalsContact CG-OE1 3.29Å; L131-E292 WeakPolarHBondContact CG-OE1 3.44Å; L131-E292 PolarHBondContact N-OE1 3.02Å; E288-E292 VanDerWaalsContact O-CB 3.31Å; E288-E292 WeakPolarHBondContact O-CB 3.34Å; E288-E292 PolarHBondContact O-N 3.45Å; S289-E292 PolarHBondContact O-N 3.35Å; A290-E292 VanDerWaalsContact C-N 3.34Å; A290-E292 PolarHBondContact O-N 3.48Å; E292-F295 PolarHBondContact O-N 3.22Å; E292-A296 WeakPolarHBondContact O-CB 3.33Å; E292-A296 PolarHBondContact O-N 3.14Å
293	L	91.8	Very high	92.5	Very high	11 Å²	11	20 Å²	20	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-44.4	175.2	-75.4	178.5	0	0	0	112.3	F149 L198 A266 I270 S289 A290 F295 A296 A297	F149-L293 HydrophobicContact CE2-CD2 4.25Å; F149-L293 HydrophobicContact CZ-CD2 3.71Å; L198-L293 HydrophobicContact CD2-CD1 4.23Å; A266-L293 HydrophobicContact CB-CD1 3.88Å; I270-L293 HydrophobicContact CD1-CD1 3.73Å; S289-L293 WeakPolarHBondContact O-CG 3.21Å; S289-L293 PolarHBondContact O-N 2.86Å; A290-L293 PolarHBondContact O-N 2.92Å; L293-F295 VanDerWaalsContact C-N 3.34Å; L293-A296 PolarHBondContact O-N 3.02Å; L293-A297 WeakPolarHBondContact O-CB 3.41Å; L293-A297 PolarHBondContact O-N 3.43Å; L293-A297 VanDerWaalsContact O-N 3.09Å
294	L	92.1	Very high	92.8	Very high	3 Å²	3	17.3 Å²	17.3	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-59.5	-46.6	174.4	-70.4	172	0	0	0	110.7	F190 A193 A194 L198 F214 A290 V291 A296 A297 F298	F190-L294 HydrophobicContact CD2-CD2 4.49Å; F190-L294 HydrophobicContact CE2-CD1 4.35Å; F190-L294 HydrophobicContact CE2-CD2 4.15Å; A193-L294 HydrophobicContact CB-CD2 3.67Å; A194-L294 HydrophobicContact CB-CD2 4.46Å; L198-L294 HydrophobicContact CD1-CD1 3.66Å; L198-L294 HydrophobicContact CD1-CD2 3.82Å; L198-L294 HydrophobicContact CD1-CG 3.64Å; L198-L294 HydrophobicContact CG-CD2 4.42Å; L198-L294 HydrophobicContact CG-CG 4.49Å; F214-L294 HydrophobicContact CD2-CB 4.27Å; F214-L294 HydrophobicContact CD2-CD1 4.33Å; F214-L294 HydrophobicContact CE1-CB 4.27Å; F214-L294 HydrophobicContact CE2-CB 3.62Å; F214-L294 HydrophobicContact CE2-CD1 4.28Å; F214-L294 HydrophobicContact CZ-CB 3.65Å; A290-L294 WeakPolarHBondContact O-CG 3.32Å; A290-L294 PolarHBondContact O-N 2.89Å; V291-L294 PolarHBondContact O-N 3.41Å; L294-A296 PolarHBondContact O-N 3.47Å; L294-A297 PolarHBondContact O-N 3.4Å; L294-F298 WeakPolarHBondContact O-CB 3.27Å; L294-F298 PolarHBondContact O-N 3.31Å
295	F	91.3	Very high	93	Very high	31 Å²	31	14 Å²	14	14%	0.136	8%	0.083	C	C	.	.	H	α-helix	trans	-60.2	-47.1	-179.6	171.1	-113.7	0	0	0	112.1	W117 L125 L131 F214 V218 L221 V291 E292 L293 A297	W117-F295 HydrophobicContact CH2-CE1 4.35Å; W117-F295 HydrophobicContact CH2-CZ 4.33Å; W117-F295 HydrophobicContact CZ3-CZ 4.41Å; L125-F295 HydrophobicContact CD1-CD1 4.09Å; L125-F295 HydrophobicContact CD1-CE1 4.15Å; L125-F295 HydrophobicContact CD2-CB 4.21Å; L125-F295 HydrophobicContact CD2-CD1 4.38Å; L125-F295 HydrophobicContact CD2-CG 4.14Å; L131-F295 HydrophobicContact CD1-CD1 3.69Å; L131-F295 HydrophobicContact CD1-CE1 3.64Å; F214-F295 VanDerWaalsContact CZ-CA 3.42Å; F214-F295 HydrophobicContact CZ-CB 3.89Å; F214-F295 VanDerWaalsContact CZ-N 3.28Å; V218-F295 HydrophobicContact CG1-CD2 4.38Å; V218-F295 HydrophobicContact CG1-CE2 4.13Å; V218-F295 HydrophobicContact CG2-CD2 3.98Å; L221-F295 HydrophobicContact CD1-CD2 3.68Å; L221-F295 HydrophobicContact CD1-CE2 3.2Å; L221-F295 HydrophobicContact CD1-CZ 3.77Å; V291-F295 VanDerWaalsContact O-CB 3.32Å; V291-F295 WeakPolarHBondContact O-CB 3.09Å; V291-F295 PolarHBondContact O-N 3.18Å; E292-F295 PolarHBondContact O-N 3.22Å; L293-F295 VanDerWaalsContact C-N 3.34Å; F295-A297 VanDerWaalsContact C-N 3.35Å; F295-A297 PolarHBondContact O-N 3.49Å
296	A	90.1	Very high	93.3	Very high	54 Å²	54	12.6 Å²	12.6	45%	0.446	8%	0.077	S	C	.	.	H	α-helix	trans	-62.4	-42.3	179.2	0	0	0	0	0	112	E292 L293 L294 T300	E292-A296 WeakPolarHBondContact O-CB 3.33Å; E292-A296 PolarHBondContact O-N 3.14Å; L293-A296 PolarHBondContact O-N 3.02Å; L294-A296 PolarHBondContact O-N 3.47Å; A296-T300 PolarHBondContact O-OG1 3.17Å
297	A	88.7	Confident	93.6	Very high	18 Å²	18	12.6 Å²	12.6	15%	0.149	8%	0.077	C	C	.	.	H	α-helix	trans	-80.7	-29.7	-173.3	0	0	0	0	0	114.3	A193 L293 L294 F295 T301	A193-A297 HydrophobicContact CB-CB 3.99Å; L293-A297 WeakPolarHBondContact O-CB 3.41Å; L293-A297 PolarHBondContact O-N 3.43Å; L293-A297 VanDerWaalsContact O-N 3.09Å; L294-A297 PolarHBondContact O-N 3.4Å; F295-A297 VanDerWaalsContact C-N 3.35Å; F295-A297 PolarHBondContact O-N 3.49Å; A297-T301 WeakPolarHBondContact O-CB 3.45Å; A297-T301 PolarHBondContact O-OG1 3.14Å
298	F	87.8	Confident	93.8	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-66.7	-75.5	-169.6	-176.7	-128.3	0	0	0	112.8	K186 T189 F190 F214 E215 L294 A302	K186-F298 HydrophobicContact CB-CE2 3.75Å; K186-F298 HydrophobicContact CB-CZ 3.95Å; K186-F298 HydrophobicContact CD-CZ 4.19Å; K186-F298 HydrophobicContact CG-CE2 4.33Å; K186-F298 HydrophobicContact CG-CZ 4.24Å; K186-F298 WeakPolarHBondContact O-CE2 3.49Å; T189-F298 PolarHBondContact OG1-O 3.26Å; F190-F298 HydrophobicContact CB-CD2 3.69Å; F190-F298 HydrophobicContact CB-CE2 3.68Å; F190-F298 HydrophobicContact CD2-CD2 4.25Å; F190-F298 HydrophobicContact CD2-CE2 4.36Å; F190-F298 HydrophobicContact CG-CD2 4.48Å; F190-F298 HydrophobicContact CG-CE2 4.42Å; F214-F298 HydrophobicContact CD1-CB 4.26Å; F214-F298 AromaticContact CD1-CD1 3.51Å; F214-F298 HydrophobicContact CD1-CD1 3.51Å; F214-F298 HydrophobicContact CD1-CD2 4.47Å; F214-F298 AromaticContact CD1-CE1 3.85Å; F214-F298 HydrophobicContact CD1-CE1 3.85Å; F214-F298 AromaticContact CD1-CG 3.87Å; F214-F298 HydrophobicContact CD1-CG 3.87Å; F214-F298 HydrophobicContact CD1-CZ 4.45Å; F214-F298 HydrophobicContact CE1-CB 3.76Å; F214-F298 AromaticContact CE1-CD1 3.57Å; F214-F298 HydrophobicContact CE1-CD1 3.57Å; F214-F298 HydrophobicContact CE1-CE1 4.34Å; F214-F298 AromaticContact CE1-CG 3.84Å; F214-F298 HydrophobicContact CE1-CG 3.84Å; E215-F298 HydrophobicContact CB-CE1 4.33Å; E215-F298 HydrophobicContact CB-CZ 4.38Å; L294-F298 WeakPolarHBondContact O-CB 3.27Å; L294-F298 PolarHBondContact O-N 3.31Å; F298-A302 VanDerWaalsContact O-CB 3.24Å; F298-A302 WeakPolarHBondContact O-CB 3.38Å; F298-A302 PolarHBondContact O-N 3.4Å
299	F	88.9	Confident	94.1	Very high	22 Å²	22	11.1 Å²	11.1	10%	0.096	7%	0.07	C	C	.	.	H	α-helix	trans	-72	-36.3	-172	-82.4	-72.8	0	0	0	114.1	Y182 K186 E215 V218 S303 I493	Y182-F299 WeakPolarHBondContact OH-CD1 3.43Å; K186-F299 HydrophobicContact CD-CD1 4.28Å; K186-F299 HydrophobicContact CD-CE1 3.69Å; K186-F299 HydrophobicContact CD-CZ 4.32Å; K186-F299 HydrophobicContact CG-CE1 4.47Å; E215-F299 HydrophobicContact CG-CZ 4.49Å; V218-F299 HydrophobicContact CB-CD2 4.17Å; V218-F299 HydrophobicContact CB-CE2 3.49Å; V218-F299 VanDerWaalsContact CB-CE2 3.49Å; V218-F299 HydrophobicContact CB-CZ 4.44Å; V218-F299 HydrophobicContact CG1-CD2 3.45Å; V218-F299 VanDerWaalsContact CG1-CD2 3.45Å; V218-F299 HydrophobicContact CG1-CE2 3.12Å; V218-F299 HydrophobicContact CG1-CZ 4.13Å; V218-F299 HydrophobicContact CG2-CD2 4.32Å; V218-F299 HydrophobicContact CG2-CE2 3.93Å; F299-S303 WeakPolarHBondContact O-CB 3.28Å; F299-S303 PolarHBondContact O-N 3.26Å; F299-I493 HydrophobicContact CB-CG1 4.08Å; F299-I493 HydrophobicContact CB-CG2 4.25Å
300	T	94.5	Very high	94.3	Very high	43 Å²	43	11.1 Å²	11.1	26%	0.264	7%	0.07	S	C	.	.	H	α-helix	trans	-69.2	-45.4	-173.3	64.4	0	0	0	0	111.4	A296 A304 P378 V379	A296-T300 PolarHBondContact O-OG1 3.17Å; T300-A304 WeakPolarHBondContact O-CB 3.29Å; T300-A304 PolarHBondContact O-N 3.18Å; T300-P378 WeakPolarHBondContact O-CG 3.4Å; T300-V379 HydrophobicContact CG2-CG2 4.02Å
301	T	95.8	Very high	94.6	Very high	16 Å²	16	11.5 Å²	11.5	10%	0.098	7%	0.072	C	C	.	.	H	α-helix	trans	-70.5	-39.5	177.2	-44.4	0	0	0	0	110.7	T189 A297 S303 A304 S305 V464	T189-T301 HydrophobicContact CG2-CG2 3.81Å; A297-T301 WeakPolarHBondContact O-CB 3.45Å; A297-T301 PolarHBondContact O-OG1 3.14Å; T301-S303 VanDerWaalsContact C-N 3.34Å; T301-S303 PolarHBondContact O-N 3.12Å; T301-A304 PolarHBondContact O-N 2.81Å; T301-S305 VanDerWaalsContact O-CB 3.3Å; T301-S305 WeakPolarHBondContact O-CB 3.4Å; T301-S305 PolarHBondContact O-N 3.42Å; T301-S305 PolarHBondContact O-OG 2.89Å; T301-V464 HydrophobicContact CG2-CB 4.22Å; T301-V464 HydrophobicContact CG2-CG1 3.62Å
302	A	96.4	Very high	94.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62.2	-43	177.7	0	0	0	0	0	111.9	Y182 A185 K186 T189 F298 T306	Y182-A302 HydrophobicContact CE2-CB 4.46Å; A185-A302 HydrophobicContact CB-CB 4.02Å; K186-A302 HydrophobicContact CB-CB 4.5Å; K186-A302 HydrophobicContact CG-CB 3.93Å; T189-A302 HydrophobicContact CG2-CB 4.24Å; F298-A302 VanDerWaalsContact O-CB 3.24Å; F298-A302 WeakPolarHBondContact O-CB 3.38Å; F298-A302 PolarHBondContact O-N 3.4Å; A302-T306 WeakPolarHBondContact O-CB 3.21Å; A302-T306 PolarHBondContact O-N 3.17Å; A302-T306 PolarHBondContact O-OG1 3.02Å
303	S	97.3	Very high	95	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.007	8%	0.077	C	C	.	.	H	α-helix	trans	-59.3	-50	173.3	169.7	0	0	0	0	112.2	F299 T301 T306 S307 L494	F299-S303 WeakPolarHBondContact O-CB 3.28Å; F299-S303 PolarHBondContact O-N 3.26Å; T301-S303 VanDerWaalsContact C-N 3.34Å; T301-S303 PolarHBondContact O-N 3.12Å; S303-T306 PolarHBondContact O-N 3.47Å; S303-S307 WeakPolarHBondContact O-CB 3.43Å; S303-S307 PolarHBondContact O-N 3.21Å; S303-S307 PolarHBondContact O-OG 3.18Å; S303-L494 WeakPolarHBondContact CB-O 3.27Å; S303-L494 PolarHBondContact OG-O 3.25Å
304	A	98.1	Very high	95.3	Very high	4 Å²	4	15.1 Å²	15.1	3%	0.033	9%	0.089	C	C	.	.	H	α-helix	trans	-65.2	-41.4	-179.7	0	0	0	0	0	112.2	T300 T301 S307 L308 L373 P378 L465	T300-A304 WeakPolarHBondContact O-CB 3.29Å; T300-A304 PolarHBondContact O-N 3.18Å; T301-A304 PolarHBondContact O-N 2.81Å; A304-S307 PolarHBondContact O-N 3.4Å; A304-L308 WeakPolarHBondContact O-CB 3.45Å; A304-L308 PolarHBondContact O-N 2.87Å; A304-L373 HydrophobicContact CB-CD2 3.95Å; A304-P378 HydrophobicContact CB-CG 3.74Å; A304-L465 HydrophobicContact CB-CD1 3.8Å; A304-L465 HydrophobicContact CB-CD2 3.68Å; A304-L465 HydrophobicContact CB-CG 4.31Å
305	S	98.4	Very high	95.5	Very high	4 Å²	4	18 Å²	18	3%	0.028	10%	0.103	C	C	.	.	H	α-helix	trans	-61.5	-43.4	175.6	-68.5	0	0	0	0	111.9	T301 S307 L308 I309 L468	T301-S305 VanDerWaalsContact O-CB 3.3Å; T301-S305 WeakPolarHBondContact O-CB 3.4Å; T301-S305 PolarHBondContact O-N 3.42Å; T301-S305 PolarHBondContact O-OG 2.89Å; S305-S307 VanDerWaalsContact C-N 3.34Å; S305-L308 WeakPolarHBondContact O-CB 3.38Å; S305-L308 PolarHBondContact O-N 3.43Å; S305-I309 WeakPolarHBondContact O-CG1 3.33Å; S305-I309 PolarHBondContact O-N 3.04Å; S305-I309 VanDerWaalsContact O-N 3.09Å; S305-L468 WeakPolarHBondContact OG-CD2 2.79Å
306	T	98.3	Very high	95.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-41.2	176.4	-54.9	0	0	0	0	111.1	V181 A302 S303 I309 L310 P496 L500	V181-T306 HydrophobicContact CG1-CG2 4.08Å; A302-T306 WeakPolarHBondContact O-CB 3.21Å; A302-T306 PolarHBondContact O-N 3.17Å; A302-T306 PolarHBondContact O-OG1 3.02Å; S303-T306 PolarHBondContact O-N 3.47Å; T306-I309 PolarHBondContact O-N 2.66Å; T306-L310 WeakPolarHBondContact O-CB 3.23Å; T306-L310 PolarHBondContact O-N 3.37Å; T306-P496 HydrophobicContact CG2-CG 3.76Å; T306-L500 HydrophobicContact CG2-CB 4.22Å; T306-L500 HydrophobicContact CG2-CD2 3.85Å
307	S	98.2	Very high	96	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-38.6	177.4	-58.4	0	0	0	0	112.3	S303 A304 S305 L310 L311 L494	S303-S307 WeakPolarHBondContact O-CB 3.43Å; S303-S307 PolarHBondContact O-N 3.21Å; S303-S307 PolarHBondContact O-OG 3.18Å; A304-S307 PolarHBondContact O-N 3.4Å; S305-S307 VanDerWaalsContact C-N 3.34Å; S307-L310 PolarHBondContact O-N 3.41Å; S307-L311 WeakPolarHBondContact O-CB 3.42Å; S307-L311 WeakPolarHBondContact O-CG 3.3Å; S307-L311 PolarHBondContact O-N 3.24Å; S307-L494 WeakPolarHBondContact OG-CD2 3.07Å
308	L	98.6	Very high	96.4	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-60.7	-49.3	173.8	173.5	67.2	0	0	0	111.1	A304 S305 L310 L311 L312 V368 V372 L465 L468 A469	A304-L308 WeakPolarHBondContact O-CB 3.45Å; A304-L308 PolarHBondContact O-N 2.87Å; S305-L308 WeakPolarHBondContact O-CB 3.38Å; S305-L308 PolarHBondContact O-N 3.43Å; L308-L310 VanDerWaalsContact C-N 3.35Å; L308-L310 PolarHBondContact O-N 3.16Å; L308-L311 PolarHBondContact O-N 3.15Å; L308-L312 HydrophobicContact CD1-CD1 3.74Å; L308-L312 HydrophobicContact CD1-CG 4.05Å; L308-L312 HydrophobicContact CG-CD1 4.05Å; L308-L312 WeakPolarHBondContact O-CB 3.42Å; L308-L312 VanDerWaalsContact O-CG 3.3Å; L308-L312 WeakPolarHBondContact O-CG 3.37Å; L308-L312 PolarHBondContact O-N 3.48Å; L308-V368 HydrophobicContact CD1-CG1 3.82Å; L308-V372 HydrophobicContact CB-CG1 4.29Å; L308-V372 HydrophobicContact CB-CG2 4.36Å; L308-V372 HydrophobicContact CD1-CG2 3.85Å; L308-L465 HydrophobicContact CD2-CD2 4.45Å; L308-L465 WeakPolarHBondContact CD2-O 3.41Å; L308-L468 HydrophobicContact CD2-CB 4.2Å; L308-L468 HydrophobicContact CD2-CD2 4.13Å; L308-L468 HydrophobicContact CD2-CG 4.15Å; L308-A469 HydrophobicContact CD1-CB 4.44Å; L308-A469 HydrophobicContact CD2-CB 4.04Å
309	I	98.4	Very high	96.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-44.8	178.7	-67.7	163.4	0	0	0	110.8	W172 V181 S305 T306 L313 L468 L472 W478 L500 L502	W172-I309 HydrophobicContact CH2-CD1 4.03Å; W172-I309 HydrophobicContact CZ3-CD1 3.82Å; V181-I309 HydrophobicContact CG1-CB 4.44Å; V181-I309 HydrophobicContact CG1-CD1 3.5Å; V181-I309 HydrophobicContact CG1-CG2 4.42Å; S305-I309 WeakPolarHBondContact O-CG1 3.33Å; S305-I309 PolarHBondContact O-N 3.04Å; S305-I309 VanDerWaalsContact O-N 3.09Å; T306-I309 PolarHBondContact O-N 2.66Å; I309-L313 WeakPolarHBondContact O-CB 3.28Å; I309-L313 PolarHBondContact O-N 2.86Å; I309-L468 HydrophobicContact CD1-CD2 4.47Å; I309-L472 HydrophobicContact CD1-CD1 4.27Å; I309-L472 HydrophobicContact CG1-CD1 3.51Å; I309-L472 HydrophobicContact CG1-CD2 4.4Å; I309-W478 PolarHBondContact O-NE1 3.35Å; I309-L500 HydrophobicContact CG2-CD2 4.41Å; I309-L502 HydrophobicContact CG2-CD1 3.41Å; I309-L502 VanDerWaalsContact CG2-CD1 3.41Å
310	L	97.9	Very high	97.2	Very high	6 Å²	6	24 Å²	24	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-51.6	177.7	175.8	61.9	0	0	0	112.1	T306 S307 L308 L313 Q314 L376 F485 M488 L500	T306-L310 WeakPolarHBondContact O-CB 3.23Å; T306-L310 PolarHBondContact O-N 3.37Å; S307-L310 PolarHBondContact O-N 3.41Å; L308-L310 VanDerWaalsContact C-N 3.35Å; L308-L310 PolarHBondContact O-N 3.16Å; L310-L313 WeakPolarHBondContact O-CB 3.4Å; L310-L313 PolarHBondContact O-N 2.83Å; L310-Q314 WeakPolarHBondContact O-CG 2.99Å; L310-Q314 PolarHBondContact O-N 2.96Å; L310-L376 HydrophobicContact CD2-CD1 4.36Å; L310-F485 HydrophobicContact CD1-CD1 3.48Å; L310-F485 VanDerWaalsContact CD1-CD1 3.48Å; L310-F485 HydrophobicContact CD1-CE1 3.96Å; L310-F485 HydrophobicContact CD1-CG 4.4Å; L310-M488 HydrophobicContact CD2-CE 4.22Å; L310-M488 HydrophobicContact CD2-SD 3.81Å; L310-L500 HydrophobicContact CB-CD2 3.95Å; L310-L500 HydrophobicContact CD1-CD1 4Å
311	L	97.7	Very high	97.4	Very high	9 Å²	9	25.6 Å²	25.6	5%	0.047	15%	0.153	C	C	.	.	H	α-helix	trans	-69.8	-37.6	-176.4	-71.7	170.1	0	0	0	111.4	S307 L308 L313 Q314 H315 V372 L376 F424	S307-L311 WeakPolarHBondContact O-CB 3.42Å; S307-L311 WeakPolarHBondContact O-CG 3.3Å; S307-L311 PolarHBondContact O-N 3.24Å; L308-L311 PolarHBondContact O-N 3.15Å; L311-L313 VanDerWaalsContact C-N 3.32Å; L311-L313 PolarHBondContact O-N 3.4Å; L311-Q314 PolarHBondContact O-N 3.17Å; L311-H315 WeakPolarHBondContact O-CB 3.31Å; L311-H315 PolarHBondContact O-CD2 3.49Å; L311-H315 PolarHBondContact O-N 3Å; L311-V372 HydrophobicContact CB-CG2 4.47Å; L311-V372 HydrophobicContact CD1-CB 4.17Å; L311-V372 HydrophobicContact CD1-CG1 4.25Å; L311-V372 HydrophobicContact CD1-CG2 3.84Å; L311-L376 HydrophobicContact CD1-CD1 3.79Å; L311-L376 HydrophobicContact CD1-CG 4.24Å; L311-L376 HydrophobicContact CD2-CD1 4.29Å; L311-L376 HydrophobicContact CG-CD1 3.97Å; L311-F424 HydrophobicContact CB-CD2 4.04Å; L311-F424 HydrophobicContact CB-CE2 3.97Å; L311-F424 HydrophobicContact CB-CZ 4.38Å; L311-F424 HydrophobicContact CD1-CD2 3.84Å; L311-F424 HydrophobicContact CD1-CE2 4Å; L311-F424 HydrophobicContact CD2-CB 4.39Å; L311-F424 HydrophobicContact CD2-CD2 4.1Å; L311-F424 HydrophobicContact CD2-CG 4.4Å; L311-F424 HydrophobicContact CG-CD2 4.22Å; L311-F424 HydrophobicContact CG-CE2 4.48Å
312	L	98	Very high	97.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-37.3	173.4	-71.9	179.1	0	0	0	112.1	L308 Q314 H315 A318 I319 I322 V368 W478	L308-L312 HydrophobicContact CD1-CD1 3.74Å; L308-L312 HydrophobicContact CD1-CG 4.05Å; L308-L312 HydrophobicContact CG-CD1 4.05Å; L308-L312 WeakPolarHBondContact O-CB 3.42Å; L308-L312 VanDerWaalsContact O-CG 3.3Å; L308-L312 WeakPolarHBondContact O-CG 3.37Å; L308-L312 PolarHBondContact O-N 3.48Å; L312-Q314 VanDerWaalsContact C-N 3.33Å; L312-Q314 PolarHBondContact O-N 3.47Å; L312-H315 CarbonylContact O-C 3.57Å; L312-H315 PolarHBondContact O-N 3.44Å; L312-A318 HydrophobicContact CD2-CB 4.13Å; L312-I319 HydrophobicContact CB-CD1 4.27Å; L312-I319 HydrophobicContact CB-CG1 4.11Å; L312-I319 HydrophobicContact CD2-CG1 4.2Å; L312-I319 WeakPolarHBondContact O-CD1 3.23Å; L312-I322 HydrophobicContact CD1-CD1 4.36Å; L312-I322 HydrophobicContact CD2-CD1 3.82Å; L312-V368 HydrophobicContact CD2-CG1 4.08Å; L312-W478 HydrophobicContact CB-CH2 4.46Å; L312-W478 HydrophobicContact CB-CZ2 3.8Å
313	L	97.3	Very high	97.4	Very high	32 Å²	32	28.3 Å²	28.3	17%	0.168	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-42.8	173.1	-176.7	52.7	0	0	0	111.9	I309 L310 L311 H315 W478 L480 F485 L502	I309-L313 WeakPolarHBondContact O-CB 3.28Å; I309-L313 PolarHBondContact O-N 2.86Å; L310-L313 WeakPolarHBondContact O-CB 3.4Å; L310-L313 PolarHBondContact O-N 2.83Å; L311-L313 VanDerWaalsContact C-N 3.32Å; L311-L313 PolarHBondContact O-N 3.4Å; L313-H315 VanDerWaalsContact C-N 3.26Å; L313-H315 PolarHBondContact O-N 3.21Å; L313-W478 VanDerWaalsContact CD1-O 3.32Å; L313-W478 WeakPolarHBondContact CD1-O 3.42Å; L313-L480 HydrophobicContact CD2-CB 4.4Å; L313-F485 HydrophobicContact CD2-CE1 3.82Å; L313-F485 HydrophobicContact CD2-CZ 4.48Å; L313-F485 HydrophobicContact CG-CE1 4.03Å; L313-F485 HydrophobicContact CG-CZ 4.31Å; L313-L502 HydrophobicContact CD2-CD1 4.42Å; L313-L502 HydrophobicContact CD2-CD2 3.51Å
