A0A077D9S7_DROME Loading...

IR52c

AlphaFold DB , UniProt , Accession A0A077D9S7, Species DROME (Drosophila melanogaster, Fruit fly), Gene IR52c, Length 599 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	52.7	Low	54.7	Low	210 Å²	210	126.4 Å²	126.4	100%	1.034	63%	0.633	S	S	*	*				0	-38.8	0	-71.8	-73.9	-106.5	0	0	113.1
2	V	54.7	Low	54.5	Low	112 Å²	112	118.6 Å²	118.6	68%	0.679	61%	0.608	S	S	*	*	H	α-helix	trans	-75.9	-32.4	-178.2	-178.2	0	0	0	0	114	L4 I5 I6	V2-L4 PolarHBondContact O-N 3.47Å; V2-I5 PolarHBondContact O-N 3.43Å; V2-I6 HydrophobicContact CG1-CD1 4.43Å
3	W	50.3	Low	54.1	Low	207 Å²	207	117.1 Å²	117.1	78%	0.784	60%	0.602	S	S	*	*	H	α-helix	trans	-71.6	-27.7	-176.9	-139.2	53	0	0	0	114	I7	W3-I7 HydrophobicContact CE3-CD1 4.17Å; W3-I7 HydrophobicContact CZ3-CD1 4.44Å; W3-I7 WeakPolarHBondContact O-CG1 3.48Å; W3-I7 PolarHBondContact O-N 3.2Å
4	L	53	Low	53.5	Low	121 Å²	121	112.2 Å²	112.2	63%	0.634	58%	0.584	S	S	*	*	H	α-helix	trans	-74.5	-29.8	-179.9	-124.4	148.7	0	0	0	112.1	V2 L8	V2-L4 PolarHBondContact O-N 3.47Å; L4-L8 HydrophobicContact CD2-CD1 4.13Å; L4-L8 PolarHBondContact O-N 3.43Å
5	I	58	Low	52.8	Low	104 Å²	104	108.7 Å²	108.7	53%	0.533	57%	0.573	S	S	.	*	H	α-helix	trans	-73.6	-35.7	178.5	-63.3	170.1	0	0	0	111	V2 L8 F9	V2-I5 PolarHBondContact O-N 3.43Å; I5-L8 PolarHBondContact O-N 3.5Å; I5-F9 HydrophobicContact CG2-CD2 4.3Å; I5-F9 PolarHBondContact O-N 3.4Å
6	I	60	Low	52.2	Low	95 Å²	95	104.9 Å²	104.9	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-70.2	-39.8	179.1	-61.5	170.5	0	0	0	110.8	V2 F9 C10	V2-I6 HydrophobicContact CG1-CD1 4.43Å; I6-F9 PolarHBondContact O-N 2.95Å; I6-C10 PolarHBondContact O-N 3.34Å; I6-C10 PolarHBondContact O-SG 3.19Å; I6-C10 VanDerWaalsContact O-SG 3.4Å
7	I	58.8	Low	51.7	Low	80 Å²	80	106 Å²	106	41%	0.41	56%	0.559	S	S	.	*	H	α-helix	trans	-67.5	-39.5	177.2	-64.7	169.4	0	0	0	111	W3 C10 L11	W3-I7 HydrophobicContact CE3-CD1 4.17Å; W3-I7 HydrophobicContact CZ3-CD1 4.44Å; W3-I7 WeakPolarHBondContact O-CG1 3.48Å; W3-I7 PolarHBondContact O-N 3.2Å; I7-C10 PolarHBondContact O-N 2.98Å; I7-L11 HydrophobicContact CG2-CD1 3.89Å; I7-L11 WeakPolarHBondContact O-CB 3.43Å; I7-L11 WeakPolarHBondContact O-CG 3.39Å; I7-L11 PolarHBondContact O-N 2.89Å
8	L	55.8	Low	51.3	Low	112 Å²	112	106.4 Å²	106.4	59%	0.586	56%	0.56	S	S	*	*	H	α-helix	trans	-66.2	-35.9	174	-86.7	157.4	0	0	0	112.8	L4 I5 G12	L4-L8 HydrophobicContact CD2-CD1 4.13Å; L4-L8 PolarHBondContact O-N 3.43Å; I5-L8 PolarHBondContact O-N 3.5Å; L8-G12 PolarHBondContact O-N 2.96Å
9	F	53.6	Low	50.8	Low	161 Å²	161	106.3 Å²	106.3	71%	0.706	56%	0.559	S	S	*	*	H	α-helix	trans	-70.3	-37.9	174	-108.7	-87.2	0	0	0	112.6	I5 I6 G12 N13	I5-F9 HydrophobicContact CG2-CD2 4.3Å; I5-F9 PolarHBondContact O-N 3.4Å; I6-F9 PolarHBondContact O-N 2.95Å; F9-G12 PolarHBondContact O-N 3.37Å; F9-N13 WeakPolarHBondContact O-CB 3.49Å; F9-N13 PolarHBondContact O-N 3.42Å
10	C	53.5	Low	50.4	Low	81 Å²	81	106.2 Å²	106.2	55%	0.547	56%	0.559	S	S	.	*	H	α-helix	trans	-69.2	-36.1	175	-71.5	0	0	0	0	112.6	I6 I7 S14	I6-C10 PolarHBondContact O-N 3.34Å; I6-C10 PolarHBondContact O-SG 3.19Å; I6-C10 VanDerWaalsContact O-SG 3.4Å; I7-C10 PolarHBondContact O-N 2.98Å; C10-S14 PolarHBondContact O-N 2.66Å; C10-S14 VanDerWaalsContact O-N 3.08Å; C10-S14 PolarHBondContact O-OG 3.35Å
11	L	51.5	Low	50.4	Low	107 Å²	107	106 Å²	106	56%	0.56	56%	0.562	S	S	*	*	H	α-helix	trans	-69.7	-39.3	172.6	-80.8	159.6	0	0	0	112.1	I7 S14 S15	I7-L11 HydrophobicContact CG2-CD1 3.89Å; I7-L11 WeakPolarHBondContact O-CB 3.43Å; I7-L11 WeakPolarHBondContact O-CG 3.39Å; I7-L11 PolarHBondContact O-N 2.89Å; L11-S14 WeakPolarHBondContact CA-OG 3.41Å; L11-S14 PolarHBondContact O-OG 3.47Å; L11-S15 WeakPolarHBondContact O-CB 3.2Å; L11-S15 PolarHBondContact O-N 3.4Å; L11-S15 PolarHBondContact O-OG 3.02Å
12	G	52.1	Low	50.4	Low	33 Å²	33	98.9 Å²	98.9	34%	0.34	53%	0.531	S	S	.	.	H	α-helix	trans	-62.3	-43.7	173.3	0	0	0	0	0	112.4	L8 F9 S15 S16	L8-G12 PolarHBondContact O-N 2.96Å; F9-G12 PolarHBondContact O-N 3.37Å; G12-S15 PolarHBondContact O-N 2.73Å; G12-S15 PolarHBondContact O-OG 3.13Å; G12-S16 PolarHBondContact O-N 2.98Å; G12-S16 PolarHBondContact O-OG 2.94Å
13	N	48.8	Very low	50.5	Low	99 Å²	99	97.9 Å²	97.9	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-75.1	-26.9	-178.2	-141.3	23.6	0	0	0	113.6	F9 S16 Q17	F9-N13 WeakPolarHBondContact O-CB 3.49Å; F9-N13 PolarHBondContact O-N 3.42Å; N13-S16 WeakPolarHBondContact CA-OG 3.36Å; N13-S16 PolarHBondContact O-OG 2.97Å; N13-S16 PolarHBondContact OD1-OG 3.43Å; N13-Q17 WeakPolarHBondContact O-CB 3.42Å; N13-Q17 VanDerWaalsContact O-CG 3.32Å; N13-Q17 WeakPolarHBondContact O-CG 3.34Å; N13-Q17 PolarHBondContact O-N 2.99Å; N13-Q17 VanDerWaalsContact O-N 3.13Å
14	S	46.4	Very low	50.9	Low	49 Å²	49	92.8 Å²	92.8	34%	0.343	51%	0.509	S	S	.	.	H	α-helix	trans	-77.2	-34.4	171.1	39.4	0	0	0	0	111.6	C10 L11 I18	C10-S14 PolarHBondContact O-N 2.66Å; C10-S14 VanDerWaalsContact O-N 3.08Å; C10-S14 PolarHBondContact O-OG 3.35Å; L11-S14 WeakPolarHBondContact CA-OG 3.41Å; L11-S14 PolarHBondContact O-OG 3.47Å; S14-I18 WeakPolarHBondContact O-CB 3.37Å; S14-I18 WeakPolarHBondContact O-CD1 3.44Å; S14-I18 WeakPolarHBondContact O-CG1 3.32Å; S14-I18 PolarHBondContact O-N 2.95Å
15	S	42.8	Very low	51.3	Low	60 Å²	60	88.5 Å²	88.5	42%	0.42	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-37.9	171.4	73.9	0	0	0	0	112.8	L11 G12 L19	L11-S15 WeakPolarHBondContact O-CB 3.2Å; L11-S15 PolarHBondContact O-N 3.4Å; L11-S15 PolarHBondContact O-OG 3.02Å; G12-S15 PolarHBondContact O-N 2.73Å; G12-S15 PolarHBondContact O-OG 3.13Å; S15-L19 WeakPolarHBondContact O-CB 3.42Å; S15-L19 PolarHBondContact O-N 3.08Å
16	S	42.5	Very low	51.6	Low	47 Å²	47	88.6 Å²	88.6	33%	0.329	49%	0.488	S	S	.	.	H	α-helix	trans	-70.6	-39.8	176.5	64.1	0	0	0	0	112.5	G12 N13 L19 D20	G12-S16 PolarHBondContact O-N 2.98Å; G12-S16 PolarHBondContact O-OG 2.94Å; N13-S16 WeakPolarHBondContact CA-OG 3.36Å; N13-S16 PolarHBondContact O-OG 2.97Å; N13-S16 PolarHBondContact OD1-OG 3.43Å; S16-L19 PolarHBondContact O-N 3.44Å; S16-D20 WeakPolarHBondContact O-CB 3.33Å; S16-D20 PolarHBondContact O-N 3.44Å
17	Q	43.9	Very low	52	Low	124 Å²	124	89.1 Å²	89.1	58%	0.579	49%	0.491	S	S	*	.	H	α-helix	trans	-66	-37	174.2	-77.6	179.4	-16.7	0	0	112.6	N13 V21	N13-Q17 WeakPolarHBondContact O-CB 3.42Å; N13-Q17 VanDerWaalsContact O-CG 3.32Å; N13-Q17 WeakPolarHBondContact O-CG 3.34Å; N13-Q17 PolarHBondContact O-N 2.99Å; N13-Q17 VanDerWaalsContact O-N 3.13Å; Q17-V21 VanDerWaalsContact O-CG2 3.27Å; Q17-V21 WeakPolarHBondContact O-CG2 3.44Å; Q17-V21 PolarHBondContact O-N 2.83Å; Q17-V21 VanDerWaalsContact O-N 3.1Å
18	I	44.9	Very low	52.8	Low	113 Å²	113	89.8 Å²	89.8	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-67.4	-41.8	174.3	-70	166.6	0	0	0	110.4	S14 V21 T22	S14-I18 WeakPolarHBondContact O-CB 3.37Å; S14-I18 WeakPolarHBondContact O-CD1 3.44Å; S14-I18 WeakPolarHBondContact O-CG1 3.32Å; S14-I18 PolarHBondContact O-N 2.95Å; I18-V21 PolarHBondContact O-N 3Å; I18-T22 PolarHBondContact O-N 2.94Å; I18-T22 PolarHBondContact O-OG1 2.86Å
19	L	42.6	Very low	53.9	Low	104 Å²	104	86 Å²	86	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-42.6	175.3	-98.3	149.3	0	0	0	112.9	S15 S16 T22 N23	S15-L19 WeakPolarHBondContact O-CB 3.42Å; S15-L19 PolarHBondContact O-N 3.08Å; S16-L19 PolarHBondContact O-N 3.44Å; L19-T22 WeakPolarHBondContact CA-OG1 3.5Å; L19-T22 PolarHBondContact O-N 2.89Å; L19-T22 PolarHBondContact O-OG1 3.06Å; L19-N23 WeakPolarHBondContact O-CB 3.49Å; L19-N23 PolarHBondContact O-N 3.33Å
20	D	42.5	Very low	55.1	Low	105 Å²	105	79.3 Å²	79.3	56%	0.561	45%	0.446	S	S	*	.	H	α-helix	trans	-66.4	-39.4	177.4	-97.6	-15.2	0	0	0	112.5	S16 N23 N24	S16-D20 WeakPolarHBondContact O-CB 3.33Å; S16-D20 PolarHBondContact O-N 3.44Å; D20-N23 PolarHBondContact O-N 3.08Å; D20-N24 PolarHBondContact O-N 3.3Å
21	V	49.9	Very low	56.5	Low	103 Å²	103	82.4 Å²	82.4	62%	0.624	45%	0.447	S	S	*	.	H	α-helix	trans	-67.8	-40.8	176.4	172.2	0	0	0	0	111	Q17 I18 S25	Q17-V21 VanDerWaalsContact O-CG2 3.27Å; Q17-V21 WeakPolarHBondContact O-CG2 3.44Å; Q17-V21 PolarHBondContact O-N 2.83Å; Q17-V21 VanDerWaalsContact O-N 3.1Å; I18-V21 PolarHBondContact O-N 3Å; V21-S25 WeakPolarHBondContact O-CB 3.33Å; V21-S25 PolarHBondContact O-N 3.01Å; V21-S25 VanDerWaalsContact O-N 3.13Å; V21-S25 PolarHBondContact O-OG 3.26Å
22	T	53.3	Low	58.1	Low	60 Å²	60	81.2 Å²	81.2	37%	0.368	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-43.3	174.7	46.5	0	0	0	0	111.9	I18 L19 N24 S25 H26	I18-T22 PolarHBondContact O-N 2.94Å; I18-T22 PolarHBondContact O-OG1 2.86Å; L19-T22 WeakPolarHBondContact CA-OG1 3.5Å; L19-T22 PolarHBondContact O-N 2.89Å; L19-T22 PolarHBondContact O-OG1 3.06Å; T22-N24 PolarHBondContact O-N 3.13Å; T22-S25 PolarHBondContact O-N 3.1Å; T22-S25 PolarHBondContact O-OG 3.23Å; T22-H26 PolarHBondContact O-CD2 3.18Å; T22-H26 PolarHBondContact O-N 3.08Å; T22-H26 VanDerWaalsContact O-N 3.07Å
23	N	55.4	Low	59.7	Low	91 Å²	91	79.6 Å²	79.6	49%	0.487	42%	0.419	S	S	.	.	H	α-helix	trans	-63.9	-43.1	179.2	-94.8	-6.1	0	0	0	113	L19 D20 H26 L27	L19-N23 WeakPolarHBondContact O-CB 3.49Å; L19-N23 PolarHBondContact O-N 3.33Å; D20-N23 PolarHBondContact O-N 3.08Å; N23-H26 PolarHBondContact O-N 3.19Å; N23-L27 WeakPolarHBondContact O-CG 3.24Å; N23-L27 PolarHBondContact O-N 2.76Å; N23-L27 VanDerWaalsContact O-N 3.13Å
24	N	59.5	Low	61.5	Low	99 Å²	99	76.4 Å²	76.4	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-65.3	-39.6	177.1	-77.8	-24.2	0	0	0	112	D20 T22 H26 L27 D28	D20-N24 PolarHBondContact O-N 3.3Å; T22-N24 PolarHBondContact O-N 3.13Å; N24-H26 VanDerWaalsContact C-N 3.34Å; N24-H26 PolarHBondContact O-N 3.33Å; N24-L27 PolarHBondContact O-N 3.5Å; N24-D28 PolarHBondContact O-N 3.05Å
25	S	61.2	Low	63.4	Low	32 Å²	32	75.3 Å²	75.3	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-65.2	-35.3	177.5	68.9	0	0	0	0	113.4	V21 T22 F29	V21-S25 WeakPolarHBondContact O-CB 3.33Å; V21-S25 PolarHBondContact O-N 3.01Å; V21-S25 VanDerWaalsContact O-N 3.13Å; V21-S25 PolarHBondContact O-OG 3.26Å; T22-S25 PolarHBondContact O-N 3.1Å; T22-S25 PolarHBondContact O-OG 3.23Å; S25-F29 WeakPolarHBondContact O-CB 3.3Å; S25-F29 PolarHBondContact O-N 2.91Å; S25-F29 VanDerWaalsContact O-N 3.08Å
26	H	64.1	Low	65.6	Low	106 Å²	106	72.5 Å²	72.5	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-68.1	-43	174.8	-84.6	-69.9	0	0	0	112	T22 N23 N24 F29 D30	T22-H26 PolarHBondContact O-CD2 3.18Å; T22-H26 PolarHBondContact O-N 3.08Å; T22-H26 VanDerWaalsContact O-N 3.07Å; N23-H26 PolarHBondContact O-N 3.19Å; N24-H26 VanDerWaalsContact C-N 3.34Å; N24-H26 PolarHBondContact O-N 3.33Å; H26-F29 PolarHBondContact O-N 3.48Å; H26-D30 PolarHBondContact O-N 3.37Å
27	L	68.6	Low	67.8	Low	106 Å²	106	70.2 Å²	70.2	56%	0.555	36%	0.361	S	S	*	.	H	α-helix	trans	-64.7	-39.3	177.5	-72.3	168.3	0	0	0	112.7	N23 N24 D30 Y31	N23-L27 WeakPolarHBondContact O-CG 3.24Å; N23-L27 PolarHBondContact O-N 2.76Å; N23-L27 VanDerWaalsContact O-N 3.13Å; N24-L27 PolarHBondContact O-N 3.5Å; L27-D30 PolarHBondContact O-N 3.13Å; L27-Y31 PolarHBondContact O-N 3.47Å; L27-Y31 VanDerWaalsContact O-N 3.09Å
28	D	75.2	Confident	70	Confident	94 Å²	94	69.1 Å²	69.1	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-68.3	-38.3	176.5	-80.5	-17.7	0	0	0	112	N24 Y31 R32 Y146	N24-D28 PolarHBondContact O-N 3.05Å; D28-Y31 PolarHBondContact O-N 3.07Å; D28-R32 WeakPolarHBondContact O-CG 3.11Å; D28-R32 PolarHBondContact O-N 2.68Å; D28-R32 VanDerWaalsContact O-N 3.15Å; D28-Y146 HydrophobicContact CB-CD2 4.43Å
29	F	79.8	Confident	72.1	Confident	31 Å²	31	65.6 Å²	65.6	14%	0.136	34%	0.335	C	S	.	.	H	α-helix	trans	-61.4	-47.4	173.1	-179.9	-94.2	0	0	0	111.7	S25 H26 Y31 R32 L33 L116 V141 F145 Y146	S25-F29 WeakPolarHBondContact O-CB 3.3Å; S25-F29 PolarHBondContact O-N 2.91Å; S25-F29 VanDerWaalsContact O-N 3.08Å; H26-F29 PolarHBondContact O-N 3.48Å; F29-Y31 VanDerWaalsContact C-N 3.33Å; F29-Y31 PolarHBondContact O-N 3.33Å; F29-R32 PolarHBondContact O-N 3.05Å; F29-L33 HydrophobicContact CE1-CD2 3.87Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 WeakPolarHBondContact O-CB 3.48Å; F29-L33 PolarHBondContact O-N 3.1Å; F29-L116 HydrophobicContact CZ-CD2 4.24Å; F29-V141 HydrophobicContact CE2-CG1 4.43Å; F29-F145 HydrophobicContact CD2-CB 4.19Å; F29-F145 HydrophobicContact CE2-CB 3.89Å; F29-Y146 HydrophobicContact CB-CD1 4.38Å; F29-Y146 HydrophobicContact CD2-CD1 4.41Å
30	D	78.9	Confident	74.4	Confident	22 Å²	22	60.7 Å²	60.7	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-43	178.5	-77	-3.2	0	0	0	112	H26 L27 R32 L33 F34 S60 L61	H26-D30 PolarHBondContact O-N 3.37Å; L27-D30 PolarHBondContact O-N 3.13Å; D30-R32 PolarHBondContact O-N 3.16Å; D30-L33 PolarHBondContact O-N 2.91Å; D30-F34 WeakPolarHBondContact O-CB 3.34Å; D30-F34 PolarHBondContact O-N 3.39Å; D30-S60 PolarHBondContact OD2-OG 3.28Å; D30-L61 HydrophobicContact CB-CD1 3.88Å
31	Y	81.8	Confident	76.7	Confident	146 Å²	146	57.9 Å²	57.9	57%	0.573	29%	0.293	S	S	*	.	H	α-helix	trans	-62.7	-42.2	178.3	-175.5	-97.6	0	0	0	112.2	L27 D28 F29 F34 G35	L27-Y31 PolarHBondContact O-N 3.47Å; L27-Y31 VanDerWaalsContact O-N 3.09Å; D28-Y31 PolarHBondContact O-N 3.07Å; F29-Y31 VanDerWaalsContact C-N 3.33Å; F29-Y31 PolarHBondContact O-N 3.33Å; Y31-F34 PolarHBondContact O-N 2.8Å; Y31-G35 PolarHBondContact O-N 3.4Å; Y31-G35 VanDerWaalsContact O-N 3.1Å
32	R	84.9	Confident	78.6	Confident	81 Å²	81	59.1 Å²	59.1	31%	0.306	30%	0.301	S	S	.	.	H	α-helix	trans	-72	-39.8	178.9	-65.5	-59.8	-176.4	150.8	11.8	112.3	D28 F29 D30 F34 G35 L36 F145 E149	D28-R32 WeakPolarHBondContact O-CG 3.11Å; D28-R32 PolarHBondContact O-N 2.68Å; D28-R32 VanDerWaalsContact O-N 3.15Å; F29-R32 PolarHBondContact O-N 3.05Å; D30-R32 PolarHBondContact O-N 3.16Å; R32-F34 VanDerWaalsContact C-N 3.29Å; R32-F34 PolarHBondContact O-N 3.37Å; R32-G35 PolarHBondContact O-N 3.17Å; R32-L36 PolarHBondContact O-N 3.11Å; R32-F145 HydrophobicContact CB-CD1 3.96Å; R32-F145 HydrophobicContact CB-CE1 3.84Å; R32-E149 IonicContact CZ-OE1 2.65Å; R32-E149 IonicContact NE-OE1 3.74Å; R32-E149 IonicContact NH1-OE1 3.27Å; R32-E149 PolarHBondContact NH1-OE1 2.77Å; R32-E149 IonicContact NH2-OE1 3.16Å; R32-E149 PolarHBondContact NH2-OE1 3.46Å
33	L	86	Confident	80.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-38.4	174.6	-176.7	59.4	0	0	0	111.1	F29 D30 L36 L37 L61 L114 L116	F29-L33 HydrophobicContact CE1-CD2 3.87Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 WeakPolarHBondContact O-CB 3.48Å; F29-L33 PolarHBondContact O-N 3.1Å; D30-L33 PolarHBondContact O-N 2.91Å; L33-L36 HydrophobicContact CD1-CD2 4.28Å; L33-L36 WeakPolarHBondContact O-CB 3.4Å; L33-L36 PolarHBondContact O-N 2.95Å; L33-L37 HydrophobicContact CG-CD1 4.38Å; L33-L37 WeakPolarHBondContact O-CG 3.43Å; L33-L37 PolarHBondContact O-N 3.11Å; L33-L61 HydrophobicContact CB-CD1 4.16Å; L33-L61 HydrophobicContact CD2-CD1 3.93Å; L33-L61 HydrophobicContact CG-CD1 4.19Å; L33-L114 HydrophobicContact CD1-CD2 3.94Å; L33-L116 HydrophobicContact CD1-CD2 4.07Å; L33-L116 HydrophobicContact CD2-CD1 4.19Å; L33-L116 HydrophobicContact CD2-CD2 4.13Å
34	F	86.8	Confident	81.8	Confident	32 Å²	32	61 Å²	61	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-46	172.5	179.2	-102.8	0	0	0	111.9	D30 Y31 R32 L36 L37 Q38 L61 R64 L65	D30-F34 WeakPolarHBondContact O-CB 3.34Å; D30-F34 PolarHBondContact O-N 3.39Å; Y31-F34 PolarHBondContact O-N 2.8Å; R32-F34 VanDerWaalsContact C-N 3.29Å; R32-F34 PolarHBondContact O-N 3.37Å; F34-L36 VanDerWaalsContact C-N 3.29Å; F34-L36 PolarHBondContact O-N 3.12Å; F34-L37 PolarHBondContact O-N 2.89Å; F34-L37 VanDerWaalsContact O-N 3.17Å; F34-Q38 HydrophobicContact CD1-CG 4.29Å; F34-Q38 HydrophobicContact CE1-CG 3.92Å; F34-Q38 HydrophobicContact CE2-CG 4.33Å; F34-Q38 HydrophobicContact CZ-CG 3.95Å; F34-Q38 VanDerWaalsContact CZ-NE2 3.26Å; F34-Q38 WeakPolarHBondContact O-CG 3.27Å; F34-Q38 PolarHBondContact O-N 3.17Å; F34-L61 HydrophobicContact CB-CD2 3.7Å; F34-L61 HydrophobicContact CB-CG 4.35Å; F34-L61 HydrophobicContact CD2-CD2 4.01Å; F34-L61 HydrophobicContact CG-CD2 4.37Å; F34-R64 HydrophobicContact CD2-CB 4.11Å; F34-R64 HydrophobicContact CE2-CB 3.61Å; F34-R64 HydrophobicContact CZ-CB 4.15Å; F34-L65 HydrophobicContact CD2-CD1 4.46Å; F34-L65 HydrophobicContact CD2-CD2 4.36Å; F34-L65 HydrophobicContact CD2-CG 3.99Å; F34-L65 HydrophobicContact CE2-CD2 4.16Å; F34-L65 HydrophobicContact CE2-CG 3.9Å
35	G	86.9	Confident	83.3	Confident	26 Å²	26	62 Å²	62	27%	0.268	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-39	174.6	0	0	0	0	0	113	Y31 R32 R39	Y31-G35 PolarHBondContact O-N 3.4Å; Y31-G35 VanDerWaalsContact O-N 3.1Å; R32-G35 PolarHBondContact O-N 3.17Å; G35-R39 WeakPolarHBondContact O-CB 3.15Å; G35-R39 PolarHBondContact O-N 3.48Å
36	L	89	Confident	84.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.6	-45.3	173.5	175.5	61.9	0	0	0	112.1	R32 L33 F34 Q38 R39 L40 L114 V141 F145 V151 L167 I173	R32-L36 PolarHBondContact O-N 3.11Å; L33-L36 HydrophobicContact CD1-CD2 4.28Å; L33-L36 WeakPolarHBondContact O-CB 3.4Å; L33-L36 PolarHBondContact O-N 2.95Å; F34-L36 VanDerWaalsContact C-N 3.29Å; F34-L36 PolarHBondContact O-N 3.12Å; L36-Q38 VanDerWaalsContact C-N 3.34Å; L36-Q38 PolarHBondContact O-N 2.92Å; L36-R39 WeakPolarHBondContact O-CB 3.11Å; L36-R39 PolarHBondContact O-N 3.06Å; L36-L40 HydrophobicContact CD1-CG 4.36Å; L36-L40 WeakPolarHBondContact O-CG 3.23Å; L36-L40 PolarHBondContact O-N 2.72Å; L36-L114 HydrophobicContact CD2-CD1 4.04Å; L36-L114 HydrophobicContact CD2-CD2 3.98Å; L36-V141 HydrophobicContact CD2-CG2 3.67Å; L36-F145 HydrophobicContact CB-CE1 4.35Å; L36-F145 HydrophobicContact CB-CZ 4.22Å; L36-F145 HydrophobicContact CD2-CE1 4.39Å; L36-F145 HydrophobicContact CD2-CZ 4.06Å; L36-V151 HydrophobicContact CD1-CG2 3.96Å; L36-V151 HydrophobicContact CD2-CG2 4.07Å; L36-L167 HydrophobicContact CB-CD1 3.95Å; L36-L167 HydrophobicContact CD1-CD1 3.63Å; L36-L167 HydrophobicContact CG-CD1 4.38Å; L36-I173 HydrophobicContact CD1-CD1 3.39Å
37	L	89.5	Confident	86.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-35.9	178.7	-71.5	173.2	0	0	0	112.3	L33 F34 L40 Q41 Y46 L61 L65 L88 L114	L33-L37 HydrophobicContact CG-CD1 4.38Å; L33-L37 WeakPolarHBondContact O-CG 3.43Å; L33-L37 PolarHBondContact O-N 3.11Å; F34-L37 PolarHBondContact O-N 2.89Å; F34-L37 VanDerWaalsContact O-N 3.17Å; L37-L40 PolarHBondContact O-N 3.25Å; L37-Q41 PolarHBondContact O-N 2.81Å; L37-Y46 WeakPolarHBondContact O-CE1 3.26Å; L37-Y46 PolarHBondContact O-OH 3.13Å; L37-L61 HydrophobicContact CD1-CD2 3.72Å; L37-L65 HydrophobicContact CB-CD1 4.42Å; L37-L65 HydrophobicContact CB-CD2 4.18Å; L37-L65 HydrophobicContact CD1-CD1 3.6Å; L37-L88 HydrophobicContact CD2-CD2 3.63Å; L37-L114 HydrophobicContact CD2-CD2 3.89Å
38	Q	88.8	Confident	87.1	Confident	100 Å²	100	54 Å²	54	47%	0.467	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-43.8	170.9	-74.1	-172.7	-42.2	0	0	111.8	F34 L36 L40 Q41 V42	F34-Q38 HydrophobicContact CD1-CG 4.29Å; F34-Q38 HydrophobicContact CE1-CG 3.92Å; F34-Q38 HydrophobicContact CE2-CG 4.33Å; F34-Q38 HydrophobicContact CZ-CG 3.95Å; F34-Q38 VanDerWaalsContact CZ-NE2 3.26Å; F34-Q38 WeakPolarHBondContact O-CG 3.27Å; F34-Q38 PolarHBondContact O-N 3.17Å; L36-Q38 VanDerWaalsContact C-N 3.34Å; L36-Q38 PolarHBondContact O-N 2.92Å; Q38-L40 VanDerWaalsContact C-N 3.31Å; Q38-L40 PolarHBondContact O-N 2.89Å; Q38-Q41 WeakPolarHBondContact O-CB 3.36Å; Q38-Q41 PolarHBondContact O-N 2Å; Q38-Q41 VanDerWaalsContact O-N 3.15Å; Q38-V42 WeakPolarHBondContact O-CG2 3.49Å; Q38-V42 PolarHBondContact O-N 2.8Å; Q38-V42 VanDerWaalsContact O-N 3.09Å
39	R	90.1	Very high	87.9	Confident	40 Å²	40	49.6 Å²	49.6	15%	0.151	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-44.8	174.4	177.5	-179.7	169	-172.3	-7.2	111.2	G35 L36 Q41 V42 E43 N166 L167 K171	G35-R39 WeakPolarHBondContact O-CB 3.15Å; G35-R39 PolarHBondContact O-N 3.48Å; L36-R39 WeakPolarHBondContact O-CB 3.11Å; L36-R39 PolarHBondContact O-N 3.06Å; R39-Q41 VanDerWaalsContact C-N 3.25Å; R39-Q41 PolarHBondContact O-N 3.01Å; R39-V42 PolarHBondContact O-N 3.35Å; R39-V42 VanDerWaalsContact O-N 3.16Å; R39-E43 HydrophobicContact CG-CG 4.47Å; R39-E43 IonicContact CZ-OE1 2.79Å; R39-E43 IonicContact NE-OE1 2.71Å; R39-E43 PolarHBondContact NE-OE1 3.35Å; R39-E43 IonicContact NH2-OE1 3.75Å; R39-E43 PolarHBondContact NH2-OE1 2.89Å; R39-E43 PolarHBondContact O-N 3.03Å; R39-N166 PolarHBondContact NH1-O 2.71Å; R39-L167 PolarHBondContact NH1-O 2.85Å; R39-K171 PolarHBondContact NH2-O 3.22Å
40	L	90.8	Very high	88.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-32.6	177.3	-70.9	-177.3	0	0	0	112.7	L36 L37 Q38 K44 Y46 L88 R112 L114 I173 Y174	L36-L40 HydrophobicContact CD1-CG 4.36Å; L36-L40 WeakPolarHBondContact O-CG 3.23Å; L36-L40 PolarHBondContact O-N 2.72Å; L37-L40 PolarHBondContact O-N 3.25Å; Q38-L40 VanDerWaalsContact C-N 3.31Å; Q38-L40 PolarHBondContact O-N 2.89Å; L40-K44 CarbonylContact O-C 3.51Å; L40-K44 PolarHBondContact O-N 3.45Å; L40-K44 VanDerWaalsContact O-N 3.12Å; L40-Y46 HydrophobicContact CB-CE1 4.17Å; L40-L88 HydrophobicContact CD1-CD1 4.36Å; L40-L88 HydrophobicContact CD1-CD2 4.22Å; L40-R112 PolarHBondContact O-NH1 2.79Å; L40-L114 HydrophobicContact CD1-CD2 4.39Å; L40-I173 HydrophobicContact CD2-CB 4.26Å; L40-I173 HydrophobicContact CD2-CD1 3.82Å; L40-Y174 HydrophobicContact CD1-CE2 4.01Å; L40-Y174 HydrophobicContact CD2-CD2 3.87Å; L40-Y174 HydrophobicContact CD2-CE2 3.51Å; L40-Y174 HydrophobicContact CG-CE2 4.4Å
41	Q	90	Very high	88.9	Confident	45 Å²	45	47.1 Å²	47.1	21%	0.21	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-37	175.4	-171.9	67.8	-16.8	0	0	111.7	L37 Q38 R39 K44 F45 Y46	L37-Q41 PolarHBondContact O-N 2.81Å; Q38-Q41 WeakPolarHBondContact O-CB 3.36Å; Q38-Q41 PolarHBondContact O-N 2Å; Q38-Q41 VanDerWaalsContact O-N 3.15Å; R39-Q41 VanDerWaalsContact C-N 3.25Å; R39-Q41 PolarHBondContact O-N 3.01Å; Q41-K44 CarbonylContact O-C 3.51Å; Q41-F45 VanDerWaalsContact NE2-CD2 3.33Å; Q41-F45 WeakPolarHBondContact O-CA 3.32Å; Q41-F45 PolarHBondContact O-N 2.78Å; Q41-Y46 HydrophobicContact CB-CD1 4.36Å; Q41-Y46 HydrophobicContact CB-CE1 3.72Å; Q41-Y46 HydrophobicContact CG-CE1 4.44Å; Q41-Y46 PolarHBondContact NE2-O 3.33Å; Q41-Y46 PolarHBondContact OE1-O 2.98Å; Q41-Y46 VanDerWaalsContact OE1-O 3.11Å
42	V	89.3	Confident	89.3	Confident	130 Å²	130	40.2 Å²	40.2	79%	0.788	20%	0.198	S	C	*	.	H	α-helix	trans	-75.2	-40.9	176.6	176.5	0	0	0	0	111.8	Q38 R39	Q38-V42 WeakPolarHBondContact O-CG2 3.49Å; Q38-V42 PolarHBondContact O-N 2.8Å; Q38-V42 VanDerWaalsContact O-N 3.09Å; R39-V42 PolarHBondContact O-N 3.35Å; R39-V42 VanDerWaalsContact O-N 3.16Å
43	E	88.8	Confident	89.2	Confident	67 Å²	67	36.4 Å²	36.4	31%	0.313	18%	0.184	S	C	.	.	H	α-helix	trans	-64.3	-45.2	178.9	-76.3	-171.1	-165.1	0	0	112.1	R39 S172 I173	R39-E43 HydrophobicContact CG-CG 4.47Å; R39-E43 IonicContact CZ-OE1 2.79Å; R39-E43 IonicContact NE-OE1 2.71Å; R39-E43 PolarHBondContact NE-OE1 3.35Å; R39-E43 IonicContact NH2-OE1 3.75Å; R39-E43 PolarHBondContact NH2-OE1 2.89Å; R39-E43 PolarHBondContact O-N 3.03Å; E43-S172 WeakPolarHBondContact OE2-CA 3.29Å; E43-S172 PolarHBondContact OE2-OG 3.4Å; E43-I173 PolarHBondContact OE2-N 2.76Å
44	K	88.1	Confident	88.5	Confident	122 Å²	122	43.7 Å²	43.7	53%	0.53	22%	0.218	S	C	.	.	S	Bend	trans	-153	122.8	172.1	179.9	177.3	-174.3	178.8	0	108.3	L40 Q41 Y46 R112	L40-K44 CarbonylContact O-C 3.51Å; L40-K44 PolarHBondContact O-N 3.45Å; L40-K44 VanDerWaalsContact O-N 3.12Å; Q41-K44 CarbonylContact O-C 3.51Å; K44-Y46 PolarHBondContact O-N 3.08Å; K44-R112 PolarHBondContact O-NH1 3.47Å; K44-R112 PolarHBondContact O-NH2 2.7Å
45	F	91.8	Very high	87.4	Confident	121 Å²	121	48.5 Å²	48.5	53%	0.531	25%	0.245	S	C	.	.			trans	-56.3	136.5	-177.6	-177.7	-98.9	0	0	0	111.9	Q41 D47 L86 R112	Q41-F45 VanDerWaalsContact NE2-CD2 3.33Å; Q41-F45 WeakPolarHBondContact O-CA 3.32Å; Q41-F45 PolarHBondContact O-N 2.78Å; F45-D47 HydrophobicContact CE1-CB 4.03Å; F45-L86 HydrophobicContact CD1-CD1 4.18Å; F45-R112 PolarHBondContact O-NH2 3.05Å
46	Y	92.1	Very high	86.6	Confident	2 Å²	2	48 Å²	48	1%	0.008	24%	0.237	C	C	.	.			trans	-122	140.4	165.3	58.1	-91.5	0	0	0	110.8	L37 L40 Q41 K44 V67 L86 L88	L37-Y46 WeakPolarHBondContact O-CE1 3.26Å; L37-Y46 PolarHBondContact O-OH 3.13Å; L40-Y46 HydrophobicContact CB-CE1 4.17Å; Q41-Y46 HydrophobicContact CB-CD1 4.36Å; Q41-Y46 HydrophobicContact CB-CE1 3.72Å; Q41-Y46 HydrophobicContact CG-CE1 4.44Å; Q41-Y46 PolarHBondContact NE2-O 3.33Å; Q41-Y46 PolarHBondContact OE1-O 2.98Å; Q41-Y46 VanDerWaalsContact OE1-O 3.11Å; K44-Y46 PolarHBondContact O-N 3.08Å; Y46-V67 HydrophobicContact CD2-CG1 3.89Å; Y46-V67 HydrophobicContact CD2-CG2 4.4Å; Y46-V67 HydrophobicContact CE2-CB 4.29Å; Y46-V67 HydrophobicContact CE2-CG1 3.95Å; Y46-V67 HydrophobicContact CE2-CG2 3.91Å; Y46-L86 WeakPolarHBondContact CA-O 3.36Å; Y46-L86 WeakPolarHBondContact CB-O 3.36Å; Y46-L88 HydrophobicContact CD1-CB 4.13Å; Y46-L88 HydrophobicContact CD1-CD2 3.88Å; Y46-L88 HydrophobicContact CD2-CB 4Å; Y46-L88 HydrophobicContact CD2-CD2 4.35Å; Y46-L88 HydrophobicContact CE1-CD2 3.68Å; Y46-L88 HydrophobicContact CE2-CD2 4.17Å; Y46-L88 HydrophobicContact CG-CB 3.79Å; Y46-L88 HydrophobicContact CG-CD2 4.25Å
47	D	90.8	Very high	85	Confident	48 Å²	48	51.3 Å²	51.3	26%	0.257	27%	0.265	S	S	.	.	S	Bend	trans	-99.5	-21.5	-178.9	59.1	10.6	0	0	0	113	F45 V67 P68 S84	F45-D47 HydrophobicContact CE1-CB 4.03Å; D47-V67 VanDerWaalsContact O-CG1 3.31Å; D47-V67 WeakPolarHBondContact O-CG1 3.46Å; D47-P68 WeakPolarHBondContact O-CD 3.32Å; D47-P68 WeakPolarHBondContact O-CG 2.95Å; D47-S84 VanDerWaalsContact OD2-CB 3.28Å; D47-S84 WeakPolarHBondContact OD2-CB 3.07Å; D47-S84 PolarHBondContact OD2-OG 2.89Å
48	T	90.5	Very high	83.8	Confident	26 Å²	26	51.5 Å²	51.5	16%	0.16	27%	0.266	C	S	.	.			trans	-140.9	135.9	-172	-45.9	0	0	0	0	109.2	V70 T87 L88	T48-V70 HydrophobicContact CG2-CG2 4.06Å; T48-T87 WeakPolarHBondContact O-CA 3.45Å; T48-L88 PolarHBondContact O-N 3.02Å
49	L	90.6	Very high	82.5	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.9	173.8	-172.6	67.8	0	0	0	109.3	V51 F62 V67 P68 A69 V70 L88 L90	L49-V51 HydrophobicContact CD2-CG2 4.33Å; L49-V51 HydrophobicContact CG-CG2 4.08Å; L49-F62 HydrophobicContact CD2-CD1 3.81Å; L49-F62 HydrophobicContact CD2-CE1 3.51Å; L49-V67 HydrophobicContact CB-CG1 4.47Å; L49-P68 PolarHBondContact N-O 3.15Å; L49-A69 HydrophobicContact CB-CB 4.36Å; L49-A69 CarbonylContact O-C 3.54Å; L49-A69 VanDerWaalsContact O-CA 3.28Å; L49-A69 WeakPolarHBondContact O-CA 3.24Å; L49-V70 PolarHBondContact O-N 3.44Å; L49-L88 CarbonylContact C-O 3.52Å; L49-L88 WeakPolarHBondContact CA-O 3.49Å; L49-L88 HydrophobicContact CD1-CB 4.07Å; L49-L88 HydrophobicContact CD1-CD2 3.86Å; L49-L88 HydrophobicContact CD1-CG 3.97Å; L49-L90 HydrophobicContact CD1-CB 4.13Å; L49-L90 HydrophobicContact CD2-CD2 4.44Å
50	L	90.7	Very high	81.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.7	177.7	-179.3	60	0	0	0	109.6	Y52 V70 V72 F83 T87 L88 I89 L90 L108	L50-Y52 HydrophobicContact CD2-CE2 3.67Å; L50-Y52 HydrophobicContact CG-CD2 4.43Å; L50-Y52 HydrophobicContact CG-CE2 3.9Å; L50-V70 HydrophobicContact CD1-CB 4.03Å; L50-V70 HydrophobicContact CD1-CG1 3.75Å; L50-V72 HydrophobicContact CD1-CG2 3.6Å; L50-F83 HydrophobicContact CD1-CE1 3.85Å; L50-F83 HydrophobicContact CD1-CE2 4.34Å; L50-F83 HydrophobicContact CD1-CZ 3.45Å; L50-F83 VanDerWaalsContact CD1-CZ 3.45Å; L50-F83 HydrophobicContact CD2-CD2 4.28Å; L50-F83 HydrophobicContact CD2-CE1 4.09Å; L50-F83 HydrophobicContact CD2-CE2 3.71Å; L50-F83 HydrophobicContact CD2-CZ 3.58Å; L50-F83 HydrophobicContact CG-CE1 4.4Å; L50-F83 HydrophobicContact CG-CZ 4.09Å; L50-T87 HydrophobicContact CB-CG2 3.68Å; L50-L88 PolarHBondContact N-O 2.92Å; L50-I89 HydrophobicContact CB-CG1 4.45Å; L50-I89 HydrophobicContact CD2-CG1 4.32Å; L50-I89 CarbonylContact O-C 3.6Å; L50-I89 WeakPolarHBondContact O-CA 3.34Å; L50-L90 PolarHBondContact O-N 3.45Å; L50-L108 HydrophobicContact CD2-CD1 3.66Å; L50-L108 HydrophobicContact CD2-CD2 4.14Å
51	V	89.8	Confident	80.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.3	-172.4	-173.8	0	0	0	0	110.1	L49 C56 F62 V70 L71 V72 L90	L49-V51 HydrophobicContact CD2-CG2 4.33Å; L49-V51 HydrophobicContact CG-CG2 4.08Å; V51-C56 HydrophobicContact CG1-CB 4.17Å; V51-F62 HydrophobicContact CB-CZ 4.5Å; V51-F62 HydrophobicContact CG1-CZ 4.27Å; V51-F62 HydrophobicContact CG2-CE1 3.85Å; V51-F62 HydrophobicContact CG2-CZ 3.65Å; V51-V70 PolarHBondContact N-O 2.86Å; V51-L71 HydrophobicContact CB-CD1 3.91Å; V51-L71 HydrophobicContact CG1-CD1 3.75Å; V51-V72 PolarHBondContact O-N 3.47Å; V51-L90 CarbonylContact C-O 3.55Å; V51-L90 VanDerWaalsContact CA-O 3.26Å; V51-L90 WeakPolarHBondContact CA-O 3.18Å; V51-L90 HydrophobicContact CG2-CB 4.38Å; V51-L90 HydrophobicContact CG2-CD2 4.4Å
52	Y	89.7	Confident	79.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.1	174.8	-72.1	-73.1	0	0	0	111	L50 V72 G75 I89 L90 C92 E97 E99	L50-Y52 HydrophobicContact CD2-CE2 3.67Å; L50-Y52 HydrophobicContact CG-CD2 4.43Å; L50-Y52 HydrophobicContact CG-CE2 3.9Å; Y52-V72 HydrophobicContact CD1-CB 3.75Å; Y52-V72 HydrophobicContact CD1-CG1 3.9Å; Y52-V72 HydrophobicContact CE1-CB 3.75Å; Y52-V72 HydrophobicContact CE1-CG1 3.66Å; Y52-V72 HydrophobicContact CE1-CG2 4.33Å; Y52-G75 WeakPolarHBondContact CE1-O 3.36Å; Y52-I89 HydrophobicContact CD2-CG2 3.63Å; Y52-I89 HydrophobicContact CE2-CG2 3.81Å; Y52-L90 PolarHBondContact N-O 3.09Å; Y52-C92 PolarHBondContact O-N 3.33Å; Y52-E97 HydrophobicContact CD2-CB 4.19Å; Y52-E97 HydrophobicContact CD2-CG 4.02Å; Y52-E97 HydrophobicContact CE2-CG 3.96Å; Y52-E97 HydrophobicContact CG-CB 4.36Å; Y52-E99 PolarHBondContact OH-OE2 3.48Å
53	G	83.8	Confident	78.5	Confident	2 Å²	2	53.8 Å²	53.8	2%	0.021	28%	0.282	C	S	.	.			trans	135.6	149.4	175.7	0	0	0	0	0	113.9
54	E	70.4	Confident	78	Confident	153 Å²	153	57.5 Å²	57.5	72%	0.715	29%	0.293	S	S	*	.	S	Bend	trans	-79.4	-45.2	178.9	-64.4	-174.2	157.8	0	0	112.1	S73	E54-S73 WeakPolarHBondContact CG-O 3.33Å
55	D	65.1	Low	77.5	Confident	132 Å²	132	52.4 Å²	52.4	71%	0.706	27%	0.272	S	S	*	.			trans	-107.1	55.2	-176.4	-70.4	-32.6	0	0	0	112.2	A57 K118	D55-A57 PolarHBondContact O-N 2.83Å; D55-K118 PolarHBondContact O-NZ 3.22Å
56	C	69	Low	77.1	Confident	16 Å²	16	56.2 Å²	56.2	11%	0.108	29%	0.291	C	S	.	.			trans	-82.4	97.6	168.4	-69.1	0	0	0	0	109.4	V51 I58 C92	V51-C56 HydrophobicContact CG1-CB 4.17Å; C56-I58 HydrophobicContact CB-CD1 4.29Å; C56-I58 HydrophobicContact CB-CG1 4.27Å; C56-I58 PolarHBondContact O-N 3.32Å; C56-C92 WeakPolarHBondContact CA-SG 3.08Å; C56-C92 HydrophobicContact CB-CB 4.25Å; C56-C92 WeakPolarHBondContact CB-SG 3.46Å; C56-C92 WeakPolarHBondContact SG-CB 3.14Å; C56-C92 CovalentContact SG-SG 2Å; C56-C92 PolarHBondContact SG-SG 3.26Å
57	A	55.6	Low	76.7	Confident	70 Å²	70	57.1 Å²	57.1	58%	0.579	30%	0.297	S	S	*	.			trans	-71.9	60.6	173.7	0	0	0	0	0	111.7	D55	D55-A57 PolarHBondContact O-N 2.83Å
58	I	63.8	Low	76.6	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	31%	0.311	C	S	.	.			trans	-124.8	6.4	-177.2	-45.7	-178.8	0	0	0	113.7	C56 S60 L61 F62 L90 L116	C56-I58 HydrophobicContact CB-CD1 4.29Å; C56-I58 HydrophobicContact CB-CG1 4.27Å; C56-I58 PolarHBondContact O-N 3.32Å; I58-S60 VanDerWaalsContact C-N 3.26Å; I58-S60 PolarHBondContact O-N 2.89Å; I58-S60 VanDerWaalsContact O-N 3.15Å; I58-L61 HydrophobicContact CB-CB 4.49Å; I58-L61 HydrophobicContact CG2-CB 3.38Å; I58-L61 HydrophobicContact CG2-CD1 3.91Å; I58-L61 HydrophobicContact CG2-CG 4.16Å; I58-L61 WeakPolarHBondContact O-CB 3.4Å; I58-L61 PolarHBondContact O-N 3.45Å; I58-F62 HydrophobicContact CB-CE1 4.24Å; I58-F62 HydrophobicContact CB-CE2 3.95Å; I58-F62 HydrophobicContact CB-CZ 3.65Å; I58-F62 HydrophobicContact CG2-CD1 4.18Å; I58-F62 HydrophobicContact CG2-CE1 3.56Å; I58-F62 HydrophobicContact CG2-CE2 4.11Å; I58-F62 HydrophobicContact CG2-CZ 3.51Å; I58-F62 WeakPolarHBondContact O-CD2 3.01Å; I58-F62 PolarHBondContact O-N 3.33Å; I58-L90 HydrophobicContact CD1-CD2 3.53Å; I58-L90 HydrophobicContact CD1-CG 4.25Å; I58-L90 HydrophobicContact CG2-CD2 4.41Å; I58-L116 HydrophobicContact CD1-CD1 3.59Å
59	P	62.7	Low	76.4	Confident	86 Å²	86	59.9 Å²	59.9	56%	0.558	32%	0.321	S	S	*	.	H	α-helix	trans	-52.8	-40.3	179.5	-26.2	32.7	0	0	0	114.7	L61 F62 E63	P59-L61 PolarHBondContact O-N 3.38Å; P59-F62 PolarHBondContact O-N 3.44Å; P59-E63 PolarHBondContact O-N 3.24Å
60	S	64.7	Low	76.3	Confident	49 Å²	49	61.3 Å²	61.3	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-30	177.7	51.1	0	0	0	0	113.6	D30 I58	D30-S60 PolarHBondContact OD2-OG 3.28Å; I58-S60 VanDerWaalsContact C-N 3.26Å; I58-S60 PolarHBondContact O-N 2.89Å; I58-S60 VanDerWaalsContact O-N 3.15Å
61	L	69.8	Low	76.1	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-81.7	-36.3	-176.5	-118.1	144.2	0	0	0	111.1	D30 L33 F34 L37 I58 P59 R64 L65	D30-L61 HydrophobicContact CB-CD1 3.88Å; L33-L61 HydrophobicContact CB-CD1 4.16Å; L33-L61 HydrophobicContact CD2-CD1 3.93Å; L33-L61 HydrophobicContact CG-CD1 4.19Å; F34-L61 HydrophobicContact CB-CD2 3.7Å; F34-L61 HydrophobicContact CB-CG 4.35Å; F34-L61 HydrophobicContact CD2-CD2 4.01Å; F34-L61 HydrophobicContact CG-CD2 4.37Å; L37-L61 HydrophobicContact CD1-CD2 3.72Å; I58-L61 HydrophobicContact CB-CB 4.49Å; I58-L61 HydrophobicContact CG2-CB 3.38Å; I58-L61 HydrophobicContact CG2-CD1 3.91Å; I58-L61 HydrophobicContact CG2-CG 4.16Å; I58-L61 WeakPolarHBondContact O-CB 3.4Å; I58-L61 PolarHBondContact O-N 3.45Å; P59-L61 PolarHBondContact O-N 3.38Å; L61-R64 PolarHBondContact O-N 3.09Å; L61-L65 HydrophobicContact CD2-CD1 3.8Å; L61-L65 WeakPolarHBondContact O-CD1 3.42Å; L61-L65 PolarHBondContact O-N 3.46Å
62	F	70.1	Confident	76	Confident	49 Å²	49	66.8 Å²	66.8	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-33.8	178.2	-55.4	-42.7	0	0	0	112.6	L49 V51 I58 P59 R64 L65 A69	L49-F62 HydrophobicContact CD2-CD1 3.81Å; L49-F62 HydrophobicContact CD2-CE1 3.51Å; V51-F62 HydrophobicContact CB-CZ 4.5Å; V51-F62 HydrophobicContact CG1-CZ 4.27Å; V51-F62 HydrophobicContact CG2-CE1 3.85Å; V51-F62 HydrophobicContact CG2-CZ 3.65Å; I58-F62 HydrophobicContact CB-CE1 4.24Å; I58-F62 HydrophobicContact CB-CE2 3.95Å; I58-F62 HydrophobicContact CB-CZ 3.65Å; I58-F62 HydrophobicContact CG2-CD1 4.18Å; I58-F62 HydrophobicContact CG2-CE1 3.56Å; I58-F62 HydrophobicContact CG2-CE2 4.11Å; I58-F62 HydrophobicContact CG2-CZ 3.51Å; I58-F62 WeakPolarHBondContact O-CD2 3.01Å; I58-F62 PolarHBondContact O-N 3.33Å; P59-F62 PolarHBondContact O-N 3.44Å; F62-R64 PolarHBondContact O-N 2.81Å; F62-L65 PolarHBondContact O-N 3.45Å; F62-A69 HydrophobicContact CD1-CB 3.85Å; F62-A69 HydrophobicContact CE1-CB 4.23Å; F62-A69 HydrophobicContact CG-CB 4.07Å
63	E	72	Confident	75.7	Confident	177 Å²	177	69.8 Å²	69.8	83%	0.827	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.7	174.8	-69	-174.5	173.3	0	0	112.7	P59	P59-E63 PolarHBondContact O-N 3.24Å
64	R	77.4	Confident	75.7	Confident	144 Å²	144	73.6 Å²	73.6	54%	0.543	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-29	-179.7	-63.8	-179.4	-177.7	-177.5	2.4	112.8	F34 L61 F62	F34-R64 HydrophobicContact CD2-CB 4.11Å; F34-R64 HydrophobicContact CE2-CB 3.61Å; F34-R64 HydrophobicContact CZ-CB 4.15Å; L61-R64 PolarHBondContact O-N 3.09Å; F62-R64 PolarHBondContact O-N 2.81Å
65	L	77.5	Confident	76.4	Confident	16 Å²	16	66.4 Å²	66.4	8%	0.084	37%	0.374	C	S	.	.	S	Bend	trans	-80.7	115.4	175.3	-77.8	154	0	0	0	108.7	F34 L37 L61 F62 V67	F34-L65 HydrophobicContact CD2-CD1 4.46Å; F34-L65 HydrophobicContact CD2-CD2 4.36Å; F34-L65 HydrophobicContact CD2-CG 3.99Å; F34-L65 HydrophobicContact CE2-CD2 4.16Å; F34-L65 HydrophobicContact CE2-CG 3.9Å; L37-L65 HydrophobicContact CB-CD1 4.42Å; L37-L65 HydrophobicContact CB-CD2 4.18Å; L37-L65 HydrophobicContact CD1-CD1 3.6Å; L61-L65 HydrophobicContact CD2-CD1 3.8Å; L61-L65 WeakPolarHBondContact O-CD1 3.42Å; L61-L65 PolarHBondContact O-N 3.46Å; F62-L65 PolarHBondContact O-N 3.45Å; L65-V67 PolarHBondContact O-N 3.16Å
66	Q	82.3	Confident	77.5	Confident	200 Å²	200	62 Å²	62	94%	0.935	35%	0.353	S	S	*	.			trans	-75.3	45.3	173.7	-63	-179.2	-0.3	0	0	111.7
67	V	85.4	Confident	78.2	Confident	22 Å²	22	61.9 Å²	61.9	13%	0.133	35%	0.352	C	S	.	.	S	Bend	trans	-130.5	129.2	-176.8	-175.7	0	0	0	0	108.2	Y46 D47 L49 L65 A69	Y46-V67 HydrophobicContact CD2-CG1 3.89Å; Y46-V67 HydrophobicContact CD2-CG2 4.4Å; Y46-V67 HydrophobicContact CE2-CB 4.29Å; Y46-V67 HydrophobicContact CE2-CG1 3.95Å; Y46-V67 HydrophobicContact CE2-CG2 3.91Å; D47-V67 VanDerWaalsContact O-CG1 3.31Å; D47-V67 WeakPolarHBondContact O-CG1 3.46Å; L49-V67 HydrophobicContact CB-CG1 4.47Å; L65-V67 PolarHBondContact O-N 3.16Å; V67-A69 PolarHBondContact O-N 3.03Å
68	P	88	Confident	79.5	Confident	85 Å²	85	65.8 Å²	65.8	55%	0.552	36%	0.363	S	S	*	.			trans	-59.3	124.7	175.8	24.8	-34.6	0	0	0	110.7	D47 L49	D47-P68 WeakPolarHBondContact O-CD 3.32Å; D47-P68 WeakPolarHBondContact O-CG 2.95Å; L49-P68 PolarHBondContact N-O 3.15Å
69	A	86.7	Confident	80.5	Confident	46 Å²	46	70.3 Å²	70.3	38%	0.38	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.6	175.8	0	0	0	0	0	110.4	L49 F62 V67	L49-A69 HydrophobicContact CB-CB 4.36Å; L49-A69 CarbonylContact O-C 3.54Å; L49-A69 VanDerWaalsContact O-CA 3.28Å; L49-A69 WeakPolarHBondContact O-CA 3.24Å; F62-A69 HydrophobicContact CD1-CB 3.85Å; F62-A69 HydrophobicContact CE1-CB 4.23Å; F62-A69 HydrophobicContact CG-CB 4.07Å; V67-A69 PolarHBondContact O-N 3.03Å
70	V	87.2	Confident	81.5	Confident	33 Å²	33	69.9 Å²	69.9	20%	0.2	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.3	178.9	173.7	0	0	0	0	107.9	T48 L49 L50 V51 V72 W81	T48-V70 HydrophobicContact CG2-CG2 4.06Å; L49-V70 PolarHBondContact O-N 3.44Å; L50-V70 HydrophobicContact CD1-CB 4.03Å; L50-V70 HydrophobicContact CD1-CG1 3.75Å; V51-V70 PolarHBondContact N-O 2.86Å; V70-V72 HydrophobicContact CG1-CG2 4.3Å; V70-W81 HydrophobicContact CB-CH2 4.39Å; V70-W81 HydrophobicContact CG1-CH2 3.05Å; V70-W81 HydrophobicContact CG1-CZ2 3.87Å; V70-W81 HydrophobicContact CG1-CZ3 3.46Å; V70-W81 VanDerWaalsContact CG1-CZ3 3.46Å
71	L	87.4	Confident	82.3	Confident	107 Å²	107	71.4 Å²	71.4	56%	0.56	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	122	179.6	-173.9	68.6	0	0	0	110.5	V51	V51-L71 HydrophobicContact CB-CD1 3.91Å; V51-L71 HydrophobicContact CG1-CD1 3.75Å
72	V	88.2	Confident	82.7	Confident	9 Å²	9	77.6 Å²	77.6	6%	0.055	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	83.3	173.4	-174.5	0	0	0	0	108.1	L50 V51 Y52 V70 S74 G75 S76 T77 W81	L50-V72 HydrophobicContact CD1-CG2 3.6Å; V51-V72 PolarHBondContact O-N 3.47Å; Y52-V72 HydrophobicContact CD1-CB 3.75Å; Y52-V72 HydrophobicContact CD1-CG1 3.9Å; Y52-V72 HydrophobicContact CE1-CB 3.75Å; Y52-V72 HydrophobicContact CE1-CG1 3.66Å; Y52-V72 HydrophobicContact CE1-CG2 4.33Å; V70-V72 HydrophobicContact CG1-CG2 4.3Å; V72-S74 VanDerWaalsContact C-N 3.34Å; V72-S74 PolarHBondContact O-N 3.05Å; V72-G75 PolarHBondContact O-N 3.08Å; V72-S76 WeakPolarHBondContact CG1-O 3.3Å; V72-T77 HydrophobicContact CG1-CG2 4.41Å; V72-T77 HydrophobicContact CG2-CG2 4.47Å; V72-W81 HydrophobicContact CG2-CZ3 3.97Å
73	S	83.5	Confident	83.3	Confident	63 Å²	63	76.1 Å²	76.1	44%	0.441	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-34.6	-177.5	52.3	0	0	0	0	112.8	E54 G75	E54-S73 WeakPolarHBondContact CG-O 3.33Å; S73-G75 PolarHBondContact O-N 3.33Å
74	S	83.8	Confident	83.7	Confident	81 Å²	81	69.7 Å²	69.7	57%	0.566	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-11.5	178.1	49.2	0	0	0	0	114.5	V72 S76	V72-S74 VanDerWaalsContact C-N 3.34Å; V72-S74 PolarHBondContact O-N 3.05Å; S74-S76 PolarHBondContact O-N 3.28Å; S74-S76 PolarHBondContact OG-O 3.03Å
75	G	84.8	Confident	83.8	Confident	3 Å²	3	66.8 Å²	66.8	3%	0.031	38%	0.377	C	S	.	.	S	Bend	trans	78.7	-10.6	-175.1	0	0	0	0	0	115.2	Y52 V72 S73 D96 R98 E99	Y52-G75 WeakPolarHBondContact CE1-O 3.36Å; V72-G75 PolarHBondContact O-N 3.08Å; S73-G75 PolarHBondContact O-N 3.33Å; G75-D96 WeakPolarHBondContact CA-O 3.17Å; G75-R98 CarbonylContact O-C 3.52Å; G75-R98 WeakPolarHBondContact O-CA 3.35Å; G75-R98 PolarHBondContact O-N 2.87Å; G75-E99 PolarHBondContact O-N 3.22Å; G75-E99 VanDerWaalsContact O-N 3.11Å
76	S	87.6	Confident	84.3	Confident	39 Å²	39	68.6 Å²	68.6	27%	0.273	39%	0.387	S	S	.	.	S	Bend	trans	-143.9	159.9	-179.1	78.9	0	0	0	0	112.8	V72 S74 R98	V72-S76 WeakPolarHBondContact CG1-O 3.3Å; S74-S76 PolarHBondContact O-N 3.28Å; S74-S76 PolarHBondContact OG-O 3.03Å; S76-R98 VanDerWaalsContact CB-O 3.24Å; S76-R98 WeakPolarHBondContact CB-O 3.36Å
77	T	84.4	Confident	84.7	Confident	13 Å²	13	59.1 Å²	59.1	8%	0.08	34%	0.342	C	S	.	.			trans	-107.6	137.4	177.3	61.5	0	0	0	0	111.3	V72 F79 W81 E99 T104	V72-T77 HydrophobicContact CG1-CG2 4.41Å; V72-T77 HydrophobicContact CG2-CG2 4.47Å; T77-F79 PolarHBondContact OG1-O 2.84Å; T77-W81 HydrophobicContact CG2-CE3 3.74Å; T77-W81 HydrophobicContact CG2-CZ3 4.14Å; T77-E99 WeakPolarHBondContact CG2-OE2 3.5Å; T77-E99 PolarHBondContact N-OE1 3.15Å; T77-E99 PolarHBondContact N-OE2 2.86Å; T77-E99 PolarHBondContact OG1-OE1 3.39Å; T77-E99 PolarHBondContact OG1-OE2 3.09Å; T77-T104 PolarHBondContact OG1-OG1 3.27Å
78	N	82.5	Confident	85.1	Confident	152 Å²	152	58.1 Å²	58.1	81%	0.813	34%	0.336	S	S	*	.	S	Bend	trans	-92.9	2.6	178.5	62.8	-23.3	0	0	0	113.7
79	F	83.9	Confident	85.4	Confident	100 Å²	100	54 Å²	54	44%	0.439	31%	0.31	S	S	.	.	S	Bend	trans	-137.9	160.1	177.6	55.4	-95.4	0	0	0	110.8	T77 W81 N101	T77-F79 PolarHBondContact OG1-O 2.84Å; F79-W81 HydrophobicContact CD2-CB 4.26Å; F79-W81 HydrophobicContact CD2-CG 4.23Å; F79-W81 HydrophobicContact CE2-CB 3.99Å; F79-W81 AromaticContact CE2-CD1 3.69Å; F79-W81 AromaticContact CE2-CD2 3.57Å; F79-W81 HydrophobicContact CE2-CD2 3.57Å; F79-W81 AromaticContact CE2-CE2 3.79Å; F79-W81 HydrophobicContact CE2-CE3 4.08Å; F79-W81 AromaticContact CE2-CG 3.53Å; F79-W81 HydrophobicContact CE2-CG 3.53Å; F79-W81 HydrophobicContact CE2-CZ2 4.45Å; F79-W81 AromaticContact CE2-NE1 3.87Å; F79-W81 HydrophobicContact CZ-CD2 4.01Å; F79-W81 HydrophobicContact CZ-CE3 4.15Å; F79-W81 HydrophobicContact CZ-CG 4.42Å; F79-W81 HydrophobicContact CZ-CH2 4.37Å; F79-W81 HydrophobicContact CZ-CZ2 4.29Å; F79-W81 HydrophobicContact CZ-CZ3 4.35Å; F79-W81 PolarHBondContact O-N 3.05Å; F79-N101 PolarHBondContact O-ND2 3.32Å
80	D	83.6	Confident	85.6	Confident	76 Å²	76	51.9 Å²	51.9	41%	0.406	29%	0.292	S	S	.	.			trans	-71.3	93.7	178	-68.7	-10.8	0	0	0	110.2	N101 R103	D80-N101 PolarHBondContact OD1-ND2 3.19Å; D80-N101 PolarHBondContact OD1-OD1 2.95Å; D80-R103 VanDerWaalsContact CG-CD 3.41Å; D80-R103 WeakPolarHBondContact OD2-CD 3.26Å; D80-R103 IonicContact OD2-CZ 3.39Å; D80-R103 IonicContact OD2-NE 3.14Å; D80-R103 IonicContact OD2-NH1 2.81Å; D80-R103 PolarHBondContact OD2-NH1 3.03Å
81	W	81.8	Confident	85.8	Confident	82 Å²	82	50.3 Å²	50.3	31%	0.311	28%	0.282	S	S	.	.			trans	-80.2	147.4	177.4	-136.8	-8.8	0	0	0	111.2	V70 V72 T77 F79 F83 T104 K107	V70-W81 HydrophobicContact CB-CH2 4.39Å; V70-W81 HydrophobicContact CG1-CH2 3.05Å; V70-W81 HydrophobicContact CG1-CZ2 3.87Å; V70-W81 HydrophobicContact CG1-CZ3 3.46Å; V70-W81 VanDerWaalsContact CG1-CZ3 3.46Å; V72-W81 HydrophobicContact CG2-CZ3 3.97Å; T77-W81 HydrophobicContact CG2-CE3 3.74Å; T77-W81 HydrophobicContact CG2-CZ3 4.14Å; F79-W81 HydrophobicContact CD2-CB 4.26Å; F79-W81 HydrophobicContact CD2-CG 4.23Å; F79-W81 HydrophobicContact CE2-CB 3.99Å; F79-W81 AromaticContact CE2-CD1 3.69Å; F79-W81 AromaticContact CE2-CD2 3.57Å; F79-W81 HydrophobicContact CE2-CD2 3.57Å; F79-W81 AromaticContact CE2-CE2 3.79Å; F79-W81 HydrophobicContact CE2-CE3 4.08Å; F79-W81 AromaticContact CE2-CG 3.53Å; F79-W81 HydrophobicContact CE2-CG 3.53Å; F79-W81 HydrophobicContact CE2-CZ2 4.45Å; F79-W81 AromaticContact CE2-NE1 3.87Å; F79-W81 HydrophobicContact CZ-CD2 4.01Å; F79-W81 HydrophobicContact CZ-CE3 4.15Å; F79-W81 HydrophobicContact CZ-CG 4.42Å; F79-W81 HydrophobicContact CZ-CH2 4.37Å; F79-W81 HydrophobicContact CZ-CZ2 4.29Å; F79-W81 HydrophobicContact CZ-CZ3 4.35Å; F79-W81 PolarHBondContact O-N 3.05Å; W81-F83 HydrophobicContact CB-CD2 4.03Å; W81-F83 HydrophobicContact CB-CE2 3.78Å; W81-F83 HydrophobicContact CB-CZ 4.35Å; W81-F83 AromaticContact CD2-CE1 3.93Å; W81-F83 HydrophobicContact CD2-CE1 3.93Å; W81-F83 AromaticContact CD2-CE2 3.79Å; W81-F83 HydrophobicContact CD2-CE2 3.79Å; W81-F83 AromaticContact CD2-CZ 3.42Å; W81-F83 HydrophobicContact CD2-CZ 3.42Å; W81-F83 VanDerWaalsContact CD2-CZ 3.42Å; W81-F83 AromaticContact CE3-CE1 3.86Å; W81-F83 HydrophobicContact CE3-CE1 3.86Å; W81-F83 AromaticContact CE3-CE2 3.43Å; W81-F83 HydrophobicContact CE3-CE2 3.43Å; W81-F83 VanDerWaalsContact CE3-CE2 3.43Å; W81-F83 AromaticContact CE3-CZ 2.98Å; W81-F83 HydrophobicContact CE3-CZ 2.98Å; W81-F83 HydrophobicContact CG-CD2 4.38Å; W81-F83 HydrophobicContact CG-CE1 4.45Å; W81-F83 AromaticContact CG-CE2 3.97Å; W81-F83 HydrophobicContact CG-CE2 3.97Å; W81-F83 HydrophobicContact CG-CZ 4.03Å; W81-F83 HydrophobicContact CH2-CZ 4.33Å; W81-F83 HydrophobicContact CZ3-CE1 4.23Å; W81-F83 HydrophobicContact CZ3-CE2 4.32Å; W81-F83 AromaticContact CZ3-CZ 3.5Å; W81-F83 HydrophobicContact CZ3-CZ 3.5Å; W81-T104 PolarHBondContact N-OG1 3.24Å; W81-K107 WeakPolarHBondContact O-CD 3.28Å; W81-K107 PolarHBondContact O-NZ 3.16Å
82	N	79.3	Confident	85.8	Confident	132 Å²	132	45.3 Å²	45.3	71%	0.706	26%	0.256	S	S	*	.			trans	-112	69.6	-179.7	-148.1	26.5	0	0	0	110	K107	N82-K107 VanDerWaalsContact OD1-CE 3.29Å; N82-K107 WeakPolarHBondContact OD1-CE 3.46Å; N82-K107 PolarHBondContact OD1-NZ 2.81Å
83	F	81.7	Confident	85.8	Confident	19 Å²	19	46.6 Å²	46.6	8%	0.083	26%	0.263	C	S	.	.			trans	-67.1	143	174.3	-70.3	-66.3	0	0	0	111.3	L50 W81 T87 T104 L108	L50-F83 HydrophobicContact CD1-CE1 3.85Å; L50-F83 HydrophobicContact CD1-CE2 4.34Å; L50-F83 HydrophobicContact CD1-CZ 3.45Å; L50-F83 VanDerWaalsContact CD1-CZ 3.45Å; L50-F83 HydrophobicContact CD2-CD2 4.28Å; L50-F83 HydrophobicContact CD2-CE1 4.09Å; L50-F83 HydrophobicContact CD2-CE2 3.71Å; L50-F83 HydrophobicContact CD2-CZ 3.58Å; L50-F83 HydrophobicContact CG-CE1 4.4Å; L50-F83 HydrophobicContact CG-CZ 4.09Å; W81-F83 HydrophobicContact CB-CD2 4.03Å; W81-F83 HydrophobicContact CB-CE2 3.78Å; W81-F83 HydrophobicContact CB-CZ 4.35Å; W81-F83 AromaticContact CD2-CE1 3.93Å; W81-F83 HydrophobicContact CD2-CE1 3.93Å; W81-F83 AromaticContact CD2-CE2 3.79Å; W81-F83 HydrophobicContact CD2-CE2 3.79Å; W81-F83 AromaticContact CD2-CZ 3.42Å; W81-F83 HydrophobicContact CD2-CZ 3.42Å; W81-F83 VanDerWaalsContact CD2-CZ 3.42Å; W81-F83 AromaticContact CE3-CE1 3.86Å; W81-F83 HydrophobicContact CE3-CE1 3.86Å; W81-F83 AromaticContact CE3-CE2 3.43Å; W81-F83 HydrophobicContact CE3-CE2 3.43Å; W81-F83 VanDerWaalsContact CE3-CE2 3.43Å; W81-F83 AromaticContact CE3-CZ 2.98Å; W81-F83 HydrophobicContact CE3-CZ 2.98Å; W81-F83 HydrophobicContact CG-CD2 4.38Å; W81-F83 HydrophobicContact CG-CE1 4.45Å; W81-F83 AromaticContact CG-CE2 3.97Å; W81-F83 HydrophobicContact CG-CE2 3.97Å; W81-F83 HydrophobicContact CG-CZ 4.03Å; W81-F83 HydrophobicContact CH2-CZ 4.33Å; W81-F83 HydrophobicContact CZ3-CE1 4.23Å; W81-F83 HydrophobicContact CZ3-CE2 4.32Å; W81-F83 AromaticContact CZ3-CZ 3.5Å; W81-F83 HydrophobicContact CZ3-CZ 3.5Å; F83-T87 HydrophobicContact CD1-CG2 4.26Å; F83-T104 HydrophobicContact CD2-CG2 4.02Å; F83-T104 HydrophobicContact CE2-CG2 3.94Å; F83-L108 HydrophobicContact CB-CD2 3.71Å; F83-L108 HydrophobicContact CD2-CD1 4Å; F83-L108 HydrophobicContact CD2-CD2 3.68Å; F83-L108 HydrophobicContact CD2-CG 3.99Å; F83-L108 HydrophobicContact CE2-CD1 4.16Å; F83-L108 HydrophobicContact CE2-CD2 4.47Å; F83-L108 HydrophobicContact CG-CD2 3.84Å