314	Q	96.6	Very high	97.3	Very high	69 Å²	69	35 Å²	35	32%	0.322	20%	0.196	S	C	.	.	H	α-helix	trans	-71.6	-20.8	179.3	-72.4	175.9	-12.4	0	0	113.1	L310 L311 L312 F485	L310-Q314 WeakPolarHBondContact O-CG 2.99Å; L310-Q314 PolarHBondContact O-N 2.96Å; L311-Q314 PolarHBondContact O-N 3.17Å; L312-Q314 VanDerWaalsContact C-N 3.33Å; L312-Q314 PolarHBondContact O-N 3.47Å; Q314-F485 HydrophobicContact CG-CD1 4.15Å; Q314-F485 HydrophobicContact CG-CD2 4.32Å; Q314-F485 HydrophobicContact CG-CE1 3.6Å; Q314-F485 HydrophobicContact CG-CE2 3.81Å; Q314-F485 HydrophobicContact CG-CG 4.47Å; Q314-F485 HydrophobicContact CG-CZ 3.42Å; Q314-F485 VanDerWaalsContact CG-CZ 3.42Å
315	H	96.6	Very high	97.2	Very high	64 Å²	64	36.2 Å²	36.2	30%	0.296	20%	0.2	S	C	.	.			trans	-130.4	72.1	-173.7	-60.3	-73.7	0	0	0	112.7	L311 L312 L313 A317 A318 F424	L311-H315 WeakPolarHBondContact O-CB 3.31Å; L311-H315 PolarHBondContact O-CD2 3.49Å; L311-H315 PolarHBondContact O-N 3Å; L312-H315 CarbonylContact O-C 3.57Å; L312-H315 PolarHBondContact O-N 3.44Å; L313-H315 VanDerWaalsContact C-N 3.26Å; L313-H315 PolarHBondContact O-N 3.21Å; H315-A317 PolarHBondContact O-N 2.89Å; H315-A317 VanDerWaalsContact O-N 3.09Å; H315-A318 HydrophobicContact CB-CB 4.4Å; H315-A318 WeakPolarHBondContact O-CB 3.45Å; H315-A318 PolarHBondContact O-N 3.36Å; H315-F424 HydrophobicContact CB-CD1 3.78Å; H315-F424 HydrophobicContact CB-CE1 4.03Å; H315-F424 AromaticContact CD2-CD1 3.35Å; H315-F424 WeakPolarHBondContact CD2-CD1 3.45Å; H315-F424 AromaticContact CD2-CG 3.63Å; H315-F424 AromaticContact CG-CD1 3.48Å; H315-F424 VanDerWaalsContact CG-CD1 3.48Å; H315-F424 WeakPolarHBondContact NE2-CB 3.33Å; H315-F424 AromaticContact NE2-CG 3.97Å
316	P	95.9	Very high	96.9	Very high	89 Å²	89	36.1 Å²	36.1	58%	0.578	20%	0.2	S	C	*	.	H	α-helix	trans	-56.8	-28.2	-179.8	-26	34.7	0	0	0	114.6	A318 I319 A320	P316-A318 PolarHBondContact O-N 3.22Å; P316-I319 WeakPolarHBondContact O-CB 3.48Å; P316-I319 PolarHBondContact O-N 3.37Å; P316-I319 VanDerWaalsContact O-N 3.09Å; P316-A320 PolarHBondContact O-N 3.43Å; P316-A320 VanDerWaalsContact O-N 3.08Å
317	A	96.8	Very high	96.6	Very high	73 Å²	73	39.9 Å²	39.9	60%	0.603	23%	0.226	S	C	*	.	H	α-helix	trans	-60.4	-32.5	174.5	0	0	0	0	0	112.6	H315 K321	H315-A317 PolarHBondContact O-N 2.89Å; H315-A317 VanDerWaalsContact O-N 3.09Å; A317-K321 PolarHBondContact O-N 2.96Å
318	A	97.5	Very high	96.3	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-70.7	-37.2	174.5	0	0	0	0	0	111.5	L312 H315 P316 A320 K321 I322 F424	L312-A318 HydrophobicContact CD2-CB 4.13Å; H315-A318 HydrophobicContact CB-CB 4.4Å; H315-A318 WeakPolarHBondContact O-CB 3.45Å; H315-A318 PolarHBondContact O-N 3.36Å; P316-A318 PolarHBondContact O-N 3.22Å; A318-A320 VanDerWaalsContact C-N 3.35Å; A318-A320 PolarHBondContact O-N 3.48Å; A318-K321 PolarHBondContact O-N 3.06Å; A318-I322 WeakPolarHBondContact O-CG1 3.17Å; A318-I322 PolarHBondContact O-N 2.81Å; A318-F424 HydrophobicContact CB-CE1 3.97Å
319	I	97.1	Very high	95.9	Very high	32 Å²	32	47.4 Å²	47.4	16%	0.164	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-47.3	173.5	-64.4	174.4	0	0	0	110.2	L312 P316 K321 I322 Q323 V473 W478	L312-I319 HydrophobicContact CB-CD1 4.27Å; L312-I319 HydrophobicContact CB-CG1 4.11Å; L312-I319 HydrophobicContact CD2-CG1 4.2Å; L312-I319 WeakPolarHBondContact O-CD1 3.23Å; P316-I319 WeakPolarHBondContact O-CB 3.48Å; P316-I319 PolarHBondContact O-N 3.37Å; P316-I319 VanDerWaalsContact O-N 3.09Å; I319-K321 VanDerWaalsContact C-N 3.32Å; I319-K321 PolarHBondContact O-N 3.34Å; I319-I322 PolarHBondContact O-N 3.48Å; I319-I322 VanDerWaalsContact O-N 3.15Å; I319-Q323 HydrophobicContact CG2-CG 4.45Å; I319-Q323 WeakPolarHBondContact O-CG 3.38Å; I319-Q323 PolarHBondContact O-N 3.49Å; I319-V473 HydrophobicContact CG2-CG1 4.34Å; I319-V473 HydrophobicContact CG2-CG2 4.19Å; I319-W478 HydrophobicContact CD1-CH2 3.92Å; I319-W478 HydrophobicContact CD1-CZ2 3.9Å
320	A	96.6	Very high	95.3	Very high	53 Å²	53	50.1 Å²	50.1	44%	0.438	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-40.9	178.8	0	0	0	0	0	112.6	P316 A318 Q323 Q324	P316-A320 PolarHBondContact O-N 3.43Å; P316-A320 VanDerWaalsContact O-N 3.08Å; A318-A320 VanDerWaalsContact C-N 3.35Å; A318-A320 PolarHBondContact O-N 3.48Å; A320-Q323 WeakPolarHBondContact O-CB 3.47Å; A320-Q323 PolarHBondContact O-N 3.38Å; A320-Q324 PolarHBondContact O-N 3.38Å
321	K	97.1	Very high	94.7	Very high	77 Å²	77	51.6 Å²	51.6	34%	0.335	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-37.1	175.8	-73.4	179.4	179.5	179.8	0	112.9	A317 A318 I319 Q324 E325 Y364 E427	A317-K321 PolarHBondContact O-N 2.96Å; A318-K321 PolarHBondContact O-N 3.06Å; I319-K321 VanDerWaalsContact C-N 3.32Å; I319-K321 PolarHBondContact O-N 3.34Å; K321-Q324 PolarHBondContact O-N 3.44Å; K321-E325 PolarHBondContact O-N 2.91Å; K321-Y364 HydrophobicContact CB-CD1 3.77Å; K321-Y364 HydrophobicContact CB-CE1 3.31Å; K321-Y364 HydrophobicContact CB-CE2 4.21Å; K321-Y364 HydrophobicContact CB-CG 4.4Å; K321-Y364 HydrophobicContact CD-CE1 4.29Å; K321-Y364 HydrophobicContact CD-CE2 3.83Å; K321-Y364 WeakPolarHBondContact CD-OH 3.49Å; K321-Y364 HydrophobicContact CG-CE1 4.43Å; K321-E427 IonicContact NZ-OE1 2.54Å; K321-E427 PolarHBondContact NZ-OE1 3.27Å
322	I	97	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-46.2	171	-65.4	166.5	0	0	0	109.7	L312 A318 I319 Q324 E325 L326 Y364 V365 V368 V473	L312-I322 HydrophobicContact CD1-CD1 4.36Å; L312-I322 HydrophobicContact CD2-CD1 3.82Å; A318-I322 WeakPolarHBondContact O-CG1 3.17Å; A318-I322 PolarHBondContact O-N 2.81Å; I319-I322 PolarHBondContact O-N 3.48Å; I319-I322 VanDerWaalsContact O-N 3.15Å; I322-Q324 VanDerWaalsContact C-N 3.31Å; I322-Q324 PolarHBondContact O-N 2.9Å; I322-E325 PolarHBondContact O-N 2.79Å; I322-L326 HydrophobicContact CG2-CD1 3.92Å; I322-L326 HydrophobicContact CG2-CG 4.12Å; I322-L326 VanDerWaalsContact O-CG 3.28Å; I322-L326 WeakPolarHBondContact O-CG 3.09Å; I322-L326 PolarHBondContact O-N 2.97Å; I322-Y364 HydrophobicContact CG1-CD1 3.82Å; I322-Y364 HydrophobicContact CG1-CE1 3.94Å; I322-V365 HydrophobicContact CB-CG2 4.49Å; I322-V365 HydrophobicContact CG1-CG2 4.13Å; I322-V365 HydrophobicContact CG2-CG2 3.78Å; I322-V368 HydrophobicContact CD1-CG1 4.43Å; I322-V368 HydrophobicContact CD1-CG2 4.2Å; I322-V368 HydrophobicContact CG1-CG2 4.39Å; I322-V473 HydrophobicContact CB-CG1 4.44Å; I322-V473 HydrophobicContact CB-CG2 4.3Å; I322-V473 HydrophobicContact CD1-CG2 4.29Å; I322-V473 HydrophobicContact CG2-CB 4.13Å; I322-V473 HydrophobicContact CG2-CG1 3.98Å; I322-V473 HydrophobicContact CG2-CG2 3.92Å
323	Q	95.1	Very high	91.7	Very high	73 Å²	73	60.4 Å²	60.4	34%	0.341	36%	0.36	S	S	.	.	H	α-helix	trans	-57.5	-44.7	177.1	-70.3	173.8	-30.5	0	0	111.8	I319 A320 L326 S327 V473	I319-Q323 HydrophobicContact CG2-CG 4.45Å; I319-Q323 WeakPolarHBondContact O-CG 3.38Å; I319-Q323 PolarHBondContact O-N 3.49Å; A320-Q323 WeakPolarHBondContact O-CB 3.47Å; A320-Q323 PolarHBondContact O-N 3.38Å; Q323-L326 PolarHBondContact O-N 2.79Å; Q323-S327 WeakPolarHBondContact O-CB 3.46Å; Q323-S327 PolarHBondContact O-N 3.47Å; Q323-S327 PolarHBondContact O-OG 3.16Å; Q323-S327 VanDerWaalsContact O-OG 3.12Å; Q323-V473 HydrophobicContact CB-CG1 4.35Å; Q323-V473 HydrophobicContact CG-CG1 3.23Å
324	Q	95.6	Very high	89.8	Confident	142 Å²	142	61 Å²	61	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-60.1	-45.6	175.9	-173.3	-177.9	6.4	0	0	112	A320 K321 I322 S327 A328	A320-Q324 PolarHBondContact O-N 3.38Å; K321-Q324 PolarHBondContact O-N 3.44Å; I322-Q324 VanDerWaalsContact C-N 3.31Å; I322-Q324 PolarHBondContact O-N 2.9Å; Q324-S327 PolarHBondContact O-N 3.32Å; Q324-A328 WeakPolarHBondContact O-CB 3.45Å; Q324-A328 PolarHBondContact O-N 2.86Å
325	E	95.9	Very high	88.2	Confident	29 Å²	29	58.5 Å²	58.5	14%	0.136	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-44	176.9	178.5	170.2	-114.9	0	0	111.9	K321 I322 A328 Q329 L362 R363 Y364 V365	K321-E325 PolarHBondContact O-N 2.91Å; I322-E325 PolarHBondContact O-N 2.79Å; E325-A328 PolarHBondContact O-N 2.77Å; E325-Q329 WeakPolarHBondContact O-CG 3.33Å; E325-Q329 PolarHBondContact O-N 3.27Å; E325-Q329 VanDerWaalsContact O-N 3.08Å; E325-L362 HydrophobicContact CG-CD2 4.02Å; E325-R363 PolarHBondContact OE1-N 3.11Å; E325-Y364 PolarHBondContact OE1-N 3.21Å; E325-Y364 WeakPolarHBondContact OE2-CB 3.47Å; E325-Y364 PolarHBondContact OE2-N 2.88Å; E325-V365 WeakPolarHBondContact OE2-CG2 3.42Å; E325-V365 PolarHBondContact OE2-N 3.02Å
326	L	93.4	Very high	86.2	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-44.1	177.6	-65.9	178.8	0	0	0	111.6	I322 Q323 Q329 G330 L331 G332 L362 V470 V473 R474	I322-L326 HydrophobicContact CG2-CD1 3.92Å; I322-L326 HydrophobicContact CG2-CG 4.12Å; I322-L326 VanDerWaalsContact O-CG 3.28Å; I322-L326 WeakPolarHBondContact O-CG 3.09Å; I322-L326 PolarHBondContact O-N 2.97Å; Q323-L326 PolarHBondContact O-N 2.79Å; L326-Q329 PolarHBondContact O-N 2.78Å; L326-G330 PolarHBondContact O-N 3.19Å; L326-L331 HydrophobicContact CB-CB 4.39Å; L326-L331 HydrophobicContact CD2-CB 4.2Å; L326-L331 HydrophobicContact CD2-CD1 4.47Å; L326-L331 CarbonylContact O-C 3.58Å; L326-L331 WeakPolarHBondContact O-CA 3.34Å; L326-L331 PolarHBondContact O-N 3.36Å; L326-G332 PolarHBondContact O-N 2.77Å; L326-L362 HydrophobicContact CD2-CD1 4.14Å; L326-L362 HydrophobicContact CD2-CD2 3.87Å; L326-V470 HydrophobicContact CD1-CG1 4.36Å; L326-V470 HydrophobicContact CD2-CG1 4.19Å; L326-V470 HydrophobicContact CD2-CG2 4.03Å; L326-V473 HydrophobicContact CD1-CB 4.46Å; L326-V473 HydrophobicContact CD1-CG1 4.15Å; L326-R474 HydrophobicContact CD1-CG 4.04Å
327	S	91.9	Very high	84.7	Confident	81 Å²	81	56.9 Å²	56.9	57%	0.566	37%	0.369	S	S	*	.	H	α-helix	trans	-60.9	-44.2	175.4	-66.5	0	0	0	0	111.8	Q323 Q324 Q329 G330	Q323-S327 WeakPolarHBondContact O-CB 3.46Å; Q323-S327 PolarHBondContact O-N 3.47Å; Q323-S327 PolarHBondContact O-OG 3.16Å; Q323-S327 VanDerWaalsContact O-OG 3.12Å; Q324-S327 PolarHBondContact O-N 3.32Å; S327-Q329 PolarHBondContact O-N 2.79Å; S327-G330 PolarHBondContact O-N 2.82Å
328	A	92.2	Very high	82.7	Confident	82 Å²	82	57.4 Å²	57.4	68%	0.678	37%	0.373	S	S	*	.	H	α-helix	trans	-63.3	-29.1	178.2	0	0	0	0	0	113.4	Q324 E325	Q324-A328 WeakPolarHBondContact O-CB 3.45Å; Q324-A328 PolarHBondContact O-N 2.86Å; E325-A328 PolarHBondContact O-N 2.77Å
329	Q	90	Very high	80.6	Confident	77 Å²	77	61.8 Å²	61.8	36%	0.36	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	4.2	176.5	-65.4	-66.6	-40.7	0	0	113.5	E325 L326 S327 L331 L362	E325-Q329 WeakPolarHBondContact O-CG 3.33Å; E325-Q329 PolarHBondContact O-N 3.27Å; E325-Q329 VanDerWaalsContact O-N 3.08Å; L326-Q329 PolarHBondContact O-N 2.78Å; S327-Q329 PolarHBondContact O-N 2.79Å; Q329-L331 HydrophobicContact CB-CD1 4.06Å; Q329-L331 HydrophobicContact CB-CG 4.09Å; Q329-L331 PolarHBondContact O-N 2.86Å; Q329-L362 HydrophobicContact CG-CD2 4.13Å
330	G	85.9	Confident	78.4	Confident	58 Å²	58	65.6 Å²	65.6	60%	0.598	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	17.5	-176.3	0	0	0	0	0	114.1	L326 S327	L326-G330 PolarHBondContact O-N 3.19Å; S327-G330 PolarHBondContact O-N 2.82Å
331	L	84.6	Confident	76	Confident	36 Å²	36	68.1 Å²	68.1	19%	0.188	44%	0.443	C	S	.	.			trans	-102.7	2	-177.8	-59.1	177.1	0	0	0	113.2	L326 Q329 H333 L354 L362 R474	L326-L331 HydrophobicContact CB-CB 4.39Å; L326-L331 HydrophobicContact CD2-CB 4.2Å; L326-L331 HydrophobicContact CD2-CD1 4.47Å; L326-L331 CarbonylContact O-C 3.58Å; L326-L331 WeakPolarHBondContact O-CA 3.34Å; L326-L331 PolarHBondContact O-N 3.36Å; Q329-L331 HydrophobicContact CB-CD1 4.06Å; Q329-L331 HydrophobicContact CB-CG 4.09Å; Q329-L331 PolarHBondContact O-N 2.86Å; L331-H333 VanDerWaalsContact C-N 3.35Å; L331-H333 PolarHBondContact O-N 3.26Å; L331-L354 HydrophobicContact CD1-CD2 3.71Å; L331-L354 HydrophobicContact CD2-CD2 3.64Å; L331-L354 HydrophobicContact CG-CD2 4.28Å; L331-L362 HydrophobicContact CD1-CD2 4.14Å; L331-R474 PolarHBondContact O-NE 3.14Å
332	G	68.5	Low	73.3	Confident	33 Å²	33	70.9 Å²	70.9	34%	0.34	47%	0.466	S	S	.	.			trans	-75	-14.9	-176.5	0	0	0	0	0	115.5	L326	L326-G332 PolarHBondContact O-N 2.77Å
333	H	63.9	Low	71.1	Confident	161 Å²	161	73.1 Å²	73.1	75%	0.745	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-82	125.4	-176.6	-71.5	78.4	0	0	0	111.6	L331 R474	L331-H333 VanDerWaalsContact C-N 3.35Å; L331-H333 PolarHBondContact O-N 3.26Å; H333-R474 PolarHBondContact O-NH2 3.16Å
334	A	58.4	Low	69	Low	45 Å²	45	73.6 Å²	73.6	37%	0.372	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-85.3	149.9	162.6	0	0	0	0	0	109.2	G336	A334-G336 PolarHBondContact O-N 3.16Å
335	C	62.1	Low	67.3	Low	16 Å²	16	69.1 Å²	69.1	11%	0.108	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-59.6	139.3	176.8	-179.2	0	0	0	0	110.6	C337 R345 C348 C350 E351	C335-C337 VanDerWaalsContact C-N 3.32Å; C335-C337 WeakPolarHBondContact CB-SG 3.14Å; C335-C337 PolarHBondContact O-N 3.23Å; C335-C337 WeakPolarHBondContact SG-CB 3.31Å; C335-C337 PolarHBondContact SG-N 2.81Å; C335-C337 CovalentContact SG-SG 2.09Å; C335-C337 PolarHBondContact SG-SG 3.48Å; C335-R345 PolarHBondContact O-NH1 2.97Å; C335-R345 VanDerWaalsContact O-NH1 3.14Å; C335-R345 PolarHBondContact O-NH2 3.19Å; C335-R345 PolarHBondContact SG-NH2 2.96Å; C335-C348 VanDerWaalsContact CB-SG 3.55Å; C335-C350 HydrophobicContact CB-CB 3.91Å; C335-C350 VanDerWaalsContact SG-CB 3.53Å; C335-C350 PolarHBondContact SG-SG 2.97Å; C335-E351 HydrophobicContact CB-CG 4.1Å; C335-E351 PolarHBondContact N-OE1 3.05Å
336	G	55.7	Low	65.4	Low	72 Å²	72	71.2 Å²	71.2	74%	0.742	49%	0.492	S	S	*	.			trans	-81.5	6.7	168.9	0	0	0	0	0	116.3	A334	A334-G336 PolarHBondContact O-N 3.16Å
337	C	63.3	Low	63.7	Low	47 Å²	47	75.9 Å²	75.9	32%	0.318	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-59.8	138.5	175.2	-29.1	0	0	0	0	111.4	C335 R345 C350	C335-C337 VanDerWaalsContact C-N 3.32Å; C335-C337 WeakPolarHBondContact CB-SG 3.14Å; C335-C337 PolarHBondContact O-N 3.23Å; C335-C337 WeakPolarHBondContact SG-CB 3.31Å; C335-C337 PolarHBondContact SG-N 2.81Å; C335-C337 CovalentContact SG-SG 2.09Å; C335-C337 PolarHBondContact SG-SG 3.48Å; C337-R345 PolarHBondContact O-NE 2.94Å; C337-R345 PolarHBondContact O-NH1 3.39Å; C337-R345 PolarHBondContact O-NH2 3.28Å; C337-R345 PolarHBondContact SG-NH2 3.48Å; C337-R345 VanDerWaalsContact SG-NH2 3.37Å; C337-C350 PolarHBondContact SG-SG 2.98Å
338	A	53.8	Low	62.3	Low	84 Å²	84	73.3 Å²	73.3	69%	0.694	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-64.2	140.1	176.4	0	0	0	0	0	111.7
339	P	54.9	Low	60.8	Low	97 Å²	97	75.5 Å²	75.5	63%	0.63	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-62.4	140.3	163	21.9	-24	0	0	0	109.6
340	L	50.9	Low	59.6	Low	111 Å²	111	74.8 Å²	74.8	58%	0.581	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-65.2	145.3	171.5	-87.7	135.1	0	0	0	109.7	T342 P346	L340-T342 PolarHBondContact O-N 2.86Å; L340-P346 VanDerWaalsContact CD1-CD 3.48Å; L340-P346 HydrophobicContact CD1-CG 3.67Å
341	A	46	Very low	58.7	Low	107 Å²	107	72.6 Å²	72.6	88%	0.884	49%	0.486	S	S	*	.	S	Bend	trans	-56.5	-20.1	-176.6	0	0	0	0	0	114.3
342	T	41.2	Very low	58	Low	134 Å²	134	75.4 Å²	75.4	82%	0.822	51%	0.506	S	S	*	.	S	Bend	trans	-143.6	101.4	176.3	52.3	0	0	0	0	110.6	L340	L340-T342 PolarHBondContact O-N 2.86Å
343	G	49.6	Very low	58.8	Low	48 Å²	48	76.4 Å²	76.4	50%	0.495	50%	0.504	S	S	.	.	S	Bend	trans	122.8	169	166.8	0	0	0	0	0	115.3
344	P	51	Low	60	Low	83 Å²	83	69.1 Å²	69.1	54%	0.539	47%	0.47	S	S	.	.	S	Bend	trans	-62.9	141.6	177.6	26.1	-33	0	0	0	110.7
345	R	60.1	Low	61.6	Low	47 Å²	47	69.9 Å²	69.9	18%	0.177	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-58.5	129.3	-176.1	-165.1	169.2	172.4	-177.4	-10.1	111.5	C335 C337	C335-R345 PolarHBondContact O-NH1 2.97Å; C335-R345 VanDerWaalsContact O-NH1 3.14Å; C335-R345 PolarHBondContact O-NH2 3.19Å; C335-R345 PolarHBondContact SG-NH2 2.96Å; C337-R345 PolarHBondContact O-NE 2.94Å; C337-R345 PolarHBondContact O-NH1 3.39Å; C337-R345 PolarHBondContact O-NH2 3.28Å; C337-R345 PolarHBondContact SG-NH2 3.48Å; C337-R345 VanDerWaalsContact SG-NH2 3.37Å
346	P	56.8	Low	63	Low	74 Å²	74	71 Å²	71	48%	0.481	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-63.5	156.8	179.4	23.9	-32.2	0	0	0	111.5	L340 C348	L340-P346 VanDerWaalsContact CD1-CD 3.48Å; L340-P346 HydrophobicContact CD1-CG 3.67Å; P346-C348 PolarHBondContact O-N 2.84Å; P346-C348 VanDerWaalsContact O-N 3.12Å
347	D	57.6	Low	64.7	Low	101 Å²	101	70 Å²	70	54%	0.54	46%	0.462	S	S	.	.			trans	-59.8	115.8	174	-75.6	-19.8	0	0	0	109
348	C	61.7	Low	66	Low	27 Å²	27	68 Å²	68	18%	0.182	45%	0.449	C	S	.	.			trans	-105.8	142	-178.2	98.1	0	0	0	0	109.1	C335 P346 C350	C335-C348 VanDerWaalsContact CB-SG 3.55Å; P346-C348 PolarHBondContact O-N 2.84Å; P346-C348 VanDerWaalsContact O-N 3.12Å; C348-C350 WeakPolarHBondContact CB-SG 3.4Å; C348-C350 PolarHBondContact O-N 3.29Å; C348-C350 VanDerWaalsContact O-N 3.16Å; C348-C350 WeakPolarHBondContact SG-CB 3.21Å; C348-C350 CovalentContact SG-SG 2.05Å; C348-C350 PolarHBondContact SG-SG 3.38Å
349	S	61.2	Low	67.9	Low	128 Å²	128	64 Å²	64	90%	0.895	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.7	178.6	51.9	0	0	0	0	114.2
350	C	63.8	Low	69.7	Low	61 Å²	61	62.5 Å²	62.5	41%	0.412	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-17.4	-178.2	13.4	0	0	0	0	114.5	C335 C337 C348 P352	C335-C350 HydrophobicContact CB-CB 3.91Å; C335-C350 VanDerWaalsContact SG-CB 3.53Å; C335-C350 PolarHBondContact SG-SG 2.97Å; C337-C350 PolarHBondContact SG-SG 2.98Å; C348-C350 WeakPolarHBondContact CB-SG 3.4Å; C348-C350 PolarHBondContact O-N 3.29Å; C348-C350 VanDerWaalsContact O-N 3.16Å; C348-C350 WeakPolarHBondContact SG-CB 3.21Å; C348-C350 CovalentContact SG-SG 2.05Å; C348-C350 PolarHBondContact SG-SG 3.38Å; C350-P352 WeakPolarHBondContact O-CD 3.31Å
351	E	67.9	Low	71.7	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.056	41%	0.413	C	S	.	.	S	Bend	trans	-110.9	88.7	173.8	-75.1	175.7	-175.4	0	0	108.7	R166 R170 C335	R166-E351 WeakPolarHBondContact CD-OE2 3.42Å; R166-E351 IonicContact CZ-OE2 3.41Å; R166-E351 IonicContact NE-OE2 3.81Å; R166-E351 PolarHBondContact NE-OE2 3.45Å; R166-E351 PolarHBondContact NH1-O 2.85Å; R166-E351 IonicContact NH1-OE2 2.71Å; R170-E351 IonicContact CZ-OE2 3.47Å; R170-E351 IonicContact NH2-OE1 3.34Å; R170-E351 IonicContact NH2-OE2 3.09Å; R170-E351 PolarHBondContact NH2-OE2 3.4Å; C335-E351 HydrophobicContact CB-CG 4.1Å; C335-E351 PolarHBondContact N-OE1 3.05Å
352	P	70.5	Confident	74.1	Confident	95 Å²	95	58 Å²	58	62%	0.617	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-59.8	142.5	-177.5	24.8	-33.2	0	0	0	110.5	C350	C350-P352 WeakPolarHBondContact O-CD 3.31Å
353	D	83.6	Confident	76.6	Confident	54 Å²	54	59.7 Å²	59.7	29%	0.289	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-65.3	138.9	172.5	-65.9	-30.7	0	0	0	109.5	P159 R163	P159-D353 HydrophobicContact CB-CB 3.82Å; P159-D353 HydrophobicContact CG-CB 4.35Å; R163-D353 IonicContact CZ-OD2 3.92Å; R163-D353 VanDerWaalsContact CZ-OD2 3.23Å; R163-D353 IonicContact NE-OD1 2.58Å; R163-D353 IonicContact NE-OD2 3.44Å; R163-D353 PolarHBondContact NE-OD2 2.93Å; R163-D353 IonicContact NH2-OD2 2.88Å; R163-D353 PolarHBondContact NH2-OD2 3.4Å
354	L	89.9	Confident	78.9	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-71.7	139.3	175.8	-66.8	174.2	0	0	0	109.5	V158 L331 A358 L359 L467 V470	V158-L354 WeakPolarHBondContact CG1-O 3.31Å; L331-L354 HydrophobicContact CD1-CD2 3.71Å; L331-L354 HydrophobicContact CD2-CD2 3.64Å; L331-L354 HydrophobicContact CG-CD2 4.28Å; L354-A358 HydrophobicContact CB-CB 4.49Å; L354-A358 HydrophobicContact CD2-CB 4.08Å; L354-L359 HydrophobicContact CD1-CD2 4.02Å; L354-L467 HydrophobicContact CB-CD2 4.28Å; L354-L467 HydrophobicContact CD1-CD2 3.91Å; L354-V470 HydrophobicContact CD1-CG1 4.08Å; L354-V470 HydrophobicContact CD1-CG2 4.41Å
355	S	91.4	Very high	81.1	Confident	62 Å²	62	55.1 Å²	55.1	43%	0.434	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-85.4	161	167.6	66.9	0	0	0	0	110.7	A357 A358 L359	S355-A357 PolarHBondContact O-N 2.88Å; S355-A358 WeakPolarHBondContact O-CB 3.33Å; S355-A358 PolarHBondContact O-N 3.36Å; S355-A358 PolarHBondContact OG-N 3.38Å; S355-A358 VanDerWaalsContact OG-N 3.13Å; S355-L359 PolarHBondContact O-N 3.21Å
356	L	91.9	Very high	82.9	Confident	39 Å²	39	54.7 Å²	54.7	20%	0.204	32%	0.32	C	S	.	.	H	α-helix	trans	-57.5	-33.3	172	-171.7	65.8	0	0	0	111.8	R151 L154 E155 V158 L359 G360	R151-L356 HydrophobicContact CG-CD2 3.96Å; L154-L356 HydrophobicContact CB-CD2 4.19Å; E155-L356 HydrophobicContact CG-CB 3.79Å; E155-L356 HydrophobicContact CG-CD2 3.86Å; V158-L356 HydrophobicContact CG2-CD1 4.18Å; L356-L359 PolarHBondContact O-N 2.99Å; L356-G360 PolarHBondContact O-N 3.3Å
357	A	91.8	Very high	84.8	Confident	50 Å²	50	51.7 Å²	51.7	41%	0.413	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-36.4	174.7	0	0	0	0	0	112.6	S355 G360 R361	S355-A357 PolarHBondContact O-N 2.88Å; A357-G360 PolarHBondContact O-N 3.43Å; A357-R361 PolarHBondContact O-N 3.43Å; A357-R361 PolarHBondContact O-NH1 3.25Å
358	A	91.4	Very high	86.7	Confident	6 Å²	6	46.9 Å²	46.9	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-44	174.3	0	0	0	0	0	111.4	L354 S355 G360 R361	L354-A358 HydrophobicContact CB-CB 4.49Å; L354-A358 HydrophobicContact CD2-CB 4.08Å; S355-A358 WeakPolarHBondContact O-CB 3.33Å; S355-A358 PolarHBondContact O-N 3.36Å; S355-A358 PolarHBondContact OG-N 3.38Å; S355-A358 VanDerWaalsContact OG-N 3.13Å; A358-G360 VanDerWaalsContact C-N 3.27Å; A358-G360 PolarHBondContact O-N 3.02Å; A358-R361 PolarHBondContact O-N 3.39Å
359	L	93.3	Very high	88.4	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-39.4	173.3	-69.7	176.8	0	0	0	112.4	V158 L354 S355 L356 R361 L362 A463 Q466 L467	V158-L359 HydrophobicContact CG1-CD1 3.98Å; V158-L359 HydrophobicContact CG2-CD1 4.22Å; L354-L359 HydrophobicContact CD1-CD2 4.02Å; S355-L359 PolarHBondContact O-N 3.21Å; L356-L359 PolarHBondContact O-N 2.99Å; L359-R361 PolarHBondContact O-N 2.9Å; L359-L362 HydrophobicContact CD2-CD1 4.25Å; L359-L362 PolarHBondContact O-N 3.15Å; L359-L362 VanDerWaalsContact O-N 3.13Å; L359-A463 HydrophobicContact CD1-CB 4.13Å; L359-Q466 HydrophobicContact CD2-CB 4.07Å; L359-L467 HydrophobicContact CD1-CD1 4.45Å; L359-L467 HydrophobicContact CD1-CD2 4.07Å; L359-L467 HydrophobicContact CD1-CG 3.99Å; L359-L467 HydrophobicContact CD2-CD2 3.84Å; L359-L467 HydrophobicContact CD2-CG 4.15Å; L359-L467 HydrophobicContact CG-CD2 4.38Å
360	G	91.9	Very high	90.1	Very high	64 Å²	64	40.8 Å²	40.8	66%	0.66	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.6	176.4	0	0	0	0	0	115	L356 A357 A358	L356-G360 PolarHBondContact O-N 3.3Å; A357-G360 PolarHBondContact O-N 3.43Å; A358-G360 VanDerWaalsContact C-N 3.27Å; A358-G360 PolarHBondContact O-N 3.02Å
361	R	93.4	Very high	91.6	Very high	124 Å²	124	37.9 Å²	37.9	47%	0.468	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-14.3	175.4	-65.4	-169	-60.7	-89.2	5.8	113.7	A357 A358 L359 R363	A357-R361 PolarHBondContact O-N 3.43Å; A357-R361 PolarHBondContact O-NH1 3.25Å; A358-R361 PolarHBondContact O-N 3.39Å; L359-R361 PolarHBondContact O-N 2.9Å; R361-R363 VanDerWaalsContact C-N 3.33Å; R361-R363 PolarHBondContact O-N 3.12Å
362	L	95.4	Very high	93	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.208	C	C	.	.			trans	-83	76.5	179.1	-57.8	178.7	0	0	0	110.3	E325 L326 Q329 L331 L359 V365 D366 V470	E325-L362 HydrophobicContact CG-CD2 4.02Å; L326-L362 HydrophobicContact CD2-CD1 4.14Å; L326-L362 HydrophobicContact CD2-CD2 3.87Å; Q329-L362 HydrophobicContact CG-CD2 4.13Å; L331-L362 HydrophobicContact CD1-CD2 4.14Å; L359-L362 HydrophobicContact CD2-CD1 4.25Å; L359-L362 PolarHBondContact O-N 3.15Å; L359-L362 VanDerWaalsContact O-N 3.13Å; L362-V365 HydrophobicContact CB-CB 3.9Å; L362-V365 HydrophobicContact CB-CG2 4.12Å; L362-V365 HydrophobicContact CD1-CG2 4.45Å; L362-D366 PolarHBondContact O-N 3.19Å; L362-V470 HydrophobicContact CD1-CG2 3.64Å
363	R	95	Very high	94.3	Very high	169 Å²	169	33 Å²	33	64%	0.638	18%	0.179	S	C	*	.	H	α-helix	trans	-67	-42.8	-174.1	-66.2	-174.7	177.4	-169.7	-0.8	112	E325 R361 D366 C367	E325-R363 PolarHBondContact OE1-N 3.11Å; R361-R363 VanDerWaalsContact C-N 3.33Å; R361-R363 PolarHBondContact O-N 3.12Å; R363-D366 PolarHBondContact O-N 3.45Å; R363-C367 PolarHBondContact O-N 2.8Å; R363-C367 PolarHBondContact O-SG 3.28Å
364	Y	97.1	Very high	94.8	Very high	35 Å²	35	30.7 Å²	30.7	14%	0.137	17%	0.166	C	C	.	.	H	α-helix	trans	-70.5	-39.7	179.4	-172.1	-100.2	0	0	0	111.2	K321 I322 E325 D366 C367 V368 P426 E427	K321-Y364 HydrophobicContact CB-CD1 3.77Å; K321-Y364 HydrophobicContact CB-CE1 3.31Å; K321-Y364 HydrophobicContact CB-CE2 4.21Å; K321-Y364 HydrophobicContact CB-CG 4.4Å; K321-Y364 HydrophobicContact CD-CE1 4.29Å; K321-Y364 HydrophobicContact CD-CE2 3.83Å; K321-Y364 WeakPolarHBondContact CD-OH 3.49Å; K321-Y364 HydrophobicContact CG-CE1 4.43Å; I322-Y364 HydrophobicContact CG1-CD1 3.82Å; I322-Y364 HydrophobicContact CG1-CE1 3.94Å; E325-Y364 PolarHBondContact OE1-N 3.21Å; E325-Y364 WeakPolarHBondContact OE2-CB 3.47Å; E325-Y364 PolarHBondContact OE2-N 2.88Å; Y364-D366 VanDerWaalsContact C-N 3.32Å; Y364-D366 PolarHBondContact O-N 3.22Å; Y364-C367 WeakPolarHBondContact O-CB 3.12Å; Y364-C367 PolarHBondContact O-N 2.73Å; Y364-C367 VanDerWaalsContact O-N 3.16Å; Y364-V368 HydrophobicContact CD1-CG2 4.05Å; Y364-V368 HydrophobicContact CE1-CG2 3.65Å; Y364-V368 WeakPolarHBondContact O-CG2 3.36Å; Y364-V368 PolarHBondContact O-N 3.38Å; Y364-P426 HydrophobicContact CE2-CB 4Å; Y364-E427 HydrophobicContact CE2-CG 4.31Å
365	V	97.8	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60	-41.5	170.9	178.9	0	0	0	0	111.4	I322 E325 L362 C367 V368 V369 Q466 A469	I322-V365 HydrophobicContact CB-CG2 4.49Å; I322-V365 HydrophobicContact CG1-CG2 4.13Å; I322-V365 HydrophobicContact CG2-CG2 3.78Å; E325-V365 WeakPolarHBondContact OE2-CG2 3.42Å; E325-V365 PolarHBondContact OE2-N 3.02Å; L362-V365 HydrophobicContact CB-CB 3.9Å; L362-V365 HydrophobicContact CB-CG2 4.12Å; L362-V365 HydrophobicContact CD1-CG2 4.45Å; V365-C367 VanDerWaalsContact C-N 3.34Å; V365-C367 PolarHBondContact O-N 3.46Å; V365-V368 WeakPolarHBondContact O-CB 3.43Å; V365-V368 PolarHBondContact O-N 3.27Å; V365-V369 WeakPolarHBondContact O-CG2 3.44Å; V365-V369 PolarHBondContact O-N 3.4Å; V365-Q466 HydrophobicContact CG1-CB 3.97Å; V365-Q466 HydrophobicContact CG1-CG 3.99Å; V365-A469 HydrophobicContact CG1-CB 3.94Å
366	D	96.7	Very high	95.1	Very high	37 Å²	37	29.8 Å²	29.8	20%	0.198	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-42.3	173.2	-179	66.2	0	0	0	112.2	L362 R363 Y364 V368 V369 K370	L362-D366 PolarHBondContact O-N 3.19Å; R363-D366 PolarHBondContact O-N 3.45Å; Y364-D366 VanDerWaalsContact C-N 3.32Å; Y364-D366 PolarHBondContact O-N 3.22Å; D366-V368 PolarHBondContact O-N 2.92Å; D366-V369 PolarHBondContact O-N 2.87Å; D366-K370 WeakPolarHBondContact O-CB 3.27Å; D366-K370 WeakPolarHBondContact O-CG 3.29Å; D366-K370 PolarHBondContact O-N 3.49Å; D366-K370 WeakPolarHBondContact OD2-CE 3.44Å; D366-K370 IonicContact OD2-NZ 2.74Å; D366-K370 PolarHBondContact OD2-NZ 2.89Å
367	C	96.5	Very high	95.2	Very high	11 Å²	11	28 Å²	28	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-43.6	174.8	-68.7	0	0	0	0	112.2	R363 Y364 V365 K370 E371 P426 F429	R363-C367 PolarHBondContact O-N 2.8Å; R363-C367 PolarHBondContact O-SG 3.28Å; Y364-C367 WeakPolarHBondContact O-CB 3.12Å; Y364-C367 PolarHBondContact O-N 2.73Å; Y364-C367 VanDerWaalsContact O-N 3.16Å; V365-C367 VanDerWaalsContact C-N 3.34Å; V365-C367 PolarHBondContact O-N 3.46Å; C367-K370 PolarHBondContact O-N 3.45Å; C367-E371 PolarHBondContact O-N 3.22Å; C367-P426 HydrophobicContact CB-CB 4.08Å; C367-P426 WeakPolarHBondContact CB-O 3.46Å; C367-F429 HydrophobicContact CB-CB 4.18Å; C367-F429 PolarHBondContact SG-O 3.41Å
368	V	97.9	Very high	95.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-50.1	175.1	164.9	0	0	0	0	110.4	L308 L312 I322 Y364 V365 D366 K370 E371 V372 F424 P426	L308-V368 HydrophobicContact CD1-CG1 3.82Å; L312-V368 HydrophobicContact CD2-CG1 4.08Å; I322-V368 HydrophobicContact CD1-CG1 4.43Å; I322-V368 HydrophobicContact CD1-CG2 4.2Å; I322-V368 HydrophobicContact CG1-CG2 4.39Å; Y364-V368 HydrophobicContact CD1-CG2 4.05Å; Y364-V368 HydrophobicContact CE1-CG2 3.65Å; Y364-V368 WeakPolarHBondContact O-CG2 3.36Å; Y364-V368 PolarHBondContact O-N 3.38Å; V365-V368 WeakPolarHBondContact O-CB 3.43Å; V365-V368 PolarHBondContact O-N 3.27Å; D366-V368 PolarHBondContact O-N 2.92Å; V368-K370 VanDerWaalsContact C-N 3.29Å; V368-K370 PolarHBondContact O-N 2.93Å; V368-E371 PolarHBondContact O-N 2.98Å; V368-V372 HydrophobicContact CG1-CG2 4.43Å; V368-V372 VanDerWaalsContact O-CG2 3.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.36Å; V368-V372 PolarHBondContact O-N 3.42Å; V368-F424 HydrophobicContact CG1-CZ 4.26Å; V368-P426 HydrophobicContact CB-CG 4.41Å; V368-P426 HydrophobicContact CG2-CB 3.84Å; V368-P426 HydrophobicContact CG2-CG 3.62Å
369	V	98.1	Very high	95.5	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-40.5	178.6	170.7	0	0	0	0	111.1	V365 D366 V372 L373 L465 Q466	V365-V369 WeakPolarHBondContact O-CG2 3.44Å; V365-V369 PolarHBondContact O-N 3.4Å; D366-V369 PolarHBondContact O-N 2.87Å; V369-V372 PolarHBondContact O-N 3.07Å; V369-L373 HydrophobicContact CG1-CD1 4.12Å; V369-L373 WeakPolarHBondContact O-CG 3.35Å; V369-L373 PolarHBondContact O-N 3.46Å; V369-L373 VanDerWaalsContact O-N 3.09Å; V369-L465 HydrophobicContact CG1-CB 3.92Å; V369-L465 HydrophobicContact CG1-CD1 3.82Å; V369-L465 HydrophobicContact CG2-CB 3.81Å; V369-Q466 HydrophobicContact CG2-CG 3.96Å
370	K	96.1	Very high	95.3	Very high	27 Å²	27	28.7 Å²	28.7	12%	0.117	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176	-75.9	169.3	173.2	163.6	0	112	D366 C367 V368 L373 R374 F429 E434 Y445	D366-K370 WeakPolarHBondContact O-CB 3.27Å; D366-K370 WeakPolarHBondContact O-CG 3.29Å; D366-K370 PolarHBondContact O-N 3.49Å; D366-K370 WeakPolarHBondContact OD2-CE 3.44Å; D366-K370 IonicContact OD2-NZ 2.74Å; D366-K370 PolarHBondContact OD2-NZ 2.89Å; C367-K370 PolarHBondContact O-N 3.45Å; V368-K370 VanDerWaalsContact C-N 3.29Å; V368-K370 PolarHBondContact O-N 2.93Å; K370-L373 PolarHBondContact O-N 3.27Å; K370-R374 WeakPolarHBondContact O-CB 3.3Å; K370-R374 PolarHBondContact O-N 2.9Å; K370-F429 HydrophobicContact CB-CB 4.32Å; K370-F429 HydrophobicContact CB-CD1 3.89Å; K370-F429 HydrophobicContact CB-CD2 3.7Å; K370-F429 HydrophobicContact CB-CE1 4.08Å; K370-F429 HydrophobicContact CB-CE2 3.86Å; K370-F429 HydrophobicContact CB-CG 3.71Å; K370-F429 HydrophobicContact CB-CZ 4.06Å; K370-F429 HydrophobicContact CD-CB 3.93Å; K370-F429 HydrophobicContact CD-CD1 3.77Å; K370-F429 HydrophobicContact CD-CE1 4.47Å; K370-F429 HydrophobicContact CD-CG 3.91Å; K370-F429 HydrophobicContact CG-CD1 4.34Å; K370-F429 HydrophobicContact CG-CG 4.44Å; K370-E434 IonicContact NZ-OE1 3.19Å; K370-E434 PolarHBondContact NZ-OE1 3.46Å; K370-Y445 VanDerWaalsContact CA-OH 3.25Å; K370-Y445 WeakPolarHBondContact CA-OH 3.32Å; K370-Y445 HydrophobicContact CG-CE1 4.3Å; K370-Y445 WeakPolarHBondContact O-CE2 3.25Å; K370-Y445 PolarHBondContact O-OH 3.49Å
371	E	96.1	Very high	95.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.7	-38.2	179.1	-175.3	67.7	171.1	0	0	112.7	C367 V368 L373 R374 L375 G423 F424 D425 R428 F429	C367-E371 PolarHBondContact O-N 3.22Å; V368-E371 PolarHBondContact O-N 2.98Å; E371-L373 PolarHBondContact O-N 2.85Å; E371-R374 WeakPolarHBondContact O-CB 3.42Å; E371-R374 PolarHBondContact O-N 3.39Å; E371-R374 IonicContact OE1-CZ 2.8Å; E371-R374 IonicContact OE1-NE 3.14Å; E371-R374 PolarHBondContact OE1-NE 3.42Å; E371-R374 IonicContact OE1-NH2 3.93Å; E371-R374 PolarHBondContact OE1-NH2 3.18Å; E371-R374 WeakPolarHBondContact OE2-CD 3.36Å; E371-R374 IonicContact OE2-CZ 3.65Å; E371-R374 IonicContact OE2-NE 3.92Å; E371-R374 PolarHBondContact OE2-NE 3.41Å; E371-R374 IonicContact OE2-NH2 3.47Å; E371-L375 HydrophobicContact CG-CD1 4.21Å; E371-L375 PolarHBondContact O-N 3.24Å; E371-G423 VanDerWaalsContact OE1-O 3.05Å; E371-F424 HydrophobicContact CB-CD2 4.32Å; E371-F424 HydrophobicContact CB-CE2 4.02Å; E371-F424 HydrophobicContact CG-CD2 3.52Å; E371-F424 HydrophobicContact CG-CE2 3.73Å; E371-F424 HydrophobicContact CG-CG 4.21Å; E371-D425 VanDerWaalsContact CD-O 3.3Å; E371-D425 PolarHBondContact OE1-N 3.46Å; E371-R428 IonicContact OE1-CZ 3.85Å; E371-R428 IonicContact OE1-NE 3.33Å; E371-R428 PolarHBondContact OE1-NE 3.1Å; E371-R428 IonicContact OE1-NH2 2.59Å; E371-R428 IonicContact OE2-NE 3.74Å; E371-F429 HydrophobicContact CB-CD2 4.24Å; E371-F429 HydrophobicContact CB-CE2 4.1Å; E371-F429 VanDerWaalsContact OE2-CE2 3.28Å; E371-F429 WeakPolarHBondContact OE2-CE2 3.36Å
372	V	97.4	Very high	95.2	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-56.7	-49.9	172	170.2	0	0	0	0	110.7	L308 L311 V368 V369 R374 L375 L376 F424	L308-V372 HydrophobicContact CB-CG1 4.29Å; L308-V372 HydrophobicContact CB-CG2 4.36Å; L308-V372 HydrophobicContact CD1-CG2 3.85Å; L311-V372 HydrophobicContact CB-CG2 4.47Å; L311-V372 HydrophobicContact CD1-CB 4.17Å; L311-V372 HydrophobicContact CD1-CG1 4.25Å; L311-V372 HydrophobicContact CD1-CG2 3.84Å; V368-V372 HydrophobicContact CG1-CG2 4.43Å; V368-V372 VanDerWaalsContact O-CG2 3.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.36Å; V368-V372 PolarHBondContact O-N 3.42Å; V369-V372 PolarHBondContact O-N 3.07Å; V372-R374 VanDerWaalsContact C-N 3.29Å; V372-R374 PolarHBondContact O-N 2.89Å; V372-L375 PolarHBondContact O-N 3.11Å; V372-L376 CarbonylContact O-C 3.57Å; V372-L376 PolarHBondContact O-N 3.19Å; V372-F424 HydrophobicContact CG2-CE2 3.94Å
373	L	96.6	Very high	95.1	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-72.1	-22.8	-179.3	-66.6	176.1	0	0	0	113.1	A304 V369 K370 E371 P377 P378 P447 F448 L465	A304-L373 HydrophobicContact CB-CD2 3.95Å; V369-L373 HydrophobicContact CG1-CD1 4.12Å; V369-L373 WeakPolarHBondContact O-CG 3.35Å; V369-L373 PolarHBondContact O-N 3.46Å; V369-L373 VanDerWaalsContact O-N 3.09Å; K370-L373 PolarHBondContact O-N 3.27Å; E371-L373 PolarHBondContact O-N 2.85Å; L373-P377 WeakPolarHBondContact O-CA 3.42Å; L373-P377 WeakPolarHBondContact O-CB 3.48Å; L373-P378 HydrophobicContact CD2-CG 4.31Å; L373-P447 HydrophobicContact CB-CB 3.85Å; L373-P447 HydrophobicContact CB-CG 4.07Å; L373-F448 HydrophobicContact CD1-CE2 3.69Å; L373-F448 HydrophobicContact CD1-CZ 3.54Å; L373-L465 HydrophobicContact CD1-CD1 4.19Å; L373-L465 HydrophobicContact CD2-CD1 4.1Å; L373-L465 HydrophobicContact CG-CD1 4.28Å
374	R	94.8	Very high	95.2	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.015	9%	0.092	C	C	.	.	H	α-helix	trans	-69.4	-53.8	172.4	-171	-166	65.6	79.7	-3.2	110.5	K370 E371 V372 H411 Y417 P421 G423 F429 Y445	K370-R374 WeakPolarHBondContact O-CB 3.3Å; K370-R374 PolarHBondContact O-N 2.9Å; E371-R374 WeakPolarHBondContact O-CB 3.42Å; E371-R374 PolarHBondContact O-N 3.39Å; E371-R374 IonicContact OE1-CZ 2.8Å; E371-R374 IonicContact OE1-NE 3.14Å; E371-R374 PolarHBondContact OE1-NE 3.42Å; E371-R374 IonicContact OE1-NH2 3.93Å; E371-R374 PolarHBondContact OE1-NH2 3.18Å; E371-R374 WeakPolarHBondContact OE2-CD 3.36Å; E371-R374 IonicContact OE2-CZ 3.65Å; E371-R374 IonicContact OE2-NE 3.92Å; E371-R374 PolarHBondContact OE2-NE 3.41Å; E371-R374 IonicContact OE2-NH2 3.47Å; V372-R374 VanDerWaalsContact C-N 3.29Å; V372-R374 PolarHBondContact O-N 2.89Å; R374-H411 HydrophobicContact CG-CB 3.96Å; R374-H411 WeakPolarHBondContact O-CB 3.44Å; R374-H411 PolarHBondContact O-ND1 3.38Å; R374-Y417 HydrophobicContact CG-CE2 4.21Å; R374-P421 VanDerWaalsContact CZ-O 3.25Å; R374-P421 PolarHBondContact NH1-O 2.85Å; R374-P421 PolarHBondContact NH2-O 2.89Å; R374-G423 PolarHBondContact NH2-O 2.94Å; R374-F429 HydrophobicContact CB-CE2 4.38Å; R374-F429 HydrophobicContact CB-CZ 4.2Å; R374-F429 HydrophobicContact CG-CZ 4.47Å; R374-Y445 HydrophobicContact CB-CD2 4.22Å; R374-Y445 HydrophobicContact CB-CE2 3.98Å; R374-Y445 HydrophobicContact CG-CD2 4.4Å