84	S	81.6	Confident	85.9	Confident	41 Å²	41	44.9 Å²	44.9	29%	0.287	25%	0.247	S	C	.	.			trans	-68.3	148.3	171.4	176.3	0	0	0	0	110.1	D47 L86 T87	D47-S84 VanDerWaalsContact OD2-CB 3.28Å; D47-S84 WeakPolarHBondContact OD2-CB 3.07Å; D47-S84 PolarHBondContact OD2-OG 2.89Å; S84-L86 PolarHBondContact O-N 3.45Å; S84-L86 WeakPolarHBondContact OG-CB 3.48Å; S84-L86 PolarHBondContact OG-N 3.31Å; S84-T87 PolarHBondContact N-OG1 3.26Å; S84-T87 VanDerWaalsContact O-CB 3.29Å; S84-T87 WeakPolarHBondContact O-CB 3.34Å; S84-T87 PolarHBondContact O-N 3.33Å; S84-T87 PolarHBondContact O-OG1 3.29Å
85	S	78.6	Confident	86.2	Confident	83 Å²	83	45.6 Å²	45.6	58%	0.58	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.4	168.9	59.1	0	0	0	0	112.7	T87	S85-T87 VanDerWaalsContact C-N 3.31Å
86	L	87.8	Confident	86.3	Confident	55 Å²	55	47.2 Å²	47.2	29%	0.288	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.2	174.6	-56.3	174.7	0	0	0	112.9	F45 Y46 S84 L88	F45-L86 HydrophobicContact CD1-CD1 4.18Å; Y46-L86 WeakPolarHBondContact CA-O 3.36Å; Y46-L86 WeakPolarHBondContact CB-O 3.36Å; S84-L86 PolarHBondContact O-N 3.45Å; S84-L86 WeakPolarHBondContact OG-CB 3.48Å; S84-L86 PolarHBondContact OG-N 3.31Å; L86-L88 PolarHBondContact O-N 2.88Å
87	T	91.8	Very high	86.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.7	131	179.4	-54.2	0	0	0	0	111.4	T48 L50 F83 S84 S85 L108	T48-T87 WeakPolarHBondContact O-CA 3.45Å; L50-T87 HydrophobicContact CB-CG2 3.68Å; F83-T87 HydrophobicContact CD1-CG2 4.26Å; S84-T87 PolarHBondContact N-OG1 3.26Å; S84-T87 VanDerWaalsContact O-CB 3.29Å; S84-T87 WeakPolarHBondContact O-CB 3.34Å; S84-T87 PolarHBondContact O-N 3.33Å; S84-T87 PolarHBondContact O-OG1 3.29Å; S85-T87 VanDerWaalsContact C-N 3.31Å; T87-L108 HydrophobicContact CG2-CD2 4.44Å
88	L	93.3	Very high	86.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.2	167.6	179.7	66.7	0	0	0	108.6	L37 L40 Y46 T48 L49 L50 L86 R112	L37-L88 HydrophobicContact CD2-CD2 3.63Å; L40-L88 HydrophobicContact CD1-CD1 4.36Å; L40-L88 HydrophobicContact CD1-CD2 4.22Å; Y46-L88 HydrophobicContact CD1-CB 4.13Å; Y46-L88 HydrophobicContact CD1-CD2 3.88Å; Y46-L88 HydrophobicContact CD2-CB 4Å; Y46-L88 HydrophobicContact CD2-CD2 4.35Å; Y46-L88 HydrophobicContact CE1-CD2 3.68Å; Y46-L88 HydrophobicContact CE2-CD2 4.17Å; Y46-L88 HydrophobicContact CG-CB 3.79Å; Y46-L88 HydrophobicContact CG-CD2 4.25Å; T48-L88 PolarHBondContact O-N 3.02Å; L49-L88 CarbonylContact C-O 3.52Å; L49-L88 WeakPolarHBondContact CA-O 3.49Å; L49-L88 HydrophobicContact CD1-CB 4.07Å; L49-L88 HydrophobicContact CD1-CD2 3.86Å; L49-L88 HydrophobicContact CD1-CG 3.97Å; L50-L88 PolarHBondContact N-O 2.92Å; L86-L88 PolarHBondContact O-N 2.88Å; L88-R112 HydrophobicContact CD1-CB 3.67Å
89	I	93.2	Very high	87	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.9	178.4	-55.9	174.8	0	0	0	108.2	L50 Y52 L108 R112 R113 L114	L50-I89 HydrophobicContact CB-CG1 4.45Å; L50-I89 HydrophobicContact CD2-CG1 4.32Å; L50-I89 CarbonylContact O-C 3.6Å; L50-I89 WeakPolarHBondContact O-CA 3.34Å; Y52-I89 HydrophobicContact CD2-CG2 3.63Å; Y52-I89 HydrophobicContact CE2-CG2 3.81Å; I89-L108 HydrophobicContact CD1-CB 4.09Å; I89-L108 HydrophobicContact CD1-CD1 4.29Å; I89-L108 HydrophobicContact CD1-CD2 4.14Å; I89-L108 HydrophobicContact CD1-CG 4.41Å; I89-R112 PolarHBondContact N-O 3.1Å; I89-R113 HydrophobicContact CB-CG 3.87Å; I89-R113 HydrophobicContact CD1-CG 3.96Å; I89-R113 HydrophobicContact CG1-CG 4.42Å; I89-R113 HydrophobicContact CG2-CG 4.19Å; I89-R113 CarbonylContact O-C 3.35Å; I89-R113 WeakPolarHBondContact O-CA 3.23Å; I89-L114 PolarHBondContact O-N 2.77Å
90	L	91.6	Very high	87.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.3	174.5	-177.9	65.9	0	0	0	108.3	L49 L50 V51 Y52 I58 L114 L116	L49-L90 HydrophobicContact CD1-CB 4.13Å; L49-L90 HydrophobicContact CD2-CD2 4.44Å; L50-L90 PolarHBondContact O-N 3.45Å; V51-L90 CarbonylContact C-O 3.55Å; V51-L90 VanDerWaalsContact CA-O 3.26Å; V51-L90 WeakPolarHBondContact CA-O 3.18Å; V51-L90 HydrophobicContact CG2-CB 4.38Å; V51-L90 HydrophobicContact CG2-CD2 4.4Å; Y52-L90 PolarHBondContact N-O 3.09Å; I58-L90 HydrophobicContact CD1-CD2 3.53Å; I58-L90 HydrophobicContact CD1-CG 4.25Å; I58-L90 HydrophobicContact CG2-CD2 4.41Å; L90-L114 WeakPolarHBondContact CA-O 3.21Å; L90-L114 HydrophobicContact CD1-CB 4.01Å; L90-L114 HydrophobicContact CD1-CD2 3.91Å; L90-L114 HydrophobicContact CD1-CG 3.96Å; L90-L116 HydrophobicContact CD1-CD1 4.37Å; L90-L116 HydrophobicContact CD1-CD2 4.4Å; L90-L116 HydrophobicContact CD1-CG 4.21Å
91	S	91.4	Very high	87.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.3	179.8	-166	0	0	0	0	110.4	N93 L114 I115 L116	S91-N93 VanDerWaalsContact C-N 3.27Å; S91-N93 PolarHBondContact O-N 2.88Å; S91-N93 PolarHBondContact OG-O 3.37Å; S91-L114 PolarHBondContact N-O 2.87Å; S91-I115 WeakPolarHBondContact O-CA 3.44Å; S91-L116 PolarHBondContact O-N 3.4Å
92	C	87.3	Confident	87.5	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.014	23%	0.233	C	C	.	.	S	Bend	trans	-78.9	-14.3	-176.7	-70.1	0	0	0	0	114	Y52 C56 L116	Y52-C92 PolarHBondContact O-N 3.33Å; C56-C92 WeakPolarHBondContact CA-SG 3.08Å; C56-C92 HydrophobicContact CB-CB 4.25Å; C56-C92 WeakPolarHBondContact CB-SG 3.46Å; C56-C92 WeakPolarHBondContact SG-CB 3.14Å; C56-C92 CovalentContact SG-SG 2Å; C56-C92 PolarHBondContact SG-SG 3.26Å; C92-L116 CarbonylContact C-O 3.43Å
93	N	87.7	Confident	87.8	Confident	37 Å²	37	45.8 Å²	45.8	20%	0.198	22%	0.218	C	C	.	.	S	Bend	trans	-154.2	145.9	165.8	-172.6	3.1	0	0	0	108.2	S91 Q95 D96	S91-N93 VanDerWaalsContact C-N 3.27Å; S91-N93 PolarHBondContact O-N 2.88Å; S91-N93 PolarHBondContact OG-O 3.37Å; N93-Q95 PolarHBondContact O-N 3.28Å; N93-D96 VanDerWaalsContact CB-OD2 3.3Å; N93-D96 WeakPolarHBondContact CB-OD2 3.14Å; N93-D96 PolarHBondContact N-OD2 2.76Å; N93-D96 VanDerWaalsContact N-OD2 3.08Å; N93-D96 WeakPolarHBondContact O-CB 3.31Å; N93-D96 PolarHBondContact O-N 3.47Å
94	F	87.3	Confident	88.2	Confident	26 Å²	26	44.9 Å²	44.9	11%	0.114	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-17.2	-179	72.2	-83	0	0	0	113.8	I115 I121 V126 F129 Y130	F94-I115 HydrophobicContact CB-CG2 3.94Å; F94-I121 HydrophobicContact CD1-CD1 4.2Å; F94-I121 HydrophobicContact CE1-CD1 3.81Å; F94-I121 HydrophobicContact CE1-CG2 4.28Å; F94-V126 HydrophobicContact CB-CG1 3.97Å; F94-V126 HydrophobicContact CB-CG2 4.48Å; F94-V126 HydrophobicContact CD1-CG2 4.21Å; F94-V126 HydrophobicContact CG-CG2 4.27Å; F94-F129 HydrophobicContact CD2-CB 4.3Å; F94-F129 AromaticContact CD2-CD1 3.92Å; F94-F129 HydrophobicContact CD2-CD1 3.92Å; F94-F129 HydrophobicContact CD2-CD2 4.22Å; F94-F129 HydrophobicContact CD2-CE1 4.23Å; F94-F129 AromaticContact CD2-CG 3.89Å; F94-F129 HydrophobicContact CD2-CG 3.89Å; F94-F129 HydrophobicContact CD2-CZ 4.5Å; F94-F129 HydrophobicContact CE2-CD2 4.29Å; F94-F129 HydrophobicContact CE2-CG 4.31Å; F94-F129 WeakPolarHBondContact O-CE1 3.49Å; F94-Y130 HydrophobicContact CB-CE2 3.98Å
95	Q	89.1	Confident	88.5	Confident	96 Å²	96	44.8 Å²	44.8	45%	0.449	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-6	177.2	-61.9	-176.9	-18	0	0	114.2	N93 R98	N93-Q95 PolarHBondContact O-N 3.28Å; Q95-R98 WeakPolarHBondContact O-CG 3.48Å; Q95-R98 PolarHBondContact O-NE 2.98Å
96	D	87.9	Confident	88.8	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.203	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-24.8	-176.9	-62.9	-14.9	0	0	0	111.6	G75 N93 R98	G75-D96 WeakPolarHBondContact CA-O 3.17Å; N93-D96 VanDerWaalsContact CB-OD2 3.3Å; N93-D96 WeakPolarHBondContact CB-OD2 3.14Å; N93-D96 PolarHBondContact N-OD2 2.76Å; N93-D96 VanDerWaalsContact N-OD2 3.08Å; N93-D96 WeakPolarHBondContact O-CB 3.31Å; N93-D96 PolarHBondContact O-N 3.47Å; D96-R98 PolarHBondContact O-N 3.47Å; D96-R98 VanDerWaalsContact O-N 3.13Å
97	E	89.9	Confident	88.7	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.009	19%	0.192	C	C	.	.			trans	-77.2	95.5	171	-173.2	-179.4	170.6	0	0	110.2	Y52 R113 Y130 K133 Q135	Y52-E97 HydrophobicContact CD2-CB 4.19Å; Y52-E97 HydrophobicContact CD2-CG 4.02Å; Y52-E97 HydrophobicContact CE2-CG 3.96Å; Y52-E97 HydrophobicContact CG-CB 4.36Å; E97-R113 IonicContact OE1-CZ 2.81Å; E97-R113 IonicContact OE1-NE 2.93Å; E97-R113 PolarHBondContact OE1-NE 2.79Å; E97-R113 IonicContact OE1-NH2 2.68Å; E97-R113 PolarHBondContact OE1-NH2 3.46Å; E97-R113 IonicContact OE2-NE 3.92Å; E97-R113 PolarHBondContact OE2-NE 2.87Å; E97-Y130 WeakPolarHBondContact OE2-CE1 3.41Å; E97-Y130 PolarHBondContact OE2-OH 3.46Å; E97-K133 PolarHBondContact O-NZ 3.26Å; E97-Q135 PolarHBondContact OE1-NE2 2.81Å
98	R	89.4	Confident	88.6	Confident	148 Å²	148	43.3 Å²	43.3	56%	0.558	19%	0.192	S	C	*	.			trans	-119.4	36.3	-178.1	-57.9	-176.2	-172.6	173.6	5.4	111.6	G75 S76 Q95 D96 E100	G75-R98 CarbonylContact O-C 3.52Å; G75-R98 WeakPolarHBondContact O-CA 3.35Å; G75-R98 PolarHBondContact O-N 2.87Å; S76-R98 VanDerWaalsContact CB-O 3.24Å; S76-R98 WeakPolarHBondContact CB-O 3.36Å; Q95-R98 WeakPolarHBondContact O-CG 3.48Å; Q95-R98 PolarHBondContact O-NE 2.98Å; D96-R98 PolarHBondContact O-N 3.47Å; D96-R98 VanDerWaalsContact O-N 3.13Å; R98-E100 PolarHBondContact O-N 2.89Å; R98-E100 VanDerWaalsContact O-N 3.11Å
99	E	88.9	Confident	88.3	Confident	14 Å²	14	43.9 Å²	43.9	7%	0.065	19%	0.194	C	C	.	.			trans	-61.9	116	-179	-168	59.8	-111.4	0	0	110.8	Y52 G75 T77 N101 T104	Y52-E99 PolarHBondContact OH-OE2 3.48Å; G75-E99 PolarHBondContact O-N 3.22Å; G75-E99 VanDerWaalsContact O-N 3.11Å; T77-E99 WeakPolarHBondContact CG2-OE2 3.5Å; T77-E99 PolarHBondContact N-OE1 3.15Å; T77-E99 PolarHBondContact N-OE2 2.86Å; T77-E99 PolarHBondContact OG1-OE1 3.39Å; T77-E99 PolarHBondContact OG1-OE2 3.09Å; E99-N101 PolarHBondContact OE1-N 2.78Å; E99-T104 HydrophobicContact CG-CG2 4.01Å
100	E	86.3	Confident	87.9	Confident	171 Å²	171	46.6 Å²	46.6	80%	0.799	21%	0.211	S	C	*	.			trans	-101.6	-19.6	179.4	-70	-179.8	-178.9	0	0	111.8	R98 Y102	R98-E100 PolarHBondContact O-N 2.89Å; R98-E100 VanDerWaalsContact O-N 3.11Å; E100-Y102 PolarHBondContact O-N 3.46Å
101	N	88.4	Confident	87.9	Confident	28 Å²	28	46.6 Å²	46.6	15%	0.15	21%	0.211	C	C	.	.			trans	-69.6	115.8	177.4	-175.9	-41	0	0	0	110.2	F79 D80 E99 R103 T104 L105	F79-N101 PolarHBondContact O-ND2 3.32Å; D80-N101 PolarHBondContact OD1-ND2 3.19Å; D80-N101 PolarHBondContact OD1-OD1 2.95Å; E99-N101 PolarHBondContact OE1-N 2.78Å; N101-R103 VanDerWaalsContact C-N 3.33Å; N101-R103 PolarHBondContact O-N 2.97Å; N101-R103 WeakPolarHBondContact OD1-CB 3.37Å; N101-R103 PolarHBondContact OD1-N 3.06Å; N101-T104 PolarHBondContact O-N 2.8Å; N101-T104 PolarHBondContact OD1-N 3.25Å; N101-L105 WeakPolarHBondContact O-CB 3.33Å; N101-L105 PolarHBondContact O-N 3.33Å
102	Y	85.3	Confident	87.9	Confident	96 Å²	96	47.4 Å²	47.4	38%	0.376	21%	0.214	S	C	.	.	H	α-helix	trans	-60	-38.9	-176.1	91.1	-94.1	0	0	0	113.4	E100 L105 M106 N270 D272	E100-Y102 PolarHBondContact O-N 3.46Å; Y102-L105 PolarHBondContact O-N 3.43Å; Y102-M106 WeakPolarHBondContact O-CB 3.37Å; Y102-M106 PolarHBondContact O-N 3.17Å; Y102-N270 PolarHBondContact OH-ND2 3.24Å; Y102-D272 WeakPolarHBondContact CE2-OD2 3.37Å
103	R	86.4	Confident	88.2	Confident	105 Å²	105	47.3 Å²	47.3	40%	0.396	21%	0.213	S	C	.	.	H	α-helix	trans	-70.6	-42.7	-179.1	-73	178.3	164.6	-172.9	-2.9	111.1	D80 N101 L105 K107	D80-R103 VanDerWaalsContact CG-CD 3.41Å; D80-R103 WeakPolarHBondContact OD2-CD 3.26Å; D80-R103 IonicContact OD2-CZ 3.39Å; D80-R103 IonicContact OD2-NE 3.14Å; D80-R103 IonicContact OD2-NH1 2.81Å; D80-R103 PolarHBondContact OD2-NH1 3.03Å; N101-R103 VanDerWaalsContact C-N 3.33Å; N101-R103 PolarHBondContact O-N 2.97Å; N101-R103 WeakPolarHBondContact OD1-CB 3.37Å; N101-R103 PolarHBondContact OD1-N 3.06Å; R103-L105 VanDerWaalsContact C-N 3.34Å; R103-K107 WeakPolarHBondContact O-CG 3.32Å; R103-K107 PolarHBondContact O-N 3.1Å
104	T	88.6	Confident	88.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-45	175.1	-55.3	0	0	0	0	109.9	T77 W81 F83 E99 N101 M106 K107 L108	T77-T104 PolarHBondContact OG1-OG1 3.27Å; W81-T104 PolarHBondContact N-OG1 3.24Å; F83-T104 HydrophobicContact CD2-CG2 4.02Å; F83-T104 HydrophobicContact CE2-CG2 3.94Å; E99-T104 HydrophobicContact CG-CG2 4.01Å; N101-T104 PolarHBondContact O-N 2.8Å; N101-T104 PolarHBondContact OD1-N 3.25Å; T104-M106 PolarHBondContact O-N 3.02Å; T104-K107 PolarHBondContact O-N 3.39Å; T104-L108 HydrophobicContact CG2-CD1 3.83Å; T104-L108 HydrophobicContact CG2-CG 4.34Å; T104-L108 WeakPolarHBondContact O-CB 3.45Å; T104-L108 WeakPolarHBondContact O-CG 3.21Å; T104-L108 PolarHBondContact O-N 3.28Å
105	L	87.7	Confident	88.8	Confident	38 Å²	38	44.3 Å²	44.3	20%	0.199	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-44.4	179.4	-169.6	149.2	0	0	0	112.3	N101 Y102 R103 K107 L108 Q109	N101-L105 WeakPolarHBondContact O-CB 3.33Å; N101-L105 PolarHBondContact O-N 3.33Å; Y102-L105 PolarHBondContact O-N 3.43Å; R103-L105 VanDerWaalsContact C-N 3.34Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 3.44Å; L105-L108 CarbonylContact O-C 3.59Å; L105-L108 PolarHBondContact O-N 3.04Å; L105-Q109 PolarHBondContact O-N 3.47Å
106	M	85.1	Confident	88.8	Confident	38 Å²	38	40.5 Å²	40.5	19%	0.187	18%	0.181	C	C	.	.	H	α-helix	trans	-59.7	-41.3	177.2	-172.8	169.6	172.7	0	0	112	Y102 T104 Q109 D272 R494	Y102-M106 WeakPolarHBondContact O-CB 3.37Å; Y102-M106 PolarHBondContact O-N 3.17Å; T104-M106 PolarHBondContact O-N 3.02Å; M106-Q109 WeakPolarHBondContact O-CB 3.36Å; M106-Q109 PolarHBondContact O-N 3.26Å; M106-D272 HydrophobicContact CE-CB 4.05Å; M106-D272 HydrophobicContact SD-CB 4Å; M106-R494 VanDerWaalsContact CE-O 3.31Å; M106-R494 WeakPolarHBondContact CE-O 3.38Å
107	K	86.8	Confident	88.8	Confident	70 Å²	70	38.9 Å²	38.9	30%	0.304	17%	0.172	S	C	.	.	H	α-helix	trans	-69.3	-37.8	177.3	-66.7	171.9	-165.4	177.9	0	112.7	W81 N82 R103 T104 L105 Q109	W81-K107 WeakPolarHBondContact O-CD 3.28Å; W81-K107 PolarHBondContact O-NZ 3.16Å; N82-K107 VanDerWaalsContact OD1-CE 3.29Å; N82-K107 WeakPolarHBondContact OD1-CE 3.46Å; N82-K107 PolarHBondContact OD1-NZ 2.81Å; R103-K107 WeakPolarHBondContact O-CG 3.32Å; R103-K107 PolarHBondContact O-N 3.1Å; T104-K107 PolarHBondContact O-N 3.39Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 3.44Å; K107-Q109 VanDerWaalsContact C-N 3.3Å
108	L	88.6	Confident	88.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-82.7	-4.1	179.9	-66.7	-178.9	0	0	0	113.3	L50 F83 T87 I89 T104 L105 T110 S111 R113	L50-L108 HydrophobicContact CD2-CD1 3.66Å; L50-L108 HydrophobicContact CD2-CD2 4.14Å; F83-L108 HydrophobicContact CB-CD2 3.71Å; F83-L108 HydrophobicContact CD2-CD1 4Å; F83-L108 HydrophobicContact CD2-CD2 3.68Å; F83-L108 HydrophobicContact CD2-CG 3.99Å; F83-L108 HydrophobicContact CE2-CD1 4.16Å; F83-L108 HydrophobicContact CE2-CD2 4.47Å; F83-L108 HydrophobicContact CG-CD2 3.84Å; T87-L108 HydrophobicContact CG2-CD2 4.44Å; I89-L108 HydrophobicContact CD1-CB 4.09Å; I89-L108 HydrophobicContact CD1-CD1 4.29Å; I89-L108 HydrophobicContact CD1-CD2 4.14Å; I89-L108 HydrophobicContact CD1-CG 4.41Å; T104-L108 HydrophobicContact CG2-CD1 3.83Å; T104-L108 HydrophobicContact CG2-CG 4.34Å; T104-L108 WeakPolarHBondContact O-CB 3.45Å; T104-L108 WeakPolarHBondContact O-CG 3.21Å; T104-L108 PolarHBondContact O-N 3.28Å; L105-L108 CarbonylContact O-C 3.59Å; L105-L108 PolarHBondContact O-N 3.04Å; L108-T110 VanDerWaalsContact C-N 3.31Å; L108-T110 PolarHBondContact O-N 3.19Å; L108-S111 WeakPolarHBondContact O-CB 3.42Å; L108-S111 PolarHBondContact O-N 3.31Å; L108-R113 PolarHBondContact O-NH1 3.04Å; L108-R113 PolarHBondContact O-NH2 3.15Å
109	Q	87.3	Confident	88	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.056	19%	0.186	C	C	.	.	S	Bend	trans	-58.5	-43.8	-174.9	-171.3	174.6	11	0	0	111.7	L105 M106 K107 R113 E134 H495	L105-Q109 PolarHBondContact O-N 3.47Å; M106-Q109 WeakPolarHBondContact O-CB 3.36Å; M106-Q109 PolarHBondContact O-N 3.26Å; K107-Q109 VanDerWaalsContact C-N 3.3Å; Q109-R113 PolarHBondContact O-NH1 3.48Å; Q109-E134 PolarHBondContact NE2-O 2.99Å; Q109-H495 PolarHBondContact NE2-O 2.84Å
110	T	85.4	Confident	87.6	Confident	56 Å²	56	47.5 Å²	47.5	34%	0.344	23%	0.227	S	C	.	.	S	Bend	trans	-86.3	-10	-179.3	60.9	0	0	0	0	113.6	L108 N137	L108-T110 VanDerWaalsContact C-N 3.31Å; L108-T110 PolarHBondContact O-N 3.19Å; T110-N137 PolarHBondContact O-ND2 3.43Å
111	S	90.2	Very high	87.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	20%	0.198	C	C	.	.	S	Bend	trans	-62.3	145.9	179.9	-61.4	0	0	0	0	112.3	L108 R113	L108-S111 WeakPolarHBondContact O-CB 3.42Å; L108-S111 PolarHBondContact O-N 3.31Å; S111-R113 PolarHBondContact O-NH1 2.91Å
112	R	93.2	Very high	87.6	Confident	16 Å²	16	46.6 Å²	46.6	6%	0.06	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.8	177	-68.4	175.6	-67.8	168.7	-3.5	109.6	L40 K44 F45 L88 I89 Y174	L40-R112 PolarHBondContact O-NH1 2.79Å; K44-R112 PolarHBondContact O-NH1 3.47Å; K44-R112 PolarHBondContact O-NH2 2.7Å; F45-R112 PolarHBondContact O-NH2 3.05Å; L88-R112 HydrophobicContact CD1-CB 3.67Å; I89-R112 PolarHBondContact N-O 3.1Å; R112-Y174 HydrophobicContact CB-CD1 4.23Å; R112-Y174 HydrophobicContact CB-CD2 4.34Å; R112-Y174 HydrophobicContact CB-CE1 3.9Å; R112-Y174 HydrophobicContact CB-CE2 4Å; R112-Y174 HydrophobicContact CB-CG 4.43Å; R112-Y174 HydrophobicContact CG-CD1 4Å; R112-Y174 HydrophobicContact CG-CD2 3.98Å; R112-Y174 HydrophobicContact CG-CE1 4.2Å; R112-Y174 HydrophobicContact CG-CE2 4.16Å; R112-Y174 HydrophobicContact CG-CG 3.88Å
113	R	93.6	Very high	87.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.5	-179.5	-71.5	169.1	176.9	72.7	4.9	110.8	I89 E97 L108 Q109 S111 I115 N137 V138 A139 Y174	I89-R113 HydrophobicContact CB-CG 3.87Å; I89-R113 HydrophobicContact CD1-CG 3.96Å; I89-R113 HydrophobicContact CG1-CG 4.42Å; I89-R113 HydrophobicContact CG2-CG 4.19Å; I89-R113 CarbonylContact O-C 3.35Å; I89-R113 WeakPolarHBondContact O-CA 3.23Å; E97-R113 IonicContact OE1-CZ 2.81Å; E97-R113 IonicContact OE1-NE 2.93Å; E97-R113 PolarHBondContact OE1-NE 2.79Å; E97-R113 IonicContact OE1-NH2 2.68Å; E97-R113 PolarHBondContact OE1-NH2 3.46Å; E97-R113 IonicContact OE2-NE 3.92Å; E97-R113 PolarHBondContact OE2-NE 2.87Å; L108-R113 PolarHBondContact O-NH1 3.04Å; L108-R113 PolarHBondContact O-NH2 3.15Å; Q109-R113 PolarHBondContact O-NH1 3.48Å; S111-R113 PolarHBondContact O-NH1 2.91Å; R113-I115 HydrophobicContact CB-CD1 4.22Å; R113-N137 PolarHBondContact N-O 2.84Å; R113-V138 HydrophobicContact CB-CG2 4.22Å; R113-A139 PolarHBondContact O-N 2.05Å; R113-A139 VanDerWaalsContact O-O 3.12Å; R113-Y174 PolarHBondContact O-OH 2.92Å
114	L	93.5	Very high	88.1	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118	169.3	-175.6	61.2	0	0	0	109.2	L33 L36 L37 L40 I89 L90 S91 A139 V141	L33-L114 HydrophobicContact CD1-CD2 3.94Å; L36-L114 HydrophobicContact CD2-CD1 4.04Å; L36-L114 HydrophobicContact CD2-CD2 3.98Å; L37-L114 HydrophobicContact CD2-CD2 3.89Å; L40-L114 HydrophobicContact CD1-CD2 4.39Å; I89-L114 PolarHBondContact O-N 2.77Å; L90-L114 WeakPolarHBondContact CA-O 3.21Å; L90-L114 HydrophobicContact CD1-CB 4.01Å; L90-L114 HydrophobicContact CD1-CD2 3.91Å; L90-L114 HydrophobicContact CD1-CG 3.96Å; S91-L114 PolarHBondContact N-O 2.87Å; L114-A139 CarbonylContact C-O 3.51Å; L114-A139 WeakPolarHBondContact CA-O 3.37Å; L114-A139 HydrophobicContact CD1-CB 4.25Å; L114-V141 HydrophobicContact CD1-CG2 3.81Å
115	I	93	Very high	88.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.2	-176.5	-46.6	-58.4	0	0	0	109.9	S91 F94 R113 L117 Y130 V138 A139 M140 V141	S91-I115 WeakPolarHBondContact O-CA 3.44Å; F94-I115 HydrophobicContact CB-CG2 3.94Å; R113-I115 HydrophobicContact CB-CD1 4.22Å; I115-L117 HydrophobicContact CG2-CD2 3.93Å; I115-Y130 HydrophobicContact CD1-CE2 3.74Å; I115-Y130 WeakPolarHBondContact CD1-OH 3.34Å; I115-Y130 HydrophobicContact CG1-CE2 3.84Å; I115-V138 HydrophobicContact CG1-CG1 3.86Å; I115-A139 PolarHBondContact N-O 2.97Å; I115-M140 HydrophobicContact CB-CB 3.91Å; I115-M140 CarbonylContact O-C 3.06Å; I115-M140 WeakPolarHBondContact O-CA 3.47Å; I115-M140 WeakPolarHBondContact O-CB 3.35Å; I115-V141 PolarHBondContact O-N 2.91Å
116	L	89.5	Confident	88.5	Confident	16 Å²	16	42.3 Å²	42.3	8%	0.084	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.4	171.6	-53.2	-179.6	0	0	0	108.3	F29 L33 I58 L90 S91 C92 V141	F29-L116 HydrophobicContact CZ-CD2 4.24Å; L33-L116 HydrophobicContact CD1-CD2 4.07Å; L33-L116 HydrophobicContact CD2-CD1 4.19Å; L33-L116 HydrophobicContact CD2-CD2 4.13Å; I58-L116 HydrophobicContact CD1-CD1 3.59Å; L90-L116 HydrophobicContact CD1-CD1 4.37Å; L90-L116 HydrophobicContact CD1-CD2 4.4Å; L90-L116 HydrophobicContact CD1-CG 4.21Å; S91-L116 PolarHBondContact O-N 3.4Å; C92-L116 CarbonylContact C-O 3.43Å; L116-V141 HydrophobicContact CD2-CB 4.32Å
117	L	87.3	Confident	88.9	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.6	-179.3	-61	179.7	0	0	0	109.9	I115 I121 V126 M140 V141 K142 E143	I115-L117 HydrophobicContact CG2-CD2 3.93Å; L117-I121 HydrophobicContact CD2-CD1 4.46Å; L117-I121 HydrophobicContact CD2-CG2 4.44Å; L117-V126 HydrophobicContact CD1-CG2 4.48Å; L117-V126 HydrophobicContact CD2-CG2 3.69Å; L117-M140 HydrophobicContact CD1-CB 4.11Å; L117-M140 HydrophobicContact CD1-CG 3.84Å; L117-M140 HydrophobicContact CD1-SD 3.78Å; L117-M140 HydrophobicContact CG-CB 4.15Å; L117-M140 HydrophobicContact CG-CG 4.43Å; L117-V141 PolarHBondContact N-O 2.84Å; L117-K142 HydrophobicContact CB-CG 4.4Å; L117-K142 HydrophobicContact CD1-CG 4.24Å; L117-E143 PolarHBondContact O-N 3.17Å
118	K	82.7	Confident	89.1	Confident	105 Å²	105	41.2 Å²	41.2	46%	0.457	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-91.4	130.6	171.8	-62.5	-177.9	-177	177.4	0	110.6	D55 I121 E143	D55-K118 PolarHBondContact O-NZ 3.22Å; K118-I121 VanDerWaalsContact O-CD1 3.24Å; K118-I121 WeakPolarHBondContact O-CD1 3.45Å; K118-E143 WeakPolarHBondContact CA-OE1 3.33Å; K118-E143 WeakPolarHBondContact CB-OE1 3.36Å
119	G	79.8	Confident	89.3	Confident	38 Å²	38	43.9 Å²	43.9	39%	0.392	23%	0.225	S	C	.	.	S	Bend	trans	71.4	-161.4	-178.9	0	0	0	0	0	116.9	I121 E143	G119-I121 VanDerWaalsContact C-N 3.32Å; G119-I121 PolarHBondContact O-N 3.39Å; G119-I121 VanDerWaalsContact O-N 3.08Å; G119-E143 PolarHBondContact N-OE1 2.89Å
120	H	79.9	Confident	89.5	Confident	203 Å²	203	43.3 Å²	43.3	94%	0.94	22%	0.223	S	C	*	.	S	Bend	trans	-86.6	55.4	-172.6	-69.8	-65	0	0	0	114
121	I	86.4	Confident	89.8	Confident	37 Å²	37	43 Å²	43	19%	0.19	22%	0.222	C	C	.	.			trans	-83.8	137.1	175.7	-59.9	161.1	0	0	0	110.3	F94 L117 K118 G119 V126	F94-I121 HydrophobicContact CD1-CD1 4.2Å; F94-I121 HydrophobicContact CE1-CD1 3.81Å; F94-I121 HydrophobicContact CE1-CG2 4.28Å; L117-I121 HydrophobicContact CD2-CD1 4.46Å; L117-I121 HydrophobicContact CD2-CG2 4.44Å; K118-I121 VanDerWaalsContact O-CD1 3.24Å; K118-I121 WeakPolarHBondContact O-CD1 3.45Å; G119-I121 VanDerWaalsContact C-N 3.32Å; G119-I121 PolarHBondContact O-N 3.39Å; G119-I121 VanDerWaalsContact O-N 3.08Å; I121-V126 HydrophobicContact CG2-CG2 3.75Å
122	K	89.7	Confident	89.8	Confident	143 Å²	143	51.7 Å²	51.7	62%	0.622	26%	0.26	S	S	*	.			trans	-80.3	128.3	174.2	-68.6	-175.1	-179.9	-177.7	0	110	E124 S125	K122-E124 PolarHBondContact O-N 3.25Å; K122-E124 VanDerWaalsContact O-N 3.16Å; K122-S125 PolarHBondContact O-N 3.3Å; K122-S125 VanDerWaalsContact O-N 3.1Å; K122-S125 PolarHBondContact O-OG 2.79Å
123	P	90.1	Very high	89.6	Confident	10 Å²	10	54.3 Å²	54.3	7%	0.065	27%	0.272	C	S	.	.	H	α-helix	trans	-53.2	-36.1	178.1	-29.2	36.4	0	0	0	114.2	S125 V126 C127 M140 Y152 Y162	P123-S125 VanDerWaalsContact C-N 3.31Å; P123-S125 PolarHBondContact O-N 2.81Å; P123-V126 WeakPolarHBondContact O-CB 3.5Å; P123-V126 PolarHBondContact O-N 2.8Å; P123-V126 VanDerWaalsContact O-N 3.08Å; P123-C127 PolarHBondContact O-N 3.05Å; P123-M140 VanDerWaalsContact CA-SD 3.59Å; P123-M140 HydrophobicContact CB-CE 4.36Å; P123-M140 HydrophobicContact CB-SD 3.65Å; P123-M140 HydrophobicContact CG-SD 4.4Å; P123-Y152 HydrophobicContact CB-CD1 4.16Å; P123-Y152 HydrophobicContact CB-CG 4.37Å; P123-Y152 HydrophobicContact CG-CD1 3.63Å; P123-Y152 HydrophobicContact CG-CE1 3.96Å; P123-Y152 HydrophobicContact CG-CG 3.98Å; P123-Y162 HydrophobicContact CB-CD1 4.24Å; P123-Y162 HydrophobicContact CB-CD2 4.23Å; P123-Y162 HydrophobicContact CB-CE1 4.5Å; P123-Y162 HydrophobicContact CB-CE2 4.48Å; P123-Y162 HydrophobicContact CB-CG 4.11Å
124	E	91.2	Very high	89.3	Confident	83 Å²	83	56.5 Å²	56.5	39%	0.388	28%	0.282	S	S	.	.	H	α-helix	trans	-54	-46.2	177.9	-62.9	164.9	176.7	0	0	111.9	K122 V126 C127 D128 N161 Y162	K122-E124 PolarHBondContact O-N 3.25Å; K122-E124 VanDerWaalsContact O-N 3.16Å; E124-V126 PolarHBondContact O-N 2.92Å; E124-C127 PolarHBondContact O-N 3.44Å; E124-D128 VanDerWaalsContact O-CG 3.25Å; E124-D128 PolarHBondContact O-N 2.96Å; E124-N161 PolarHBondContact O-ND2 2.87Å; E124-Y162 HydrophobicContact CG-CD1 3.69Å; E124-Y162 HydrophobicContact CG-CE1 3.39Å
125	S	91.9	Very high	89.1	Confident	56 Å²	56	56.7 Å²	56.7	39%	0.392	28%	0.283	S	S	.	.	H	α-helix	trans	-64.6	-29.6	-179.2	64.9	0	0	0	0	113.3	K122 P123 F129	K122-S125 PolarHBondContact O-N 3.3Å; K122-S125 VanDerWaalsContact O-N 3.1Å; K122-S125 PolarHBondContact O-OG 2.79Å; P123-S125 VanDerWaalsContact C-N 3.31Å; P123-S125 PolarHBondContact O-N 2.81Å; S125-F129 WeakPolarHBondContact O-CB 2.93Å; S125-F129 PolarHBondContact O-N 2.92Å
126	V	92.4	Very high	89	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-76.4	-44.2	177.7	-179.2	0	0	0	0	109.6	F94 L117 I121 P123 E124 D128 F129 Y130 M140	F94-V126 HydrophobicContact CB-CG1 3.97Å; F94-V126 HydrophobicContact CB-CG2 4.48Å; F94-V126 HydrophobicContact CD1-CG2 4.21Å; F94-V126 HydrophobicContact CG-CG2 4.27Å; L117-V126 HydrophobicContact CD1-CG2 4.48Å; L117-V126 HydrophobicContact CD2-CG2 3.69Å; I121-V126 HydrophobicContact CG2-CG2 3.75Å; P123-V126 WeakPolarHBondContact O-CB 3.5Å; P123-V126 PolarHBondContact O-N 2.8Å; P123-V126 VanDerWaalsContact O-N 3.08Å; E124-V126 PolarHBondContact O-N 2.92Å; V126-D128 VanDerWaalsContact C-N 3.32Å; V126-D128 PolarHBondContact O-N 3.4Å; V126-F129 WeakPolarHBondContact O-CB 3.35Å; V126-F129 PolarHBondContact O-N 3.08Å; V126-Y130 HydrophobicContact CG1-CD2 3.86Å; V126-Y130 HydrophobicContact CG1-CE2 4.02Å; V126-Y130 WeakPolarHBondContact O-CD2 3.45Å; V126-Y130 PolarHBondContact O-N 3.23Å; V126-M140 HydrophobicContact CB-CE 4.12Å; V126-M140 HydrophobicContact CB-SD 3.86Å; V126-M140 HydrophobicContact CG1-CE 4.07Å; V126-M140 HydrophobicContact CG1-SD 4.02Å; V126-M140 HydrophobicContact CG2-SD 4.22Å
127	C	93.6	Very high	89.1	Confident	7 Å²	7	58.9 Å²	58.9	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-41.3	174.1	-64	0	0	0	0	111.8	P123 E124 Y130 S131 M140 C154 N161	P123-C127 PolarHBondContact O-N 3.05Å; E124-C127 PolarHBondContact O-N 3.44Å; C127-Y130 PolarHBondContact O-N 3.25Å; C127-S131 WeakPolarHBondContact O-CB 3.32Å; C127-S131 PolarHBondContact O-N 2.95Å; C127-M140 WeakPolarHBondContact SG-CE 3.45Å; C127-C154 WeakPolarHBondContact CA-SG 3.06Å; C127-C154 HydrophobicContact CB-CB 3.9Å; C127-C154 WeakPolarHBondContact CB-SG 3.46Å; C127-C154 WeakPolarHBondContact SG-CA 3.32Å; C127-C154 WeakPolarHBondContact SG-CB 3.27Å; C127-C154 CovalentContact SG-SG 2.05Å; C127-C154 PolarHBondContact SG-SG 3.23Å; C127-N161 HydrophobicContact CB-CB 4.39Å; C127-N161 PolarHBondContact SG-O 3.22Å
128	D	92.4	Very high	89.4	Confident	77 Å²	77	58.9 Å²	58.9	41%	0.412	29%	0.294	S	S	.	.	H	α-helix	trans	-65.9	-38.8	176.8	-67.7	-21.4	0	0	0	112.1	E124 V126 K132 N161	E124-D128 VanDerWaalsContact O-CG 3.25Å; E124-D128 PolarHBondContact O-N 2.96Å; V126-D128 VanDerWaalsContact C-N 3.32Å; V126-D128 PolarHBondContact O-N 3.4Å; D128-K132 VanDerWaalsContact O-CG 3.3Å; D128-K132 WeakPolarHBondContact O-CG 3.49Å; D128-K132 PolarHBondContact O-N 2.72Å; D128-K132 VanDerWaalsContact O-N 3.09Å; D128-N161 PolarHBondContact OD1-ND2 3.16Å
129	F	92.9	Very high	90	Very high	57 Å²	57	53.9 Å²	53.9	25%	0.25	27%	0.272	C	S	.	.	H	α-helix	trans	-60.2	-49.5	175.8	175.9	-95.2	0	0	0	111.5	F94 S125 V126 K132 K133	F94-F129 HydrophobicContact CD2-CB 4.3Å; F94-F129 AromaticContact CD2-CD1 3.92Å; F94-F129 HydrophobicContact CD2-CD1 3.92Å; F94-F129 HydrophobicContact CD2-CD2 4.22Å; F94-F129 HydrophobicContact CD2-CE1 4.23Å; F94-F129 AromaticContact CD2-CG 3.89Å; F94-F129 HydrophobicContact CD2-CG 3.89Å; F94-F129 HydrophobicContact CD2-CZ 4.5Å; F94-F129 HydrophobicContact CE2-CD2 4.29Å; F94-F129 HydrophobicContact CE2-CG 4.31Å; F94-F129 WeakPolarHBondContact O-CE1 3.49Å; S125-F129 WeakPolarHBondContact O-CB 2.93Å; S125-F129 PolarHBondContact O-N 2.92Å; V126-F129 WeakPolarHBondContact O-CB 3.35Å; V126-F129 PolarHBondContact O-N 3.08Å; F129-K132 PolarHBondContact O-N 3.45Å; F129-K133 HydrophobicContact CE1-CD 4.03Å; F129-K133 HydrophobicContact CZ-CD 4.3Å; F129-K133 VanDerWaalsContact CZ-CE 3.41Å; F129-K133 PolarHBondContact O-N 3.17Å
130	Y	91.9	Very high	90.6	Very high	1 Å²	1	52 Å²	52	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-73.3	-33	-179.8	-83.1	-69.3	0	0	0	113.5	F94 E97 I115 V126 C127 K132 K133 E134 Q135 V138	F94-Y130 HydrophobicContact CB-CE2 3.98Å; E97-Y130 WeakPolarHBondContact OE2-CE1 3.41Å; E97-Y130 PolarHBondContact OE2-OH 3.46Å; I115-Y130 HydrophobicContact CD1-CE2 3.74Å; I115-Y130 WeakPolarHBondContact CD1-OH 3.34Å; I115-Y130 HydrophobicContact CG1-CE2 3.84Å; V126-Y130 HydrophobicContact CG1-CD2 3.86Å; V126-Y130 HydrophobicContact CG1-CE2 4.02Å; V126-Y130 WeakPolarHBondContact O-CD2 3.45Å; V126-Y130 PolarHBondContact O-N 3.23Å; C127-Y130 PolarHBondContact O-N 3.25Å; Y130-K132 VanDerWaalsContact C-N 3.31Å; Y130-K132 PolarHBondContact O-N 3.33Å; Y130-K133 CarbonylContact O-C 3.57Å; Y130-K133 WeakPolarHBondContact O-CA 3.21Å; Y130-K133 PolarHBondContact O-N 2.88Å; Y130-K133 VanDerWaalsContact O-N 3.09Å; Y130-E134 PolarHBondContact O-N 3.41Å; Y130-E134 VanDerWaalsContact O-N 3.16Å; Y130-Q135 HydrophobicContact CD1-CB 3.97Å; Y130-Q135 VanDerWaalsContact CE1-OE1 3.31Å; Y130-Q135 PolarHBondContact O-N 2.94Å; Y130-V138 HydrophobicContact CD1-CG2 4.09Å; Y130-V138 HydrophobicContact CD2-CG1 3.94Å; Y130-V138 HydrophobicContact CD2-CG2 4.1Å; Y130-V138 HydrophobicContact CE2-CG1 4.31Å; Y130-V138 HydrophobicContact CG-CG1 4.41Å; Y130-V138 HydrophobicContact CG-CG2 3.72Å
131	S	90.6	Very high	91.2	Very high	49 Å²	49	42.4 Å²	42.4	34%	0.343	21%	0.209	S	C	.	.	H	α-helix	trans	-64.1	-36.3	174	-170.2	0	0	0	0	111.7	C127 K133 E134	C127-S131 WeakPolarHBondContact O-CB 3.32Å; C127-S131 PolarHBondContact O-N 2.95Å; S131-K133 PolarHBondContact O-N 2.98Å; S131-E134 PolarHBondContact O-N 2.98Å
132	K	89.9	Confident	91.3	Very high	183 Å²	183	42.9 Å²	42.9	80%	0.796	21%	0.21	S	C	*	.	H	α-helix	trans	-66.5	-25.5	174.3	-74.5	173.1	-177.2	178.7	0	112.8	D128 F129 Y130 E134	D128-K132 VanDerWaalsContact O-CG 3.3Å; D128-K132 WeakPolarHBondContact O-CG 3.49Å; D128-K132 PolarHBondContact O-N 2.72Å; D128-K132 VanDerWaalsContact O-N 3.09Å; F129-K132 PolarHBondContact O-N 3.45Å; Y130-K132 VanDerWaalsContact C-N 3.31Å; Y130-K132 PolarHBondContact O-N 3.33Å; K132-E134 VanDerWaalsContact C-N 3.33Å
133	K	88.5	Confident	90.9	Very high	72 Å²	72	41 Å²	41	31%	0.313	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	3.3	173	-66.6	-174.6	172.3	-171.5	0	113.2	E97 F129 Y130 S131 Q135	E97-K133 PolarHBondContact O-NZ 3.26Å; F129-K133 HydrophobicContact CE1-CD 4.03Å; F129-K133 HydrophobicContact CZ-CD 4.3Å; F129-K133 VanDerWaalsContact CZ-CE 3.41Å; F129-K133 PolarHBondContact O-N 3.17Å; Y130-K133 CarbonylContact O-C 3.57Å; Y130-K133 WeakPolarHBondContact O-CA 3.21Å; Y130-K133 PolarHBondContact O-N 2.88Å; Y130-K133 VanDerWaalsContact O-N 3.09Å; S131-K133 PolarHBondContact O-N 2.98Å; K133-Q135 HydrophobicContact CB-CG 4.22Å; K133-Q135 PolarHBondContact O-N 2.77Å
134	E	88.3	Confident	90.4	Very high	45 Å²	45	43.3 Å²	43.3	21%	0.21	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	33.8	-177.3	-59.2	-179	170.9	0	0	113.5	Q109 Y130 S131 K132 H136 R493 P497	Q109-E134 PolarHBondContact NE2-O 2.99Å; Y130-E134 PolarHBondContact O-N 3.41Å; Y130-E134 VanDerWaalsContact O-N 3.16Å; S131-E134 PolarHBondContact O-N 2.98Å; K132-E134 VanDerWaalsContact C-N 3.33Å; E134-H136 WeakPolarHBondContact CA-NE2 3.38Å; E134-H136 PolarHBondContact O-CD2 2.68Å; E134-R493 VanDerWaalsContact CD-NH2 3.3Å; E134-R493 IonicContact OE1-CZ 2.88Å; E134-R493 IonicContact OE1-NH1 3.85Å; E134-R493 PolarHBondContact OE1-NH1 3.2Å; E134-R493 IonicContact OE1-NH2 3.84Å; E134-R493 PolarHBondContact OE1-NH2 3.4Å; E134-R493 IonicContact OE2-CZ 3.02Å; E134-R493 IonicContact OE2-NH1 2.84Å; E134-R493 PolarHBondContact OE2-NH1 2.94Å; E134-R493 IonicContact OE2-NH2 2.78Å; E134-R493 PolarHBondContact OE2-NH2 3.25Å; E134-R493 VanDerWaalsContact OE2-NH2 3.1Å; E134-P497 HydrophobicContact CB-CG 4.24Å
135	Q	90.1	Very high	90	Very high	5 Å²	5	39.4 Å²	39.4	2%	0.023	20%	0.196	C	C	.	.			trans	-112.2	98.7	179	-71	170.6	-18.1	0	0	108.7	E97 Y130 K133 V138	E97-Q135 PolarHBondContact OE1-NE2 2.81Å; Y130-Q135 HydrophobicContact CD1-CB 3.97Å; Y130-Q135 VanDerWaalsContact CE1-OE1 3.31Å; Y130-Q135 PolarHBondContact O-N 2.94Å; K133-Q135 HydrophobicContact CB-CG 4.22Å; K133-Q135 PolarHBondContact O-N 2.77Å; Q135-V138 WeakPolarHBondContact O-CG2 3.4Å
136	H	89.8	Confident	89.4	Confident	24 Å²	24	40.1 Å²	40.1	11%	0.111	19%	0.191	C	C	.	.			trans	-99.8	-19.5	-165.4	-55.4	-72.3	0	0	0	114.3	E134 V138 Q177 F178	E134-H136 WeakPolarHBondContact CA-NE2 3.38Å; E134-H136 PolarHBondContact O-CD2 2.68Å; H136-V138 VanDerWaalsContact C-N 3.29Å; H136-V138 PolarHBondContact O-N 3.01Å; H136-Q177 PolarHBondContact O-NE2 3.47Å; H136-F178 HydrophobicContact CB-CE2 4.15Å; H136-F178 AromaticContact CD2-CE2 3.52Å; H136-F178 AromaticContact CD2-CZ 3.42Å; H136-F178 VanDerWaalsContact CD2-CZ 3.42Å; H136-F178 WeakPolarHBondContact CD2-CZ 3.5Å; H136-F178 AromaticContact CG-CE2 3.91Å; H136-F178 AromaticContact CG-CZ 3.92Å; H136-F178 AromaticContact NE2-CZ 3.68Å
137	N	91.9	Very high	88.8	Confident	39 Å²	39	46.3 Å²	46.3	21%	0.209	22%	0.22	C	C	.	.			trans	-84	68.6	-178.4	-70.4	-27.8	0	0	0	111.7	T110 R113 Y174	T110-N137 PolarHBondContact O-ND2 3.43Å; R113-N137 PolarHBondContact N-O 2.84Å; N137-Y174 HydrophobicContact CB-CD1 4.24Å; N137-Y174 WeakPolarHBondContact O-CE1 3.39Å
138	V	94.2	Very high	88.1	Confident	2 Å²	2	50 Å²	50	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131	-174	-174.6	0	0	0	0	111.8	R113 I115 Y130 Q135 H136 C154	R113-V138 HydrophobicContact CB-CG2 4.22Å; I115-V138 HydrophobicContact CG1-CG1 3.86Å; Y130-V138 HydrophobicContact CD1-CG2 4.09Å; Y130-V138 HydrophobicContact CD2-CG1 3.94Å; Y130-V138 HydrophobicContact CD2-CG2 4.1Å; Y130-V138 HydrophobicContact CE2-CG1 4.31Å; Y130-V138 HydrophobicContact CG-CG1 4.41Å; Y130-V138 HydrophobicContact CG-CG2 3.72Å; Q135-V138 WeakPolarHBondContact O-CG2 3.4Å; H136-V138 VanDerWaalsContact C-N 3.29Å; H136-V138 PolarHBondContact O-N 3.01Å; V138-C154 HydrophobicContact CB-CB 4.27Å; V138-C154 PolarHBondContact O-N 3.15Å
139	A	94.3	Very high	87.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.5	167	0	0	0	0	0	109.2	R113 L114 I115 V151 Y152 I173 Y174	R113-A139 PolarHBondContact O-N 2.05Å; R113-A139 VanDerWaalsContact O-O 3.12Å; L114-A139 CarbonylContact C-O 3.51Å; L114-A139 WeakPolarHBondContact CA-O 3.37Å; L114-A139 HydrophobicContact CD1-CB 4.25Å; I115-A139 PolarHBondContact N-O 2.97Å; A139-V151 HydrophobicContact CB-CG1 4.07Å; A139-Y152 CarbonylContact C-O 3.51Å; A139-Y152 WeakPolarHBondContact CA-O 3.17Å; A139-I173 HydrophobicContact CB-CG2 3.57Å; A139-Y174 HydrophobicContact CB-CE1 3.82Å; A139-Y174 HydrophobicContact CB-CE2 4.45Å
140	M	93.3	Very high	87.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	150.8	-176.9	70	-161.7	86.3	0	0	111.8	I115 L117 P123 V126 C127 Y152 C154	I115-M140 HydrophobicContact CB-CB 3.91Å; I115-M140 CarbonylContact O-C 3.06Å; I115-M140 WeakPolarHBondContact O-CA 3.47Å; I115-M140 WeakPolarHBondContact O-CB 3.35Å; L117-M140 HydrophobicContact CD1-CB 4.11Å; L117-M140 HydrophobicContact CD1-CG 3.84Å; L117-M140 HydrophobicContact CD1-SD 3.78Å; L117-M140 HydrophobicContact CG-CB 4.15Å; L117-M140 HydrophobicContact CG-CG 4.43Å; P123-M140 VanDerWaalsContact CA-SD 3.59Å; P123-M140 HydrophobicContact CB-CE 4.36Å; P123-M140 HydrophobicContact CB-SD 3.65Å; P123-M140 HydrophobicContact CG-SD 4.4Å; V126-M140 HydrophobicContact CB-CE 4.12Å; V126-M140 HydrophobicContact CB-SD 3.86Å; V126-M140 HydrophobicContact CG1-CE 4.07Å; V126-M140 HydrophobicContact CG1-SD 4.02Å; V126-M140 HydrophobicContact CG2-SD 4.22Å; C127-M140 WeakPolarHBondContact SG-CE 3.45Å; M140-Y152 HydrophobicContact CG-CG 4.45Å; M140-Y152 PolarHBondContact N-O 3.17Å; M140-Y152 PolarHBondContact O-N 3.47Å; M140-C154 WeakPolarHBondContact CE-SG 3.35Å
141	V	91.4	Very high	87.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.6	-172.6	177.2	0	0	0	0	108.1	F29 L36 L114 I115 L116 L117 F145 V151	F29-V141 HydrophobicContact CE2-CG1 4.43Å; L36-V141 HydrophobicContact CD2-CG2 3.67Å; L114-V141 HydrophobicContact CD1-CG2 3.81Å; I115-V141 PolarHBondContact O-N 2.91Å; L116-V141 HydrophobicContact CD2-CB 4.32Å; L117-V141 PolarHBondContact N-O 2.84Å; V141-F145 HydrophobicContact CG1-CB 3.24Å; V141-F145 HydrophobicContact CG1-CD1 3.65Å; V141-F145 HydrophobicContact CG1-CD2 3.48Å; V141-F145 VanDerWaalsContact CG1-CD2 3.48Å; V141-F145 HydrophobicContact CG1-CE1 4.31Å; V141-F145 HydrophobicContact CG1-CE2 4.17Å; V141-F145 HydrophobicContact CG1-CG 3.17Å; V141-V151 HydrophobicContact CG2-CG1 4.37Å; V141-V151 HydrophobicContact CG2-CG2 4.29Å
142	K	88.2	Confident	87.7	Confident	48 Å²	48	45.3 Å²	45.3	21%	0.209	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	161.5	180	-67.4	-172.8	175.3	-170	0	111.3	L117 N144 F145 Y152	L117-K142 HydrophobicContact CB-CG 4.4Å; L117-K142 HydrophobicContact CD1-CG 4.24Å; K142-N144 VanDerWaalsContact CB-OD1 3.23Å; K142-N144 WeakPolarHBondContact CB-OD1 3.02Å; K142-N144 PolarHBondContact O-N 3.36Å; K142-N144 VanDerWaalsContact O-N 3.12Å; K142-F145 WeakPolarHBondContact O-CB 3.45Å; K142-F145 PolarHBondContact O-N 3Å; K142-Y152 HydrophobicContact CD-CE2 4Å; K142-Y152 HydrophobicContact CG-CE2 4.05Å
143	E	81.3	Confident	87.9	Confident	104 Å²	104	36.6 Å²	36.6	49%	0.486	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-37	174.1	-73.9	169.9	-177	0	0	113.3	L117 K118 G119 F145 Y146	L117-E143 PolarHBondContact O-N 3.17Å; K118-E143 WeakPolarHBondContact CA-OE1 3.33Å; K118-E143 WeakPolarHBondContact CB-OE1 3.36Å; G119-E143 PolarHBondContact N-OE1 2.89Å; E143-F145 PolarHBondContact O-N 2.91Å; E143-Y146 VanDerWaalsContact O-CD1 3.26Å; E143-Y146 WeakPolarHBondContact O-CD1 3.29Å; E143-Y146 VanDerWaalsContact O-CE1 3.32Å; E143-Y146 WeakPolarHBondContact O-CE1 3.39Å
144	N	79.9	Confident	88.2	Confident	57 Å²	57	33.7 Å²	33.7	31%	0.305	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	19.3	178.8	66.2	-12.9	0	0	0	114.7	K142 Y146 Q147 L148	K142-N144 VanDerWaalsContact CB-OD1 3.23Å; K142-N144 WeakPolarHBondContact CB-OD1 3.02Å; K142-N144 PolarHBondContact O-N 3.36Å; K142-N144 VanDerWaalsContact O-N 3.12Å; N144-Y146 PolarHBondContact O-N 3.23Å; N144-Q147 PolarHBondContact O-N 3.48Å; N144-L148 WeakPolarHBondContact ND2-CD1 3.29Å; N144-L148 PolarHBondContact O-N 3.47Å
145	F	82.4	Confident	88.4	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-32.9	178.8	-179.9	-119.8	0	0	0	113.7	F29 R32 L36 V141 K142 E143 Q147 E149 V150 V151 L167	F29-F145 HydrophobicContact CD2-CB 4.19Å; F29-F145 HydrophobicContact CE2-CB 3.89Å; R32-F145 HydrophobicContact CB-CD1 3.96Å; R32-F145 HydrophobicContact CB-CE1 3.84Å; L36-F145 HydrophobicContact CB-CE1 4.35Å; L36-F145 HydrophobicContact CB-CZ 4.22Å; L36-F145 HydrophobicContact CD2-CE1 4.39Å; L36-F145 HydrophobicContact CD2-CZ 4.06Å; V141-F145 HydrophobicContact CG1-CB 3.24Å; V141-F145 HydrophobicContact CG1-CD1 3.65Å; V141-F145 HydrophobicContact CG1-CD2 3.48Å; V141-F145 VanDerWaalsContact CG1-CD2 3.48Å; V141-F145 HydrophobicContact CG1-CE1 4.31Å; V141-F145 HydrophobicContact CG1-CE2 4.17Å; V141-F145 HydrophobicContact CG1-CG 3.17Å; K142-F145 WeakPolarHBondContact O-CB 3.45Å; K142-F145 PolarHBondContact O-N 3Å; E143-F145 PolarHBondContact O-N 2.91Å; F145-Q147 PolarHBondContact O-N 3.23Å; F145-E149 VanDerWaalsContact O-CA 3.31Å; F145-E149 WeakPolarHBondContact O-CA 3.4Å; F145-E149 PolarHBondContact O-N 3.1Å; F145-V150 WeakPolarHBondContact CD2-O 3.31Å; F145-V151 HydrophobicContact CE2-CG2 3.83Å; F145-V151 HydrophobicContact CZ-CG2 4.28Å; F145-L167 HydrophobicContact CZ-CD1 4.33Å; F145-L167 HydrophobicContact CZ-CD2 4.25Å
146	Y	79.5	Confident	88.3	Confident	71 Å²	71	33.7 Å²	33.7	28%	0.278	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-22.7	176.2	66.5	-80.7	0	0	0	113.2	D28 F29 E143 N144	D28-Y146 HydrophobicContact CB-CD2 4.43Å; F29-Y146 HydrophobicContact CB-CD1 4.38Å; F29-Y146 HydrophobicContact CD2-CD1 4.41Å; E143-Y146 VanDerWaalsContact O-CD1 3.26Å; E143-Y146 WeakPolarHBondContact O-CD1 3.29Å; E143-Y146 VanDerWaalsContact O-CE1 3.32Å; E143-Y146 WeakPolarHBondContact O-CE1 3.39Å; N144-Y146 PolarHBondContact O-N 3.23Å
147	Q	79.7	Confident	88.2	Confident	130 Å²	130	35.5 Å²	35.5	61%	0.607	17%	0.17	S	C	*	.	H	α-helix	trans	-99.1	-43.5	178.2	-60	179.5	-17.2	0	0	112.7	N144 F145	N144-Q147 PolarHBondContact O-N 3.48Å; F145-Q147 PolarHBondContact O-N 3.23Å
148	L	80.4	Confident	87.8	Confident	86 Å²	86	38.4 Å²	38.4	45%	0.45	18%	0.182	S	C	.	.	H	α-helix	trans	-90.5	-27.8	-172.8	-65.5	-176.5	0	0	0	113.1	N144 V150	N144-L148 WeakPolarHBondContact ND2-CD1 3.29Å; N144-L148 PolarHBondContact O-N 3.47Å; L148-V150 HydrophobicContact CB-CB 4.46Å; L148-V150 HydrophobicContact CB-CG2 4.12Å; L148-V150 WeakPolarHBondContact O-CG2 3.16Å; L148-V150 PolarHBondContact O-N 2.93Å
149	E	84.8	Confident	87.3	Confident	42 Å²	42	47.1 Å²	47.1	20%	0.196	23%	0.229	C	C	.	.			trans	54.2	24	-175.8	-55.5	-179.3	159.2	0	0	114	R32 F145 L167 F168	R32-E149 IonicContact CZ-OE1 2.65Å; R32-E149 IonicContact NE-OE1 3.74Å; R32-E149 IonicContact NH1-OE1 3.27Å; R32-E149 PolarHBondContact NH1-OE1 2.77Å; R32-E149 IonicContact NH2-OE1 3.16Å; R32-E149 PolarHBondContact NH2-OE1 3.46Å; F145-E149 VanDerWaalsContact O-CA 3.31Å; F145-E149 WeakPolarHBondContact O-CA 3.4Å; F145-E149 PolarHBondContact O-N 3.1Å; E149-L167 HydrophobicContact CB-CB 4.33Å; E149-L167 PolarHBondContact O-N 2.89Å; E149-F168 WeakPolarHBondContact OE2-CE2 3.45Å
150	V	89.7	Confident	86.8	Confident	21 Å²	21	52 Å²	52	13%	0.127	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.3	-179.7	179.7	0	0	0	0	110.6	F145 L148 Y152 K164 L165	F145-V150 WeakPolarHBondContact CD2-O 3.31Å; L148-V150 HydrophobicContact CB-CB 4.46Å; L148-V150 HydrophobicContact CB-CG2 4.12Å; L148-V150 WeakPolarHBondContact O-CG2 3.16Å; L148-V150 PolarHBondContact O-N 2.93Å; V150-Y152 HydrophobicContact CB-CE2 4.34Å; V150-Y152 HydrophobicContact CG1-CD2 4.22Å; V150-Y152 HydrophobicContact CG1-CE1 4.25Å; V150-Y152 HydrophobicContact CG1-CE2 3.83Å; V150-K164 HydrophobicContact CG1-CB 4.05Å; V150-L165 CarbonylContact C-O 3.58Å; V150-L165 WeakPolarHBondContact CA-O 3.45Å
151	V	91.6	Very high	86.7	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132.4	166.2	-175.6	0	0	0	0	108.5	L36 A139 V141 F145 L165 I173	L36-V151 HydrophobicContact CD1-CG2 3.96Å; L36-V151 HydrophobicContact CD2-CG2 4.07Å; A139-V151 HydrophobicContact CB-CG1 4.07Å; V141-V151 HydrophobicContact CG2-CG1 4.37Å; V141-V151 HydrophobicContact CG2-CG2 4.29Å; F145-V151 HydrophobicContact CE2-CG2 3.83Å; F145-V151 HydrophobicContact CZ-CG2 4.28Å; V151-L165 PolarHBondContact N-O 2.9Å; V151-L165 PolarHBondContact O-N 2.81Å; V151-I173 HydrophobicContact CG1-CD1 4.43Å; V151-I173 HydrophobicContact CG1-CG2 4.01Å; V151-I173 HydrophobicContact CG2-CD1 4.42Å
152	Y	92.8	Very high	86.7	Confident	20 Å²	20	54.7 Å²	54.7	8%	0.078	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.8	173.9	-57.9	-99.7	0	0	0	107.8	P123 A139 M140 K142 V150 Y162 E163 K164	P123-Y152 HydrophobicContact CB-CD1 4.16Å; P123-Y152 HydrophobicContact CB-CG 4.37Å; P123-Y152 HydrophobicContact CG-CD1 3.63Å; P123-Y152 HydrophobicContact CG-CE1 3.96Å; P123-Y152 HydrophobicContact CG-CG 3.98Å; A139-Y152 CarbonylContact C-O 3.51Å; A139-Y152 WeakPolarHBondContact CA-O 3.17Å; M140-Y152 HydrophobicContact CG-CG 4.45Å; M140-Y152 PolarHBondContact N-O 3.17Å; M140-Y152 PolarHBondContact O-N 3.47Å; K142-Y152 HydrophobicContact CD-CE2 4Å; K142-Y152 HydrophobicContact CG-CE2 4.05Å; V150-Y152 HydrophobicContact CB-CE2 4.34Å; V150-Y152 HydrophobicContact CG1-CD2 4.22Å; V150-Y152 HydrophobicContact CG1-CE1 4.25Å; V150-Y152 HydrophobicContact CG1-CE2 3.83Å; Y152-Y162 AromaticContact CD1-CD2 3.91Å; Y152-Y162 HydrophobicContact CD1-CD2 3.91Å; Y152-Y162 AromaticContact CD1-CE2 3.9Å; Y152-Y162 HydrophobicContact CD1-CE2 3.9Å; Y152-Y162 HydrophobicContact CE1-CE2 4.35Å; Y152-E163 WeakPolarHBondContact CA-O 3.24Å; Y152-K164 HydrophobicContact CD1-CD 4.4Å; Y152-K164 HydrophobicContact CD1-CG 3.8Å; Y152-K164 HydrophobicContact CE1-CD 3.83Å; Y152-K164 HydrophobicContact CE1-CG 3.73Å
153	S	93.6	Very high	86.9	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.007	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.2	178.2	-176.7	0	0	0	0	110.5	R155 Y162 E163 I173	S153-R155 PolarHBondContact OG-NH1 2.79Å; S153-Y162 CarbonylContact O-C 3.3Å; S153-Y162 WeakPolarHBondContact O-CA 3.22Å; S153-E163 PolarHBondContact N-O 3.22Å; S153-E163 PolarHBondContact O-N 3.43Å; S153-I173 WeakPolarHBondContact CB-O 3.35Å; S153-I173 PolarHBondContact OG-O 3.06Å
154	C	94.3	Very high	87.4	Confident	11 Å²	11	55.5 Å²	55.5	7%	0.074	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	144	177.4	-64.1	0	0	0	0	111.2	C127 V138 M140 N161	C127-C154 WeakPolarHBondContact CA-SG 3.06Å; C127-C154 HydrophobicContact CB-CB 3.9Å; C127-C154 WeakPolarHBondContact CB-SG 3.46Å; C127-C154 WeakPolarHBondContact SG-CA 3.32Å; C127-C154 WeakPolarHBondContact SG-CB 3.27Å; C127-C154 CovalentContact SG-SG 2.05Å; C127-C154 PolarHBondContact SG-SG 3.23Å; V138-C154 HydrophobicContact CB-CB 4.27Å; V138-C154 PolarHBondContact O-N 3.15Å; M140-C154 WeakPolarHBondContact CE-SG 3.35Å; C154-N161 CarbonylContact C-O 3.45Å; C154-N161 WeakPolarHBondContact CA-O 3.45Å
155	R	92.4	Very high	87.9	Confident	12 Å²	12	52.9 Å²	52.9	5%	0.045	25%	0.253	C	S	.	.			trans	-128.2	132.9	177.4	-62.2	-62.7	176.7	-120.8	1.9	109.3	S153 Q158 N161 E163 I173	S153-R155 PolarHBondContact OG-NH1 2.79Å; R155-Q158 HydrophobicContact CB-CB 4.43Å; R155-Q158 HydrophobicContact CB-CG 4.35Å; R155-N161 PolarHBondContact N-O 3.49Å; R155-N161 CarbonylContact O-C 3.51Å; R155-N161 VanDerWaalsContact O-CA 3.23Å; R155-N161 WeakPolarHBondContact O-CA 3.46Å; R155-E163 HydrophobicContact CG-CB 3.89Å; R155-E163 IonicContact CZ-OE2 2.68Å; R155-E163 VanDerWaalsContact CZ-OE2 3.28Å; R155-E163 IonicContact NE-OE2 3.62Å; R155-E163 PolarHBondContact NE-OE2 2.7Å; R155-E163 IonicContact NH2-OE2 3.72Å; R155-E163 PolarHBondContact NH2-OE2 3.28Å; R155-I173 PolarHBondContact NH1-O 3.29Å; R155-I173 PolarHBondContact NH2-O 3.32Å
156	L	88.7	Confident	88.1	Confident	38 Å²	38	56.1 Å²	56.1	20%	0.199	27%	0.27	C	S	.	.	S	Bend	trans	-104.2	152.3	175.4	-165.4	66	0	0	0	107.9	Q158 Q177 F178	L156-Q158 PolarHBondContact O-N 3.23Å; L156-Q177 HydrophobicContact CB-CB 4.33Å; L156-F178 HydrophobicContact CD2-CE1 3.8Å; L156-F178 HydrophobicContact CD2-CE2 4.35Å; L156-F178 HydrophobicContact CD2-CZ 3.58Å
157	F	87.3	Confident	88.2	Confident	62 Å²	62	53.3 Å²	53.3	27%	0.272	26%	0.26	S	S	.	.	S	Bend	trans	63.4	19	179.5	-40.7	-62.8	0	0	0	115.3	F178 M181 H182 A184	F157-F178 AromaticContact CE2-CD1 3.94Å; F157-F178 HydrophobicContact CE2-CD1 3.94Å; F157-F178 HydrophobicContact CE2-CE1 4.09Å; F157-F178 AromaticContact CZ-CD1 3.85Å; F157-F178 HydrophobicContact CZ-CD1 3.85Å; F157-F178 AromaticContact CZ-CE1 3.69Å; F157-F178 HydrophobicContact CZ-CE1 3.69Å; F157-M181 WeakPolarHBondContact CD1-O 3.13Å; F157-M181 HydrophobicContact CE1-CB 4.46Å; F157-M181 HydrophobicContact CE2-CB 4.2Å; F157-M181 HydrophobicContact CE2-CG 3.97Å; F157-M181 HydrophobicContact CZ-CB 4.13Å; F157-M181 HydrophobicContact CZ-CE 4.11Å; F157-M181 HydrophobicContact CZ-CG 3.94Å; F157-H182 HydrophobicContact CB-CB 4.13Å; F157-A184 HydrophobicContact CD1-CB 3.66Å; F157-A184 HydrophobicContact CE1-CB 3.38Å; F157-A184 HydrophobicContact CZ-CB 4.31Å
158	Q	84.9	Confident	88.1	Confident	100 Å²	100	54 Å²	54	47%	0.467	26%	0.261	S	S	.	.	S	Bend	trans	-120.4	151.8	174.3	-62.9	-177.8	8.7	0	0	109.9	R155 L156 Q160	R155-Q158 HydrophobicContact CB-CB 4.43Å; R155-Q158 HydrophobicContact CB-CG 4.35Å; L156-Q158 PolarHBondContact O-N 3.23Å; Q158-Q160 PolarHBondContact O-N 2.64Å
159	D	82.8	Confident	88	Confident	185 Å²	185	53.8 Å²	53.8	99%	0.989	26%	0.26	S	S	*	.	S	Bend	trans	-58.9	-38.2	177.7	-64	-33.5	0	0	0	111.9
160	Q	84.8	Confident	87.7	Confident	101 Å²	101	55.1 Å²	55.1	47%	0.472	29%	0.285	S	S	.	.	S	Bend	trans	-97.7	117.8	171.2	-168	171.1	17.3	0	0	109.4	Q158 Y162	Q158-Q160 PolarHBondContact O-N 2.64Å; Q160-Y162 HydrophobicContact CG-CD1 4.1Å; Q160-Y162 HydrophobicContact CG-CE1 4.03Å; Q160-Y162 WeakPolarHBondContact CG-O 3.49Å; Q160-Y162 PolarHBondContact NE2-OH 3.3Å; Q160-Y162 VanDerWaalsContact NE2-OH 3.17Å; Q160-Y162 PolarHBondContact O-N 3.44Å
161	N	89.8	Confident	87.6	Confident	33 Å²	33	59.3 Å²	59.3	18%	0.176	30%	0.302	C	S	.	.	S	Bend	trans	-75	9.5	-175.6	69.5	-3.6	0	0	0	114.3	E124 C127 D128 C154 R155	E124-N161 PolarHBondContact O-ND2 2.87Å; C127-N161 HydrophobicContact CB-CB 4.39Å; C127-N161 PolarHBondContact SG-O 3.22Å; D128-N161 PolarHBondContact OD1-ND2 3.16Å; C154-N161 CarbonylContact C-O 3.45Å; C154-N161 WeakPolarHBondContact CA-O 3.45Å; R155-N161 PolarHBondContact N-O 3.49Å; R155-N161 CarbonylContact O-C 3.51Å; R155-N161 VanDerWaalsContact O-CA 3.23Å; R155-N161 WeakPolarHBondContact O-CA 3.46Å
162	Y	91.6	Very high	87.5	Confident	25 Å²	25	61.8 Å²	61.8	10%	0.098	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151.6	175.1	74.7	-86	0	0	0	113.1	P123 E124 Y152 S153 Q160 K164	P123-Y162 HydrophobicContact CB-CD1 4.24Å; P123-Y162 HydrophobicContact CB-CD2 4.23Å; P123-Y162 HydrophobicContact CB-CE1 4.5Å; P123-Y162 HydrophobicContact CB-CE2 4.48Å; P123-Y162 HydrophobicContact CB-CG 4.11Å; E124-Y162 HydrophobicContact CG-CD1 3.69Å; E124-Y162 HydrophobicContact CG-CE1 3.39Å; Y152-Y162 AromaticContact CD1-CD2 3.91Å; Y152-Y162 HydrophobicContact CD1-CD2 3.91Å; Y152-Y162 AromaticContact CD1-CE2 3.9Å; Y152-Y162 HydrophobicContact CD1-CE2 3.9Å; Y152-Y162 HydrophobicContact CE1-CE2 4.35Å; S153-Y162 CarbonylContact O-C 3.3Å; S153-Y162 WeakPolarHBondContact O-CA 3.22Å; Q160-Y162 HydrophobicContact CG-CD1 4.1Å; Q160-Y162 HydrophobicContact CG-CE1 4.03Å; Q160-Y162 WeakPolarHBondContact CG-O 3.49Å; Q160-Y162 PolarHBondContact NE2-OH 3.3Å; Q160-Y162 VanDerWaalsContact NE2-OH 3.17Å; Q160-Y162 PolarHBondContact O-N 3.44Å; Y162-K164 HydrophobicContact CD2-CG 4.3Å; Y162-K164 HydrophobicContact CE2-CD 4.49Å; Y162-K164 HydrophobicContact CE2-CG 3.86Å
163	E	92.2	Very high	87.3	Confident	42 Å²	42	60.9 Å²	60.9	20%	0.196	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.2	174.6	-171.6	179	-174.2	0	0	109.2	Y152 S153 R155 L165 K175	Y152-E163 WeakPolarHBondContact CA-O 3.24Å; S153-E163 PolarHBondContact N-O 3.22Å; S153-E163 PolarHBondContact O-N 3.43Å; R155-E163 HydrophobicContact CG-CB 3.89Å; R155-E163 IonicContact CZ-OE2 2.68Å; R155-E163 VanDerWaalsContact CZ-OE2 3.28Å; R155-E163 IonicContact NE-OE2 3.62Å; R155-E163 PolarHBondContact NE-OE2 2.7Å; R155-E163 IonicContact NH2-OE2 3.72Å; R155-E163 PolarHBondContact NH2-OE2 3.28Å; E163-L165 HydrophobicContact CG-CD2 3.9Å; E163-L165 HydrophobicContact CG-CG 4.27Å; E163-K175 IonicContact OE1-NZ 3.01Å; E163-K175 IonicContact OE2-NZ 3.69Å; E163-K175 PolarHBondContact OE2-NZ 3Å
164	K	91.6	Very high	87.2	Confident	127 Å²	127	62 Å²	62	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.2	171.9	-57.2	-172.7	-169.1	178.3	0	109.2	V150 Y152 Y162	V150-K164 HydrophobicContact CG1-CB 4.05Å; Y152-K164 HydrophobicContact CD1-CD 4.4Å; Y152-K164 HydrophobicContact CD1-CG 3.8Å; Y152-K164 HydrophobicContact CE1-CD 3.83Å; Y152-K164 HydrophobicContact CE1-CG 3.73Å; Y162-K164 HydrophobicContact CD2-CG 4.3Å; Y162-K164 HydrophobicContact CE2-CD 4.49Å; Y162-K164 HydrophobicContact CE2-CG 3.86Å
165	L	90.4	Very high	86.9	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.2	-178	-61.9	174.5	0	0	0	109.3	V150 V151 E163 K171 I173	V150-L165 CarbonylContact C-O 3.58Å; V150-L165 WeakPolarHBondContact CA-O 3.45Å; V151-L165 PolarHBondContact N-O 2.9Å; V151-L165 PolarHBondContact O-N 2.81Å; E163-L165 HydrophobicContact CG-CD2 3.9Å; E163-L165 HydrophobicContact CG-CG 4.27Å; L165-K171 HydrophobicContact CD2-CB 4.07Å; L165-K171 HydrophobicContact CD2-CD 3.83Å; L165-I173 HydrophobicContact CD1-CG1 4.45Å
166	N	87.1	Confident	86.7	Confident	69 Å²	69	68.1 Å²	68.1	37%	0.369	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	151.8	168.2	-54.9	-52.8	0	0	0	110.3	R39 F168 D169	R39-N166 PolarHBondContact NH1-O 2.71Å; N166-F168 PolarHBondContact O-N 2.91Å; N166-D169 HydrophobicContact CB-CB 4.5Å; N166-D169 WeakPolarHBondContact CB-OD2 3.31Å; N166-D169 PolarHBondContact N-OD2 2.79Å; N166-D169 VanDerWaalsContact N-OD2 3.09Å; N166-D169 PolarHBondContact ND2-OD1 3.42Å; N166-D169 PolarHBondContact ND2-OD2 3.34Å; N166-D169 PolarHBondContact O-N 2.98Å
167	L	80.8	Confident	86.8	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.063	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.4	180	-171.7	64	0	0	0	113.6	L36 R39 F145 E149	L36-L167 HydrophobicContact CB-CD1 3.95Å; L36-L167 HydrophobicContact CD1-CD1 3.63Å; L36-L167 HydrophobicContact CG-CD1 4.38Å; R39-L167 PolarHBondContact NH1-O 2.85Å; F145-L167 HydrophobicContact CZ-CD1 4.33Å; F145-L167 HydrophobicContact CZ-CD2 4.25Å; E149-L167 HydrophobicContact CB-CB 4.33Å; E149-L167 PolarHBondContact O-N 2.89Å
168	F	78.9	Confident	87	Confident	144 Å²	144	65.3 Å²	65.3	63%	0.632	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	0.7	-176.4	-59.8	-70.9	0	0	0	114.9	E149 N166 G170	E149-F168 WeakPolarHBondContact OE2-CE2 3.45Å; N166-F168 PolarHBondContact O-N 2.91Å; F168-G170 PolarHBondContact O-N 2.96Å
169	D	78.6	Confident	87.4	Confident	82 Å²	82	68.2 Å²	68.2	44%	0.439	34%	0.342	S	S	.	.	S	Bend	trans	-70.9	-0.9	-174.5	-75.3	-14.6	0	0	0	114.2	N166 K171	N166-D169 HydrophobicContact CB-CB 4.5Å; N166-D169 WeakPolarHBondContact CB-OD2 3.31Å; N166-D169 PolarHBondContact N-OD2 2.79Å; N166-D169 VanDerWaalsContact N-OD2 3.09Å; N166-D169 PolarHBondContact ND2-OD1 3.42Å; N166-D169 PolarHBondContact ND2-OD2 3.34Å; N166-D169 PolarHBondContact O-N 2.98Å; D169-K171 PolarHBondContact O-N 3.28Å
170	G	78.7	Confident	87.9	Confident	70 Å²	70	62.4 Å²	62.4	72%	0.722	31%	0.311	S	S	*	.			trans	65.4	-7.6	-179.8	0	0	0	0	0	115.7	F168	F168-G170 PolarHBondContact O-N 2.96Å
171	K	87.1	Confident	88.4	Confident	110 Å²	110	57.9 Å²	57.9	48%	0.478	29%	0.29	S	S	.	.			trans	-75.1	127.6	176.8	-68.8	179.4	177.2	-179.1	0	111.1	R39 L165 D169 I173	R39-K171 PolarHBondContact NH2-O 3.22Å; L165-K171 HydrophobicContact CD2-CB 4.07Å; L165-K171 HydrophobicContact CD2-CD 3.83Å; D169-K171 PolarHBondContact O-N 3.28Å; K171-I173 PolarHBondContact O-N 3.04Å
172	S	88.3	Confident	88.5	Confident	52 Å²	52	61.6 Å²	61.6	36%	0.364	31%	0.306	S	S	.	.			trans	-58.6	136.7	178.1	-174.3	0	0	0	0	112.3	E43 Y174	E43-S172 WeakPolarHBondContact OE2-CA 3.29Å; E43-S172 PolarHBondContact OE2-OG 3.4Å; S172-Y174 PolarHBondContact OG-O 2.97Å; S172-Y174 VanDerWaalsContact OG-O 3.1Å
173	I	89.9	Confident	88.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.315	C	S	.	.	S	Bend	trans	-70.6	-53.7	-176.9	-65.7	173.5	0	0	0	109.3	L36 L40 E43 A139 V151 S153 R155 L165 K171	L36-I173 HydrophobicContact CD1-CD1 3.39Å; L40-I173 HydrophobicContact CD2-CB 4.26Å; L40-I173 HydrophobicContact CD2-CD1 3.82Å; E43-I173 PolarHBondContact OE2-N 2.76Å; A139-I173 HydrophobicContact CB-CG2 3.57Å; V151-I173 HydrophobicContact CG1-CD1 4.43Å; V151-I173 HydrophobicContact CG1-CG2 4.01Å; V151-I173 HydrophobicContact CG2-CD1 4.42Å; S153-I173 WeakPolarHBondContact CB-O 3.35Å; S153-I173 PolarHBondContact OG-O 3.06Å; R155-I173 PolarHBondContact NH1-O 3.29Å; R155-I173 PolarHBondContact NH2-O 3.32Å; L165-I173 HydrophobicContact CD1-CG1 4.45Å; K171-I173 PolarHBondContact O-N 3.04Å
174	Y	90.8	Very high	88.7	Confident	25 Å²	25	60.8 Å²	60.8	10%	0.098	31%	0.314	C	S	.	.	S	Bend	trans	-93	126.7	178.5	-58.9	-83.5	0	0	0	110.1	L40 R112 R113 N137 A139 S172	L40-Y174 HydrophobicContact CD1-CE2 4.01Å; L40-Y174 HydrophobicContact CD2-CD2 3.87Å; L40-Y174 HydrophobicContact CD2-CE2 3.51Å; L40-Y174 HydrophobicContact CG-CE2 4.4Å; R112-Y174 HydrophobicContact CB-CD1 4.23Å; R112-Y174 HydrophobicContact CB-CD2 4.34Å; R112-Y174 HydrophobicContact CB-CE1 3.9Å; R112-Y174 HydrophobicContact CB-CE2 4Å; R112-Y174 HydrophobicContact CB-CG 4.43Å; R112-Y174 HydrophobicContact CG-CD1 4Å; R112-Y174 HydrophobicContact CG-CD2 3.98Å; R112-Y174 HydrophobicContact CG-CE1 4.2Å; R112-Y174 HydrophobicContact CG-CE2 4.16Å; R112-Y174 HydrophobicContact CG-CG 3.88Å; R113-Y174 PolarHBondContact O-OH 2.92Å; N137-Y174 HydrophobicContact CB-CD1 4.24Å; N137-Y174 WeakPolarHBondContact O-CE1 3.39Å; A139-Y174 HydrophobicContact CB-CE1 3.82Å; A139-Y174 HydrophobicContact CB-CE2 4.45Å; S172-Y174 PolarHBondContact OG-O 2.97Å; S172-Y174 VanDerWaalsContact OG-O 3.1Å
175	K	89.1	Confident	88.9	Confident	84 Å²	84	58 Å²	58	37%	0.365	31%	0.309	S	S	.	.			trans	-113.3	144.8	174.3	-68.5	177.9	-178	163	0	109.1	E163 Q177	E163-K175 IonicContact OE1-NZ 3.01Å; E163-K175 IonicContact OE2-NZ 3.69Å; E163-K175 PolarHBondContact OE2-NZ 3Å; K175-Q177 WeakPolarHBondContact O-CG 3.32Å; K175-Q177 PolarHBondContact O-N 2.97Å
176	D	87.3	Confident	89.1	Confident	67 Å²	67	57.9 Å²	57.9	36%	0.358	31%	0.308	S	S	.	.			trans	-75.5	94.2	170.2	-174.3	-5.2	0	0	0	109.1	F178 R179 I501	D176-F178 VanDerWaalsContact C-N 3.31Å; D176-F178 PolarHBondContact O-N 2.82Å; D176-R179 HydrophobicContact CB-CG 4.09Å; D176-R179 PolarHBondContact O-N 3.31Å; D176-R179 WeakPolarHBondContact OD2-CD 3.42Å; D176-R179 WeakPolarHBondContact OD2-CG 3.18Å; D176-R179 IonicContact OD2-CZ 2.98Å; D176-R179 IonicContact OD2-NE 3.28Å; D176-R179 PolarHBondContact OD2-NE 2.97Å; D176-R179 IonicContact OD2-NH2 3.42Å; D176-I501 WeakPolarHBondContact OD1-CD1 3.44Å
177	Q	90.4	Very high	89.6	Confident	22 Å²	22	57.4 Å²	57.4	10%	0.103	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-75.2	-24.2	-166.5	-44.6	-167.5	60.1	0	0	112.2	H136 L156 K175 R179	H136-Q177 PolarHBondContact O-NE2 3.47Å; L156-Q177 HydrophobicContact CB-CB 4.33Å; K175-Q177 WeakPolarHBondContact O-CG 3.32Å; K175-Q177 PolarHBondContact O-N 2.97Å; Q177-R179 VanDerWaalsContact C-N 3.31Å; Q177-R179 PolarHBondContact O-N 2.99Å
178	F	92.9	Very high	90.3	Very high	19 Å²	19	56.8 Å²	56.8	8%	0.083	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-85	-3.1	-178.5	-66.7	-78.7	0	0	0	113.4	H136 L156 F157 D176 N180 M181 V225 P497 Y498 I501	H136-F178 HydrophobicContact CB-CE2 4.15Å; H136-F178 AromaticContact CD2-CE2 3.52Å; H136-F178 AromaticContact CD2-CZ 3.42Å; H136-F178 VanDerWaalsContact CD2-CZ 3.42Å; H136-F178 WeakPolarHBondContact CD2-CZ 3.5Å; H136-F178 AromaticContact CG-CE2 3.91Å; H136-F178 AromaticContact CG-CZ 3.92Å; H136-F178 AromaticContact NE2-CZ 3.68Å; L156-F178 HydrophobicContact CD2-CE1 3.8Å; L156-F178 HydrophobicContact CD2-CE2 4.35Å; L156-F178 HydrophobicContact CD2-CZ 3.58Å; F157-F178 AromaticContact CE2-CD1 3.94Å; F157-F178 HydrophobicContact CE2-CD1 3.94Å; F157-F178 HydrophobicContact CE2-CE1 4.09Å; F157-F178 AromaticContact CZ-CD1 3.85Å; F157-F178 HydrophobicContact CZ-CD1 3.85Å; F157-F178 AromaticContact CZ-CE1 3.69Å; F157-F178 HydrophobicContact CZ-CE1 3.69Å; D176-F178 VanDerWaalsContact C-N 3.31Å; D176-F178 PolarHBondContact O-N 2.82Å; F178-N180 PolarHBondContact O-N 2.84Å; F178-M181 HydrophobicContact CD1-CE 4.45Å; F178-M181 HydrophobicContact CD1-CG 4.31Å; F178-M181 HydrophobicContact CD1-SD 4.36Å; F178-V225 WeakPolarHBondContact O-CB 3.38Å; F178-V225 WeakPolarHBondContact O-CG1 3.33Å; F178-P497 HydrophobicContact CD2-CB 4.44Å; F178-P497 HydrophobicContact CE1-CB 4.15Å; F178-P497 HydrophobicContact CE2-CB 3.59Å; F178-P497 HydrophobicContact CZ-CB 3.42Å; F178-P497 VanDerWaalsContact CZ-CB 3.42Å; F178-P497 HydrophobicContact CZ-CG 4.18Å; F178-Y498 HydrophobicContact CB-CG 4.45Å; F178-Y498 AromaticContact CD1-CD1 3.46Å; F178-Y498 HydrophobicContact CD1-CD1 3.46Å; F178-Y498 VanDerWaalsContact CD1-CD1 3.46Å; F178-Y498 HydrophobicContact CD1-CE1 4.29Å; F178-Y498 HydrophobicContact CD1-CG 4.14Å; F178-Y498 AromaticContact CE1-CD1 3.71Å; F178-Y498 HydrophobicContact CE1-CD1 3.71Å; F178-Y498 HydrophobicContact CE1-CE1 4.32Å; F178-Y498 HydrophobicContact CG-CD1 4.05Å; F178-Y498 HydrophobicContact CG-CG 4.34Å; F178-Y498 HydrophobicContact CZ-CD1 4.47Å; F178-I501 HydrophobicContact CB-CD1 3.65Å
179	R	92.3	Very high	91	Very high	162 Å²	162	50 Å²	50	61%	0.611	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-65.7	-23.4	168	-72.2	-175.9	179.5	-133.1	-7.5	113.1	D176 Q177	D176-R179 HydrophobicContact CB-CG 4.09Å; D176-R179 PolarHBondContact O-N 3.31Å; D176-R179 WeakPolarHBondContact OD2-CD 3.42Å; D176-R179 WeakPolarHBondContact OD2-CG 3.18Å; D176-R179 IonicContact OD2-CZ 2.98Å; D176-R179 IonicContact OD2-NE 3.28Å; D176-R179 PolarHBondContact OD2-NE 2.97Å; D176-R179 IonicContact OD2-NH2 3.42Å; Q177-R179 VanDerWaalsContact C-N 3.31Å; Q177-R179 PolarHBondContact O-N 2.99Å
180	N	94	Very high	91.7	Very high	62 Å²	62	46.3 Å²	46.3	33%	0.332	25%	0.249	S	C	.	.			trans	-144.5	101.1	174.2	-175.6	-1	0	0	0	109.5	F178 H182 V225 N226	F178-N180 PolarHBondContact O-N 2.84Å; N180-H182 VanDerWaalsContact C-N 3.27Å; N180-H182 PolarHBondContact ND2-CE1 2.83Å; N180-H182 PolarHBondContact ND2-NE2 3.09Å; N180-H182 PolarHBondContact O-CD2 2.86Å; N180-H182 PolarHBondContact O-N 3.22Å; N180-H182 PolarHBondContact OD1-N 2.84Å; N180-H182 VanDerWaalsContact OD1-N 3.15Å; N180-V225 CarbonylContact C-O 3.52Å; N180-V225 WeakPolarHBondContact CA-O 3.45Å; N180-N226 WeakPolarHBondContact OD1-CB 3.46Å; N180-N226 PolarHBondContact OD1-ND2 2.98Å
181	M	94	Very high	92.3	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.034	22%	0.217	C	C	.	.			trans	-83.8	-0.2	-177.2	-65.8	-178	65.4	0	0	113.2	F157 F178 G183 A184 I186 V225 A227 Y498	F157-M181 WeakPolarHBondContact CD1-O 3.13Å; F157-M181 HydrophobicContact CE1-CB 4.46Å; F157-M181 HydrophobicContact CE2-CB 4.2Å; F157-M181 HydrophobicContact CE2-CG 3.97Å; F157-M181 HydrophobicContact CZ-CB 4.13Å; F157-M181 HydrophobicContact CZ-CE 4.11Å; F157-M181 HydrophobicContact CZ-CG 3.94Å; F178-M181 HydrophobicContact CD1-CE 4.45Å; F178-M181 HydrophobicContact CD1-CG 4.31Å; F178-M181 HydrophobicContact CD1-SD 4.36Å; M181-G183 PolarHBondContact O-N 3.02Å; M181-G183 VanDerWaalsContact O-N 3.11Å; M181-A184 HydrophobicContact CB-CB 4.13Å; M181-A184 HydrophobicContact CE-CB 4.12Å; M181-A184 VanDerWaalsContact O-CB 3.26Å; M181-A184 WeakPolarHBondContact O-CB 3.33Å; M181-A184 PolarHBondContact O-N 3.46Å; M181-I186 HydrophobicContact CE-CD1 4.37Å; M181-I186 HydrophobicContact CE-CG1 3.96Å; M181-I186 HydrophobicContact SD-CD1 4.04Å; M181-I186 HydrophobicContact SD-CG1 4.29Å; M181-V225 HydrophobicContact CG-CB 4.36Å; M181-V225 HydrophobicContact CG-CG2 4.37Å; M181-V225 PolarHBondContact N-O 2.85Å; M181-V225 HydrophobicContact SD-CB 4.32Å; M181-V225 HydrophobicContact SD-CG2 3.79Å; M181-A227 HydrophobicContact CB-CB 4.02Å; M181-A227 HydrophobicContact CE-CB 4.34Å; M181-A227 HydrophobicContact CG-CB 4.41Å; M181-A227 HydrophobicContact SD-CB 3.78Å; M181-Y498 HydrophobicContact CE-CE1 4.22Å
182	H	93.6	Very high	92.5	Very high	111 Å²	111	41.7 Å²	41.7	51%	0.514	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	37.5	179	-64.8	-87	0	0	0	114.2	F157 N180 N226	F157-H182 HydrophobicContact CB-CB 4.13Å; N180-H182 VanDerWaalsContact C-N 3.27Å; N180-H182 PolarHBondContact ND2-CE1 2.83Å; N180-H182 PolarHBondContact ND2-NE2 3.09Å; N180-H182 PolarHBondContact O-CD2 2.86Å; N180-H182 PolarHBondContact O-N 3.22Å; N180-H182 PolarHBondContact OD1-N 2.84Å; N180-H182 VanDerWaalsContact OD1-N 3.15Å; H182-N226 PolarHBondContact N-O 3.23Å
183	G	93.4	Very high	92.5	Very high	28 Å²	28	40 Å²	40	29%	0.289	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	9.3	-179.8	0	0	0	0	0	114.8	M181 N226 T228	M181-G183 PolarHBondContact O-N 3.02Å; M181-G183 VanDerWaalsContact O-N 3.11Å; G183-N226 PolarHBondContact N-O 2.78Å; G183-T228 WeakPolarHBondContact O-CB 3.42Å; G183-T228 VanDerWaalsContact O-CG2 3.22Å; G183-T228 WeakPolarHBondContact O-CG2 3.43Å; G183-T228 PolarHBondContact O-OG1 3.47Å
184	A	93.8	Very high	92.6	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	20%	0.203	C	C	.	.			trans	-59.5	145.2	175	0	0	0	0	0	111.7	F157 M181 A227 T228	F157-A184 HydrophobicContact CD1-CB 3.66Å; F157-A184 HydrophobicContact CE1-CB 3.38Å; F157-A184 HydrophobicContact CZ-CB 4.31Å; M181-A184 HydrophobicContact CB-CB 4.13Å; M181-A184 HydrophobicContact CE-CB 4.12Å; M181-A184 VanDerWaalsContact O-CB 3.26Å; M181-A184 WeakPolarHBondContact O-CB 3.33Å; M181-A184 PolarHBondContact O-N 3.46Å; A184-A227 WeakPolarHBondContact O-CB 3.43Å; A184-T228 PolarHBondContact O-N 2.76Å; A184-T228 PolarHBondContact O-OG1 3.49Å
185	P	95.1	Very high	92.6	Very high	68 Å²	68	40.1 Å²	40.1	44%	0.442	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	138	-173.7	30.5	-34.6	0	0	0	111.8	T228 Q230	P185-T228 CarbonylContact C-O 3.47Å; P185-T228 WeakPolarHBondContact CA-O 3.44Å; P185-T228 WeakPolarHBondContact CA-OG1 3.42Å; P185-Q230 HydrophobicContact CB-CB 3.92Å
186	I	95.9	Very high	92.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.8	163.5	-62.4	-179.1	0	0	0	106.8	M181 T188 F221 V222 V225 A227 T228 Q230 D257 I258 Y498	M181-I186 HydrophobicContact CE-CD1 4.37Å; M181-I186 HydrophobicContact CE-CG1 3.96Å; M181-I186 HydrophobicContact SD-CD1 4.04Å; M181-I186 HydrophobicContact SD-CG1 4.29Å; I186-T188 HydrophobicContact CG2-CG2 3.78Å; I186-T188 PolarHBondContact O-N 2.72Å; I186-F221 HydrophobicContact CD1-CD1 4.27Å; I186-F221 HydrophobicContact CD1-CE1 3.99Å; I186-V222 HydrophobicContact CD1-CG2 4.2Å; I186-V225 HydrophobicContact CD1-CG2 4.32Å; I186-A227 HydrophobicContact CD1-CB 3.75Å; I186-A227 HydrophobicContact CG1-CB 3.98Å; I186-T228 PolarHBondContact N-O 2.87Å; I186-Q230 PolarHBondContact O-N 3.06Å; I186-D257 HydrophobicContact CG2-CB 4.18Å; I186-I258 HydrophobicContact CG2-CD1 4.28Å; I186-I258 HydrophobicContact CG2-CG1 4.34Å; I186-Y498 HydrophobicContact CD1-CE2 4.29Å
187	R	96	Very high	93.1	Very high	58 Å²	58	33.9 Å²	33.9	22%	0.219	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.8	-178	-60.4	169.9	-66.3	163.3	2.1	109.6	Q230 R232 D254 I255 L256 D257 I258	R187-Q230 WeakPolarHBondContact CA-O 3.32Å; R187-R232 HydrophobicContact CB-CG 4.18Å; R187-D254 PolarHBondContact NH1-O 2.68Å; R187-D254 PolarHBondContact NH2-O 2.93Å; R187-I255 PolarHBondContact NH1-O 3.49Å; R187-I255 VanDerWaalsContact NH1-O 3.16Å; R187-L256 HydrophobicContact CB-CD2 4.44Å; R187-D257 VanDerWaalsContact CB-OD2 3.31Å; R187-D257 WeakPolarHBondContact CB-OD2 3.32Å; R187-D257 WeakPolarHBondContact CG-OD2 3.31Å; R187-D257 IonicContact CZ-OD1 2.79Å; R187-D257 IonicContact CZ-OD2 3.1Å; R187-D257 PolarHBondContact N-OD2 3.48Å; R187-D257 IonicContact NE-OD1 3.01Å; R187-D257 PolarHBondContact NE-OD1 3.38Å; R187-D257 IonicContact NE-OD2 2.91Å; R187-D257 PolarHBondContact NE-OD2 2.88Å; R187-D257 IonicContact NH2-OD1 2.7Å; R187-D257 PolarHBondContact NH2-OD1 3.38Å; R187-D257 IonicContact NH2-OD2 3.47Å; R187-D257 PolarHBondContact O-N 3.12Å; R187-I258 PolarHBondContact O-N 2.64Å
188	T	95.6	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	161.7	-176.8	72.6	0	0	0	0	112.4	I186 Q230 I231 R232 I258	I186-T188 HydrophobicContact CG2-CG2 3.78Å; I186-T188 PolarHBondContact O-N 2.72Å; T188-Q230 PolarHBondContact N-O 3.49Å; T188-I231 WeakPolarHBondContact O-CA 3.35Å; T188-R232 PolarHBondContact O-N 2.94Å; T188-I258 VanDerWaalsContact CA-O 3.3Å; T188-I258 WeakPolarHBondContact CA-O 2.88Å; T188-I258 WeakPolarHBondContact CB-O 3.2Å; T188-I258 HydrophobicContact CG2-CB 4.42Å; T188-I258 WeakPolarHBondContact CG2-O 3.35Å
189	L	94.6	Very high	93.2	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	150	171.9	-168.9	58.6	0	0	0	108.9	I236 V242 I247 F250 L256 I260	L189-I236 HydrophobicContact CD1-CD1 4.17Å; L189-I236 HydrophobicContact CD1-CG1 4.33Å; L189-V242 HydrophobicContact CD2-CG1 3.94Å; L189-V242 HydrophobicContact CD2-CG2 4.37Å; L189-V242 HydrophobicContact CG-CG1 4.48Å; L189-I247 HydrophobicContact CB-CG1 4.38Å; L189-I247 HydrophobicContact CD2-CG1 4.1Å; L189-I247 HydrophobicContact CG-CD1 4.41Å; L189-I247 HydrophobicContact CG-CG1 4.2Å; L189-F250 HydrophobicContact CD2-CD2 4.1Å; L189-F250 HydrophobicContact CD2-CE2 4.21Å; L189-L256 HydrophobicContact CB-CD1 3.55Å; L189-L256 HydrophobicContact CB-CD2 4.25Å; L189-L256 HydrophobicContact CD2-CD1 4.29Å; L189-I260 WeakPolarHBondContact O-CB 3.46Å; L189-I260 PolarHBondContact O-N 3.23Å
190	S	93.2	Very high	93.2	Very high	4 Å²	4	28.9 Å²	28.9	3%	0.028	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	147.1	-179.4	-171.1	0	0	0	0	111.5	K192 T197 I247 I260	S190-K192 PolarHBondContact O-N 3.11Å; S190-K192 PolarHBondContact OG-N 2.67Å; S190-T197 VanDerWaalsContact OG-CB 3.24Å; S190-T197 WeakPolarHBondContact OG-CB 3.31Å; S190-T197 WeakPolarHBondContact OG-CG2 3.46Å; S190-T197 PolarHBondContact OG-OG1 2.86Å; S190-I247 VanDerWaalsContact C-CD1 3.44Å; S190-I260 WeakPolarHBondContact CA-O 3.25Å; S190-I260 PolarHBondContact OG-O 3.35Å; S190-I260 VanDerWaalsContact OG-O 3.09Å
191	D	90.8	Very high	93	Very high	11 Å²	11	32 Å²	32	6%	0.059	17%	0.168	C	C	.	.			trans	-76.1	-5.9	170.5	59.1	-7.7	0	0	0	113.2	E193 R196 T197 I247 C261	D191-E193 PolarHBondContact O-N 3.07Å; D191-R196 IonicContact OD2-CZ 3.08Å; D191-R196 VanDerWaalsContact OD2-CZ 3.27Å; D191-R196 IonicContact OD2-NE 2.6Å; D191-R196 PolarHBondContact OD2-NE 3.25Å; D191-R196 VanDerWaalsContact OD2-NE 3.16Å; D191-R196 IonicContact OD2-NH2 2.71Å; D191-R196 PolarHBondContact OD2-NH2 2.71Å; D191-T197 PolarHBondContact OD1-OG1 3.43Å; D191-I247 HydrophobicContact CB-CD1 4.06Å; D191-I247 VanDerWaalsContact N-CD1 3.33Å; D191-C261 HydrophobicContact CB-CB 3.95Å; D191-C261 WeakPolarHBondContact OD2-CB 3.38Å
192	K	90.6	Very high	92.7	Very high	72 Å²	72	33.1 Å²	33.1	31%	0.313	17%	0.173	S	C	.	.			trans	49.8	31.9	179.5	-54.4	-170.4	-172.4	-162.1	0	113.3	S190 P194 T197 P199 E208 F210 E233	S190-K192 PolarHBondContact O-N 3.11Å; S190-K192 PolarHBondContact OG-N 2.67Å; K192-P194 WeakPolarHBondContact O-CD 3.39Å; K192-T197 CarbonylContact C-O 3.55Å; K192-T197 PolarHBondContact N-OG1 3.16Å; K192-P199 HydrophobicContact CB-CG 4.17Å; K192-P199 HydrophobicContact CD-CB 4.28Å; K192-P199 HydrophobicContact CD-CG 4.18Å; K192-P199 HydrophobicContact CG-CG 4.3Å; K192-E208 VanDerWaalsContact NZ-CD 3.33Å; K192-E208 IonicContact NZ-OE1 2.73Å; K192-E208 PolarHBondContact NZ-OE1 2.93Å; K192-E208 IonicContact NZ-OE2 3.79Å; K192-E208 PolarHBondContact NZ-OE2 3.21Å; K192-F210 HydrophobicContact CG-CE1 4.44Å; K192-E233 IonicContact NZ-OE1 3.91Å; K192-E233 PolarHBondContact NZ-OE1 3.38Å
193	E	90	Very high	92.4	Very high	18 Å²	18	33.5 Å²	33.5	8%	0.084	19%	0.189	C	C	.	.			trans	-95.7	110.7	-175.9	-177.5	63.4	-167.6	0	0	112	D191 R196 T197 S440 R443 Q458	D191-E193 PolarHBondContact O-N 3.07Å; E193-R196 WeakPolarHBondContact O-CB 3.45Å; E193-R196 PolarHBondContact O-N 3.15Å; E193-R196 VanDerWaalsContact O-N 3.07Å; E193-T197 CarbonylContact C-O 3.58Å; E193-T197 VanDerWaalsContact C-O 3.3Å; E193-T197 PolarHBondContact N-OG1 3.24Å; E193-T197 PolarHBondContact O-N 2.97Å; E193-T197 PolarHBondContact O-OG1 3.3Å; E193-S440 PolarHBondContact OE1-OG 3.44Å; E193-S440 PolarHBondContact OE2-OG 2.92Å; E193-R443 IonicContact OE1-CZ 2.76Å; E193-R443 IonicContact OE1-NH2 3.66Å; E193-R443 PolarHBondContact OE1-NH2 3.2Å; E193-Q458 PolarHBondContact OE1-NE2 2.76Å
194	P	90.7	Very high	92.2	Very high	23 Å²	23	41.1 Å²	41.1	15%	0.149	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	147.5	178.2	-17	33.5	0	0	0	112.3	K192 I198 Q458 M526 L531	K192-P194 WeakPolarHBondContact O-CD 3.39Å; P194-I198 HydrophobicContact CB-CG1 4.15Å; P194-Q458 PolarHBondContact O-NE2 2.86Å; P194-M526 HydrophobicContact CB-CE 3.67Å; P194-M526 HydrophobicContact CB-CG 4Å; P194-M526 HydrophobicContact CB-SD 3.61Å; P194-M526 HydrophobicContact CG-CE 4.43Å; P194-L531 HydrophobicContact CG-CD1 3.72Å
195	P	91.9	Very high	91.8	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.032	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	cis	-86.7	2.1	2.8	34.2	-37	0	0	0	114.6	G212 Y213 T461 S522 M526	P195-G212 WeakPolarHBondContact O-CA 3.21Å; P195-Y213 HydrophobicContact CG-CE1 4.31Å; P195-T461 HydrophobicContact CB-CG2 4.27Å; P195-T461 WeakPolarHBondContact CB-OG1 3.07Å; P195-T461 WeakPolarHBondContact CG-OG1 3.48Å; P195-S522 VanDerWaalsContact CB-CB 3.48Å; P195-M526 HydrophobicContact CB-SD 4.37Å
196	R	92.6	Very high	91.4	Very high	20 Å²	20	43 Å²	43	8%	0.075	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-48.2	-174.6	-179.1	169.6	54.2	-136.6	-1.8	111.6	D191 E193 G212 Y213 V214 G215 E262	D191-R196 IonicContact OD2-CZ 3.08Å; D191-R196 VanDerWaalsContact OD2-CZ 3.27Å; D191-R196 IonicContact OD2-NE 2.6Å; D191-R196 PolarHBondContact OD2-NE 3.25Å; D191-R196 VanDerWaalsContact OD2-NE 3.16Å; D191-R196 IonicContact OD2-NH2 2.71Å; D191-R196 PolarHBondContact OD2-NH2 2.71Å; E193-R196 WeakPolarHBondContact O-CB 3.45Å; E193-R196 PolarHBondContact O-N 3.15Å; E193-R196 VanDerWaalsContact O-N 3.07Å; R196-G212 CarbonylContact O-C 3.27Å; R196-G212 WeakPolarHBondContact O-CA 3.38Å; R196-Y213 HydrophobicContact CB-CE1 3.82Å; R196-Y213 HydrophobicContact CB-CE2 4.46Å; R196-Y213 HydrophobicContact CG-CE1 4.3Å; R196-Y213 HydrophobicContact CG-CE2 4.05Å; R196-Y213 PolarHBondContact O-N 3.03Å; R196-V214 HydrophobicContact CG-CB 3.81Å; R196-V214 HydrophobicContact CG-CG2 3.52Å; R196-V214 PolarHBondContact O-N 2.95Å; R196-V214 VanDerWaalsContact O-N 3.12Å; R196-G215 PolarHBondContact O-N 3.06Å; R196-E262 IonicContact CZ-OE2 3.76Å; R196-E262 VanDerWaalsContact NH1-CB 3.27Å; R196-E262 IonicContact NH1-OE2 2.72Å; R196-E262 PolarHBondContact NH1-OE2 3.19Å
197	T	93.8	Very high	91	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.			trans	-135.4	123.5	-179.4	46.4	0	0	0	0	109.1	S190 D191 K192 E193 K211 V214 I260	S190-T197 VanDerWaalsContact OG-CB 3.24Å; S190-T197 WeakPolarHBondContact OG-CB 3.31Å; S190-T197 WeakPolarHBondContact OG-CG2 3.46Å; S190-T197 PolarHBondContact OG-OG1 2.86Å; D191-T197 PolarHBondContact OD1-OG1 3.43Å; K192-T197 CarbonylContact C-O 3.55Å; K192-T197 PolarHBondContact N-OG1 3.16Å; E193-T197 CarbonylContact C-O 3.58Å; E193-T197 VanDerWaalsContact C-O 3.3Å; E193-T197 PolarHBondContact N-OG1 3.24Å; E193-T197 PolarHBondContact O-N 2.97Å; E193-T197 PolarHBondContact O-OG1 3.3Å; T197-K211 WeakPolarHBondContact CA-O 3.43Å; T197-V214 HydrophobicContact CG2-CB 4.33Å; T197-I260 HydrophobicContact CG2-CB 4.4Å; T197-I260 HydrophobicContact CG2-CG2 3.38Å; T197-I260 WeakPolarHBondContact CG2-O 3.41Å
198	I	93.9	Very high	90.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	103.3	-178.2	-64.4	163.9	0	0	0	106.7	P194 F210 K211 D525 M526 A529 L531	P194-I198 HydrophobicContact CB-CG1 4.15Å; I198-F210 WeakPolarHBondContact O-CA 3.1Å; I198-K211 HydrophobicContact CB-CB 3.98Å; I198-K211 HydrophobicContact CG2-CB 4.36Å; I198-K211 PolarHBondContact N-O 3.38Å; I198-K211 PolarHBondContact O-N 2.71Å; I198-D525 HydrophobicContact CD1-CB 4.08Å; I198-M526 HydrophobicContact CD1-CG 3.53Å; I198-M526 HydrophobicContact CG1-CG 4Å; I198-A529 HydrophobicContact CG2-CB 3.69Å; I198-L531 HydrophobicContact CG2-CD1 3.82Å
199	P	91.8	Very high	90.4	Very high	25 Å²	25	50.6 Å²	50.6	16%	0.162	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	140	176.9	28.5	-34.7	0	0	0	110.3	K192 E208 F210	K192-P199 HydrophobicContact CB-CG 4.17Å; K192-P199 HydrophobicContact CD-CB 4.28Å; K192-P199 HydrophobicContact CD-CG 4.18Å; K192-P199 HydrophobicContact CG-CG 4.3Å; P199-E208 HydrophobicContact CB-CG 4.41Å; P199-E208 VanDerWaalsContact CB-OE1 3.24Å; P199-E208 WeakPolarHBondContact CB-OE1 3.48Å; P199-F210 HydrophobicContact CB-CD1 4.36Å; P199-F210 HydrophobicContact CB-CE1 4.27Å
200	Y	91.4	Very high	90.3	Very high	73 Å²	73	50.6 Å²	50.6	29%	0.286	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.3	170.8	77.1	-77.6	0	0	0	110.4	D202 K209 K211	Y200-D202 HydrophobicContact CE2-CB 4.5Å; Y200-K209 HydrophobicContact CD1-CB 4.2Å; Y200-K209 WeakPolarHBondContact CD1-O 2.9Å; Y200-K209 HydrophobicContact CE1-CB 3.51Å; Y200-K209 HydrophobicContact CE2-CB 4.32Å; Y200-K209 PolarHBondContact N-O 3.36Å; Y200-K209 PolarHBondContact O-N 3.11Å; Y200-K209 VanDerWaalsContact O-O 3.14Å; Y200-K211 HydrophobicContact CD1-CB 4.36Å; Y200-K211 HydrophobicContact CD1-CD 4.18Å; Y200-K211 HydrophobicContact CD1-CG 3.64Å; Y200-K211 HydrophobicContact CE1-CB 4.48Å; Y200-K211 HydrophobicContact CE1-CD 4.3Å; Y200-K211 HydrophobicContact CE1-CG 3.51Å
201	I	90.4	Very high	90.4	Very high	128 Å²	128	52.4 Å²	52.4	66%	0.656	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.1	176.1	-58.8	173.5	0	0	0	108.6	S203	I201-S203 PolarHBondContact O-N 3.15Å
202	D	88.3	Confident	90.5	Very high	29 Å²	29	52 Å²	52	16%	0.155	28%	0.276	C	S	.	.			trans	-71.5	115.3	175.1	-170	-11.7	0	0	0	110.4	Y200 K204 T205 G206 E207 K209	Y200-D202 HydrophobicContact CE2-CB 4.5Å; D202-K204 PolarHBondContact O-N 3.43Å; D202-K204 PolarHBondContact OD1-N 3.42Å; D202-T205 PolarHBondContact O-N 2.87Å; D202-G206 WeakPolarHBondContact O-CA 3.44Å; D202-G206 PolarHBondContact O-N 3.09Å; D202-E207 PolarHBondContact N-O 3.03Å; D202-K209 HydrophobicContact CB-CD 3.99Å; D202-K209 HydrophobicContact CB-CG 4.48Å; D202-K209 IonicContact OD2-NZ 2.86Å; D202-K209 PolarHBondContact OD2-NZ 2.93Å
203	S	86.6	Confident	90.7	Very high	120 Å²	120	48.7 Å²	48.7	84%	0.839	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-23.4	176.2	58.4	0	0	0	0	114.8	I201	I201-S203 PolarHBondContact O-N 3.15Å
204	K	88.7	Confident	90.9	Very high	187 Å²	187	47.8 Å²	47.8	81%	0.813	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-43	-177.9	-66.1	-175.3	179.2	-177.1	0	113.6	D202	D202-K204 PolarHBondContact O-N 3.43Å; D202-K204 PolarHBondContact OD1-N 3.42Å
205	T	86.4	Confident	91.1	Very high	73 Å²	73	46.7 Å²	46.7	45%	0.448	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-18.4	-175.5	64.1	0	0	0	0	112.9	D202 E207 K209	D202-T205 PolarHBondContact O-N 2.87Å; T205-E207 PolarHBondContact O-N 3.47Å; T205-E207 PolarHBondContact OG1-N 2.89Å; T205-E207 PolarHBondContact OG1-OE2 3.21Å; T205-E207 VanDerWaalsContact OG1-OE2 3.07Å; T205-K209 PolarHBondContact OG1-NZ 2.97Å
206	G	85.6	Confident	91.3	Very high	57 Å²	57	48.3 Å²	48.3	59%	0.588	26%	0.258	S	S	*	.			trans	72.9	2.1	-172.4	0	0	0	0	0	113.7	D202	D202-G206 WeakPolarHBondContact O-CA 3.44Å; D202-G206 PolarHBondContact O-N 3.09Å
207	E	87.8	Confident	91.5	Very high	115 Å²	115	47.4 Å²	47.4	54%	0.537	26%	0.255	S	S	.	.			trans	-86.7	146.1	-179.2	-61.5	166.7	154.4	0	0	111	D202 T205	D202-E207 PolarHBondContact N-O 3.03Å; T205-E207 PolarHBondContact O-N 3.47Å; T205-E207 PolarHBondContact OG1-N 2.89Å; T205-E207 PolarHBondContact OG1-OE2 3.21Å; T205-E207 VanDerWaalsContact OG1-OE2 3.07Å
208	E	87.8	Confident	91.6	Very high	50 Å²	50	47.4 Å²	47.4	23%	0.234	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	134.3	168.9	-167.4	-178.2	-151.9	0	0	110	K192 P199 I231 E233	K192-E208 VanDerWaalsContact NZ-CD 3.33Å; K192-E208 IonicContact NZ-OE1 2.73Å; K192-E208 PolarHBondContact NZ-OE1 2.93Å; K192-E208 IonicContact NZ-OE2 3.79Å; K192-E208 PolarHBondContact NZ-OE2 3.21Å; P199-E208 HydrophobicContact CB-CG 4.41Å; P199-E208 VanDerWaalsContact CB-OE1 3.24Å; P199-E208 WeakPolarHBondContact CB-OE1 3.48Å; E208-I231 HydrophobicContact CB-CD1 4.16Å; E208-I231 VanDerWaalsContact O-CD1 3.25Å; E208-I231 WeakPolarHBondContact O-CD1 3.43Å; E208-E233 VanDerWaalsContact OE2-OE1 3.1Å
209	K	91.3	Very high	91.6	Very high	51 Å²	51	48.1 Å²	48.1	22%	0.222	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	166.7	176.5	-67.9	-174.1	-174.6	167.4	0	109.6	Y200 D202 T205	Y200-K209 HydrophobicContact CD1-CB 4.2Å; Y200-K209 WeakPolarHBondContact CD1-O 2.9Å; Y200-K209 HydrophobicContact CE1-CB 3.51Å; Y200-K209 HydrophobicContact CE2-CB 4.32Å; Y200-K209 PolarHBondContact N-O 3.36Å; Y200-K209 PolarHBondContact O-N 3.11Å; Y200-K209 VanDerWaalsContact O-O 3.14Å; D202-K209 HydrophobicContact CB-CD 3.99Å; D202-K209 HydrophobicContact CB-CG 4.48Å; D202-K209 IonicContact OD2-NZ 2.86Å; D202-K209 PolarHBondContact OD2-NZ 2.93Å; T205-K209 PolarHBondContact OG1-NZ 2.97Å
210	F	93.1	Very high	91.8	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130	-176	-56	-73.8	0	0	0	111.9	K192 I198 P199 G215 S219 M229 I231 I260	K192-F210 HydrophobicContact CG-CE1 4.44Å; I198-F210 WeakPolarHBondContact O-CA 3.1Å; P199-F210 HydrophobicContact CB-CD1 4.36Å; P199-F210 HydrophobicContact CB-CE1 4.27Å; F210-G215 CarbonylContact O-C 3.58Å; F210-S219 PolarHBondContact O-OG 3.23Å; F210-M229 HydrophobicContact CD2-SD 4.01Å; F210-M229 HydrophobicContact CE2-SD 4.27Å; F210-I231 HydrophobicContact CE2-CD1 3.55Å; F210-I231 HydrophobicContact CE2-CG1 3.98Å; F210-I231 HydrophobicContact CZ-CD1 3.86Å; F210-I231 HydrophobicContact CZ-CG1 4.46Å; F210-I231 HydrophobicContact CZ-CG2 4.4Å; F210-I260 HydrophobicContact CD2-CD1 3.42Å; F210-I260 VanDerWaalsContact CD2-CD1 3.42Å; F210-I260 HydrophobicContact CE2-CD1 3.6Å; F210-I260 HydrophobicContact CG-CD1 4.24Å
211	K	94.1	Very high	92.1	Very high	43 Å²	43	46.4 Å²	46.4	19%	0.187	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-167.6	159.9	-70.9	-175.1	179.6	-172.9	0	109.8	T197 I198 Y200 M216 D525	T197-K211 WeakPolarHBondContact CA-O 3.43Å; I198-K211 HydrophobicContact CB-CB 3.98Å; I198-K211 HydrophobicContact CG2-CB 4.36Å; I198-K211 PolarHBondContact N-O 3.38Å; I198-K211 PolarHBondContact O-N 2.71Å; Y200-K211 HydrophobicContact CD1-CB 4.36Å; Y200-K211 HydrophobicContact CD1-CD 4.18Å; Y200-K211 HydrophobicContact CD1-CG 3.64Å; Y200-K211 HydrophobicContact CE1-CB 4.48Å; Y200-K211 HydrophobicContact CE1-CD 4.3Å; Y200-K211 HydrophobicContact CE1-CG 3.51Å; K211-M216 HydrophobicContact CG-SD 4.41Å; K211-D525 HydrophobicContact CB-CB 4.49Å; K211-D525 HydrophobicContact CD-CB 3.82Å; K211-D525 IonicContact NZ-OD1 2.98Å; K211-D525 PolarHBondContact NZ-OD1 3.41Å
212	G	93.8	Very high	92.4	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.01	22%	0.224	C	C	.	.	S	Bend	trans	84.3	166.8	-169.9	0	0	0	0	0	110.8	P195 R196 V214 G215 M216	P195-G212 WeakPolarHBondContact O-CA 3.21Å; R196-G212 CarbonylContact O-C 3.27Å; R196-G212 WeakPolarHBondContact O-CA 3.38Å; G212-V214 PolarHBondContact O-N 3.46Å; G212-G215 PolarHBondContact O-N 2.91Å; G212-M216 WeakPolarHBondContact O-CB 3.49Å; G212-M216 WeakPolarHBondContact O-CG 3.47Å; G212-M216 PolarHBondContact O-N 2.89Å
213	Y	94.1	Very high	92.7	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-31.5	-170.6	61.9	-92.5	0	0	0	113.5	P195 R196 L217 Y278 L279 L488 I519	P195-Y213 HydrophobicContact CG-CE1 4.31Å; R196-Y213 HydrophobicContact CB-CE1 3.82Å; R196-Y213 HydrophobicContact CB-CE2 4.46Å; R196-Y213 HydrophobicContact CG-CE1 4.3Å; R196-Y213 HydrophobicContact CG-CE2 4.05Å; R196-Y213 PolarHBondContact O-N 3.03Å; Y213-L217 WeakPolarHBondContact O-CB 3.46Å; Y213-L217 PolarHBondContact O-N 2.72Å; Y213-Y278 HydrophobicContact CD2-CE1 4.25Å; Y213-L279 HydrophobicContact CD2-CD1 3.83Å; Y213-L279 HydrophobicContact CE2-CD1 3.78Å; Y213-L488 HydrophobicContact CE2-CD1 3.72Å; Y213-L488 WeakPolarHBondContact OH-CD1 3.36Å; Y213-I519 HydrophobicContact CD1-CG1 3.86Å; Y213-I519 HydrophobicContact CG-CG1 3.92Å
214	V	95.4	Very high	93.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-82.4	-41.3	172.8	176	0	0	0	0	111.1	R196 T197 G212 M216 L217 I218 I260 L488 I490	R196-V214 HydrophobicContact CG-CB 3.81Å; R196-V214 HydrophobicContact CG-CG2 3.52Å; R196-V214 PolarHBondContact O-N 2.95Å; R196-V214 VanDerWaalsContact O-N 3.12Å; T197-V214 HydrophobicContact CG2-CB 4.33Å; G212-V214 PolarHBondContact O-N 3.46Å; V214-M216 VanDerWaalsContact C-N 3.31Å; V214-M216 PolarHBondContact O-N 3.47Å; V214-L217 WeakPolarHBondContact O-CB 3.39Å; V214-L217 PolarHBondContact O-N 2.94Å; V214-I218 HydrophobicContact CG1-CD1 3.94Å; V214-I218 PolarHBondContact O-N 3.46Å; V214-I218 VanDerWaalsContact O-N 3.12Å; V214-I260 HydrophobicContact CG1-CG2 3.92Å; V214-L488 HydrophobicContact CG2-CD2 4.33Å; V214-I490 HydrophobicContact CG1-CD1 4.47Å
215	G	95.1	Very high	93.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-42.3	177.3	0	0	0	0	0	112.6	R196 F210 G212 S219	R196-G215 PolarHBondContact O-N 3.06Å; F210-G215 CarbonylContact O-C 3.58Å; G212-G215 PolarHBondContact O-N 2.91Å; G215-S219 WeakPolarHBondContact O-CB 3.35Å; G215-S219 PolarHBondContact O-N 2.95Å; G215-S219 PolarHBondContact O-OG 3.11Å
216	M	95.6	Very high	94	Very high	39 Å²	39	36.9 Å²	36.9	19%	0.192	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-42.2	176	-72.2	-62.6	-65.6	0	0	112.4	K211 G212 V214 I218 S219 Q220 W518	K211-M216 HydrophobicContact CG-SD 4.41Å; G212-M216 WeakPolarHBondContact O-CB 3.49Å; G212-M216 WeakPolarHBondContact O-CG 3.47Å; G212-M216 PolarHBondContact O-N 2.89Å; V214-M216 VanDerWaalsContact C-N 3.31Å; V214-M216 PolarHBondContact O-N 3.47Å; M216-I218 VanDerWaalsContact C-N 3.33Å; M216-I218 PolarHBondContact O-N 3.42Å; M216-S219 PolarHBondContact O-N 2.93Å; M216-Q220 WeakPolarHBondContact O-CB 3.28Å; M216-Q220 WeakPolarHBondContact O-CG 3.28Å; M216-Q220 PolarHBondContact O-N 2.78Å; M216-W518 HydrophobicContact CB-CD2 3.43Å; M216-W518 VanDerWaalsContact CB-CD2 3.43Å; M216-W518 HydrophobicContact CB-CE3 3.67Å; M216-W518 HydrophobicContact CB-CG 3.89Å; M216-W518 HydrophobicContact CB-CH2 4.11Å; M216-W518 HydrophobicContact CB-CZ2 3.9Å; M216-W518 HydrophobicContact CB-CZ3 4.01Å; M216-W518 HydrophobicContact CE-CZ2 4.38Å; M216-W518 HydrophobicContact CG-CD2 4.12Å; M216-W518 HydrophobicContact CG-CG 4.06Å
217	L	96.1	Very high	94.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-53	-51.4	176.5	167.7	67.1	0	0	0	111.4	Y213 V214 F221 Y278 I490 H505 M506 Q509 W518	Y213-L217 WeakPolarHBondContact O-CB 3.46Å; Y213-L217 PolarHBondContact O-N 2.72Å; V214-L217 WeakPolarHBondContact O-CB 3.39Å; V214-L217 PolarHBondContact O-N 2.94Å; L217-F221 PolarHBondContact O-N 3.25Å; L217-Y278 HydrophobicContact CD2-CD1 4.04Å; L217-Y278 HydrophobicContact CD2-CD2 4.48Å; L217-Y278 HydrophobicContact CD2-CE1 3.66Å; L217-Y278 HydrophobicContact CD2-CE2 4.15Å; L217-Y278 HydrophobicContact CD2-CG 4.44Å; L217-I490 HydrophobicContact CD2-CD1 3.37Å; L217-H505 PolarHBondContact O-NE2 2.82Å; L217-M506 HydrophobicContact CD1-CB 4.34Å; L217-M506 HydrophobicContact CD1-CG 3.93Å; L217-M506 HydrophobicContact CD2-CE 4.48Å; L217-M506 HydrophobicContact CD2-CG 3.85Å; L217-M506 HydrophobicContact CG-CG 4.33Å; L217-Q509 HydrophobicContact CD1-CB 4.21Å; L217-Q509 HydrophobicContact CD1-CG 4.03Å; L217-W518 HydrophobicContact CB-CZ3 4.01Å
218	I	96	Very high	94.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-72.8	-41.3	-177	-63.3	174.6	0	0	0	110.5	V214 M216 Q220 F221 V222 M229 I258 I260 F502	V214-I218 HydrophobicContact CG1-CD1 3.94Å; V214-I218 PolarHBondContact O-N 3.46Å; V214-I218 VanDerWaalsContact O-N 3.12Å; M216-I218 VanDerWaalsContact C-N 3.33Å; M216-I218 PolarHBondContact O-N 3.42Å; I218-Q220 VanDerWaalsContact C-N 3.29Å; I218-Q220 PolarHBondContact O-N 3.15Å; I218-F221 WeakPolarHBondContact O-CB 3.47Å; I218-F221 PolarHBondContact O-N 3.21Å; I218-F221 VanDerWaalsContact O-N 3.09Å; I218-V222 HydrophobicContact CG2-CG2 4.42Å; I218-V222 WeakPolarHBondContact O-CG2 3.47Å; I218-V222 PolarHBondContact O-N 3.24Å; I218-M229 HydrophobicContact CG2-CE 3.96Å; I218-I258 HydrophobicContact CD1-CG2 3.76Å; I218-I258 HydrophobicContact CG1-CG2 4.36Å; I218-I260 HydrophobicContact CD1-CB 3.97Å; I218-I260 HydrophobicContact CD1-CG1 3.68Å; I218-I260 HydrophobicContact CD1-CG2 3.96Å; I218-I260 HydrophobicContact CG2-CD1 4.46Å; I218-I260 HydrophobicContact CG2-CG1 4.43Å; I218-F502 HydrophobicContact CG1-CE2 4.22Å; I218-F502 HydrophobicContact CG1-CZ 4.19Å
219	S	94.9	Very high	95.1	Very high	15 Å²	15	32.6 Å²	32.6	11%	0.105	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-37.9	176.1	-64.8	0	0	0	0	112.8	F210 G215 M216 K223	F210-S219 PolarHBondContact O-OG 3.23Å; G215-S219 WeakPolarHBondContact O-CB 3.35Å; G215-S219 PolarHBondContact O-N 2.95Å; G215-S219 PolarHBondContact O-OG 3.11Å; M216-S219 PolarHBondContact O-N 2.93Å; S219-K223 WeakPolarHBondContact O-CG 3.48Å; S219-K223 PolarHBondContact O-N 3.24Å
220	Q	95.9	Very high	95.2	Very high	63 Å²	63	34.2 Å²	34.2	29%	0.294	17%	0.169	S	C	.	.	H	α-helix	trans	-72.8	-33.8	175.1	-66.3	-59.7	-21.1	0	0	112	M216 I218 K223 K224 W518	M216-Q220 WeakPolarHBondContact O-CB 3.28Å; M216-Q220 WeakPolarHBondContact O-CG 3.28Å; M216-Q220 PolarHBondContact O-N 2.78Å; I218-Q220 VanDerWaalsContact C-N 3.29Å; I218-Q220 PolarHBondContact O-N 3.15Å; Q220-K223 PolarHBondContact O-N 2.79Å; Q220-K224 WeakPolarHBondContact O-CB 3.42Å; Q220-K224 PolarHBondContact O-N 3.44Å; Q220-W518 HydrophobicContact CG-CH2 4.18Å; Q220-W518 HydrophobicContact CG-CZ2 4Å
221	F	97.1	Very high	95.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-51.8	173.8	179.6	-109.3	0	0	0	111.3	I186 L217 I218 K223 K224 V225 I258 Y498 I501 F502 H505	I186-F221 HydrophobicContact CD1-CD1 4.27Å; I186-F221 HydrophobicContact CD1-CE1 3.99Å; L217-F221 PolarHBondContact O-N 3.25Å; I218-F221 WeakPolarHBondContact O-CB 3.47Å; I218-F221 PolarHBondContact O-N 3.21Å; I218-F221 VanDerWaalsContact O-N 3.09Å; F221-K223 PolarHBondContact O-N 3.3Å; F221-K224 WeakPolarHBondContact O-CA 3.41Å; F221-K224 WeakPolarHBondContact O-CB 3.26Å; F221-K224 PolarHBondContact O-N 3.12Å; F221-V225 HydrophobicContact CD1-CG2 4.49Å; F221-V225 HydrophobicContact CD2-CG1 4.37Å; F221-V225 HydrophobicContact CE1-CG2 4.19Å; F221-V225 HydrophobicContact CE2-CG1 3.78Å; F221-V225 HydrophobicContact CZ-CG1 3.87Å; F221-V225 HydrophobicContact CZ-CG2 4.34Å; F221-V225 WeakPolarHBondContact O-CG2 3.3Å; F221-V225 PolarHBondContact O-N 2.96Å; F221-I258 HydrophobicContact CD1-CD1 4.44Å; F221-I258 HydrophobicContact CE1-CD1 4.31Å; F221-Y498 AromaticContact CE1-CD2 3.93Å; F221-Y498 HydrophobicContact CE1-CD2 3.93Å; F221-Y498 AromaticContact CE1-CE2 3.9Å; F221-Y498 HydrophobicContact CE1-CE2 3.9Å; F221-Y498 AromaticContact CZ-CD2 3.82Å; F221-Y498 HydrophobicContact CZ-CD2 3.82Å; F221-Y498 HydrophobicContact CZ-CE2 4.28Å; F221-I501 HydrophobicContact CE2-CB 4.47Å; F221-I501 HydrophobicContact CE2-CG2 4.06Å; F221-F502 HydrophobicContact CB-CD2 4.21Å; F221-F502 HydrophobicContact CB-CE2 4.28Å; F221-F502 AromaticContact CD1-CD2 3.64Å; F221-F502 HydrophobicContact CD1-CD2 3.64Å; F221-F502 HydrophobicContact CD1-CE2 4.22Å; F221-F502 AromaticContact CD2-CD2 3.85Å; F221-F502 HydrophobicContact CD2-CD2 3.85Å; F221-F502 HydrophobicContact CE1-CB 4.28Å; F221-F502 AromaticContact CE1-CD2 3.89Å; F221-F502 HydrophobicContact CE1-CD2 3.89Å; F221-F502 HydrophobicContact CE1-CG 4.5Å; F221-F502 HydrophobicContact CE2-CB 3.98Å; F221-F502 HydrophobicContact CE2-CD2 4.09Å; F221-F502 AromaticContact CG-CD2 3.61Å; F221-F502 HydrophobicContact CG-CD2 3.61Å; F221-F502 HydrophobicContact CG-CE2 4.15Å; F221-F502 HydrophobicContact CZ-CB 3.83Å; F221-F502 HydrophobicContact CZ-CD2 4.11Å; F221-F502 HydrophobicContact CZ-CG 4.46Å; F221-H505 HydrophobicContact CD2-CB 3.88Å; F221-H505 AromaticContact CD2-CD2 3.92Å; F221-H505 AromaticContact CD2-CG 3.86Å; F221-H505 HydrophobicContact CE2-CB 4.41Å; F221-H505 PolarHBondContact N-NE2 3.29Å
222	V	96.4	Very high	95.1	Very high	11 Å²	11	36.2 Å²	36.2	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-52.9	-42.4	177.9	172.3	0	0	0	0	111.1	I186 I218 N226 A227 M229	I186-V222 HydrophobicContact CD1-CG2 4.2Å; I218-V222 HydrophobicContact CG2-CG2 4.42Å; I218-V222 WeakPolarHBondContact O-CG2 3.47Å; I218-V222 PolarHBondContact O-N 3.24Å; V222-N226 PolarHBondContact O-N 2.91Å; V222-A227 HydrophobicContact CG1-CB 4.16Å; V222-A227 WeakPolarHBondContact CG1-O 3.49Å; V222-A227 PolarHBondContact O-N 2.79Å; V222-M229 HydrophobicContact CG1-CB 4.26Å; V222-M229 HydrophobicContact CG2-CB 4.36Å; V222-M229 HydrophobicContact CG2-CE 3.85Å
223	K	95.1	Very high	94.8	Very high	140 Å²	140	40.7 Å²	40.7	61%	0.609	20%	0.199	S	C	*	.	H	α-helix	trans	-67.1	-43.1	174.8	-71	174.9	-176.1	176.4	0	112.9	S219 Q220 F221 V225 N226	S219-K223 WeakPolarHBondContact O-CG 3.48Å; S219-K223 PolarHBondContact O-N 3.24Å; Q220-K223 PolarHBondContact O-N 2.79Å; F221-K223 PolarHBondContact O-N 3.3Å; K223-V225 VanDerWaalsContact C-N 3.3Å; K223-V225 PolarHBondContact O-N 3.48Å; K223-N226 PolarHBondContact O-N 3.21Å
224	K	96.2	Very high	94.4	Very high	100 Å²	100	45.8 Å²	45.8	44%	0.435	23%	0.226	S	C	.	.	H	α-helix	trans	-58.2	-41.7	179.8	179.3	-174.8	175.7	-171.2	0	111.6	Q220 F221 H505	Q220-K224 WeakPolarHBondContact O-CB 3.42Å; Q220-K224 PolarHBondContact O-N 3.44Å; F221-K224 WeakPolarHBondContact O-CA 3.41Å; F221-K224 WeakPolarHBondContact O-CB 3.26Å; F221-K224 PolarHBondContact O-N 3.12Å; K224-H505 HydrophobicContact CD-CB 4.49Å