375	L	93	Very high	95.1	Very high	27 Å²	27	16.6 Å²	16.6	14%	0.141	9%	0.091	C	C	.	.	H	α-helix	trans	-73.8	-46.2	-175.1	-80.1	170.8	0	0	0	113.2	E371 V372 P377 P421 F424	E371-L375 HydrophobicContact CG-CD1 4.21Å; E371-L375 PolarHBondContact O-N 3.24Å; V372-L375 PolarHBondContact O-N 3.11Å; L375-P377 VanDerWaalsContact O-CD 3.27Å; L375-P377 WeakPolarHBondContact O-CD 3.43Å; L375-P421 VanDerWaalsContact CD2-O 3.31Å; L375-P421 WeakPolarHBondContact CD2-O 3.35Å; L375-F424 HydrophobicContact CD1-CB 3.77Å; L375-F424 HydrophobicContact CD1-CD2 3.84Å; L375-F424 HydrophobicContact CD1-CG 4.31Å
376	L	94.6	Very high	95.1	Very high	25 Å²	25	16.7 Å²	16.7	13%	0.131	9%	0.092	C	C	.	.	S	Bend	trans	-122.4	62.9	-174.5	-57.7	178.7	0	0	0	110	L310 L311 V372 P378 L494	L310-L376 HydrophobicContact CD2-CD1 4.36Å; L311-L376 HydrophobicContact CD1-CD1 3.79Å; L311-L376 HydrophobicContact CD1-CG 4.24Å; L311-L376 HydrophobicContact CD2-CD1 4.29Å; L311-L376 HydrophobicContact CG-CD1 3.97Å; V372-L376 CarbonylContact O-C 3.57Å; V372-L376 PolarHBondContact O-N 3.19Å; L376-P378 WeakPolarHBondContact O-CD 3.39Å; L376-L494 HydrophobicContact CB-CD1 3.86Å; L376-L494 HydrophobicContact CB-CD2 3.9Å; L376-L494 HydrophobicContact CD2-CD1 3.79Å; L376-L494 HydrophobicContact CG-CD1 4.38Å
377	P	95	Very high	95.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.			trans	-62.9	129.2	177.4	25.8	-32.5	0	0	0	109.3	L373 L375 V379 I407 R408	L373-P377 WeakPolarHBondContact O-CA 3.42Å; L373-P377 WeakPolarHBondContact O-CB 3.48Å; L375-P377 VanDerWaalsContact O-CD 3.27Å; L375-P377 WeakPolarHBondContact O-CD 3.43Å; P377-V379 PolarHBondContact O-N 3.39Å; P377-I407 HydrophobicContact CB-CG2 3.98Å; P377-I407 HydrophobicContact CG-CG2 4.27Å; P377-R408 HydrophobicContact CG-CB 4.1Å; P377-R408 PolarHBondContact O-NH2 3.49Å
378	P	95.2	Very high	95.1	Very high	11 Å²	11	23 Å²	23	7%	0.071	12%	0.115	C	C	.	.	S	Bend	trans	-56.3	-38.7	179.7	-30.4	36.7	0	0	0	113.4	T300 A304 L373 L376 I493 L494	T300-P378 WeakPolarHBondContact O-CG 3.4Å; A304-P378 HydrophobicContact CB-CG 3.74Å; L373-P378 HydrophobicContact CD2-CG 4.31Å; L376-P378 WeakPolarHBondContact O-CD 3.39Å; P378-I493 WeakPolarHBondContact O-CA 3.43Å; P378-L494 PolarHBondContact O-N 3.02Å
379	V	92.6	Very high	95	Very high	52 Å²	52	24.8 Å²	24.8	32%	0.315	13%	0.126	S	C	.	.	S	Bend	trans	-108.7	115.8	177.6	179.5	0	0	0	0	108.8	T300 P377 G381 I493	T300-V379 HydrophobicContact CG2-CG2 4.02Å; P377-V379 PolarHBondContact O-N 3.39Å; V379-G381 VanDerWaalsContact C-N 3.26Å; V379-G381 VanDerWaalsContact CG1-O 3.29Å; V379-G381 WeakPolarHBondContact CG1-O 3.17Å; V379-G381 PolarHBondContact O-N 3.26Å; V379-I493 HydrophobicContact CG2-CD1 4Å
380	S	89.2	Confident	95	Very high	10 Å²	10	25.8 Å²	25.8	7%	0.07	13%	0.13	C	C	.	.			trans	-73.2	-14.8	-176.9	-66.4	0	0	0	0	113.8	I407 R408 T490	S380-I407 PolarHBondContact O-N 3.22Å; S380-R408 PolarHBondContact O-N 3.45Å; S380-R408 PolarHBondContact OG-NE 2.92Å; S380-R408 PolarHBondContact OG-NH2 3.18Å; S380-T490 PolarHBondContact OG-O 2.89Å
381	G	92.3	Very high	95	Very high	15 Å²	15	30.5 Å²	30.5	16%	0.155	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-172.9	-178.4	0	0	0	0	0	112.7	V379 Y405	V379-G381 VanDerWaalsContact C-N 3.26Å; V379-G381 VanDerWaalsContact CG1-O 3.29Å; V379-G381 WeakPolarHBondContact CG1-O 3.17Å; V379-G381 PolarHBondContact O-N 3.26Å; G381-Y405 WeakPolarHBondContact CA-O 3.48Å
382	G	92.5	Very high	95	Very high	11 Å²	11	30.7 Å²	30.7	11%	0.113	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.9	-179.5	0	0	0	0	0	113.4	M404 Y405	G382-M404 WeakPolarHBondContact O-CA 3.39Å; G382-Y405 VanDerWaalsContact CA-CE1 3.46Å; G382-Y405 PolarHBondContact N-O 2.88Å; G382-Y405 WeakPolarHBondContact O-CD1 3.47Å; G382-Y405 WeakPolarHBondContact O-CE1 3.24Å; G382-Y405 PolarHBondContact O-N 2.76Å; G382-Y405 VanDerWaalsContact O-N 3.16Å
383	Y	93.5	Very high	94.9	Very high	81 Å²	81	34.6 Å²	34.6	32%	0.318	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.1	177.3	-68.8	-89.8	0	0	0	111.6	V93 Q116 V403 M404	V93-Y383 HydrophobicContact CG1-CE1 4.39Å; Q116-Y383 PolarHBondContact N-O 3.24Å; Y383-V403 CarbonylContact C-O 3.46Å; Y383-V403 WeakPolarHBondContact CA-O 3.12Å; Y383-M404 HydrophobicContact CD1-CB 3.88Å; Y383-M404 HydrophobicContact CD1-CG 3.95Å; Y383-M404 HydrophobicContact CD2-CG 4.42Å; Y383-M404 HydrophobicContact CE1-CB 3.76Å; Y383-M404 HydrophobicContact CE1-CG 3.66Å; Y383-M404 HydrophobicContact CE1-SD 3.89Å; Y383-M404 HydrophobicContact CE2-CE 4.2Å; Y383-M404 HydrophobicContact CE2-CG 4.15Å; Y383-M404 HydrophobicContact CE2-SD 4.27Å; Y383-M404 HydrophobicContact CG-CG 4.33Å; Y383-M404 PolarHBondContact OH-SD 3.2Å
384	R	95.7	Very high	94.8	Very high	13 Å²	13	36.1 Å²	36.1	5%	0.049	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.4	-178.3	-68.7	-59.3	178.4	-86.6	1.3	109.9	I105 E109 V113 R114 S402 V403 Y405	I105-R384 HydrophobicContact CG2-CG 4.03Å; E109-R384 WeakPolarHBondContact OE2-CD 3.29Å; E109-R384 IonicContact OE2-CZ 2.76Å; E109-R384 IonicContact OE2-NE 3.38Å; E109-R384 PolarHBondContact OE2-NE 3.34Å; E109-R384 IonicContact OE2-NH2 3.76Å; V113-R384 HydrophobicContact CB-CB 3.98Å; V113-R384 HydrophobicContact CB-CG 4.37Å; V113-R384 HydrophobicContact CG1-CB 4.33Å; V113-R384 HydrophobicContact CG2-CB 4.31Å; V113-R384 HydrophobicContact CG2-CG 4.15Å; R114-R384 CarbonylContact O-C 3.54Å; R114-R384 WeakPolarHBondContact O-CA 3.48Å; R114-R384 WeakPolarHBondContact O-CD 3.31Å; R384-S402 CarbonylContact O-C 3.6Å; R384-S402 WeakPolarHBondContact O-CA 3.27Å; R384-V403 HydrophobicContact CB-CB 4.35Å; R384-V403 PolarHBondContact N-O 3.49Å; R384-V403 PolarHBondContact O-N 3.38Å; R384-Y405 HydrophobicContact CG-CD1 4.28Å; R384-Y405 HydrophobicContact CG-CE1 4.43Å
385	T	96.1	Very high	94.9	Very high	19 Å²	19	37.8 Å²	37.8	12%	0.117	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132	167.7	-57.4	0	0	0	0	109.1	V113 R114 Q116	V113-T385 CarbonylContact C-O 3.6Å; V113-T385 VanDerWaalsContact CA-O 3.27Å; V113-T385 WeakPolarHBondContact CA-O 3.4Å; R114-T385 PolarHBondContact N-O 2.74Å; R114-T385 PolarHBondContact O-N 2.89Å; Q116-T385 PolarHBondContact NE2-OG1 2.91Å
386	V	97.4	Very high	95.1	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.4	178.5	-177.7	0	0	0	0	110	R388 F390 I397 P398 G400 W401 V403	V386-R388 WeakPolarHBondContact CG1-O 3.27Å; V386-F390 HydrophobicContact CG1-CD1 4.05Å; V386-F390 HydrophobicContact CG1-CE1 3.84Å; V386-F390 HydrophobicContact CG2-CE1 4.32Å; V386-I397 HydrophobicContact CG1-CG2 4.35Å; V386-I397 HydrophobicContact CG2-CG2 3.62Å; V386-P398 WeakPolarHBondContact CB-O 3.29Å; V386-P398 WeakPolarHBondContact CG1-O 3.26Å; V386-G400 PolarHBondContact O-N 2.9Å; V386-W401 VanDerWaalsContact CG2-O 3.31Å; V386-W401 WeakPolarHBondContact CG2-O 3.28Å; V386-W401 PolarHBondContact N-O 2.74Å; V386-V403 HydrophobicContact CG2-CG2 3.53Å
387	L	96.6	Very high	95.2	Very high	57 Å²	57	35.3 Å²	35.3	30%	0.298	19%	0.185	S	C	.	.	S	Bend	trans	-86.9	-32.5	-176.8	-64.4	177.6	0	0	0	112.7	L112 R114 K399	L112-L387 PolarHBondContact O-N 3.2Å; R114-L387 HydrophobicContact CB-CD1 4.32Å; R114-L387 HydrophobicContact CB-CD2 4.18Å; R114-L387 HydrophobicContact CB-CG 4.42Å; R114-L387 HydrophobicContact CG-CD2 3.8Å; R114-L387 HydrophobicContact CG-CG 4.4Å; L387-K399 WeakPolarHBondContact O-CD 3.48Å; L387-K399 WeakPolarHBondContact O-CE 3.47Å; L387-K399 WeakPolarHBondContact O-CG 3.39Å
388	R	95.9	Very high	95.3	Very high	124 Å²	124	35.5 Å²	35.5	47%	0.468	19%	0.186	S	C	.	.	S	Bend	trans	-148.2	150.4	176.5	65.2	-177.4	-172.5	179.8	2.7	109.1	L112 V386 F390	L112-R388 HydrophobicContact CD2-CG 4.39Å; L112-R388 VanDerWaalsContact CD2-NE 3.34Å; V386-R388 WeakPolarHBondContact CG1-O 3.27Å; R388-F390 WeakPolarHBondContact O-CD1 3.45Å; R388-F390 PolarHBondContact O-N 2.66Å
389	T	97.3	Very high	95.3	Very high	36 Å²	36	42 Å²	42	22%	0.221	21%	0.213	C	C	.	.			trans	-62.2	135.5	175.7	-54.1	0	0	0	0	110.1	D42 Q396 I397 K399	D42-T389 HydrophobicContact CB-CG2 3.76Å; D42-T389 WeakPolarHBondContact OD2-CB 3.37Å; D42-T389 WeakPolarHBondContact OD2-CG2 3.36Å; D42-T389 PolarHBondContact OD2-OG1 3.26Å; T389-Q396 HydrophobicContact CG2-CB 4.16Å; T389-I397 VanDerWaalsContact CA-O 3.26Å; T389-I397 WeakPolarHBondContact CA-O 3.2Å; T389-K399 PolarHBondContact OG1-N 2.99Å; T389-K399 VanDerWaalsContact OG1-N 3.11Å
390	F	97.4	Very high	95.4	Very high	22 Å²	22	42 Å²	42	10%	0.096	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.7	176.1	67	-81.9	0	0	0	110.8	T104 I105 L112 V113 V386 R388 L392 I397	T104-F390 HydrophobicContact CG2-CE2 4.48Å; I105-F390 HydrophobicContact CD1-CE2 3.88Å; I105-F390 HydrophobicContact CD1-CZ 3.46Å; I105-F390 VanDerWaalsContact CD1-CZ 3.46Å; L112-F390 HydrophobicContact CB-CD1 4.21Å; L112-F390 HydrophobicContact CB-CE1 4.31Å; L112-F390 HydrophobicContact CD1-CD2 4.16Å; L112-F390 HydrophobicContact CD1-CE2 4.47Å; L112-F390 HydrophobicContact CD1-CG 4.3Å; L112-F390 HydrophobicContact CD2-CB 4.21Å; L112-F390 HydrophobicContact CD2-CG 4.38Å; V113-F390 HydrophobicContact CG1-CE1 4.15Å; V113-F390 HydrophobicContact CG1-CZ 4.39Å; V386-F390 HydrophobicContact CG1-CD1 4.05Å; V386-F390 HydrophobicContact CG1-CE1 3.84Å; V386-F390 HydrophobicContact CG2-CE1 4.32Å; R388-F390 WeakPolarHBondContact O-CD1 3.45Å; R388-F390 PolarHBondContact O-N 2.66Å; F390-L392 HydrophobicContact CD2-CB 4.43Å; F390-L392 HydrophobicContact CE2-CB 4.01Å; F390-L392 HydrophobicContact CE2-CD1 4.31Å; F390-L392 HydrophobicContact CE2-CD2 4.42Å; F390-L392 HydrophobicContact CE2-CG 4.5Å; F390-I397 HydrophobicContact CD1-CB 4.07Å; F390-I397 HydrophobicContact CD1-CG2 4.31Å; F390-I397 HydrophobicContact CD2-CB 4.48Å; F390-I397 HydrophobicContact CD2-CG1 4.4Å; F390-I397 HydrophobicContact CE1-CB 3.75Å; F390-I397 HydrophobicContact CE1-CG1 4.41Å; F390-I397 HydrophobicContact CE1-CG2 3.56Å; F390-I397 HydrophobicContact CE2-CB 4.18Å; F390-I397 HydrophobicContact CE2-CG1 3.96Å; F390-I397 HydrophobicContact CE2-CG2 4.49Å; F390-I397 HydrophobicContact CG-CB 4.42Å; F390-I397 HydrophobicContact CZ-CB 3.79Å; F390-I397 HydrophobicContact CZ-CG1 3.95Å; F390-I397 HydrophobicContact CZ-CG2 3.65Å; F390-I397 PolarHBondContact N-O 3.36Å; F390-I397 WeakPolarHBondContact O-CB 3.41Å; F390-I397 PolarHBondContact O-N 2.9Å
391	E	96.6	Very high	95.7	Very high	126 Å²	126	42.1 Å²	42.1	59%	0.589	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	136	174.4	176.1	176.4	167.4	0	0	111.1	L47 Y395	L47-E391 HydrophobicContact CD1-CB 3.71Å; L47-E391 HydrophobicContact CD1-CG 3.46Å; L47-E391 VanDerWaalsContact CD1-CG 3.46Å; E391-Y395 CarbonylContact C-O 3.58Å; E391-Y395 WeakPolarHBondContact CA-O 3.26Å
392	L	95.9	Very high	95.9	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	120.8	170.1	-167.9	70.8	0	0	0	109	V83 V96 N101 T104 I105 F390 G394 Y395 I397	V83-L392 HydrophobicContact CG1-CD2 4.46Å; V83-L392 HydrophobicContact CG2-CD2 4.23Å; V83-L392 HydrophobicContact CG2-CG 4.41Å; V96-L392 HydrophobicContact CB-CD2 4.49Å; V96-L392 HydrophobicContact CG1-CD2 3.85Å; V96-L392 HydrophobicContact CG2-CD2 3.73Å; N101-L392 HydrophobicContact CB-CD1 4.16Å; N101-L392 HydrophobicContact CB-CD2 4.44Å; N101-L392 HydrophobicContact CB-CG 4.38Å; T104-L392 HydrophobicContact CG2-CD1 3.95Å; I105-L392 HydrophobicContact CD1-CD2 4.11Å; I105-L392 HydrophobicContact CG1-CD2 4.45Å; F390-L392 HydrophobicContact CD2-CB 4.43Å; F390-L392 HydrophobicContact CE2-CB 4.01Å; F390-L392 HydrophobicContact CE2-CD1 4.31Å; F390-L392 HydrophobicContact CE2-CD2 4.42Å; F390-L392 HydrophobicContact CE2-CG 4.5Å; L392-G394 VanDerWaalsContact C-N 3.27Å; L392-G394 PolarHBondContact O-N 2.99Å; L392-Y395 PolarHBondContact N-O 3.04Å; L392-Y395 PolarHBondContact O-N 2.97Å; L392-I397 HydrophobicContact CB-CD1 3.95Å; L392-I397 HydrophobicContact CB-CG1 3.54Å; L392-I397 HydrophobicContact CD2-CD1 4.27Å; L392-I397 HydrophobicContact CD2-CG1 4.27Å
393	D	93.8	Very high	96.1	Very high	83 Å²	83	41.2 Å²	41.2	44%	0.444	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	39.8	176.3	-152.7	13.7	0	0	0	113.2	T82 V83 N101 Y395	T82-D393 PolarHBondContact OG1-OD2 3.28Å; T82-D393 VanDerWaalsContact OG1-OD2 3.06Å; V83-D393 HydrophobicContact CB-CB 4.35Å; V83-D393 HydrophobicContact CG2-CB 3.73Å; N101-D393 PolarHBondContact ND2-OD2 3.37Å; D393-Y395 VanDerWaalsContact C-N 3.28Å; D393-Y395 HydrophobicContact CB-CD2 4.45Å; D393-Y395 WeakPolarHBondContact O-CD2 3.29Å; D393-Y395 WeakPolarHBondContact O-CE2 3.4Å; D393-Y395 PolarHBondContact O-N 3.25Å
394	G	95.3	Very high	96.2	Very high	35 Å²	35	38 Å²	38	36%	0.361	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	8.8	-177.6	0	0	0	0	0	115.4	L392	L392-G394 VanDerWaalsContact C-N 3.27Å; L392-G394 PolarHBondContact O-N 2.99Å
395	Y	97	Very high	96.2	Very high	39 Å²	39	38.2 Å²	38.2	15%	0.153	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	151.3	177.6	-59.6	-74.9	0	0	0	112.2	P48 L49 P50 K51 V83 E391 L392 D393	P48-Y395 HydrophobicContact CG-CD1 4.01Å; P48-Y395 HydrophobicContact CG-CE1 4.28Å; P48-Y395 WeakPolarHBondContact O-CA 3.46Å; L49-Y395 WeakPolarHBondContact O-CD1 3.28Å; P50-Y395 VanDerWaalsContact CA-CD1 3.45Å; P50-Y395 HydrophobicContact CB-CD1 4.47Å; P50-Y395 HydrophobicContact CB-CG 4.25Å; P50-Y395 HydrophobicContact CG-CG 4.11Å; K51-Y395 HydrophobicContact CG-CE1 4.4Å; V83-Y395 HydrophobicContact CB-CD2 4.43Å; V83-Y395 HydrophobicContact CG1-CD2 4.36Å; E391-Y395 CarbonylContact C-O 3.58Å; E391-Y395 WeakPolarHBondContact CA-O 3.26Å; L392-Y395 PolarHBondContact N-O 3.04Å; L392-Y395 PolarHBondContact O-N 2.97Å; D393-Y395 VanDerWaalsContact C-N 3.28Å; D393-Y395 HydrophobicContact CB-CD2 4.45Å; D393-Y395 WeakPolarHBondContact O-CD2 3.29Å; D393-Y395 WeakPolarHBondContact O-CE2 3.4Å; D393-Y395 PolarHBondContact O-N 3.25Å
396	Q	96.9	Very high	96.1	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	133.9	165.8	57.5	165.4	-72	0	0	111	D42 L47 P48 L49 P50 T389 P398	D42-Q396 PolarHBondContact O-NE2 3.19Å; L47-Q396 HydrophobicContact CB-CB 4.17Å; L47-Q396 WeakPolarHBondContact O-CG 3.3Å; L47-Q396 PolarHBondContact O-NE2 2.97Å; P48-Q396 WeakPolarHBondContact O-CG 3.42Å; P48-Q396 PolarHBondContact O-N 3.42Å; L49-Q396 HydrophobicContact CD2-CG 4.17Å; P50-Q396 WeakPolarHBondContact CD-O 3.24Å; T389-Q396 HydrophobicContact CG2-CB 4.16Å; Q396-P398 WeakPolarHBondContact O-CD 3.18Å
397	I	97.4	Very high	95.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	97.8	172.9	-52.5	-58.1	0	0	0	107.1	P50 V83 I94 V386 T389 F390 L392 V403	P50-I397 HydrophobicContact CG-CD1 3.98Å; V83-I397 HydrophobicContact CG1-CD1 4.25Å; I94-I397 HydrophobicContact CD1-CB 4.44Å; I94-I397 HydrophobicContact CD1-CD1 3.88Å; I94-I397 HydrophobicContact CD1-CG2 3.85Å; I94-I397 HydrophobicContact CG2-CD1 4.01Å; V386-I397 HydrophobicContact CG1-CG2 4.35Å; V386-I397 HydrophobicContact CG2-CG2 3.62Å; T389-I397 VanDerWaalsContact CA-O 3.26Å; T389-I397 WeakPolarHBondContact CA-O 3.2Å; F390-I397 HydrophobicContact CD1-CB 4.07Å; F390-I397 HydrophobicContact CD1-CG2 4.31Å; F390-I397 HydrophobicContact CD2-CB 4.48Å; F390-I397 HydrophobicContact CD2-CG1 4.4Å; F390-I397 HydrophobicContact CE1-CB 3.75Å; F390-I397 HydrophobicContact CE1-CG1 4.41Å; F390-I397 HydrophobicContact CE1-CG2 3.56Å; F390-I397 HydrophobicContact CE2-CB 4.18Å; F390-I397 HydrophobicContact CE2-CG1 3.96Å; F390-I397 HydrophobicContact CE2-CG2 4.49Å; F390-I397 HydrophobicContact CG-CB 4.42Å; F390-I397 HydrophobicContact CZ-CB 3.79Å; F390-I397 HydrophobicContact CZ-CG1 3.95Å; F390-I397 HydrophobicContact CZ-CG2 3.65Å; F390-I397 PolarHBondContact N-O 3.36Å; F390-I397 WeakPolarHBondContact O-CB 3.41Å; F390-I397 PolarHBondContact O-N 2.9Å; L392-I397 HydrophobicContact CB-CD1 3.95Å; L392-I397 HydrophobicContact CB-CG1 3.54Å; L392-I397 HydrophobicContact CD2-CD1 4.27Å; L392-I397 HydrophobicContact CD2-CG1 4.27Å; I397-V403 HydrophobicContact CG2-CG2 3.67Å
398	P	96.2	Very high	95.7	Very high	3 Å²	3	36 Å²	36	2%	0.019	19%	0.187	C	C	.	.			trans	-70.4	146.9	-166.3	-17.6	30.8	0	0	0	113.4	L49 V386 Q396 G400 W401	L49-P398 HydrophobicContact CD2-CG 3.31Å; V386-P398 WeakPolarHBondContact CB-O 3.29Å; V386-P398 WeakPolarHBondContact CG1-O 3.26Å; Q396-P398 WeakPolarHBondContact O-CD 3.18Å; P398-G400 PolarHBondContact O-N 3.44Å; P398-W401 HydrophobicContact CB-CG 4.24Å; P398-W401 HydrophobicContact CG-CD2 4.35Å; P398-W401 HydrophobicContact CG-CG 4.37Å; P398-W401 WeakPolarHBondContact O-CB 3.48Å; P398-W401 PolarHBondContact O-N 3.24Å
399	K	96.1	Very high	95.5	Very high	147 Å²	147	30.3 Å²	30.3	64%	0.639	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.5	137.9	170.8	-179.1	176.8	177.9	-174.2	0	111.8	L387 T389 W401	L387-K399 WeakPolarHBondContact O-CD 3.48Å; L387-K399 WeakPolarHBondContact O-CE 3.47Å; L387-K399 WeakPolarHBondContact O-CG 3.39Å; T389-K399 PolarHBondContact OG1-N 2.99Å; T389-K399 VanDerWaalsContact OG1-N 3.11Å; K399-W401 VanDerWaalsContact C-N 3.25Å; K399-W401 PolarHBondContact O-N 3.21Å
400	G	94.4	Very high	95.2	Very high	53 Å²	53	28.6 Å²	28.6	55%	0.546	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-15.7	176.4	0	0	0	0	0	115	V386 P398	V386-G400 PolarHBondContact O-N 2.9Å; P398-G400 PolarHBondContact O-N 3.44Å
401	W	95.2	Very high	95	Very high	12 Å²	12	27.6 Å²	27.6	5%	0.045	15%	0.151	C	C	.	.			trans	-69.2	156.9	174.3	-77.2	50.8	0	0	0	111.8	W37 S40 M54 K85 P92 I94 V386 P398 K399	W37-W401 HydrophobicContact CE3-CZ2 4.09Å; S40-W401 VanDerWaalsContact OG-CZ2 3.31Å; S40-W401 WeakPolarHBondContact OG-CZ2 3.41Å; M54-W401 HydrophobicContact CE-CH2 3.96Å; M54-W401 HydrophobicContact CE-CZ3 4.26Å; M54-W401 HydrophobicContact SD-CH2 4.26Å; M54-W401 HydrophobicContact SD-CZ3 4.47Å; K85-W401 HydrophobicContact CB-CZ3 4.14Å; K85-W401 HydrophobicContact CD-CH2 4.47Å; P92-W401 HydrophobicContact CB-CD2 3.89Å; P92-W401 HydrophobicContact CB-CE3 3.67Å; P92-W401 HydrophobicContact CB-CH2 4.09Å; P92-W401 HydrophobicContact CB-CZ2 4.28Å; P92-W401 HydrophobicContact CB-CZ3 3.78Å; P92-W401 HydrophobicContact CG-CD2 4.15Å; P92-W401 HydrophobicContact CG-CE3 4.39Å; P92-W401 HydrophobicContact CG-CG 4.39Å; I94-W401 HydrophobicContact CD1-CD2 4.47Å; I94-W401 HydrophobicContact CD1-CE3 3.78Å; I94-W401 HydrophobicContact CD1-CZ3 4.38Å; I94-W401 HydrophobicContact CG1-CE3 3.79Å; I94-W401 HydrophobicContact CG1-CZ3 4.14Å; V386-W401 VanDerWaalsContact CG2-O 3.31Å; V386-W401 WeakPolarHBondContact CG2-O 3.28Å; V386-W401 PolarHBondContact N-O 2.74Å; P398-W401 HydrophobicContact CB-CG 4.24Å; P398-W401 HydrophobicContact CG-CD2 4.35Å; P398-W401 HydrophobicContact CG-CG 4.37Å; P398-W401 WeakPolarHBondContact O-CB 3.48Å; P398-W401 PolarHBondContact O-N 3.24Å; K399-W401 VanDerWaalsContact C-N 3.25Å; K399-W401 PolarHBondContact O-N 3.21Å