225	V	96.3	Very high	93.9	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.5	-179.2	-60.4	0	0	0	0	113.7	F178 N180 M181 I186 F221 K223 A227 I501	F178-V225 WeakPolarHBondContact O-CB 3.38Å; F178-V225 WeakPolarHBondContact O-CG1 3.33Å; N180-V225 CarbonylContact C-O 3.52Å; N180-V225 WeakPolarHBondContact CA-O 3.45Å; M181-V225 HydrophobicContact CG-CB 4.36Å; M181-V225 HydrophobicContact CG-CG2 4.37Å; M181-V225 PolarHBondContact N-O 2.85Å; M181-V225 HydrophobicContact SD-CB 4.32Å; M181-V225 HydrophobicContact SD-CG2 3.79Å; I186-V225 HydrophobicContact CD1-CG2 4.32Å; F221-V225 HydrophobicContact CD1-CG2 4.49Å; F221-V225 HydrophobicContact CD2-CG1 4.37Å; F221-V225 HydrophobicContact CE1-CG2 4.19Å; F221-V225 HydrophobicContact CE2-CG1 3.78Å; F221-V225 HydrophobicContact CZ-CG1 3.87Å; F221-V225 HydrophobicContact CZ-CG2 4.34Å; F221-V225 WeakPolarHBondContact O-CG2 3.3Å; F221-V225 PolarHBondContact O-N 2.96Å; K223-V225 VanDerWaalsContact C-N 3.3Å; K223-V225 PolarHBondContact O-N 3.48Å; V225-A227 VanDerWaalsContact C-N 3.31Å; V225-A227 HydrophobicContact CG2-CB 3.74Å; V225-A227 PolarHBondContact O-N 3.4Å; V225-I501 HydrophobicContact CG1-CG2 4.35Å
226	N	96.4	Very high	93.4	Very high	84 Å²	84	50 Å²	50	45%	0.449	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	50.8	-176.4	-172.3	35.3	0	0	0	112.3	N180 H182 G183 V222 K223	N180-N226 WeakPolarHBondContact OD1-CB 3.46Å; N180-N226 PolarHBondContact OD1-ND2 2.98Å; H182-N226 PolarHBondContact N-O 3.23Å; G183-N226 PolarHBondContact N-O 2.78Å; V222-N226 PolarHBondContact O-N 2.91Å; K223-N226 PolarHBondContact O-N 3.21Å
227	A	95.8	Very high	92.5	Very high	13 Å²	13	55 Å²	55	11%	0.107	27%	0.268	C	S	.	.			trans	-106.1	172	176.6	0	0	0	0	0	111.3	M181 A184 I186 V222 V225	M181-A227 HydrophobicContact CB-CB 4.02Å; M181-A227 HydrophobicContact CE-CB 4.34Å; M181-A227 HydrophobicContact CG-CB 4.41Å; M181-A227 HydrophobicContact SD-CB 3.78Å; A184-A227 WeakPolarHBondContact O-CB 3.43Å; I186-A227 HydrophobicContact CD1-CB 3.75Å; I186-A227 HydrophobicContact CG1-CB 3.98Å; V222-A227 HydrophobicContact CG1-CB 4.16Å; V222-A227 WeakPolarHBondContact CG1-O 3.49Å; V222-A227 PolarHBondContact O-N 2.79Å; V225-A227 VanDerWaalsContact C-N 3.31Å; V225-A227 HydrophobicContact CG2-CB 3.74Å; V225-A227 PolarHBondContact O-N 3.4Å
228	T	94.4	Very high	91	Very high	68 Å²	68	62.7 Å²	62.7	42%	0.417	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.4	168.6	53.5	0	0	0	0	110.4	G183 A184 P185 I186	G183-T228 WeakPolarHBondContact O-CB 3.42Å; G183-T228 VanDerWaalsContact O-CG2 3.22Å; G183-T228 WeakPolarHBondContact O-CG2 3.43Å; G183-T228 PolarHBondContact O-OG1 3.47Å; A184-T228 PolarHBondContact O-N 2.76Å; A184-T228 PolarHBondContact O-OG1 3.49Å; P185-T228 CarbonylContact C-O 3.47Å; P185-T228 WeakPolarHBondContact CA-O 3.44Å; P185-T228 WeakPolarHBondContact CA-OG1 3.42Å; I186-T228 PolarHBondContact N-O 2.87Å
229	M	93.8	Very high	89.3	Confident	50 Å²	50	71.1 Å²	71.1	25%	0.246	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	114.9	175.7	-176.2	177	-69.5	0	0	108.3	F210 I218 V222 I231 I260	F210-M229 HydrophobicContact CD2-SD 4.01Å; F210-M229 HydrophobicContact CE2-SD 4.27Å; I218-M229 HydrophobicContact CG2-CE 3.96Å; V222-M229 HydrophobicContact CG1-CB 4.26Å; V222-M229 HydrophobicContact CG2-CB 4.36Å; V222-M229 HydrophobicContact CG2-CE 3.85Å; M229-I231 HydrophobicContact CG-CG1 4.31Å; M229-I260 HydrophobicContact SD-CD1 4.3Å
230	Q	94.6	Very high	88.1	Confident	85 Å²	85	76.1 Å²	76.1	40%	0.397	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	102.1	176.7	-174.6	-178.4	23	0	0	109.5	P185 I186 R187 T188 R232	P185-Q230 HydrophobicContact CB-CB 3.92Å; I186-Q230 PolarHBondContact O-N 3.06Å; R187-Q230 WeakPolarHBondContact CA-O 3.32Å; T188-Q230 PolarHBondContact N-O 3.49Å; Q230-R232 PolarHBondContact O-N 3.45Å
231	I	92.9	Very high	87	Confident	43 Å²	43	77.9 Å²	77.9	22%	0.221	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	120	177.1	-52.3	174.8	0	0	0	108.5	T188 E208 F210 M229 E233	T188-I231 WeakPolarHBondContact O-CA 3.35Å; E208-I231 HydrophobicContact CB-CD1 4.16Å; E208-I231 VanDerWaalsContact O-CD1 3.25Å; E208-I231 WeakPolarHBondContact O-CD1 3.43Å; F210-I231 HydrophobicContact CE2-CD1 3.55Å; F210-I231 HydrophobicContact CE2-CG1 3.98Å; F210-I231 HydrophobicContact CZ-CD1 3.86Å; F210-I231 HydrophobicContact CZ-CG1 4.46Å; F210-I231 HydrophobicContact CZ-CG2 4.4Å; M229-I231 HydrophobicContact CG-CG1 4.31Å; I231-E233 HydrophobicContact CG2-CG 3.7Å; I231-E233 PolarHBondContact O-N 3.35Å
232	R	91.8	Very high	86.4	Confident	44 Å²	44	78.8 Å²	78.8	17%	0.166	39%	0.39	C	S	.	.			trans	-91.8	63	-177.1	-67.2	-64.9	-56.7	-76.2	0.3	111.9	R187 T188 Q230 D234 L235 L256	R187-R232 HydrophobicContact CB-CG 4.18Å; T188-R232 PolarHBondContact O-N 2.94Å; Q230-R232 PolarHBondContact O-N 3.45Å; R232-D234 VanDerWaalsContact C-OD1 3.31Å; R232-D234 VanDerWaalsContact CA-OD1 3.27Å; R232-D234 WeakPolarHBondContact CA-OD1 3.18Å; R232-D234 WeakPolarHBondContact CD-OD1 3.46Å; R232-D234 IonicContact CZ-OD1 2.7Å; R232-D234 IonicContact CZ-OD2 3.82Å; R232-D234 IonicContact NE-OD1 3.79Å; R232-D234 PolarHBondContact NE-OD1 3.41Å; R232-D234 IonicContact NE-OD2 2.79Å; R232-D234 PolarHBondContact NE-OD2 3.33Å; R232-D234 IonicContact NH2-OD1 2.69Å; R232-D234 IonicContact NH2-OD2 2.85Å; R232-D234 PolarHBondContact NH2-OD2 3.34Å; R232-D234 PolarHBondContact O-N 3.04Å; R232-L235 HydrophobicContact CB-CD1 3.7Å; R232-L235 HydrophobicContact CB-CG 4.06Å; R232-L235 HydrophobicContact CG-CD1 4.48Å; R232-L235 PolarHBondContact O-N 2.81Å; R232-L256 HydrophobicContact CB-CD2 3.81Å; R232-L256 HydrophobicContact CG-CD2 3.8Å
233	E	86.6	Confident	86	Confident	95 Å²	95	78.3 Å²	78.3	44%	0.444	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-66.8	-17.7	176.2	-62.2	-158.2	134.9	0	0	112.8	K192 E208 I231 L235 I236	K192-E233 IonicContact NZ-OE1 3.91Å; K192-E233 PolarHBondContact NZ-OE1 3.38Å; E208-E233 VanDerWaalsContact OE2-OE1 3.1Å; I231-E233 HydrophobicContact CG2-CG 3.7Å; I231-E233 PolarHBondContact O-N 3.35Å; E233-L235 PolarHBondContact O-N 3.45Å; E233-L235 VanDerWaalsContact O-N 3.15Å; E233-I236 HydrophobicContact CB-CD1 4.3Å; E233-I236 HydrophobicContact CG-CD1 4.42Å; E233-I236 WeakPolarHBondContact O-CB 3.43Å; E233-I236 WeakPolarHBondContact O-CG1 3.45Å; E233-I236 PolarHBondContact O-N 3.23Å
234	D	86.4	Confident	85.8	Confident	109 Å²	109	73.4 Å²	73.4	58%	0.583	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-62.8	-16	173.6	62.1	-62.5	0	0	0	114	R232 I236	R232-D234 VanDerWaalsContact C-OD1 3.31Å; R232-D234 VanDerWaalsContact CA-OD1 3.27Å; R232-D234 WeakPolarHBondContact CA-OD1 3.18Å; R232-D234 WeakPolarHBondContact CD-OD1 3.46Å; R232-D234 IonicContact CZ-OD1 2.7Å; R232-D234 IonicContact CZ-OD2 3.82Å; R232-D234 IonicContact NE-OD1 3.79Å; R232-D234 PolarHBondContact NE-OD1 3.41Å; R232-D234 IonicContact NE-OD2 2.79Å; R232-D234 PolarHBondContact NE-OD2 3.33Å; R232-D234 IonicContact NH2-OD1 2.69Å; R232-D234 IonicContact NH2-OD2 2.85Å; R232-D234 PolarHBondContact NH2-OD2 3.34Å; R232-D234 PolarHBondContact O-N 3.04Å; D234-I236 VanDerWaalsContact C-N 3.35Å
235	L	85.5	Confident	85.5	Confident	39 Å²	39	69 Å²	69	20%	0.204	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-84.3	-13	176.2	-60.4	175.7	0	0	0	112.9	R232 E233 F250 I255 L256	R232-L235 HydrophobicContact CB-CD1 3.7Å; R232-L235 HydrophobicContact CB-CG 4.06Å; R232-L235 HydrophobicContact CG-CD1 4.48Å; R232-L235 PolarHBondContact O-N 2.81Å; E233-L235 PolarHBondContact O-N 3.45Å; E233-L235 VanDerWaalsContact O-N 3.15Å; L235-F250 HydrophobicContact CB-CE2 4.3Å; L235-F250 HydrophobicContact CD1-CD2 4.43Å; L235-I255 HydrophobicContact CD1-CG2 3.67Å; L235-I255 HydrophobicContact CD2-CG2 3.9Å; L235-I255 HydrophobicContact CG-CG2 4.46Å; L235-L256 HydrophobicContact CD1-CD2 3.79Å; L235-L256 HydrophobicContact CD1-CG 4.18Å
236	I	83.4	Confident	85.2	Confident	49 Å²	49	71.7 Å²	71.7	25%	0.251	36%	0.362	S	S	.	.	S	Bend	trans	-80.2	125.4	179.2	-47.5	-173.5	0	0	0	107.5	L189 E233 D234 E240 V242	L189-I236 HydrophobicContact CD1-CD1 4.17Å; L189-I236 HydrophobicContact CD1-CG1 4.33Å; E233-I236 HydrophobicContact CB-CD1 4.3Å; E233-I236 HydrophobicContact CG-CD1 4.42Å; E233-I236 WeakPolarHBondContact O-CB 3.43Å; E233-I236 WeakPolarHBondContact O-CG1 3.45Å; E233-I236 PolarHBondContact O-N 3.23Å; D234-I236 VanDerWaalsContact C-N 3.35Å; I236-E240 VanDerWaalsContact CG2-O 3.28Å; I236-E240 WeakPolarHBondContact CG2-O 3.45Å; I236-V242 HydrophobicContact CB-CG2 4.06Å; I236-V242 HydrophobicContact CD1-CG2 3.71Å; I236-V242 HydrophobicContact CG1-CG2 3.46Å; I236-V242 VanDerWaalsContact CG1-CG2 3.46Å; I236-V242 HydrophobicContact CG2-CG2 3.76Å
237	K	77.1	Confident	85.1	Confident	144 Å²	144	67.7 Å²	67.7	63%	0.626	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-71.5	142.8	171.4	-65.5	-177.1	-163.1	151.8	0	109.2	D239 E240	K237-D239 PolarHBondContact O-N 3.18Å; K237-E240 HydrophobicContact CB-CB 4.49Å; K237-E240 IonicContact NZ-OE2 3.26Å; K237-E240 PolarHBondContact O-N 3.38Å
238	D	63.4	Low	84.9	Confident	163 Å²	163	67.3 Å²	67.3	87%	0.872	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	126.3	177.3	-64.3	-37.8	0	0	0	110.5	E240	D238-E240 PolarHBondContact O-N 2.85Å
239	D	61.3	Low	84.8	Confident	177 Å²	177	67.5 Å²	67.5	95%	0.947	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	3.2	177.2	-140.6	29.4	0	0	0	117.2	K237	K237-D239 PolarHBondContact O-N 3.18Å
240	E	70.2	Confident	84.8	Confident	119 Å²	119	67.3 Å²	67.3	56%	0.556	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-102.6	134.6	174.5	-72	-178.2	177.1	0	0	112.5	I236 K237 D238	I236-E240 VanDerWaalsContact CG2-O 3.28Å; I236-E240 WeakPolarHBondContact CG2-O 3.45Å; K237-E240 HydrophobicContact CB-CB 4.49Å; K237-E240 IonicContact NZ-OE2 3.26Å; K237-E240 PolarHBondContact O-N 3.38Å; D238-E240 PolarHBondContact O-N 2.85Å
241	E	72.5	Confident	84.7	Confident	101 Å²	101	63.3 Å²	63.3	47%	0.472	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-81.5	130.9	170	-72.1	-177.2	-157.5	0	0	109.9	S243 G437 K441	E241-S243 PolarHBondContact O-N 3.23Å; E241-G437 WeakPolarHBondContact OE2-CA 3.44Å; E241-K441 VanDerWaalsContact OE1-CE 3.31Å; E241-K441 WeakPolarHBondContact OE1-CE 3.28Å; E241-K441 IonicContact OE1-NZ 3.47Å; E241-K441 PolarHBondContact OE1-NZ 3.41Å
242	V	84.4	Confident	84.6	Confident	19 Å²	19	62 Å²	62	12%	0.115	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-74.3	125.9	-177.8	-178.9	0	0	0	0	110.8	L189 I236 D246 I247	L189-V242 HydrophobicContact CD2-CG1 3.94Å; L189-V242 HydrophobicContact CD2-CG2 4.37Å; L189-V242 HydrophobicContact CG-CG1 4.48Å; I236-V242 HydrophobicContact CB-CG2 4.06Å; I236-V242 HydrophobicContact CD1-CG2 3.71Å; I236-V242 HydrophobicContact CG1-CG2 3.46Å; I236-V242 VanDerWaalsContact CG1-CG2 3.46Å; I236-V242 HydrophobicContact CG2-CG2 3.76Å; V242-D246 HydrophobicContact CG1-CB 4.25Å; V242-I247 HydrophobicContact CG1-CD1 3.87Å; V242-I247 HydrophobicContact CG1-CG1 3.53Å
243	S	88.3	Confident	84.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.007	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-85	160	173	78.2	0	0	0	0	112.7	E241 V245 D246 I247 Y416	E241-S243 PolarHBondContact O-N 3.23Å; S243-V245 PolarHBondContact O-N 3.05Å; S243-V245 PolarHBondContact OG-N 3.1Å; S243-D246 WeakPolarHBondContact CB-OD2 3.24Å; S243-D246 PolarHBondContact N-OD2 3.04Å; S243-D246 PolarHBondContact O-N 3.25Å; S243-D246 PolarHBondContact OG-N 3.21Å; S243-D246 VanDerWaalsContact OG-N 3.12Å; S243-D246 PolarHBondContact OG-OD2 3.11Å; S243-I247 WeakPolarHBondContact O-CG1 3.33Å; S243-I247 PolarHBondContact O-N 3.26Å; S243-Y416 VanDerWaalsContact CB-CE2 3.44Å; S243-Y416 WeakPolarHBondContact CB-OH 3.5Å; S243-Y416 PolarHBondContact OG-OH 3.44Å
244	F	89.6	Confident	84.8	Confident	37 Å²	37	63 Å²	63	16%	0.162	32%	0.321	C	S	.	.	H	α-helix	trans	-60.5	-26.8	170.6	75.8	-81.1	0	0	0	113	T248 C261 E262 R264 Y416 Y436	F244-T248 WeakPolarHBondContact O-CB 3.45Å; F244-T248 PolarHBondContact O-N 3.39Å; F244-T248 PolarHBondContact O-OG1 3Å; F244-C261 HydrophobicContact CB-CB 4.18Å; F244-E262 WeakPolarHBondContact CD2-O 3.47Å; F244-R264 HydrophobicContact CD2-CB 4.32Å; F244-R264 HydrophobicContact CE2-CB 3.89Å; F244-R264 HydrophobicContact CE2-CG 4.32Å; F244-Y416 HydrophobicContact CE1-CD2 4.05Å; F244-Y416 HydrophobicContact CE1-CG 4.3Å; F244-Y436 HydrophobicContact CD1-CD2 4.24Å; F244-Y436 AromaticContact CD1-CE2 3.62Å; F244-Y436 HydrophobicContact CD1-CE2 3.62Å; F244-Y436 HydrophobicContact CE1-CD2 4.45Å; F244-Y436 HydrophobicContact CE1-CE2 4.05Å
245	V	90.1	Very high	85.2	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-43.3	177.5	178.8	0	0	0	0	110.6	S243 I247 T248 N249 Y416	S243-V245 PolarHBondContact O-N 3.05Å; S243-V245 PolarHBondContact OG-N 3.1Å; V245-I247 VanDerWaalsContact C-N 3.35Å; V245-I247 PolarHBondContact O-N 2.96Å; V245-T248 PolarHBondContact O-N 2.86Å; V245-N249 VanDerWaalsContact O-CG 3.31Å; V245-N249 PolarHBondContact O-N 2.64Å; V245-N249 PolarHBondContact O-ND2 3.07Å; V245-Y416 HydrophobicContact CB-CD1 4.05Å; V245-Y416 HydrophobicContact CB-CE1 3.7Å; V245-Y416 HydrophobicContact CG1-CD1 4.34Å; V245-Y416 HydrophobicContact CG1-CE1 3.97Å; V245-Y416 HydrophobicContact CG2-CD1 3.42Å; V245-Y416 VanDerWaalsContact CG2-CD1 3.42Å; V245-Y416 HydrophobicContact CG2-CD2 4.12Å; V245-Y416 HydrophobicContact CG2-CE1 3.61Å; V245-Y416 HydrophobicContact CG2-CE2 4.3Å; V245-Y416 HydrophobicContact CG2-CG 3.68Å
246	D	91.2	Very high	85.6	Confident	57 Å²	57	58.7 Å²	58.7	31%	0.305	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-43	177	-58.5	-48.2	0	0	0	111	V242 S243 T248 N249 F250	V242-D246 HydrophobicContact CG1-CB 4.25Å; S243-D246 WeakPolarHBondContact CB-OD2 3.24Å; S243-D246 PolarHBondContact N-OD2 3.04Å; S243-D246 PolarHBondContact O-N 3.25Å; S243-D246 PolarHBondContact OG-N 3.21Å; S243-D246 VanDerWaalsContact OG-N 3.12Å; S243-D246 PolarHBondContact OG-OD2 3.11Å; D246-T248 VanDerWaalsContact C-N 3.34Å; D246-T248 PolarHBondContact O-N 2.88Å; D246-N249 WeakPolarHBondContact O-CB 3.48Å; D246-N249 PolarHBondContact O-N 2.74Å; D246-N249 VanDerWaalsContact O-N 3.16Å; D246-F250 HydrophobicContact CB-CE2 4.12Å; D246-F250 HydrophobicContact CB-CZ 4.49Å; D246-F250 WeakPolarHBondContact O-CD2 3.24Å; D246-F250 VanDerWaalsContact O-CG 3.24Å; D246-F250 WeakPolarHBondContact O-CG 3.47Å; D246-F250 PolarHBondContact O-N 3.02Å
247	I	93.3	Very high	86.2	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-43.6	176.6	-61.5	167.6	0	0	0	110.8	L189 S190 D191 V242 S243 V245 N249 F250 T251 L256 C261	L189-I247 HydrophobicContact CB-CG1 4.38Å; L189-I247 HydrophobicContact CD2-CG1 4.1Å; L189-I247 HydrophobicContact CG-CD1 4.41Å; L189-I247 HydrophobicContact CG-CG1 4.2Å; S190-I247 VanDerWaalsContact C-CD1 3.44Å; D191-I247 HydrophobicContact CB-CD1 4.06Å; D191-I247 VanDerWaalsContact N-CD1 3.33Å; V242-I247 HydrophobicContact CG1-CD1 3.87Å; V242-I247 HydrophobicContact CG1-CG1 3.53Å; S243-I247 WeakPolarHBondContact O-CG1 3.33Å; S243-I247 PolarHBondContact O-N 3.26Å; V245-I247 VanDerWaalsContact C-N 3.35Å; V245-I247 PolarHBondContact O-N 2.96Å; I247-N249 VanDerWaalsContact C-N 3.27Å; I247-N249 PolarHBondContact O-N 2.66Å; I247-F250 PolarHBondContact O-N 3.3Å; I247-T251 PolarHBondContact O-N 3.11Å; I247-T251 PolarHBondContact O-OG1 3.03Å; I247-L256 HydrophobicContact CG2-CD1 4.13Å; I247-C261 HydrophobicContact CD1-CB 4.15Å; I247-C261 VanDerWaalsContact CG2-SG 3.51Å
248	T	92.4	Very high	87.1	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-36.5	176.9	-57.1	0	0	0	0	111.6	F244 V245 D246 T251 S252 R264	F244-T248 WeakPolarHBondContact O-CB 3.45Å; F244-T248 PolarHBondContact O-N 3.39Å; F244-T248 PolarHBondContact O-OG1 3Å; V245-T248 PolarHBondContact O-N 2.86Å; D246-T248 VanDerWaalsContact C-N 3.34Å; D246-T248 PolarHBondContact O-N 2.88Å; T248-T251 PolarHBondContact O-OG1 3.31Å; T248-S252 VanDerWaalsContact O-CB 3.29Å; T248-S252 WeakPolarHBondContact O-CB 3.32Å; T248-S252 PolarHBondContact O-N 2.95Å; T248-S252 PolarHBondContact O-OG 3.03Å; T248-R264 HydrophobicContact CG2-CB 4.33Å; T248-R264 PolarHBondContact OG1-N 3.08Å
249	N	91.8	Very high	88.7	Confident	72 Å²	72	42.3 Å²	42.3	39%	0.385	22%	0.217	S	C	.	.	H	α-helix	trans	-69.2	-41.8	174.6	-71.1	-26.7	0	0	0	111.9	V245 D246 I247 S252 N253	V245-N249 VanDerWaalsContact O-CG 3.31Å; V245-N249 PolarHBondContact O-N 2.64Å; V245-N249 PolarHBondContact O-ND2 3.07Å; D246-N249 WeakPolarHBondContact O-CB 3.48Å; D246-N249 PolarHBondContact O-N 2.74Å; D246-N249 VanDerWaalsContact O-N 3.16Å; I247-N249 VanDerWaalsContact C-N 3.27Å; I247-N249 PolarHBondContact O-N 2.66Å; N249-S252 PolarHBondContact O-N 2.81Å; N249-N253 WeakPolarHBondContact O-CB 3.47Å; N249-N253 PolarHBondContact O-N 3.36Å; N249-N253 PolarHBondContact O-ND2 3.12Å
250	F	93.6	Very high	90.3	Very high	47 Å²	47	33.9 Å²	33.9	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-38.4	177.6	-64.2	-35.8	0	0	0	112.9	L189 L235 D246 I247 N253 D254 I255 L256	L189-F250 HydrophobicContact CD2-CD2 4.1Å; L189-F250 HydrophobicContact CD2-CE2 4.21Å; L235-F250 HydrophobicContact CB-CE2 4.3Å; L235-F250 HydrophobicContact CD1-CD2 4.43Å; D246-F250 HydrophobicContact CB-CE2 4.12Å; D246-F250 HydrophobicContact CB-CZ 4.49Å; D246-F250 WeakPolarHBondContact O-CD2 3.24Å; D246-F250 VanDerWaalsContact O-CG 3.24Å; D246-F250 WeakPolarHBondContact O-CG 3.47Å; D246-F250 PolarHBondContact O-N 3.02Å; I247-F250 PolarHBondContact O-N 3.3Å; F250-N253 PolarHBondContact O-N 3.43Å; F250-D254 PolarHBondContact O-N 2.9Å; F250-I255 HydrophobicContact CB-CB 4.36Å; F250-I255 HydrophobicContact CD1-CD1 4.01Å; F250-I255 WeakPolarHBondContact O-CB 3.31Å; F250-I255 PolarHBondContact O-N 2.81Å; F250-L256 HydrophobicContact CB-CD1 3.69Å; F250-L256 HydrophobicContact CB-CG 3.91Å; F250-L256 HydrophobicContact CD2-CD1 4.29Å; F250-L256 HydrophobicContact CG-CD1 4.48Å; F250-L256 PolarHBondContact O-N 3.08Å
251	T	93.5	Very high	91.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.4	-39.7	173.6	55.7	0	0	0	0	111.6	I247 T248 N253 D254 L256 P491	I247-T251 PolarHBondContact O-N 3.11Å; I247-T251 PolarHBondContact O-OG1 3.03Å; T248-T251 PolarHBondContact O-OG1 3.31Å; T251-N253 PolarHBondContact O-N 3.45Å; T251-D254 PolarHBondContact O-N 3.16Å; T251-D254 VanDerWaalsContact O-N 3.15Å; T251-L256 HydrophobicContact CG2-CB 3.72Å; T251-L256 HydrophobicContact CG2-CD1 4.4Å; T251-P491 HydrophobicContact CG2-CB 3.9Å; T251-P491 VanDerWaalsContact OG1-CB 3.32Å; T251-P491 WeakPolarHBondContact OG1-CB 3.25Å
252	S	90.3	Very high	92.3	Very high	15 Å²	15	24.5 Å²	24.5	11%	0.105	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-26	177.4	-65	0	0	0	0	113.4	T248 N249 A273 R494	T248-S252 VanDerWaalsContact O-CB 3.29Å; T248-S252 WeakPolarHBondContact O-CB 3.32Å; T248-S252 PolarHBondContact O-N 2.95Å; T248-S252 PolarHBondContact O-OG 3.03Å; N249-S252 PolarHBondContact O-N 2.81Å; S252-A273 WeakPolarHBondContact OG-CB 3.37Å; S252-R494 PolarHBondContact O-NE 3.3Å
253	N	91.4	Very high	92.6	Very high	106 Å²	106	23.8 Å²	23.8	57%	0.567	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	17.5	177.7	-68.1	-32.3	0	0	0	113.4	N249 F250 T251 I255	N249-N253 WeakPolarHBondContact O-CB 3.47Å; N249-N253 PolarHBondContact O-N 3.36Å; N249-N253 PolarHBondContact O-ND2 3.12Å; F250-N253 PolarHBondContact O-N 3.43Å; T251-N253 PolarHBondContact O-N 3.45Å; N253-I255 HydrophobicContact CB-CD1 4.31Å; N253-I255 HydrophobicContact CB-CG1 4.25Å; N253-I255 PolarHBondContact O-N 3.05Å; N253-I255 VanDerWaalsContact O-N 3.1Å
254	D	90.7	Very high	92.5	Very high	55 Å²	55	26.1 Å²	26.1	29%	0.294	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	14.4	175.4	-61.4	-45.5	0	0	0	116.1	R187 F250 T251 R493	R187-D254 PolarHBondContact NH1-O 2.68Å; R187-D254 PolarHBondContact NH2-O 2.93Å; F250-D254 PolarHBondContact O-N 2.9Å; T251-D254 PolarHBondContact O-N 3.16Å; T251-D254 VanDerWaalsContact O-N 3.15Å; D254-R493 HydrophobicContact CB-CG 4.26Å; D254-R493 VanDerWaalsContact CB-NE 3.29Å; D254-R493 VanDerWaalsContact CG-NE 3.28Å; D254-R493 WeakPolarHBondContact OD1-CD 3.37Å; D254-R493 WeakPolarHBondContact OD1-CG 3.22Å; D254-R493 IonicContact OD1-CZ 3.05Å; D254-R493 IonicContact OD1-NE 3.39Å; D254-R493 PolarHBondContact OD1-NE 3.5Å
255	I	94.1	Very high	92.1	Very high	58 Å²	58	26 Å²	26	30%	0.297	14%	0.135	S	C	.	.	S	Bend	trans	-78.3	-39.4	179.8	-55.5	178.3	0	0	0	110.8	R187 L235 F250 N253	R187-I255 PolarHBondContact NH1-O 3.49Å; R187-I255 VanDerWaalsContact NH1-O 3.16Å; L235-I255 HydrophobicContact CD1-CG2 3.67Å; L235-I255 HydrophobicContact CD2-CG2 3.9Å; L235-I255 HydrophobicContact CG-CG2 4.46Å; F250-I255 HydrophobicContact CB-CB 4.36Å; F250-I255 HydrophobicContact CD1-CD1 4.01Å; F250-I255 WeakPolarHBondContact O-CB 3.31Å; F250-I255 PolarHBondContact O-N 2.81Å; N253-I255 HydrophobicContact CB-CD1 4.31Å; N253-I255 HydrophobicContact CB-CG1 4.25Å; N253-I255 PolarHBondContact O-N 3.05Å; N253-I255 VanDerWaalsContact O-N 3.1Å
256	L	95.4	Very high	91.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.			trans	-112.1	148.9	177	-64.7	178.5	0	0	0	110.3	R187 L189 R232 L235 I247 F250 T251 R493	R187-L256 HydrophobicContact CB-CD2 4.44Å; L189-L256 HydrophobicContact CB-CD1 3.55Å; L189-L256 HydrophobicContact CB-CD2 4.25Å; L189-L256 HydrophobicContact CD2-CD1 4.29Å; R232-L256 HydrophobicContact CB-CD2 3.81Å; R232-L256 HydrophobicContact CG-CD2 3.8Å; L235-L256 HydrophobicContact CD1-CD2 3.79Å; L235-L256 HydrophobicContact CD1-CG 4.18Å; I247-L256 HydrophobicContact CG2-CD1 4.13Å; F250-L256 HydrophobicContact CB-CD1 3.69Å; F250-L256 HydrophobicContact CB-CG 3.91Å; F250-L256 HydrophobicContact CD2-CD1 4.29Å; F250-L256 HydrophobicContact CG-CD1 4.48Å; F250-L256 PolarHBondContact O-N 3.08Å; T251-L256 HydrophobicContact CG2-CB 3.72Å; T251-L256 HydrophobicContact CG2-CD1 4.4Å; L256-R493 WeakPolarHBondContact O-CB 3.27Å
257	D	95.5	Very high	90.1	Very high	12 Å²	12	32 Å²	32	6%	0.064	16%	0.163	C	C	.	.	S	Bend	trans	-85.8	-48.2	176.5	-61.7	-47.4	0	0	0	111.1	I186 R187 R493 L496	I186-D257 HydrophobicContact CG2-CB 4.18Å; R187-D257 VanDerWaalsContact CB-OD2 3.31Å; R187-D257 WeakPolarHBondContact CB-OD2 3.32Å; R187-D257 WeakPolarHBondContact CG-OD2 3.31Å; R187-D257 IonicContact CZ-OD1 2.79Å; R187-D257 IonicContact CZ-OD2 3.1Å; R187-D257 PolarHBondContact N-OD2 3.48Å; R187-D257 IonicContact NE-OD1 3.01Å; R187-D257 PolarHBondContact NE-OD1 3.38Å; R187-D257 IonicContact NE-OD2 2.91Å; R187-D257 PolarHBondContact NE-OD2 2.88Å; R187-D257 IonicContact NH2-OD1 2.7Å; R187-D257 PolarHBondContact NH2-OD1 3.38Å; R187-D257 IonicContact NH2-OD2 3.47Å; R187-D257 PolarHBondContact O-N 3.12Å; D257-R493 PolarHBondContact O-N 2.91Å; D257-L496 HydrophobicContact CB-CD1 4.02Å
258	I	96.8	Very high	89.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	125.7	-179.9	-56	-177.8	0	0	0	109.3	I186 R187 T188 I218 F221 I490 L492 L496 Y498 F502	I186-I258 HydrophobicContact CG2-CD1 4.28Å; I186-I258 HydrophobicContact CG2-CG1 4.34Å; R187-I258 PolarHBondContact O-N 2.64Å; T188-I258 VanDerWaalsContact CA-O 3.3Å; T188-I258 WeakPolarHBondContact CA-O 2.88Å; T188-I258 WeakPolarHBondContact CB-O 3.2Å; T188-I258 HydrophobicContact CG2-CB 4.42Å; T188-I258 WeakPolarHBondContact CG2-O 3.35Å; I218-I258 HydrophobicContact CD1-CG2 3.76Å; I218-I258 HydrophobicContact CG1-CG2 4.36Å; F221-I258 HydrophobicContact CD1-CD1 4.44Å; F221-I258 HydrophobicContact CE1-CD1 4.31Å; I258-I490 HydrophobicContact CG2-CG2 3.95Å; I258-L492 HydrophobicContact CB-CD2 4.28Å; I258-L492 HydrophobicContact CD1-CD2 4.47Å; I258-L492 HydrophobicContact CG1-CD2 3.89Å; I258-L492 HydrophobicContact CG2-CD2 3.95Å; I258-L496 HydrophobicContact CD1-CD2 4.43Å; I258-L496 HydrophobicContact CG1-CD2 4.15Å; I258-Y498 HydrophobicContact CD1-CE2 4.09Å; I258-F502 HydrophobicContact CD1-CD1 4.39Å; I258-F502 HydrophobicContact CD1-CD2 3.92Å; I258-F502 HydrophobicContact CD1-CE1 4.47Å; I258-F502 HydrophobicContact CD1-CE2 4.02Å; I258-F502 HydrophobicContact CD1-CG 4.12Å; I258-F502 HydrophobicContact CD1-CZ 4.29Å; I258-F502 HydrophobicContact CG2-CE1 4.41Å; I258-F502 HydrophobicContact CG2-CZ 4.09Å
259	G	95.6	Very high	88.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.2	170.9	0	0	0	0	0	111.5	C261 I490 P491	G259-C261 VanDerWaalsContact C-N 3.3Å; G259-C261 PolarHBondContact O-N 2.93Å; G259-I490 WeakPolarHBondContact O-CG2 3.25Å; G259-P491 PolarHBondContact N-O 3.43Å
260	I	95.3	Very high	87.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	65.7	174.3	-43.9	-178.1	0	0	0	108.3	L189 S190 T197 F210 V214 I218 M229	L189-I260 WeakPolarHBondContact O-CB 3.46Å; L189-I260 PolarHBondContact O-N 3.23Å; S190-I260 WeakPolarHBondContact CA-O 3.25Å; S190-I260 PolarHBondContact OG-O 3.35Å; S190-I260 VanDerWaalsContact OG-O 3.09Å; T197-I260 HydrophobicContact CG2-CB 4.4Å; T197-I260 HydrophobicContact CG2-CG2 3.38Å; T197-I260 WeakPolarHBondContact CG2-O 3.41Å; F210-I260 HydrophobicContact CD2-CD1 3.42Å; F210-I260 VanDerWaalsContact CD2-CD1 3.42Å; F210-I260 HydrophobicContact CE2-CD1 3.6Å; F210-I260 HydrophobicContact CG-CD1 4.24Å; V214-I260 HydrophobicContact CG1-CG2 3.92Å; I218-I260 HydrophobicContact CD1-CB 3.97Å; I218-I260 HydrophobicContact CD1-CG1 3.68Å; I218-I260 HydrophobicContact CD1-CG2 3.96Å; I218-I260 HydrophobicContact CG2-CD1 4.46Å; I218-I260 HydrophobicContact CG2-CG1 4.43Å; M229-I260 HydrophobicContact SD-CD1 4.3Å
261	C	93.5	Very high	87.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-161.6	-176.6	177.8	62.4	0	0	0	0	110	D191 F244 I247 G259 P491	D191-C261 HydrophobicContact CB-CB 3.95Å; D191-C261 WeakPolarHBondContact OD2-CB 3.38Å; F244-C261 HydrophobicContact CB-CB 4.18Å; I247-C261 HydrophobicContact CD1-CB 4.15Å; I247-C261 VanDerWaalsContact CG2-SG 3.51Å; G259-C261 VanDerWaalsContact C-N 3.3Å; G259-C261 PolarHBondContact O-N 2.93Å; C261-P491 VanDerWaalsContact O-CD 3.32Å; C261-P491 WeakPolarHBondContact O-CD 3.44Å
262	E	91.6	Very high	86.8	Confident	23 Å²	23	44.2 Å²	44.2	11%	0.107	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-85.1	139.6	167.8	175.1	162.2	-130.7	0	0	110.7	R196 F244 L488 S489	R196-E262 IonicContact CZ-OE2 3.76Å; R196-E262 VanDerWaalsContact NH1-CB 3.27Å; R196-E262 IonicContact NH1-OE2 2.72Å; R196-E262 PolarHBondContact NH1-OE2 3.19Å; F244-E262 WeakPolarHBondContact CD2-O 3.47Å; E262-L488 HydrophobicContact CB-CD1 4.47Å; E262-L488 HydrophobicContact CB-CG 4.08Å; E262-L488 HydrophobicContact CG-CG 3.99Å; E262-L488 VanDerWaalsContact OE1-CA 3.28Å; E262-L488 WeakPolarHBondContact OE1-CA 2.98Å; E262-L488 VanDerWaalsContact OE1-CB 3.31Å; E262-L488 WeakPolarHBondContact OE1-CB 3.44Å; E262-L488 WeakPolarHBondContact OE1-CG 3.43Å; E262-S489 CarbonylContact C-O 3.58Å
263	A	91.1	Very high	86.8	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.025	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-77.9	143.2	178	0	0	0	0	0	112.1	T265 I274 S489 P491	A263-T265 PolarHBondContact O-N 3.37Å; A263-I274 HydrophobicContact CB-CB 4.2Å; A263-I274 HydrophobicContact CB-CG2 3.44Å; A263-I274 VanDerWaalsContact CB-CG2 3.44Å; A263-S489 WeakPolarHBondContact CB-O 3.39Å; A263-S489 PolarHBondContact N-O 2.83Å; A263-P491 HydrophobicContact CB-CB 4.49Å; A263-P491 HydrophobicContact CB-CG 3.8Å
264	R	86.5	Confident	86.9	Confident	51 Å²	51	39.2 Å²	39.2	19%	0.192	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-69.2	118.4	168.4	-174.1	-177.8	-172.9	-148.1	4.1	109.6	F244 T248 E267 M268 E419	F244-R264 HydrophobicContact CD2-CB 4.32Å; F244-R264 HydrophobicContact CE2-CB 3.89Å; F244-R264 HydrophobicContact CE2-CG 4.32Å; T248-R264 HydrophobicContact CG2-CB 4.33Å; T248-R264 PolarHBondContact OG1-N 3.08Å; R264-E267 IonicContact CZ-OE2 3.23Å; R264-E267 VanDerWaalsContact CZ-OE2 3.29Å; R264-E267 IonicContact NH1-OE2 2.7Å; R264-E267 PolarHBondContact NH1-OE2 2.55Å; R264-E267 IonicContact NH2-OE1 3.39Å; R264-E267 IonicContact NH2-OE2 3.69Å; R264-E267 PolarHBondContact NH2-OE2 3.2Å; R264-M268 WeakPolarHBondContact O-CG 3.33Å; R264-E419 IonicContact CZ-OE1 2.87Å; R264-E419 IonicContact CZ-OE2 2.79Å; R264-E419 IonicContact NE-OE2 2.9Å; R264-E419 IonicContact NH2-OE1 3.92Å; R264-E419 PolarHBondContact NH2-OE1 3.23Å; R264-E419 IonicContact NH2-OE2 3.98Å; R264-E419 PolarHBondContact NH2-OE2 3.48Å
265	T	80.1	Confident	87	Confident	33 Å²	33	36.8 Å²	36.8	20%	0.202	19%	0.19	C	C	.	.			trans	-110	-30.9	-176.7	52.1	0	0	0	0	114.4	A263 E267 M268 I274	A263-T265 PolarHBondContact O-N 3.37Å; T265-E267 PolarHBondContact O-N 2.84Å; T265-M268 PolarHBondContact O-N 2.88Å; T265-M268 VanDerWaalsContact O-N 3.16Å; T265-I274 HydrophobicContact CG2-CD1 4.4Å
266	L	72.9	Confident	86.8	Confident	79 Å²	79	40.8 Å²	40.8	41%	0.414	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-38.6	-168.6	-170.3	69.7	0	0	0	114.6	E419 F420	L266-E419 HydrophobicContact CD2-CB 3.97Å; L266-F420 HydrophobicContact CB-CE1 4.38Å; L266-F420 HydrophobicContact CB-CZ 4.12Å; L266-F420 HydrophobicContact CD1-CD1 4.21Å; L266-F420 HydrophobicContact CD1-CE1 3.87Å; L266-F420 HydrophobicContact CD1-CZ 4.46Å; L266-F420 HydrophobicContact CD2-CD1 3.81Å; L266-F420 HydrophobicContact CD2-CD2 3.93Å; L266-F420 HydrophobicContact CD2-CE1 3.8Å; L266-F420 HydrophobicContact CD2-CE2 3.94Å; L266-F420 HydrophobicContact CD2-CG 3.89Å; L266-F420 HydrophobicContact CD2-CZ 3.89Å; L266-F420 HydrophobicContact CG-CE1 4.24Å; L266-F420 HydrophobicContact CG-CZ 4.38Å
267	E	67.9	Low	86.6	Confident	114 Å²	114	42.6 Å²	42.6	53%	0.533	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	10	-179	-65.1	-164.6	158.8	0	0	113.8	R264 T265 S269 E419	R264-E267 IonicContact CZ-OE2 3.23Å; R264-E267 VanDerWaalsContact CZ-OE2 3.29Å; R264-E267 IonicContact NH1-OE2 2.7Å; R264-E267 PolarHBondContact NH1-OE2 2.55Å; R264-E267 IonicContact NH2-OE1 3.39Å; R264-E267 IonicContact NH2-OE2 3.69Å; R264-E267 PolarHBondContact NH2-OE2 3.2Å; T265-E267 PolarHBondContact O-N 2.84Å; E267-S269 PolarHBondContact O-N 3.46Å; E267-E419 VanDerWaalsContact OE1-CD 3.32Å
268	M	73.3	Confident	86.4	Confident	38 Å²	38	42.2 Å²	42.2	19%	0.187	21%	0.212	C	C	.	.			trans	-74.4	116.7	-179.3	-78.1	-168.2	106.1	0	0	111	R264 T265 N270 Y271 A273 I274	R264-M268 WeakPolarHBondContact O-CG 3.33Å; T265-M268 PolarHBondContact O-N 2.88Å; T265-M268 VanDerWaalsContact O-N 3.16Å; M268-N270 VanDerWaalsContact C-N 3.28Å; M268-N270 WeakPolarHBondContact CE-O 3.24Å; M268-Y271 HydrophobicContact CB-CD1 4.18Å; M268-Y271 HydrophobicContact CB-CE1 3.94Å; M268-Y271 HydrophobicContact SD-CD1 4.2Å; M268-A273 HydrophobicContact CE-CB 4.28Å; M268-I274 HydrophobicContact CE-CG2 3.76Å; M268-I274 HydrophobicContact SD-CD1 4.46Å; M268-I274 HydrophobicContact SD-CG2 3.6Å
269	S	70.8	Confident	86.1	Confident	128 Å²	128	43.1 Å²	43.1	90%	0.895	22%	0.217	S	C	*	.	S	Bend	trans	-75.6	-19.6	166.6	59.6	0	0	0	0	112.7	E267	E267-S269 PolarHBondContact O-N 3.46Å
270	N	78.8	Confident	85.9	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.23	24%	0.244	C	C	.	.			trans	-143.4	135.5	-178.1	-174.1	1.4	0	0	0	111	Y102 M268 D272	Y102-N270 PolarHBondContact OH-ND2 3.24Å; M268-N270 VanDerWaalsContact C-N 3.28Å; M268-N270 WeakPolarHBondContact CE-O 3.24Å; N270-D272 PolarHBondContact ND2-OD2 3.14Å; N270-D272 WeakPolarHBondContact OD1-CB 3.37Å; N270-D272 PolarHBondContact OD1-N 3.09Å; N270-D272 PolarHBondContact OD1-OD1 3.05Å; N270-D272 PolarHBondContact OD1-OD2 3.23Å; N270-D272 VanDerWaalsContact OD1-OD2 3.08Å
271	Y	85.9	Confident	85.8	Confident	132 Å²	132	49.3 Å²	49.3	52%	0.518	25%	0.249	S	C	.	.			trans	-100.3	8.3	-179.2	-58.4	-70.3	0	0	0	113.9	M268 A273 I274	M268-Y271 HydrophobicContact CB-CD1 4.18Å; M268-Y271 HydrophobicContact CB-CE1 3.94Å; M268-Y271 HydrophobicContact SD-CD1 4.2Å; Y271-A273 PolarHBondContact O-N 3.45Å; Y271-A273 VanDerWaalsContact O-N 3.15Å; Y271-I274 HydrophobicContact CD1-CD1 3.47Å; Y271-I274 VanDerWaalsContact CD1-CD1 3.47Å; Y271-I274 HydrophobicContact CD1-CG1 4.14Å; Y271-I274 HydrophobicContact CE1-CD1 4.36Å; Y271-I274 HydrophobicContact CG-CD1 4.19Å; Y271-I274 WeakPolarHBondContact O-CG1 3.4Å; Y271-I274 PolarHBondContact O-N 3.37Å
272	D	86.3	Confident	85.8	Confident	39 Å²	39	50.6 Å²	50.6	21%	0.209	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.3	179.9	-67.6	-21.6	0	0	0	112.9	Y102 M106 N270 R499	Y102-D272 WeakPolarHBondContact CE2-OD2 3.37Å; M106-D272 HydrophobicContact CE-CB 4.05Å; M106-D272 HydrophobicContact SD-CB 4Å; N270-D272 PolarHBondContact ND2-OD2 3.14Å; N270-D272 WeakPolarHBondContact OD1-CB 3.37Å; N270-D272 PolarHBondContact OD1-N 3.09Å; N270-D272 PolarHBondContact OD1-OD1 3.05Å; N270-D272 PolarHBondContact OD1-OD2 3.23Å; N270-D272 VanDerWaalsContact OD1-OD2 3.08Å; D272-R499 PolarHBondContact O-NH1 2.95Å
273	A	89.8	Confident	85.9	Confident	4 Å²	4	51.1 Å²	51.1	3%	0.033	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	15.9	-179.6	0	0	0	0	0	114.4	S252 M268 Y271 L492 R494	S252-A273 WeakPolarHBondContact OG-CB 3.37Å; M268-A273 HydrophobicContact CE-CB 4.28Å; Y271-A273 PolarHBondContact O-N 3.45Å; Y271-A273 VanDerWaalsContact O-N 3.15Å; A273-L492 CarbonylContact C-O 3.41Å; A273-L492 VanDerWaalsContact C-O 3.27Å; A273-L492 VanDerWaalsContact CA-O 3.31Å; A273-L492 WeakPolarHBondContact CA-O 3.38Å; A273-L492 PolarHBondContact O-N 2.74Å; A273-R494 HydrophobicContact CB-CG 3.93Å
274	I	92.8	Very high	86.2	Confident	11 Å²	11	51 Å²	51	6%	0.056	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-131.6	153.3	176.5	64.3	160.4	0	0	0	110.8	A263 T265 M268 Y271 I490 R499	A263-I274 HydrophobicContact CB-CB 4.2Å; A263-I274 HydrophobicContact CB-CG2 3.44Å; A263-I274 VanDerWaalsContact CB-CG2 3.44Å; T265-I274 HydrophobicContact CG2-CD1 4.4Å; M268-I274 HydrophobicContact CE-CG2 3.76Å; M268-I274 HydrophobicContact SD-CD1 4.46Å; M268-I274 HydrophobicContact SD-CG2 3.6Å; Y271-I274 HydrophobicContact CD1-CD1 3.47Å; Y271-I274 VanDerWaalsContact CD1-CD1 3.47Å; Y271-I274 HydrophobicContact CD1-CG1 4.14Å; Y271-I274 HydrophobicContact CE1-CD1 4.36Å; Y271-I274 HydrophobicContact CG-CD1 4.19Å; Y271-I274 WeakPolarHBondContact O-CG1 3.4Å; Y271-I274 PolarHBondContact O-N 3.37Å; I274-I490 CarbonylContact C-O 3.52Å; I274-I490 WeakPolarHBondContact CA-O 3.21Å; I274-R499 PolarHBondContact O-NH2 3.38Å
275	S	93.8	Very high	86.6	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.028	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-71.9	166.4	175.5	76	0	0	0	0	112.5	S489 I490 E503	S275-S489 WeakPolarHBondContact O-CB 3.35Å; S275-S489 PolarHBondContact O-OG 2.98Å; S275-I490 PolarHBondContact N-O 3.47Å; S275-I490 PolarHBondContact OG-N 2.88Å; S275-E503 WeakPolarHBondContact CA-OE1 3.47Å
276	Y	90.2	Very high	87.3	Confident	142 Å²	142	47 Å²	47	56%	0.557	24%	0.239	S	C	*	.	S	Bend	trans	-50.3	143.9	159.4	-167.2	-95.5	0	0	0	111.4	Y278 E503 L507	Y276-Y278 PolarHBondContact O-N 3.25Å; Y276-Y278 VanDerWaalsContact O-N 3.15Å; Y276-E503 PolarHBondContact N-OE1 3.49Å; Y276-E503 VanDerWaalsContact N-OE1 3.08Å; Y276-L507 HydrophobicContact CD1-CD2 4.06Å; Y276-L507 HydrophobicContact CE1-CD2 4.23Å
277	P	91.1	Very high	88.4	Confident	38 Å²	38	43.3 Å²	43.3	25%	0.247	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-49.1	116.5	177.3	-35	40.3	0	0	0	113.9	I487	P277-I487 HydrophobicContact CB-CG2 3.51Å; P277-I487 HydrophobicContact CG-CG2 3.71Å
278	Y	90.3	Very high	89.7	Confident	4 Å²	4	38 Å²	38	2%	0.016	20%	0.195	C	C	.	.			trans	-81.9	-53.9	178.6	-175.7	-144.7	0	0	0	111.3	Y213 L217 Y276 L488 M506 K510 T515	Y213-Y278 HydrophobicContact CD2-CE1 4.25Å; L217-Y278 HydrophobicContact CD2-CD1 4.04Å; L217-Y278 HydrophobicContact CD2-CD2 4.48Å; L217-Y278 HydrophobicContact CD2-CE1 3.66Å; L217-Y278 HydrophobicContact CD2-CE2 4.15Å; L217-Y278 HydrophobicContact CD2-CG 4.44Å; Y276-Y278 PolarHBondContact O-N 3.25Å; Y276-Y278 VanDerWaalsContact O-N 3.15Å; Y278-L488 WeakPolarHBondContact CB-O 3.45Å; Y278-L488 HydrophobicContact CD1-CD2 4.05Å; Y278-L488 PolarHBondContact N-O 3.35Å; Y278-M506 HydrophobicContact CD2-CB 4.37Å; Y278-M506 HydrophobicContact CD2-CE 4Å; Y278-M506 HydrophobicContact CG-CE 3.85Å; Y278-K510 HydrophobicContact CE2-CB 4.35Å; Y278-K510 WeakPolarHBondContact O-CD 3.38Å; Y278-K510 WeakPolarHBondContact O-CE 3.32Å; Y278-K510 PolarHBondContact O-NZ 3.19Å; Y278-T515 HydrophobicContact CE1-CG2 4.02Å; Y278-T515 HydrophobicContact CE2-CG2 4.21Å; Y278-T515 WeakPolarHBondContact OH-CB 3.3Å; Y278-T515 WeakPolarHBondContact OH-CG2 3.3Å; Y278-T515 PolarHBondContact OH-OG1 2.82Å
279	L	91.8	Very high	90.5	Very high	19 Å²	19	38.7 Å²	38.7	10%	0.099	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	156.3	-178.3	-67.2	174.2	0	0	0	110.7	Y213 L457 L488 T515 I519	Y213-L279 HydrophobicContact CD2-CD1 3.83Å; Y213-L279 HydrophobicContact CE2-CD1 3.78Å; L279-L457 HydrophobicContact CB-CD1 4.12Å; L279-L457 HydrophobicContact CD1-CD1 3.75Å; L279-L457 HydrophobicContact CD1-CD2 4.46Å; L279-L488 HydrophobicContact CB-CB 4.17Å; L279-L488 PolarHBondContact N-O 2.89Å; L279-L488 PolarHBondContact O-N 3.29Å; L279-T515 HydrophobicContact CD1-CG2 3.84Å; L279-T515 HydrophobicContact CD2-CG2 3.89Å; L279-T515 HydrophobicContact CG-CG2 4.23Å; L279-I519 HydrophobicContact CD1-CD1 4.26Å
280	M	91	Very high	91.3	Very high	115 Å²	115	33.3 Å²	33.3	57%	0.567	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.4	171.6	-66.6	167.2	177.2	0	0	107.4	F485 D486	M280-F485 HydrophobicContact CB-CE2 4.25Å; M280-F485 HydrophobicContact CE-CZ 3.79Å; M280-F485 HydrophobicContact CG-CE2 4.09Å; M280-F485 HydrophobicContact CG-CZ 3.91Å; M280-F485 HydrophobicContact SD-CE2 3.79Å; M280-F485 HydrophobicContact SD-CZ 3.59Å; M280-F485 VanDerWaalsContact SD-CZ 3.59Å; M280-D486 CarbonylContact C-O 3.49Å; M280-D486 WeakPolarHBondContact CA-O 3.21Å
281	S	92.4	Very high	91.5	Very high	15 Å²	15	34.5 Å²	34.5	11%	0.105	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	178.6	179.2	-151.4	0	0	0	0	110.1	A456 L457 D486	S281-A456 WeakPolarHBondContact OG-CB 3.4Å; S281-A456 PolarHBondContact OG-N 2.86Å; S281-L457 PolarHBondContact OG-N 3.4Å; S281-D486 PolarHBondContact N-O 3Å; S281-D486 PolarHBondContact O-N 2.79Å
282	S	94	Very high	91.3	Very high	28 Å²	28	31.4 Å²	31.4	20%	0.196	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.2	162	53.9	0	0	0	0	108.1	T455 A456 Y476 Q484	S282-T455 CarbonylContact O-C 3.49Å; S282-T455 VanDerWaalsContact O-CA 3.27Å; S282-T455 WeakPolarHBondContact O-CA 3.39Å; S282-A456 PolarHBondContact O-N 3.41Å; S282-Y476 PolarHBondContact O-OH 3.44Å; S282-Y476 VanDerWaalsContact O-OH 3.08Å; S282-Y476 PolarHBondContact OG-OH 3.44Å; S282-Q484 WeakPolarHBondContact CB-O 3.34Å
283	Y	93.9	Very high	91.2	Very high	34 Å²	34	31.9 Å²	31.9	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	88.5	177.6	-164.5	-162.9	0	0	0	109.9	E417 P453 V454 T455 C481 L482 N483	Y283-E417 HydrophobicContact CE1-CG 4.06Å; Y283-E417 PolarHBondContact OH-OE1 3.44Å; Y283-P453 HydrophobicContact CD2-CB 4.44Å; Y283-P453 HydrophobicContact CE2-CB 3.85Å; Y283-V454 VanDerWaalsContact CD2-C 3.44Å; Y283-T455 HydrophobicContact CD2-CG2 3.84Å; Y283-T455 HydrophobicContact CE2-CG2 4.13Å; Y283-T455 HydrophobicContact CG-CG2 4.32Å; Y283-C481 WeakPolarHBondContact O-CB 3.47Å; Y283-L482 HydrophobicContact CD1-CB 4.15Å; Y283-L482 HydrophobicContact CD1-CD1 4.11Å; Y283-L482 HydrophobicContact CE1-CD1 3.95Å; Y283-L482 HydrophobicContact CG-CB 4.48Å; Y283-L482 PolarHBondContact O-N 2.91Å; Y283-N483 PolarHBondContact N-O 3.32Å; Y283-N483 PolarHBondContact O-N 3.29Å; Y283-N483 VanDerWaalsContact O-N 3.15Å
284	C	95.8	Very high	90.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-163.2	-173.6	-45.6	0	0	0	0	110.6	P453 V454 Y476 C477 C481	C284-P453 CarbonylContact O-C 3.47Å; C284-P453 VanDerWaalsContact O-CA 3.29Å; C284-P453 WeakPolarHBondContact O-CA 3.04Å; C284-V454 PolarHBondContact N-O 3.43Å; C284-V454 PolarHBondContact O-N 3.37Å; C284-Y476 HydrophobicContact CB-CE1 4.29Å; C284-Y476 HydrophobicContact CB-CE2 3.98Å; C284-Y476 WeakPolarHBondContact CB-OH 3.28Å; C284-Y476 PolarHBondContact SG-OH 3.31Å; C284-C477 WeakPolarHBondContact CB-O 3.42Å; C284-C481 HydrophobicContact CB-CB 3.77Å; C284-C481 WeakPolarHBondContact CB-SG 3.22Å; C284-C481 WeakPolarHBondContact SG-CB 3.14Å; C284-C481 CovalentContact SG-SG 2.03Å; C284-C481 PolarHBondContact SG-SG 2.82Å
285	F	95.7	Very high	90.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.7	-170.9	-65.4	-86.4	0	0	0	112.7	A287 F401 M411 L451 F452 P453 C477 F480 L482	F285-A287 PolarHBondContact O-N 2.79Å; F285-F401 AromaticContact CE2-CE1 3.77Å; F285-F401 HydrophobicContact CE2-CE1 3.77Å; F285-F401 HydrophobicContact CE2-CZ 4.11Å; F285-F401 HydrophobicContact CZ-CE1 4.02Å; F285-M411 HydrophobicContact CD1-CG 4.46Å; F285-M411 HydrophobicContact CE1-CE 3.77Å; F285-M411 HydrophobicContact CE1-CG 3.71Å; F285-M411 HydrophobicContact CE1-SD 3.51Å; F285-M411 VanDerWaalsContact CE1-SD 3.51Å; F285-M411 HydrophobicContact CE2-CE 4.34Å; F285-M411 HydrophobicContact CZ-CE 3.58Å; F285-M411 HydrophobicContact CZ-CG 4.4Å; F285-M411 HydrophobicContact CZ-SD 3.6Å; F285-M411 VanDerWaalsContact CZ-SD 3.6Å; F285-L451 HydrophobicContact CD1-CB 4.24Å; F285-F452 CarbonylContact C-O 3.55Å; F285-F452 WeakPolarHBondContact CA-O 3.33Å; F285-P453 HydrophobicContact CD1-CB 4.24Å; F285-P453 HydrophobicContact CE1-CB 4.01Å; F285-P453 HydrophobicContact CE1-CG 4.39Å; F285-C477 HydrophobicContact CB-CB 4.44Å; F285-C477 PolarHBondContact N-O 2.89Å; F285-C477 WeakPolarHBondContact O-CB 3.37Å; F285-C477 PolarHBondContact O-N 2.9Å; F285-F480 AromaticContact CD2-CD2 3.54Å; F285-F480 HydrophobicContact CD2-CD2 3.54Å; F285-F480 AromaticContact CD2-CE2 3.28Å; F285-F480 HydrophobicContact CD2-CE2 3.28Å; F285-F480 HydrophobicContact CD2-CZ 4.18Å; F285-F480 AromaticContact CE2-CD2 3.57Å; F285-F480 HydrophobicContact CE2-CD2 3.57Å; F285-F480 AromaticContact CE2-CE2 3.55Å; F285-F480 HydrophobicContact CE2-CE2 3.55Å; F285-F480 AromaticContact CG-CE2 3.97Å; F285-F480 HydrophobicContact CG-CE2 3.97Å; F285-F480 HydrophobicContact CZ-CE2 4.4Å; F285-L482 HydrophobicContact CE2-CD2 4.38Å; F285-L482 HydrophobicContact CE2-CG 4.32Å; F285-L482 HydrophobicContact CZ-CD2 3.77Å; F285-L482 HydrophobicContact CZ-CG 3.87Å
286	M	95.9	Very high	89.9	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	106.7	155.2	164.2	173.5	176.4	0	0	107.4	F446 F452 V454 W459 I462 F474	M286-F446 HydrophobicContact CE-CD1 3.44Å; M286-F446 VanDerWaalsContact CE-CD1 3.44Å; M286-F446 HydrophobicContact CE-CE1 3.48Å; M286-F446 VanDerWaalsContact CE-CE1 3.48Å; M286-F446 HydrophobicContact CE-CG 4.36Å; M286-F446 HydrophobicContact CE-CZ 4.41Å; M286-F452 HydrophobicContact CB-CB 4.41Å; M286-F452 PolarHBondContact N-O 3.49Å; M286-F452 PolarHBondContact O-N 3.28Å; M286-F452 VanDerWaalsContact O-N 3.1Å; M286-V454 HydrophobicContact CB-CG1 4Å; M286-V454 HydrophobicContact CB-CG2 3.67Å; M286-W459 HydrophobicContact CB-CE3 4.17Å; M286-W459 HydrophobicContact CB-CZ3 4.08Å; M286-W459 HydrophobicContact CG-CE3 4.27Å; M286-W459 HydrophobicContact CG-CZ3 3.74Å; M286-W459 HydrophobicContact SD-CE3 4.4Å; M286-W459 HydrophobicContact SD-CZ3 4.03Å; M286-I462 HydrophobicContact CE-CG2 3.89Å; M286-I462 HydrophobicContact SD-CD1 3.83Å; M286-I462 HydrophobicContact SD-CG2 3.79Å; M286-F474 HydrophobicContact CE-CB 3.71Å; M286-F474 HydrophobicContact CE-CD1 3.58Å; M286-F474 HydrophobicContact CE-CD2 3.36Å; M286-F474 HydrophobicContact CE-CE1 3.99Å; M286-F474 HydrophobicContact CE-CE2 3.81Å; M286-F474 HydrophobicContact CE-CG 3.25Å; M286-F474 HydrophobicContact CE-CZ 4.1Å; M286-F474 HydrophobicContact CG-CB 3.8Å; M286-F474 HydrophobicContact CG-CD1 3.39Å; M286-F474 HydrophobicContact CG-CE1 4.16Å; M286-F474 HydrophobicContact CG-CG 3.76Å; M286-F474 HydrophobicContact SD-CD1 4.32Å; M286-F474 HydrophobicContact SD-CG 4.36Å
287	A	95.7	Very high	89.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	138.9	-176.9	0	0	0	0	0	111	F285 L398 L451 F474 Y475 C477	F285-A287 PolarHBondContact O-N 2.79Å; A287-L398 HydrophobicContact CB-CD1 4.46Å; A287-L451 HydrophobicContact CB-CD2 3.54Å; A287-F474 CarbonylContact O-C 3.49Å; A287-F474 WeakPolarHBondContact O-CA 3.4Å; A287-F474 WeakPolarHBondContact O-CB 3.4Å; A287-F474 WeakPolarHBondContact O-CD1 3.3Å; A287-Y475 HydrophobicContact CB-CD1 4.26Å; A287-Y475 HydrophobicContact CB-CE1 3.71Å; A287-Y475 HydrophobicContact CB-CE2 4.31Å; A287-Y475 PolarHBondContact N-O 2.65Å; A287-Y475 VanDerWaalsContact O-CD1 3.31Å; A287-Y475 WeakPolarHBondContact O-CD1 3.48Å; A287-Y475 PolarHBondContact O-N 3.16Å; A287-C477 HydrophobicContact CB-CB 4.1Å
288	P	94.2	Very high	89.5	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.019	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	142.2	171.9	-20.8	30.3	0	0	0	110.1	Y409 T448 Y450 I473 F474 Y475	P288-Y409 HydrophobicContact CB-CD1 4.48Å; P288-Y409 HydrophobicContact CB-CE1 3.82Å; P288-Y409 HydrophobicContact CG-CD1 3.9Å; P288-Y409 HydrophobicContact CG-CE1 3.74Å; P288-T448 HydrophobicContact CB-CG2 4.46Å; P288-T448 WeakPolarHBondContact CG-O 3.16Å; P288-Y450 WeakPolarHBondContact CD-O 3.15Å; P288-Y450 WeakPolarHBondContact CG-O 3.2Å; P288-I473 CarbonylContact C-O 3.54Å; P288-I473 WeakPolarHBondContact CA-O 3.31Å; P288-F474 HydrophobicContact CB-CD1 4.41Å; P288-F474 HydrophobicContact CB-CE1 4.2Å; P288-F474 HydrophobicContact CG-CD1 4.15Å; P288-F474 HydrophobicContact CG-CE1 3.61Å; P288-F474 HydrophobicContact CG-CZ 4.22Å; P288-F474 VanDerWaalsContact N-CD1 3.3Å; P288-Y475 WeakPolarHBondContact O-CE1 3.39Å
289	L	91.1	Very high	89.3	Confident	52 Å²	52	33.5 Å²	33.5	27%	0.272	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-60	136.3	171.4	-84.5	156.1	0	0	0	109.2	K472 I473 Y475	L289-K472 VanDerWaalsContact CD1-C 3.47Å; L289-K472 HydrophobicContact CD1-CB 3.8Å; L289-K472 WeakPolarHBondContact CD1-O 3.39Å; L289-I473 PolarHBondContact N-O 3.3Å; L289-Y475 HydrophobicContact CD2-CD1 4.04Å; L289-Y475 HydrophobicContact CG-CD1 4.18Å
290	P	87.3	Confident	88.9	Confident	16 Å²	16	37.5 Å²	37.5	10%	0.104	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-61	147.7	178	-14.8	26.9	0	0	0	110.1	I394 E395 R397	P290-I394 HydrophobicContact CB-CG2 3.77Å; P290-I394 HydrophobicContact CG-CG2 4.13Å; P290-I394 WeakPolarHBondContact O-CG2 3.33Å; P290-E395 HydrophobicContact CB-CB 3.67Å; P290-E395 WeakPolarHBondContact CB-O 3.44Å; P290-E395 WeakPolarHBondContact CG-O 3.48Å; P290-R397 HydrophobicContact CG-CG 3.98Å
291	D	82.3	Confident	88.6	Confident	68 Å²	68	34.6 Å²	34.6	36%	0.364	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-66.3	148.1	178.8	-68.7	-14.6	0	0	0	109.6	E395 R408	D291-E395 PolarHBondContact O-N 3.25Å; D291-E395 VanDerWaalsContact O-N 3.08Å; D291-R408 IonicContact OD1-CZ 2.64Å; D291-R408 IonicContact OD1-NH1 3.74Å; D291-R408 IonicContact OD1-NH2 3.29Å; D291-R408 PolarHBondContact OD1-NH2 3.35Å; D291-R408 IonicContact OD2-CZ 3.89Å; D291-R408 IonicContact OD2-NH1 3.38Å; D291-R408 PolarHBondContact OD2-NH1 3.02Å; D291-R408 IonicContact OD2-NH2 3.74Å; D291-R408 PolarHBondContact OD2-NH2 3.36Å
292	S	82.8	Confident	88.2	Confident	66 Å²	66	34.6 Å²	34.6	46%	0.462	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-73	147	166.2	51.1	0	0	0	0	110.4
293	L	83.2	Confident	87.6	Confident	50 Å²	50	35.6 Å²	35.6	26%	0.262	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-54.3	132.5	170.7	-78.2	168.6	0	0	0	110.7	P392 P393	L293-P392 WeakPolarHBondContact O-CB 3.31Å; L293-P393 HydrophobicContact CD1-CB 3.78Å; L293-P393 HydrophobicContact CD1-CG 3.7Å; L293-P393 PolarHBondContact N-O 2.93Å
294	P	83.3	Confident	86.9	Confident	64 Å²	64	35.6 Å²	35.6	42%	0.416	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-63.7	143.2	178.6	27.2	-34.2	0	0	0	109.9	S296 D297 V298	P294-S296 PolarHBondContact O-N 2.51Å; P294-D297 HydrophobicContact CG-CB 4.09Å; P294-D297 VanDerWaalsContact CG-OD2 3.31Å; P294-D297 WeakPolarHBondContact CG-OD2 3.46Å; P294-D297 PolarHBondContact O-N 2.8Å; P294-V298 PolarHBondContact O-N 3.24Å
295	F	83.1	Confident	86.4	Confident	64 Å²	64	40.4 Å²	40.4	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-57.6	-25.4	-177.9	-75.2	-71.9	0	0	0	113.6	D297 Y299 L389 P392 N550	F295-D297 VanDerWaalsContact C-N 3.29Å; F295-D297 PolarHBondContact O-N 2.9Å; F295-Y299 WeakPolarHBondContact O-CE2 3.28Å; F295-L389 HydrophobicContact CD1-CD2 3.95Å; F295-L389 HydrophobicContact CE1-CD2 4.28Å; F295-P392 HydrophobicContact CZ-CG 4.45Å; F295-N550 HydrophobicContact CB-CB 4.04Å
296	S	83.3	Confident	85.9	Confident	19 Å²	19	44.3 Å²	44.3	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-40.4	173.1	57.5	0	0	0	0	112.8	P294 N550	P294-S296 PolarHBondContact O-N 2.51Å; S296-N550 WeakPolarHBondContact CA-O 3.28Å
297	D	86	Confident	85.4	Confident	61 Å²	61	46.7 Å²	46.7	33%	0.326	28%	0.279	S	S	.	.	H	α-helix	trans	-89.9	-16.4	-170.3	-64.1	-15.7	0	0	0	112.1	P294 F295 Y299 M300 A301 W553	P294-D297 HydrophobicContact CG-CB 4.09Å; P294-D297 VanDerWaalsContact CG-OD2 3.31Å; P294-D297 WeakPolarHBondContact CG-OD2 3.46Å; P294-D297 PolarHBondContact O-N 2.8Å; F295-D297 VanDerWaalsContact C-N 3.29Å; F295-D297 PolarHBondContact O-N 2.9Å; D297-Y299 PolarHBondContact O-N 3.48Å; D297-M300 PolarHBondContact O-N 2.89Å; D297-A301 WeakPolarHBondContact O-CB 2.98Å; D297-A301 PolarHBondContact O-N 3.49Å; D297-W553 PolarHBondContact OD1-NE1 3.34Å
298	V	87.5	Confident	84.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-51.2	-42.2	174.8	168.3	0	0	0	0	111.9	P294 M300 A301 I302 L385 F388	P294-V298 PolarHBondContact O-N 3.24Å; V298-M300 VanDerWaalsContact C-N 3.26Å; V298-M300 PolarHBondContact O-N 3.15Å; V298-A301 PolarHBondContact O-N 3.05Å; V298-I302 HydrophobicContact CG1-CD1 4.28Å; V298-I302 WeakPolarHBondContact O-CD1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.22Å; V298-I302 PolarHBondContact O-N 2.9Å; V298-L385 HydrophobicContact CG1-CD1 4.14Å; V298-F388 HydrophobicContact CG1-CB 3.57Å; V298-F388 HydrophobicContact CG1-CD2 4.14Å; V298-F388 HydrophobicContact CG1-CG 4.4Å
299	Y	85.2	Confident	84.6	Confident	28 Å²	28	56.3 Å²	56.3	11%	0.11	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-31.2	-179.1	-63.8	-79.1	0	0	0	113.3	F295 D297 L385 N550 L551 V554	F295-Y299 WeakPolarHBondContact O-CE2 3.28Å; D297-Y299 PolarHBondContact O-N 3.48Å; Y299-L385 HydrophobicContact CD1-CD1 3.88Å; Y299-L385 HydrophobicContact CE1-CD1 3.77Å; Y299-L385 HydrophobicContact CE1-CD2 4.34Å; Y299-N550 WeakPolarHBondContact CE2-O 3.41Å; Y299-L551 HydrophobicContact CE1-CD2 4.3Å; Y299-L551 HydrophobicContact CE2-CD2 3.98Å; Y299-L551 WeakPolarHBondContact OH-CD2 3.5Å; Y299-V554 HydrophobicContact CD1-CG2 4Å; Y299-V554 HydrophobicContact CD2-CG2 4.3Å; Y299-V554 HydrophobicContact CE1-CG2 4.49Å; Y299-V554 HydrophobicContact CG-CG2 3.89Å
300	M	83.9	Confident	84.4	Confident	103 Å²	103	59.2 Å²	59.2	51%	0.507	34%	0.342	S	S	.	.	H	α-helix	trans	-89.4	-34.2	178.5	-66.6	-58.4	-63.6	0	0	111.9	D297 V298 I302 V303 W553	D297-M300 PolarHBondContact O-N 2.89Å; V298-M300 VanDerWaalsContact C-N 3.26Å; V298-M300 PolarHBondContact O-N 3.15Å; M300-I302 VanDerWaalsContact C-N 3.28Å; M300-I302 PolarHBondContact O-N 3.44Å; M300-V303 PolarHBondContact O-N 2.79Å; M300-W553 HydrophobicContact CG-CB 4.18Å; M300-W553 HydrophobicContact CG-CD2 4.46Å; M300-W553 HydrophobicContact CG-CG 4.08Å
301	A	83.2	Confident	84.4	Confident	54 Å²	54	61 Å²	61	45%	0.446	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-29.8	-177.3	0	0	0	0	0	113.8	D297 V298 V303	D297-A301 WeakPolarHBondContact O-CB 2.98Å; D297-A301 PolarHBondContact O-N 3.49Å; V298-A301 PolarHBondContact O-N 3.05Å; A301-V303 VanDerWaalsContact C-N 3.26Å; A301-V303 PolarHBondContact O-N 3.45Å
302	I	84.5	Confident	84.7	Confident	16 Å²	16	62.6 Å²	62.6	8%	0.082	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.2	179.9	-63.8	160.3	0	0	0	111.7	V298 M300 Y381 Y384 L385 F388	V298-I302 HydrophobicContact CG1-CD1 4.28Å; V298-I302 WeakPolarHBondContact O-CD1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.22Å; V298-I302 PolarHBondContact O-N 2.9Å; M300-I302 VanDerWaalsContact C-N 3.28Å; M300-I302 PolarHBondContact O-N 3.44Å; I302-Y381 HydrophobicContact CB-CD2 4.28Å; I302-Y381 HydrophobicContact CB-CE2 4.05Å; I302-Y381 HydrophobicContact CD1-CE2 4.22Å; I302-Y381 HydrophobicContact CG2-CD2 3.55Å; I302-Y381 HydrophobicContact CG2-CE2 3.84Å; I302-Y381 HydrophobicContact CG2-CG 4.45Å; I302-Y384 HydrophobicContact CG2-CG 4.48Å; I302-L385 HydrophobicContact CD1-CB 3.76Å; I302-L385 HydrophobicContact CD1-CD1 3.71Å; I302-L385 HydrophobicContact CD1-CG 4.36Å; I302-F388 HydrophobicContact CD1-CD2 4.26Å; I302-F388 HydrophobicContact CG1-CD2 3.6Å; I302-F388 HydrophobicContact CG1-CE2 3.8Å
303	V	81.1	Confident	85	Confident	48 Å²	48	63.7 Å²	63.7	29%	0.291	36%	0.356	S	S	.	.	S	Bend	trans	-103.2	90.1	-171	-174.7	0	0	0	0	110	M300 A301 L308 Y381	M300-V303 PolarHBondContact O-N 2.79Å; A301-V303 VanDerWaalsContact C-N 3.26Å; A301-V303 PolarHBondContact O-N 3.45Å; V303-L308 HydrophobicContact CG1-CD1 3.58Å; V303-L308 HydrophobicContact CG1-CD2 3.66Å; V303-L308 HydrophobicContact CG1-CG 3.37Å; V303-Y381 HydrophobicContact CG2-CD2 3.91Å; V303-Y381 HydrophobicContact CG2-CE2 3.7Å
304	A	80.9	Confident	85.3	Confident	35 Å²	35	64 Å²	64	29%	0.289	36%	0.357	S	S	.	.			trans	-62.7	138.8	175.3	0	0	0	0	0	111.2	S306 I307 L308	A304-S306 PolarHBondContact O-N 3.04Å; A304-S306 VanDerWaalsContact O-N 3.14Å; A304-I307 HydrophobicContact CB-CD1 3.89Å; A304-I307 HydrophobicContact CB-CG1 4.09Å; A304-I307 WeakPolarHBondContact O-CB 3.34Å; A304-I307 PolarHBondContact O-N 2.94Å; A304-L308 PolarHBondContact O-N 3.1Å
305	P	85.1	Confident	85.6	Confident	100 Å²	100	61.9 Å²	61.9	65%	0.649	34%	0.341	S	S	*	.	H	α-helix	trans	-55.8	-34.5	179.6	-27.6	34.4	0	0	0	113.8	I307 L308 I309	P305-I307 VanDerWaalsContact C-N 3.31Å; P305-I307 PolarHBondContact O-N 3.15Å; P305-L308 PolarHBondContact O-N 3.46Å; P305-I309 VanDerWaalsContact O-CG1 3.31Å; P305-I309 WeakPolarHBondContact O-CG1 3.36Å; P305-I309 PolarHBondContact O-N 2.85Å
306	S	85.2	Confident	86	Confident	83 Å²	83	60.5 Å²	60.5	58%	0.58	34%	0.34	S	S	*	.	H	α-helix	trans	-61.5	-37.6	176	52.1	0	0	0	0	112.8	A304 I309 M310	A304-S306 PolarHBondContact O-N 3.04Å; A304-S306 VanDerWaalsContact O-N 3.14Å; S306-I309 PolarHBondContact O-N 3.41Å; S306-M310 PolarHBondContact O-N 2.91Å
307	I	84	Confident	86.3	Confident	51 Å²	51	64 Å²	64	26%	0.262	36%	0.356	S	S	.	.	H	α-helix	trans	-69.9	-42	178.8	-63.4	172.6	0	0	0	110	A304 P305 I309 M310 F311 M380	A304-I307 HydrophobicContact CB-CD1 3.89Å; A304-I307 HydrophobicContact CB-CG1 4.09Å; A304-I307 WeakPolarHBondContact O-CB 3.34Å; A304-I307 PolarHBondContact O-N 2.94Å; P305-I307 VanDerWaalsContact C-N 3.31Å; P305-I307 PolarHBondContact O-N 3.15Å; I307-I309 VanDerWaalsContact C-N 3.33Å; I307-I309 PolarHBondContact O-N 3.07Å; I307-M310 WeakPolarHBondContact O-CB 3.34Å; I307-M310 PolarHBondContact O-N 2.87Å; I307-F311 HydrophobicContact CG2-CD2 3.6Å; I307-F311 HydrophobicContact CG2-CE2 3.28Å; I307-F311 HydrophobicContact CG2-CZ 4.33Å; I307-F311 WeakPolarHBondContact O-CD2 3.44Å; I307-F311 PolarHBondContact O-N 3.23Å; I307-M380 HydrophobicContact CD1-CE 4.22Å
308	L	85	Confident	86.4	Confident	99 Å²	99	61.8 Å²	61.8	52%	0.518	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-41.8	174.2	-75.2	169.8	0	0	0	112.3	V303 A304 P305 M310 F311 L312	V303-L308 HydrophobicContact CG1-CD1 3.58Å; V303-L308 HydrophobicContact CG1-CD2 3.66Å; V303-L308 HydrophobicContact CG1-CG 3.37Å; A304-L308 PolarHBondContact O-N 3.1Å; P305-L308 PolarHBondContact O-N 3.46Å; L308-M310 VanDerWaalsContact C-N 3.34Å; L308-F311 PolarHBondContact O-N 3.33Å; L308-L312 WeakPolarHBondContact O-CB 3.49Å; L308-L312 PolarHBondContact O-N 2.81Å
309	I	88.9	Confident	86.5	Confident	106 Å²	106	61.8 Å²	61.8	54%	0.544	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-44.2	176.1	-67.5	164.8	0	0	0	110.2	P305 S306 I307 L312 I313	P305-I309 VanDerWaalsContact O-CG1 3.31Å; P305-I309 WeakPolarHBondContact O-CG1 3.36Å; P305-I309 PolarHBondContact O-N 2.85Å; S306-I309 PolarHBondContact O-N 3.41Å; I307-I309 VanDerWaalsContact C-N 3.33Å; I307-I309 PolarHBondContact O-N 3.07Å; I309-L312 PolarHBondContact O-N 3.36Å; I309-I313 HydrophobicContact CG2-CD1 3.91Å; I309-I313 VanDerWaalsContact O-CG1 3.3Å; I309-I313 WeakPolarHBondContact O-CG1 3.24Å; I309-I313 PolarHBondContact O-N 2.82Å
310	M	86.5	Confident	86.6	Confident	112 Å²	112	63 Å²	63	55%	0.552	36%	0.355	S	S	*	.	H	α-helix	trans	-59.7	-47.8	175.4	-171.9	-148.6	-81	0	0	111.2	S306 I307 L308 L312 I313 I314	S306-M310 PolarHBondContact O-N 2.91Å; I307-M310 WeakPolarHBondContact O-CB 3.34Å; I307-M310 PolarHBondContact O-N 2.87Å; L308-M310 VanDerWaalsContact C-N 3.34Å; M310-L312 VanDerWaalsContact C-N 3.3Å; M310-L312 PolarHBondContact O-N 3.18Å; M310-I313 PolarHBondContact O-N 3.43Å; M310-I313 VanDerWaalsContact O-N 3.17Å; M310-I314 HydrophobicContact CG-CD1 3.91Å; M310-I314 HydrophobicContact CG-CG1 4.42Å; M310-I314 WeakPolarHBondContact O-CG1 3.44Å; M310-I314 PolarHBondContact O-N 2.7Å; M310-I314 HydrophobicContact SD-CD1 3.91Å
311	F	86.5	Confident	86.8	Confident	55 Å²	55	61.6 Å²	61.6	24%	0.241	35%	0.349	C	S	.	.	H	α-helix	trans	-59.5	-41.1	177.4	-80.4	-57.4	0	0	0	112.5	I307 L308 I314 F315 F348 S377	I307-F311 HydrophobicContact CG2-CD2 3.6Å; I307-F311 HydrophobicContact CG2-CE2 3.28Å; I307-F311 HydrophobicContact CG2-CZ 4.33Å; I307-F311 WeakPolarHBondContact O-CD2 3.44Å; I307-F311 PolarHBondContact O-N 3.23Å; L308-F311 PolarHBondContact O-N 3.33Å; F311-I314 PolarHBondContact O-N 3.47Å; F311-F315 WeakPolarHBondContact O-CB 3.45Å; F311-F315 PolarHBondContact O-N 2.65Å; F311-F348 HydrophobicContact CD1-CD1 4.38Å; F311-F348 HydrophobicContact CD1-CE1 4.26Å; F311-S377 WeakPolarHBondContact CE1-OG 3.37Å; F311-S377 WeakPolarHBondContact CZ-OG 3.35Å
312	L	88.9	Confident	86.9	Confident	100 Å²	100	59.1 Å²	59.1	52%	0.524	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-42.5	176.2	-172.5	150.3	0	0	0	111.4	L308 I309 M310 F315 C316	L308-L312 WeakPolarHBondContact O-CB 3.49Å; L308-L312 PolarHBondContact O-N 2.81Å; I309-L312 PolarHBondContact O-N 3.36Å; M310-L312 VanDerWaalsContact C-N 3.3Å; M310-L312 PolarHBondContact O-N 3.18Å; L312-F315 WeakPolarHBondContact O-CB 3.34Å; L312-F315 PolarHBondContact O-N 3.43Å; L312-C316 PolarHBondContact O-N 3.37Å; L312-C316 PolarHBondContact O-SG 3.45Å
313	I	90.4	Very high	86.9	Confident	90 Å²	90	58.9 Å²	58.9	46%	0.462	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-48.9	176.6	-68.3	165	0	0	0	110.7	I309 M310 F315 C316 I317	I309-I313 HydrophobicContact CG2-CD1 3.91Å; I309-I313 VanDerWaalsContact O-CG1 3.3Å; I309-I313 WeakPolarHBondContact O-CG1 3.24Å; I309-I313 PolarHBondContact O-N 2.82Å; M310-I313 PolarHBondContact O-N 3.43Å; M310-I313 VanDerWaalsContact O-N 3.17Å; I313-F315 VanDerWaalsContact C-N 3.32Å; I313-F315 PolarHBondContact O-N 3.49Å; I313-C316 PolarHBondContact O-N 2.91Å; I313-I317 HydrophobicContact CG2-CD1 3.77Å; I313-I317 HydrophobicContact CG2-CG1 4.48Å; I313-I317 VanDerWaalsContact O-CG1 3.3Å; I313-I317 WeakPolarHBondContact O-CG1 3.49Å; I313-I317 PolarHBondContact O-N 2.8Å
314	I	88.8	Confident	87.1	Confident	57 Å²	57	61 Å²	61	29%	0.292	33%	0.331	S	S	.	.	H	α-helix	trans	-63.2	-42.5	179.6	-59.9	169.5	0	0	0	109.9	M310 F311 C316 I317 C318 F348	M310-I314 HydrophobicContact CG-CD1 3.91Å; M310-I314 HydrophobicContact CG-CG1 4.42Å; M310-I314 WeakPolarHBondContact O-CG1 3.44Å; M310-I314 PolarHBondContact O-N 2.7Å; M310-I314 HydrophobicContact SD-CD1 3.91Å; F311-I314 PolarHBondContact O-N 3.47Å; I314-C316 PolarHBondContact O-N 3.2Å; I314-I317 PolarHBondContact O-N 3.14Å; I314-C318 WeakPolarHBondContact O-CB 3.38Å; I314-C318 PolarHBondContact O-N 2.78Å; I314-C318 PolarHBondContact O-SG 3.36Å; I314-F348 HydrophobicContact CB-CZ 4.3Å; I314-F348 HydrophobicContact CG2-CE1 4.21Å; I314-F348 HydrophobicContact CG2-CZ 3.7Å
315	F	90.1	Very high	87.1	Confident	18 Å²	18	61.2 Å²	61.2	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-55.6	-49.1	174	169.4	-93.9	0	0	0	111.6	F311 L312 I313 I317 C318 S319 L339 C344 L345 F348	F311-F315 WeakPolarHBondContact O-CB 3.45Å; F311-F315 PolarHBondContact O-N 2.65Å; L312-F315 WeakPolarHBondContact O-CB 3.34Å; L312-F315 PolarHBondContact O-N 3.43Å; I313-F315 VanDerWaalsContact C-N 3.32Å; I313-F315 PolarHBondContact O-N 3.49Å; F315-I317 PolarHBondContact O-N 2.69Å; F315-C318 PolarHBondContact O-N 2.89Å; F315-S319 WeakPolarHBondContact O-CB 3.46Å; F315-S319 PolarHBondContact O-N 2.98Å; F315-L339 WeakPolarHBondContact CZ-O 3.47Å; F315-C344 HydrophobicContact CD2-CB 4.21Å; F315-C344 HydrophobicContact CE2-CB 3.81Å; F315-L345 HydrophobicContact CE2-CB 4Å; F315-L345 HydrophobicContact CE2-CD1 4.18Å; F315-L345 HydrophobicContact CZ-CB 4.49Å; F315-L345 HydrophobicContact CZ-CD1 4.5Å; F315-F348 HydrophobicContact CB-CD2 4.38Å; F315-F348 HydrophobicContact CB-CE2 4.22Å; F315-F348 AromaticContact CD2-CD2 3.9Å; F315-F348 HydrophobicContact CD2-CD2 3.9Å; F315-F348 HydrophobicContact CD2-CE2 4.34Å
316	C	90.3	Very high	86.8	Confident	36 Å²	36	60.2 Å²	60.2	24%	0.243	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-43.4	177.5	-71.5	0	0	0	0	112	L312 I313 I314 S319 V320 V338	L312-C316 PolarHBondContact O-N 3.37Å; L312-C316 PolarHBondContact O-SG 3.45Å; I313-C316 PolarHBondContact O-N 2.91Å; I314-C316 PolarHBondContact O-N 3.2Å; C316-S319 PolarHBondContact O-N 2.95Å; C316-V320 VanDerWaalsContact O-CG2 3.28Å; C316-V320 WeakPolarHBondContact O-CG2 3.2Å; C316-V320 PolarHBondContact O-N 2.84Å; C316-V338 HydrophobicContact CB-CG1 4.35Å
317	I	90.2	Very high	86.5	Confident	92 Å²	92	61.7 Å²	61.7	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-50.7	177.9	-67.2	165.9	0	0	0	110.6	I313 I314 F315 S319 V320 L321	I313-I317 HydrophobicContact CG2-CD1 3.77Å; I313-I317 HydrophobicContact CG2-CG1 4.48Å; I313-I317 VanDerWaalsContact O-CG1 3.3Å; I313-I317 WeakPolarHBondContact O-CG1 3.49Å; I313-I317 PolarHBondContact O-N 2.8Å; I314-I317 PolarHBondContact O-N 3.14Å; F315-I317 PolarHBondContact O-N 2.69Å; I317-S319 VanDerWaalsContact C-N 3.3Å; I317-S319 PolarHBondContact O-N 2.93Å; I317-V320 PolarHBondContact O-N 3.37Å; I317-L321 HydrophobicContact CG2-CD1 3.93Å; I317-L321 HydrophobicContact CG2-CG 4.45Å; I317-L321 WeakPolarHBondContact O-CB 3.38Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.43Å; I317-L321 PolarHBondContact O-N 3.45Å
318	C	88.1	Confident	85.9	Confident	14 Å²	14	69.5 Å²	69.5	10%	0.095	34%	0.337	C	S	.	.	H	α-helix	trans	-60.1	-41.8	177.9	-73.6	0	0	0	0	111.6	I314 F315 L321 I322 F348 V370	I314-C318 WeakPolarHBondContact O-CB 3.38Å; I314-C318 PolarHBondContact O-N 2.78Å; I314-C318 PolarHBondContact O-SG 3.36Å; F315-C318 PolarHBondContact O-N 2.89Å; C318-L321 PolarHBondContact O-N 3.07Å; C318-I322 WeakPolarHBondContact O-CB 3.39Å; C318-I322 WeakPolarHBondContact O-CG1 3.02Å; C318-I322 PolarHBondContact O-N 2.76Å; C318-F348 HydrophobicContact CB-CE2 4.25Å; C318-V370 HydrophobicContact CB-CG2 4.08Å
319	S	89.1	Confident	85.2	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-46.3	177.9	-176.6	0	0	0	0	112.2	F315 C316 I317 L321 I322 I323 V338 N341	F315-S319 WeakPolarHBondContact O-CB 3.46Å; F315-S319 PolarHBondContact O-N 2.98Å; C316-S319 PolarHBondContact O-N 2.95Å; I317-S319 VanDerWaalsContact C-N 3.3Å; I317-S319 PolarHBondContact O-N 2.93Å; S319-L321 PolarHBondContact O-N 3.32Å; S319-I322 PolarHBondContact O-N 3.12Å; S319-I323 WeakPolarHBondContact O-CD1 3.33Å; S319-I323 VanDerWaalsContact O-CG1 3.27Å; S319-I323 WeakPolarHBondContact O-CG1 3.44Å; S319-I323 PolarHBondContact O-N 3.44Å; S319-V338 WeakPolarHBondContact CB-O 3.42Å; S319-V338 WeakPolarHBondContact OG-CA 3.38Å; S319-V338 PolarHBondContact OG-O 3.46Å; S319-N341 WeakPolarHBondContact OG-CB 3.44Å; S319-N341 PolarHBondContact OG-ND2 3.36Å; S319-N341 VanDerWaalsContact OG-ND2 3.08Å
320	V	88.9	Confident	84.1	Confident	55 Å²	55	69.9 Å²	69.9	33%	0.333	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-45.8	174.6	169.5	0	0	0	0	111	C316 I317 I322 I323 Y324 L333 V338	C316-V320 VanDerWaalsContact O-CG2 3.28Å; C316-V320 WeakPolarHBondContact O-CG2 3.2Å; C316-V320 PolarHBondContact O-N 2.84Å; I317-V320 PolarHBondContact O-N 3.37Å; V320-I322 PolarHBondContact O-N 2.96Å; V320-I323 PolarHBondContact O-N 3.3Å; V320-Y324 WeakPolarHBondContact O-CB 3.22Å; V320-Y324 PolarHBondContact O-N 3.41Å; V320-L333 HydrophobicContact CG1-CD2 4.11Å; V320-V338 HydrophobicContact CG2-CG1 3.84Å; V320-V338 HydrophobicContact CG2-CG2 3.78Å
321	L	87.1	Confident	83.1	Confident	73 Å²	73	75.9 Å²	75.9	38%	0.382	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-40.6	-179.5	-70.4	173	0	0	0	112.4	I317 C318 S319 I325 I366	I317-L321 HydrophobicContact CG2-CD1 3.93Å; I317-L321 HydrophobicContact CG2-CG 4.45Å; I317-L321 WeakPolarHBondContact O-CB 3.38Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.43Å; I317-L321 PolarHBondContact O-N 3.45Å; C318-L321 PolarHBondContact O-N 3.07Å; S319-L321 PolarHBondContact O-N 3.32Å; L321-I325 WeakPolarHBondContact O-CB 3.36Å; L321-I325 WeakPolarHBondContact O-CD1 3.36Å; L321-I325 WeakPolarHBondContact O-CG1 3.48Å; L321-I325 PolarHBondContact O-N 3.38Å; L321-I366 HydrophobicContact CB-CD1 3.92Å
322	I	85.7	Confident	82.4	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-50.3	177.4	-70.5	166	0	0	0	110.2	C318 S319 V320 Y324 I325 Q326 C344 L363 I366 F367	C318-I322 WeakPolarHBondContact O-CB 3.39Å; C318-I322 WeakPolarHBondContact O-CG1 3.02Å; C318-I322 PolarHBondContact O-N 2.76Å; S319-I322 PolarHBondContact O-N 3.12Å; V320-I322 PolarHBondContact O-N 2.96Å; I322-Y324 PolarHBondContact O-N 3.36Å; I322-I325 PolarHBondContact O-N 3.2Å; I322-Q326 HydrophobicContact CG2-CG 4.46Å; I322-Q326 WeakPolarHBondContact O-CB 3.44Å; I322-Q326 WeakPolarHBondContact O-CG 3.19Å; I322-Q326 PolarHBondContact O-N 3.45Å; I322-C344 HydrophobicContact CD1-CB 4.35Å; I322-L363 HydrophobicContact CG1-CD1 4.46Å; I322-I366 HydrophobicContact CD1-CG2 4.24Å; I322-I366 HydrophobicContact CG1-CG2 3.9Å; I322-F367 HydrophobicContact CD1-CE1 3.9Å; I322-F367 HydrophobicContact CD1-CZ 4.48Å; I322-F367 HydrophobicContact CG1-CE1 4.45Å
323	I	85.1	Confident	81.8	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.056	34%	0.335	C	S	.	.	H	α-helix	trans	-61.7	-46.7	-179.4	-65.2	164.2	0	0	0	110.4	S319 V320 I325 Q326 E327 L333 S337 V338	S319-I323 WeakPolarHBondContact O-CD1 3.33Å; S319-I323 VanDerWaalsContact O-CG1 3.27Å; S319-I323 WeakPolarHBondContact O-CG1 3.44Å; S319-I323 PolarHBondContact O-N 3.44Å; V320-I323 PolarHBondContact O-N 3.3Å; I323-I325 PolarHBondContact O-N 3.06Å; I323-Q326 PolarHBondContact O-N 2.93Å; I323-E327 WeakPolarHBondContact O-CB 3.45Å; I323-E327 PolarHBondContact O-N 3.02Å; I323-L333 HydrophobicContact CB-CD2 3.99Å; I323-L333 HydrophobicContact CG2-CD2 3.77Å; I323-S337 WeakPolarHBondContact CD1-O 3.29Å; I323-V338 HydrophobicContact CD1-CG2 4.2Å
324	Y	83.9	Confident	81.4	Confident	93 Å²	93	71.8 Å²	71.8	37%	0.365	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-42.9	-179.9	179.7	-106.7	0	0	0	112.6	V320 I322 R328 Y330	V320-Y324 WeakPolarHBondContact O-CB 3.22Å; V320-Y324 PolarHBondContact O-N 3.41Å; I322-Y324 PolarHBondContact O-N 3.36Å; Y324-R328 VanDerWaalsContact O-CA 3.24Å; Y324-R328 WeakPolarHBondContact O-CA 3.38Å; Y324-R328 PolarHBondContact O-N 2.95Å; Y324-Y330 HydrophobicContact CD2-CE1 4.23Å; Y324-Y330 HydrophobicContact CE2-CD1 4.39Å; Y324-Y330 HydrophobicContact CE2-CD2 4.26Å; Y324-Y330 AromaticContact CE2-CE1 3.83Å; Y324-Y330 HydrophobicContact CE2-CE1 3.83Å; Y324-Y330 AromaticContact CE2-CE2 3.69Å; Y324-Y330 HydrophobicContact CE2-CE2 3.69Å; Y324-Y330 AromaticContact CE2-CZ 3.45Å; Y324-Y330 VanDerWaalsContact CE2-CZ 3.45Å; Y324-Y330 PolarHBondContact OH-OH 3.09Å
325	I	81.3	Confident	81	Confident	39 Å²	39	76.2 Å²	76.2	20%	0.2	36%	0.359	C	S	.	.	H	α-helix	trans	-74.3	-35.5	-177.9	-68.7	168.5	0	0	0	111.9	L321 I322 I323 K362 L363 I366	L321-I325 WeakPolarHBondContact O-CB 3.36Å; L321-I325 WeakPolarHBondContact O-CD1 3.36Å; L321-I325 WeakPolarHBondContact O-CG1 3.48Å; L321-I325 PolarHBondContact O-N 3.38Å; I322-I325 PolarHBondContact O-N 3.2Å; I323-I325 PolarHBondContact O-N 3.06Å; I325-K362 HydrophobicContact CD1-CB 4.48Å; I325-L363 HydrophobicContact CG2-CB 4.23Å; I325-L363 HydrophobicContact CG2-CD1 4.36Å; I325-I366 HydrophobicContact CD1-CD1 3.37Å
326	Q	78.9	Confident	80.6	Confident	80 Å²	80	84.8 Å²	84.8	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-75.6	-46.9	-179.8	-74.5	-179.1	-14.8	0	0	112.2	I322 I323 L363	I322-Q326 HydrophobicContact CG2-CG 4.46Å; I322-Q326 WeakPolarHBondContact O-CB 3.44Å; I322-Q326 WeakPolarHBondContact O-CG 3.19Å; I322-Q326 PolarHBondContact O-N 3.45Å; I323-Q326 PolarHBondContact O-N 2.93Å; Q326-L363 HydrophobicContact CG-CD1 4.48Å; Q326-L363 HydrophobicContact CG-CD2 4.3Å
327	E	78.5	Confident	80.2	Confident	113 Å²	113	85 Å²	85	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-95.3	-12.6	-172.9	-60.6	-167.9	-164.5	0	0	113.6	I323 S329 S332	I323-E327 WeakPolarHBondContact O-CB 3.45Å; I323-E327 PolarHBondContact O-N 3.02Å; E327-S329 PolarHBondContact O-N 2.9Å; E327-S332 WeakPolarHBondContact OE2-CB 3.38Å; E327-S332 PolarHBondContact OE2-OG 3.33Å
328	R	71.3	Confident	79.9	Confident	215 Å²	215	81.6 Å²	81.6	81%	0.811	38%	0.376	S	S	*	.			trans	50.7	25.7	179.4	-62.2	-172	178.9	-178	1.5	114.3	Y324	Y324-R328 VanDerWaalsContact O-CA 3.24Å; Y324-R328 WeakPolarHBondContact O-CA 3.38Å; Y324-R328 PolarHBondContact O-N 2.95Å
329	S	71.3	Confident	79.7	Confident	48 Å²	48	85.3 Å²	85.3	34%	0.336	40%	0.395	S	S	.	.			trans	-139.6	136.5	-174.7	-178.6	0	0	0	0	110.6	E327 R331 S332	E327-S329 PolarHBondContact O-N 2.9Å; S329-R331 VanDerWaalsContact C-N 3.27Å; S329-R331 PolarHBondContact O-N 2.89Å; S329-R331 PolarHBondContact OG-N 3.4Å; S329-S332 PolarHBondContact O-OG 3.44Å
330	Y	65.9	Low	79.4	Confident	166 Å²	166	91.8 Å²	91.8	65%	0.651	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-74.3	-17.7	174.4	-71.4	-85.2	0	0	0	112.9	Y324 S332 L333	Y324-Y330 HydrophobicContact CD2-CE1 4.23Å; Y324-Y330 HydrophobicContact CE2-CD1 4.39Å; Y324-Y330 HydrophobicContact CE2-CD2 4.26Å; Y324-Y330 AromaticContact CE2-CE1 3.83Å; Y324-Y330 HydrophobicContact CE2-CE1 3.83Å; Y324-Y330 AromaticContact CE2-CE2 3.69Å; Y324-Y330 HydrophobicContact CE2-CE2 3.69Å; Y324-Y330 AromaticContact CE2-CZ 3.45Å; Y324-Y330 VanDerWaalsContact CE2-CZ 3.45Å; Y324-Y330 PolarHBondContact OH-OH 3.09Å; Y330-S332 PolarHBondContact O-N 2.87Å; Y330-L333 HydrophobicContact CD1-CD1 3.96Å; Y330-L333 PolarHBondContact O-N 2.96Å
331	R	65.8	Low	79.3	Confident	237 Å²	237	90 Å²	90	89%	0.894	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-69.6	-17	-176.5	-74.8	-177.3	174.1	167.4	-1.3	113.8	S329	S329-R331 VanDerWaalsContact C-N 3.27Å; S329-R331 PolarHBondContact O-N 2.89Å; S329-R331 PolarHBondContact OG-N 3.4Å
332	S	70.8	Confident	79.2	Confident	22 Å²	22	89.9 Å²	89.9	15%	0.154	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-95.6	-2	179.3	54.4	0	0	0	0	114.9	E327 S329 Y330 T334 S337	E327-S332 WeakPolarHBondContact OE2-CB 3.38Å; E327-S332 PolarHBondContact OE2-OG 3.33Å; S329-S332 PolarHBondContact O-OG 3.44Å; Y330-S332 PolarHBondContact O-N 2.87Å; S332-T334 VanDerWaalsContact C-N 3.25Å; S332-T334 PolarHBondContact O-N 2.79Å; S332-S337 PolarHBondContact O-OG 3.15Å
333	L	77.1	Confident	79.1	Confident	56 Å²	56	91.3 Å²	91.3	29%	0.293	42%	0.422	S	S	.	.			trans	-79.8	73.5	172.5	-64.1	173.3	0	0	0	110	V320 I323 Y330 V338	V320-L333 HydrophobicContact CG1-CD2 4.11Å; I323-L333 HydrophobicContact CB-CD2 3.99Å; I323-L333 HydrophobicContact CG2-CD2 3.77Å; Y330-L333 HydrophobicContact CD1-CD1 3.96Å; Y330-L333 PolarHBondContact O-N 2.96Å; L333-V338 HydrophobicContact CD2-CG2 4.46Å
334	T	81.9	Confident	79.1	Confident	82 Å²	82	90.9 Å²	90.9	50%	0.503	42%	0.42	S	S	.	.			trans	-93.4	148.3	169.2	-56.7	0	0	0	0	109.1	S332 R336 S337 V338	S332-T334 VanDerWaalsContact C-N 3.25Å; S332-T334 PolarHBondContact O-N 2.79Å; T334-R336 HydrophobicContact CG2-CB 4.27Å; T334-R336 PolarHBondContact O-N 3.23Å; T334-R336 VanDerWaalsContact O-N 3.11Å; T334-S337 PolarHBondContact N-OG 3.12Å; T334-S337 PolarHBondContact O-N 3.44Å; T334-S337 PolarHBondContact O-OG 3.25Å; T334-V338 PolarHBondContact O-N 3.03Å
335	I	80.2	Confident	79.2	Confident	149 Å²	149	90.2 Å²	90.2	76%	0.764	42%	0.423	S	S	*	.	H	α-helix	trans	-51.9	-39.4	176.7	-62.4	169.8	0	0	0	111.3	V338 L339	I335-V338 PolarHBondContact O-N 3.34Å; I335-L339 WeakPolarHBondContact O-CB 3.49Å; I335-L339 PolarHBondContact O-N 3.44Å
336	R	81.4	Confident	79.5	Confident	198 Å²	198	92.8 Å²	92.8	75%	0.747	43%	0.43	S	S	*	.	H	α-helix	trans	-62.9	-43.5	175.4	-174.7	-178.6	177.7	-167.4	-1	113.1	T334 V338 M340	T334-R336 HydrophobicContact CG2-CB 4.27Å; T334-R336 PolarHBondContact O-N 3.23Å; T334-R336 VanDerWaalsContact O-N 3.11Å; R336-V338 VanDerWaalsContact C-N 3.34Å; R336-M340 VanDerWaalsContact O-CB 3.27Å; R336-M340 WeakPolarHBondContact O-CB 3.29Å; R336-M340 PolarHBondContact O-N 2.78Å
337	S	80.9	Confident	79.8	Confident	41 Å²	41	89.1 Å²	89.1	29%	0.287	41%	0.414	S	S	.	.	H	α-helix	trans	-70.9	-32.9	-178.4	55.4	0	0	0	0	111.7	I323 S332 T334	I323-S337 WeakPolarHBondContact CD1-O 3.29Å; S332-S337 PolarHBondContact O-OG 3.15Å; T334-S337 PolarHBondContact N-OG 3.12Å; T334-S337 PolarHBondContact O-N 3.44Å; T334-S337 PolarHBondContact O-OG 3.25Å
338	V	85	Confident	80.2	Confident	20 Å²	20	85.1 Å²	85.1	12%	0.121	40%	0.395	C	S	.	.	H	α-helix	trans	-70.4	-47.3	175	177.5	0	0	0	0	111.4	C316 S319 V320 I323 L333 T334 I335 R336	C316-V338 HydrophobicContact CB-CG1 4.35Å; S319-V338 WeakPolarHBondContact CB-O 3.42Å; S319-V338 WeakPolarHBondContact OG-CA 3.38Å; S319-V338 PolarHBondContact OG-O 3.46Å; V320-V338 HydrophobicContact CG2-CG1 3.84Å; V320-V338 HydrophobicContact CG2-CG2 3.78Å; I323-V338 HydrophobicContact CD1-CG2 4.2Å; L333-V338 HydrophobicContact CD2-CG2 4.46Å; T334-V338 PolarHBondContact O-N 3.03Å; I335-V338 PolarHBondContact O-N 3.34Å; R336-V338 VanDerWaalsContact C-N 3.34Å
339	L	83.6	Confident	80.8	Confident	92 Å²	92	80 Å²	80	48%	0.482	38%	0.383	S	S	.	.	H	α-helix	trans	-73	-35.1	-177	-168.6	69.2	0	0	0	112.8	F315 I335	F315-L339 WeakPolarHBondContact CZ-O 3.47Å; I335-L339 WeakPolarHBondContact O-CB 3.49Å; I335-L339 PolarHBondContact O-N 3.44Å
340	M	82.6	Confident	81.4	Confident	136 Å²	136	80.5 Å²	80.5	67%	0.67	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	37.2	-178	-63.3	-71.5	180	0	0	112.6	R336 D342	R336-M340 VanDerWaalsContact O-CB 3.27Å; R336-M340 WeakPolarHBondContact O-CB 3.29Å; R336-M340 PolarHBondContact O-N 2.78Å; M340-D342 PolarHBondContact O-N 3.22Å; M340-D342 VanDerWaalsContact O-N 3.16Å
341	N	86.9	Confident	82.5	Confident	17 Å²	17	77.6 Å²	77.6	9%	0.091	38%	0.382	C	S	.	.			trans	-79	97.8	175	-174	-21.4	0	0	0	110.3	S319 I343 C344 L345	S319-N341 WeakPolarHBondContact OG-CB 3.44Å; S319-N341 PolarHBondContact OG-ND2 3.36Å; S319-N341 VanDerWaalsContact OG-ND2 3.08Å; N341-I343 VanDerWaalsContact C-N 3.3Å; N341-I343 PolarHBondContact O-N 3.43Å; N341-I343 PolarHBondContact OD1-N 3.46Å; N341-C344 HydrophobicContact CB-CB 4.06Å; N341-C344 PolarHBondContact O-N 2.94Å; N341-C344 PolarHBondContact OD1-N 3.32Å; N341-L345 WeakPolarHBondContact O-CB 3.37Å; N341-L345 PolarHBondContact O-N 3.21Å
342	D	84.2	Confident	83.4	Confident	71 Å²	71	72 Å²	72	38%	0.38	38%	0.377	S	S	.	.	H	α-helix	trans	-56.7	-38.8	-177.7	-179.8	66.9	0	0	0	113.1	M340 L345 R346	M340-D342 PolarHBondContact O-N 3.22Å; M340-D342 VanDerWaalsContact O-N 3.16Å; D342-L345 PolarHBondContact O-N 3.19Å; D342-R346 WeakPolarHBondContact O-CB 3.42Å; D342-R346 VanDerWaalsContact O-CG 3.29Å; D342-R346 WeakPolarHBondContact O-CG 3.44Å; D342-R346 PolarHBondContact O-N 2.87Å; D342-R346 IonicContact OD1-CZ 3.44Å; D342-R346 VanDerWaalsContact OD1-CZ 3.3Å; D342-R346 IonicContact OD1-NE 3Å; D342-R346 PolarHBondContact OD1-NE 2.78Å; D342-R346 IonicContact OD1-NH2 3.22Å; D342-R346 PolarHBondContact OD1-NH2 2.82Å; D342-R346 IonicContact OD2-CZ 2.74Å; D342-R346 IonicContact OD2-NE 3.03Å; D342-R346 PolarHBondContact OD2-NE 3.15Å; D342-R346 IonicContact OD2-NH2 2.94Å; D342-R346 PolarHBondContact OD2-NH2 2.89Å; D342-R346 VanDerWaalsContact OD2-NH2 3.08Å
343	I	84.1	Confident	84.1	Confident	32 Å²	32	73.6 Å²	73.6	16%	0.164	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-46	-179.8	-55.7	177.9	0	0	0	110.2	N341 G347 F353 F367	N341-I343 VanDerWaalsContact C-N 3.3Å; N341-I343 PolarHBondContact O-N 3.43Å; N341-I343 PolarHBondContact OD1-N 3.46Å; I343-G347 PolarHBondContact O-N 2.97Å; I343-F353 HydrophobicContact CG2-CB 4.35Å; I343-F353 HydrophobicContact CG2-CD2 3.53Å; I343-F353 HydrophobicContact CG2-CE2 3.98Å; I343-F353 HydrophobicContact CG2-CG 4.02Å; I343-F367 HydrophobicContact CG2-CE1 3.53Å; I343-F367 HydrophobicContact CG2-CZ 3.98Å
344	C	85.3	Confident	84.3	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.007	39%	0.393	C	S	.	.	H	α-helix	trans	-67.8	-42.1	179	-160.9	0	0	0	0	110.7	F315 I322 N341 G347 F348	F315-C344 HydrophobicContact CD2-CB 4.21Å; F315-C344 HydrophobicContact CE2-CB 3.81Å; I322-C344 HydrophobicContact CD1-CB 4.35Å; N341-C344 HydrophobicContact CB-CB 4.06Å; N341-C344 PolarHBondContact O-N 2.94Å; N341-C344 PolarHBondContact OD1-N 3.32Å; C344-G347 PolarHBondContact O-N 2.8Å; C344-F348 WeakPolarHBondContact O-CD2 3.37Å; C344-F348 PolarHBondContact O-N 2.83Å
345	L	86	Confident	84.2	Confident	80 Å²	80	75.7 Å²	75.7	42%	0.419	39%	0.39	S	S	.	.	H	α-helix	trans	-64.6	-48.3	-177.3	-174	71	0	0	0	111.4	F315 N341 D342 G347 F348 L349	F315-L345 HydrophobicContact CE2-CB 4Å; F315-L345 HydrophobicContact CE2-CD1 4.18Å; F315-L345 HydrophobicContact CZ-CB 4.49Å; F315-L345 HydrophobicContact CZ-CD1 4.5Å; N341-L345 WeakPolarHBondContact O-CB 3.37Å; N341-L345 PolarHBondContact O-N 3.21Å; D342-L345 PolarHBondContact O-N 3.19Å; L345-G347 VanDerWaalsContact C-N 3.28Å; L345-G347 PolarHBondContact O-N 3.48Å; L345-F348 PolarHBondContact O-N 2.99Å; L345-L349 HydrophobicContact CG-CD1 4.18Å; L345-L349 WeakPolarHBondContact O-CG 3.35Å; L345-L349 PolarHBondContact O-N 3.28Å
346	R	87.6	Confident	84.2	Confident	92 Å²	92	70 Å²	70	35%	0.347	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-40.2	174	-70.6	-178.9	-164.5	-159.9	7.9	111.6	D342 L349 A350 Q351 F353	D342-R346 WeakPolarHBondContact O-CB 3.42Å; D342-R346 VanDerWaalsContact O-CG 3.29Å; D342-R346 WeakPolarHBondContact O-CG 3.44Å; D342-R346 PolarHBondContact O-N 2.87Å; D342-R346 IonicContact OD1-CZ 3.44Å; D342-R346 VanDerWaalsContact OD1-CZ 3.3Å; D342-R346 IonicContact OD1-NE 3Å; D342-R346 PolarHBondContact OD1-NE 2.78Å; D342-R346 IonicContact OD1-NH2 3.22Å; D342-R346 PolarHBondContact OD1-NH2 2.82Å; D342-R346 IonicContact OD2-CZ 2.74Å; D342-R346 IonicContact OD2-NE 3.03Å; D342-R346 PolarHBondContact OD2-NE 3.15Å; D342-R346 IonicContact OD2-NH2 2.94Å; D342-R346 PolarHBondContact OD2-NH2 2.89Å; D342-R346 VanDerWaalsContact OD2-NH2 3.08Å; R346-L349 CarbonylContact O-C 3.59Å; R346-L349 PolarHBondContact O-N 2.77Å; R346-A350 PolarHBondContact O-N 3.28Å; R346-Q351 HydrophobicContact CB-CB 4.03Å; R346-Q351 HydrophobicContact CG-CB 4.4Å; R346-Q351 WeakPolarHBondContact O-CA 3.38Å; R346-Q351 WeakPolarHBondContact O-CB 3.45Å; R346-Q351 PolarHBondContact O-N 3.01Å; R346-F353 HydrophobicContact CB-CB 4.08Å
347	G	86.3	Confident	83.8	Confident	4 Å²	4	72.6 Å²	72.6	4%	0.041	37%	0.372	C	S	.	.	H	α-helix	trans	-52.5	-59.5	173.9	0	0	0	0	0	111.5	I343 C344 L345 L349 A350 S374	I343-G347 PolarHBondContact O-N 2.97Å; C344-G347 PolarHBondContact O-N 2.8Å; L345-G347 VanDerWaalsContact C-N 3.28Å; L345-G347 PolarHBondContact O-N 3.48Å; G347-L349 VanDerWaalsContact C-N 3.29Å; G347-L349 PolarHBondContact O-N 3.02Å; G347-A350 WeakPolarHBondContact O-CA 3.4Å; G347-A350 PolarHBondContact O-N 3.25Å; G347-S374 VanDerWaalsContact C-OG 3.31Å; G347-S374 VanDerWaalsContact O-CB 3.24Å; G347-S374 WeakPolarHBondContact O-CB 3.4Å; G347-S374 PolarHBondContact O-OG 3.32Å
348	F	85.1	Confident	83.3	Confident	29 Å²	29	79.2 Å²	79.2	13%	0.127	40%	0.398	C	S	.	.	H	α-helix	trans	-60.5	-32.2	-180	-87.4	-85.4	0	0	0	114.3	F311 I314 F315 C318 C344 L345 A350 V370 S374	F311-F348 HydrophobicContact CD1-CD1 4.38Å; F311-F348 HydrophobicContact CD1-CE1 4.26Å; I314-F348 HydrophobicContact CB-CZ 4.3Å; I314-F348 HydrophobicContact CG2-CE1 4.21Å; I314-F348 HydrophobicContact CG2-CZ 3.7Å; F315-F348 HydrophobicContact CB-CD2 4.38Å; F315-F348 HydrophobicContact CB-CE2 4.22Å; F315-F348 AromaticContact CD2-CD2 3.9Å; F315-F348 HydrophobicContact CD2-CD2 3.9Å; F315-F348 HydrophobicContact CD2-CE2 4.34Å; C318-F348 HydrophobicContact CB-CE2 4.25Å; C344-F348 WeakPolarHBondContact O-CD2 3.37Å; C344-F348 PolarHBondContact O-N 2.83Å; L345-F348 PolarHBondContact O-N 2.99Å; F348-A350 PolarHBondContact O-N 3Å; F348-V370 HydrophobicContact CD2-CG1 4.07Å; F348-V370 HydrophobicContact CE2-CG1 4.13Å; F348-V370 HydrophobicContact CE2-CG2 4.18Å; F348-S374 VanDerWaalsContact CA-OG 3.26Å; F348-S374 WeakPolarHBondContact CA-OG 3.37Å
349	L	83.9	Confident	82.7	Confident	107 Å²	107	84.8 Å²	84.8	56%	0.56	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	9.4	175	-66.6	173.9	0	0	0	113.6	L345 R346 G347 Q351	L345-L349 HydrophobicContact CG-CD1 4.18Å; L345-L349 WeakPolarHBondContact O-CG 3.35Å; L345-L349 PolarHBondContact O-N 3.28Å; R346-L349 CarbonylContact O-C 3.59Å; R346-L349 PolarHBondContact O-N 2.77Å; G347-L349 VanDerWaalsContact C-N 3.29Å; G347-L349 PolarHBondContact O-N 3.02Å; L349-Q351 HydrophobicContact CB-CG 4.2Å; L349-Q351 PolarHBondContact O-N 3.17Å
350	A	85.8	Confident	82.5	Confident	59 Å²	59	84.2 Å²	84.2	49%	0.488	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	30.2	-176.3	0	0	0	0	0	114	R346 G347 F348	R346-A350 PolarHBondContact O-N 3.28Å; G347-A350 WeakPolarHBondContact O-CA 3.4Å; G347-A350 PolarHBondContact O-N 3.25Å; F348-A350 PolarHBondContact O-N 3Å
351	Q	87.3	Confident	82.6	Confident	104 Å²	104	88.2 Å²	88.2	49%	0.486	42%	0.423	S	S	.	.			trans	-96.4	148.1	176.7	-66.7	-176.3	-27.6	0	0	111.7	R346 L349	R346-Q351 HydrophobicContact CB-CB 4.03Å; R346-Q351 HydrophobicContact CG-CB 4.4Å; R346-Q351 WeakPolarHBondContact O-CA 3.38Å; R346-Q351 WeakPolarHBondContact O-CB 3.45Å; R346-Q351 PolarHBondContact O-N 3.01Å; L349-Q351 HydrophobicContact CB-CG 4.2Å; L349-Q351 PolarHBondContact O-N 3.17Å
352	P	86.4	Confident	82.4	Confident	120 Å²	120	94.5 Å²	94.5	78%	0.779	45%	0.449	S	S	*	.			trans	-66.3	137.5	174.9	28	-33.8	0	0	0	111
353	F	84.8	Confident	82.5	Confident	55 Å²	55	91.2 Å²	91.2	24%	0.241	43%	0.432	C	S	.	.			trans	-131	152.3	179.4	57.1	-97.4	0	0	0	111.6	I343 R346 F355 F367	I343-F353 HydrophobicContact CG2-CB 4.35Å; I343-F353 HydrophobicContact CG2-CD2 3.53Å; I343-F353 HydrophobicContact CG2-CE2 3.98Å; I343-F353 HydrophobicContact CG2-CG 4.02Å; R346-F353 HydrophobicContact CB-CB 4.08Å; F353-F355 HydrophobicContact CE2-CD2 4.47Å; F353-F355 PolarHBondContact O-N 3.05Å; F353-F367 AromaticContact CE2-CD1 3.7Å; F353-F367 HydrophobicContact CE2-CD1 3.7Å; F353-F367 AromaticContact CE2-CE1 3.84Å; F353-F367 HydrophobicContact CE2-CE1 3.84Å; F353-F367 HydrophobicContact CE2-CG 4.35Å; F353-F367 AromaticContact CZ-CD1 3.8Å; F353-F367 HydrophobicContact CZ-CD1 3.8Å; F353-F367 HydrophobicContact CZ-CE1 4.32Å; F353-F367 HydrophobicContact CZ-CG 4.47Å
354	P	81.1	Confident	82.5	Confident	84 Å²	84	93.9 Å²	93.9	55%	0.545	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-68.6	122.5	179	27.3	-33.6	0	0	0	111
355	F	80.1	Confident	82.7	Confident	99 Å²	99	99 Å²	99	43%	0.434	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-81.4	132.8	178.4	-162.2	-93.9	0	0	0	111	F353 Y359 K364 F367	F353-F355 HydrophobicContact CE2-CD2 4.47Å; F353-F355 PolarHBondContact O-N 3.05Å; F355-Y359 HydrophobicContact CE1-CD1 4.02Å; F355-Y359 HydrophobicContact CE1-CG 4.2Å; F355-K364 HydrophobicContact CZ-CG 4.17Å; F355-F367 HydrophobicContact CD2-CD2 4.1Å; F355-F367 HydrophobicContact CD2-CE2 4.35Å; F355-F367 HydrophobicContact CE2-CB 4.18Å; F355-F367 AromaticContact CE2-CD2 3.35Å; F355-F367 HydrophobicContact CE2-CD2 3.35Å; F355-F367 AromaticContact CE2-CE2 3.91Å; F355-F367 HydrophobicContact CE2-CE2 3.91Å; F355-F367 AromaticContact CE2-CG 3.96Å; F355-F367 HydrophobicContact CE2-CG 3.96Å; F355-F367 AromaticContact CZ-CD2 3.93Å; F355-F367 HydrophobicContact CZ-CD2 3.93Å; F355-F367 HydrophobicContact CZ-CE2 4.38Å
356	P	79.3	Confident	82.7	Confident	28 Å²	28	95.9 Å²	95.9	18%	0.182	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-66.1	138.8	-177.4	25.7	-33.9	0	0	0	112.3	Q358 L363 F367	P356-Q358 VanDerWaalsContact C-N 3.32Å; P356-Q358 PolarHBondContact O-N 2.61Å; P356-L363 HydrophobicContact CG-CD2 3.78Å; P356-F367 HydrophobicContact CG-CE2 3.9Å; P356-F367 HydrophobicContact CG-CZ 4.34Å
357	R	72.6	Confident	82.7	Confident	254 Å²	254	92 Å²	92	96%	0.958	44%	0.439	S	S	*	.	S	Bend	trans	-67.6	-28.7	-175.7	-163.4	173.2	-177.6	172.1	0.7	113.5
358	Q	70.8	Confident	82.7	Confident	180 Å²	180	96.9 Å²	96.9	84%	0.841	46%	0.462	S	S	*	.	S	Bend	trans	-105.1	114.8	173	-66.1	-179	-5.1	0	0	108.9	P356	P356-Q358 VanDerWaalsContact C-N 3.32Å; P356-Q358 PolarHBondContact O-N 2.61Å
359	Y	72.1	Confident	82.9	Confident	137 Å²	137	100.3 Å²	100.3	54%	0.537	48%	0.481	S	S	.	.			trans	-124.9	146.3	-177.9	64.8	-104.4	0	0	0	112.4	F355 K364	F355-Y359 HydrophobicContact CE1-CD1 4.02Å; F355-Y359 HydrophobicContact CE1-CG 4.2Å; Y359-K364 HydrophobicContact CD2-CD 3.77Å; Y359-K364 HydrophobicContact CD2-CG 4.1Å; Y359-K364 HydrophobicContact CE2-CD 3.97Å; Y359-K364 HydrophobicContact CG-CD 4.49Å; Y359-K364 HydrophobicContact CG-CG 4.47Å; Y359-K364 PolarHBondContact OH-NZ 3.35Å
360	N	80.1	Confident	83.1	Confident	80 Å²	80	95.4 Å²	95.4	43%	0.428	46%	0.455	S	S	.	.			trans	-108.6	156.9	169.7	-164.1	-8.4	0	0	0	109.5	K362 L363 K364	N360-K362 PolarHBondContact O-N 3.29Å; N360-L363 PolarHBondContact O-N 3.16Å; N360-K364 PolarHBondContact O-N 3.03Å
361	R	83.9	Confident	83.1	Confident	220 Å²	220	96 Å²	96	83%	0.83	46%	0.455	S	S	*	.	H	α-helix	trans	-54.4	-37.4	176.3	-70.4	-174.4	177.8	-178.5	-0.7	111.9	K364 L365	R361-K364 PolarHBondContact O-N 3.24Å; R361-L365 PolarHBondContact O-N 3.01Å; R361-L365 VanDerWaalsContact O-N 3.1Å
362	K	84.6	Confident	83.2	Confident	148 Å²	148	96.7 Å²	96.7	64%	0.643	46%	0.456	S	S	*	.	H	α-helix	trans	-62.6	-42.1	176	-59.3	-174.9	-179.7	-175.2	0	112.7	I325 N360 L365 I366	I325-K362 HydrophobicContact CD1-CB 4.48Å; N360-K362 PolarHBondContact O-N 3.29Å; K362-L365 PolarHBondContact O-N 3.4Å; K362-I366 WeakPolarHBondContact O-CG1 3.15Å; K362-I366 PolarHBondContact O-N 3.38Å; K362-I366 VanDerWaalsContact O-N 3.13Å
363	L	85.1	Confident	83.2	Confident	3 Å²	3	92.2 Å²	92.2	2%	0.016	43%	0.428	C	S	.	.	H	α-helix	trans	-69.7	-39.2	179.7	-173	66	0	0	0	111.4	I322 I325 Q326 P356 N360 L365 I366 F367	I322-L363 HydrophobicContact CG1-CD1 4.46Å; I325-L363 HydrophobicContact CG2-CB 4.23Å; I325-L363 HydrophobicContact CG2-CD1 4.36Å; Q326-L363 HydrophobicContact CG-CD1 4.48Å; Q326-L363 HydrophobicContact CG-CD2 4.3Å; P356-L363 HydrophobicContact CG-CD2 3.78Å; N360-L363 PolarHBondContact O-N 3.16Å; L363-L365 VanDerWaalsContact C-N 3.31Å; L363-L365 PolarHBondContact O-N 3.01Å; L363-I366 PolarHBondContact O-N 3.27Å; L363-F367 HydrophobicContact CD1-CD2 4.25Å; L363-F367 HydrophobicContact CD1-CE2 3.68Å; L363-F367 HydrophobicContact CD1-CZ 4.15Å; L363-F367 HydrophobicContact CD2-CE2 3.95Å; L363-F367 HydrophobicContact CG-CD2 3.9Å; L363-F367 HydrophobicContact CG-CE2 3.5Å; L363-F367 VanDerWaalsContact CG-CE2 3.5Å; L363-F367 HydrophobicContact CG-CZ 4.42Å; L363-F367 WeakPolarHBondContact O-CD2 3.19Å; L363-F367 PolarHBondContact O-N 3.01Å
364	K	85.4	Confident	83.4	Confident	87 Å²	87	89.8 Å²	89.8	38%	0.378	42%	0.418	S	S	.	.	H	α-helix	trans	-57.7	-43.8	171.4	-78	-176.7	162.1	179.9	0	111.9	F355 Y359 N360 R361 F367 M368	F355-K364 HydrophobicContact CZ-CG 4.17Å; Y359-K364 HydrophobicContact CD2-CD 3.77Å; Y359-K364 HydrophobicContact CD2-CG 4.1Å; Y359-K364 HydrophobicContact CE2-CD 3.97Å; Y359-K364 HydrophobicContact CG-CD 4.49Å; Y359-K364 HydrophobicContact CG-CG 4.47Å; Y359-K364 PolarHBondContact OH-NZ 3.35Å; N360-K364 PolarHBondContact O-N 3.03Å; R361-K364 PolarHBondContact O-N 3.24Å; K364-F367 PolarHBondContact O-N 3.2Å; K364-M368 WeakPolarHBondContact O-CG 3.4Å; K364-M368 PolarHBondContact O-N 3.08Å
365	L	87.5	Confident	83.8	Confident	109 Å²	109	90.4 Å²	90.4	57%	0.571	42%	0.416	S	S	*	.	H	α-helix	trans	-63.4	-42.7	178.7	-173.2	146.2	0	0	0	112	R361 K362 L363 M368 L369	R361-L365 PolarHBondContact O-N 3.01Å; R361-L365 VanDerWaalsContact O-N 3.1Å; K362-L365 PolarHBondContact O-N 3.4Å; L363-L365 VanDerWaalsContact C-N 3.31Å; L363-L365 PolarHBondContact O-N 3.01Å; L365-M368 PolarHBondContact O-N 3.24Å; L365-L369 HydrophobicContact CD2-CD1 3.61Å; L365-L369 HydrophobicContact CD2-CG 4.17Å; L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 2.69Å
366	I	87.1	Confident	84.2	Confident	15 Å²	15	90.6 Å²	90.6	8%	0.077	42%	0.421	C	S	.	.	H	α-helix	trans	-62.5	-45	176.7	-66.5	161.2	0	0	0	111.1	L321 I322 I325 K362 L363 M368 L369 V370	L321-I366 HydrophobicContact CB-CD1 3.92Å; I322-I366 HydrophobicContact CD1-CG2 4.24Å; I322-I366 HydrophobicContact CG1-CG2 3.9Å; I325-I366 HydrophobicContact CD1-CD1 3.37Å; K362-I366 WeakPolarHBondContact O-CG1 3.15Å; K362-I366 PolarHBondContact O-N 3.38Å; K362-I366 VanDerWaalsContact O-N 3.13Å; L363-I366 PolarHBondContact O-N 3.27Å; I366-M368 VanDerWaalsContact C-N 3.33Å; I366-M368 PolarHBondContact O-N 3.2Å; I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 3.1Å; I366-V370 HydrophobicContact CG2-CG2 4.48Å; I366-V370 WeakPolarHBondContact O-CG2 3.42Å; I366-V370 PolarHBondContact O-N 2.79Å
367	F	87.1	Confident	84.5	Confident	11 Å²	11	90.6 Å²	90.6	5%	0.048	42%	0.421	C	S	.	.	H	α-helix	trans	-64.4	-36.2	176.7	-73.7	-53.3	0	0	0	113	I322 I343 F353 F355 P356 L363 K364 V370 C371	I322-F367 HydrophobicContact CD1-CE1 3.9Å; I322-F367 HydrophobicContact CD1-CZ 4.48Å; I322-F367 HydrophobicContact CG1-CE1 4.45Å; I343-F367 HydrophobicContact CG2-CE1 3.53Å; I343-F367 HydrophobicContact CG2-CZ 3.98Å; F353-F367 AromaticContact CE2-CD1 3.7Å; F353-F367 HydrophobicContact CE2-CD1 3.7Å; F353-F367 AromaticContact CE2-CE1 3.84Å; F353-F367 HydrophobicContact CE2-CE1 3.84Å; F353-F367 HydrophobicContact CE2-CG 4.35Å; F353-F367 AromaticContact CZ-CD1 3.8Å; F353-F367 HydrophobicContact CZ-CD1 3.8Å; F353-F367 HydrophobicContact CZ-CE1 4.32Å; F353-F367 HydrophobicContact CZ-CG 4.47Å; F355-F367 HydrophobicContact CD2-CD2 4.1Å; F355-F367 HydrophobicContact CD2-CE2 4.35Å; F355-F367 HydrophobicContact CE2-CB 4.18Å; F355-F367 AromaticContact CE2-CD2 3.35Å; F355-F367 HydrophobicContact CE2-CD2 3.35Å; F355-F367 AromaticContact CE2-CE2 3.91Å; F355-F367 HydrophobicContact CE2-CE2 3.91Å; F355-F367 AromaticContact CE2-CG 3.96Å; F355-F367 HydrophobicContact CE2-CG 3.96Å; F355-F367 AromaticContact CZ-CD2 3.93Å; F355-F367 HydrophobicContact CZ-CD2 3.93Å; F355-F367 HydrophobicContact CZ-CE2 4.38Å; P356-F367 HydrophobicContact CG-CE2 3.9Å; P356-F367 HydrophobicContact CG-CZ 4.34Å; L363-F367 HydrophobicContact CD1-CD2 4.25Å; L363-F367 HydrophobicContact CD1-CE2 3.68Å; L363-F367 HydrophobicContact CD1-CZ 4.15Å; L363-F367 HydrophobicContact CD2-CE2 3.95Å; L363-F367 HydrophobicContact CG-CD2 3.9Å; L363-F367 HydrophobicContact CG-CE2 3.5Å; L363-F367 VanDerWaalsContact CG-CE2 3.5Å; L363-F367 HydrophobicContact CG-CZ 4.42Å; L363-F367 WeakPolarHBondContact O-CD2 3.19Å; L363-F367 PolarHBondContact O-N 3.01Å; K364-F367 PolarHBondContact O-N 3.2Å; F367-V370 PolarHBondContact O-N 2.84Å; F367-C371 VanDerWaalsContact O-CB 3.32Å; F367-C371 WeakPolarHBondContact O-CB 3.34Å; F367-C371 PolarHBondContact O-N 3.22Å
368	M	87.4	Confident	85.3	Confident	106 Å²	106	81.4 Å²	81.4	52%	0.522	39%	0.393	S	S	.	.	H	α-helix	trans	-62.7	-43.4	171.7	-72.1	-60.8	-59.9	0	0	111.5	K364 L365 I366 C371 F372	K364-M368 WeakPolarHBondContact O-CG 3.4Å; K364-M368 PolarHBondContact O-N 3.08Å; L365-M368 PolarHBondContact O-N 3.24Å; I366-M368 VanDerWaalsContact C-N 3.33Å; I366-M368 PolarHBondContact O-N 3.2Å; M368-C371 WeakPolarHBondContact O-CB 3.45Å; M368-C371 PolarHBondContact O-N 3.01Å; M368-F372 HydrophobicContact CE-CD2 4.24Å; M368-F372 HydrophobicContact CE-CE2 3.55Å; M368-F372 HydrophobicContact CE-CZ 4.27Å; M368-F372 WeakPolarHBondContact O-CD2 3.21Å; M368-F372 PolarHBondContact O-N 3.16Å
369	L	87.7	Confident	86.2	Confident	101 Å²	101	76.1 Å²	76.1	53%	0.529	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-43.9	176.9	-72.2	174.9	0	0	0	112.3	L365 I366 C371 F372 S373	L365-L369 HydrophobicContact CD2-CD1 3.61Å; L365-L369 HydrophobicContact CD2-CG 4.17Å; L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 2.69Å; I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 3.1Å; L369-C371 VanDerWaalsContact C-N 3.33Å; L369-C371 PolarHBondContact O-N 2.9Å; L369-F372 PolarHBondContact O-N 3.42Å; L369-S373 VanDerWaalsContact O-CB 3.3Å; L369-S373 WeakPolarHBondContact O-CB 3.48Å; L369-S373 PolarHBondContact O-N 2.75Å
370	V	88.2	Confident	87	Confident	3 Å²	3	72.9 Å²	72.9	2%	0.018	36%	0.364	C	S	.	.	H	α-helix	trans	-61.2	-44.4	175	173.9	0	0	0	0	110.1	C318 F348 I366 F367 S373 S374	C318-V370 HydrophobicContact CB-CG2 4.08Å; F348-V370 HydrophobicContact CD2-CG1 4.07Å; F348-V370 HydrophobicContact CE2-CG1 4.13Å; F348-V370 HydrophobicContact CE2-CG2 4.18Å; I366-V370 HydrophobicContact CG2-CG2 4.48Å; I366-V370 WeakPolarHBondContact O-CG2 3.42Å; I366-V370 PolarHBondContact O-N 2.79Å; F367-V370 PolarHBondContact O-N 2.84Å; V370-S373 PolarHBondContact O-N 3.17Å; V370-S374 WeakPolarHBondContact O-CB 3.49Å; V370-S374 PolarHBondContact O-N 3.21Å; V370-S374 PolarHBondContact O-OG 3.22Å
371	C	87.4	Confident	87.5	Confident	72 Å²	72	72.8 Å²	72.8	49%	0.486	36%	0.358	S	S	.	.	H	α-helix	trans	-60.5	-48.7	177.1	-173.5	0	0	0	0	112.3	F367 M368 L369 S373 S374 L375	F367-C371 VanDerWaalsContact O-CB 3.32Å; F367-C371 WeakPolarHBondContact O-CB 3.34Å; F367-C371 PolarHBondContact O-N 3.22Å; M368-C371 WeakPolarHBondContact O-CB 3.45Å; M368-C371 PolarHBondContact O-N 3.01Å; L369-C371 VanDerWaalsContact C-N 3.33Å; L369-C371 PolarHBondContact O-N 2.9Å; C371-S373 PolarHBondContact O-N 3.16Å; C371-S374 PolarHBondContact O-N 2.87Å; C371-L375 WeakPolarHBondContact O-CB 3.48Å; C371-L375 PolarHBondContact O-N 3.28Å