402	S	95.9	Very high	94.5	Very high	7 Å²	7	25.1 Å²	25.1	5%	0.049	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.5	169.4	-76.8	0	0	0	0	110.2	P92 V93 I94 Q116 R384	P92-S402 WeakPolarHBondContact O-CB 3.14Å; P92-S402 PolarHBondContact O-N 3.4Å; V93-S402 CarbonylContact C-O 3.47Å; V93-S402 VanDerWaalsContact CA-O 3.31Å; V93-S402 WeakPolarHBondContact CA-O 3.36Å; I94-S402 PolarHBondContact N-O 2.8Å; Q116-S402 VanDerWaalsContact CD-OG 3.24Å; Q116-S402 PolarHBondContact NE2-OG 3.22Å; Q116-S402 PolarHBondContact OE1-OG 3.14Å; R384-S402 CarbonylContact O-C 3.6Å; R384-S402 WeakPolarHBondContact O-CA 3.27Å
403	V	96.9	Very high	94	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.5	169.8	169.4	0	0	0	0	108	I94 V96 I105 Y383 R384 V386 I397	I94-V403 HydrophobicContact CB-CG2 4.21Å; I94-V403 CarbonylContact O-C 3.49Å; I94-V403 VanDerWaalsContact O-CA 3.29Å; I94-V403 WeakPolarHBondContact O-CA 3.41Å; V96-V403 HydrophobicContact CB-CG1 4.33Å; V96-V403 HydrophobicContact CG2-CG1 3.68Å; I105-V403 HydrophobicContact CD1-CG1 3.97Å; I105-V403 HydrophobicContact CG1-CG1 4.19Å; I105-V403 HydrophobicContact CG2-CG1 4.38Å; Y383-V403 CarbonylContact C-O 3.46Å; Y383-V403 WeakPolarHBondContact CA-O 3.12Å; R384-V403 HydrophobicContact CB-CB 4.35Å; R384-V403 PolarHBondContact N-O 3.49Å; R384-V403 PolarHBondContact O-N 3.38Å; V386-V403 HydrophobicContact CG2-CG2 3.53Å; I397-V403 HydrophobicContact CG2-CG2 3.67Å
404	M	95.4	Very high	93.6	Very high	14 Å²	14	24.8 Å²	24.8	7%	0.069	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	98.8	173.1	-169	-160	174.1	0	0	108.8	V93 I94 R95 V96 G382 Y383	V93-M404 HydrophobicContact CG1-CB 3.79Å; I94-M404 PolarHBondContact O-N 2.91Å; R95-M404 VanDerWaalsContact NH1-CG 3.27Å; R95-M404 PolarHBondContact NH1-O 3.48Å; R95-M404 PolarHBondContact NH1-SD 2.97Å; V96-M404 PolarHBondContact N-O 3.44Å; G382-M404 WeakPolarHBondContact O-CA 3.39Å; Y383-M404 HydrophobicContact CD1-CB 3.88Å; Y383-M404 HydrophobicContact CD1-CG 3.95Å; Y383-M404 HydrophobicContact CD2-CG 4.42Å; Y383-M404 HydrophobicContact CE1-CB 3.76Å; Y383-M404 HydrophobicContact CE1-CG 3.66Å; Y383-M404 HydrophobicContact CE1-SD 3.89Å; Y383-M404 HydrophobicContact CE2-CE 4.2Å; Y383-M404 HydrophobicContact CE2-CG 4.15Å; Y383-M404 HydrophobicContact CE2-SD 4.27Å; Y383-M404 HydrophobicContact CG-CG 4.33Å; Y383-M404 PolarHBondContact OH-SD 3.2Å
405	Y	95.8	Very high	92.9	Very high	18 Å²	18	28 Å²	28	7%	0.071	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	149.4	173	73.7	-89.9	0	0	0	109.9	R95 V96 V102 I105 L106 G381 G382 R384 I407	R95-Y405 VanDerWaalsContact NH1-C 3.29Å; R95-Y405 PolarHBondContact NH1-O 3.16Å; V96-Y405 CarbonylContact O-C 3.49Å; V96-Y405 VanDerWaalsContact O-CA 3.31Å; V96-Y405 WeakPolarHBondContact O-CA 3.49Å; V102-Y405 HydrophobicContact CG1-CD2 3.9Å; V102-Y405 HydrophobicContact CG1-CG 4.36Å; I105-Y405 HydrophobicContact CG2-CD1 4.17Å; L106-Y405 HydrophobicContact CD1-CE2 4.5Å; L106-Y405 HydrophobicContact CD2-CD1 4.18Å; L106-Y405 HydrophobicContact CD2-CD2 4.25Å; L106-Y405 HydrophobicContact CD2-CE1 3.78Å; L106-Y405 HydrophobicContact CD2-CE2 3.85Å; L106-Y405 HydrophobicContact CD2-CG 4.4Å; G381-Y405 WeakPolarHBondContact CA-O 3.48Å; G382-Y405 VanDerWaalsContact CA-CE1 3.46Å; G382-Y405 PolarHBondContact N-O 2.88Å; G382-Y405 WeakPolarHBondContact O-CD1 3.47Å; G382-Y405 WeakPolarHBondContact O-CE1 3.24Å; G382-Y405 PolarHBondContact O-N 2.76Å; G382-Y405 VanDerWaalsContact O-N 3.16Å; R384-Y405 HydrophobicContact CG-CD1 4.28Å; R384-Y405 HydrophobicContact CG-CE1 4.43Å; Y405-I407 HydrophobicContact CD2-CG1 4.38Å; Y405-I407 HydrophobicContact CE2-CD1 4.16Å; Y405-I407 HydrophobicContact CE2-CG1 3.89Å
406	S	94.3	Very high	92	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.2	-176.6	-164.7	0	0	0	0	112.2	R95 V96 D409 T410	R95-S406 PolarHBondContact NH2-OG 3.27Å; V96-S406 PolarHBondContact O-N 3.45Å; S406-D409 VanDerWaalsContact CB-CB 3.5Å; S406-D409 WeakPolarHBondContact CB-OD2 3.3Å; S406-D409 WeakPolarHBondContact OG-CB 3.32Å; S406-D409 PolarHBondContact OG-N 3.34Å; S406-D409 PolarHBondContact OG-OD1 3.48Å; S406-D409 PolarHBondContact OG-OD2 3.17Å; S406-T410 VanDerWaalsContact O-CB 3.3Å; S406-T410 WeakPolarHBondContact O-CB 3.38Å; S406-T410 PolarHBondContact O-OG1 3.48Å
407	I	94.4	Very high	91.2	Very high	3 Å²	3	29 Å²	29	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-77.6	-52.3	170.6	-67.8	170.5	0	0	0	108.6	P377 S380 Y405 D409 T410 H411 I446	P377-I407 HydrophobicContact CB-CG2 3.98Å; P377-I407 HydrophobicContact CG-CG2 4.27Å; S380-I407 PolarHBondContact O-N 3.22Å; Y405-I407 HydrophobicContact CD2-CG1 4.38Å; Y405-I407 HydrophobicContact CE2-CD1 4.16Å; Y405-I407 HydrophobicContact CE2-CG1 3.89Å; I407-D409 PolarHBondContact O-N 3.38Å; I407-T410 PolarHBondContact O-N 3.3Å; I407-H411 WeakPolarHBondContact CG2-CE1 3.29Å; I407-H411 PolarHBondContact O-CD2 2.99Å; I407-H411 VanDerWaalsContact O-CG 3.32Å; I407-H411 PolarHBondContact O-N 3.31Å; I407-I446 WeakPolarHBondContact CD1-O 3.49Å; I407-I446 HydrophobicContact CG1-CD1 4.22Å; I407-I446 HydrophobicContact CG1-CG1 4.32Å; I407-I446 HydrophobicContact CG2-CG1 4.38Å; I407-I446 WeakPolarHBondContact CG2-O 3.48Å
408	R	91.3	Very high	89.7	Confident	27 Å²	27	39.5 Å²	39.5	10%	0.102	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-54.9	-179.2	176.5	-178	-57.8	-78.3	-13.1	111.9	P377 S380 T410 H411 E412	P377-R408 HydrophobicContact CG-CB 4.1Å; P377-R408 PolarHBondContact O-NH2 3.49Å; S380-R408 PolarHBondContact O-N 3.45Å; S380-R408 PolarHBondContact OG-NE 2.92Å; S380-R408 PolarHBondContact OG-NH2 3.18Å; R408-T410 PolarHBondContact O-N 3.26Å; R408-H411 PolarHBondContact O-N 2.64Å; R408-H411 VanDerWaalsContact O-N 3.09Å; R408-E412 WeakPolarHBondContact CD-OE1 3.31Å; R408-E412 HydrophobicContact CG-CG 4.33Å; R408-E412 WeakPolarHBondContact CG-OE1 3.45Å; R408-E412 WeakPolarHBondContact O-CG 3.31Å; R408-E412 PolarHBondContact O-N 3.05Å
409	D	91.4	Very high	88.2	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.032	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-37.5	-176.7	-58.1	-11.9	0	0	0	110.9	R77 R95 S406 I407 E412 T413	R77-D409 IonicContact CZ-OD1 2.8Å; R77-D409 VanDerWaalsContact NH1-CA 3.26Å; R77-D409 VanDerWaalsContact NH1-CB 3.26Å; R77-D409 PolarHBondContact NH1-O 2.8Å; R77-D409 VanDerWaalsContact NH1-O 3.12Å; R77-D409 VanDerWaalsContact NH2-CB 3.31Å; R77-D409 IonicContact NH2-OD1 3.17Å; R77-D409 PolarHBondContact NH2-OD1 2.81Å; R77-D409 IonicContact NH2-OD2 3.54Å; R95-D409 IonicContact CZ-OD2 2.97Å; R95-D409 IonicContact NE-OD2 3.8Å; R95-D409 PolarHBondContact NE-OD2 3.25Å; R95-D409 IonicContact NH2-OD2 3.75Å; R95-D409 PolarHBondContact NH2-OD2 3.42Å; R95-D409 VanDerWaalsContact NH2-OD2 3.09Å; S406-D409 VanDerWaalsContact CB-CB 3.5Å; S406-D409 WeakPolarHBondContact CB-OD2 3.3Å; S406-D409 WeakPolarHBondContact OG-CB 3.32Å; S406-D409 PolarHBondContact OG-N 3.34Å; S406-D409 PolarHBondContact OG-OD1 3.48Å; S406-D409 PolarHBondContact OG-OD2 3.17Å; I407-D409 PolarHBondContact O-N 3.38Å; D409-E412 PolarHBondContact O-N 3.4Å; D409-T413 PolarHBondContact O-N 2.77Å; D409-T413 VanDerWaalsContact O-N 3.08Å; D409-T413 PolarHBondContact O-OG1 2.88Å
410	T	92.3	Very high	87	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-39.9	177.8	-59.6	0	0	0	0	111.7	G98 V102 S406 I407 R408 A414 I446	G98-T410 PolarHBondContact N-OG1 3.43Å; V102-T410 WeakPolarHBondContact CG2-OG1 3.44Å; S406-T410 VanDerWaalsContact O-CB 3.3Å; S406-T410 WeakPolarHBondContact O-CB 3.38Å; S406-T410 PolarHBondContact O-OG1 3.48Å; I407-T410 PolarHBondContact O-N 3.3Å; R408-T410 PolarHBondContact O-N 3.26Å; T410-A414 VanDerWaalsContact O-CB 3.22Å; T410-A414 WeakPolarHBondContact O-CB 3.38Å; T410-A414 PolarHBondContact O-N 3.03Å; T410-A414 VanDerWaalsContact O-N 3.13Å; T410-I446 HydrophobicContact CG2-CD1 4.4Å
411	H	91.6	Very high	86	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.2	-34.3	175.2	-68	-178.9	0	0	0	112.9	R374 I407 R408 Y417 H444 I446	R374-H411 HydrophobicContact CG-CB 3.96Å; R374-H411 WeakPolarHBondContact O-CB 3.44Å; R374-H411 PolarHBondContact O-ND1 3.38Å; I407-H411 WeakPolarHBondContact CG2-CE1 3.29Å; I407-H411 PolarHBondContact O-CD2 2.99Å; I407-H411 VanDerWaalsContact O-CG 3.32Å; I407-H411 PolarHBondContact O-N 3.31Å; R408-H411 PolarHBondContact O-N 2.64Å; R408-H411 VanDerWaalsContact O-N 3.09Å; H411-Y417 WeakPolarHBondContact O-CD2 3.43Å; H411-Y417 VanDerWaalsContact O-CE2 3.3Å; H411-Y417 WeakPolarHBondContact O-CE2 3.28Å; H411-H444 PolarHBondContact CD2-O 3.26Å; H411-H444 VanDerWaalsContact CD2-O 3.29Å; H411-I446 PolarHBondContact NE2-N 2.83Å
412	E	87.1	Confident	85.1	Confident	74 Å²	74	47 Å²	47	35%	0.346	25%	0.254	S	S	.	.	H	α-helix	trans	-71.3	-38.6	178.7	-73.8	167.8	178.6	0	0	112.3	R77 R408 D409 P421	R77-E412 IonicContact CZ-OE2 3.99Å; R77-E412 IonicContact NH1-OE2 3.51Å; R77-E412 PolarHBondContact NH1-OE2 3.08Å; R77-E412 IonicContact NH2-OE2 3.72Å; R77-E412 PolarHBondContact NH2-OE2 3.16Å; R408-E412 WeakPolarHBondContact CD-OE1 3.31Å; R408-E412 HydrophobicContact CG-CG 4.33Å; R408-E412 WeakPolarHBondContact CG-OE1 3.45Å; R408-E412 WeakPolarHBondContact O-CG 3.31Å; R408-E412 PolarHBondContact O-N 3.05Å; D409-E412 PolarHBondContact O-N 3.4Å; E412-P421 WeakPolarHBondContact O-CB 3.3Å; E412-P421 WeakPolarHBondContact O-CG 3.45Å
413	T	84.6	Confident	84.6	Confident	72 Å²	72	48.1 Å²	48.1	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-107.6	5.8	-172	62.3	0	0	0	0	114.3	D409 A415	D409-T413 PolarHBondContact O-N 2.77Å; D409-T413 VanDerWaalsContact O-N 3.08Å; D409-T413 PolarHBondContact O-OG1 2.88Å; T413-A415 PolarHBondContact O-N 3.28Å
414	A	85.3	Confident	84.5	Confident	10 Å²	10	49.1 Å²	49.1	8%	0.083	27%	0.271	C	S	.	.			trans	-68.5	116.6	179.4	0	0	0	0	0	110.8	T410 V416 Y417 H444	T410-A414 VanDerWaalsContact O-CB 3.22Å; T410-A414 WeakPolarHBondContact O-CB 3.38Å; T410-A414 PolarHBondContact O-N 3.03Å; T410-A414 VanDerWaalsContact O-N 3.13Å; A414-V416 HydrophobicContact CB-CG1 4.16Å; A414-V416 PolarHBondContact O-N 3.37Å; A414-Y417 HydrophobicContact CB-CD2 3.73Å; A414-Y417 HydrophobicContact CB-CE2 3.63Å; A414-Y417 WeakPolarHBondContact O-CD2 3.4Å; A414-Y417 PolarHBondContact O-N 2.94Å; A414-Y417 VanDerWaalsContact O-N 3.1Å; A414-H444 HydrophobicContact CB-CB 3.89Å
415	A	80.8	Confident	84.3	Confident	101 Å²	101	50.5 Å²	50.5	84%	0.835	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.6	-178.8	0	0	0	0	0	114.6	T413 Y417	T413-A415 PolarHBondContact O-N 3.28Å; A415-Y417 PolarHBondContact O-N 2.95Å
416	V	79.2	Confident	84.2	Confident	46 Å²	46	49.9 Å²	49.9	28%	0.279	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-21	176.2	72.8	0	0	0	0	112.8	A414 R418 R437 H444	A414-V416 HydrophobicContact CB-CG1 4.16Å; A414-V416 PolarHBondContact O-N 3.37Å; V416-R418 PolarHBondContact O-N 3.11Å; V416-R437 HydrophobicContact CG2-CG 4.19Å; V416-H444 HydrophobicContact CG1-CB 3.68Å
417	Y	80.3	Confident	84.1	Confident	16 Å²	16	55.1 Å²	55.1	6%	0.063	30%	0.301	C	S	.	.			trans	-83.9	101	177.7	-57.5	-53.9	0	0	0	109.3	R374 H411 A414 A415 F429 H444 Y445	R374-Y417 HydrophobicContact CG-CE2 4.21Å; H411-Y417 WeakPolarHBondContact O-CD2 3.43Å; H411-Y417 VanDerWaalsContact O-CE2 3.3Å; H411-Y417 WeakPolarHBondContact O-CE2 3.28Å; A414-Y417 HydrophobicContact CB-CD2 3.73Å; A414-Y417 HydrophobicContact CB-CE2 3.63Å; A414-Y417 WeakPolarHBondContact O-CD2 3.4Å; A414-Y417 PolarHBondContact O-N 2.94Å; A414-Y417 VanDerWaalsContact O-N 3.1Å; A415-Y417 PolarHBondContact O-N 2.95Å; Y417-F429 HydrophobicContact CE1-CZ 4.26Å; Y417-H444 PolarHBondContact OH-O 2.84Å; Y417-Y445 WeakPolarHBondContact OH-CB 3.47Å
418	R	65.5	Low	83.7	Confident	220 Å²	220	55.9 Å²	55.9	83%	0.83	30%	0.304	S	S	*	.			trans	-72.8	-35.1	-170.8	-66.6	-176.6	-177.5	164.7	1.6	114.5	V416	V416-R418 PolarHBondContact O-N 3.11Å
419	S	63.6	Low	83.6	Confident	51 Å²	51	54.8 Å²	54.8	36%	0.357	30%	0.3	S	S	.	.	S	Bend	trans	-92.1	165.2	172.6	-4.6	0	0	0	0	110.7	P421 R428	S419-P421 VanDerWaalsContact O-N 3.1Å; S419-R428 PolarHBondContact OG-NH1 3.25Å
420	P	72.8	Confident	83.1	Confident	96 Å²	96	55.6 Å²	55.6	62%	0.623	31%	0.31	S	S	*	.			trans	-48.6	120.8	-170.3	-29.5	34.8	0	0	0	111.3	E422 G423 R428	P420-E422 PolarHBondContact O-N 2.83Å; P420-G423 PolarHBondContact O-N 3.4Å; P420-R428 PolarHBondContact O-NH2 3.16Å
421	P	72.1	Confident	81.7	Confident	47 Å²	47	59.5 Å²	59.5	31%	0.305	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.8	-171.3	23.5	-33.5	0	0	0	112.6	R374 L375 E412 S419	R374-P421 VanDerWaalsContact CZ-O 3.25Å; R374-P421 PolarHBondContact NH1-O 2.85Å; R374-P421 PolarHBondContact NH2-O 2.89Å; L375-P421 VanDerWaalsContact CD2-O 3.31Å; L375-P421 WeakPolarHBondContact CD2-O 3.35Å; E412-P421 WeakPolarHBondContact O-CB 3.3Å; E412-P421 WeakPolarHBondContact O-CG 3.45Å; S419-P421 VanDerWaalsContact O-N 3.1Å
422	E	76.8	Confident	79.9	Confident	179 Å²	179	67.5 Å²	67.5	84%	0.836	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-21	177.5	-56.4	-174.6	-176.2	0	0	113.3	P420	P420-E422 PolarHBondContact O-N 2.83Å
423	G	86	Confident	78.5	Confident	30 Å²	30	65.9 Å²	65.9	31%	0.309	37%	0.367	S	S	.	.	S	Bend	trans	-80.9	146.6	-178.9	0	0	0	0	0	112.7	E371 R374 P420 R428	E371-G423 VanDerWaalsContact OE1-O 3.05Å; R374-G423 PolarHBondContact NH2-O 2.94Å; P420-G423 PolarHBondContact O-N 3.4Å; G423-R428 PolarHBondContact O-NH2 3.15Å
424	F	93.3	Very high	77	Confident	22 Å²	22	67.1 Å²	67.1	10%	0.096	37%	0.368	C	S	.	.			trans	-83.5	110.5	170.5	-179.6	-98.7	0	0	0	110.9	L311 H315 A318 V368 E371 V372 L375 P426	L311-F424 HydrophobicContact CB-CD2 4.04Å; L311-F424 HydrophobicContact CB-CE2 3.97Å; L311-F424 HydrophobicContact CB-CZ 4.38Å; L311-F424 HydrophobicContact CD1-CD2 3.84Å; L311-F424 HydrophobicContact CD1-CE2 4Å; L311-F424 HydrophobicContact CD2-CB 4.39Å; L311-F424 HydrophobicContact CD2-CD2 4.1Å; L311-F424 HydrophobicContact CD2-CG 4.4Å; L311-F424 HydrophobicContact CG-CD2 4.22Å; L311-F424 HydrophobicContact CG-CE2 4.48Å; H315-F424 HydrophobicContact CB-CD1 3.78Å; H315-F424 HydrophobicContact CB-CE1 4.03Å; H315-F424 AromaticContact CD2-CD1 3.35Å; H315-F424 WeakPolarHBondContact CD2-CD1 3.45Å; H315-F424 AromaticContact CD2-CG 3.63Å; H315-F424 AromaticContact CG-CD1 3.48Å; H315-F424 VanDerWaalsContact CG-CD1 3.48Å; H315-F424 WeakPolarHBondContact NE2-CB 3.33Å; H315-F424 AromaticContact NE2-CG 3.97Å; A318-F424 HydrophobicContact CB-CE1 3.97Å; V368-F424 HydrophobicContact CG1-CZ 4.26Å; E371-F424 HydrophobicContact CB-CD2 4.32Å; E371-F424 HydrophobicContact CB-CE2 4.02Å; E371-F424 HydrophobicContact CG-CD2 3.52Å; E371-F424 HydrophobicContact CG-CE2 3.73Å; E371-F424 HydrophobicContact CG-CG 4.21Å; V372-F424 HydrophobicContact CG2-CE2 3.94Å; L375-F424 HydrophobicContact CD1-CB 3.77Å; L375-F424 HydrophobicContact CD1-CD2 3.84Å; L375-F424 HydrophobicContact CD1-CG 4.31Å; F424-P426 HydrophobicContact CD1-CG 4.35Å; F424-P426 HydrophobicContact CE1-CG 3.62Å; F424-P426 HydrophobicContact CE2-CG 4.41Å; F424-P426 HydrophobicContact CZ-CG 3.65Å
425	D	92.6	Very high	75.1	Confident	42 Å²	42	73.2 Å²	73.2	23%	0.225	40%	0.399	C	S	.	.			trans	-143.4	103.6	173.4	154.6	33.3	0	0	0	109.3	E371 E427 R428	E371-D425 VanDerWaalsContact CD-O 3.3Å; E371-D425 PolarHBondContact OE1-N 3.46Å; D425-E427 PolarHBondContact O-N 2.73Å; D425-E427 WeakPolarHBondContact OD1-CA 3.26Å; D425-E427 VanDerWaalsContact OD1-CB 3.3Å; D425-E427 WeakPolarHBondContact OD1-CB 3.45Å; D425-E427 PolarHBondContact OD1-N 2.94Å; D425-R428 HydrophobicContact CB-CG 4.27Å; D425-R428 WeakPolarHBondContact O-CD 3.2Å; D425-R428 WeakPolarHBondContact O-CG 3.33Å; D425-R428 PolarHBondContact O-NE 3.11Å; D425-R428 VanDerWaalsContact OD2-CG 3.23Å; D425-R428 WeakPolarHBondContact OD2-CG 3.28Å; D425-R428 IonicContact OD2-CZ 3.5Å; D425-R428 IonicContact OD2-NE 3.42Å; D425-R428 IonicContact OD2-NH1 2.72Å; D425-R428 PolarHBondContact OD2-NH1 3.49Å
426	P	93.8	Very high	73.6	Confident	6 Å²	6	73.1 Å²	73.1	4%	0.039	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-58.9	-30.2	175.8	-29.1	37.9	0	0	0	114.1	Y364 C367 V368 F424 R428 F429	Y364-P426 HydrophobicContact CE2-CB 4Å; C367-P426 HydrophobicContact CB-CB 4.08Å; C367-P426 WeakPolarHBondContact CB-O 3.46Å; V368-P426 HydrophobicContact CB-CG 4.41Å; V368-P426 HydrophobicContact CG2-CB 3.84Å; V368-P426 HydrophobicContact CG2-CG 3.62Å; F424-P426 HydrophobicContact CD1-CG 4.35Å; F424-P426 HydrophobicContact CE1-CG 3.62Å; F424-P426 HydrophobicContact CE2-CG 4.41Å; F424-P426 HydrophobicContact CZ-CG 3.65Å; P426-R428 PolarHBondContact O-N 3.04Å; P426-R428 VanDerWaalsContact O-N 3.08Å; P426-F429 PolarHBondContact O-N 3.19Å
427	E	90.5	Very high	72.4	Confident	109 Å²	109	73.3 Å²	73.3	51%	0.509	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-66.8	-17.1	-171.8	-58.1	-167	162.6	0	0	112.9	K321 Y364 D425 F429 G430	K321-E427 IonicContact NZ-OE1 2.54Å; K321-E427 PolarHBondContact NZ-OE1 3.27Å; Y364-E427 HydrophobicContact CE2-CG 4.31Å; D425-E427 PolarHBondContact O-N 2.73Å; D425-E427 WeakPolarHBondContact OD1-CA 3.26Å; D425-E427 VanDerWaalsContact OD1-CB 3.3Å; D425-E427 WeakPolarHBondContact OD1-CB 3.45Å; D425-E427 PolarHBondContact OD1-N 2.94Å; E427-F429 PolarHBondContact O-N 3.42Å; E427-G430 PolarHBondContact O-N 3.02Å
428	R	87.9	Confident	70.8	Confident	19 Å²	19	75.1 Å²	75.1	7%	0.072	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-53.2	-22	168.2	-56.7	176.8	-151.1	-61.3	20.4	113.8	E371 S419 P420 G423 D425 P426 S433 R437	E371-R428 IonicContact OE1-CZ 3.85Å; E371-R428 IonicContact OE1-NE 3.33Å; E371-R428 PolarHBondContact OE1-NE 3.1Å; E371-R428 IonicContact OE1-NH2 2.59Å; E371-R428 IonicContact OE2-NE 3.74Å; S419-R428 PolarHBondContact OG-NH1 3.25Å; P420-R428 PolarHBondContact O-NH2 3.16Å; G423-R428 PolarHBondContact O-NH2 3.15Å; D425-R428 HydrophobicContact CB-CG 4.27Å; D425-R428 WeakPolarHBondContact O-CD 3.2Å; D425-R428 WeakPolarHBondContact O-CG 3.33Å; D425-R428 PolarHBondContact O-NE 3.11Å; D425-R428 VanDerWaalsContact OD2-CG 3.23Å; D425-R428 WeakPolarHBondContact OD2-CG 3.28Å; D425-R428 IonicContact OD2-CZ 3.5Å; D425-R428 IonicContact OD2-NE 3.42Å; D425-R428 IonicContact OD2-NH1 2.72Å; D425-R428 PolarHBondContact OD2-NH1 3.49Å; P426-R428 PolarHBondContact O-N 3.04Å; P426-R428 VanDerWaalsContact O-N 3.08Å; R428-S433 VanDerWaalsContact O-CB 3.24Å; R428-S433 WeakPolarHBondContact O-CB 3.16Å; R428-S433 PolarHBondContact O-OG 2.91Å; R428-R437 PolarHBondContact O-NH2 3.36Å
429	F	88.3	Confident	69.7	Low	5 Å²	5	69.5 Å²	69.5	2%	0.022	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-103.8	8.4	179.3	-67.8	-79.5	0	0	0	113.6	C367 K370 E371 R374 Y417 P426 E427 Y445	C367-F429 HydrophobicContact CB-CB 4.18Å; C367-F429 PolarHBondContact SG-O 3.41Å; K370-F429 HydrophobicContact CB-CB 4.32Å; K370-F429 HydrophobicContact CB-CD1 3.89Å; K370-F429 HydrophobicContact CB-CD2 3.7Å; K370-F429 HydrophobicContact CB-CE1 4.08Å; K370-F429 HydrophobicContact CB-CE2 3.86Å; K370-F429 HydrophobicContact CB-CG 3.71Å; K370-F429 HydrophobicContact CB-CZ 4.06Å; K370-F429 HydrophobicContact CD-CB 3.93Å; K370-F429 HydrophobicContact CD-CD1 3.77Å; K370-F429 HydrophobicContact CD-CE1 4.47Å; K370-F429 HydrophobicContact CD-CG 3.91Å; K370-F429 HydrophobicContact CG-CD1 4.34Å; K370-F429 HydrophobicContact CG-CG 4.44Å; E371-F429 HydrophobicContact CB-CD2 4.24Å; E371-F429 HydrophobicContact CB-CE2 4.1Å; E371-F429 VanDerWaalsContact OE2-CE2 3.28Å; E371-F429 WeakPolarHBondContact OE2-CE2 3.36Å; R374-F429 HydrophobicContact CB-CE2 4.38Å; R374-F429 HydrophobicContact CB-CZ 4.2Å; R374-F429 HydrophobicContact CG-CZ 4.47Å; Y417-F429 HydrophobicContact CE1-CZ 4.26Å; P426-F429 PolarHBondContact O-N 3.19Å; E427-F429 PolarHBondContact O-N 3.42Å; F429-Y445 HydrophobicContact CE1-CD1 4.49Å; F429-Y445 AromaticContact CE1-CD2 3.94Å; F429-Y445 HydrophobicContact CE1-CD2 3.94Å; F429-Y445 HydrophobicContact CE1-CE2 4.16Å; F429-Y445 HydrophobicContact CE1-CG 4.1Å; F429-Y445 AromaticContact CZ-CD2 3.77Å; F429-Y445 HydrophobicContact CZ-CD2 3.77Å; F429-Y445 AromaticContact CZ-CE2 3.85Å; F429-Y445 HydrophobicContact CZ-CE2 3.85Å; F429-Y445 HydrophobicContact CZ-CG 4.4Å
430	G	81.3	Confident	68.5	Low	23 Å²	23	71.5 Å²	71.5	24%	0.237	42%	0.416	C	S	.	.	S	Bend	trans	-63.3	167.3	175.7	0	0	0	0	0	113.8	E427 E432 S433 E434	E427-G430 PolarHBondContact O-N 3.02Å; G430-E432 PolarHBondContact O-N 2.71Å; G430-S433 WeakPolarHBondContact O-CA 3.33Å; G430-S433 WeakPolarHBondContact O-CB 3.34Å; G430-S433 PolarHBondContact O-N 3.39Å; G430-E434 PolarHBondContact O-N 2.97Å
431	V	62.3	Low	67.8	Low	82 Å²	82	67.6 Å²	67.6	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-53.7	-45.9	-171.1	-179.7	0	0	0	0	112.8	S433 E434 D435	V431-S433 PolarHBondContact O-N 3.01Å; V431-S433 VanDerWaalsContact O-N 3.16Å; V431-E434 PolarHBondContact O-N 3.11Å; V431-D435 PolarHBondContact O-N 3.44Å
432	E	54.4	Low	67.6	Low	168 Å²	168	74 Å²	74	79%	0.785	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-28.4	178.9	-61.3	-175.4	165.3	0	0	112.7	G430 T436	G430-E432 PolarHBondContact O-N 2.71Å; E432-T436 PolarHBondContact O-OG1 3.21Å
433	S	56.5	Low	68.1	Low	39 Å²	39	66.8 Å²	66.8	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-82.5	-23	177.8	-71.1	0	0	0	0	113.4	R428 G430 V431 R437	R428-S433 VanDerWaalsContact O-CB 3.24Å; R428-S433 WeakPolarHBondContact O-CB 3.16Å; R428-S433 PolarHBondContact O-OG 2.91Å; G430-S433 WeakPolarHBondContact O-CA 3.33Å; G430-S433 WeakPolarHBondContact O-CB 3.34Å; G430-S433 PolarHBondContact O-N 3.39Å; V431-S433 PolarHBondContact O-N 3.01Å; V431-S433 VanDerWaalsContact O-N 3.16Å; S433-R437 WeakPolarHBondContact O-CD 3.27Å; S433-R437 WeakPolarHBondContact O-CG 3.44Å
434	E	53.7	Low	68.2	Low	99 Å²	99	67.5 Å²	67.5	46%	0.463	37%	0.372	S	S	.	.	H	α-helix	trans	-77.1	-40.8	177	-68.7	-159.7	154.9	0	0	112	K370 G430 V431 T436 R437	K370-E434 IonicContact NZ-OE1 3.19Å; K370-E434 PolarHBondContact NZ-OE1 3.46Å; G430-E434 PolarHBondContact O-N 2.97Å; V431-E434 PolarHBondContact O-N 3.11Å; E434-T436 VanDerWaalsContact C-N 3.26Å; E434-T436 PolarHBondContact O-N 3.01Å; E434-R437 PolarHBondContact O-N 2.75Å; E434-R437 VanDerWaalsContact O-N 3.14Å
435	D	45.3	Very low	68.1	Low	137 Å²	137	68.7 Å²	68.7	73%	0.733	38%	0.376	S	S	*	.	H	α-helix	trans	-65.3	-30.8	178.3	-70.4	-28	0	0	0	112.4	V431 R437	V431-D435 PolarHBondContact O-N 3.44Å; D435-R437 VanDerWaalsContact C-N 3.31Å; D435-R437 PolarHBondContact O-N 3.31Å
436	T	48.4	Very low	68.2	Low	99 Å²	99	67 Å²	67	61%	0.607	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.2	177.9	-41.5	0	0	0	0	113	E432 E434	E432-T436 PolarHBondContact O-OG1 3.21Å; E434-T436 VanDerWaalsContact C-N 3.26Å; E434-T436 PolarHBondContact O-N 3.01Å
437	R	54.7	Low	68.2	Low	50 Å²	50	67.4 Å²	67.4	19%	0.189	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-18.4	-168.9	-83.6	170.5	-177.8	167.3	5.5	115.6	V416 R428 S433 E434 D435 G441	V416-R437 HydrophobicContact CG2-CG 4.19Å; R428-R437 PolarHBondContact O-NH2 3.36Å; S433-R437 WeakPolarHBondContact O-CD 3.27Å; S433-R437 WeakPolarHBondContact O-CG 3.44Å; E434-R437 PolarHBondContact O-N 2.75Å; E434-R437 VanDerWaalsContact O-N 3.14Å; D435-R437 VanDerWaalsContact C-N 3.31Å; D435-R437 PolarHBondContact O-N 3.31Å; R437-G441 WeakPolarHBondContact O-CA 3.37Å; R437-G441 PolarHBondContact O-N 2.91Å
438	G	47.2	Very low	68.5	Low	55 Å²	55	63.7 Å²	63.7	57%	0.567	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	-173.7	172.7	0	0	0	0	0	116.7	C440 G441	G438-C440 VanDerWaalsContact C-N 3.32Å; G438-C440 PolarHBondContact O-N 2.97Å; G438-G441 PolarHBondContact O-N 3.32Å
439	S	41.3	Very low	68.8	Low	101 Å²	101	63.5 Å²	63.5	71%	0.706	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.5	177.2	172.9	0	0	0	0	112.9
440	C	39.5	Very low	69	Low	94 Å²	94	63.7 Å²	63.7	64%	0.635	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-75.5	-22.3	-179	-147.9	0	0	0	0	112.8	G438 R442	G438-C440 VanDerWaalsContact C-N 3.32Å; G438-C440 PolarHBondContact O-N 2.97Å; C440-R442 PolarHBondContact O-N 2.84Å
441	G	57.5	Low	69.5	Low	14 Å²	14	63.8 Å²	63.8	14%	0.144	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-82.7	-0.1	-175.5	0	0	0	0	0	116.6	R437 G438 F443	R437-G441 WeakPolarHBondContact O-CA 3.37Å; R437-G441 PolarHBondContact O-N 2.91Å; G438-G441 PolarHBondContact O-N 3.32Å; G441-F443 PolarHBondContact O-N 2.95Å
442	R	68.8	Low	71	Confident	181 Å²	181	61.8 Å²	61.8	68%	0.683	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-70	-25.1	-172	-67.8	-174.7	-169.7	172.2	4.7	114.9	C440	C440-R442 PolarHBondContact O-N 2.84Å
443	F	86	Confident	72.9	Confident	28 Å²	28	55.5 Å²	55.5	12%	0.123	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-96	1.5	-176.4	-78.7	-90.9	0	0	0	114.4	A99 R103 L106 L107 G441 Y445 I446	A99-F443 HydrophobicContact CB-CB 4.02Å; R103-F443 HydrophobicContact CB-CB 4.07Å; R103-F443 HydrophobicContact CB-CD1 3.77Å; R103-F443 HydrophobicContact CB-CD2 3.78Å; R103-F443 HydrophobicContact CB-CE1 4.12Å; R103-F443 HydrophobicContact CB-CE2 4.12Å; R103-F443 HydrophobicContact CB-CG 3.59Å; R103-F443 HydrophobicContact CB-CZ 4.28Å; R103-F443 HydrophobicContact CG-CD1 4.3Å; R103-F443 HydrophobicContact CG-CD2 3.61Å; R103-F443 HydrophobicContact CG-CE1 4.29Å; R103-F443 HydrophobicContact CG-CE2 3.59Å; R103-F443 HydrophobicContact CG-CG 3.98Å; R103-F443 HydrophobicContact CG-CZ 3.94Å; L106-F443 HydrophobicContact CB-CE1 4.19Å; L106-F443 HydrophobicContact CD1-CD1 4.26Å; L106-F443 HydrophobicContact CD1-CE1 3.96Å; L107-F443 HydrophobicContact CD1-CE2 4.34Å; L107-F443 HydrophobicContact CD1-CZ 4.24Å; L107-F443 HydrophobicContact CD2-CZ 3.98Å; L107-F443 HydrophobicContact CG-CZ 3.96Å; G441-F443 PolarHBondContact O-N 2.95Å; F443-Y445 VanDerWaalsContact C-N 3.33Å; F443-I446 HydrophobicContact CB-CG2 4.37Å; F443-I446 HydrophobicContact CD1-CG2 3.88Å; F443-I446 HydrophobicContact CG-CG2 4.38Å
444	H	88.2	Confident	74.7	Confident	45 Å²	45	55.4 Å²	55.4	21%	0.208	32%	0.321	C	S	.	.	S	Bend	trans	-75.3	-24.9	169.5	-61.5	-66.7	0	0	0	112.6	A99 H411 A414 V416 Y417	A99-H444 VanDerWaalsContact CB-CE1 3.48Å; A99-H444 WeakPolarHBondContact CB-CE1 3.31Å; A99-H444 VanDerWaalsContact CB-ND1 3.33Å; A99-H444 WeakPolarHBondContact CB-ND1 3.32Å; H411-H444 PolarHBondContact CD2-O 3.26Å; H411-H444 VanDerWaalsContact CD2-O 3.29Å; A414-H444 HydrophobicContact CB-CB 3.89Å; V416-H444 HydrophobicContact CG1-CB 3.68Å; Y417-H444 PolarHBondContact OH-O 2.84Å
445	Y	92	Very high	76.7	Confident	47 Å²	47	53.4 Å²	53.4	18%	0.184	32%	0.317	C	S	.	.			trans	-124.9	99.7	178.5	-178.6	-106.6	0	0	0	110.2	K370 R374 Y417 F429 F443 P447	K370-Y445 VanDerWaalsContact CA-OH 3.25Å; K370-Y445 WeakPolarHBondContact CA-OH 3.32Å; K370-Y445 HydrophobicContact CG-CE1 4.3Å; K370-Y445 WeakPolarHBondContact O-CE2 3.25Å; K370-Y445 PolarHBondContact O-OH 3.49Å; R374-Y445 HydrophobicContact CB-CD2 4.22Å; R374-Y445 HydrophobicContact CB-CE2 3.98Å; R374-Y445 HydrophobicContact CG-CD2 4.4Å; Y417-Y445 WeakPolarHBondContact OH-CB 3.47Å; F429-Y445 HydrophobicContact CE1-CD1 4.49Å; F429-Y445 AromaticContact CE1-CD2 3.94Å; F429-Y445 HydrophobicContact CE1-CD2 3.94Å; F429-Y445 HydrophobicContact CE1-CE2 4.16Å; F429-Y445 HydrophobicContact CE1-CG 4.1Å; F429-Y445 AromaticContact CZ-CD2 3.77Å; F429-Y445 HydrophobicContact CZ-CD2 3.77Å; F429-Y445 AromaticContact CZ-CE2 3.85Å; F429-Y445 HydrophobicContact CZ-CE2 3.85Å; F429-Y445 HydrophobicContact CZ-CG 4.4Å; F443-Y445 VanDerWaalsContact C-N 3.33Å; Y445-P447 VanDerWaalsContact C-CD 3.47Å; Y445-P447 HydrophobicContact CD1-CG 4.38Å; Y445-P447 HydrophobicContact CD2-CG 4.36Å; Y445-P447 HydrophobicContact CE1-CG 3.76Å; Y445-P447 HydrophobicContact CE2-CG 3.73Å; Y445-P447 VanDerWaalsContact CZ-CG 3.4Å; Y445-P447 WeakPolarHBondContact OH-CG 3.39Å
446	I	94.7	Very high	79.1	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.031	29%	0.291	C	S	.	.			trans	-134.2	44.1	-171.8	53.4	166.8	0	0	0	113.5	V102 L106 I407 T410 H411 F443 F448 G449	V102-I446 HydrophobicContact CB-CD1 4.32Å; V102-I446 HydrophobicContact CG1-CD1 3.43Å; V102-I446 VanDerWaalsContact CG1-CD1 3.43Å; L106-I446 HydrophobicContact CD1-CD1 4.37Å; I407-I446 WeakPolarHBondContact CD1-O 3.49Å; I407-I446 HydrophobicContact CG1-CD1 4.22Å; I407-I446 HydrophobicContact CG1-CG1 4.32Å; I407-I446 HydrophobicContact CG2-CG1 4.38Å; I407-I446 WeakPolarHBondContact CG2-O 3.48Å; T410-I446 HydrophobicContact CG2-CD1 4.4Å; H411-I446 PolarHBondContact NE2-N 2.83Å; F443-I446 HydrophobicContact CB-CG2 4.37Å; F443-I446 HydrophobicContact CD1-CG2 3.88Å; F443-I446 HydrophobicContact CG-CG2 4.38Å; I446-F448 PolarHBondContact O-N 3.2Å; I446-G449 PolarHBondContact O-N 2.97Å
447	P	94.8	Very high	81.3	Confident	15 Å²	15	44.7 Å²	44.7	10%	0.097	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.2	179.8	25.6	-33	0	0	0	113.4	L373 Y445	L373-P447 HydrophobicContact CB-CB 3.85Å; L373-P447 HydrophobicContact CB-CG 4.07Å; Y445-P447 VanDerWaalsContact C-CD 3.47Å; Y445-P447 HydrophobicContact CD1-CG 4.38Å; Y445-P447 HydrophobicContact CD2-CG 4.36Å; Y445-P447 HydrophobicContact CE1-CG 3.76Å; Y445-P447 HydrophobicContact CE2-CG 3.73Å; Y445-P447 VanDerWaalsContact CZ-CG 3.4Å; Y445-P447 WeakPolarHBondContact OH-CG 3.39Å
448	F	95.4	Very high	83.3	Confident	31 Å²	31	45.2 Å²	45.2	14%	0.136	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	14.8	178.1	-61.6	-73.2	0	0	0	113.1	L373 I446 C455 Q458 A461 Q462	L373-F448 HydrophobicContact CD1-CE2 3.69Å; L373-F448 HydrophobicContact CD1-CZ 3.54Å; I446-F448 PolarHBondContact O-N 3.2Å; F448-C455 HydrophobicContact CB-CB 3.84Å; F448-C455 HydrophobicContact CD1-CB 3.93Å; F448-C455 HydrophobicContact CG-CB 4.34Å; F448-C455 PolarHBondContact O-N 3.34Å; F448-Q458 HydrophobicContact CB-CB 4.32Å; F448-Q458 HydrophobicContact CB-CG 4.34Å; F448-Q458 HydrophobicContact CD1-CB 3.85Å; F448-Q458 HydrophobicContact CD1-CG 4.01Å; F448-Q458 HydrophobicContact CD2-CB 4.23Å; F448-Q458 VanDerWaalsContact CD2-CD 3.5Å; F448-Q458 HydrophobicContact CD2-CG 3.51Å; F448-Q458 HydrophobicContact CE1-CB 4.21Å; F448-Q458 HydrophobicContact CE1-CG 4.17Å; F448-Q458 HydrophobicContact CE2-CG 3.7Å; F448-Q458 HydrophobicContact CG-CB 3.86Å; F448-Q458 HydrophobicContact CG-CG 3.67Å; F448-Q458 HydrophobicContact CZ-CG 4.02Å; F448-A461 HydrophobicContact CE1-CB 4.12Å; F448-Q462 HydrophobicContact CE2-CG 4.22Å; F448-Q462 HydrophobicContact CZ-CG 4.06Å
449	G	94	Very high	85.6	Confident	15 Å²	15	48.5 Å²	48.5	16%	0.155	27%	0.273	C	S	.	.			trans	68.5	-148	-174	0	0	0	0	0	112.4	I446	I446-G449 PolarHBondContact O-N 2.97Å
450	G	92.5	Very high	88.2	Confident	8 Å²	8	44.6 Å²	44.6	8%	0.082	24%	0.244	C	C	.	.			trans	-173.2	175.3	-175.8	0	0	0	0	0	113	S454	G450-S454 PolarHBondContact O-N 2.78Å
451	G	92.6	Very high	90.9	Very high	26 Å²	26	41 Å²	41	27%	0.268	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	64	-148.8	-179	0	0	0	0	0	113.3	R453 S454	G451-R453 PolarHBondContact O-N 3.25Å; G451-R453 VanDerWaalsContact O-N 3.14Å; G451-S454 PolarHBondContact O-N 2.66Å; G451-S454 PolarHBondContact O-OG 2.75Å
452	A	93.3	Very high	92.8	Very high	39 Å²	39	41 Å²	41	32%	0.322	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-62.1	-23.2	-176.8	0	0	0	0	0	113.4	E109 H138 R142	E109-A452 HydrophobicContact CB-CB 4.24Å; E109-A452 HydrophobicContact CG-CB 4.24Å; H138-A452 PolarHBondContact CE1-O 3.35Å; H138-A452 VanDerWaalsContact CE1-O 3.27Å; R142-A452 PolarHBondContact NE-O 2.95Å; R142-A452 PolarHBondContact NH1-O 2.9Å
453	R	94.3	Very high	94.1	Very high	37 Å²	37	32.4 Å²	32.4	14%	0.14	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-103.5	17.9	-177.4	-59.6	-69.8	-172.8	167.8	5.1	113.2	E109 L130 A133 H138 G451	E109-R453 HydrophobicContact CG-CG 3.8Å; E109-R453 IonicContact OE1-CZ 3.86Å; E109-R453 IonicContact OE1-NE 2.79Å; E109-R453 PolarHBondContact OE1-NE 2.81Å; E109-R453 IonicContact OE1-NH2 2.72Å; E109-R453 PolarHBondContact OE1-NH2 3.16Å; L130-R453 PolarHBondContact O-NH1 3.33Å; A133-R453 VanDerWaalsContact O-CZ 3.28Å; A133-R453 PolarHBondContact O-NH1 3.32Å; A133-R453 PolarHBondContact O-NH2 3.2Å; H138-R453 PolarHBondContact CD2-NH1 2.84Å; H138-R453 WeakPolarHBondContact NE2-CD 3.39Å; H138-R453 PolarHBondContact NE2-NH1 3.46Å; H138-R453 VanDerWaalsContact NE2-NH1 3.16Å; G451-R453 PolarHBondContact O-N 3.25Å; G451-R453 VanDerWaalsContact O-N 3.14Å
454	S	94.7	Very high	94.7	Very high	37 Å²	37	31.4 Å²	31.4	26%	0.259	18%	0.181	S	C	.	.			trans	-58.3	145.7	174.4	61.2	0	0	0	0	110.8	R142 G450 G451 L456	R142-S454 VanDerWaalsContact CZ-O 3.27Å; R142-S454 PolarHBondContact NH1-O 3.07Å; R142-S454 PolarHBondContact NH2-O 3.46Å; R142-S454 PolarHBondContact NH2-OG 2.76Å; G450-S454 PolarHBondContact O-N 2.78Å; G451-S454 PolarHBondContact O-N 2.66Å; G451-S454 PolarHBondContact O-OG 2.75Å; S454-L456 PolarHBondContact O-N 2.81Å
455	C	96.1	Very high	95.2	Very high	57 Å²	57	29.3 Å²	29.3	39%	0.385	17%	0.172	S	C	.	.			trans	-61.6	123.7	-177.3	-173.6	0	0	0	0	111.4	F448 G457	F448-C455 HydrophobicContact CB-CB 3.84Å; F448-C455 HydrophobicContact CD1-CB 3.93Å; F448-C455 HydrophobicContact CG-CB 4.34Å; F448-C455 PolarHBondContact O-N 3.34Å; C455-G457 VanDerWaalsContact C-N 3.34Å; C455-G457 PolarHBondContact SG-N 3.15Å; C455-G457 VanDerWaalsContact SG-N 3.43Å
456	L	95.4	Very high	95.4	Very high	38 Å²	38	28 Å²	28	20%	0.199	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-35.9	173.6	-71.8	176.7	0	0	0	111.7	L130 R142 L145 A146 F149 S454 Q458	L130-L456 HydrophobicContact CD2-CD1 3.75Å; L130-L456 HydrophobicContact CD2-CG 4.46Å; R142-L456 HydrophobicContact CG-CD1 4.15Å; R142-L456 HydrophobicContact CG-CD2 3.97Å; R142-L456 HydrophobicContact CG-CG 4.39Å; L145-L456 HydrophobicContact CB-CD1 3.69Å; A146-L456 HydrophobicContact CB-CD2 4.21Å; F149-L456 WeakPolarHBondContact CB-O 3.36Å; F149-L456 HydrophobicContact CD2-CB 3.58Å; F149-L456 HydrophobicContact CE2-CB 3.71Å; F149-L456 HydrophobicContact CE2-CD1 4.4Å; F149-L456 HydrophobicContact CG-CB 4.33Å; F149-L456 WeakPolarHBondContact CG-O 3.42Å; S454-L456 PolarHBondContact O-N 2.81Å; L456-Q458 PolarHBondContact O-N 2.9Å
457	G	95	Very high	95.6	Very high	15 Å²	15	27.7 Å²	27.7	16%	0.155	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	8.4	-179.1	0	0	0	0	0	115.3	C455 K459 L460 A461	C455-G457 VanDerWaalsContact C-N 3.34Å; C455-G457 PolarHBondContact SG-N 3.15Å; C455-G457 VanDerWaalsContact SG-N 3.43Å; G457-K459 PolarHBondContact O-N 2.87Å; G457-L460 WeakPolarHBondContact O-CB 3.14Å; G457-L460 PolarHBondContact O-N 3.46Å; G457-A461 PolarHBondContact O-N 3.38Å
458	Q	95.1	Very high	95.7	Very high	61 Å²	61	27 Å²	27	29%	0.285	16%	0.161	S	C	.	.	H	α-helix	trans	-51.8	-51.3	-175.5	169.2	173	-3.5	0	0	112.5	F448 L456 L460 A461 Q462	F448-Q458 HydrophobicContact CB-CB 4.32Å; F448-Q458 HydrophobicContact CB-CG 4.34Å; F448-Q458 HydrophobicContact CD1-CB 3.85Å; F448-Q458 HydrophobicContact CD1-CG 4.01Å; F448-Q458 HydrophobicContact CD2-CB 4.23Å; F448-Q458 VanDerWaalsContact CD2-CD 3.5Å; F448-Q458 HydrophobicContact CD2-CG 3.51Å; F448-Q458 HydrophobicContact CE1-CB 4.21Å; F448-Q458 HydrophobicContact CE1-CG 4.17Å; F448-Q458 HydrophobicContact CE2-CG 3.7Å; F448-Q458 HydrophobicContact CG-CB 3.86Å; F448-Q458 HydrophobicContact CG-CG 3.67Å; F448-Q458 HydrophobicContact CZ-CG 4.02Å; L456-Q458 PolarHBondContact O-N 2.9Å; Q458-L460 VanDerWaalsContact C-N 3.34Å; Q458-L460 PolarHBondContact O-N 3.49Å; Q458-A461 PolarHBondContact O-N 3.42Å; Q458-Q462 WeakPolarHBondContact O-CG 3.29Å; Q458-Q462 PolarHBondContact O-N 3.27Å