372	F	88.8	Confident	87.8	Confident	118 Å²	118	65.3 Å²	65.3	52%	0.518	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-42.5	176.7	-84.9	-67.2	0	0	0	112.4	M368 L369 S374 L375 I376	M368-F372 HydrophobicContact CE-CD2 4.24Å; M368-F372 HydrophobicContact CE-CE2 3.55Å; M368-F372 HydrophobicContact CE-CZ 4.27Å; M368-F372 WeakPolarHBondContact O-CD2 3.21Å; M368-F372 PolarHBondContact O-N 3.16Å; L369-F372 PolarHBondContact O-N 3.42Å; F372-S374 VanDerWaalsContact C-N 3.28Å; F372-S374 PolarHBondContact O-N 2.76Å; F372-L375 PolarHBondContact O-N 3.03Å; F372-I376 VanDerWaalsContact O-CG1 3.27Å; F372-I376 WeakPolarHBondContact O-CG1 3.11Å; F372-I376 PolarHBondContact O-N 3.48Å
373	S	86.4	Confident	88.1	Confident	26 Å²	26	60.9 Å²	60.9	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-59.7	-41.7	175.9	179.4	0	0	0	0	111.2	L369 V370 C371 I376 S377	L369-S373 VanDerWaalsContact O-CB 3.3Å; L369-S373 WeakPolarHBondContact O-CB 3.48Å; L369-S373 PolarHBondContact O-N 2.75Å; V370-S373 PolarHBondContact O-N 3.17Å; C371-S373 PolarHBondContact O-N 3.16Å; S373-I376 PolarHBondContact O-N 3.35Å; S373-S377 WeakPolarHBondContact O-CB 3.38Å; S373-S377 PolarHBondContact O-N 3.16Å; S373-S377 PolarHBondContact O-OG 3.32Å
374	S	88.2	Confident	88.4	Confident	4 Å²	4	66.3 Å²	66.3	3%	0.028	35%	0.349	C	S	.	.	H	α-helix	trans	-70.5	-39.3	-179.3	-49.1	0	0	0	0	112	G347 F348 V370 C371 F372 S377 T378	G347-S374 VanDerWaalsContact C-OG 3.31Å; G347-S374 VanDerWaalsContact O-CB 3.24Å; G347-S374 WeakPolarHBondContact O-CB 3.4Å; G347-S374 PolarHBondContact O-OG 3.32Å; F348-S374 VanDerWaalsContact CA-OG 3.26Å; F348-S374 WeakPolarHBondContact CA-OG 3.37Å; V370-S374 WeakPolarHBondContact O-CB 3.49Å; V370-S374 PolarHBondContact O-N 3.21Å; V370-S374 PolarHBondContact O-OG 3.22Å; C371-S374 PolarHBondContact O-N 2.87Å; F372-S374 VanDerWaalsContact C-N 3.28Å; F372-S374 PolarHBondContact O-N 2.76Å; S374-S377 PolarHBondContact O-N 2.96Å; S374-T378 VanDerWaalsContact O-CB 3.32Å; S374-T378 WeakPolarHBondContact O-CB 3.14Å; S374-T378 PolarHBondContact O-N 2.74Å; S374-T378 PolarHBondContact O-OG1 2.98Å
375	L	89.9	Confident	88.6	Confident	98 Å²	98	63.6 Å²	63.6	51%	0.513	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-51.1	173	-173.8	158.4	0	0	0	110.7	C371 F372 S377 T378 T379	C371-L375 WeakPolarHBondContact O-CB 3.48Å; C371-L375 PolarHBondContact O-N 3.28Å; F372-L375 PolarHBondContact O-N 3.03Å; L375-S377 VanDerWaalsContact C-N 3.33Å; L375-S377 PolarHBondContact O-N 3.42Å; L375-T378 PolarHBondContact O-N 3.08Å; L375-T379 HydrophobicContact CD2-CG2 4.02Å; L375-T379 HydrophobicContact CG-CG2 4.47Å; L375-T379 WeakPolarHBondContact O-CB 3.38Å; L375-T379 VanDerWaalsContact O-CG2 3.22Å; L375-T379 WeakPolarHBondContact O-CG2 3.5Å; L375-T379 PolarHBondContact O-N 2.96Å; L375-T379 PolarHBondContact O-OG1 3.47Å
376	I	88.6	Confident	88.7	Confident	103 Å²	103	64.5 Å²	64.5	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-45.6	179.2	-67.9	166.8	0	0	0	110.5	F372 S373 T379 M380	F372-I376 VanDerWaalsContact O-CG1 3.27Å; F372-I376 WeakPolarHBondContact O-CG1 3.11Å; F372-I376 PolarHBondContact O-N 3.48Å; S373-I376 PolarHBondContact O-N 3.35Å; I376-T379 WeakPolarHBondContact CA-OG1 3.45Å; I376-T379 PolarHBondContact O-OG1 2.91Å; I376-M380 WeakPolarHBondContact O-CB 3.27Å; I376-M380 PolarHBondContact O-N 3.47Å
377	S	86.4	Confident	88.9	Confident	27 Å²	27	66.3 Å²	66.3	19%	0.189	36%	0.357	C	S	.	.	H	α-helix	trans	-65.9	-44.4	-177.7	-50.5	0	0	0	0	112.3	F311 S373 S374 L375 Y381	F311-S377 WeakPolarHBondContact CE1-OG 3.37Å; F311-S377 WeakPolarHBondContact CZ-OG 3.35Å; S373-S377 WeakPolarHBondContact O-CB 3.38Å; S373-S377 PolarHBondContact O-N 3.16Å; S373-S377 PolarHBondContact O-OG 3.32Å; S374-S377 PolarHBondContact O-N 2.96Å; L375-S377 VanDerWaalsContact C-N 3.33Å; L375-S377 PolarHBondContact O-N 3.42Å; S377-Y381 WeakPolarHBondContact O-CB 3.18Å; S377-Y381 PolarHBondContact O-N 3.37Å
378	T	88.3	Confident	89	Confident	61 Å²	61	68 Å²	68	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-47.7	179.2	-53.3	0	0	0	0	110.3	S374 L375 M380 Y381 T382	S374-T378 VanDerWaalsContact O-CB 3.32Å; S374-T378 WeakPolarHBondContact O-CB 3.14Å; S374-T378 PolarHBondContact O-N 2.74Å; S374-T378 PolarHBondContact O-OG1 2.98Å; L375-T378 PolarHBondContact O-N 3.08Å; T378-M380 PolarHBondContact O-N 2.03Å; T378-Y381 PolarHBondContact O-N 2.9Å; T378-T382 HydrophobicContact CG2-CG2 4.43Å; T378-T382 WeakPolarHBondContact O-CG2 3.49Å; T378-T382 PolarHBondContact O-N 3.22Å; T378-T382 PolarHBondContact O-OG1 2.69Å
379	T	90.4	Very high	88.9	Confident	70 Å²	70	65.5 Å²	65.5	43%	0.429	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-42.3	178.9	53.3	0	0	0	0	112.1	L375 I376 T382 A383	L375-T379 HydrophobicContact CD2-CG2 4.02Å; L375-T379 HydrophobicContact CG-CG2 4.47Å; L375-T379 WeakPolarHBondContact O-CB 3.38Å; L375-T379 VanDerWaalsContact O-CG2 3.22Å; L375-T379 WeakPolarHBondContact O-CG2 3.5Å; L375-T379 PolarHBondContact O-N 2.96Å; L375-T379 PolarHBondContact O-OG1 3.47Å; I376-T379 WeakPolarHBondContact CA-OG1 3.45Å; I376-T379 PolarHBondContact O-OG1 2.91Å; T379-T382 WeakPolarHBondContact CA-OG1 3.02Å; T379-T382 PolarHBondContact O-N 3.08Å; T379-T382 PolarHBondContact O-OG1 3.05Å; T379-A383 VanDerWaalsContact O-CB 3.26Å; T379-A383 WeakPolarHBondContact O-CB 3.4Å; T379-A383 PolarHBondContact O-N 3.25Å
380	M	89.8	Confident	88.7	Confident	69 Å²	69	71.9 Å²	71.9	34%	0.34	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-53.8	173.9	178.2	-170	147.3	0	0	111	I307 I376 T378 T382 A383 Y384	I307-M380 HydrophobicContact CD1-CE 4.22Å; I376-M380 WeakPolarHBondContact O-CB 3.27Å; I376-M380 PolarHBondContact O-N 3.47Å; T378-M380 PolarHBondContact O-N 2.03Å; M380-T382 VanDerWaalsContact C-N 3.34Å; M380-T382 PolarHBondContact O-N 3.48Å; M380-A383 PolarHBondContact O-N 3.5Å; M380-Y384 HydrophobicContact CE-CD2 3.95Å; M380-Y384 HydrophobicContact CE-CE2 3.66Å; M380-Y384 HydrophobicContact CG-CD2 3.6Å; M380-Y384 HydrophobicContact CG-CE2 3.5Å; M380-Y384 VanDerWaalsContact O-CD2 3.22Å; M380-Y384 WeakPolarHBondContact O-CD2 3.34Å; M380-Y384 PolarHBondContact O-N 2.93Å; M380-Y384 HydrophobicContact SD-CE2 4.26Å
381	Y	89	Confident	88.4	Confident	78 Å²	78	73.7 Å²	73.7	31%	0.306	39%	0.39	S	S	.	.	H	α-helix	trans	-59.5	-45.2	-179.7	-178.6	-93.3	0	0	0	111.5	I302 V303 S377 T378 A383 Y384 L385	I302-Y381 HydrophobicContact CB-CD2 4.28Å; I302-Y381 HydrophobicContact CB-CE2 4.05Å; I302-Y381 HydrophobicContact CD1-CE2 4.22Å; I302-Y381 HydrophobicContact CG2-CD2 3.55Å; I302-Y381 HydrophobicContact CG2-CE2 3.84Å; I302-Y381 HydrophobicContact CG2-CG 4.45Å; V303-Y381 HydrophobicContact CG2-CD2 3.91Å; V303-Y381 HydrophobicContact CG2-CE2 3.7Å; S377-Y381 WeakPolarHBondContact O-CB 3.18Å; S377-Y381 PolarHBondContact O-N 3.37Å; T378-Y381 PolarHBondContact O-N 2.9Å; Y381-A383 VanDerWaalsContact C-N 3.33Å; Y381-A383 PolarHBondContact O-N 3.35Å; Y381-Y384 PolarHBondContact O-N 3.24Å; Y381-L385 HydrophobicContact CE1-CD2 4.04Å; Y381-L385 VanDerWaalsContact O-CB 3.22Å; Y381-L385 WeakPolarHBondContact O-CB 3.38Å; Y381-L385 PolarHBondContact O-N 3.31Å
382	T	90.4	Very high	88.2	Confident	62 Å²	62	71.5 Å²	71.5	38%	0.38	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-37.1	177.9	53.9	0	0	0	0	112.6	T378 T379 M380 Q386	T378-T382 HydrophobicContact CG2-CG2 4.43Å; T378-T382 WeakPolarHBondContact O-CG2 3.49Å; T378-T382 PolarHBondContact O-N 3.22Å; T378-T382 PolarHBondContact O-OG1 2.69Å; T379-T382 WeakPolarHBondContact CA-OG1 3.02Å; T379-T382 PolarHBondContact O-N 3.08Å; T379-T382 PolarHBondContact O-OG1 3.05Å; M380-T382 VanDerWaalsContact C-N 3.34Å; M380-T382 PolarHBondContact O-N 3.48Å; T382-Q386 WeakPolarHBondContact O-CB 3.45Å; T382-Q386 VanDerWaalsContact O-CG 3.24Å; T382-Q386 WeakPolarHBondContact O-CG 3.13Å; T382-Q386 PolarHBondContact O-N 3.15Å
383	A	92	Very high	88	Confident	55 Å²	55	67.8 Å²	67.8	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-68.7	-45.2	178.8	0	0	0	0	0	111.5	T379 M380 Y381 Q386 A387	T379-A383 VanDerWaalsContact O-CB 3.26Å; T379-A383 WeakPolarHBondContact O-CB 3.4Å; T379-A383 PolarHBondContact O-N 3.25Å; M380-A383 PolarHBondContact O-N 3.5Å; Y381-A383 VanDerWaalsContact C-N 3.33Å; Y381-A383 PolarHBondContact O-N 3.35Å; A383-Q386 PolarHBondContact O-N 3.3Å; A383-A387 WeakPolarHBondContact O-CB 3.4Å; A383-A387 PolarHBondContact O-N 2.89Å
384	Y	91.1	Very high	88	Confident	118 Å²	118	72 Å²	72	46%	0.463	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-41.6	174.7	-79.5	-67.7	0	0	0	112.1	I302 M380 Y381 A387 F388	I302-Y384 HydrophobicContact CG2-CG 4.48Å; M380-Y384 HydrophobicContact CE-CD2 3.95Å; M380-Y384 HydrophobicContact CE-CE2 3.66Å; M380-Y384 HydrophobicContact CG-CD2 3.6Å; M380-Y384 HydrophobicContact CG-CE2 3.5Å; M380-Y384 VanDerWaalsContact O-CD2 3.22Å; M380-Y384 WeakPolarHBondContact O-CD2 3.34Å; M380-Y384 PolarHBondContact O-N 2.93Å; M380-Y384 HydrophobicContact SD-CE2 4.26Å; Y381-Y384 PolarHBondContact O-N 3.24Å; Y384-A387 PolarHBondContact O-N 3.08Å; Y384-F388 WeakPolarHBondContact O-CB 3.06Å; Y384-F388 WeakPolarHBondContact O-CG 3.05Å; Y384-F388 PolarHBondContact O-N 3.1Å
385	L	90	Very high	87.8	Confident	30 Å²	30	76.5 Å²	76.5	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-46.7	176.5	-178.1	64.8	0	0	0	111.1	V298 Y299 I302 Y381 A387 F388 L389	V298-L385 HydrophobicContact CG1-CD1 4.14Å; Y299-L385 HydrophobicContact CD1-CD1 3.88Å; Y299-L385 HydrophobicContact CE1-CD1 3.77Å; Y299-L385 HydrophobicContact CE1-CD2 4.34Å; I302-L385 HydrophobicContact CD1-CB 3.76Å; I302-L385 HydrophobicContact CD1-CD1 3.71Å; I302-L385 HydrophobicContact CD1-CG 4.36Å; Y381-L385 HydrophobicContact CE1-CD2 4.04Å; Y381-L385 VanDerWaalsContact O-CB 3.22Å; Y381-L385 WeakPolarHBondContact O-CB 3.38Å; Y381-L385 PolarHBondContact O-N 3.31Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 3.1Å; L385-F388 PolarHBondContact O-N 3.48Å; L385-L389 HydrophobicContact CD1-CD1 4.11Å; L385-L389 HydrophobicContact CD1-CG 4.15Å; L385-L389 HydrophobicContact CG-CD1 3.93Å; L385-L389 HydrophobicContact CG-CG 4.35Å; L385-L389 WeakPolarHBondContact O-CB 3.38Å; L385-L389 WeakPolarHBondContact O-CG 3.45Å; L385-L389 PolarHBondContact O-N 2.9Å
386	Q	89.5	Confident	87.6	Confident	127 Å²	127	77.5 Å²	77.5	59%	0.593	42%	0.415	S	S	*	.	H	α-helix	trans	-58.9	-47.1	175	-76.7	176.4	-15.4	0	0	111.1	T382 A383 F388 L389 W390	T382-Q386 WeakPolarHBondContact O-CB 3.45Å; T382-Q386 VanDerWaalsContact O-CG 3.24Å; T382-Q386 WeakPolarHBondContact O-CG 3.13Å; T382-Q386 PolarHBondContact O-N 3.15Å; A383-Q386 PolarHBondContact O-N 3.3Å; Q386-F388 PolarHBondContact O-N 3.43Å; Q386-L389 PolarHBondContact O-N 2.87Å; Q386-W390 PolarHBondContact O-N 3.29Å
387	A	90.4	Very high	87.8	Confident	53 Å²	53	80.1 Å²	80.1	44%	0.438	42%	0.418	S	S	.	.	H	α-helix	trans	-59.7	-45.7	178.6	0	0	0	0	0	112.5	A383 Y384 L385 W390 G391	A383-A387 WeakPolarHBondContact O-CB 3.4Å; A383-A387 PolarHBondContact O-N 2.89Å; Y384-A387 PolarHBondContact O-N 3.08Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 3.1Å; A387-W390 PolarHBondContact O-N 3.27Å; A387-G391 PolarHBondContact O-N 3.44Å
388	F	88.7	Confident	88.1	Confident	47 Å²	47	79.7 Å²	79.7	21%	0.206	41%	0.413	C	S	.	.	H	α-helix	trans	-73.2	-28	-179.2	-71.4	3	0	0	0	113	V298 I302 Y384 L385 Q386 G391 P392 P393	V298-F388 HydrophobicContact CG1-CB 3.57Å; V298-F388 HydrophobicContact CG1-CD2 4.14Å; V298-F388 HydrophobicContact CG1-CG 4.4Å; I302-F388 HydrophobicContact CD1-CD2 4.26Å; I302-F388 HydrophobicContact CG1-CD2 3.6Å; I302-F388 HydrophobicContact CG1-CE2 3.8Å; Y384-F388 WeakPolarHBondContact O-CB 3.06Å; Y384-F388 WeakPolarHBondContact O-CG 3.05Å; Y384-F388 PolarHBondContact O-N 3.1Å; L385-F388 PolarHBondContact O-N 3.48Å; Q386-F388 PolarHBondContact O-N 3.43Å; F388-G391 CarbonylContact O-C 3.32Å; F388-G391 VanDerWaalsContact O-C 3.32Å; F388-P392 VanDerWaalsContact O-CA 3.28Å; F388-P392 WeakPolarHBondContact O-CA 3.45Å; F388-P392 VanDerWaalsContact O-N 3.08Å; F388-P393 HydrophobicContact CD1-CG 3.93Å; F388-P393 HydrophobicContact CD2-CG 3.95Å; F388-P393 HydrophobicContact CE1-CG 3.78Å; F388-P393 HydrophobicContact CE2-CG 3.79Å; F388-P393 HydrophobicContact CG-CG 4.03Å; F388-P393 HydrophobicContact CZ-CG 3.7Å
389	L	85.2	Confident	88.2	Confident	53 Å²	53	81.1 Å²	81.1	28%	0.277	42%	0.422	S	S	.	.	H	α-helix	trans	-72	-31.7	171.5	-71.7	175.2	0	0	0	112.2	F295 L385 Q386 I546	F295-L389 HydrophobicContact CD1-CD2 3.95Å; F295-L389 HydrophobicContact CE1-CD2 4.28Å; L385-L389 HydrophobicContact CD1-CD1 4.11Å; L385-L389 HydrophobicContact CD1-CG 4.15Å; L385-L389 HydrophobicContact CG-CD1 3.93Å; L385-L389 HydrophobicContact CG-CG 4.35Å; L385-L389 WeakPolarHBondContact O-CB 3.38Å; L385-L389 WeakPolarHBondContact O-CG 3.45Å; L385-L389 PolarHBondContact O-N 2.9Å; Q386-L389 PolarHBondContact O-N 2.87Å; L389-I546 HydrophobicContact CD1-CD1 4.32Å; L389-I546 HydrophobicContact CD2-CD1 4.06Å
390	W	83.5	Confident	88.3	Confident	235 Å²	235	79.8 Å²	79.8	89%	0.89	42%	0.415	S	S	*	.	H	α-helix	trans	-73.8	-37.2	173.4	-84.9	110.2	0	0	0	112.9	Q386 A387	Q386-W390 PolarHBondContact O-N 3.29Å; A387-W390 PolarHBondContact O-N 3.27Å
391	G	82.4	Confident	88.4	Confident	42 Å²	42	78.4 Å²	78.4	43%	0.433	41%	0.408	S	S	.	.	S	Bend	trans	-153.3	98	179.5	0	0	0	0	0	109.8	A387 F388	A387-G391 PolarHBondContact O-N 3.44Å; F388-G391 CarbonylContact O-C 3.32Å; F388-G391 VanDerWaalsContact O-C 3.32Å
392	P	83.9	Confident	88.5	Confident	25 Å²	25	78.9 Å²	78.9	16%	0.162	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-59.2	144.6	179.3	21.3	-32.4	0	0	0	110.5	L293 F295 F388 I394	L293-P392 WeakPolarHBondContact O-CB 3.31Å; F295-P392 HydrophobicContact CZ-CG 4.45Å; F388-P392 VanDerWaalsContact O-CA 3.28Å; F388-P392 WeakPolarHBondContact O-CA 3.45Å; F388-P392 VanDerWaalsContact O-N 3.08Å; P392-I394 PolarHBondContact O-N 2.65Å
393	P	84.5	Confident	88.4	Confident	40 Å²	40	78 Å²	78	26%	0.26	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-60	137.7	175.7	-10.8	22	0	0	0	109.6	L293 F388	L293-P393 HydrophobicContact CD1-CB 3.78Å; L293-P393 HydrophobicContact CD1-CG 3.7Å; L293-P393 PolarHBondContact N-O 2.93Å; F388-P393 HydrophobicContact CD1-CG 3.93Å; F388-P393 HydrophobicContact CD2-CG 3.95Å; F388-P393 HydrophobicContact CE1-CG 3.78Å; F388-P393 HydrophobicContact CE2-CG 3.79Å; F388-P393 HydrophobicContact CG-CG 4.03Å; F388-P393 HydrophobicContact CZ-CG 3.7Å
394	I	85.4	Confident	88.3	Confident	114 Å²	114	75.7 Å²	75.7	59%	0.585	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-89.3	143.1	178.8	-56.4	168.1	0	0	0	108.1	P290 P392	P290-I394 HydrophobicContact CB-CG2 3.77Å; P290-I394 HydrophobicContact CG-CG2 4.13Å; P290-I394 WeakPolarHBondContact O-CG2 3.33Å; P392-I394 PolarHBondContact O-N 2.65Å
395	E	84	Confident	88.1	Confident	99 Å²	99	74.3 Å²	74.3	46%	0.463	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-55.4	150.7	171.7	-75.2	-176	173.9	0	0	112.1	P290 D291 R397	P290-E395 HydrophobicContact CB-CB 3.67Å; P290-E395 WeakPolarHBondContact CB-O 3.44Å; P290-E395 WeakPolarHBondContact CG-O 3.48Å; D291-E395 PolarHBondContact O-N 3.25Å; D291-E395 VanDerWaalsContact O-N 3.08Å; E395-R397 PolarHBondContact O-N 3.34Å
396	P	86.8	Confident	88	Confident	120 Å²	120	81.2 Å²	81.2	78%	0.779	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-60.6	139.9	178.1	26.5	-34	0	0	0	110.6
397	R	91.5	Very high	88	Confident	157 Å²	157	76.9 Å²	76.9	59%	0.592	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-66.2	152.5	174	-68.4	-177.2	-175.8	172.2	1.8	110.7	P290 E395 T399 Y475	P290-R397 HydrophobicContact CG-CG 3.98Å; E395-R397 PolarHBondContact O-N 3.34Å; R397-T399 PolarHBondContact O-N 2.95Å; R397-Y475 HydrophobicContact CB-CE2 4.38Å; R397-Y475 HydrophobicContact CG-CE1 4.36Å; R397-Y475 HydrophobicContact CG-CE2 4.3Å
398	L	92.5	Very high	87.9	Confident	18 Å²	18	80.5 Å²	80.5	9%	0.094	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-62.6	133.2	174.6	-58.3	171.6	0	0	0	110	A287 D403 V404 Y409 L451 Y475 F480	A287-L398 HydrophobicContact CB-CD1 4.46Å; L398-D403 HydrophobicContact CD2-CB 3.95Å; L398-V404 HydrophobicContact CD1-CG2 4.47Å; L398-Y409 HydrophobicContact CD1-CD2 4.07Å; L398-Y409 HydrophobicContact CD1-CE2 4.49Å; L398-L451 HydrophobicContact CD1-CD1 3.99Å; L398-L451 HydrophobicContact CD1-CD2 3.77Å; L398-Y475 PolarHBondContact N-OH 3.1Å; L398-F480 HydrophobicContact CB-CE1 3.77Å; L398-F480 HydrophobicContact CB-CZ 4.34Å; L398-F480 HydrophobicContact CD1-CZ 4.44Å
399	T	92.3	Very high	88.1	Confident	92 Å²	92	79 Å²	79	56%	0.564	39%	0.393	S	S	*	.			trans	-117.6	-22.9	179.8	64.6	0	0	0	0	113.5	R397 D403 A479	R397-T399 PolarHBondContact O-N 2.95Å; T399-D403 WeakPolarHBondContact CA-OD2 3.41Å; T399-D403 PolarHBondContact N-OD2 2.79Å; T399-D403 PolarHBondContact OG1-OD2 3.45Å; T399-A479 WeakPolarHBondContact O-CB 3.49Å
400	S	92.4	Very high	88.5	Confident	41 Å²	41	78.3 Å²	78.3	29%	0.287	39%	0.391	S	S	.	.	S	Bend	trans	-145.6	164	-177.5	69.2	0	0	0	0	112.8	D402 D403	S400-D402 PolarHBondContact O-N 2.9Å; S400-D403 PolarHBondContact N-OD2 3.38Å; S400-D403 WeakPolarHBondContact O-CB 3.39Å; S400-D403 PolarHBondContact O-N 2.78Å; S400-D403 VanDerWaalsContact O-N 3.08Å; S400-D403 VanDerWaalsContact OG-CG 3.29Å; S400-D403 PolarHBondContact OG-N 2.71Å; S400-D403 PolarHBondContact OG-OD1 2.83Å; S400-D403 PolarHBondContact OG-OD2 3.22Å
401	F	91.1	Very high	89	Confident	40 Å²	40	67.4 Å²	67.4	18%	0.175	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-28.6	172.4	-70.7	-75.4	0	0	0	113	F285 D403 V404 M411 L421 L424 V426 F480	F285-F401 AromaticContact CE2-CE1 3.77Å; F285-F401 HydrophobicContact CE2-CE1 3.77Å; F285-F401 HydrophobicContact CE2-CZ 4.11Å; F285-F401 HydrophobicContact CZ-CE1 4.02Å; F401-D403 VanDerWaalsContact C-N 3.31Å; F401-V404 WeakPolarHBondContact O-CB 3.3Å; F401-V404 PolarHBondContact O-N 3.07Å; F401-M411 HydrophobicContact CD1-CE 3.87Å; F401-M411 HydrophobicContact CE1-CE 3.84Å; F401-L421 HydrophobicContact CE1-CD2 4.29Å; F401-L424 HydrophobicContact CE2-CD1 4.26Å; F401-L424 HydrophobicContact CZ-CD1 4.06Å; F401-V426 HydrophobicContact CB-CG1 4.42Å; F401-V426 HydrophobicContact CB-CG2 4.49Å; F401-V426 HydrophobicContact CD1-CG1 4.07Å; F401-V426 HydrophobicContact CD1-CG2 4.11Å; F401-V426 HydrophobicContact CD2-CG2 4Å; F401-V426 HydrophobicContact CE1-CG2 4.28Å; F401-V426 HydrophobicContact CE2-CG2 4.19Å; F401-V426 HydrophobicContact CG-CG1 4.34Å; F401-V426 HydrophobicContact CG-CG2 3.96Å; F401-V426 HydrophobicContact CZ-CG2 4.33Å; F401-F480 AromaticContact CD1-CD2 3.68Å; F401-F480 HydrophobicContact CD1-CD2 3.68Å; F401-F480 HydrophobicContact CD1-CE2 4.05Å; F401-F480 HydrophobicContact CD2-CB 4.11Å; F401-F480 HydrophobicContact CD2-CD2 4.26Å; F401-F480 HydrophobicContact CD2-CG 4.49Å; F401-F480 AromaticContact CE1-CD2 3.54Å; F401-F480 HydrophobicContact CE1-CD2 3.54Å; F401-F480 HydrophobicContact CE1-CE2 4.06Å; F401-F480 HydrophobicContact CE2-CB 3.94Å; F401-F480 HydrophobicContact CE2-CD2 4.12Å; F401-F480 HydrophobicContact CE2-CG 4.48Å; F401-F480 HydrophobicContact CG-CD2 4.06Å; F401-F480 HydrophobicContact CZ-CB 4.33Å; F401-F480 AromaticContact CZ-CD2 3.77Å; F401-F480 HydrophobicContact CZ-CD2 3.77Å
402	D	90.1	Very high	89.6	Confident	89 Å²	89	65.4 Å²	65.4	48%	0.476	33%	0.33	S	S	.	.	H	α-helix	trans	-74.2	-23.3	176.8	-73.4	-32.1	0	0	0	112.9	S400 V404 K405	S400-D402 PolarHBondContact O-N 2.9Å; D402-V404 VanDerWaalsContact C-N 3.28Å; D402-K405 IonicContact OD1-NZ 2.84Å; D402-K405 PolarHBondContact OD1-NZ 3.05Å
403	D	89.8	Confident	90.1	Very high	43 Å²	43	64.2 Å²	64.2	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-69.5	-32.4	171.7	-60	-29.7	0	0	0	110.6	L398 T399 S400 F401 K405 K406 S407	L398-D403 HydrophobicContact CD2-CB 3.95Å; T399-D403 WeakPolarHBondContact CA-OD2 3.41Å; T399-D403 PolarHBondContact N-OD2 2.79Å; T399-D403 PolarHBondContact OG1-OD2 3.45Å; S400-D403 PolarHBondContact N-OD2 3.38Å; S400-D403 WeakPolarHBondContact O-CB 3.39Å; S400-D403 PolarHBondContact O-N 2.78Å; S400-D403 VanDerWaalsContact O-N 3.08Å; S400-D403 VanDerWaalsContact OG-CG 3.29Å; S400-D403 PolarHBondContact OG-N 2.71Å; S400-D403 PolarHBondContact OG-OD1 2.83Å; S400-D403 PolarHBondContact OG-OD2 3.22Å; F401-D403 VanDerWaalsContact C-N 3.31Å; D403-K405 PolarHBondContact O-N 3.23Å; D403-K406 PolarHBondContact O-N 3.46Å; D403-S407 WeakPolarHBondContact O-CB 3.38Å; D403-S407 PolarHBondContact O-N 3.23Å
404	V	89.1	Confident	90.5	Very high	6 Å²	6	62.5 Å²	62.5	4%	0.036	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-46.4	176.6	-177.3	0	0	0	0	110.5	L398 F401 D402 K406 S407 L451 F480	L398-V404 HydrophobicContact CD1-CG2 4.47Å; F401-V404 WeakPolarHBondContact O-CB 3.3Å; F401-V404 PolarHBondContact O-N 3.07Å; D402-V404 VanDerWaalsContact C-N 3.28Å; V404-K406 PolarHBondContact O-N 2.91Å; V404-S407 WeakPolarHBondContact O-CB 3.5Å; V404-S407 PolarHBondContact O-N 3.3Å; V404-S407 PolarHBondContact O-OG 3.18Å; V404-L451 HydrophobicContact CB-CD1 4.27Å; V404-L451 HydrophobicContact CG1-CD1 3.6Å; V404-L451 HydrophobicContact CG2-CD1 3.64Å; V404-F480 HydrophobicContact CG2-CE1 4.49Å; V404-F480 HydrophobicContact CG2-CE2 4.06Å; V404-F480 HydrophobicContact CG2-CZ 3.71Å
405	K	87.1	Confident	90.7	Very high	90 Å²	90	61 Å²	61	39%	0.391	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-28.8	177.6	-60.9	176.5	-173.8	154.8	0	114.1	D402 D403 D430	D402-K405 IonicContact OD1-NZ 2.84Å; D402-K405 PolarHBondContact OD1-NZ 3.05Å; D403-K405 PolarHBondContact O-N 3.23Å; K405-D430 WeakPolarHBondContact CA-OD2 3.49Å
406	K	88.8	Confident	90.9	Very high	174 Å²	174	58.5 Å²	58.5	76%	0.757	29%	0.29	S	S	*	.	H	α-helix	trans	-89.5	-15.9	178	-65.7	173.3	-171.8	161.9	0	112.3	D403 V404	D403-K406 PolarHBondContact O-N 3.46Å; V404-K406 PolarHBondContact O-N 2.91Å
407	S	87.9	Confident	91.1	Very high	37 Å²	37	53.1 Å²	53.1	26%	0.259	25%	0.254	S	S	.	.	S	Bend	trans	-85.4	172.7	-179.5	81	0	0	0	0	111	D403 V404 Y409	D403-S407 WeakPolarHBondContact O-CB 3.38Å; D403-S407 PolarHBondContact O-N 3.23Å; V404-S407 WeakPolarHBondContact O-CB 3.5Å; V404-S407 PolarHBondContact O-N 3.3Å; V404-S407 PolarHBondContact O-OG 3.18Å; S407-Y409 VanDerWaalsContact C-N 3.25Å; S407-Y409 WeakPolarHBondContact OG-CD2 3.32Å; S407-Y409 PolarHBondContact OG-N 3.29Å; S407-Y409 VanDerWaalsContact OG-N 3.16Å
408	R	89.6	Confident	91	Very high	129 Å²	129	50.2 Å²	50.2	49%	0.487	24%	0.243	S	C	.	.	S	Bend	trans	-80.9	-3.4	172.2	68.1	175.1	-173.5	-178.8	-5.9	113.7	D291	D291-R408 IonicContact OD1-CZ 2.64Å; D291-R408 IonicContact OD1-NH1 3.74Å; D291-R408 IonicContact OD1-NH2 3.29Å; D291-R408 PolarHBondContact OD1-NH2 3.35Å; D291-R408 IonicContact OD2-CZ 3.89Å; D291-R408 IonicContact OD2-NH1 3.38Å; D291-R408 PolarHBondContact OD2-NH1 3.02Å; D291-R408 IonicContact OD2-NH2 3.74Å; D291-R408 PolarHBondContact OD2-NH2 3.36Å
409	Y	91.5	Very high	90.6	Very high	15 Å²	15	51.5 Å²	51.5	6%	0.059	25%	0.248	C	C	.	.			trans	-89.9	137.4	-168.8	-54.5	-63.1	0	0	0	111.4	P288 L398 S407 T448 N449 L451	P288-Y409 HydrophobicContact CB-CD1 4.48Å; P288-Y409 HydrophobicContact CB-CE1 3.82Å; P288-Y409 HydrophobicContact CG-CD1 3.9Å; P288-Y409 HydrophobicContact CG-CE1 3.74Å; L398-Y409 HydrophobicContact CD1-CD2 4.07Å; L398-Y409 HydrophobicContact CD1-CE2 4.49Å; S407-Y409 VanDerWaalsContact C-N 3.25Å; S407-Y409 WeakPolarHBondContact OG-CD2 3.32Å; S407-Y409 PolarHBondContact OG-N 3.29Å; S407-Y409 VanDerWaalsContact OG-N 3.16Å; Y409-T448 WeakPolarHBondContact CD1-O 3.31Å; Y409-T448 WeakPolarHBondContact CE1-O 3.46Å; Y409-N449 WeakPolarHBondContact CA-O 3.46Å; Y409-L451 HydrophobicContact CG-CD2 4.48Å
410	T	93.6	Very high	90.4	Very high	39 Å²	39	48.5 Å²	48.5	24%	0.239	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.7	173.4	-55.4	0	0	0	0	109.4	A412 D430 E432 N449 Y450 L451	T410-A412 PolarHBondContact O-N 2.94Å; T410-D430 WeakPolarHBondContact CG2-O 3.42Å; T410-E432 HydrophobicContact CG2-CB 4.34Å; T410-E432 HydrophobicContact CG2-CG 3.78Å; T410-N449 PolarHBondContact N-O 3.37Å; T410-Y450 HydrophobicContact CG2-CD1 4.22Å; T410-Y450 HydrophobicContact CG2-CE1 4.05Å; T410-Y450 CarbonylContact O-C 3.56Å; T410-Y450 WeakPolarHBondContact O-CA 3.22Å; T410-L451 PolarHBondContact O-N 3Å
411	M	94.8	Very high	90.3	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	114.5	176.5	-167	-174	-68.1	0	0	109.7	F285 F401 I413 L421 D430 V431 E432	F285-M411 HydrophobicContact CD1-CG 4.46Å; F285-M411 HydrophobicContact CE1-CE 3.77Å; F285-M411 HydrophobicContact CE1-CG 3.71Å; F285-M411 HydrophobicContact CE1-SD 3.51Å; F285-M411 VanDerWaalsContact CE1-SD 3.51Å; F285-M411 HydrophobicContact CE2-CE 4.34Å; F285-M411 HydrophobicContact CZ-CE 3.58Å; F285-M411 HydrophobicContact CZ-CG 4.4Å; F285-M411 HydrophobicContact CZ-SD 3.6Å; F285-M411 VanDerWaalsContact CZ-SD 3.6Å; F401-M411 HydrophobicContact CD1-CE 3.87Å; F401-M411 HydrophobicContact CE1-CE 3.84Å; M411-I413 HydrophobicContact CG-CG2 3.67Å; M411-I413 HydrophobicContact SD-CG2 3.73Å; M411-L421 HydrophobicContact SD-CD1 4.03Å; M411-L421 HydrophobicContact SD-CD2 4.05Å; M411-D430 PolarHBondContact N-O 3.08Å; M411-V431 HydrophobicContact CB-CG2 4.22Å; M411-V431 CarbonylContact O-C 3.59Å; M411-V431 WeakPolarHBondContact O-CA 3.2Å; M411-V431 HydrophobicContact SD-CG2 4.45Å; M411-E432 PolarHBondContact O-N 2.89Å
412	A	96.1	Very high	90.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.9	170.4	0	0	0	0	0	108.1	T410 E432 Y434 F439 L442 Y450 L451 F452 P453	T410-A412 PolarHBondContact O-N 2.94Å; A412-E432 WeakPolarHBondContact CA-O 3.06Å; A412-Y434 HydrophobicContact CB-CD2 4.23Å; A412-Y434 HydrophobicContact CB-CE2 4.05Å; A412-F439 WeakPolarHBondContact O-CE2 3.44Å; A412-L442 HydrophobicContact CB-CD2 4.09Å; A412-Y450 HydrophobicContact CB-CD1 3.88Å; A412-Y450 HydrophobicContact CB-CG 4.15Å; A412-L451 PolarHBondContact N-O 3.35Å; A412-F452 HydrophobicContact CB-CD1 3.95Å; A412-F452 HydrophobicContact CB-CE1 3.73Å; A412-P453 WeakPolarHBondContact O-CD 3.46Å
413	I	94.4	Very high	90	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160	178.3	67.5	162.9	0	0	0	111.7	M411 E417 R418 L421 V431 E432 I433 Y434 P453	M411-I413 HydrophobicContact CG-CG2 3.67Å; M411-I413 HydrophobicContact SD-CG2 3.73Å; I413-E417 WeakPolarHBondContact CA-OE2 3.34Å; I413-E417 HydrophobicContact CB-CB 4.12Å; I413-E417 VanDerWaalsContact CB-OE2 3.31Å; I413-E417 WeakPolarHBondContact CB-OE2 3.46Å; I413-E417 HydrophobicContact CD1-CB 4.33Å; I413-R418 HydrophobicContact CD1-CB 4.48Å; I413-L421 HydrophobicContact CD1-CD1 3.65Å; I413-L421 HydrophobicContact CD1-CG 4.47Å; I413-L421 HydrophobicContact CG2-CD1 4.39Å; I413-V431 HydrophobicContact CD1-CG1 3.69Å; I413-V431 HydrophobicContact CG1-CG1 3.62Å; I413-V431 HydrophobicContact CG2-CG1 4.24Å; I413-E432 PolarHBondContact N-O 3.45Å; I413-I433 HydrophobicContact CD1-CD1 4.29Å; I413-I433 HydrophobicContact CD1-CG1 3.93Å; I413-I433 HydrophobicContact CG1-CB 4.41Å; I413-I433 HydrophobicContact CG1-CG1 3.78Å; I413-Y434 PolarHBondContact O-N 3.35Å; I413-P453 HydrophobicContact CG2-CG 4.2Å
414	N	91.4	Very high	89.8	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	154.6	168.7	-164.4	-15.3	0	0	0	111.4	Y416 E417 Y434 Y436 F439	N414-Y416 PolarHBondContact O-N 3.43Å; N414-E417 HydrophobicContact CB-CB 4.42Å; N414-E417 HydrophobicContact CB-CG 3.98Å; N414-E417 WeakPolarHBondContact CB-OE1 3.32Å; N414-E417 PolarHBondContact N-OE2 3.12Å; N414-E417 WeakPolarHBondContact O-CB 3.46Å; N414-E417 PolarHBondContact O-N 3.26Å; N414-Y434 CarbonylContact C-O 3.5Å; N414-Y434 WeakPolarHBondContact CA-O 3.23Å; N414-Y436 WeakPolarHBondContact ND2-CD2 3.45Å; N414-Y436 WeakPolarHBondContact ND2-CE2 3.31Å; N414-Y436 WeakPolarHBondContact OD1-CA 3.48Å; N414-F439 HydrophobicContact CB-CD1 4.14Å; N414-F439 HydrophobicContact CB-CG 4.2Å
415	I	90.8	Very high	89.8	Confident	82 Å²	82	57.4 Å²	57.4	42%	0.421	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-55.3	-38	177.1	-165.8	168.8	0	0	0	112.7	E417 R418 I433 Y434	I415-E417 VanDerWaalsContact C-N 3.27Å; I415-E417 PolarHBondContact O-N 2.81Å; I415-R418 WeakPolarHBondContact O-CB 3.22Å; I415-I433 HydrophobicContact CB-CG2 4.3Å; I415-I433 HydrophobicContact CG1-CG2 4.49Å; I415-Y434 PolarHBondContact N-O 2.96Å
416	Y	87.9	Confident	89.8	Confident	48 Å²	48	54.4 Å²	54.4	19%	0.188	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-75.5	-13.3	179.4	-53.6	-69.2	0	0	0	113.6	S243 F244 V245 N414 Y436	S243-Y416 VanDerWaalsContact CB-CE2 3.44Å; S243-Y416 WeakPolarHBondContact CB-OH 3.5Å; S243-Y416 PolarHBondContact OG-OH 3.44Å; F244-Y416 HydrophobicContact CE1-CD2 4.05Å; F244-Y416 HydrophobicContact CE1-CG 4.3Å; V245-Y416 HydrophobicContact CB-CD1 4.05Å; V245-Y416 HydrophobicContact CB-CE1 3.7Å; V245-Y416 HydrophobicContact CG1-CD1 4.34Å; V245-Y416 HydrophobicContact CG1-CE1 3.97Å; V245-Y416 HydrophobicContact CG2-CD1 3.42Å; V245-Y416 VanDerWaalsContact CG2-CD1 3.42Å; V245-Y416 HydrophobicContact CG2-CD2 4.12Å; V245-Y416 HydrophobicContact CG2-CE1 3.61Å; V245-Y416 HydrophobicContact CG2-CE2 4.3Å; V245-Y416 HydrophobicContact CG2-CG 3.68Å; N414-Y416 PolarHBondContact O-N 3.43Å; Y416-Y436 HydrophobicContact CD2-CD2 4.13Å; Y416-Y436 HydrophobicContact CE2-CD2 4.13Å
417	E	89.6	Confident	89.6	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.033	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-86.6	-13.2	179.8	-72.4	156.7	-163.9	0	0	113	Y283 I413 N414 I415 E419 F420 L421 P453 L482	Y283-E417 HydrophobicContact CE1-CG 4.06Å; Y283-E417 PolarHBondContact OH-OE1 3.44Å; I413-E417 WeakPolarHBondContact CA-OE2 3.34Å; I413-E417 HydrophobicContact CB-CB 4.12Å; I413-E417 VanDerWaalsContact CB-OE2 3.31Å; I413-E417 WeakPolarHBondContact CB-OE2 3.46Å; I413-E417 HydrophobicContact CD1-CB 4.33Å; N414-E417 HydrophobicContact CB-CB 4.42Å; N414-E417 HydrophobicContact CB-CG 3.98Å; N414-E417 WeakPolarHBondContact CB-OE1 3.32Å; N414-E417 PolarHBondContact N-OE2 3.12Å; N414-E417 WeakPolarHBondContact O-CB 3.46Å; N414-E417 PolarHBondContact O-N 3.26Å; I415-E417 VanDerWaalsContact C-N 3.27Å; I415-E417 PolarHBondContact O-N 2.81Å; E417-E419 PolarHBondContact O-N 3.43Å; E417-F420 WeakPolarHBondContact O-CB 3.34Å; E417-F420 PolarHBondContact O-N 3.16Å; E417-L421 PolarHBondContact O-N 3.27Å; E417-P453 WeakPolarHBondContact OE2-CG 3.5Å; E417-L482 HydrophobicContact CB-CD1 4.15Å; E417-L482 HydrophobicContact CG-CD1 4.07Å
418	R	89.4	Confident	89.5	Confident	95 Å²	95	49.4 Å²	49.4	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-52.1	-41.8	175.5	-180	-167.7	-69.5	-100.2	4.9	111.3	I413 I415 F420 L421 E422	I413-R418 HydrophobicContact CD1-CB 4.48Å; I415-R418 WeakPolarHBondContact O-CB 3.22Å; R418-F420 VanDerWaalsContact C-N 3.27Å; R418-F420 PolarHBondContact O-N 3.23Å; R418-L421 PolarHBondContact O-N 2.85Å; R418-L421 VanDerWaalsContact O-N 3.11Å; R418-E422 WeakPolarHBondContact CD-OE1 3.48Å; R418-E422 HydrophobicContact CG-CG 4.32Å; R418-E422 WeakPolarHBondContact CG-OE1 3.31Å; R418-E422 WeakPolarHBondContact O-CG 3.3Å; R418-E422 PolarHBondContact O-N 3.12Å
419	E	86	Confident	89.2	Confident	45 Å²	45	51.1 Å²	51.1	21%	0.21	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-36.8	179.8	-69	165.3	-158.5	0	0	112.4	R264 L266 E267 E417 A423	R264-E419 IonicContact CZ-OE1 2.87Å; R264-E419 IonicContact CZ-OE2 2.79Å; R264-E419 IonicContact NE-OE2 2.9Å; R264-E419 IonicContact NH2-OE1 3.92Å; R264-E419 PolarHBondContact NH2-OE1 3.23Å; R264-E419 IonicContact NH2-OE2 3.98Å; R264-E419 PolarHBondContact NH2-OE2 3.48Å; L266-E419 HydrophobicContact CD2-CB 3.97Å; E267-E419 VanDerWaalsContact OE1-CD 3.32Å; E417-E419 PolarHBondContact O-N 3.43Å; E419-A423 WeakPolarHBondContact O-CB 3.4Å; E419-A423 PolarHBondContact O-N 3.04Å
420	F	87.4	Confident	88.9	Confident	29 Å²	29	53.5 Å²	53.5	13%	0.127	28%	0.279	C	S	.	.	H	α-helix	trans	-67.8	-42	176.3	-70.3	-89.8	0	0	0	111.6	L266 E417 R418 A423 L424 L482 N483	L266-F420 HydrophobicContact CB-CE1 4.38Å; L266-F420 HydrophobicContact CB-CZ 4.12Å; L266-F420 HydrophobicContact CD1-CD1 4.21Å; L266-F420 HydrophobicContact CD1-CE1 3.87Å; L266-F420 HydrophobicContact CD1-CZ 4.46Å; L266-F420 HydrophobicContact CD2-CD1 3.81Å; L266-F420 HydrophobicContact CD2-CD2 3.93Å; L266-F420 HydrophobicContact CD2-CE1 3.8Å; L266-F420 HydrophobicContact CD2-CE2 3.94Å; L266-F420 HydrophobicContact CD2-CG 3.89Å; L266-F420 HydrophobicContact CD2-CZ 3.89Å; L266-F420 HydrophobicContact CG-CE1 4.24Å; L266-F420 HydrophobicContact CG-CZ 4.38Å; E417-F420 WeakPolarHBondContact O-CB 3.34Å; E417-F420 PolarHBondContact O-N 3.16Å; R418-F420 VanDerWaalsContact C-N 3.27Å; R418-F420 PolarHBondContact O-N 3.23Å; F420-A423 PolarHBondContact O-N 2.8Å; F420-L424 WeakPolarHBondContact O-CB 3.31Å; F420-L424 VanDerWaalsContact O-CG 3.24Å; F420-L424 WeakPolarHBondContact O-CG 3.21Å; F420-L424 PolarHBondContact O-N 2.63Å; F420-L482 HydrophobicContact CB-CB 4.06Å; F420-L482 HydrophobicContact CB-CD2 4.15Å; F420-L482 HydrophobicContact CB-CG 4.5Å; F420-L482 HydrophobicContact CD1-CB 4.39Å; F420-L482 HydrophobicContact CG-CB 4.29Å; F420-N483 HydrophobicContact CD1-CB 4.33Å; F420-N483 HydrophobicContact CE1-CB 4.04Å
421	L	89.4	Confident	88.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-39.3	177.9	-68.5	-175.2	0	0	0	112.2	F401 M411 I413 E417 R418 L424 N425 V426 L428 V431 L482	F401-L421 HydrophobicContact CE1-CD2 4.29Å; M411-L421 HydrophobicContact SD-CD1 4.03Å; M411-L421 HydrophobicContact SD-CD2 4.05Å; I413-L421 HydrophobicContact CD1-CD1 3.65Å; I413-L421 HydrophobicContact CD1-CG 4.47Å; I413-L421 HydrophobicContact CG2-CD1 4.39Å; E417-L421 PolarHBondContact O-N 3.27Å; R418-L421 PolarHBondContact O-N 2.85Å; R418-L421 VanDerWaalsContact O-N 3.11Å; L421-L424 CarbonylContact O-C 3.56Å; L421-L424 PolarHBondContact O-N 3.46Å; L421-N425 PolarHBondContact O-N 2.96Å; L421-N425 VanDerWaalsContact O-N 3.11Å; L421-V426 HydrophobicContact CB-CB 4.48Å; L421-V426 HydrophobicContact CD2-CB 4.15Å; L421-V426 HydrophobicContact CD2-CG1 4.28Å; L421-V426 HydrophobicContact CD2-CG2 4.4Å; L421-V426 PolarHBondContact O-N 3.08Å; L421-L428 HydrophobicContact CB-CD2 4.23Å; L421-L428 HydrophobicContact CD1-CD2 3.85Å; L421-V431 HydrophobicContact CD1-CG1 3.9Å; L421-V431 HydrophobicContact CD1-CG2 4.04Å; L421-L482 HydrophobicContact CD2-CD2 3.43Å; L421-L482 VanDerWaalsContact CD2-CD2 3.43Å; L421-L482 HydrophobicContact CG-CD2 4.03Å
422	E	88.3	Confident	88.9	Confident	102 Å²	102	55.8 Å²	55.8	48%	0.477	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-44.2	174.6	-71.6	177.3	-177.2	0	0	111	R418 L424 N425	R418-E422 WeakPolarHBondContact CD-OE1 3.48Å; R418-E422 HydrophobicContact CG-CG 4.32Å; R418-E422 WeakPolarHBondContact CG-OE1 3.31Å; R418-E422 WeakPolarHBondContact O-CG 3.3Å; R418-E422 PolarHBondContact O-N 3.12Å; E422-L424 PolarHBondContact O-N 3.29Å; E422-N425 PolarHBondContact O-N 2.96Å
423	A	86.6	Confident	88.8	Confident	73 Å²	73	58.4 Å²	58.4	60%	0.603	30%	0.301	S	S	*	.	H	α-helix	trans	-61.8	-31	175.2	0	0	0	0	0	113.1	E419 F420	E419-A423 WeakPolarHBondContact O-CB 3.4Å; E419-A423 PolarHBondContact O-N 3.04Å; F420-A423 PolarHBondContact O-N 2.8Å
424	L	87	Confident	88.7	Confident	79 Å²	79	61.2 Å²	61.2	41%	0.414	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.9	176.9	-67.3	172.1	0	0	0	113.8	F401 F420 L421 E422 V426	F401-L424 HydrophobicContact CE2-CD1 4.26Å; F401-L424 HydrophobicContact CZ-CD1 4.06Å; F420-L424 WeakPolarHBondContact O-CB 3.31Å; F420-L424 VanDerWaalsContact O-CG 3.24Å; F420-L424 WeakPolarHBondContact O-CG 3.21Å; F420-L424 PolarHBondContact O-N 2.63Å; L421-L424 CarbonylContact O-C 3.56Å; L421-L424 PolarHBondContact O-N 3.46Å; E422-L424 PolarHBondContact O-N 3.29Å; L424-V426 VanDerWaalsContact C-N 3.27Å; L424-V426 HydrophobicContact CB-CG2 3.84Å; L424-V426 PolarHBondContact O-N 3.18Å
425	N	87.6	Confident	88.7	Confident	152 Å²	152	65.2 Å²	65.2	81%	0.813	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	38.3	-174.5	-64.2	-54.5	0	0	0	113.8	L421 E422	L421-N425 PolarHBondContact O-N 2.96Å; L421-N425 VanDerWaalsContact O-N 3.11Å; E422-N425 PolarHBondContact O-N 2.96Å
426	V	87.3	Confident	88.4	Confident	27 Å²	27	62.1 Å²	62.1	16%	0.164	32%	0.317	C	S	.	.			trans	-86.8	138.3	177.6	-180	0	0	0	0	110	F401 L421 L424	F401-V426 HydrophobicContact CB-CG1 4.42Å; F401-V426 HydrophobicContact CB-CG2 4.49Å; F401-V426 HydrophobicContact CD1-CG1 4.07Å; F401-V426 HydrophobicContact CD1-CG2 4.11Å; F401-V426 HydrophobicContact CD2-CG2 4Å; F401-V426 HydrophobicContact CE1-CG2 4.28Å; F401-V426 HydrophobicContact CE2-CG2 4.19Å; F401-V426 HydrophobicContact CG-CG1 4.34Å; F401-V426 HydrophobicContact CG-CG2 3.96Å; F401-V426 HydrophobicContact CZ-CG2 4.33Å; L421-V426 HydrophobicContact CB-CB 4.48Å; L421-V426 HydrophobicContact CD2-CB 4.15Å; L421-V426 HydrophobicContact CD2-CG1 4.28Å; L421-V426 HydrophobicContact CD2-CG2 4.4Å; L421-V426 PolarHBondContact O-N 3.08Å; L424-V426 VanDerWaalsContact C-N 3.27Å; L424-V426 HydrophobicContact CB-CG2 3.84Å; L424-V426 PolarHBondContact O-N 3.18Å
427	S	85.9	Confident	88.3	Confident	47 Å²	47	60.1 Å²	60.1	33%	0.329	31%	0.311	S	S	.	.			trans	-66.3	140.5	175.7	-176.5	0	0	0	0	111.1	E429	S427-E429 WeakPolarHBondContact OG-CG 2.93Å; S427-E429 PolarHBondContact OG-N 2.6Å
428	L	85.4	Confident	88.4	Confident	60 Å²	60	66.4 Å²	66.4	31%	0.314	34%	0.338	S	S	.	.	S	Bend	trans	-92.5	6.1	179.3	-61.8	177.4	0	0	0	113.7	L421 D430 V431	L421-L428 HydrophobicContact CB-CD2 4.23Å; L421-L428 HydrophobicContact CD1-CD2 3.85Å; L428-D430 PolarHBondContact O-N 3.34Å; L428-V431 HydrophobicContact CD2-CB 4.34Å; L428-V431 HydrophobicContact CD2-CG1 4.4Å; L428-V431 HydrophobicContact CD2-CG2 4.31Å; L428-V431 PolarHBondContact O-N 2.73Å
429	E	83.7	Confident	88.5	Confident	165 Å²	165	62.3 Å²	62.3	77%	0.771	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-40.9	-175.9	-72.2	172.1	164.2	0	0	113.1	S427	S427-E429 WeakPolarHBondContact OG-CG 2.93Å; S427-E429 PolarHBondContact OG-N 2.6Å
430	D	85.4	Confident	88.6	Confident	65 Å²	65	61.3 Å²	61.3	35%	0.348	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	27.8	-179.6	-58	-50.3	0	0	0	112.5	K405 T410 M411 L428	K405-D430 WeakPolarHBondContact CA-OD2 3.49Å; T410-D430 WeakPolarHBondContact CG2-O 3.42Å; M411-D430 PolarHBondContact N-O 3.08Å; L428-D430 PolarHBondContact O-N 3.34Å
431	V	92.4	Very high	88.7	Confident	21 Å²	21	65.7 Å²	65.7	13%	0.127	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.3	-174.7	-176.1	0	0	0	0	110.5	M411 I413 L421 L428 I433	M411-V431 HydrophobicContact CB-CG2 4.22Å; M411-V431 CarbonylContact O-C 3.59Å; M411-V431 WeakPolarHBondContact O-CA 3.2Å; M411-V431 HydrophobicContact SD-CG2 4.45Å; I413-V431 HydrophobicContact CD1-CG1 3.69Å; I413-V431 HydrophobicContact CG1-CG1 3.62Å; I413-V431 HydrophobicContact CG2-CG1 4.24Å; L421-V431 HydrophobicContact CD1-CG1 3.9Å; L421-V431 HydrophobicContact CD1-CG2 4.04Å; L428-V431 HydrophobicContact CD2-CB 4.34Å; L428-V431 HydrophobicContact CD2-CG1 4.4Å; L428-V431 HydrophobicContact CD2-CG2 4.31Å; L428-V431 PolarHBondContact O-N 2.73Å; V431-I433 HydrophobicContact CG1-CG1 4.15Å
432	E	94.4	Very high	88.9	Confident	71 Å²	71	67.2 Å²	67.2	33%	0.332	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.6	172.3	-72.5	-174.5	-179.7	0	0	110.7	T410 M411 A412 I413 Y434 Y450	T410-E432 HydrophobicContact CG2-CB 4.34Å; T410-E432 HydrophobicContact CG2-CG 3.78Å; M411-E432 PolarHBondContact O-N 2.89Å; A412-E432 WeakPolarHBondContact CA-O 3.06Å; I413-E432 PolarHBondContact N-O 3.45Å; E432-Y434 HydrophobicContact CB-CD2 4.33Å; E432-Y434 HydrophobicContact CB-CE2 3.55Å; E432-Y434 PolarHBondContact OE2-OH 3.08Å; E432-Y450 VanDerWaalsContact OE2-CE1 3.25Å; E432-Y450 WeakPolarHBondContact OE2-CE1 3.14Å; E432-Y450 PolarHBondContact OE2-OH 3.3Å
433	I	94.3	Very high	89.1	Confident	54 Å²	54	63.4 Å²	63.4	28%	0.277	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.4	-172.1	-55.5	177.3	0	0	0	109.1	I413 I415 V431	I413-I433 HydrophobicContact CD1-CD1 4.29Å; I413-I433 HydrophobicContact CD1-CG1 3.93Å; I413-I433 HydrophobicContact CG1-CB 4.41Å; I413-I433 HydrophobicContact CG1-CG1 3.78Å; I415-I433 HydrophobicContact CB-CG2 4.3Å; I415-I433 HydrophobicContact CG1-CG2 4.49Å; V431-I433 HydrophobicContact CG1-CG1 4.15Å
434	Y	92.8	Very high	89.2	Confident	59 Å²	59	63.2 Å²	63.2	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.4	-177.3	-67.9	-87.4	0	0	0	110.9	A412 I413 N414 I415 E432 L442	A412-Y434 HydrophobicContact CB-CD2 4.23Å; A412-Y434 HydrophobicContact CB-CE2 4.05Å; I413-Y434 PolarHBondContact O-N 3.35Å; N414-Y434 CarbonylContact C-O 3.5Å; N414-Y434 WeakPolarHBondContact CA-O 3.23Å; I415-Y434 PolarHBondContact N-O 2.96Å; E432-Y434 HydrophobicContact CB-CD2 4.33Å; E432-Y434 HydrophobicContact CB-CE2 3.55Å; E432-Y434 PolarHBondContact OE2-OH 3.08Å; Y434-L442 HydrophobicContact CD2-CD2 4.08Å; Y434-L442 HydrophobicContact CE1-CD2 4.13Å; Y434-L442 HydrophobicContact CE2-CD2 3.64Å
435	D	90.4	Very high	89.4	Confident	89 Å²	89	62.8 Å²	62.8	48%	0.476	32%	0.324	S	S	.	.			trans	-68	155.1	168.6	-173.6	22.1	0	0	0	111	G437 K438 F439	D435-G437 PolarHBondContact O-N 3.16Å; D435-K438 HydrophobicContact CB-CD 4.47Å; D435-K438 PolarHBondContact O-N 3.21Å; D435-K438 VanDerWaalsContact O-N 3.08Å; D435-F439 WeakPolarHBondContact O-CB 3.4Å; D435-F439 PolarHBondContact O-N 3.46Å
436	Y	86.1	Confident	89.5	Confident	17 Å²	17	56.1 Å²	56.1	7%	0.067	29%	0.288	C	S	.	.	H	α-helix	trans	-50.1	-52.6	-169.9	-171.6	-90.5	0	0	0	112.5	F244 N414 Y416 F439 S440	F244-Y436 HydrophobicContact CD1-CD2 4.24Å; F244-Y436 AromaticContact CD1-CE2 3.62Å; F244-Y436 HydrophobicContact CD1-CE2 3.62Å; F244-Y436 HydrophobicContact CE1-CD2 4.45Å; F244-Y436 HydrophobicContact CE1-CE2 4.05Å; N414-Y436 WeakPolarHBondContact ND2-CD2 3.45Å; N414-Y436 WeakPolarHBondContact ND2-CE2 3.31Å; N414-Y436 WeakPolarHBondContact OD1-CA 3.48Å; Y416-Y436 HydrophobicContact CD2-CD2 4.13Å; Y416-Y436 HydrophobicContact CE2-CD2 4.13Å; Y436-F439 PolarHBondContact O-N 2.73Å; Y436-S440 PolarHBondContact O-N 2.71Å; Y436-S440 VanDerWaalsContact O-N 3.14Å
437	G	85.4	Confident	89.8	Confident	5 Å²	5	57.3 Å²	57.3	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-69.5	-37.3	-179.2	0	0	0	0	0	114.6	E241 D435 K441	E241-G437 WeakPolarHBondContact OE2-CA 3.44Å; D435-G437 PolarHBondContact O-N 3.16Å; G437-K441 WeakPolarHBondContact O-CG 3.41Å; G437-K441 PolarHBondContact O-N 3.25Å; G437-K441 VanDerWaalsContact O-N 3.12Å
438	K	90.4	Very high	90.1	Very high	139 Å²	139	57.3 Å²	57.3	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-67.8	-39.3	177	-70.1	-178.8	-176.8	170.6	0	111.2	D435 K441 L442	D435-K438 HydrophobicContact CB-CD 4.47Å; D435-K438 PolarHBondContact O-N 3.21Å; D435-K438 VanDerWaalsContact O-N 3.08Å; K438-K441 PolarHBondContact O-N 3.4Å; K438-L442 WeakPolarHBondContact O-CB 3.02Å; K438-L442 PolarHBondContact O-N 3.35Å
439	F	92.3	Very high	90.4	Very high	9 Å²	9	58.5 Å²	58.5	4%	0.039	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-49.8	175.4	174.1	-103.2	0	0	0	111.4	A412 N414 D435 Y436 K441 L442 R443 F452 P453	A412-F439 WeakPolarHBondContact O-CE2 3.44Å; N414-F439 HydrophobicContact CB-CD1 4.14Å; N414-F439 HydrophobicContact CB-CG 4.2Å; D435-F439 WeakPolarHBondContact O-CB 3.4Å; D435-F439 PolarHBondContact O-N 3.46Å; Y436-F439 PolarHBondContact O-N 2.73Å; F439-K441 VanDerWaalsContact C-N 3.32Å; F439-K441 PolarHBondContact O-N 3.05Å; F439-L442 PolarHBondContact O-N 2.9Å; F439-R443 WeakPolarHBondContact O-CB 3.31Å; F439-R443 PolarHBondContact O-N 3.22Å; F439-F452 AromaticContact CE2-CD1 3.96Å; F439-F452 HydrophobicContact CE2-CD1 3.96Å; F439-F452 HydrophobicContact CZ-CD1 4.46Å; F439-P453 HydrophobicContact CE2-CG 4.3Å; F439-P453 HydrophobicContact CZ-CG 3.84Å
440	S	89	Confident	90.9	Very high	24 Å²	24	52.4 Å²	52.4	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-42.6	178.9	-166.3	0	0	0	0	111.6	E193 Y436 R443 S444	E193-S440 PolarHBondContact OE1-OG 3.44Å; E193-S440 PolarHBondContact OE2-OG 2.92Å; Y436-S440 PolarHBondContact O-N 2.71Å; Y436-S440 VanDerWaalsContact O-N 3.14Å; S440-R443 PolarHBondContact O-N 2.98Å; S440-S444 PolarHBondContact O-N 3.06Å; S440-S444 VanDerWaalsContact O-N 3.14Å
441	K	89.8	Confident	91.4	Very high	122 Å²	122	49.3 Å²	49.3	53%	0.53	25%	0.252	S	S	.	.	H	α-helix	trans	-62.3	-48.5	173.9	-72.5	169.9	-170.3	160.8	0	112.3	E241 G437 K438 F439 R443 S444 T445	E241-K441 VanDerWaalsContact OE1-CE 3.31Å; E241-K441 WeakPolarHBondContact OE1-CE 3.28Å; E241-K441 IonicContact OE1-NZ 3.47Å; E241-K441 PolarHBondContact OE1-NZ 3.41Å; G437-K441 WeakPolarHBondContact O-CG 3.41Å; G437-K441 PolarHBondContact O-N 3.25Å; G437-K441 VanDerWaalsContact O-N 3.12Å; K438-K441 PolarHBondContact O-N 3.4Å; F439-K441 VanDerWaalsContact C-N 3.32Å; F439-K441 PolarHBondContact O-N 3.05Å; K441-R443 VanDerWaalsContact C-N 3.33Å; K441-R443 PolarHBondContact O-N 2.94Å; K441-S444 WeakPolarHBondContact O-CB 3.49Å; K441-S444 PolarHBondContact O-N 2.92Å; K441-S444 PolarHBondContact O-OG 3.02Å; K441-T445 PolarHBondContact O-N 3.21Å
442	L	93.1	Very high	91.6	Very high	32 Å²	32	48.3 Å²	48.3	17%	0.168	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-44.6	-180	-179.4	64.3	0	0	0	111.1	A412 Y434 K438 F439 S444 T445 Y450 F452	A412-L442 HydrophobicContact CB-CD2 4.09Å; Y434-L442 HydrophobicContact CD2-CD2 4.08Å; Y434-L442 HydrophobicContact CE1-CD2 4.13Å; Y434-L442 HydrophobicContact CE2-CD2 3.64Å; K438-L442 WeakPolarHBondContact O-CB 3.02Å; K438-L442 PolarHBondContact O-N 3.35Å; F439-L442 PolarHBondContact O-N 2.9Å; L442-S444 VanDerWaalsContact C-N 3.28Å; L442-S444 PolarHBondContact O-N 3.29Å; L442-T445 WeakPolarHBondContact O-CB 3.35Å; L442-T445 PolarHBondContact O-N 3.47Å; L442-T445 PolarHBondContact O-OG1 3.09Å; L442-Y450 HydrophobicContact CD1-CE2 4.49Å; L442-F452 HydrophobicContact CD2-CE1 4.04Å; L442-F452 HydrophobicContact CG-CE1 3.87Å; L442-F452 HydrophobicContact CG-CZ 4.1Å
443	R	92.2	Very high	91.6	Very high	22 Å²	22	45 Å²	45	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-39.2	177.1	-174.2	173.2	57.4	76.9	6.6	112.1	E193 F439 S440 K441 T445 F446 F452 Q458	E193-R443 IonicContact OE1-CZ 2.76Å; E193-R443 IonicContact OE1-NH2 3.66Å; E193-R443 PolarHBondContact OE1-NH2 3.2Å; F439-R443 WeakPolarHBondContact O-CB 3.31Å; F439-R443 PolarHBondContact O-N 3.22Å; S440-R443 PolarHBondContact O-N 2.98Å; K441-R443 VanDerWaalsContact C-N 3.33Å; K441-R443 PolarHBondContact O-N 2.94Å; R443-T445 PolarHBondContact O-N 2.79Å; R443-T445 VanDerWaalsContact O-N 3.16Å; R443-F446 PolarHBondContact O-N 3.28Å; R443-F452 HydrophobicContact CB-CD1 3.89Å; R443-F452 HydrophobicContact CB-CE1 4.18Å; R443-F452 HydrophobicContact CB-CG 4.24Å; R443-F452 HydrophobicContact CG-CB 4.01Å; R443-F452 HydrophobicContact CG-CD1 4.08Å; R443-F452 HydrophobicContact CG-CD2 4.43Å; R443-F452 HydrophobicContact CG-CG 3.92Å; R443-Q458 VanDerWaalsContact CZ-NE2 3.29Å; R443-Q458 VanDerWaalsContact NH1-CD 3.3Å
444	S	88.6	Confident	91.7	Very high	69 Å²	69	42.4 Å²	42.4	48%	0.483	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-14.1	176.2	80.9	0	0	0	0	114.4	S440 K441 L442 F446	S440-S444 PolarHBondContact O-N 3.06Å; S440-S444 VanDerWaalsContact O-N 3.14Å; K441-S444 WeakPolarHBondContact O-CB 3.49Å; K441-S444 PolarHBondContact O-N 2.92Å; K441-S444 PolarHBondContact O-OG 3.02Å; L442-S444 VanDerWaalsContact C-N 3.28Å; L442-S444 PolarHBondContact O-N 3.29Å; S444-F446 VanDerWaalsContact C-N 3.29Å; S444-F446 WeakPolarHBondContact O-CD2 3.39Å