459	K	95.6	Very high	95.9	Very high	124 Å²	124	25.5 Å²	25.5	54%	0.539	16%	0.155	S	C	.	.	H	α-helix	trans	-68.6	-34.5	-176.5	-66.5	-62.1	179.9	-173.1	0	112.7	L154 G457 A463	L154-K459 HydrophobicContact CD1-CB 3.58Å; G457-K459 PolarHBondContact O-N 2.87Å; K459-A463 WeakPolarHBondContact O-CB 3.33Å; K459-A463 PolarHBondContact O-N 3.32Å
460	L	96	Very high	95.9	Very high	18 Å²	18	24.8 Å²	24.8	9%	0.094	15%	0.147	C	C	.	.	H	α-helix	trans	-64.5	-49.3	173.4	-179.6	62.4	0	0	0	111.2	F149 L154 F157 L161 L197 G457 Q458 Q462 A463 V464	F149-L460 HydrophobicContact CD1-CB 4.31Å; F149-L460 HydrophobicContact CD1-CD2 4.3Å; F149-L460 HydrophobicContact CE1-CD2 3.97Å; L154-L460 HydrophobicContact CD2-CB 3.78Å; L154-L460 HydrophobicContact CD2-CD1 3.88Å; L154-L460 HydrophobicContact CD2-CG 4.42Å; F157-L460 HydrophobicContact CD2-CD1 4.39Å; L161-L460 HydrophobicContact CD1-CD1 3.57Å; L197-L460 HydrophobicContact CD1-CD2 4.12Å; L197-L460 HydrophobicContact CD2-CD2 4.02Å; G457-L460 WeakPolarHBondContact O-CB 3.14Å; G457-L460 PolarHBondContact O-N 3.46Å; Q458-L460 VanDerWaalsContact C-N 3.34Å; Q458-L460 PolarHBondContact O-N 3.49Å; L460-Q462 VanDerWaalsContact C-N 3.34Å; L460-Q462 PolarHBondContact O-N 2.67Å; L460-A463 PolarHBondContact O-N 3.48Å; L460-V464 WeakPolarHBondContact O-CG2 3.39Å; L460-V464 PolarHBondContact O-N 2.83Å
461	A	96.8	Very high	96	Very high	18 Å²	18	24.4 Å²	24.4	15%	0.149	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-42.5	179.2	0	0	0	0	0	111.8	F448 G457 Q458 V464 L465	F448-A461 HydrophobicContact CE1-CB 4.12Å; G457-A461 PolarHBondContact O-N 3.38Å; Q458-A461 PolarHBondContact O-N 3.42Å; A461-V464 PolarHBondContact O-N 2.95Å; A461-L465 WeakPolarHBondContact O-CG 3.38Å; A461-L465 PolarHBondContact O-N 2.91Å
462	Q	96.9	Very high	96.2	Very high	14 Å²	14	23.2 Å²	23.2	7%	0.065	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-48	174	-72.7	-177.4	-50.9	0	0	111.4	F448 Q458 L460 V464 L465 Q466	F448-Q462 HydrophobicContact CE2-CG 4.22Å; F448-Q462 HydrophobicContact CZ-CG 4.06Å; Q458-Q462 WeakPolarHBondContact O-CG 3.29Å; Q458-Q462 PolarHBondContact O-N 3.27Å; L460-Q462 VanDerWaalsContact C-N 3.34Å; L460-Q462 PolarHBondContact O-N 2.67Å; Q462-V464 VanDerWaalsContact C-N 3.34Å; Q462-V464 PolarHBondContact O-N 3.33Å; Q462-L465 PolarHBondContact O-N 3.11Å; Q462-Q466 VanDerWaalsContact O-CG 3.28Å; Q462-Q466 WeakPolarHBondContact O-CG 3.29Å; Q462-Q466 PolarHBondContact O-N 3.19Å
463	A	96.9	Very high	96.2	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.017	12%	0.117	C	C	.	.	H	α-helix	trans	-59.7	-42.7	177.8	0	0	0	0	0	112.1	V158 L359 K459 L460 L465 Q466 L467	V158-A463 HydrophobicContact CG2-CB 4.31Å; L359-A463 HydrophobicContact CD1-CB 4.13Å; K459-A463 WeakPolarHBondContact O-CB 3.33Å; K459-A463 PolarHBondContact O-N 3.32Å; L460-A463 PolarHBondContact O-N 3.48Å; A463-L465 PolarHBondContact O-N 2.82Å; A463-Q466 PolarHBondContact O-N 2.97Å; A463-L467 VanDerWaalsContact O-CB 3.31Å; A463-L467 WeakPolarHBondContact O-CB 3.39Å; A463-L467 WeakPolarHBondContact O-CG 3.49Å; A463-L467 PolarHBondContact O-N 3.21Å
464	V	97.7	Very high	96	Very high	6 Å²	6	21.3 Å²	21.3	4%	0.036	12%	0.116	C	C	.	.	H	α-helix	trans	-60.1	-44.8	176.4	172.2	0	0	0	0	111.6	L161 L165 M192 T301 L460 A461 Q462 L467 L468	L161-V464 HydrophobicContact CD1-CG2 4.03Å; L161-V464 HydrophobicContact CD2-CG2 4.08Å; L165-V464 HydrophobicContact CD1-CG1 4.44Å; M192-V464 HydrophobicContact CE-CG1 4.06Å; T301-V464 HydrophobicContact CG2-CB 4.22Å; T301-V464 HydrophobicContact CG2-CG1 3.62Å; L460-V464 WeakPolarHBondContact O-CG2 3.39Å; L460-V464 PolarHBondContact O-N 2.83Å; A461-V464 PolarHBondContact O-N 2.95Å; Q462-V464 VanDerWaalsContact C-N 3.34Å; Q462-V464 PolarHBondContact O-N 3.33Å; V464-L467 PolarHBondContact O-N 3.17Å; V464-L468 VanDerWaalsContact O-CB 3.32Å; V464-L468 WeakPolarHBondContact O-CB 3.37Å; V464-L468 PolarHBondContact O-N 3.01Å
465	L	98.4	Very high	95.7	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-68.5	-39.9	179.8	-65.3	171.4	0	0	0	112.4	A304 L308 V369 L373 A461 Q462 A463 L468 A469	A304-L465 HydrophobicContact CB-CD1 3.8Å; A304-L465 HydrophobicContact CB-CD2 3.68Å; A304-L465 HydrophobicContact CB-CG 4.31Å; L308-L465 HydrophobicContact CD2-CD2 4.45Å; L308-L465 WeakPolarHBondContact CD2-O 3.41Å; V369-L465 HydrophobicContact CG1-CB 3.92Å; V369-L465 HydrophobicContact CG1-CD1 3.82Å; V369-L465 HydrophobicContact CG2-CB 3.81Å; L373-L465 HydrophobicContact CD1-CD1 4.19Å; L373-L465 HydrophobicContact CD2-CD1 4.1Å; L373-L465 HydrophobicContact CG-CD1 4.28Å; A461-L465 WeakPolarHBondContact O-CG 3.38Å; A461-L465 PolarHBondContact O-N 2.91Å; Q462-L465 PolarHBondContact O-N 3.11Å; A463-L465 PolarHBondContact O-N 2.82Å; L465-L468 PolarHBondContact O-N 2.92Å; L465-A469 WeakPolarHBondContact O-CB 3.37Å; L465-A469 PolarHBondContact O-N 3.1Å
466	Q	98.1	Very high	95.5	Very high	18 Å²	18	18.2 Å²	18.2	8%	0.084	9%	0.094	C	C	.	.	H	α-helix	trans	-63.9	-47.2	175.3	-67.7	179.2	-54.9	0	0	110.9	L359 V365 V369 Q462 A463 L468 A469 V470	L359-Q466 HydrophobicContact CD2-CB 4.07Å; V365-Q466 HydrophobicContact CG1-CB 3.97Å; V365-Q466 HydrophobicContact CG1-CG 3.99Å; V369-Q466 HydrophobicContact CG2-CG 3.96Å; Q462-Q466 VanDerWaalsContact O-CG 3.28Å; Q462-Q466 WeakPolarHBondContact O-CG 3.29Å; Q462-Q466 PolarHBondContact O-N 3.19Å; A463-Q466 PolarHBondContact O-N 2.97Å; Q466-L468 VanDerWaalsContact C-N 3.33Å; Q466-L468 PolarHBondContact O-N 3.15Å; Q466-A469 PolarHBondContact O-N 3.41Å; Q466-V470 WeakPolarHBondContact O-CG2 3.26Å; Q466-V470 PolarHBondContact O-N 2.87Å
467	L	97.6	Very high	95.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.9	-43.2	175.7	-71.9	169.8	0	0	0	111.6	V158 L161 Q162 L165 L354 L359 A463 V464 V470 E471	V158-L467 HydrophobicContact CG1-CD1 4.26Å; V158-L467 HydrophobicContact CG1-CD2 4.49Å; L161-L467 HydrophobicContact CB-CD1 3.97Å; Q162-L467 HydrophobicContact CB-CD1 4.23Å; Q162-L467 HydrophobicContact CB-CD2 3.86Å; Q162-L467 HydrophobicContact CG-CD2 3.91Å; L165-L467 HydrophobicContact CD1-CB 3.46Å; L165-L467 VanDerWaalsContact CD1-CB 3.46Å; L165-L467 HydrophobicContact CD1-CD1 4.24Å; L354-L467 HydrophobicContact CB-CD2 4.28Å; L354-L467 HydrophobicContact CD1-CD2 3.91Å; L359-L467 HydrophobicContact CD1-CD1 4.45Å; L359-L467 HydrophobicContact CD1-CD2 4.07Å; L359-L467 HydrophobicContact CD1-CG 3.99Å; L359-L467 HydrophobicContact CD2-CD2 3.84Å; L359-L467 HydrophobicContact CD2-CG 4.15Å; L359-L467 HydrophobicContact CG-CD2 4.38Å; A463-L467 VanDerWaalsContact O-CB 3.31Å; A463-L467 WeakPolarHBondContact O-CB 3.39Å; A463-L467 WeakPolarHBondContact O-CG 3.49Å; A463-L467 PolarHBondContact O-N 3.21Å; V464-L467 PolarHBondContact O-N 3.17Å; L467-V470 PolarHBondContact O-N 3.16Å; L467-E471 WeakPolarHBondContact O-CG 3.5Å; L467-E471 PolarHBondContact O-N 2.7Å
468	L	98.2	Very high	95.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-45.6	176.8	-179.4	57.6	0	0	0	111.5	L165 V169 S305 L308 I309 V464 L465 Q466 V470 E471 L472	L165-L468 HydrophobicContact CD2-CB 4.03Å; L165-L468 HydrophobicContact CD2-CD1 3.92Å; L165-L468 HydrophobicContact CD2-CG 4.44Å; V169-L468 HydrophobicContact CG2-CD1 4.11Å; S305-L468 WeakPolarHBondContact OG-CD2 2.79Å; L308-L468 HydrophobicContact CD2-CB 4.2Å; L308-L468 HydrophobicContact CD2-CD2 4.13Å; L308-L468 HydrophobicContact CD2-CG 4.15Å; I309-L468 HydrophobicContact CD1-CD2 4.47Å; V464-L468 VanDerWaalsContact O-CB 3.32Å; V464-L468 WeakPolarHBondContact O-CB 3.37Å; V464-L468 PolarHBondContact O-N 3.01Å; L465-L468 PolarHBondContact O-N 2.92Å; Q466-L468 VanDerWaalsContact C-N 3.33Å; Q466-L468 PolarHBondContact O-N 3.15Å; L468-V470 VanDerWaalsContact C-N 3.3Å; L468-V470 PolarHBondContact O-N 3.34Å; L468-E471 PolarHBondContact O-N 3.38Å; L468-L472 HydrophobicContact CD1-CD1 3.87Å; L468-L472 HydrophobicContact CD1-CG 3.92Å; L468-L472 HydrophobicContact CD2-CD1 4.5Å; L468-L472 HydrophobicContact CG-CD1 3.75Å; L468-L472 HydrophobicContact CG-CG 4.29Å; L468-L472 VanDerWaalsContact O-CB 3.31Å; L468-L472 WeakPolarHBondContact O-CB 3.21Å; L468-L472 WeakPolarHBondContact O-CD1 3.36Å; L468-L472 VanDerWaalsContact O-CG 3.24Å; L468-L472 WeakPolarHBondContact O-CG 3.45Å; L468-L472 PolarHBondContact O-N 3.12Å
469	A	97.8	Very high	95.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.9	-45.1	176.4	0	0	0	0	0	111.3	L308 V365 L465 Q466 V473	L308-A469 HydrophobicContact CD1-CB 4.44Å; L308-A469 HydrophobicContact CD2-CB 4.04Å; V365-A469 HydrophobicContact CG1-CB 3.94Å; L465-A469 WeakPolarHBondContact O-CB 3.37Å; L465-A469 PolarHBondContact O-N 3.1Å; Q466-A469 PolarHBondContact O-N 3.41Å; A469-V473 WeakPolarHBondContact O-CB 3.35Å; A469-V473 VanDerWaalsContact O-CG2 3.23Å; A469-V473 WeakPolarHBondContact O-CG2 3.37Å; A469-V473 PolarHBondContact O-N 3.49Å
470	V	95.5	Very high	95.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.3	-51.3	177.6	175	0	0	0	0	111.1	L326 L354 L362 Q466 L467 L468 L472 V473 R474	L326-V470 HydrophobicContact CD1-CG1 4.36Å; L326-V470 HydrophobicContact CD2-CG1 4.19Å; L326-V470 HydrophobicContact CD2-CG2 4.03Å; L354-V470 HydrophobicContact CD1-CG1 4.08Å; L354-V470 HydrophobicContact CD1-CG2 4.41Å; L362-V470 HydrophobicContact CD1-CG2 3.64Å; Q466-V470 WeakPolarHBondContact O-CG2 3.26Å; Q466-V470 PolarHBondContact O-N 2.87Å; L467-V470 PolarHBondContact O-N 3.16Å; L468-V470 VanDerWaalsContact C-N 3.3Å; L468-V470 PolarHBondContact O-N 3.34Å; V470-L472 PolarHBondContact O-N 2.89Å; V470-V473 PolarHBondContact O-N 3.3Å; V470-R474 HydrophobicContact CG1-CG 4.32Å; V470-R474 WeakPolarHBondContact O-CB 3.46Å; V470-R474 VanDerWaalsContact O-CG 3.24Å; V470-R474 WeakPolarHBondContact O-CG 3.39Å; V470-R474 PolarHBondContact O-N 3.08Å
471	E	94.8	Very high	95.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.9	-37	-176.3	-67.5	-61.5	151.6	0	0	112.1	Q162 L165 R166 V169 L467 L468 R474 T475	Q162-E471 HydrophobicContact CG-CG 4.32Å; Q162-E471 VanDerWaalsContact CG-OE1 3.24Å; Q162-E471 WeakPolarHBondContact CG-OE1 3.42Å; Q162-E471 PolarHBondContact NE2-OE1 2.99Å; L165-E471 HydrophobicContact CB-CG 4.43Å; R166-E471 HydrophobicContact CB-CG 4.3Å; R166-E471 WeakPolarHBondContact CB-OE2 3.42Å; R166-E471 VanDerWaalsContact CG-OE2 3.3Å; R166-E471 WeakPolarHBondContact CG-OE2 3.21Å; R166-E471 IonicContact CZ-OE1 3.71Å; R166-E471 IonicContact NE-OE1 2.9Å; R166-E471 PolarHBondContact NE-OE1 3.12Å; R166-E471 IonicContact NE-OE2 2.71Å; R166-E471 PolarHBondContact NE-OE2 2.89Å; R166-E471 IonicContact NH2-OE1 3.62Å; R166-E471 PolarHBondContact NH2-OE1 3.5Å; V169-E471 HydrophobicContact CG2-CB 4.36Å; L467-E471 WeakPolarHBondContact O-CG 3.5Å; L467-E471 PolarHBondContact O-N 2.7Å; L468-E471 PolarHBondContact O-N 3.38Å; E471-R474 IonicContact OE1-NH1 3.72Å; E471-T475 WeakPolarHBondContact O-CB 3.31Å; E471-T475 PolarHBondContact O-N 3.36Å; E471-T475 VanDerWaalsContact O-N 3.1Å; E471-T475 PolarHBondContact O-OG1 3.41Å
472	L	95.3	Very high	95.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-54.3	172.9	-78	166.6	0	0	0	111.3	V169 W172 I309 L468 V470 R474 T475 A476 W478 F504	V169-L472 HydrophobicContact CG1-CD2 4.32Å; V169-L472 HydrophobicContact CG2-CD2 4.15Å; V169-L472 HydrophobicContact CG2-CG 4.34Å; W172-L472 HydrophobicContact CZ3-CD2 4.25Å; I309-L472 HydrophobicContact CD1-CD1 4.27Å; I309-L472 HydrophobicContact CG1-CD1 3.51Å; I309-L472 HydrophobicContact CG1-CD2 4.4Å; L468-L472 HydrophobicContact CD1-CD1 3.87Å; L468-L472 HydrophobicContact CD1-CG 3.92Å; L468-L472 HydrophobicContact CD2-CD1 4.5Å; L468-L472 HydrophobicContact CG-CD1 3.75Å; L468-L472 HydrophobicContact CG-CG 4.29Å; L468-L472 VanDerWaalsContact O-CB 3.31Å; L468-L472 WeakPolarHBondContact O-CB 3.21Å; L468-L472 WeakPolarHBondContact O-CD1 3.36Å; L468-L472 VanDerWaalsContact O-CG 3.24Å; L468-L472 WeakPolarHBondContact O-CG 3.45Å; L468-L472 PolarHBondContact O-N 3.12Å; V470-L472 PolarHBondContact O-N 2.89Å; L472-R474 VanDerWaalsContact C-N 3.27Å; L472-R474 PolarHBondContact O-N 3.27Å; L472-T475 PolarHBondContact O-N 3.38Å; L472-A476 PolarHBondContact O-N 2.91Å; L472-W478 HydrophobicContact CB-CH2 3.94Å; L472-W478 HydrophobicContact CB-CZ3 3.83Å; L472-W478 HydrophobicContact CD2-CE3 4.31Å; L472-W478 HydrophobicContact CD2-CZ3 4.16Å; L472-F504 HydrophobicContact CD2-CE1 4.03Å
473	V	94.2	Very high	95.5	Very high	6 Å²	6	30.6 Å²	30.6	4%	0.036	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-28.6	-174.7	172.5	0	0	0	0	112.5	I319 I322 Q323 L326 A469 V470 L507	I319-V473 HydrophobicContact CG2-CG1 4.34Å; I319-V473 HydrophobicContact CG2-CG2 4.19Å; I322-V473 HydrophobicContact CB-CG1 4.44Å; I322-V473 HydrophobicContact CB-CG2 4.3Å; I322-V473 HydrophobicContact CD1-CG2 4.29Å; I322-V473 HydrophobicContact CG2-CB 4.13Å; I322-V473 HydrophobicContact CG2-CG1 3.98Å; I322-V473 HydrophobicContact CG2-CG2 3.92Å; Q323-V473 HydrophobicContact CB-CG1 4.35Å; Q323-V473 HydrophobicContact CG-CG1 3.23Å; L326-V473 HydrophobicContact CD1-CB 4.46Å; L326-V473 HydrophobicContact CD1-CG1 4.15Å; A469-V473 WeakPolarHBondContact O-CB 3.35Å; A469-V473 VanDerWaalsContact O-CG2 3.23Å; A469-V473 WeakPolarHBondContact O-CG2 3.37Å; A469-V473 PolarHBondContact O-N 3.49Å; V470-V473 PolarHBondContact O-N 3.3Å; V473-L507 VanDerWaalsContact O-CD1 3.23Å; V473-L507 WeakPolarHBondContact O-CD1 3.47Å
474	R	89.1	Confident	95.4	Very high	31 Å²	31	33.6 Å²	33.6	12%	0.117	18%	0.184	C	C	.	.	H	α-helix	trans	-81.2	-25.6	176.4	-72.2	175.7	72.2	-155.8	5.1	114	L326 L331 H333 V470 E471 L472	L326-R474 HydrophobicContact CD1-CG 4.04Å; L331-R474 PolarHBondContact O-NE 3.14Å; H333-R474 PolarHBondContact O-NH2 3.16Å; V470-R474 HydrophobicContact CG1-CG 4.32Å; V470-R474 WeakPolarHBondContact O-CB 3.46Å; V470-R474 VanDerWaalsContact O-CG 3.24Å; V470-R474 WeakPolarHBondContact O-CG 3.39Å; V470-R474 PolarHBondContact O-N 3.08Å; E471-R474 IonicContact OE1-NH1 3.72Å; L472-R474 VanDerWaalsContact C-N 3.27Å; L472-R474 PolarHBondContact O-N 3.27Å
475	T	88.8	Confident	95.3	Very high	23 Å²	23	37.7 Å²	37.7	14%	0.141	20%	0.202	C	C	.	.	H	α-helix	trans	-113.5	-34.4	-166.1	-49.1	0	0	0	0	113.6	V169 R170 E471 L472 P506 L507	V169-T475 HydrophobicContact CG1-CG2 4.05Å; R170-T475 HydrophobicContact CG-CG2 3.95Å; E471-T475 WeakPolarHBondContact O-CB 3.31Å; E471-T475 PolarHBondContact O-N 3.36Å; E471-T475 VanDerWaalsContact O-N 3.1Å; E471-T475 PolarHBondContact O-OG1 3.41Å; L472-T475 PolarHBondContact O-N 3.38Å; T475-P506 WeakPolarHBondContact O-CA 3.38Å; T475-L507 PolarHBondContact O-N 3.21Å
476	A	92.5	Very high	95	Very high	5 Å²	5	38.6 Å²	38.6	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.9	-163.6	0	0	0	0	0	113.4	V169 L472 W478 F504 H505	V169-A476 HydrophobicContact CG1-CB 4.22Å; L472-A476 PolarHBondContact O-N 2.91Å; A476-W478 HydrophobicContact CB-CE3 4.28Å; A476-W478 WeakPolarHBondContact O-CZ3 3.45Å; A476-F504 HydrophobicContact CB-CD1 4.15Å; A476-H505 CarbonylContact C-O 3.58Å; A476-H505 VanDerWaalsContact CA-O 3.3Å; A476-H505 WeakPolarHBondContact CA-O 3.47Å
477	R	94.8	Very high	94.6	Very high	170 Å²	170	43.1 Å²	43.1	64%	0.642	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101	150.4	149.5	-60	-164.8	179.2	-127.6	2	108.1	H505 L507	R477-H505 PolarHBondContact N-O 3.28Å; R477-H505 PolarHBondContact O-N 3.26Å; R477-L507 HydrophobicContact CG-CD2 3.44Å; R477-L507 VanDerWaalsContact CG-CD2 3.44Å; R477-L507 HydrophobicContact CG-CG 4.26Å
478	W	97.2	Very high	94.3	Very high	22 Å²	22	45 Å²	45	8%	0.083	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153	177.4	59.3	90.8	0	0	0	111.2	I309 L312 L313 I319 L472 A476 L502 F503 F504	I309-W478 PolarHBondContact O-NE1 3.35Å; L312-W478 HydrophobicContact CB-CH2 4.46Å; L312-W478 HydrophobicContact CB-CZ2 3.8Å; L313-W478 VanDerWaalsContact CD1-O 3.32Å; L313-W478 WeakPolarHBondContact CD1-O 3.42Å; I319-W478 HydrophobicContact CD1-CH2 3.92Å; I319-W478 HydrophobicContact CD1-CZ2 3.9Å; L472-W478 HydrophobicContact CB-CH2 3.94Å; L472-W478 HydrophobicContact CB-CZ3 3.83Å; L472-W478 HydrophobicContact CD2-CE3 4.31Å; L472-W478 HydrophobicContact CD2-CZ3 4.16Å; A476-W478 HydrophobicContact CB-CE3 4.28Å; A476-W478 WeakPolarHBondContact O-CZ3 3.45Å; W478-L502 HydrophobicContact CG-CD1 4.36Å; W478-F503 CarbonylContact C-O 3.53Å; W478-F503 WeakPolarHBondContact CA-O 3.08Å; W478-F503 VanDerWaalsContact CB-O 3.29Å; W478-F503 WeakPolarHBondContact CB-O 3.27Å; W478-F504 HydrophobicContact CB-CD1 3.67Å; W478-F504 HydrophobicContact CB-CE1 3.77Å; W478-F504 HydrophobicContact CB-CG 4.17Å; W478-F504 HydrophobicContact CB-CZ 4.37Å; W478-F504 HydrophobicContact CD2-CE1 4.32Å; W478-F504 HydrophobicContact CE3-CE1 4.48Å; W478-F504 HydrophobicContact CG-CD1 4.37Å; W478-F504 HydrophobicContact CG-CE1 4.05Å
479	E	97	Very high	93.8	Very high	97 Å²	97	49 Å²	49	45%	0.453	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158.1	-178.2	65.7	-175	165.4	0	0	110.9	L502 F503 H505	E479-L502 CarbonylContact O-C 3.55Å; E479-L502 VanDerWaalsContact O-CA 3.24Å; E479-L502 WeakPolarHBondContact O-CA 3.19Å; E479-L502 WeakPolarHBondContact O-CB 3.37Å; E479-L502 WeakPolarHBondContact O-CD2 3.31Å; E479-F503 HydrophobicContact CG-CB 3.89Å; E479-F503 HydrophobicContact CG-CD2 4.33Å; E479-F503 PolarHBondContact N-O 2.65Å; E479-F503 PolarHBondContact O-N 2.97Å; E479-H505 IonicContact OE1-CD2 2.83Å; E479-H505 IonicContact OE1-CE1 2.84Å; E479-H505 IonicContact OE1-NE2 2.86Å; E479-H505 PolarHBondContact OE1-NE2 3.31Å
480	L	97.4	Very high	93	Very high	42 Å²	42	50.1 Å²	50.1	22%	0.22	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.2	-177.1	-166.7	65.1	0	0	0	110.4	L313 T482 A484 F485 L500 L502	L313-L480 HydrophobicContact CD2-CB 4.4Å; L480-T482 VanDerWaalsContact C-N 3.27Å; L480-T482 WeakPolarHBondContact CD1-OG1 3.46Å; L480-T482 WeakPolarHBondContact CD2-O 3.47Å; L480-T482 VanDerWaalsContact CG-O 3.26Å; L480-T482 WeakPolarHBondContact CG-O 3.4Å; L480-T482 WeakPolarHBondContact CG-OG1 3.32Å; L480-A484 VanDerWaalsContact CD2-C 3.47Å; L480-F485 HydrophobicContact CD1-CD1 4.26Å; L480-F485 HydrophobicContact CD1-CE1 4.46Å; L480-F485 HydrophobicContact CD2-CD1 4.12Å; L480-F485 HydrophobicContact CD2-CE1 4.3Å; L480-F485 HydrophobicContact CD2-CG 4.31Å; L480-L500 HydrophobicContact CD1-CD1 4.1Å; L480-L502 HydrophobicContact CB-CD2 4.48Å; L480-L502 HydrophobicContact CD1-CD2 3.77Å