445	T	90.3	Very high	91.7	Very high	70 Å²	70	40.2 Å²	40.2	43%	0.429	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.6	177.9	69.5	0	0	0	0	113.7	K441 L442 R443 N447	K441-T445 PolarHBondContact O-N 3.21Å; L442-T445 WeakPolarHBondContact O-CB 3.35Å; L442-T445 PolarHBondContact O-N 3.47Å; L442-T445 PolarHBondContact O-OG1 3.09Å; R443-T445 PolarHBondContact O-N 2.79Å; R443-T445 VanDerWaalsContact O-N 3.16Å; T445-N447 PolarHBondContact O-N 3.01Å
446	F	91.3	Very high	91.9	Very high	12 Å²	12	37.6 Å²	37.6	5%	0.053	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	38.9	-177.6	-74.5	-96.8	0	0	0	113.2	M286 R443 S444 T448 I462 E465 Q466 F469 I473 F474 F537	M286-F446 HydrophobicContact CE-CD1 3.44Å; M286-F446 VanDerWaalsContact CE-CD1 3.44Å; M286-F446 HydrophobicContact CE-CE1 3.48Å; M286-F446 VanDerWaalsContact CE-CE1 3.48Å; M286-F446 HydrophobicContact CE-CG 4.36Å; M286-F446 HydrophobicContact CE-CZ 4.41Å; R443-F446 PolarHBondContact O-N 3.28Å; S444-F446 VanDerWaalsContact C-N 3.29Å; S444-F446 WeakPolarHBondContact O-CD2 3.39Å; F446-T448 PolarHBondContact O-N 3.14Å; F446-I462 HydrophobicContact CE1-CG2 3.75Å; F446-I462 HydrophobicContact CZ-CG2 3.89Å; F446-E465 HydrophobicContact CZ-CG 4.48Å; F446-Q466 HydrophobicContact CE1-CG 3.93Å; F446-F469 HydrophobicContact CD1-CE2 4.11Å; F446-F469 AromaticContact CE1-CE2 3.95Å; F446-F469 HydrophobicContact CE1-CE2 3.95Å; F446-F469 HydrophobicContact CE1-CZ 4.3Å; F446-F469 HydrophobicContact CE2-CZ 4.29Å; F446-F469 HydrophobicContact CZ-CE2 4.26Å; F446-F469 HydrophobicContact CZ-CZ 4.14Å; F446-I473 HydrophobicContact CB-CD1 3.73Å; F446-I473 HydrophobicContact CD1-CD1 3.7Å; F446-I473 HydrophobicContact CD1-CG1 4.28Å; F446-I473 HydrophobicContact CG-CD1 4Å; F446-F474 HydrophobicContact CB-CE2 3.95Å; F446-F474 AromaticContact CD1-CD2 3.77Å; F446-F474 HydrophobicContact CD1-CD2 3.77Å; F446-F474 AromaticContact CD1-CE2 3.89Å; F446-F474 HydrophobicContact CD1-CE2 3.89Å; F446-F474 HydrophobicContact CG-CE2 4.39Å; F446-F474 WeakPolarHBondContact O-CE2 3.46Å; F446-F537 HydrophobicContact CB-CB 4.17Å; F446-F537 HydrophobicContact CB-CG 4.46Å; F446-F537 HydrophobicContact CD2-CD2 4.02Å; F446-F537 HydrophobicContact CD2-CE2 4.33Å; F446-F537 HydrophobicContact CD2-CG 4.33Å; F446-F537 HydrophobicContact CE2-CD2 4.43Å
447	N	92.5	Very high	92.2	Very high	52 Å²	52	38 Å²	38	28%	0.278	20%	0.204	S	C	.	.			trans	-71.8	116.3	-179.5	-173.8	-21.3	0	0	0	111.8	T445 N449 Y450 F474	T445-N447 PolarHBondContact O-N 3.01Å; N447-N449 PolarHBondContact O-N 3.11Å; N447-N449 WeakPolarHBondContact OD1-CB 3.46Å; N447-N449 PolarHBondContact OD1-N 2.93Å; N447-Y450 HydrophobicContact CB-CD2 4.05Å; N447-Y450 PolarHBondContact O-N 2.93Å; N447-F474 WeakPolarHBondContact O-CZ 3.44Å
448	T	91.6	Very high	92.5	Very high	46 Å²	46	38.7 Å²	38.7	28%	0.282	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-2	-175	55.4	0	0	0	0	114.9	P288 Y409 F446 Y450 F474	P288-T448 HydrophobicContact CB-CG2 4.46Å; P288-T448 WeakPolarHBondContact CG-O 3.16Å; Y409-T448 WeakPolarHBondContact CD1-O 3.31Å; Y409-T448 WeakPolarHBondContact CE1-O 3.46Å; F446-T448 PolarHBondContact O-N 3.14Å; T448-Y450 VanDerWaalsContact C-N 3.33Å; T448-F474 HydrophobicContact CG2-CE2 4.19Å; T448-F474 HydrophobicContact CG2-CZ 4.3Å
449	N	92.8	Very high	92.7	Very high	85 Å²	85	33.6 Å²	33.6	46%	0.455	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-17.2	172.6	-66.1	-16.3	0	0	0	112.4	Y409 T410 N447	Y409-N449 WeakPolarHBondContact CA-O 3.46Å; T410-N449 PolarHBondContact N-O 3.37Å; N447-N449 PolarHBondContact O-N 3.11Å; N447-N449 WeakPolarHBondContact OD1-CB 3.46Å; N447-N449 PolarHBondContact OD1-N 2.93Å
450	Y	95.1	Very high	92.7	Very high	38 Å²	38	36.4 Å²	36.4	15%	0.149	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.8	-173.4	-63.5	-74.5	0	0	0	113.2	P288 T410 A412 E432 L442 N447 T448 F452	P288-Y450 WeakPolarHBondContact CD-O 3.15Å; P288-Y450 WeakPolarHBondContact CG-O 3.2Å; T410-Y450 HydrophobicContact CG2-CD1 4.22Å; T410-Y450 HydrophobicContact CG2-CE1 4.05Å; T410-Y450 CarbonylContact O-C 3.56Å; T410-Y450 WeakPolarHBondContact O-CA 3.22Å; A412-Y450 HydrophobicContact CB-CD1 3.88Å; A412-Y450 HydrophobicContact CB-CG 4.15Å; E432-Y450 VanDerWaalsContact OE2-CE1 3.25Å; E432-Y450 WeakPolarHBondContact OE2-CE1 3.14Å; E432-Y450 PolarHBondContact OE2-OH 3.3Å; L442-Y450 HydrophobicContact CD1-CE2 4.49Å; N447-Y450 HydrophobicContact CB-CD2 4.05Å; N447-Y450 PolarHBondContact O-N 2.93Å; T448-Y450 VanDerWaalsContact C-N 3.33Å; Y450-F452 VanDerWaalsContact CB-CZ 3.48Å; Y450-F452 HydrophobicContact CD2-CZ 4.29Å; Y450-F452 HydrophobicContact CG-CZ 4.2Å
451	L	95.2	Very high	92.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	132	161.5	-59.2	172.1	0	0	0	108.4	F285 A287 L398 V404 Y409 T410 A412	F285-L451 HydrophobicContact CD1-CB 4.24Å; A287-L451 HydrophobicContact CB-CD2 3.54Å; L398-L451 HydrophobicContact CD1-CD1 3.99Å; L398-L451 HydrophobicContact CD1-CD2 3.77Å; V404-L451 HydrophobicContact CB-CD1 4.27Å; V404-L451 HydrophobicContact CG1-CD1 3.6Å; V404-L451 HydrophobicContact CG2-CD1 3.64Å; Y409-L451 HydrophobicContact CG-CD2 4.48Å; T410-L451 PolarHBondContact O-N 3Å; A412-L451 PolarHBondContact N-O 3.35Å
452	F	96.1	Very high	92.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.3	180	-62.3	-76.1	0	0	0	110.5	F285 M286 A412 F439 L442 R443 Y450 V454 F474	F285-F452 CarbonylContact C-O 3.55Å; F285-F452 WeakPolarHBondContact CA-O 3.33Å; M286-F452 HydrophobicContact CB-CB 4.41Å; M286-F452 PolarHBondContact N-O 3.49Å; M286-F452 PolarHBondContact O-N 3.28Å; M286-F452 VanDerWaalsContact O-N 3.1Å; A412-F452 HydrophobicContact CB-CD1 3.95Å; A412-F452 HydrophobicContact CB-CE1 3.73Å; F439-F452 AromaticContact CE2-CD1 3.96Å; F439-F452 HydrophobicContact CE2-CD1 3.96Å; F439-F452 HydrophobicContact CZ-CD1 4.46Å; L442-F452 HydrophobicContact CD2-CE1 4.04Å; L442-F452 HydrophobicContact CG-CE1 3.87Å; L442-F452 HydrophobicContact CG-CZ 4.1Å; R443-F452 HydrophobicContact CB-CD1 3.89Å; R443-F452 HydrophobicContact CB-CE1 4.18Å; R443-F452 HydrophobicContact CB-CG 4.24Å; R443-F452 HydrophobicContact CG-CB 4.01Å; R443-F452 HydrophobicContact CG-CD1 4.08Å; R443-F452 HydrophobicContact CG-CD2 4.43Å; R443-F452 HydrophobicContact CG-CG 3.92Å; Y450-F452 VanDerWaalsContact CB-CZ 3.48Å; Y450-F452 HydrophobicContact CD2-CZ 4.29Å; Y450-F452 HydrophobicContact CG-CZ 4.2Å; F452-V454 PolarHBondContact O-N 2.94Å; F452-F474 HydrophobicContact CD2-CE1 4.25Å; F452-F474 HydrophobicContact CE2-CE1 4.41Å; F452-F474 HydrophobicContact CE2-CZ 4.42Å
453	P	94.9	Very high	92.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.5	167.8	25.8	-29.5	0	0	0	109.7	Y283 C284 F285 A412 I413 E417 F439 L482	Y283-P453 HydrophobicContact CD2-CB 4.44Å; Y283-P453 HydrophobicContact CE2-CB 3.85Å; C284-P453 CarbonylContact O-C 3.47Å; C284-P453 VanDerWaalsContact O-CA 3.29Å; C284-P453 WeakPolarHBondContact O-CA 3.04Å; F285-P453 HydrophobicContact CD1-CB 4.24Å; F285-P453 HydrophobicContact CE1-CB 4.01Å; F285-P453 HydrophobicContact CE1-CG 4.39Å; A412-P453 WeakPolarHBondContact O-CD 3.46Å; I413-P453 HydrophobicContact CG2-CG 4.2Å; E417-P453 WeakPolarHBondContact OE2-CG 3.5Å; F439-P453 HydrophobicContact CE2-CG 4.3Å; F439-P453 HydrophobicContact CZ-CG 3.84Å; P453-L482 HydrophobicContact CB-CD1 3.6Å; P453-L482 HydrophobicContact CB-CG 4.4Å; P453-L482 HydrophobicContact CG-CD1 4.17Å
454	V	95.1	Very high	92.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	143.9	177.5	-63.2	0	0	0	0	109.7	Y283 C284 M286 F452 W459 I462 Y476	Y283-V454 VanDerWaalsContact CD2-C 3.44Å; C284-V454 PolarHBondContact N-O 3.43Å; C284-V454 PolarHBondContact O-N 3.37Å; M286-V454 HydrophobicContact CB-CG1 4Å; M286-V454 HydrophobicContact CB-CG2 3.67Å; F452-V454 PolarHBondContact O-N 2.94Å; V454-W459 HydrophobicContact CG2-CB 4.16Å; V454-W459 HydrophobicContact CG2-CE3 4.48Å; V454-I462 HydrophobicContact CG1-CD1 4.03Å; V454-Y476 HydrophobicContact CG2-CD2 4.16Å; V454-Y476 HydrophobicContact CG2-CE2 4.06Å
455	T	94	Very high	92.9	Very high	14 Å²	14	28.8 Å²	28.8	9%	0.086	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	152.8	170.5	63.5	0	0	0	0	110	S282 Y283 L457 Q458 W459	S282-T455 CarbonylContact O-C 3.49Å; S282-T455 VanDerWaalsContact O-CA 3.27Å; S282-T455 WeakPolarHBondContact O-CA 3.39Å; Y283-T455 HydrophobicContact CD2-CG2 3.84Å; Y283-T455 HydrophobicContact CE2-CG2 4.13Å; Y283-T455 HydrophobicContact CG-CG2 4.32Å; T455-L457 PolarHBondContact O-N 3.48Å; T455-L457 VanDerWaalsContact O-N 3.16Å; T455-Q458 PolarHBondContact O-N 2.95Å; T455-Q458 WeakPolarHBondContact OG1-CB 3.34Å; T455-Q458 PolarHBondContact OG1-N 3.43Å; T455-W459 PolarHBondContact O-N 2.86Å
456	A	93.8	Very high	92.9	Very high	34 Å²	34	25.5 Å²	25.5	28%	0.281	13%	0.132	S	C	.	.	H	α-helix	trans	-58.1	-30.1	175.1	0	0	0	0	0	112.3	S281 S282 F460 Y476	S281-A456 WeakPolarHBondContact OG-CB 3.4Å; S281-A456 PolarHBondContact OG-N 2.86Å; S282-A456 PolarHBondContact O-N 3.41Å; A456-F460 PolarHBondContact O-N 3.49Å; A456-F460 VanDerWaalsContact O-N 3.16Å; A456-Y476 HydrophobicContact CB-CE1 4.5Å
457	L	92.3	Very high	92.9	Very high	26 Å²	26	30.7 Å²	30.7	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-41.3	174.4	-66.3	174.1	0	0	0	112	L279 S281 T455 L488 I519	L279-L457 HydrophobicContact CB-CD1 4.12Å; L279-L457 HydrophobicContact CD1-CD1 3.75Å; L279-L457 HydrophobicContact CD1-CD2 4.46Å; S281-L457 PolarHBondContact OG-N 3.4Å; T455-L457 PolarHBondContact O-N 3.48Å; T455-L457 VanDerWaalsContact O-N 3.16Å; L457-L488 HydrophobicContact CD1-CD1 4.29Å; L457-I519 HydrophobicContact CD2-CD1 3.95Å
458	Q	92.6	Very high	92.6	Very high	19 Å²	19	32.3 Å²	32.3	9%	0.089	16%	0.163	C	C	.	.	H	α-helix	trans	-71.5	-41	175.6	-171.9	170.6	56.4	0	0	111.5	E193 P194 R443 T455 F460 T461 I462	E193-Q458 PolarHBondContact OE1-NE2 2.76Å; P194-Q458 PolarHBondContact O-NE2 2.86Å; R443-Q458 VanDerWaalsContact CZ-NE2 3.29Å; R443-Q458 VanDerWaalsContact NH1-CD 3.3Å; T455-Q458 PolarHBondContact O-N 2.95Å; T455-Q458 WeakPolarHBondContact OG1-CB 3.34Å; T455-Q458 PolarHBondContact OG1-N 3.43Å; Q458-F460 PolarHBondContact O-N 3.35Å; Q458-T461 PolarHBondContact O-N 2.88Å; Q458-T461 VanDerWaalsContact O-N 3.08Å; Q458-I462 HydrophobicContact CG-CD1 4.11Å; Q458-I462 PolarHBondContact O-N 3.24Å
459	W	94.6	Very high	92.5	Very high	32 Å²	32	30.8 Å²	30.8	12%	0.121	15%	0.152	C	C	.	.	H	α-helix	trans	-55.6	-37.5	176.1	174.5	-108.6	0	0	0	112.6	M286 V454 T455 T461 I462 N463 F474 Y475 Y476	M286-W459 HydrophobicContact CB-CE3 4.17Å; M286-W459 HydrophobicContact CB-CZ3 4.08Å; M286-W459 HydrophobicContact CG-CE3 4.27Å; M286-W459 HydrophobicContact CG-CZ3 3.74Å; M286-W459 HydrophobicContact SD-CE3 4.4Å; M286-W459 HydrophobicContact SD-CZ3 4.03Å; V454-W459 HydrophobicContact CG2-CB 4.16Å; V454-W459 HydrophobicContact CG2-CE3 4.48Å; T455-W459 PolarHBondContact O-N 2.86Å; W459-T461 VanDerWaalsContact C-N 3.27Å; W459-T461 PolarHBondContact O-N 3.46Å; W459-I462 HydrophobicContact CE3-CB 4.16Å; W459-I462 HydrophobicContact CE3-CG2 3.99Å; W459-I462 HydrophobicContact CZ3-CB 4.48Å; W459-I462 HydrophobicContact CZ3-CG2 3.83Å; W459-I462 PolarHBondContact O-N 3.39Å; W459-N463 HydrophobicContact CD2-CB 4.45Å; W459-N463 HydrophobicContact CZ2-CB 4.07Å; W459-N463 WeakPolarHBondContact O-CB 3.48Å; W459-N463 PolarHBondContact O-N 2.9Å; W459-F474 HydrophobicContact CH2-CB 4.04Å; W459-F474 WeakPolarHBondContact CH2-O 3.21Å; W459-F474 HydrophobicContact CZ3-CB 4.11Å; W459-Y475 VanDerWaalsContact CH2-C 3.46Å; W459-Y476 HydrophobicContact CB-CD2 3.83Å; W459-Y476 HydrophobicContact CB-CE2 4.18Å; W459-Y476 AromaticContact CD1-CG 3.91Å; W459-Y476 HydrophobicContact CD2-CD2 4.06Å; W459-Y476 HydrophobicContact CD2-CG 4.32Å; W459-Y476 AromaticContact CG-CD2 3.66Å; W459-Y476 HydrophobicContact CG-CD2 3.66Å; W459-Y476 HydrophobicContact CG-CE2 4.46Å; W459-Y476 AromaticContact CG-CG 3.98Å; W459-Y476 HydrophobicContact CG-CG 3.98Å; W459-Y476 VanDerWaalsContact CZ2-N 3.33Å
460	F	92.3	Very high	92.2	Very high	67 Å²	67	33.7 Å²	33.7	29%	0.294	16%	0.161	S	C	.	.	H	α-helix	trans	-52.4	-47.9	176.3	178.9	-92.5	0	0	0	111.7	A456 Q458 N463 E464 I519 D520	A456-F460 PolarHBondContact O-N 3.49Å; A456-F460 VanDerWaalsContact O-N 3.16Å; Q458-F460 PolarHBondContact O-N 3.35Å; F460-N463 PolarHBondContact O-N 3.38Å; F460-E464 HydrophobicContact CD1-CG 4.49Å; F460-E464 HydrophobicContact CE1-CG 4.09Å; F460-E464 HydrophobicContact CZ-CG 4.34Å; F460-E464 WeakPolarHBondContact O-CG 3.35Å; F460-E464 PolarHBondContact O-N 3.4Å; F460-I519 HydrophobicContact CD1-CG2 3.83Å; F460-I519 HydrophobicContact CE1-CG2 4.19Å; F460-I519 HydrophobicContact CG-CG2 4.36Å; F460-D520 VanDerWaalsContact CZ-OD1 3.31Å; F460-D520 WeakPolarHBondContact CZ-OD1 3.31Å
461	T	90.8	Very high	91.8	Very high	4 Å²	4	36 Å²	36	3%	0.025	17%	0.17	C	C	.	.	H	α-helix	trans	-70.2	-39.8	-178.9	-61.3	0	0	0	0	112	P195 Q458 W459 N463 E464 E465 Y523 M526	P195-T461 HydrophobicContact CB-CG2 4.27Å; P195-T461 WeakPolarHBondContact CB-OG1 3.07Å; P195-T461 WeakPolarHBondContact CG-OG1 3.48Å; Q458-T461 PolarHBondContact O-N 2.88Å; Q458-T461 VanDerWaalsContact O-N 3.08Å; W459-T461 VanDerWaalsContact C-N 3.27Å; W459-T461 PolarHBondContact O-N 3.46Å; T461-N463 VanDerWaalsContact C-N 3.32Å; T461-N463 PolarHBondContact O-N 2.99Å; T461-E464 PolarHBondContact O-N 2.97Å; T461-E465 PolarHBondContact O-N 3.37Å; T461-Y523 HydrophobicContact CG2-CD2 4.05Å; T461-M526 HydrophobicContact CG2-CE 4.41Å; T461-M526 HydrophobicContact CG2-SD 3.5Å; T461-M526 VanDerWaalsContact CG2-SD 3.5Å
462	I	92.1	Very high	91.6	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.051	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-40.2	175.4	-64.3	170.8	0	0	0	110.9	M286 F446 V454 Q458 W459 E464 E465 Q466	M286-I462 HydrophobicContact CE-CG2 3.89Å; M286-I462 HydrophobicContact SD-CD1 3.83Å; M286-I462 HydrophobicContact SD-CG2 3.79Å; F446-I462 HydrophobicContact CE1-CG2 3.75Å; F446-I462 HydrophobicContact CZ-CG2 3.89Å; V454-I462 HydrophobicContact CG1-CD1 4.03Å; Q458-I462 HydrophobicContact CG-CD1 4.11Å; Q458-I462 PolarHBondContact O-N 3.24Å; W459-I462 HydrophobicContact CE3-CB 4.16Å; W459-I462 HydrophobicContact CE3-CG2 3.99Å; W459-I462 HydrophobicContact CZ3-CB 4.48Å; W459-I462 HydrophobicContact CZ3-CG2 3.83Å; W459-I462 PolarHBondContact O-N 3.39Å; I462-E464 VanDerWaalsContact C-N 3.34Å; I462-E465 WeakPolarHBondContact O-CB 3.37Å; I462-E465 PolarHBondContact O-N 3.3Å; I462-Q466 WeakPolarHBondContact O-CG 3.34Å; I462-Q466 PolarHBondContact O-N 3.05Å
463	N	93.1	Very high	91.4	Very high	32 Å²	32	41.1 Å²	41.1	17%	0.171	19%	0.192	C	C	.	.	H	α-helix	trans	-70.6	-30.6	177.8	178	64.6	0	0	0	112.1	W459 F460 T461 K467 K472	W459-N463 HydrophobicContact CD2-CB 4.45Å; W459-N463 HydrophobicContact CZ2-CB 4.07Å; W459-N463 WeakPolarHBondContact O-CB 3.48Å; W459-N463 PolarHBondContact O-N 2.9Å; F460-N463 PolarHBondContact O-N 3.38Å; T461-N463 VanDerWaalsContact C-N 3.32Å; T461-N463 PolarHBondContact O-N 2.99Å; N463-K467 PolarHBondContact O-N 3.22Å; N463-K472 PolarHBondContact OD1-NZ 3.35Å
464	E	90.8	Very high	91.4	Very high	49 Å²	49	41.1 Å²	41.1	23%	0.229	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-41.5	168.9	-69.1	-53.6	129.5	0	0	111.8	F460 T461 I462 Q466 K467 Y523	F460-E464 HydrophobicContact CD1-CG 4.49Å; F460-E464 HydrophobicContact CE1-CG 4.09Å; F460-E464 HydrophobicContact CZ-CG 4.34Å; F460-E464 WeakPolarHBondContact O-CG 3.35Å; F460-E464 PolarHBondContact O-N 3.4Å; T461-E464 PolarHBondContact O-N 2.97Å; I462-E464 VanDerWaalsContact C-N 3.34Å; E464-Q466 VanDerWaalsContact C-N 3.34Å; E464-Q466 PolarHBondContact O-N 3.43Å; E464-K467 WeakPolarHBondContact O-CB 3.49Å; E464-K467 PolarHBondContact O-N 3.3Å; E464-K467 VanDerWaalsContact OE1-CE 3.28Å; E464-K467 WeakPolarHBondContact OE1-CE 3.28Å; E464-K467 IonicContact OE1-NZ 2.79Å; E464-K467 PolarHBondContact OE1-NZ 3.44Å; E464-K467 WeakPolarHBondContact OE2-CD 3.3Å; E464-K467 WeakPolarHBondContact OE2-CE 3.47Å; E464-K467 IonicContact OE2-NZ 3.06Å; E464-K467 PolarHBondContact OE2-NZ 3.24Å; E464-Y523 HydrophobicContact CB-CD1 4.36Å; E464-Y523 HydrophobicContact CB-CG 4.14Å
465	E	89	Confident	91.4	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-45.6	174.7	-172.7	171.6	-166.3	0	0	111.5	F446 T461 I462 K467 L468 F469 Y523	F446-E465 HydrophobicContact CZ-CG 4.48Å; T461-E465 PolarHBondContact O-N 3.37Å; I462-E465 WeakPolarHBondContact O-CB 3.37Å; I462-E465 PolarHBondContact O-N 3.3Å; E465-K467 PolarHBondContact O-N 3.34Å; E465-K467 VanDerWaalsContact O-N 3.12Å; E465-L468 WeakPolarHBondContact O-CB 3.35Å; E465-L468 PolarHBondContact O-N 3.28Å; E465-L468 VanDerWaalsContact O-N 3.08Å; E465-F469 HydrophobicContact CG-CE1 4.28Å; E465-F469 HydrophobicContact CG-CZ 4.09Å; E465-Y523 HydrophobicContact CB-CD2 4.2Å; E465-Y523 HydrophobicContact CB-CE2 3.56Å; E465-Y523 HydrophobicContact CG-CE2 3.89Å
466	Q	91.4	Very high	91.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-63.7	-16.1	178.3	-73.1	-174	94	0	0	114.7	F446 I462 E464 L468 F469 F474	F446-Q466 HydrophobicContact CE1-CG 3.93Å; I462-Q466 WeakPolarHBondContact O-CG 3.34Å; I462-Q466 PolarHBondContact O-N 3.05Å; E464-Q466 VanDerWaalsContact C-N 3.34Å; E464-Q466 PolarHBondContact O-N 3.43Å; Q466-L468 PolarHBondContact O-N 2.96Å; Q466-F469 HydrophobicContact CB-CD2 4.01Å; Q466-F469 HydrophobicContact CB-CE2 4.19Å; Q466-F469 HydrophobicContact CG-CD2 3.76Å; Q466-F469 HydrophobicContact CG-CE2 3.54Å; Q466-F469 HydrophobicContact CG-CZ 4.41Å; Q466-F469 WeakPolarHBondContact O-CB 3.46Å; Q466-F469 PolarHBondContact O-N 3.04Å; Q466-F474 PolarHBondContact OE1-O 3.14Å
467	K	90.1	Very high	91.6	Very high	120 Å²	120	41.9 Å²	41.9	52%	0.522	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-68.9	-19.2	174.3	-69.3	178.9	-172.8	169.9	0	112.9	N463 E464 E465	N463-K467 PolarHBondContact O-N 3.22Å; E464-K467 WeakPolarHBondContact O-CB 3.49Å; E464-K467 PolarHBondContact O-N 3.3Å; E464-K467 VanDerWaalsContact OE1-CE 3.28Å; E464-K467 WeakPolarHBondContact OE1-CE 3.28Å; E464-K467 IonicContact OE1-NZ 2.79Å; E464-K467 PolarHBondContact OE1-NZ 3.44Å; E464-K467 WeakPolarHBondContact OE2-CD 3.3Å; E464-K467 WeakPolarHBondContact OE2-CE 3.47Å; E464-K467 IonicContact OE2-NZ 3.06Å; E464-K467 PolarHBondContact OE2-NZ 3.24Å; E465-K467 PolarHBondContact O-N 3.34Å; E465-K467 VanDerWaalsContact O-N 3.12Å
468	L	87.2	Confident	91.6	Very high	87 Å²	87	46 Å²	46	46%	0.455	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-83.5	-17.6	175	-61.4	178.3	0	0	0	112.8	E465 Q466 Y523 F534	E465-L468 WeakPolarHBondContact O-CB 3.35Å; E465-L468 PolarHBondContact O-N 3.28Å; E465-L468 VanDerWaalsContact O-N 3.08Å; Q466-L468 PolarHBondContact O-N 2.96Å; L468-Y523 HydrophobicContact CD1-CE1 4.38Å; L468-Y523 WeakPolarHBondContact CD1-OH 3.43Å; L468-F534 HydrophobicContact CD1-CD1 3.53Å; L468-F534 HydrophobicContact CD1-CE1 3.91Å
469	F	89.4	Confident	91.6	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.057	23%	0.227	C	C	.	.	S	Bend	trans	-73.1	153.9	177.9	-57.4	-11.7	0	0	0	109.5	F446 E465 Q466 Y471 I473 K535 D536 F537	F446-F469 HydrophobicContact CD1-CE2 4.11Å; F446-F469 AromaticContact CE1-CE2 3.95Å; F446-F469 HydrophobicContact CE1-CE2 3.95Å; F446-F469 HydrophobicContact CE1-CZ 4.3Å; F446-F469 HydrophobicContact CE2-CZ 4.29Å; F446-F469 HydrophobicContact CZ-CE2 4.26Å; F446-F469 HydrophobicContact CZ-CZ 4.14Å; E465-F469 HydrophobicContact CG-CE1 4.28Å; E465-F469 HydrophobicContact CG-CZ 4.09Å; Q466-F469 HydrophobicContact CB-CD2 4.01Å; Q466-F469 HydrophobicContact CB-CE2 4.19Å; Q466-F469 HydrophobicContact CG-CD2 3.76Å; Q466-F469 HydrophobicContact CG-CE2 3.54Å; Q466-F469 HydrophobicContact CG-CZ 4.41Å; Q466-F469 WeakPolarHBondContact O-CB 3.46Å; Q466-F469 PolarHBondContact O-N 3.04Å; F469-Y471 VanDerWaalsContact CB-O 3.31Å; F469-Y471 WeakPolarHBondContact CB-O 3.46Å; F469-Y471 PolarHBondContact O-N 2.97Å; F469-I473 HydrophobicContact CD2-CD1 3.86Å; F469-I473 HydrophobicContact CD2-CG1 3.76Å; F469-I473 HydrophobicContact CE2-CD1 3.64Å; F469-I473 HydrophobicContact CE2-CG1 3.89Å; F469-K535 VanDerWaalsContact CE1-O 3.3Å; F469-K535 WeakPolarHBondContact CE1-O 3.27Å; F469-D536 WeakPolarHBondContact CA-OD1 3.39Å; F469-D536 VanDerWaalsContact CB-OD1 3.31Å; F469-D536 WeakPolarHBondContact CB-OD1 3.26Å; F469-F537 AromaticContact CE1-CD2 3.89Å; F469-F537 HydrophobicContact CE1-CD2 3.89Å; F469-F537 HydrophobicContact CE2-CB 4.34Å; F469-F537 HydrophobicContact CZ-CB 4.2Å; F469-F537 AromaticContact CZ-CD2 3.65Å; F469-F537 HydrophobicContact CZ-CD2 3.65Å; F469-F537 HydrophobicContact CZ-CG 4.42Å
470	K	86.8	Confident	91.5	Very high	147 Å²	147	46.8 Å²	46.8	64%	0.639	22%	0.224	S	C	*	.	S	Bend	trans	-56.8	-37.7	175.4	-168.1	167.5	-162.7	172.1	0	112.2	D536 L541	K470-D536 PolarHBondContact N-OD2 3.22Å; K470-L541 HydrophobicContact CD-CD1 3.57Å; K470-L541 HydrophobicContact CD-CG 4.25Å
471	Y	85.8	Confident	91.5	Very high	86 Å²	86	44.4 Å²	44.4	34%	0.337	22%	0.216	S	C	.	.	S	Bend	trans	-147.4	157.1	171.1	55	-84.3	0	0	0	109.6	F469 I473 P539	F469-Y471 VanDerWaalsContact CB-O 3.31Å; F469-Y471 WeakPolarHBondContact CB-O 3.46Å; F469-Y471 PolarHBondContact O-N 2.97Å; Y471-I473 HydrophobicContact CE2-CG2 4.16Å; Y471-P539 WeakPolarHBondContact CE1-O 3.1Å; Y471-P539 HydrophobicContact CE2-CG 4.49Å; Y471-P539 WeakPolarHBondContact OH-CA 3.13Å; Y471-P539 VanDerWaalsContact OH-CB 3.23Å; Y471-P539 WeakPolarHBondContact OH-CB 3.42Å; Y471-P539 WeakPolarHBondContact OH-CD 3.37Å; Y471-P539 WeakPolarHBondContact OH-CG 3.4Å; Y471-P539 PolarHBondContact OH-O 3.46Å
472	K	90.8	Very high	91.6	Very high	97 Å²	97	44.6 Å²	44.6	42%	0.422	22%	0.216	S	C	.	.			trans	-67.1	143	175.6	-60.4	-170.8	179.6	-162.6	0	109.2	L289 N463	L289-K472 VanDerWaalsContact CD1-C 3.47Å; L289-K472 HydrophobicContact CD1-CB 3.8Å; L289-K472 WeakPolarHBondContact CD1-O 3.39Å; N463-K472 PolarHBondContact OD1-NZ 3.35Å
473	I	92.3	Very high	91.5	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.051	23%	0.225	C	C	.	.			trans	-110.7	-23.2	179	28.4	173.4	0	0	0	112.1	P288 L289 F446 F469 Y471 F537	P288-I473 CarbonylContact C-O 3.54Å; P288-I473 WeakPolarHBondContact CA-O 3.31Å; L289-I473 PolarHBondContact N-O 3.3Å; F446-I473 HydrophobicContact CB-CD1 3.73Å; F446-I473 HydrophobicContact CD1-CD1 3.7Å; F446-I473 HydrophobicContact CD1-CG1 4.28Å; F446-I473 HydrophobicContact CG-CD1 4Å; F469-I473 HydrophobicContact CD2-CD1 3.86Å; F469-I473 HydrophobicContact CD2-CG1 3.76Å; F469-I473 HydrophobicContact CE2-CD1 3.64Å; F469-I473 HydrophobicContact CE2-CG1 3.89Å; Y471-I473 HydrophobicContact CE2-CG2 4.16Å; I473-F537 HydrophobicContact CD1-CB 4.03Å
474	F	95.4	Very high	91.3	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	159.3	178.2	-70.7	-101.3	0	0	0	111.5	M286 A287 P288 F446 N447 T448 F452 W459 Q466	M286-F474 HydrophobicContact CE-CB 3.71Å; M286-F474 HydrophobicContact CE-CD1 3.58Å; M286-F474 HydrophobicContact CE-CD2 3.36Å; M286-F474 HydrophobicContact CE-CE1 3.99Å; M286-F474 HydrophobicContact CE-CE2 3.81Å; M286-F474 HydrophobicContact CE-CG 3.25Å; M286-F474 HydrophobicContact CE-CZ 4.1Å; M286-F474 HydrophobicContact CG-CB 3.8Å; M286-F474 HydrophobicContact CG-CD1 3.39Å; M286-F474 HydrophobicContact CG-CE1 4.16Å; M286-F474 HydrophobicContact CG-CG 3.76Å; M286-F474 HydrophobicContact SD-CD1 4.32Å; M286-F474 HydrophobicContact SD-CG 4.36Å; A287-F474 CarbonylContact O-C 3.49Å; A287-F474 WeakPolarHBondContact O-CA 3.4Å; A287-F474 WeakPolarHBondContact O-CB 3.4Å; A287-F474 WeakPolarHBondContact O-CD1 3.3Å; P288-F474 HydrophobicContact CB-CD1 4.41Å; P288-F474 HydrophobicContact CB-CE1 4.2Å; P288-F474 HydrophobicContact CG-CD1 4.15Å; P288-F474 HydrophobicContact CG-CE1 3.61Å; P288-F474 HydrophobicContact CG-CZ 4.22Å; P288-F474 VanDerWaalsContact N-CD1 3.3Å; F446-F474 HydrophobicContact CB-CE2 3.95Å; F446-F474 AromaticContact CD1-CD2 3.77Å; F446-F474 HydrophobicContact CD1-CD2 3.77Å; F446-F474 AromaticContact CD1-CE2 3.89Å; F446-F474 HydrophobicContact CD1-CE2 3.89Å; F446-F474 HydrophobicContact CG-CE2 4.39Å; F446-F474 WeakPolarHBondContact O-CE2 3.46Å; N447-F474 WeakPolarHBondContact O-CZ 3.44Å; T448-F474 HydrophobicContact CG2-CE2 4.19Å; T448-F474 HydrophobicContact CG2-CZ 4.3Å; F452-F474 HydrophobicContact CD2-CE1 4.25Å; F452-F474 HydrophobicContact CE2-CE1 4.41Å; F452-F474 HydrophobicContact CE2-CZ 4.42Å; W459-F474 HydrophobicContact CH2-CB 4.04Å; W459-F474 WeakPolarHBondContact CH2-O 3.21Å; W459-F474 HydrophobicContact CZ3-CB 4.11Å; Q466-F474 PolarHBondContact OE1-O 3.14Å
475	Y	94.9	Very high	91.3	Very high	20 Å²	20	55.3 Å²	55.3	8%	0.078	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.9	167.7	73.3	-82.8	0	0	0	110.4	A287 P288 L289 R397 L398 W459 C477	A287-Y475 HydrophobicContact CB-CD1 4.26Å; A287-Y475 HydrophobicContact CB-CE1 3.71Å; A287-Y475 HydrophobicContact CB-CE2 4.31Å; A287-Y475 PolarHBondContact N-O 2.65Å; A287-Y475 VanDerWaalsContact O-CD1 3.31Å; A287-Y475 WeakPolarHBondContact O-CD1 3.48Å; A287-Y475 PolarHBondContact O-N 3.16Å; P288-Y475 WeakPolarHBondContact O-CE1 3.39Å; L289-Y475 HydrophobicContact CD2-CD1 4.04Å; L289-Y475 HydrophobicContact CG-CD1 4.18Å; R397-Y475 HydrophobicContact CB-CE2 4.38Å; R397-Y475 HydrophobicContact CG-CE1 4.36Å; R397-Y475 HydrophobicContact CG-CE2 4.3Å; L398-Y475 PolarHBondContact N-OH 3.1Å; W459-Y475 VanDerWaalsContact CH2-C 3.46Å; Y475-C477 HydrophobicContact CD2-CB 4.45Å; Y475-C477 HydrophobicContact CE2-CB 3.75Å
476	Y	96.3	Very high	91.3	Very high	42 Å²	42	55 Å²	55	17%	0.165	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.1	171.6	-169.8	-113.3	0	0	0	109.7	S282 C284 V454 A456 W459 D478	S282-Y476 PolarHBondContact O-OH 3.44Å; S282-Y476 VanDerWaalsContact O-OH 3.08Å; S282-Y476 PolarHBondContact OG-OH 3.44Å; C284-Y476 HydrophobicContact CB-CE1 4.29Å; C284-Y476 HydrophobicContact CB-CE2 3.98Å; C284-Y476 WeakPolarHBondContact CB-OH 3.28Å; C284-Y476 PolarHBondContact SG-OH 3.31Å; V454-Y476 HydrophobicContact CG2-CD2 4.16Å; V454-Y476 HydrophobicContact CG2-CE2 4.06Å; A456-Y476 HydrophobicContact CB-CE1 4.5Å; W459-Y476 HydrophobicContact CB-CD2 3.83Å; W459-Y476 HydrophobicContact CB-CE2 4.18Å; W459-Y476 AromaticContact CD1-CG 3.91Å; W459-Y476 HydrophobicContact CD2-CD2 4.06Å; W459-Y476 HydrophobicContact CD2-CG 4.32Å; W459-Y476 AromaticContact CG-CD2 3.66Å; W459-Y476 HydrophobicContact CG-CD2 3.66Å; W459-Y476 HydrophobicContact CG-CE2 4.46Å; W459-Y476 AromaticContact CG-CG 3.98Å; W459-Y476 HydrophobicContact CG-CG 3.98Å; W459-Y476 VanDerWaalsContact CZ2-N 3.33Å; Y476-D478 HydrophobicContact CD1-CB 4.21Å; Y476-D478 HydrophobicContact CE1-CB 4.11Å
477	C	95.3	Very high	91.2	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	108.3	174.5	-173.9	0	0	0	0	108.9	C284 F285 A287 Y475 F480	C284-C477 WeakPolarHBondContact CB-O 3.42Å; F285-C477 HydrophobicContact CB-CB 4.44Å; F285-C477 PolarHBondContact N-O 2.89Å; F285-C477 WeakPolarHBondContact O-CB 3.37Å; F285-C477 PolarHBondContact O-N 2.9Å; A287-C477 HydrophobicContact CB-CB 4.1Å; Y475-C477 HydrophobicContact CD2-CB 4.45Å; Y475-C477 HydrophobicContact CE2-CB 3.75Å; C477-F480 WeakPolarHBondContact SG-CE1 3.36Å
478	D	92.9	Very high	91.2	Very high	111 Å²	111	51.8 Å²	51.8	59%	0.594	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	-0.3	177.5	62.5	-17.5	0	0	0	113.1	Y476	Y476-D478 HydrophobicContact CD1-CB 4.21Å; Y476-D478 HydrophobicContact CE1-CB 4.11Å
479	A	92.3	Very high	91.6	Very high	57 Å²	57	47.8 Å²	47.8	47%	0.471	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	-34.3	-179.1	0	0	0	0	0	112.5	T399	T399-A479 WeakPolarHBondContact O-CB 3.49Å
480	F	92.2	Very high	91.9	Very high	12 Å²	12	47.2 Å²	47.2	5%	0.053	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	142.3	172.3	64.4	-84.3	0	0	0	109.7	F285 L398 F401 V404 C477	F285-F480 AromaticContact CD2-CD2 3.54Å; F285-F480 HydrophobicContact CD2-CD2 3.54Å; F285-F480 AromaticContact CD2-CE2 3.28Å; F285-F480 HydrophobicContact CD2-CE2 3.28Å; F285-F480 HydrophobicContact CD2-CZ 4.18Å; F285-F480 AromaticContact CE2-CD2 3.57Å; F285-F480 HydrophobicContact CE2-CD2 3.57Å; F285-F480 AromaticContact CE2-CE2 3.55Å; F285-F480 HydrophobicContact CE2-CE2 3.55Å; F285-F480 AromaticContact CG-CE2 3.97Å; F285-F480 HydrophobicContact CG-CE2 3.97Å; F285-F480 HydrophobicContact CZ-CE2 4.4Å; L398-F480 HydrophobicContact CB-CE1 3.77Å; L398-F480 HydrophobicContact CB-CZ 4.34Å; L398-F480 HydrophobicContact CD1-CZ 4.44Å; F401-F480 AromaticContact CD1-CD2 3.68Å; F401-F480 HydrophobicContact CD1-CD2 3.68Å; F401-F480 HydrophobicContact CD1-CE2 4.05Å; F401-F480 HydrophobicContact CD2-CB 4.11Å; F401-F480 HydrophobicContact CD2-CD2 4.26Å; F401-F480 HydrophobicContact CD2-CG 4.49Å; F401-F480 AromaticContact CE1-CD2 3.54Å; F401-F480 HydrophobicContact CE1-CD2 3.54Å; F401-F480 HydrophobicContact CE1-CE2 4.06Å; F401-F480 HydrophobicContact CE2-CB 3.94Å; F401-F480 HydrophobicContact CE2-CD2 4.12Å; F401-F480 HydrophobicContact CE2-CG 4.48Å; F401-F480 HydrophobicContact CG-CD2 4.06Å; F401-F480 HydrophobicContact CZ-CB 4.33Å; F401-F480 AromaticContact CZ-CD2 3.77Å; F401-F480 HydrophobicContact CZ-CD2 3.77Å; V404-F480 HydrophobicContact CG2-CE1 4.49Å; V404-F480 HydrophobicContact CG2-CE2 4.06Å; V404-F480 HydrophobicContact CG2-CZ 3.71Å; C477-F480 WeakPolarHBondContact SG-CE1 3.36Å
481	C	93.6	Very high	92.3	Very high	17 Å²	17	40.2 Å²	40.2	12%	0.115	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.9	-170.3	-57.7	0	0	0	0	110	Y283 C284	Y283-C481 WeakPolarHBondContact O-CB 3.47Å; C284-C481 HydrophobicContact CB-CB 3.77Å; C284-C481 WeakPolarHBondContact CB-SG 3.22Å; C284-C481 WeakPolarHBondContact SG-CB 3.14Å; C284-C481 CovalentContact SG-SG 2.03Å; C284-C481 PolarHBondContact SG-SG 2.82Å
482	L	91.8	Very high	92.7	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-41.6	166.5	-65.5	-176.9	0	0	0	110.4	Y283 F285 E417 F420 L421 P453	Y283-L482 HydrophobicContact CD1-CB 4.15Å; Y283-L482 HydrophobicContact CD1-CD1 4.11Å; Y283-L482 HydrophobicContact CE1-CD1 3.95Å; Y283-L482 HydrophobicContact CG-CB 4.48Å; Y283-L482 PolarHBondContact O-N 2.91Å; F285-L482 HydrophobicContact CE2-CD2 4.38Å; F285-L482 HydrophobicContact CE2-CG 4.32Å; F285-L482 HydrophobicContact CZ-CD2 3.77Å; F285-L482 HydrophobicContact CZ-CG 3.87Å; E417-L482 HydrophobicContact CB-CD1 4.15Å; E417-L482 HydrophobicContact CG-CD1 4.07Å; F420-L482 HydrophobicContact CB-CB 4.06Å; F420-L482 HydrophobicContact CB-CD2 4.15Å; F420-L482 HydrophobicContact CB-CG 4.5Å; F420-L482 HydrophobicContact CD1-CB 4.39Å; F420-L482 HydrophobicContact CG-CB 4.29Å; L421-L482 HydrophobicContact CD2-CD2 3.43Å; L421-L482 VanDerWaalsContact CD2-CD2 3.43Å; L421-L482 HydrophobicContact CG-CD2 4.03Å; P453-L482 HydrophobicContact CB-CD1 3.6Å; P453-L482 HydrophobicContact CB-CG 4.4Å; P453-L482 HydrophobicContact CG-CD1 4.17Å
483	N	90.4	Very high	92.8	Very high	45 Å²	45	32.9 Å²	32.9	24%	0.241	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	120.3	172.7	-175	7.2	0	0	0	110	Y283 F420 F485 D486	Y283-N483 PolarHBondContact N-O 3.32Å; Y283-N483 PolarHBondContact O-N 3.29Å; Y283-N483 VanDerWaalsContact O-N 3.15Å; F420-N483 HydrophobicContact CD1-CB 4.33Å; F420-N483 HydrophobicContact CE1-CB 4.04Å; N483-F485 VanDerWaalsContact C-N 3.32Å; N483-F485 PolarHBondContact ND2-O 2.92Å; N483-F485 PolarHBondContact OD1-N 2.91Å; N483-F485 VanDerWaalsContact OD1-N 3.1Å; N483-F485 PolarHBondContact OD1-O 3.31Å; N483-D486 WeakPolarHBondContact ND2-CA 3.44Å; N483-D486 PolarHBondContact ND2-OD1 3.03Å
484	Q	89.8	Confident	92.5	Very high	156 Å²	156	37.4 Å²	37.4	73%	0.729	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	-25.8	-179.7	-164.9	168.1	26.9	0	0	112.6	S282	S282-Q484 WeakPolarHBondContact CB-O 3.34Å
485	F	89.4	Confident	92.1	Very high	115 Å²	115	39.1 Å²	39.1	50%	0.504	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	85.8	179.8	-170.9	-105.3	0	0	0	110	M280 N483 I487	M280-F485 HydrophobicContact CB-CE2 4.25Å; M280-F485 HydrophobicContact CE-CZ 3.79Å; M280-F485 HydrophobicContact CG-CE2 4.09Å; M280-F485 HydrophobicContact CG-CZ 3.91Å; M280-F485 HydrophobicContact SD-CE2 3.79Å; M280-F485 HydrophobicContact SD-CZ 3.59Å; M280-F485 VanDerWaalsContact SD-CZ 3.59Å; N483-F485 VanDerWaalsContact C-N 3.32Å; N483-F485 PolarHBondContact ND2-O 2.92Å; N483-F485 PolarHBondContact OD1-N 2.91Å; N483-F485 VanDerWaalsContact OD1-N 3.1Å; N483-F485 PolarHBondContact OD1-O 3.31Å; F485-I487 HydrophobicContact CD1-CD1 4.11Å; F485-I487 HydrophobicContact CD1-CG1 3.97Å; F485-I487 HydrophobicContact CE1-CD1 3.64Å; F485-I487 HydrophobicContact CE1-CG1 3.68Å; F485-I487 HydrophobicContact CZ-CG1 4.43Å
486	D	89.3	Confident	91.9	Very high	9 Å²	9	38.4 Å²	38.4	5%	0.048	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.9	-179	-163.5	32.5	0	0	0	110.9	M280 S281 N483	M280-D486 CarbonylContact C-O 3.49Å; M280-D486 WeakPolarHBondContact CA-O 3.21Å; S281-D486 PolarHBondContact N-O 3Å; S281-D486 PolarHBondContact O-N 2.79Å; N483-D486 WeakPolarHBondContact ND2-CA 3.44Å; N483-D486 PolarHBondContact ND2-OD1 3.03Å
487	I	89.4	Confident	91.6	Very high	51 Å²	51	37.3 Å²	37.3	26%	0.262	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114	-173.6	-56.6	176.3	0	0	0	108.9	P277 F485 S489	P277-I487 HydrophobicContact CB-CG2 3.51Å; P277-I487 HydrophobicContact CG-CG2 3.71Å; F485-I487 HydrophobicContact CD1-CD1 4.11Å; F485-I487 HydrophobicContact CD1-CG1 3.97Å; F485-I487 HydrophobicContact CE1-CD1 3.64Å; F485-I487 HydrophobicContact CE1-CG1 3.68Å; F485-I487 HydrophobicContact CZ-CG1 4.43Å; I487-S489 PolarHBondContact O-N 3.46Å
488	L	91	Very high	91.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	103.1	175.3	-166.4	158.9	0	0	0	109.2	Y213 V214 E262 Y278 L279 L457	Y213-L488 HydrophobicContact CE2-CD1 3.72Å; Y213-L488 WeakPolarHBondContact OH-CD1 3.36Å; V214-L488 HydrophobicContact CG2-CD2 4.33Å; E262-L488 HydrophobicContact CB-CD1 4.47Å; E262-L488 HydrophobicContact CB-CG 4.08Å; E262-L488 HydrophobicContact CG-CG 3.99Å; E262-L488 VanDerWaalsContact OE1-CA 3.28Å; E262-L488 WeakPolarHBondContact OE1-CA 2.98Å; E262-L488 VanDerWaalsContact OE1-CB 3.31Å; E262-L488 WeakPolarHBondContact OE1-CB 3.44Å; E262-L488 WeakPolarHBondContact OE1-CG 3.43Å; Y278-L488 WeakPolarHBondContact CB-O 3.45Å; Y278-L488 HydrophobicContact CD1-CD2 4.05Å; Y278-L488 PolarHBondContact N-O 3.35Å; L279-L488 HydrophobicContact CB-CB 4.17Å; L279-L488 PolarHBondContact N-O 2.89Å; L279-L488 PolarHBondContact O-N 3.29Å; L457-L488 HydrophobicContact CD1-CD1 4.29Å
489	S	93.7	Very high	91.4	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.021	17%	0.169	C	C	.	.			trans	-106.2	157.4	165.3	-78.2	0	0	0	0	110.4	E262 A263 S275 I487	E262-S489 CarbonylContact C-O 3.58Å; A263-S489 WeakPolarHBondContact CB-O 3.39Å; A263-S489 PolarHBondContact N-O 2.83Å; S275-S489 WeakPolarHBondContact O-CB 3.35Å; S275-S489 PolarHBondContact O-OG 2.98Å; I487-S489 PolarHBondContact O-N 3.46Å
490	I	95.6	Very high	91.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.169	C	C	.	.			trans	-100	131.9	-179.2	-61.5	-177.9	0	0	0	108.6	V214 L217 I258 G259 I274 S275 L492 F502 M506	V214-I490 HydrophobicContact CG1-CD1 4.47Å; L217-I490 HydrophobicContact CD2-CD1 3.37Å; I258-I490 HydrophobicContact CG2-CG2 3.95Å; G259-I490 WeakPolarHBondContact O-CG2 3.25Å; I274-I490 CarbonylContact C-O 3.52Å; I274-I490 WeakPolarHBondContact CA-O 3.21Å; S275-I490 PolarHBondContact N-O 3.47Å; S275-I490 PolarHBondContact OG-N 2.88Å; I490-L492 HydrophobicContact CG2-CD2 4.32Å; I490-L492 PolarHBondContact O-N 3.05Å; I490-F502 HydrophobicContact CD1-CE1 4.26Å; I490-F502 HydrophobicContact CD1-CZ 3.95Å; I490-F502 HydrophobicContact CG2-CE1 4.32Å; I490-F502 HydrophobicContact CG2-CZ 4.39Å; I490-M506 HydrophobicContact CD1-CE 3.7Å; I490-M506 HydrophobicContact CD1-SD 4Å; I490-M506 HydrophobicContact CG1-CE 4.13Å
491	P	95.4	Very high	91.4	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-63.8	127	174.2	-19.4	30.7	0	0	0	110.9	T251 G259 C261 A263	T251-P491 HydrophobicContact CG2-CB 3.9Å; T251-P491 VanDerWaalsContact OG1-CB 3.32Å; T251-P491 WeakPolarHBondContact OG1-CB 3.25Å; G259-P491 PolarHBondContact N-O 3.43Å; C261-P491 VanDerWaalsContact O-CD 3.32Å; C261-P491 WeakPolarHBondContact O-CD 3.44Å; A263-P491 HydrophobicContact CB-CB 4.49Å; A263-P491 HydrophobicContact CB-CG 3.8Å
492	L	95.3	Very high	91.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-125.1	149.7	178.6	-62.2	-178.1	0	0	0	110	I258 A273 I490 L496 R499 F502	I258-L492 HydrophobicContact CB-CD2 4.28Å; I258-L492 HydrophobicContact CD1-CD2 4.47Å; I258-L492 HydrophobicContact CG1-CD2 3.89Å; I258-L492 HydrophobicContact CG2-CD2 3.95Å; A273-L492 CarbonylContact C-O 3.41Å; A273-L492 VanDerWaalsContact C-O 3.27Å; A273-L492 VanDerWaalsContact CA-O 3.31Å; A273-L492 WeakPolarHBondContact CA-O 3.38Å; A273-L492 PolarHBondContact O-N 2.74Å; I490-L492 HydrophobicContact CG2-CD2 4.32Å; I490-L492 PolarHBondContact O-N 3.05Å; L492-L496 HydrophobicContact CD1-CD2 4.46Å; L492-L496 HydrophobicContact CD2-CD2 4.05Å; L492-R499 HydrophobicContact CD1-CG 4.15Å; L492-F502 HydrophobicContact CD1-CD1 4.2Å; L492-F502 HydrophobicContact CD2-CD1 3.83Å; L492-F502 HydrophobicContact CD2-CE1 3.68Å
493	R	92.3	Very high	91.6	Very high	30 Å²	30	36.8 Å²	36.8	11%	0.113	17%	0.17	C	C	.	.			trans	-58	139.9	165.2	-171.1	173.4	171.6	-160.9	-6.8	110.6	E134 D254 L256 D257 H495 L496	E134-R493 VanDerWaalsContact CD-NH2 3.3Å; E134-R493 IonicContact OE1-CZ 2.88Å; E134-R493 IonicContact OE1-NH1 3.85Å; E134-R493 PolarHBondContact OE1-NH1 3.2Å; E134-R493 IonicContact OE1-NH2 3.84Å; E134-R493 PolarHBondContact OE1-NH2 3.4Å; E134-R493 IonicContact OE2-CZ 3.02Å; E134-R493 IonicContact OE2-NH1 2.84Å; E134-R493 PolarHBondContact OE2-NH1 2.94Å; E134-R493 IonicContact OE2-NH2 2.78Å; E134-R493 PolarHBondContact OE2-NH2 3.25Å; E134-R493 VanDerWaalsContact OE2-NH2 3.1Å; D254-R493 HydrophobicContact CB-CG 4.26Å; D254-R493 VanDerWaalsContact CB-NE 3.29Å; D254-R493 VanDerWaalsContact CG-NE 3.28Å; D254-R493 WeakPolarHBondContact OD1-CD 3.37Å; D254-R493 WeakPolarHBondContact OD1-CG 3.22Å; D254-R493 IonicContact OD1-CZ 3.05Å; D254-R493 IonicContact OD1-NE 3.39Å; D254-R493 PolarHBondContact OD1-NE 3.5Å; L256-R493 WeakPolarHBondContact O-CB 3.27Å; D257-R493 PolarHBondContact O-N 2.91Å; R493-H495 PolarHBondContact O-N 2.93Å; R493-L496 HydrophobicContact CB-CB 4.31Å; R493-L496 HydrophobicContact CB-CD1 4.37Å; R493-L496 WeakPolarHBondContact O-CB 3.46Å; R493-L496 PolarHBondContact O-N 3.45Å
494	R	87.3	Confident	91.8	Very high	105 Å²	105	39.2 Å²	39.2	40%	0.396	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-49	-178.6	-67.7	179.4	-175.8	172.7	5.1	111.9	M106 S252 A273 L496	M106-R494 VanDerWaalsContact CE-O 3.31Å; M106-R494 WeakPolarHBondContact CE-O 3.38Å; S252-R494 PolarHBondContact O-NE 3.3Å; A273-R494 HydrophobicContact CB-CG 3.93Å; R494-L496 PolarHBondContact O-N 2.84Å
495	H	86.5	Confident	92.1	Very high	36 Å²	36	32 Å²	32	17%	0.167	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	47.4	-178.6	-64.5	-62.3	0	0	0	112.6	Q109 R493 P497	Q109-H495 PolarHBondContact NE2-O 2.84Å; R493-H495 PolarHBondContact O-N 2.93Å; H495-P497 WeakPolarHBondContact O-CD 3.12Å
496	L	90.9	Very high	92.5	Very high	5 Å²	5	26.7 Å²	26.7	3%	0.026	12%	0.123	C	C	.	.			trans	-71.9	114	-179.2	-171.6	68.9	0	0	0	111.6	D257 I258 L492 R493 R494 Y498 R499	D257-L496 HydrophobicContact CB-CD1 4.02Å; I258-L496 HydrophobicContact CD1-CD2 4.43Å; I258-L496 HydrophobicContact CG1-CD2 4.15Å; L492-L496 HydrophobicContact CD1-CD2 4.46Å; L492-L496 HydrophobicContact CD2-CD2 4.05Å; R493-L496 HydrophobicContact CB-CB 4.31Å; R493-L496 HydrophobicContact CB-CD1 4.37Å; R493-L496 WeakPolarHBondContact O-CB 3.46Å; R493-L496 PolarHBondContact O-N 3.45Å; R494-L496 PolarHBondContact O-N 2.84Å; L496-Y498 HydrophobicContact CD1-CD1 4.49Å; L496-Y498 HydrophobicContact CD1-CD2 4.36Å; L496-Y498 HydrophobicContact CD1-CE1 3.9Å; L496-Y498 HydrophobicContact CD1-CE2 3.75Å; L496-Y498 VanDerWaalsContact CD1-CZ 3.5Å; L496-Y498 HydrophobicContact CD2-CD2 4.23Å; L496-Y498 HydrophobicContact CD2-CE2 4.02Å; L496-Y498 HydrophobicContact CG-CD2 4.17Å; L496-Y498 HydrophobicContact CG-CE2 4.01Å; L496-Y498 PolarHBondContact O-N 3.33Å; L496-Y498 VanDerWaalsContact O-N 3.11Å; L496-R499 HydrophobicContact CB-CB 4.17Å; L496-R499 HydrophobicContact CD2-CB 4.33Å; L496-R499 HydrophobicContact CG-CB 4.47Å; L496-R499 WeakPolarHBondContact O-CB 3.45Å; L496-R499 PolarHBondContact O-N 2.95Å
497	P	89.8	Confident	92.7	Very high	20 Å²	20	30.3 Å²	30.3	13%	0.13	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.4	-171	-25.6	37	0	0	0	116	E134 F178 H495	E134-P497 HydrophobicContact CB-CG 4.24Å; F178-P497 HydrophobicContact CD2-CB 4.44Å; F178-P497 HydrophobicContact CE1-CB 4.15Å; F178-P497 HydrophobicContact CE2-CB 3.59Å; F178-P497 HydrophobicContact CZ-CB 3.42Å; F178-P497 VanDerWaalsContact CZ-CB 3.42Å; F178-P497 HydrophobicContact CZ-CG 4.18Å; H495-P497 WeakPolarHBondContact O-CD 3.12Å
498	Y	91.9	Very high	93	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.039	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	25.4	-176.9	50.9	-94.7	0	0	0	112.2	F178 M181 I186 F221 I258 L496 D500 I501 F502	F178-Y498 HydrophobicContact CB-CG 4.45Å; F178-Y498 AromaticContact CD1-CD1 3.46Å; F178-Y498 HydrophobicContact CD1-CD1 3.46Å; F178-Y498 VanDerWaalsContact CD1-CD1 3.46Å; F178-Y498 HydrophobicContact CD1-CE1 4.29Å; F178-Y498 HydrophobicContact CD1-CG 4.14Å; F178-Y498 AromaticContact CE1-CD1 3.71Å; F178-Y498 HydrophobicContact CE1-CD1 3.71Å; F178-Y498 HydrophobicContact CE1-CE1 4.32Å; F178-Y498 HydrophobicContact CG-CD1 4.05Å; F178-Y498 HydrophobicContact CG-CG 4.34Å; F178-Y498 HydrophobicContact CZ-CD1 4.47Å; M181-Y498 HydrophobicContact CE-CE1 4.22Å; I186-Y498 HydrophobicContact CD1-CE2 4.29Å; F221-Y498 AromaticContact CE1-CD2 3.93Å; F221-Y498 HydrophobicContact CE1-CD2 3.93Å; F221-Y498 AromaticContact CE1-CE2 3.9Å; F221-Y498 HydrophobicContact CE1-CE2 3.9Å; F221-Y498 AromaticContact CZ-CD2 3.82Å; F221-Y498 HydrophobicContact CZ-CD2 3.82Å; F221-Y498 HydrophobicContact CZ-CE2 4.28Å; I258-Y498 HydrophobicContact CD1-CE2 4.09Å; L496-Y498 HydrophobicContact CD1-CD1 4.49Å; L496-Y498 HydrophobicContact CD1-CD2 4.36Å; L496-Y498 HydrophobicContact CD1-CE1 3.9Å; L496-Y498 HydrophobicContact CD1-CE2 3.75Å; L496-Y498 VanDerWaalsContact CD1-CZ 3.5Å; L496-Y498 HydrophobicContact CD2-CD2 4.23Å; L496-Y498 HydrophobicContact CD2-CE2 4.02Å; L496-Y498 HydrophobicContact CG-CD2 4.17Å; L496-Y498 HydrophobicContact CG-CE2 4.01Å; L496-Y498 PolarHBondContact O-N 3.33Å; L496-Y498 VanDerWaalsContact O-N 3.11Å; Y498-D500 VanDerWaalsContact C-N 3.3Å; Y498-D500 PolarHBondContact O-N 3.47Å; Y498-I501 PolarHBondContact O-N 3.32Å; Y498-F502 PolarHBondContact O-N 2.96Å
499	R	91.8	Very high	93.2	Very high	50 Å²	50	31.7 Å²	31.7	19%	0.189	15%	0.149	C	C	.	.	H	α-helix	trans	-55.2	-44.4	-179.9	179.5	173.7	177.4	142.4	1.8	112.8	D272 I274 L492 L496 F502 E503	D272-R499 PolarHBondContact O-NH1 2.95Å; I274-R499 PolarHBondContact O-NH2 3.38Å; L492-R499 HydrophobicContact CD1-CG 4.15Å; L496-R499 HydrophobicContact CB-CB 4.17Å; L496-R499 HydrophobicContact CD2-CB 4.33Å; L496-R499 HydrophobicContact CG-CB 4.47Å; L496-R499 WeakPolarHBondContact O-CB 3.45Å; L496-R499 PolarHBondContact O-N 2.95Å; R499-F502 PolarHBondContact O-N 3.28Å; R499-E503 HydrophobicContact CG-CG 4.31Å; R499-E503 IonicContact CZ-OE1 3.71Å; R499-E503 IonicContact NE-OE1 2.78Å; R499-E503 PolarHBondContact NE-OE1 3.37Å; R499-E503 IonicContact NE-OE2 3.82Å; R499-E503 IonicContact NH2-OE1 2.9Å; R499-E503 PolarHBondContact NH2-OE1 3.45Å; R499-E503 WeakPolarHBondContact O-CB 3.22Å; R499-E503 WeakPolarHBondContact O-CG 3.42Å; R499-E503 PolarHBondContact O-N 3.49Å
500	D	90.3	Very high	93.1	Very high	86 Å²	86	35.7 Å²	35.7	46%	0.46	17%	0.166	S	C	.	.	H	α-helix	trans	-60.9	-44	179.1	60.7	-38.8	0	0	0	111.8	Y498 F502 E503 E504	Y498-D500 VanDerWaalsContact C-N 3.3Å; Y498-D500 PolarHBondContact O-N 3.47Å; D500-F502 VanDerWaalsContact C-N 3.31Å; D500-F502 PolarHBondContact O-N 2.85Å; D500-E503 PolarHBondContact O-N 3.07Å; D500-E504 VanDerWaalsContact O-CB 3.24Å; D500-E504 WeakPolarHBondContact O-CB 3.4Å; D500-E504 PolarHBondContact O-N 2.95Å
501	I	93.7	Very high	93	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-37.7	177.3	-48.7	178.8	0	0	0	110.8	D176 F178 F221 V225 Y498 H505	D176-I501 WeakPolarHBondContact OD1-CD1 3.44Å; F178-I501 HydrophobicContact CB-CD1 3.65Å; F221-I501 HydrophobicContact CE2-CB 4.47Å; F221-I501 HydrophobicContact CE2-CG2 4.06Å; V225-I501 HydrophobicContact CG1-CG2 4.35Å; Y498-I501 PolarHBondContact O-N 3.32Å; I501-H505 WeakPolarHBondContact O-CB 3.34Å; I501-H505 PolarHBondContact O-N 2.86Å
502	F	95.9	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69	-50.1	177.4	-179.7	-111.8	0	0	0	111.9	I218 F221 I258 I490 L492 Y498 R499 D500 E504 H505 M506	I218-F502 HydrophobicContact CG1-CE2 4.22Å; I218-F502 HydrophobicContact CG1-CZ 4.19Å; F221-F502 HydrophobicContact CB-CD2 4.21Å; F221-F502 HydrophobicContact CB-CE2 4.28Å; F221-F502 AromaticContact CD1-CD2 3.64Å; F221-F502 HydrophobicContact CD1-CD2 3.64Å; F221-F502 HydrophobicContact CD1-CE2 4.22Å; F221-F502 AromaticContact CD2-CD2 3.85Å; F221-F502 HydrophobicContact CD2-CD2 3.85Å; F221-F502 HydrophobicContact CE1-CB 4.28Å; F221-F502 AromaticContact CE1-CD2 3.89Å; F221-F502 HydrophobicContact CE1-CD2 3.89Å; F221-F502 HydrophobicContact CE1-CG 4.5Å; F221-F502 HydrophobicContact CE2-CB 3.98Å; F221-F502 HydrophobicContact CE2-CD2 4.09Å; F221-F502 AromaticContact CG-CD2 3.61Å; F221-F502 HydrophobicContact CG-CD2 3.61Å; F221-F502 HydrophobicContact CG-CE2 4.15Å; F221-F502 HydrophobicContact CZ-CB 3.83Å; F221-F502 HydrophobicContact CZ-CD2 4.11Å; F221-F502 HydrophobicContact CZ-CG 4.46Å; I258-F502 HydrophobicContact CD1-CD1 4.39Å; I258-F502 HydrophobicContact CD1-CD2 3.92Å; I258-F502 HydrophobicContact CD1-CE1 4.47Å; I258-F502 HydrophobicContact CD1-CE2 4.02Å; I258-F502 HydrophobicContact CD1-CG 4.12Å; I258-F502 HydrophobicContact CD1-CZ 4.29Å; I258-F502 HydrophobicContact CG2-CE1 4.41Å; I258-F502 HydrophobicContact CG2-CZ 4.09Å; I490-F502 HydrophobicContact CD1-CE1 4.26Å; I490-F502 HydrophobicContact CD1-CZ 3.95Å; I490-F502 HydrophobicContact CG2-CE1 4.32Å; I490-F502 HydrophobicContact CG2-CZ 4.39Å; L492-F502 HydrophobicContact CD1-CD1 4.2Å; L492-F502 HydrophobicContact CD2-CD1 3.83Å; L492-F502 HydrophobicContact CD2-CE1 3.68Å; Y498-F502 PolarHBondContact O-N 2.96Å; R499-F502 PolarHBondContact O-N 3.28Å; D500-F502 VanDerWaalsContact C-N 3.31Å; D500-F502 PolarHBondContact O-N 2.85Å; F502-E504 PolarHBondContact O-N 3.28Å; F502-H505 WeakPolarHBondContact O-CB 3.21Å; F502-H505 PolarHBondContact O-N 3.26Å; F502-H505 VanDerWaalsContact O-N 3.15Å; F502-M506 HydrophobicContact CD1-CG 4.37Å; F502-M506 HydrophobicContact CD1-SD 3.69Å; F502-M506 HydrophobicContact CE1-CG 4.03Å; F502-M506 HydrophobicContact CE1-SD 3.22Å; F502-M506 WeakPolarHBondContact CE1-SD 2.99Å; F502-M506 HydrophobicContact CE2-CG 4.35Å; F502-M506 HydrophobicContact CZ-CG 4.02Å; F502-M506 HydrophobicContact CZ-SD 3.73Å; F502-M506 WeakPolarHBondContact O-CG 3.5Å; F502-M506 PolarHBondContact O-N 2.95Å