481	A	96.8	Very high	92	Very high	33 Å²	33	52.5 Å²	52.5	27%	0.273	29%	0.285	S	S	.	.	S	Bend	trans	-84.6	-4.4	176	0	0	0	0	0	113.1	P178 R501 F503	P178-A481 HydrophobicContact CB-CB 3.52Å; P178-A481 HydrophobicContact CG-CB 4.39Å; A481-R501 HydrophobicContact CB-CB 4.01Å; A481-R501 VanDerWaalsContact CB-O 3.27Å; A481-R501 WeakPolarHBondContact CB-O 3.45Å; A481-R501 PolarHBondContact N-O 3.05Å; A481-F503 HydrophobicContact CB-CD2 3.73Å; A481-F503 HydrophobicContact CB-CE2 3.48Å; A481-F503 VanDerWaalsContact CB-CE2 3.48Å; A481-F503 HydrophobicContact CB-CZ 4.15Å
482	T	94.8	Very high	91.1	Very high	37 Å²	37	56.1 Å²	56.1	23%	0.227	31%	0.309	C	S	.	.	S	Bend	trans	-114.5	159.6	178.8	57.3	0	0	0	0	110.7	L480 A484 R501	L480-T482 VanDerWaalsContact C-N 3.27Å; L480-T482 WeakPolarHBondContact CD1-OG1 3.46Å; L480-T482 WeakPolarHBondContact CD2-O 3.47Å; L480-T482 VanDerWaalsContact CG-O 3.26Å; L480-T482 WeakPolarHBondContact CG-O 3.4Å; L480-T482 WeakPolarHBondContact CG-OG1 3.32Å; T482-A484 PolarHBondContact O-N 3.25Å; T482-A484 PolarHBondContact OG1-O 3.17Å; T482-R501 HydrophobicContact CG2-CB 4.39Å
483	P	93.3	Very high	90.7	Very high	147 Å²	147	57.5 Å²	57.5	96%	0.955	32%	0.316	S	S	*	.	S	Bend	trans	-66.6	-22	178.9	-22.8	34.4	0	0	0	114.6
484	A	94.9	Very high	90.6	Very high	65 Å²	65	57.2 Å²	57.2	54%	0.537	31%	0.314	S	S	.	.	S	Bend	trans	-148.5	152.3	-175.2	0	0	0	0	0	111.4	L480 T482	L480-A484 VanDerWaalsContact CD2-C 3.47Å; T482-A484 PolarHBondContact O-N 3.25Å; T482-A484 PolarHBondContact OG1-O 3.17Å
485	F	94.1	Very high	90.8	Very high	93 Å²	93	57.4 Å²	57.4	41%	0.408	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-62.2	144.6	176.5	-68.8	-74.5	0	0	0	111.4	L310 L313 Q314 L480	L310-F485 HydrophobicContact CD1-CD1 3.48Å; L310-F485 VanDerWaalsContact CD1-CD1 3.48Å; L310-F485 HydrophobicContact CD1-CE1 3.96Å; L310-F485 HydrophobicContact CD1-CG 4.4Å; L313-F485 HydrophobicContact CD2-CE1 3.82Å; L313-F485 HydrophobicContact CD2-CZ 4.48Å; L313-F485 HydrophobicContact CG-CE1 4.03Å; L313-F485 HydrophobicContact CG-CZ 4.31Å; Q314-F485 HydrophobicContact CG-CD1 4.15Å; Q314-F485 HydrophobicContact CG-CD2 4.32Å; Q314-F485 HydrophobicContact CG-CE1 3.6Å; Q314-F485 HydrophobicContact CG-CE2 3.81Å; Q314-F485 HydrophobicContact CG-CG 4.47Å; Q314-F485 HydrophobicContact CG-CZ 3.42Å; Q314-F485 VanDerWaalsContact CG-CZ 3.42Å; L480-F485 HydrophobicContact CD1-CD1 4.26Å; L480-F485 HydrophobicContact CD1-CE1 4.46Å; L480-F485 HydrophobicContact CD2-CD1 4.12Å; L480-F485 HydrophobicContact CD2-CE1 4.3Å; L480-F485 HydrophobicContact CD2-CG 4.31Å
486	P	92.6	Very high	91.1	Very high	20 Å²	20	56.4 Å²	56.4	13%	0.13	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-73.5	152.6	-175.4	29.2	-35.4	0	0	0	113.3	P496 D498 L500	P486-P496 HydrophobicContact CB-CB 3.87Å; P486-P496 HydrophobicContact CG-CB 3.46Å; P486-P496 VanDerWaalsContact CG-CB 3.46Å; P486-D498 WeakPolarHBondContact CB-OD1 3.49Å; P486-D498 WeakPolarHBondContact CG-OD1 3.27Å; P486-L500 HydrophobicContact CG-CB 4.48Å; P486-L500 HydrophobicContact CG-CD1 4.11Å
487	V	91.1	Very high	91.1	Very high	114 Å²	114	60.7 Å²	60.7	69%	0.691	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-66.9	135.5	166.7	179.6	0	0	0	0	108.8	V497	V487-V497 WeakPolarHBondContact O-CG2 3.28Å; V487-V497 PolarHBondContact O-N 2.8Å
488	M	90.9	Very high	91	Very high	39 Å²	39	55.2 Å²	55.2	19%	0.192	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.8	176.9	-58.4	-58.9	-73.3	0	0	110.3	L310 L494 P496	L310-M488 HydrophobicContact CD2-CE 4.22Å; L310-M488 HydrophobicContact CD2-SD 3.81Å; M488-L494 HydrophobicContact CE-CD1 4.44Å; M488-L494 HydrophobicContact CE-CD2 3.48Å; M488-L494 VanDerWaalsContact CE-CD2 3.48Å; M488-L494 HydrophobicContact CE-CG 3.92Å; M488-P496 HydrophobicContact SD-CB 3.9Å
489	Q	87.6	Confident	90.8	Very high	85 Å²	85	54.7 Å²	54.7	40%	0.397	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.5	164.7	178.4	165.6	-11	0	0	108.7	V491 L494 H495 V497	Q489-V491 WeakPolarHBondContact CG-O 3.42Å; Q489-V491 PolarHBondContact NE2-O 2.84Å; Q489-L494 CarbonylContact O-C 3.58Å; Q489-L494 WeakPolarHBondContact O-CA 3.37Å; Q489-H495 PolarHBondContact N-O 3.17Å; Q489-H495 PolarHBondContact O-N 3.33Å; Q489-H495 PolarHBondContact OE1-NE2 3.05Å; Q489-V497 HydrophobicContact CB-CG2 4.07Å
490	T	81.6	Confident	90.8	Very high	23 Å²	23	50.1 Å²	50.1	14%	0.141	30%	0.299	C	S	.	.			trans	-106.9	-3.1	-171.1	60.1	0	0	0	0	114.7	S380	S380-T490 PolarHBondContact OG-O 2.89Å
491	V	74.5	Confident	90.8	Very high	50 Å²	50	54.3 Å²	54.3	30%	0.303	31%	0.312	S	S	.	.	S	Bend	trans	-142.2	137.1	-177.1	-176	0	0	0	0	109.3	W65 Q489	W65-V491 HydrophobicContact CZ2-CG1 4.24Å; Q489-V491 WeakPolarHBondContact CG-O 3.42Å; Q489-V491 PolarHBondContact NE2-O 2.84Å
492	P	74.9	Confident	90.9	Very high	76 Å²	76	52.8 Å²	52.8	49%	0.494	30%	0.299	S	S	.	.	S	Bend	cis	-75.2	-29.2	-2	30	-34.2	0	0	0	113.5	F222	F222-P492 HydrophobicContact CE2-CB 4.36Å
493	I	87.1	Confident	91.1	Very high	30 Å²	30	54.6 Å²	54.6	15%	0.154	30%	0.304	C	S	.	.	S	Bend	trans	-122.1	142.4	176	-60.9	-64.7	0	0	0	108.5	F299 P378 V379 H495	F299-I493 HydrophobicContact CB-CG1 4.08Å; F299-I493 HydrophobicContact CB-CG2 4.25Å; P378-I493 WeakPolarHBondContact O-CA 3.43Å; V379-I493 HydrophobicContact CG2-CD1 4Å; I493-H495 PolarHBondContact O-N 2.94Å; I493-H495 PolarHBondContact O-ND1 3.22Å
494	L	92	Very high	91.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.261	C	S	.	.			trans	-66.4	125.8	178	175.3	141.4	0	0	0	111.8	S303 S307 L376 P378 M488 Q489	S303-L494 WeakPolarHBondContact CB-O 3.27Å; S303-L494 PolarHBondContact OG-O 3.25Å; S307-L494 WeakPolarHBondContact OG-CD2 3.07Å; L376-L494 HydrophobicContact CB-CD1 3.86Å; L376-L494 HydrophobicContact CB-CD2 3.9Å; L376-L494 HydrophobicContact CD2-CD1 3.79Å; L376-L494 HydrophobicContact CG-CD1 4.38Å; P378-L494 PolarHBondContact O-N 3.02Å; M488-L494 HydrophobicContact CE-CD1 4.44Å; M488-L494 HydrophobicContact CE-CD2 3.48Å; M488-L494 VanDerWaalsContact CE-CD2 3.48Å; M488-L494 HydrophobicContact CE-CG 3.92Å; Q489-L494 CarbonylContact O-C 3.58Å; Q489-L494 WeakPolarHBondContact O-CA 3.37Å
495	H	93.1	Very high	91.2	Very high	34 Å²	34	49 Å²	49	16%	0.157	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	155.7	174.5	62.1	-77.8	0	0	0	112.2	Y182 Q489 I493	Y182-H495 HydrophobicContact CD1-CB 4.07Å; Y182-H495 HydrophobicContact CD2-CB 4Å; Y182-H495 HydrophobicContact CE1-CB 3.65Å; Y182-H495 AromaticContact CE1-CD2 3.82Å; Y182-H495 AromaticContact CE1-CG 3.81Å; Y182-H495 HydrophobicContact CE2-CB 3.57Å; Y182-H495 HydrophobicContact CG-CB 4.23Å; Y182-H495 AromaticContact CZ-CG 3.82Å; Q489-H495 PolarHBondContact N-O 3.17Å; Q489-H495 PolarHBondContact O-N 3.33Å; Q489-H495 PolarHBondContact OE1-NE2 3.05Å; I493-H495 PolarHBondContact O-N 2.94Å; I493-H495 PolarHBondContact O-ND1 3.22Å
496	P	94.4	Very high	91.1	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	134.8	171.7	29.7	-34.4	0	0	0	110.9	T306 P486 M488 D498 G499 L500	T306-P496 HydrophobicContact CG2-CG 3.76Å; P486-P496 HydrophobicContact CB-CB 3.87Å; P486-P496 HydrophobicContact CG-CB 3.46Å; P486-P496 VanDerWaalsContact CG-CB 3.46Å; M488-P496 HydrophobicContact SD-CB 3.9Å; P496-D498 VanDerWaalsContact C-N 3.29Å; P496-D498 PolarHBondContact O-N 3.35Å; P496-G499 PolarHBondContact O-N 2.72Å; P496-G499 VanDerWaalsContact O-N 3.15Å; P496-L500 HydrophobicContact CB-CB 4.12Å; P496-L500 HydrophobicContact CG-CB 3.69Å
497	V	92.1	Very high	90.7	Very high	95 Å²	95	50.1 Å²	50.1	58%	0.576	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.7	-175.6	173.5	0	0	0	0	112.9	V487 Q489	V487-V497 WeakPolarHBondContact O-CG2 3.28Å; V487-V497 PolarHBondContact O-N 2.8Å; Q489-V497 HydrophobicContact CB-CG2 4.07Å
498	D	92.9	Very high	89.5	Confident	56 Å²	56	53.7 Å²	53.7	30%	0.299	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	2	180	72.9	-12	0	0	0	113.9	P486 P496 L500	P486-D498 WeakPolarHBondContact CB-OD1 3.49Å; P486-D498 WeakPolarHBondContact CG-OD1 3.27Å; P496-D498 VanDerWaalsContact C-N 3.29Å; P496-D498 PolarHBondContact O-N 3.35Å; D498-L500 WeakPolarHBondContact OD1-CA 3.34Å; D498-L500 PolarHBondContact OD1-N 2.59Å
499	G	93.9	Very high	87.8	Confident	11 Å²	11	55.5 Å²	55.5	11%	0.113	29%	0.29	C	S	.	.			trans	79.7	7	-176.5	0	0	0	0	0	115.9	A180 V181 Y182 P496	A180-G499 CarbonylContact C-O 3.35Å; V181-G499 PolarHBondContact N-O 2.79Å; V181-G499 VanDerWaalsContact N-O 3.12Å; Y182-G499 WeakPolarHBondContact CB-O 3.48Å; Y182-G499 PolarHBondContact N-O 2.96Å; P496-G499 PolarHBondContact O-N 2.72Å; P496-G499 VanDerWaalsContact O-N 3.15Å
500	L	97.5	Very high	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.			trans	53.1	92.2	-175.3	-179.6	66.6	0	0	0	112.1	V181 T306 I309 L310 L480 P486 P496 D498 L502	V181-L500 HydrophobicContact CB-CB 4.26Å; V181-L500 HydrophobicContact CB-CD2 4.2Å; V181-L500 HydrophobicContact CB-CG 4.29Å; V181-L500 WeakPolarHBondContact CB-O 3.04Å; V181-L500 HydrophobicContact CG1-CD2 4.27Å; V181-L500 HydrophobicContact CG2-CD2 4.36Å; V181-L500 HydrophobicContact CG2-CG 4.28Å; V181-L500 VanDerWaalsContact CG2-O 3.26Å; V181-L500 WeakPolarHBondContact CG2-O 3.3Å; V181-L500 PolarHBondContact N-O 3.36Å; T306-L500 HydrophobicContact CG2-CB 4.22Å; T306-L500 HydrophobicContact CG2-CD2 3.85Å; I309-L500 HydrophobicContact CG2-CD2 4.41Å; L310-L500 HydrophobicContact CB-CD2 3.95Å; L310-L500 HydrophobicContact CD1-CD1 4Å; L480-L500 HydrophobicContact CD1-CD1 4.1Å; P486-L500 HydrophobicContact CG-CB 4.48Å; P486-L500 HydrophobicContact CG-CD1 4.11Å; P496-L500 HydrophobicContact CB-CB 4.12Å; P496-L500 HydrophobicContact CG-CB 3.69Å; D498-L500 WeakPolarHBondContact OD1-CA 3.34Å; D498-L500 PolarHBondContact OD1-N 2.59Å; L500-L502 HydrophobicContact CD1-CD2 3.93Å; L500-L502 HydrophobicContact CD1-CG 4.35Å; L500-L502 HydrophobicContact CD2-CD1 4.23Å; L500-L502 HydrophobicContact CG-CD1 4.21Å; L500-L502 HydrophobicContact CG-CD2 4.19Å; L500-L502 HydrophobicContact CG-CG 4.04Å
501	R	97.8	Very high	83.3	Confident	131 Å²	131	61.9 Å²	61.9	49%	0.494	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.3	-178.2	-63.1	-174.3	177.6	-150.3	-1.3	111.2	P178 V179 A481 T482	P178-R501 HydrophobicContact CB-CB 4.44Å; V179-R501 WeakPolarHBondContact O-CA 3.43Å; A481-R501 HydrophobicContact CB-CB 4.01Å; A481-R501 VanDerWaalsContact CB-O 3.27Å; A481-R501 WeakPolarHBondContact CB-O 3.45Å; A481-R501 PolarHBondContact N-O 3.05Å; T482-R501 HydrophobicContact CG2-CB 4.39Å
502	L	98.3	Very high	81.5	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.9	-177.4	-56.5	-178.3	0	0	0	112.1	P178 V179 V181 I309 L313 W478 E479 L480 L500 F504	P178-L502 CarbonylContact C-O 3.57Å; P178-L502 WeakPolarHBondContact CA-O 3.4Å; V179-L502 PolarHBondContact N-O 3.22Å; V179-L502 PolarHBondContact O-N 2.8Å; V181-L502 HydrophobicContact CG2-CB 4.17Å; V181-L502 HydrophobicContact CG2-CD1 3.62Å; V181-L502 HydrophobicContact CG2-CG 3.78Å; I309-L502 HydrophobicContact CG2-CD1 3.41Å; I309-L502 VanDerWaalsContact CG2-CD1 3.41Å; L313-L502 HydrophobicContact CD2-CD1 4.42Å; L313-L502 HydrophobicContact CD2-CD2 3.51Å; W478-L502 HydrophobicContact CG-CD1 4.36Å; E479-L502 CarbonylContact O-C 3.55Å; E479-L502 VanDerWaalsContact O-CA 3.24Å; E479-L502 WeakPolarHBondContact O-CA 3.19Å; E479-L502 WeakPolarHBondContact O-CB 3.37Å; E479-L502 WeakPolarHBondContact O-CD2 3.31Å; L480-L502 HydrophobicContact CB-CD2 4.48Å; L480-L502 HydrophobicContact CD1-CD2 3.77Å; L500-L502 HydrophobicContact CD1-CD2 3.93Å; L500-L502 HydrophobicContact CD1-CG 4.35Å; L500-L502 HydrophobicContact CD2-CD1 4.23Å; L500-L502 HydrophobicContact CG-CD1 4.21Å; L500-L502 HydrophobicContact CG-CD2 4.19Å; L500-L502 HydrophobicContact CG-CG 4.04Å; L502-F504 HydrophobicContact CB-CD2 4.25Å; L502-F504 HydrophobicContact CB-CE2 3.72Å; L502-F504 HydrophobicContact CB-CZ 4.24Å; L502-F504 HydrophobicContact CD1-CE2 4.3Å; L502-F504 HydrophobicContact CD1-CZ 4Å
503	F	98	Very high	79.7	Confident	75 Å²	75	64.4 Å²	64.4	33%	0.329	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	138.8	160.8	-65.1	-75.3	0	0	0	109.2	P178 W478 E479 A481	P178-F503 HydrophobicContact CB-CD1 4.29Å; P178-F503 HydrophobicContact CB-CE1 3.97Å; P178-F503 HydrophobicContact CB-CZ 4.08Å; P178-F503 HydrophobicContact CG-CE1 4.22Å; P178-F503 HydrophobicContact CG-CZ 4.24Å; W478-F503 CarbonylContact C-O 3.53Å; W478-F503 WeakPolarHBondContact CA-O 3.08Å; W478-F503 VanDerWaalsContact CB-O 3.29Å; W478-F503 WeakPolarHBondContact CB-O 3.27Å; E479-F503 HydrophobicContact CG-CB 3.89Å; E479-F503 HydrophobicContact CG-CD2 4.33Å; E479-F503 PolarHBondContact N-O 2.65Å; E479-F503 PolarHBondContact O-N 2.97Å; A481-F503 HydrophobicContact CB-CD2 3.73Å; A481-F503 HydrophobicContact CB-CE2 3.48Å; A481-F503 VanDerWaalsContact CB-CE2 3.48Å; A481-F503 HydrophobicContact CB-CZ 4.15Å
504	F	97.1	Very high	77	Confident	11 Å²	11	71.1 Å²	71.1	5%	0.048	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.1	177.2	-72.6	-94.9	0	0	0	109.4	W172 V179 V181 L472 A476 W478 L502	W172-F504 HydrophobicContact CB-CB 4.14Å; W172-F504 HydrophobicContact CB-CD1 4.33Å; W172-F504 HydrophobicContact CB-CD2 3.79Å; W172-F504 HydrophobicContact CB-CE2 4.24Å; W172-F504 HydrophobicContact CB-CG 3.83Å; W172-F504 HydrophobicContact CD2-CE2 4.38Å; W172-F504 HydrophobicContact CD2-CZ 4.32Å; W172-F504 HydrophobicContact CE3-CD1 4.28Å; W172-F504 AromaticContact CE3-CE1 3.7Å; W172-F504 HydrophobicContact CE3-CE1 3.7Å; W172-F504 HydrophobicContact CE3-CE2 4.08Å; W172-F504 AromaticContact CE3-CZ 3.58Å; W172-F504 HydrophobicContact CE3-CZ 3.58Å; W172-F504 HydrophobicContact CG-CD2 4.49Å; W172-F504 HydrophobicContact CG-CE2 4.49Å; W172-F504 HydrophobicContact CZ3-CE1 4.29Å; W172-F504 HydrophobicContact CZ3-CZ 4.1Å; V179-F504 HydrophobicContact CB-CD2 4.18Å; V179-F504 HydrophobicContact CB-CE2 4.07Å; V179-F504 HydrophobicContact CG1-CE2 4.48Å; V179-F504 HydrophobicContact CG2-CD2 4.15Å; V181-F504 HydrophobicContact CG2-CE2 4.02Å; V181-F504 HydrophobicContact CG2-CZ 4.07Å; L472-F504 HydrophobicContact CD2-CE1 4.03Å; A476-F504 HydrophobicContact CB-CD1 4.15Å; W478-F504 HydrophobicContact CB-CD1 3.67Å; W478-F504 HydrophobicContact CB-CE1 3.77Å; W478-F504 HydrophobicContact CB-CG 4.17Å; W478-F504 HydrophobicContact CB-CZ 4.37Å; W478-F504 HydrophobicContact CD2-CE1 4.32Å; W478-F504 HydrophobicContact CE3-CE1 4.48Å; W478-F504 HydrophobicContact CG-CD1 4.37Å; W478-F504 HydrophobicContact CG-CE1 4.05Å; L502-F504 HydrophobicContact CB-CD2 4.25Å; L502-F504 HydrophobicContact CB-CE2 3.72Å; L502-F504 HydrophobicContact CB-CZ 4.24Å; L502-F504 HydrophobicContact CD1-CE2 4.3Å; L502-F504 HydrophobicContact CD1-CZ 4Å
505	H	93.9	Very high	74.1	Confident	84 Å²	84	74.3 Å²	74.3	39%	0.389	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.3	-178	-57.7	-66	0	0	0	109	A476 R477 E479	A476-H505 CarbonylContact C-O 3.58Å; A476-H505 VanDerWaalsContact CA-O 3.3Å; A476-H505 WeakPolarHBondContact CA-O 3.47Å; R477-H505 PolarHBondContact N-O 3.28Å; R477-H505 PolarHBondContact O-N 3.26Å; E479-H505 IonicContact OE1-CD2 2.83Å; E479-H505 IonicContact OE1-CE1 2.84Å; E479-H505 IonicContact OE1-NE2 2.86Å; E479-H505 PolarHBondContact OE1-NE2 3.31Å
506	P	90.8	Very high	71.4	Confident	87 Å²	87	80.2 Å²	80.2	57%	0.565	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	141.8	177	27.4	-33.5	0	0	0	110.6	C173 T475 E508	C173-P506 HydrophobicContact CB-CB 4.41Å; T475-P506 WeakPolarHBondContact O-CA 3.38Å; P506-E508 PolarHBondContact O-N 3.02Å
507	L	85.4	Confident	68.2	Low	50 Å²	50	89.1 Å²	89.1	26%	0.262	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-70.5	125.2	170	-75.4	167.8	0	0	0	109.4	V473 T475 R477 T509	V473-L507 VanDerWaalsContact O-CD1 3.23Å; V473-L507 WeakPolarHBondContact O-CD1 3.47Å; T475-L507 PolarHBondContact O-N 3.21Å; R477-L507 HydrophobicContact CG-CD2 3.44Å; R477-L507 VanDerWaalsContact CG-CD2 3.44Å; R477-L507 HydrophobicContact CG-CG 4.26Å; L507-T509 PolarHBondContact O-N 3.44Å
508	E	66.3	Low	65.4	Low	188 Å²	188	96 Å²	96	88%	0.879	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.6	172.5	-68.2	-179.7	173	0	0	109.3	P506 L510	P506-E508 PolarHBondContact O-N 3.02Å; E508-L510 PolarHBondContact O-N 3.46Å; E508-L510 VanDerWaalsContact O-N 3.16Å
509	T	54.7	Low	64.1	Low	77 Å²	77	98 Å²	98	47%	0.472	57%	0.565	S	S	.	*			trans	-65	114.3	166.8	43.2	0	0	0	0	107	L507 G511	L507-T509 PolarHBondContact O-N 3.44Å; T509-G511 VanDerWaalsContact C-N 3.32Å; T509-G511 PolarHBondContact O-N 3.02Å
510	L	40.8	Very low	62.5	Low	180 Å²	180	102.6 Å²	102.6	94%	0.942	59%	0.589	S	S	*	*			trans	-49.7	102.1	164.3	-87.5	152.8	0	0	0	107.5	E508 A512	E508-L510 PolarHBondContact O-N 3.46Å; E508-L510 VanDerWaalsContact O-N 3.16Å; L510-A512 PolarHBondContact O-N 2.96Å
511	G	34.1	Very low	60.6	Low	62 Å²	62	108.3 Å²	108.3	64%	0.639	62%	0.622	S	S	*	*			trans	-62.2	131.7	177.4	0	0	0	0	0	108.6	T509 G513	T509-G511 VanDerWaalsContact C-N 3.32Å; T509-G511 PolarHBondContact O-N 3.02Å; G511-G513 PolarHBondContact O-N 3.22Å
512	A	36.9	Very low	58.4	Low	117 Å²	117	106.9 Å²	106.9	97%	0.967	63%	0.629	S	S	*	*	S	Bend	trans	-60.4	103.4	157.1	0	0	0	0	0	107.4	L510	L510-A512 PolarHBondContact O-N 2.96Å
513	G	36.7	Very low	55.9	Low	63 Å²	63	113.6 Å²	113.6	65%	0.649	67%	0.669	S	S	*	*			trans	148.2	68.2	178.4	0	0	0	0	0	113.5	G511	G511-G513 PolarHBondContact O-N 3.22Å
514	D	30.3	Very low	53.1	Low	170 Å²	170	116.2 Å²	116.2	91%	0.909	69%	0.691	S	S	*	*			trans	-150.2	78.6	137.1	-100	-16.4	0	0	0	107.3
515	G	31.9	Very low	49.9	Very low	67 Å²	67	123.7 Å²	123.7	69%	0.691	74%	0.737	S	S	*	*			trans	-73.3	122.5	153.3	0	0	0	0	0	107.6
516	L	35	Very low	46.5	Very low	158 Å²	158	126.8 Å²	126.8	83%	0.827	76%	0.764	S	S	*	*			trans	44.7	106.5	152.9	-76.9	148	0	0	0	117
517	H	28.5	Very low	42.9	Very low	190 Å²	190	130.1 Å²	130.1	88%	0.88	78%	0.781	S	S	*	*				-147.1	105.8	128.4	-91.3	-61.9	0	0	0	110.5
518	L	33.7	Very low	39	Very low	239 Å²	239	137.4 Å²	137.4	100%	1.251	83%	0.828	S	S	*	*			trans	44.3	0	158.7	-74.4	159.7	0	0	0	120

Retrieved 518 of 518 residues in 135.5 ms (Link to these results)

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