503	E	94.6	Very high	93	Very high	41 Å²	41	51.9 Å²	51.9	19%	0.192	25%	0.248	C	C	.	.	H	α-helix	trans	-64.2	-39.7	179.1	-71.5	-178.6	165.6	0	0	111.6	S275 Y276 R499 D500 H505 M506 L507	S275-E503 WeakPolarHBondContact CA-OE1 3.47Å; Y276-E503 PolarHBondContact N-OE1 3.49Å; Y276-E503 VanDerWaalsContact N-OE1 3.08Å; R499-E503 HydrophobicContact CG-CG 4.31Å; R499-E503 IonicContact CZ-OE1 3.71Å; R499-E503 IonicContact NE-OE1 2.78Å; R499-E503 PolarHBondContact NE-OE1 3.37Å; R499-E503 IonicContact NE-OE2 3.82Å; R499-E503 IonicContact NH2-OE1 2.9Å; R499-E503 PolarHBondContact NH2-OE1 3.45Å; R499-E503 WeakPolarHBondContact O-CB 3.22Å; R499-E503 WeakPolarHBondContact O-CG 3.42Å; R499-E503 PolarHBondContact O-N 3.49Å; D500-E503 PolarHBondContact O-N 3.07Å; E503-H505 VanDerWaalsContact C-N 3.34Å; E503-H505 PolarHBondContact O-N 3.03Å; E503-M506 WeakPolarHBondContact O-CB 3.19Å; E503-M506 PolarHBondContact O-N 3.04Å; E503-L507 WeakPolarHBondContact O-CG 3.35Å; E503-L507 PolarHBondContact O-N 3.35Å
504	E	95	Very high	93.2	Very high	96 Å²	96	53.4 Å²	53.4	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-45.8	171.3	-175.6	-169.5	-160.5	0	0	111	D500 F502 M506 L507 L508	D500-E504 VanDerWaalsContact O-CB 3.24Å; D500-E504 WeakPolarHBondContact O-CB 3.4Å; D500-E504 PolarHBondContact O-N 2.95Å; F502-E504 PolarHBondContact O-N 3.28Å; E504-M506 VanDerWaalsContact C-N 3.34Å; E504-M506 PolarHBondContact O-N 2.78Å; E504-L507 PolarHBondContact O-N 3.04Å; E504-L508 HydrophobicContact CG-CD1 3.98Å; E504-L508 HydrophobicContact CG-CG 4.42Å; E504-L508 WeakPolarHBondContact O-CB 2.72Å; E504-L508 VanDerWaalsContact O-CG 3.29Å; E504-L508 WeakPolarHBondContact O-CG 3.25Å; E504-L508 PolarHBondContact O-N 3.32Å
505	H	96	Very high	93.5	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.019	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-45.1	175.1	173.1	84	0	0	0	111.6	L217 F221 K224 I501 F502 E503 L507 L508 Q509	L217-H505 PolarHBondContact O-NE2 2.82Å; F221-H505 HydrophobicContact CD2-CB 3.88Å; F221-H505 AromaticContact CD2-CD2 3.92Å; F221-H505 AromaticContact CD2-CG 3.86Å; F221-H505 HydrophobicContact CE2-CB 4.41Å; F221-H505 PolarHBondContact N-NE2 3.29Å; K224-H505 HydrophobicContact CD-CB 4.49Å; I501-H505 WeakPolarHBondContact O-CB 3.34Å; I501-H505 PolarHBondContact O-N 2.86Å; F502-H505 WeakPolarHBondContact O-CB 3.21Å; F502-H505 PolarHBondContact O-N 3.26Å; F502-H505 VanDerWaalsContact O-N 3.15Å; E503-H505 VanDerWaalsContact C-N 3.34Å; E503-H505 PolarHBondContact O-N 3.03Å; H505-L507 PolarHBondContact O-N 3.36Å; H505-L508 PolarHBondContact O-N 2.88Å; H505-Q509 PolarHBondContact CE1-NE2 3.43Å; H505-Q509 WeakPolarHBondContact O-CB 3.22Å; H505-Q509 WeakPolarHBondContact O-CG 3.5Å; H505-Q509 PolarHBondContact O-N 3.46Å
506	M	96.1	Very high	93.8	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-57.1	-47.5	177.2	-67.3	173.5	56.9	0	0	112.7	L217 Y278 I490 F502 E503 E504 Q509 K510	L217-M506 HydrophobicContact CD1-CB 4.34Å; L217-M506 HydrophobicContact CD1-CG 3.93Å; L217-M506 HydrophobicContact CD2-CE 4.48Å; L217-M506 HydrophobicContact CD2-CG 3.85Å; L217-M506 HydrophobicContact CG-CG 4.33Å; Y278-M506 HydrophobicContact CD2-CB 4.37Å; Y278-M506 HydrophobicContact CD2-CE 4Å; Y278-M506 HydrophobicContact CG-CE 3.85Å; I490-M506 HydrophobicContact CD1-CE 3.7Å; I490-M506 HydrophobicContact CD1-SD 4Å; I490-M506 HydrophobicContact CG1-CE 4.13Å; F502-M506 HydrophobicContact CD1-CG 4.37Å; F502-M506 HydrophobicContact CD1-SD 3.69Å; F502-M506 HydrophobicContact CE1-CG 4.03Å; F502-M506 HydrophobicContact CE1-SD 3.22Å; F502-M506 WeakPolarHBondContact CE1-SD 2.99Å; F502-M506 HydrophobicContact CE2-CG 4.35Å; F502-M506 HydrophobicContact CZ-CG 4.02Å; F502-M506 HydrophobicContact CZ-SD 3.73Å; F502-M506 WeakPolarHBondContact O-CG 3.5Å; F502-M506 PolarHBondContact O-N 2.95Å; E503-M506 WeakPolarHBondContact O-CB 3.19Å; E503-M506 PolarHBondContact O-N 3.04Å; E504-M506 VanDerWaalsContact C-N 3.34Å; E504-M506 PolarHBondContact O-N 2.78Å; M506-Q509 PolarHBondContact O-N 2.74Å; M506-K510 PolarHBondContact O-N 2.98Å; M506-K510 VanDerWaalsContact O-N 3.15Å
507	L	94.7	Very high	94	Very high	84 Å²	84	59.7 Å²	59.7	44%	0.44	29%	0.285	S	S	.	.	H	α-helix	trans	-63.7	-46	-179.9	-68	175	0	0	0	111.2	Y276 E503 E504 H505 Q509 K510 E511	Y276-L507 HydrophobicContact CD1-CD2 4.06Å; Y276-L507 HydrophobicContact CE1-CD2 4.23Å; E503-L507 WeakPolarHBondContact O-CG 3.35Å; E503-L507 PolarHBondContact O-N 3.35Å; E504-L507 PolarHBondContact O-N 3.04Å; H505-L507 PolarHBondContact O-N 3.36Å; L507-Q509 PolarHBondContact O-N 3.45Å; L507-K510 WeakPolarHBondContact O-CB 3.19Å; L507-K510 PolarHBondContact O-N 3.11Å; L507-E511 PolarHBondContact O-N 2.95Å
508	L	95.4	Very high	94.3	Very high	54 Å²	54	59.5 Å²	59.5	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-45.2	177.6	-70.8	172.9	0	0	0	111.9	E504 H505 K510 E511 F512	E504-L508 HydrophobicContact CG-CD1 3.98Å; E504-L508 HydrophobicContact CG-CG 4.42Å; E504-L508 WeakPolarHBondContact O-CB 2.72Å; E504-L508 VanDerWaalsContact O-CG 3.29Å; E504-L508 WeakPolarHBondContact O-CG 3.25Å; E504-L508 PolarHBondContact O-N 3.32Å; H505-L508 PolarHBondContact O-N 2.88Å; L508-K510 PolarHBondContact O-N 2.98Å; L508-E511 PolarHBondContact O-N 3.2Å; L508-E511 VanDerWaalsContact O-N 3.16Å; L508-F512 HydrophobicContact CB-CD2 4.3Å; L508-F512 HydrophobicContact CB-CE2 4.16Å; L508-F512 HydrophobicContact CD2-CE2 4.19Å; L508-F512 WeakPolarHBondContact O-CD2 3.44Å; L508-F512 PolarHBondContact O-N 3.05Å
509	Q	94.5	Very high	94.3	Very high	28 Å²	28	60 Å²	60	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-36.7	178.3	-67.1	-66.9	-40.7	0	0	111.9	L217 H505 M506 L507 G513 L514 W518	L217-Q509 HydrophobicContact CD1-CB 4.21Å; L217-Q509 HydrophobicContact CD1-CG 4.03Å; H505-Q509 PolarHBondContact CE1-NE2 3.43Å; H505-Q509 WeakPolarHBondContact O-CB 3.22Å; H505-Q509 WeakPolarHBondContact O-CG 3.5Å; H505-Q509 PolarHBondContact O-N 3.46Å; M506-Q509 PolarHBondContact O-N 2.74Å; L507-Q509 PolarHBondContact O-N 3.45Å; Q509-G513 PolarHBondContact O-N 2.96Å; Q509-L514 WeakPolarHBondContact O-CB 3.32Å; Q509-L514 PolarHBondContact O-N 3.48Å; Q509-W518 HydrophobicContact CG-CH2 4.47Å; Q509-W518 VanDerWaalsContact OE1-CH2 3.22Å
510	K	92.3	Very high	94.3	Very high	88 Å²	88	61.3 Å²	61.3	38%	0.383	30%	0.296	S	S	.	.	H	α-helix	trans	-69.6	-45	174.5	-174.3	177.4	-178.8	173.9	0	111.9	Y278 M506 L507 L508 F512 G513 T515	Y278-K510 HydrophobicContact CE2-CB 4.35Å; Y278-K510 WeakPolarHBondContact O-CD 3.38Å; Y278-K510 WeakPolarHBondContact O-CE 3.32Å; Y278-K510 PolarHBondContact O-NZ 3.19Å; M506-K510 PolarHBondContact O-N 2.98Å; M506-K510 VanDerWaalsContact O-N 3.15Å; L507-K510 WeakPolarHBondContact O-CB 3.19Å; L507-K510 PolarHBondContact O-N 3.11Å; L508-K510 PolarHBondContact O-N 2.98Å; K510-F512 PolarHBondContact O-N 3.48Å; K510-G513 PolarHBondContact O-N 3.17Å; K510-T515 WeakPolarHBondContact CA-OG1 3.33Å
511	E	93.9	Very high	94.4	Very high	158 Å²	158	58.7 Å²	58.7	74%	0.738	28%	0.281	S	S	*	.	H	α-helix	trans	-62	-40.7	179.3	-171.4	176.4	-179.1	0	0	112.2	L507 L508 G513	L507-E511 PolarHBondContact O-N 2.95Å; L508-E511 PolarHBondContact O-N 3.2Å; L508-E511 VanDerWaalsContact O-N 3.16Å; E511-G513 PolarHBondContact O-N 3.43Å
512	F	95.4	Very high	94.3	Very high	149 Å²	149	58.3 Å²	58.3	65%	0.654	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-4.4	174.7	-70.2	-62	0	0	0	114.1	L508 K510 L514	L508-F512 HydrophobicContact CB-CD2 4.3Å; L508-F512 HydrophobicContact CB-CE2 4.16Å; L508-F512 HydrophobicContact CD2-CE2 4.19Å; L508-F512 WeakPolarHBondContact O-CD2 3.44Å; L508-F512 PolarHBondContact O-N 3.05Å; K510-F512 PolarHBondContact O-N 3.48Å; F512-L514 VanDerWaalsContact C-N 3.3Å; F512-L514 HydrophobicContact CB-CD1 4.38Å; F512-L514 HydrophobicContact CB-CG 4.34Å; F512-L514 PolarHBondContact O-N 2.93Å
513	G	95.2	Very high	94.1	Very high	33 Å²	33	59.5 Å²	59.5	34%	0.34	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	11	179.3	0	0	0	0	0	115	Q509 K510 E511 T515 K516 Y517	Q509-G513 PolarHBondContact O-N 2.96Å; K510-G513 PolarHBondContact O-N 3.17Å; E511-G513 PolarHBondContact O-N 3.43Å; G513-T515 VanDerWaalsContact C-N 3.31Å; G513-T515 PolarHBondContact O-N 3.38Å; G513-K516 PolarHBondContact O-N 3.4Å; G513-Y517 PolarHBondContact O-N 2.94Å; G513-Y517 VanDerWaalsContact O-N 3.12Å
514	L	95.4	Very high	93.9	Very high	61 Å²	61	64.9 Å²	64.9	32%	0.319	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-34.9	-179.7	-69.8	170.6	0	0	0	111.8	Q509 F512 K516 Y517 W518	Q509-L514 WeakPolarHBondContact O-CB 3.32Å; Q509-L514 PolarHBondContact O-N 3.48Å; F512-L514 VanDerWaalsContact C-N 3.3Å; F512-L514 HydrophobicContact CB-CD1 4.38Å; F512-L514 HydrophobicContact CB-CG 4.34Å; F512-L514 PolarHBondContact O-N 2.93Å; L514-K516 VanDerWaalsContact C-N 3.35Å; L514-K516 PolarHBondContact O-N 3.29Å; L514-Y517 WeakPolarHBondContact O-CB 3.24Å; L514-Y517 PolarHBondContact O-N 3.01Å; L514-W518 HydrophobicContact CB-CH2 4.11Å; L514-W518 HydrophobicContact CB-CZ2 3.99Å; L514-W518 HydrophobicContact CB-CZ3 4.49Å; L514-W518 VanDerWaalsContact O-CD2 3.26Å; L514-W518 VanDerWaalsContact O-CG 3.3Å; L514-W518 PolarHBondContact O-N 3.05Å
515	T	93.6	Very high	93.8	Very high	4 Å²	4	61 Å²	61	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-57.2	-47.2	173.3	-46.6	0	0	0	0	112	Y278 L279 K510 G513 W518 I519	Y278-T515 HydrophobicContact CE1-CG2 4.02Å; Y278-T515 HydrophobicContact CE2-CG2 4.21Å; Y278-T515 WeakPolarHBondContact OH-CB 3.3Å; Y278-T515 WeakPolarHBondContact OH-CG2 3.3Å; Y278-T515 PolarHBondContact OH-OG1 2.82Å; L279-T515 HydrophobicContact CD1-CG2 3.84Å; L279-T515 HydrophobicContact CD2-CG2 3.89Å; L279-T515 HydrophobicContact CG-CG2 4.23Å; K510-T515 WeakPolarHBondContact CA-OG1 3.33Å; G513-T515 VanDerWaalsContact C-N 3.31Å; G513-T515 PolarHBondContact O-N 3.38Å; T515-W518 PolarHBondContact O-N 2.84Å; T515-I519 HydrophobicContact CG2-CD1 4.15Å; T515-I519 WeakPolarHBondContact O-CG1 3.36Å; T515-I519 PolarHBondContact O-N 2.96Å
516	K	93.7	Very high	93.5	Very high	141 Å²	141	61.6 Å²	61.6	61%	0.613	29%	0.287	S	S	*	.	H	α-helix	trans	-63.4	-44.8	178.2	-179	177.4	178.4	176.8	0	111	G513 L514 W518 I519 D520	G513-K516 PolarHBondContact O-N 3.4Å; L514-K516 VanDerWaalsContact C-N 3.35Å; L514-K516 PolarHBondContact O-N 3.29Å; K516-W518 VanDerWaalsContact C-N 3.3Å; K516-W518 PolarHBondContact O-N 3.24Å; K516-I519 PolarHBondContact O-N 2.91Å; K516-D520 PolarHBondContact O-N 3.46Å
517	Y	95.2	Very high	93.2	Very high	134 Å²	134	63 Å²	63	53%	0.525	30%	0.295	S	S	.	.	H	α-helix	trans	-56.4	-43.2	175.8	171.6	-100.3	0	0	0	112.3	G513 L514 D520 Q521	G513-Y517 PolarHBondContact O-N 2.94Å; G513-Y517 VanDerWaalsContact O-N 3.12Å; L514-Y517 WeakPolarHBondContact O-CB 3.24Å; L514-Y517 PolarHBondContact O-N 3.01Å; Y517-D520 PolarHBondContact O-N 3.18Å; Y517-Q521 WeakPolarHBondContact O-CB 3.4Å; Y517-Q521 PolarHBondContact O-N 2.97Å
518	W	94.8	Very high	92.9	Very high	16 Å²	16	66.4 Å²	66.4	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-68.6	-37.2	177.1	-60.7	-33.8	0	0	0	112.9	M216 L217 Q220 Q509 L514 T515 K516 Q521 S522	M216-W518 HydrophobicContact CB-CD2 3.43Å; M216-W518 VanDerWaalsContact CB-CD2 3.43Å; M216-W518 HydrophobicContact CB-CE3 3.67Å; M216-W518 HydrophobicContact CB-CG 3.89Å; M216-W518 HydrophobicContact CB-CH2 4.11Å; M216-W518 HydrophobicContact CB-CZ2 3.9Å; M216-W518 HydrophobicContact CB-CZ3 4.01Å; M216-W518 HydrophobicContact CE-CZ2 4.38Å; M216-W518 HydrophobicContact CG-CD2 4.12Å; M216-W518 HydrophobicContact CG-CG 4.06Å; L217-W518 HydrophobicContact CB-CZ3 4.01Å; Q220-W518 HydrophobicContact CG-CH2 4.18Å; Q220-W518 HydrophobicContact CG-CZ2 4Å; Q509-W518 HydrophobicContact CG-CH2 4.47Å; Q509-W518 VanDerWaalsContact OE1-CH2 3.22Å; L514-W518 HydrophobicContact CB-CH2 4.11Å; L514-W518 HydrophobicContact CB-CZ2 3.99Å; L514-W518 HydrophobicContact CB-CZ3 4.49Å; L514-W518 VanDerWaalsContact O-CD2 3.26Å; L514-W518 VanDerWaalsContact O-CG 3.3Å; L514-W518 PolarHBondContact O-N 3.05Å; T515-W518 PolarHBondContact O-N 2.84Å; K516-W518 VanDerWaalsContact C-N 3.3Å; K516-W518 PolarHBondContact O-N 3.24Å; W518-Q521 PolarHBondContact O-N 3.45Å; W518-S522 PolarHBondContact O-N 3.21Å; W518-S522 PolarHBondContact O-OG 2.89Å
519	I	93.4	Very high	92.6	Very high	19 Å²	19	65.1 Å²	65.1	10%	0.097	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-50.6	173	-67.4	162.5	0	0	0	110	Y213 L279 L457 F460 T515 K516 Q521 S522	Y213-I519 HydrophobicContact CD1-CG1 3.86Å; Y213-I519 HydrophobicContact CG-CG1 3.92Å; L279-I519 HydrophobicContact CD1-CD1 4.26Å; L457-I519 HydrophobicContact CD2-CD1 3.95Å; F460-I519 HydrophobicContact CD1-CG2 3.83Å; F460-I519 HydrophobicContact CE1-CG2 4.19Å; F460-I519 HydrophobicContact CG-CG2 4.36Å; T515-I519 HydrophobicContact CG2-CD1 4.15Å; T515-I519 WeakPolarHBondContact O-CG1 3.36Å; T515-I519 PolarHBondContact O-N 2.96Å; K516-I519 PolarHBondContact O-N 2.91Å; I519-Q521 PolarHBondContact O-N 3.45Å; I519-S522 VanDerWaalsContact O-CB 3.32Å; I519-S522 WeakPolarHBondContact O-CB 3.23Å; I519-S522 PolarHBondContact O-N 2.84Å; I519-S522 VanDerWaalsContact O-N 3.1Å; I519-S522 PolarHBondContact O-OG 3.34Å
520	D	91.9	Very high	92.2	Very high	78 Å²	78	70.5 Å²	70.5	42%	0.417	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-32.6	179.6	-67.9	-18.7	0	0	0	112.2	F460 K516 Y517	F460-D520 VanDerWaalsContact CZ-OD1 3.31Å; F460-D520 WeakPolarHBondContact CZ-OD1 3.31Å; K516-D520 PolarHBondContact O-N 3.46Å; Y517-D520 PolarHBondContact O-N 3.18Å
521	Q	92	Very high	91.7	Very high	31 Å²	31	70.2 Å²	70.2	15%	0.145	33%	0.331	C	S	.	.	H	α-helix	trans	-85.3	-15.6	-180	-172.9	59.7	31.5	0	0	113.5	Y517 W518 I519 Y523 R524 D525	Y517-Q521 WeakPolarHBondContact O-CB 3.4Å; Y517-Q521 PolarHBondContact O-N 2.97Å; W518-Q521 PolarHBondContact O-N 3.45Å; I519-Q521 PolarHBondContact O-N 3.45Å; Q521-Y523 VanDerWaalsContact C-N 3.34Å; Q521-Y523 PolarHBondContact O-N 3.48Å; Q521-R524 WeakPolarHBondContact O-CB 3.37Å; Q521-R524 PolarHBondContact O-N 3.12Å; Q521-D525 PolarHBondContact O-N 2.89Å; Q521-D525 VanDerWaalsContact O-N 3.1Å
522	S	92.1	Very high	91	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-41.8	-169.5	-70.5	0	0	0	0	112.8	P195 W518 I519 R524 D525 M526	P195-S522 VanDerWaalsContact CB-CB 3.48Å; W518-S522 PolarHBondContact O-N 3.21Å; W518-S522 PolarHBondContact O-OG 2.89Å; I519-S522 VanDerWaalsContact O-CB 3.32Å; I519-S522 WeakPolarHBondContact O-CB 3.23Å; I519-S522 PolarHBondContact O-N 2.84Å; I519-S522 VanDerWaalsContact O-N 3.1Å; I519-S522 PolarHBondContact O-OG 3.34Å; S522-R524 VanDerWaalsContact C-N 3.32Å; S522-R524 PolarHBondContact O-N 3.01Å; S522-D525 PolarHBondContact O-N 2.88Å; S522-D525 VanDerWaalsContact O-N 3.08Å; S522-M526 WeakPolarHBondContact O-CG 3.39Å; S522-M526 PolarHBondContact O-N 2.95Å
523	Y	90.2	Very high	90	Very high	26 Å²	26	60.7 Å²	60.7	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-56.8	-45	176.9	-179.8	-113	0	0	0	112.6	T461 E464 E465 L468 Q521 D525 M526 I527	T461-Y523 HydrophobicContact CG2-CD2 4.05Å; E464-Y523 HydrophobicContact CB-CD1 4.36Å; E464-Y523 HydrophobicContact CB-CG 4.14Å; E465-Y523 HydrophobicContact CB-CD2 4.2Å; E465-Y523 HydrophobicContact CB-CE2 3.56Å; E465-Y523 HydrophobicContact CG-CE2 3.89Å; L468-Y523 HydrophobicContact CD1-CE1 4.38Å; L468-Y523 WeakPolarHBondContact CD1-OH 3.43Å; Q521-Y523 VanDerWaalsContact C-N 3.34Å; Q521-Y523 PolarHBondContact O-N 3.48Å; Y523-D525 VanDerWaalsContact C-N 3.3Å; Y523-D525 PolarHBondContact O-N 3.43Å; Y523-M526 PolarHBondContact O-N 3.2Å; Y523-I527 HydrophobicContact CD1-CD1 3.94Å; Y523-I527 HydrophobicContact CE1-CD1 3.35Å; Y523-I527 HydrophobicContact CE1-CG1 4.36Å; Y523-I527 HydrophobicContact CE2-CD1 4.3Å; Y523-I527 HydrophobicContact CE2-CG1 4.49Å; Y523-I527 PolarHBondContact O-N 2.88Å; Y523-I527 VanDerWaalsContact O-N 3.15Å
524	R	90.9	Very high	89	Confident	154 Å²	154	66.3 Å²	66.3	58%	0.581	31%	0.311	S	S	*	.	H	α-helix	trans	-67.3	-33.8	178.1	-65.3	177.6	-175.6	-101.6	2.9	111.7	Q521 S522 R528	Q521-R524 WeakPolarHBondContact O-CB 3.37Å; Q521-R524 PolarHBondContact O-N 3.12Å; S522-R524 VanDerWaalsContact C-N 3.32Å; S522-R524 PolarHBondContact O-N 3.01Å; R524-R528 VanDerWaalsContact O-CG 3.3Å; R524-R528 WeakPolarHBondContact O-CG 3.35Å; R524-R528 PolarHBondContact O-N 3.16Å; R524-R528 VanDerWaalsContact O-N 3.1Å
525	D	92.1	Very high	88.2	Confident	14 Å²	14	69.2 Å²	69.2	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-72	-33.7	176.6	-75.6	-30.7	0	0	0	112.4	I198 K211 Q521 S522 Y523 R528 A529	I198-D525 HydrophobicContact CD1-CB 4.08Å; K211-D525 HydrophobicContact CB-CB 4.49Å; K211-D525 HydrophobicContact CD-CB 3.82Å; K211-D525 IonicContact NZ-OD1 2.98Å; K211-D525 PolarHBondContact NZ-OD1 3.41Å; Q521-D525 PolarHBondContact O-N 2.89Å; Q521-D525 VanDerWaalsContact O-N 3.1Å; S522-D525 PolarHBondContact O-N 2.88Å; S522-D525 VanDerWaalsContact O-N 3.08Å; Y523-D525 VanDerWaalsContact C-N 3.3Å; Y523-D525 PolarHBondContact O-N 3.43Å; D525-R528 PolarHBondContact O-N 3.05Å; D525-R528 IonicContact OD1-CZ 3.19Å; D525-R528 IonicContact OD1-NH1 3.3Å; D525-R528 PolarHBondContact OD1-NH1 3.46Å; D525-A529 WeakPolarHBondContact O-CB 3.26Å; D525-A529 PolarHBondContact O-N 3.44Å
526	M	90.8	Very high	87.6	Confident	17 Å²	17	72.3 Å²	72.3	8%	0.084	34%	0.338	C	S	.	.	H	α-helix	trans	-62.1	-44	170.9	-69.3	173.4	59.1	0	0	112	P194 P195 I198 T461 S522 Y523 R528 A529 N530 L531 T532	P194-M526 HydrophobicContact CB-CE 3.67Å; P194-M526 HydrophobicContact CB-CG 4Å; P194-M526 HydrophobicContact CB-SD 3.61Å; P194-M526 HydrophobicContact CG-CE 4.43Å; P195-M526 HydrophobicContact CB-SD 4.37Å; I198-M526 HydrophobicContact CD1-CG 3.53Å; I198-M526 HydrophobicContact CG1-CG 4Å; T461-M526 HydrophobicContact CG2-CE 4.41Å; T461-M526 HydrophobicContact CG2-SD 3.5Å; T461-M526 VanDerWaalsContact CG2-SD 3.5Å; S522-M526 WeakPolarHBondContact O-CG 3.39Å; S522-M526 PolarHBondContact O-N 2.95Å; Y523-M526 PolarHBondContact O-N 3.2Å; M526-R528 PolarHBondContact O-N 3.37Å; M526-A529 CarbonylContact O-C 3.59Å; M526-A529 PolarHBondContact O-N 3.45Å; M526-N530 PolarHBondContact O-N 2.93Å; M526-L531 HydrophobicContact CB-CB 4.49Å; M526-L531 PolarHBondContact O-N 3.42Å; M526-T532 HydrophobicContact CE-CG2 3.55Å
527	I	89.4	Confident	87.1	Confident	34 Å²	34	68.7 Å²	68.7	17%	0.174	32%	0.322	C	S	.	.	H	α-helix	trans	-59.9	-46.5	174.3	-67.4	163.5	0	0	0	110.6	Y523 A529 N530 F534	Y523-I527 HydrophobicContact CD1-CD1 3.94Å; Y523-I527 HydrophobicContact CE1-CD1 3.35Å; Y523-I527 HydrophobicContact CE1-CG1 4.36Å; Y523-I527 HydrophobicContact CE2-CD1 4.3Å; Y523-I527 HydrophobicContact CE2-CG1 4.49Å; Y523-I527 PolarHBondContact O-N 2.88Å; Y523-I527 VanDerWaalsContact O-N 3.15Å; I527-A529 VanDerWaalsContact C-N 3.26Å; I527-A529 PolarHBondContact O-N 3.38Å; I527-N530 PolarHBondContact O-N 2.63Å; I527-F534 HydrophobicContact CD1-CE1 4.06Å; I527-F534 HydrophobicContact CD1-CE2 4.42Å; I527-F534 HydrophobicContact CD1-CZ 3.75Å; I527-F534 HydrophobicContact CG1-CZ 4.45Å; I527-F534 HydrophobicContact CG2-CE2 3.67Å; I527-F534 HydrophobicContact CG2-CZ 3.95Å
528	R	89.6	Confident	86.5	Confident	156 Å²	156	63.2 Å²	63.2	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-64.4	-30.8	179.4	-72.6	170.1	-177.1	157.5	-4	113	R524 D525 M526 N530	R524-R528 VanDerWaalsContact O-CG 3.3Å; R524-R528 WeakPolarHBondContact O-CG 3.35Å; R524-R528 PolarHBondContact O-N 3.16Å; R524-R528 VanDerWaalsContact O-N 3.1Å; D525-R528 PolarHBondContact O-N 3.05Å; D525-R528 IonicContact OD1-CZ 3.19Å; D525-R528 IonicContact OD1-NH1 3.3Å; D525-R528 PolarHBondContact OD1-NH1 3.46Å; M526-R528 PolarHBondContact O-N 3.37Å; R528-N530 PolarHBondContact O-N 2.93Å
529	A	87.9	Confident	85.5	Confident	27 Å²	27	65.4 Å²	65.4	22%	0.223	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.6	176	0	0	0	0	0	112.8	I198 D525 M526 I527 L531	I198-A529 HydrophobicContact CG2-CB 3.69Å; D525-A529 WeakPolarHBondContact O-CB 3.26Å; D525-A529 PolarHBondContact O-N 3.44Å; M526-A529 CarbonylContact O-C 3.59Å; M526-A529 PolarHBondContact O-N 3.45Å; I527-A529 VanDerWaalsContact C-N 3.26Å; I527-A529 PolarHBondContact O-N 3.38Å; A529-L531 HydrophobicContact CB-CD1 4.23Å; A529-L531 HydrophobicContact CB-CG 3.95Å; A529-L531 PolarHBondContact O-N 3.47Å; A529-L531 VanDerWaalsContact O-N 3.17Å
530	N	85.7	Confident	84.4	Confident	141 Å²	141	70.3 Å²	70.3	75%	0.754	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	24.8	-175.1	-61.6	-41	0	0	0	113.9	M526 I527 R528	M526-N530 PolarHBondContact O-N 2.93Å; I527-N530 PolarHBondContact O-N 2.63Å; R528-N530 PolarHBondContact O-N 2.93Å
531	L	83.1	Confident	83.1	Confident	82 Å²	82	70.2 Å²	70.2	43%	0.429	35%	0.352	S	S	.	.	S	Bend	trans	-78.8	-31.5	176.1	-63.3	-179	0	0	0	111.6	P194 I198 M526 A529	P194-L531 HydrophobicContact CG-CD1 3.72Å; I198-L531 HydrophobicContact CG2-CD1 3.82Å; M526-L531 HydrophobicContact CB-CB 4.49Å; M526-L531 PolarHBondContact O-N 3.42Å; A529-L531 HydrophobicContact CB-CD1 4.23Å; A529-L531 HydrophobicContact CB-CG 3.95Å; A529-L531 PolarHBondContact O-N 3.47Å; A529-L531 VanDerWaalsContact O-N 3.17Å
532	T	79.2	Confident	81.6	Confident	20 Å²	20	77.1 Å²	77.1	12%	0.123	38%	0.384	C	S	.	.	S	Bend	trans	-126.9	149.8	174.1	51.8	0	0	0	0	110.2	M526	M526-T532 HydrophobicContact CE-CG2 3.55Å
533	T	74.6	Confident	79.9	Confident	87 Å²	87	81.7 Å²	81.7	53%	0.534	41%	0.408	S	S	.	.			trans	-117	160.4	178.4	55.5	0	0	0	0	109.8	K535	T533-K535 PolarHBondContact O-N 3.45Å
534	F	72.8	Confident	78.5	Confident	151 Å²	151	88 Å²	88	66%	0.662	44%	0.444	S	S	*	.	S	Bend	trans	-72.9	52.2	171.9	-65.2	-87	0	0	0	111.2	L468 I527	L468-F534 HydrophobicContact CD1-CD1 3.53Å; L468-F534 HydrophobicContact CD1-CE1 3.91Å; I527-F534 HydrophobicContact CD1-CE1 4.06Å; I527-F534 HydrophobicContact CD1-CE2 4.42Å; I527-F534 HydrophobicContact CD1-CZ 3.75Å; I527-F534 HydrophobicContact CG1-CZ 4.45Å; I527-F534 HydrophobicContact CG2-CE2 3.67Å; I527-F534 HydrophobicContact CG2-CZ 3.95Å
535	K	78.6	Confident	77.6	Confident	121 Å²	121	86.8 Å²	86.8	53%	0.526	44%	0.44	S	S	.	.			trans	-97	128.7	178.4	-172.5	176	177.7	-173.7	0	108.7	F469 T533 F537	F469-K535 VanDerWaalsContact CE1-O 3.3Å; F469-K535 WeakPolarHBondContact CE1-O 3.27Å; T533-K535 PolarHBondContact O-N 3.45Å; K535-F537 HydrophobicContact CB-CE2 4.21Å; K535-F537 HydrophobicContact CB-CZ 4.3Å; K535-F537 HydrophobicContact CD-CE1 3.91Å; K535-F537 HydrophobicContact CD-CZ 3.99Å; K535-F537 HydrophobicContact CG-CE1 4.47Å; K535-F537 HydrophobicContact CG-CZ 4.37Å; K535-F537 WeakPolarHBondContact O-CD2 3.37Å
536	D	81.9	Confident	76.9	Confident	70 Å²	70	90.4 Å²	90.4	37%	0.374	46%	0.459	S	S	.	.			trans	-80	120	169.4	-165.7	-11.1	0	0	0	108.9	F469 K470 S538	F469-D536 WeakPolarHBondContact CA-OD1 3.39Å; F469-D536 VanDerWaalsContact CB-OD1 3.31Å; F469-D536 WeakPolarHBondContact CB-OD1 3.26Å; K470-D536 PolarHBondContact N-OD2 3.22Å; D536-S538 WeakPolarHBondContact OD1-CB 2.99Å; D536-S538 PolarHBondContact OD1-N 2.99Å; D536-S538 PolarHBondContact OD1-OG 2.93Å; D536-S538 PolarHBondContact OD2-OG 2.71Å; D536-S538 VanDerWaalsContact OD2-OG 3.08Å
537	F	83.1	Confident	76.5	Confident	64 Å²	64	94 Å²	94	28%	0.281	48%	0.475	S	S	.	.			trans	-96.4	-0.4	175.1	-66.3	-82	0	0	0	112.4	F446 F469 I473 K535	F446-F537 HydrophobicContact CB-CB 4.17Å; F446-F537 HydrophobicContact CB-CG 4.46Å; F446-F537 HydrophobicContact CD2-CD2 4.02Å; F446-F537 HydrophobicContact CD2-CE2 4.33Å; F446-F537 HydrophobicContact CD2-CG 4.33Å; F446-F537 HydrophobicContact CE2-CD2 4.43Å; F469-F537 AromaticContact CE1-CD2 3.89Å; F469-F537 HydrophobicContact CE1-CD2 3.89Å; F469-F537 HydrophobicContact CE2-CB 4.34Å; F469-F537 HydrophobicContact CZ-CB 4.2Å; F469-F537 AromaticContact CZ-CD2 3.65Å; F469-F537 HydrophobicContact CZ-CD2 3.65Å; F469-F537 HydrophobicContact CZ-CG 4.42Å; I473-F537 HydrophobicContact CD1-CB 4.03Å; K535-F537 HydrophobicContact CB-CE2 4.21Å; K535-F537 HydrophobicContact CB-CZ 4.3Å; K535-F537 HydrophobicContact CD-CE1 3.91Å; K535-F537 HydrophobicContact CD-CZ 3.99Å; K535-F537 HydrophobicContact CG-CE1 4.47Å; K535-F537 HydrophobicContact CG-CZ 4.37Å; K535-F537 WeakPolarHBondContact O-CD2 3.37Å
538	S	81.8	Confident	76.3	Confident	19 Å²	19	97.7 Å²	97.7	13%	0.133	50%	0.499	C	S	.	.	S	Bend	trans	-63.8	137.9	176.5	64.1	0	0	0	0	110.9	D536	D536-S538 WeakPolarHBondContact OD1-CB 2.99Å; D536-S538 PolarHBondContact OD1-N 2.99Å; D536-S538 PolarHBondContact OD1-OG 2.93Å; D536-S538 PolarHBondContact OD2-OG 2.71Å; D536-S538 VanDerWaalsContact OD2-OG 3.08Å
539	P	75.1	Confident	76.1	Confident	63 Å²	63	96.3 Å²	96.3	41%	0.409	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-54	147.3	171.9	-11.2	12	0	0	0	110.6	Y471 L541	Y471-P539 WeakPolarHBondContact CE1-O 3.1Å; Y471-P539 HydrophobicContact CE2-CG 4.49Å; Y471-P539 WeakPolarHBondContact OH-CA 3.13Å; Y471-P539 VanDerWaalsContact OH-CB 3.23Å; Y471-P539 WeakPolarHBondContact OH-CB 3.42Å; Y471-P539 WeakPolarHBondContact OH-CD 3.37Å; Y471-P539 WeakPolarHBondContact OH-CG 3.4Å; Y471-P539 PolarHBondContact OH-O 3.46Å; P539-L541 PolarHBondContact O-N 2.69Å
540	P	70.5	Confident	76	Confident	121 Å²	121	96.3 Å²	96.3	79%	0.786	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-55.2	138.7	171.4	26.9	-33.7	0	0	0	108.6	E542	P540-E542 PolarHBondContact O-N 3.34Å; P540-E542 VanDerWaalsContact O-N 3.16Å
541	L	63.6	Low	76.1	Confident	77 Å²	77	91.9 Å²	91.9	40%	0.403	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-55.1	125.8	174.2	-80.4	149.9	0	0	0	109	K470 P539 N543	K470-L541 HydrophobicContact CD-CD1 3.57Å; K470-L541 HydrophobicContact CD-CG 4.25Å; P539-L541 PolarHBondContact O-N 2.69Å; L541-N543 PolarHBondContact O-N 2.93Å
542	E	60.2	Low	76.4	Confident	175 Å²	175	93.9 Å²	93.9	82%	0.818	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-57.7	127.2	152.4	-79.9	-175.6	155.2	0	0	106.7	P540 D544	P540-E542 PolarHBondContact O-N 3.34Å; P540-E542 VanDerWaalsContact O-N 3.16Å; E542-D544 PolarHBondContact O-N 3.47Å
543	N	57.1	Low	76.9	Confident	97 Å²	97	98 Å²	98	52%	0.519	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-59.3	142.1	-170.6	-68.8	-53	0	0	0	110.8	L541 Y545	L541-N543 PolarHBondContact O-N 2.93Å; N543-Y545 HydrophobicContact CB-CD1 3.27Å; N543-Y545 HydrophobicContact CB-CE1 2.97Å; N543-Y545 HydrophobicContact CB-CE2 4.34Å; N543-Y545 HydrophobicContact CB-CG 4.07Å; N543-Y545 WeakPolarHBondContact ND2-CE1 3.46Å; N543-Y545 VanDerWaalsContact ND2-CZ 3.33Å; N543-Y545 PolarHBondContact ND2-OH 3.05Å; N543-Y545 PolarHBondContact O-N 3.39Å
544	D	61.4	Low	77.6	Confident	159 Å²	159	96.9 Å²	96.9	85%	0.85	48%	0.481	S	S	*	.	S	Bend	trans	-65.3	14.7	-180	-62.5	-31.6	0	0	0	114.5	E542	E542-D544 PolarHBondContact O-N 3.47Å
545	Y	71.4	Confident	78.5	Confident	128 Å²	128	93.7 Å²	93.7	50%	0.502	47%	0.467	S	S	.	.	S	Bend	trans	-100.8	137	-179.9	59.9	-109	0	0	0	111.9	N543 E547	N543-Y545 HydrophobicContact CB-CD1 3.27Å; N543-Y545 HydrophobicContact CB-CE1 2.97Å; N543-Y545 HydrophobicContact CB-CE2 4.34Å; N543-Y545 HydrophobicContact CB-CG 4.07Å; N543-Y545 WeakPolarHBondContact ND2-CE1 3.46Å; N543-Y545 VanDerWaalsContact ND2-CZ 3.33Å; N543-Y545 PolarHBondContact ND2-OH 3.05Å; N543-Y545 PolarHBondContact O-N 3.39Å; Y545-E547 HydrophobicContact CD2-CG 3.68Å; Y545-E547 HydrophobicContact CE2-CG 3.4Å; Y545-E547 VanDerWaalsContact CE2-CG 3.4Å; Y545-E547 WeakPolarHBondContact CE2-OE1 3.16Å; Y545-E547 PolarHBondContact O-N 3.39Å; Y545-E547 PolarHBondContact OH-OE1 3.43Å
546	I	76.3	Confident	79.1	Confident	90 Å²	90	90 Å²	90	46%	0.462	45%	0.454	S	S	.	.			trans	-73.3	111.4	174.3	-58.7	173.4	0	0	0	108.2	L389 N550	L389-I546 HydrophobicContact CD1-CD1 4.32Å; L389-I546 HydrophobicContact CD2-CD1 4.06Å; I546-N550 HydrophobicContact CG2-CB 4.19Å
547	E	83.7	Confident	79.5	Confident	93 Å²	93	92.7 Å²	92.7	44%	0.435	47%	0.466	S	S	.	.			trans	-77.2	155.7	173.2	-69.3	-167.9	178.3	0	0	112	Y545 H549 N550	Y545-E547 HydrophobicContact CD2-CG 3.68Å; Y545-E547 HydrophobicContact CE2-CG 3.4Å; Y545-E547 VanDerWaalsContact CE2-CG 3.4Å; Y545-E547 WeakPolarHBondContact CE2-OE1 3.16Å; Y545-E547 PolarHBondContact O-N 3.39Å; Y545-E547 PolarHBondContact OH-OE1 3.43Å; E547-H549 PolarHBondContact O-N 2.97Å; E547-N550 PolarHBondContact N-ND2 3.41Å; E547-N550 WeakPolarHBondContact O-CB 3.27Å; E547-N550 PolarHBondContact O-N 2.85Å
548	V	85.4	Confident	79.9	Confident	111 Å²	111	96 Å²	96	67%	0.673	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-59.4	-31.3	174.6	-178.3	0	0	0	0	111	N550 L551 F555	V548-N550 VanDerWaalsContact C-N 3.26Å; V548-N550 PolarHBondContact O-N 3.43Å; V548-L551 PolarHBondContact O-N 2.86Å; V548-L551 VanDerWaalsContact O-N 3.11Å; V548-F555 HydrophobicContact CG1-CE2 3.94Å
549	H	84.9	Confident	80.5	Confident	127 Å²	127	101.3 Å²	101.3	59%	0.588	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-60.9	-34.1	174.8	-176.1	67.8	0	0	0	112.5	E547 L551 Y552	E547-H549 PolarHBondContact O-N 2.97Å; H549-L551 PolarHBondContact O-N 3.46Å; H549-L551 VanDerWaalsContact O-N 3.14Å; H549-Y552 WeakPolarHBondContact O-CB 3.21Å; H549-Y552 PolarHBondContact O-N 3.49Å
550	N	84.9	Confident	81.5	Confident	26 Å²	26	102.1 Å²	102.1	14%	0.139	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-67.1	-16.6	178.1	-59.9	-19.3	0	0	0	112.3	F295 S296 Y299 I546 E547 V548 Y552	F295-N550 HydrophobicContact CB-CB 4.04Å; S296-N550 WeakPolarHBondContact CA-O 3.28Å; Y299-N550 WeakPolarHBondContact CE2-O 3.41Å; I546-N550 HydrophobicContact CG2-CB 4.19Å; E547-N550 PolarHBondContact N-ND2 3.41Å; E547-N550 WeakPolarHBondContact O-CB 3.27Å; E547-N550 PolarHBondContact O-N 2.85Å; V548-N550 VanDerWaalsContact C-N 3.26Å; V548-N550 PolarHBondContact O-N 3.43Å; N550-Y552 VanDerWaalsContact C-N 3.3Å
551	L	88.6	Confident	82.5	Confident	48 Å²	48	98.3 Å²	98.3	25%	0.251	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-91.1	10.8	174.9	-64	171.5	0	0	0	113	Y299 V548 H549 W553 V554 F555	Y299-L551 HydrophobicContact CE1-CD2 4.3Å; Y299-L551 HydrophobicContact CE2-CD2 3.98Å; Y299-L551 WeakPolarHBondContact OH-CD2 3.5Å; V548-L551 PolarHBondContact O-N 2.86Å; V548-L551 VanDerWaalsContact O-N 3.11Å; H549-L551 PolarHBondContact O-N 3.46Å; H549-L551 VanDerWaalsContact O-N 3.14Å; L551-W553 PolarHBondContact O-N 3.24Å; L551-V554 HydrophobicContact CD2-CG2 4.46Å; L551-V554 PolarHBondContact O-N 3.33Å; L551-V554 VanDerWaalsContact O-N 3.09Å; L551-F555 HydrophobicContact CB-CD2 3.69Å; L551-F555 HydrophobicContact CB-CE2 3.5Å; L551-F555 HydrophobicContact CB-CZ 4.34Å; L551-F555 HydrophobicContact CD1-CE2 3.96Å; L551-F555 HydrophobicContact CD1-CZ 4.16Å; L551-F555 HydrophobicContact CG-CE2 4.4Å; L551-F555 WeakPolarHBondContact O-CD2 3.28Å; L551-F555 PolarHBondContact O-N 3.26Å
552	Y	89.8	Confident	83.9	Confident	124 Å²	124	99.8 Å²	99.8	49%	0.486	49%	0.491	S	S	.	.	H	α-helix	trans	-49.6	-50.8	-175.2	174.5	-100.7	0	0	0	113.4	H549 N550 V554 F555 T556	H549-Y552 WeakPolarHBondContact O-CB 3.21Å; H549-Y552 PolarHBondContact O-N 3.49Å; N550-Y552 VanDerWaalsContact C-N 3.3Å; Y552-V554 PolarHBondContact O-N 2.91Å; Y552-F555 PolarHBondContact O-N 3.08Å; Y552-T556 VanDerWaalsContact O-CB 3.31Å; Y552-T556 WeakPolarHBondContact O-CB 3.49Å; Y552-T556 PolarHBondContact O-N 2.79Å; Y552-T556 PolarHBondContact O-OG1 2.98Å
553	W	88.6	Confident	85.6	Confident	106 Å²	106	93 Å²	93	40%	0.402	47%	0.468	S	S	.	.	H	α-helix	trans	-65.1	-40.3	-180	-75.4	115.8	0	0	0	112.6	D297 M300 L551 T556 M557	D297-W553 PolarHBondContact OD1-NE1 3.34Å; M300-W553 HydrophobicContact CG-CB 4.18Å; M300-W553 HydrophobicContact CG-CD2 4.46Å; M300-W553 HydrophobicContact CG-CG 4.08Å; L551-W553 PolarHBondContact O-N 3.24Å; W553-T556 PolarHBondContact O-N 2.81Å; W553-M557 WeakPolarHBondContact O-CG 3.29Å; W553-M557 PolarHBondContact O-N 3.28Å
554	V	89.2	Confident	87.3	Confident	65 Å²	65	93.6 Å²	93.6	39%	0.394	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-48.5	178.6	-179.9	0	0	0	0	110.5	Y299 L551 Y552 M557 Y558	Y299-V554 HydrophobicContact CD1-CG2 4Å; Y299-V554 HydrophobicContact CD2-CG2 4.3Å; Y299-V554 HydrophobicContact CE1-CG2 4.49Å; Y299-V554 HydrophobicContact CG-CG2 3.89Å; L551-V554 HydrophobicContact CD2-CG2 4.46Å; L551-V554 PolarHBondContact O-N 3.33Å; L551-V554 VanDerWaalsContact O-N 3.09Å; Y552-V554 PolarHBondContact O-N 2.91Å; V554-M557 PolarHBondContact O-N 2.92Å; V554-Y558 WeakPolarHBondContact O-CB 3.32Å; V554-Y558 PolarHBondContact O-N 2.98Å
555	F	92.2	Very high	88.7	Confident	84 Å²	84	88 Å²	88	37%	0.368	45%	0.449	S	S	.	.	H	α-helix	trans	-65	-40.1	177	-74.2	-49.7	0	0	0	112.2	V548 L551 Y552 M557 Y558 F559	V548-F555 HydrophobicContact CG1-CE2 3.94Å; L551-F555 HydrophobicContact CB-CD2 3.69Å; L551-F555 HydrophobicContact CB-CE2 3.5Å; L551-F555 HydrophobicContact CB-CZ 4.34Å; L551-F555 HydrophobicContact CD1-CE2 3.96Å; L551-F555 HydrophobicContact CD1-CZ 4.16Å; L551-F555 HydrophobicContact CG-CE2 4.4Å; L551-F555 WeakPolarHBondContact O-CD2 3.28Å; L551-F555 PolarHBondContact O-N 3.26Å; Y552-F555 PolarHBondContact O-N 3.08Å; F555-M557 PolarHBondContact O-N 2.76Å; F555-Y558 PolarHBondContact O-N 2.98Å; F555-F559 HydrophobicContact CB-CD2 4.15Å; F555-F559 HydrophobicContact CB-CE2 3.96Å; F555-F559 HydrophobicContact CD1-CE2 4.31Å; F555-F559 HydrophobicContact CG-CE2 4.39Å; F555-F559 WeakPolarHBondContact O-CD2 3.22Å; F555-F559 PolarHBondContact O-N 3.06Å
556	T	91.3	Very high	89.7	Confident	43 Å²	43	87 Å²	87	26%	0.264	45%	0.451	S	S	.	.	H	α-helix	trans	-58.5	-49.8	176.6	-60.9	0	0	0	0	110.8	Y552 W553 Y558 F559 V560	Y552-T556 VanDerWaalsContact O-CB 3.31Å; Y552-T556 WeakPolarHBondContact O-CB 3.49Å; Y552-T556 PolarHBondContact O-N 2.79Å; Y552-T556 PolarHBondContact O-OG1 2.98Å; W553-T556 PolarHBondContact O-N 2.81Å; T556-Y558 VanDerWaalsContact C-N 3.33Å; T556-Y558 PolarHBondContact O-N 3.22Å; T556-F559 PolarHBondContact O-N 3.35Å; T556-V560 HydrophobicContact CG2-CG2 4.34Å; T556-V560 WeakPolarHBondContact O-CB 3.5Å; T556-V560 WeakPolarHBondContact O-CG2 3.34Å; T556-V560 PolarHBondContact O-N 3.27Å
557	M	89.6	Confident	90.4	Very high	127 Å²	127	86.1 Å²	86.1	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-61.5	-40.2	177.3	-70.4	-63.1	-72	0	0	112.3	W553 V554 F555 G561	W553-M557 WeakPolarHBondContact O-CG 3.29Å; W553-M557 PolarHBondContact O-N 3.28Å; V554-M557 PolarHBondContact O-N 2.92Å; F555-M557 PolarHBondContact O-N 2.76Å; M557-G561 PolarHBondContact O-N 3.32Å
558	Y	92.3	Very high	90.7	Very high	133 Å²	133	87.8 Å²	87.8	52%	0.522	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-51.3	176.7	176.3	-101.5	0	0	0	112.5	V554 F555 T556 G561 M562	V554-Y558 WeakPolarHBondContact O-CB 3.32Å; V554-Y558 PolarHBondContact O-N 2.98Å; F555-Y558 PolarHBondContact O-N 2.98Å; T556-Y558 VanDerWaalsContact C-N 3.33Å; T556-Y558 PolarHBondContact O-N 3.22Å; Y558-G561 PolarHBondContact O-N 3.45Å; Y558-M562 HydrophobicContact CD1-CG 4.45Å; Y558-M562 HydrophobicContact CD2-CG 4.49Å; Y558-M562 HydrophobicContact CE1-CG 4.06Å; Y558-M562 HydrophobicContact CE2-CG 4.1Å; Y558-M562 WeakPolarHBondContact O-CB 3.38Å; Y558-M562 WeakPolarHBondContact O-CG 3.24Å; Y558-M562 PolarHBondContact O-N 3.32Å
559	F	94.8	Very high	90.9	Very high	130 Å²	130	88.4 Å²	88.4	57%	0.57	45%	0.453	S	S	*	.	H	α-helix	trans	-68.6	-38.1	-178.2	-70.6	-57.6	0	0	0	112.5	F555 T556 M562 G563	F555-F559 HydrophobicContact CB-CD2 4.15Å; F555-F559 HydrophobicContact CB-CE2 3.96Å; F555-F559 HydrophobicContact CD1-CE2 4.31Å; F555-F559 HydrophobicContact CG-CE2 4.39Å; F555-F559 WeakPolarHBondContact O-CD2 3.22Å; F555-F559 PolarHBondContact O-N 3.06Å; T556-F559 PolarHBondContact O-N 3.35Å; F559-M562 PolarHBondContact O-N 2.9Å; F559-G563 PolarHBondContact O-N 3.05Å
560	V	95.1	Very high	91.1	Very high	81 Å²	81	86 Å²	86	49%	0.491	44%	0.444	S	S	.	.	H	α-helix	trans	-61.5	-45.7	172.8	170.9	0	0	0	0	110.3	T556 G563 M564	T556-V560 HydrophobicContact CG2-CG2 4.34Å; T556-V560 WeakPolarHBondContact O-CB 3.5Å; T556-V560 WeakPolarHBondContact O-CG2 3.34Å; T556-V560 PolarHBondContact O-N 3.27Å; V560-G563 PolarHBondContact O-N 2.7Å; V560-M564 HydrophobicContact CG1-SD 4.24Å; V560-M564 WeakPolarHBondContact O-CG 3.45Å; V560-M564 PolarHBondContact O-N 3.24Å
561	G	92.1	Very high	91.3	Very high	40 Å²	40	89.7 Å²	89.7	41%	0.412	46%	0.463	S	S	.	.	H	α-helix	trans	-60.4	-45.8	176.7	0	0	0	0	0	113	M557 Y558 M564 G565	M557-G561 PolarHBondContact O-N 3.32Å; Y558-G561 PolarHBondContact O-N 3.45Å; G561-M564 PolarHBondContact O-N 2.94Å; G561-G565 PolarHBondContact O-N 2.73Å
562	M	93.8	Very high	91.3	Very high	108 Å²	108	94 Å²	94	53%	0.532	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-43.1	175.2	-75	-66.5	-67	0	0	112	Y558 F559 G565 L566	Y558-M562 HydrophobicContact CD1-CG 4.45Å; Y558-M562 HydrophobicContact CD2-CG 4.49Å; Y558-M562 HydrophobicContact CE1-CG 4.06Å; Y558-M562 HydrophobicContact CE2-CG 4.1Å; Y558-M562 WeakPolarHBondContact O-CB 3.38Å; Y558-M562 WeakPolarHBondContact O-CG 3.24Å; Y558-M562 PolarHBondContact O-N 3.32Å; F559-M562 PolarHBondContact O-N 2.9Å; M562-G565 PolarHBondContact O-N 3.33Å; M562-L566 WeakPolarHBondContact O-CB 3.49Å; M562-L566 PolarHBondContact O-N 2.96Å
563	G	94.8	Very high	91.3	Very high	34 Å²	34	91.9 Å²	91.9	35%	0.351	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.4	0	0	0	0	0	112.4	F559 V560 G565 L566 C567	F559-G563 PolarHBondContact O-N 3.05Å; V560-G563 PolarHBondContact O-N 2.7Å; G563-G565 PolarHBondContact O-N 3.23Å; G563-L566 PolarHBondContact O-N 2.63Å; G563-C567 WeakPolarHBondContact O-CB 3.33Å; G563-C567 PolarHBondContact O-N 2.94Å; G563-C567 PolarHBondContact O-SG 3.4Å
564	M	92.3	Very high	90.9	Very high	108 Å²	108	91.4 Å²	91.4	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-60.8	-44.5	174.6	-72	-179.5	70	0	0	111.8	V560 G561 L566 C567 F568	V560-M564 HydrophobicContact CG1-SD 4.24Å; V560-M564 WeakPolarHBondContact O-CG 3.45Å; V560-M564 PolarHBondContact O-N 3.24Å; G561-M564 PolarHBondContact O-N 2.94Å; M564-L566 PolarHBondContact O-N 2.93Å; M564-C567 WeakPolarHBondContact O-CB 3.41Å; M564-C567 PolarHBondContact O-N 3.36Å; M564-F568 HydrophobicContact CE-CE2 4.34Å; M564-F568 WeakPolarHBondContact O-CD2 3.41Å; M564-F568 PolarHBondContact O-N 3.08Å
565	G	90.8	Very high	90	Very high	41 Å²	41	98.1 Å²	98.1	42%	0.423	50%	0.501	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176.6	0	0	0	0	0	112.5	G561 M562 G563 F568 F569	G561-G565 PolarHBondContact O-N 2.73Å; M562-G565 PolarHBondContact O-N 3.33Å; G563-G565 PolarHBondContact O-N 3.23Å; G565-F568 PolarHBondContact O-N 3.37Å; G565-F569 WeakPolarHBondContact O-CB 3.27Å; G565-F569 PolarHBondContact O-N 3.48Å
566	L	93.4	Very high	88.6	Confident	107 Å²	107	97.1 Å²	97.1	56%	0.56	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-42.2	176.3	-175	127.1	0	0	0	111.8	M562 G563 M564 F569 I570	M562-L566 WeakPolarHBondContact O-CB 3.49Å; M562-L566 PolarHBondContact O-N 2.96Å; G563-L566 PolarHBondContact O-N 2.63Å; M564-L566 PolarHBondContact O-N 2.93Å; L566-F569 PolarHBondContact O-N 2.93Å; L566-I570 HydrophobicContact CD2-CD1 3.54Å; L566-I570 HydrophobicContact CG-CD1 4.05Å; L566-I570 VanDerWaalsContact O-CG1 3.28Å; L566-I570 WeakPolarHBondContact O-CG1 3.22Å; L566-I570 PolarHBondContact O-N 3.49Å
567	C	91.4	Very high	86.8	Confident	73 Å²	73	100.1 Å²	100.1	49%	0.493	52%	0.517	S	S	.	.	H	α-helix	trans	-59.6	-46.4	174.3	-74.3	0	0	0	0	112.1	G563 M564 I570 L571	G563-C567 WeakPolarHBondContact O-CB 3.33Å; G563-C567 PolarHBondContact O-N 2.94Å; G563-C567 PolarHBondContact O-SG 3.4Å; M564-C567 WeakPolarHBondContact O-CB 3.41Å; M564-C567 PolarHBondContact O-N 3.36Å; C567-I570 PolarHBondContact O-N 3.49Å; C567-L571 VanDerWaalsContact O-CG 3.3Å; C567-L571 WeakPolarHBondContact O-CG 3.35Å; C567-L571 PolarHBondContact O-N 3.26Å
568	F	88.7	Confident	85	Confident	128 Å²	128	103.6 Å²	103.6	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-63.8	-40.9	176.9	-75.7	-59.2	0	0	0	112.3	M564 G565 L571 E572	M564-F568 HydrophobicContact CE-CE2 4.34Å; M564-F568 WeakPolarHBondContact O-CD2 3.41Å; M564-F568 PolarHBondContact O-N 3.08Å; G565-F568 PolarHBondContact O-N 3.37Å; F568-L571 PolarHBondContact O-N 2.86Å; F568-E572 WeakPolarHBondContact O-CB 3.3Å; F568-E572 PolarHBondContact O-N 2.69Å
569	F	90.2	Very high	83	Confident	123 Å²	123	105.1 Å²	105.1	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-43.7	176.2	-179.7	-108.7	0	0	0	112.1	G565 L566 E572 I573	G565-F569 WeakPolarHBondContact O-CB 3.27Å; G565-F569 PolarHBondContact O-N 3.48Å; L566-F569 PolarHBondContact O-N 2.93Å; F569-E572 PolarHBondContact O-N 3.46Å; F569-I573 HydrophobicContact CD1-CD1 3.85Å; F569-I573 HydrophobicContact CE1-CD1 3.33Å; F569-I573 HydrophobicContact CE1-CG1 4.48Å; F569-I573 HydrophobicContact CE2-CD1 4.1Å; F569-I573 HydrophobicContact CG-CD1 4.44Å; F569-I573 HydrophobicContact CZ-CD1 3.49Å; F569-I573 VanDerWaalsContact CZ-CD1 3.49Å; F569-I573 HydrophobicContact CZ-CG1 4.39Å; F569-I573 WeakPolarHBondContact O-CG1 2.69Å; F569-I573 PolarHBondContact O-N 3Å
570	I	90.3	Very high	80.8	Confident	78 Å²	78	108 Å²	108	40%	0.4	54%	0.536	S	S	.	.	H	α-helix	trans	-62.8	-44.9	175.4	-69.1	167.3	0	0	0	110.8	L566 C567 E572 I573 L574	L566-I570 HydrophobicContact CD2-CD1 3.54Å; L566-I570 HydrophobicContact CG-CD1 4.05Å; L566-I570 VanDerWaalsContact O-CG1 3.28Å; L566-I570 WeakPolarHBondContact O-CG1 3.22Å; L566-I570 PolarHBondContact O-N 3.49Å; C567-I570 PolarHBondContact O-N 3.49Å; I570-E572 VanDerWaalsContact C-N 3.28Å; I570-E572 PolarHBondContact O-N 3.41Å; I570-I573 PolarHBondContact O-N 3.38Å; I570-L574 HydrophobicContact CG2-CD1 3.65Å; I570-L574 HydrophobicContact CG2-CG 4.25Å; I570-L574 WeakPolarHBondContact O-CB 3.5Å; I570-L574 VanDerWaalsContact O-CG 3.25Å; I570-L574 WeakPolarHBondContact O-CG 3.48Å; I570-L574 PolarHBondContact O-N 2.91Å
571	L	88.4	Confident	78.7	Confident	103 Å²	103	113.2 Å²	113.2	54%	0.539	55%	0.547	S	S	.	.	H	α-helix	trans	-61.8	-37.4	175.9	-72	171.9	0	0	0	112.2	C567 F568 L574 R575	C567-L571 VanDerWaalsContact O-CG 3.3Å; C567-L571 WeakPolarHBondContact O-CG 3.35Å; C567-L571 PolarHBondContact O-N 3.26Å; F568-L571 PolarHBondContact O-N 2.86Å; L571-L574 PolarHBondContact O-N 3.5Å; L571-R575 PolarHBondContact O-N 3.18Å
572	E	89.1	Confident	76.7	Confident	138 Å²	138	116.3 Å²	116.3	65%	0.645	55%	0.554	S	S	*	*	H	α-helix	trans	-67.7	-34.2	175.5	-175.5	171.2	-164.3	0	0	112.3	F568 F569 I570 P576	F568-E572 WeakPolarHBondContact O-CB 3.3Å; F568-E572 PolarHBondContact O-N 2.69Å; F569-E572 PolarHBondContact O-N 3.46Å; I570-E572 VanDerWaalsContact C-N 3.28Å; I570-E572 PolarHBondContact O-N 3.41Å; E572-P576 WeakPolarHBondContact O-CD 3.24Å; E572-P576 VanDerWaalsContact O-CG 3.25Å; E572-P576 WeakPolarHBondContact O-CG 3.38Å
573	I	88.1	Confident	74.4	Confident	79 Å²	79	114.2 Å²	114.2	41%	0.405	55%	0.549	S	S	.	.	H	α-helix	trans	-73.5	-39.4	173.4	-71.3	171.5	0	0	0	111.4	F569 I570 R575 P576 L577	F569-I573 HydrophobicContact CD1-CD1 3.85Å; F569-I573 HydrophobicContact CE1-CD1 3.33Å; F569-I573 HydrophobicContact CE1-CG1 4.48Å; F569-I573 HydrophobicContact CE2-CD1 4.1Å; F569-I573 HydrophobicContact CG-CD1 4.44Å; F569-I573 HydrophobicContact CZ-CD1 3.49Å; F569-I573 VanDerWaalsContact CZ-CD1 3.49Å; F569-I573 HydrophobicContact CZ-CG1 4.39Å; F569-I573 WeakPolarHBondContact O-CG1 2.69Å; F569-I573 PolarHBondContact O-N 3Å; I570-I573 PolarHBondContact O-N 3.38Å; I573-R575 PolarHBondContact O-N 3.49Å; I573-P576 VanDerWaalsContact O-CD 3.27Å; I573-P576 WeakPolarHBondContact O-CD 3.4Å; I573-P576 WeakPolarHBondContact O-CG 3.46Å; I573-L577 HydrophobicContact CG2-CD1 3.95Å; I573-L577 PolarHBondContact O-N 3.41Å
574	L	82.1	Confident	72.1	Confident	97 Å²	97	119.7 Å²	119.7	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-71.8	-29.1	-177.5	-70.2	171.3	0	0	0	113.1	I570 L571 R578	I570-L574 HydrophobicContact CG2-CD1 3.65Å; I570-L574 HydrophobicContact CG2-CG 4.25Å; I570-L574 WeakPolarHBondContact O-CB 3.5Å; I570-L574 VanDerWaalsContact O-CG 3.25Å; I570-L574 WeakPolarHBondContact O-CG 3.48Å; I570-L574 PolarHBondContact O-N 2.91Å; L571-L574 PolarHBondContact O-N 3.5Å; L574-R578 PolarHBondContact O-N 3.34Å
575	R	69.3	Low	70.1	Confident	205 Å²	205	118.7 Å²	118.7	77%	0.774	56%	0.559	S	S	*	*	H	α-helix	trans	-61.8	-53.9	175.8	-96.8	-176.4	171.5	179.4	-0.7	114.9	L571 I573 L577 R578 Y579	L571-R575 PolarHBondContact O-N 3.18Å; I573-R575 PolarHBondContact O-N 3.49Å; R575-L577 VanDerWaalsContact C-N 3.28Å; R575-L577 PolarHBondContact O-N 3.05Å; R575-R578 PolarHBondContact O-N 2.93Å; R575-Y579 PolarHBondContact O-N 3.4Å
576	P	62.1	Low	67.9	Low	64 Å²	64	124.7 Å²	124.7	42%	0.416	57%	0.574	S	S	.	*	H	α-helix	trans	-67.9	-28.4	176.3	25.1	-30.7	0	0	0	111.4	E572 I573 Y579 W580	E572-P576 WeakPolarHBondContact O-CD 3.24Å; E572-P576 VanDerWaalsContact O-CG 3.25Å; E572-P576 WeakPolarHBondContact O-CG 3.38Å; I573-P576 VanDerWaalsContact O-CD 3.27Å; I573-P576 WeakPolarHBondContact O-CD 3.4Å; I573-P576 WeakPolarHBondContact O-CG 3.46Å; P576-Y579 PolarHBondContact O-N 3.36Å; P576-W580 VanDerWaalsContact O-CB 3.23Å; P576-W580 WeakPolarHBondContact O-CB 3.2Å; P576-W580 PolarHBondContact O-N 3.28Å
577	L	53.7	Low	65.4	Low	106 Å²	106	123.9 Å²	123.9	56%	0.555	58%	0.576	S	S	*	*	H	α-helix	trans	-62.7	-40.6	169.6	-97.9	149.9	0	0	0	112.1	I573 R575 R581	I573-L577 HydrophobicContact CG2-CD1 3.95Å; I573-L577 PolarHBondContact O-N 3.41Å; R575-L577 VanDerWaalsContact C-N 3.28Å; R575-L577 PolarHBondContact O-N 3.05Å; L577-R581 WeakPolarHBondContact O-CB 3.35Å; L577-R581 PolarHBondContact O-N 2.99Å
578	R	52	Low	63.3	Low	199 Å²	199	126.9 Å²	126.9	75%	0.751	58%	0.583	S	S	*	*	H	α-helix	trans	-70.1	-37.2	173.7	-127.7	175.3	-173.6	170.9	1.7	112.5	L574 R575 N582	L574-R578 PolarHBondContact O-N 3.34Å; R575-R578 PolarHBondContact O-N 2.93Å; R578-N582 WeakPolarHBondContact O-CB 3.47Å; R578-N582 PolarHBondContact O-N 3.06Å
579	Y	51.2	Low	61.3	Low	166 Å²	166	129.2 Å²	129.2	65%	0.651	59%	0.589	S	S	*	*	H	α-helix	trans	-68.8	-41.8	176	-164.5	-96.6	0	0	0	112.1	R575 P576 N582 C583	R575-Y579 PolarHBondContact O-N 3.4Å; P576-Y579 PolarHBondContact O-N 3.36Å; Y579-N582 PolarHBondContact O-N 3.39Å; Y579-C583 WeakPolarHBondContact O-CB 3.4Å; Y579-C583 PolarHBondContact O-N 3.33Å
580	W	48.2	Very low	58.9	Low	190 Å²	190	127.4 Å²	127.4	72%	0.72	59%	0.591	S	S	*	*	H	α-helix	trans	-70.9	-34.3	173.8	-88.5	65.1	0	0	0	112.4	P576 C583 K584	P576-W580 VanDerWaalsContact O-CB 3.23Å; P576-W580 WeakPolarHBondContact O-CB 3.2Å; P576-W580 PolarHBondContact O-N 3.28Å; W580-C583 PolarHBondContact O-N 3.13Å; W580-K584 VanDerWaalsContact O-CB 3.3Å; W580-K584 WeakPolarHBondContact O-CB 3.49Å; W580-K584 PolarHBondContact O-N 2.94Å
581	R	50.3	Low	56.6	Low	191 Å²	191	132.8 Å²	132.8	72%	0.721	61%	0.607	S	S	*	*	H	α-helix	trans	-66.3	-37.9	173.2	-147.8	170.2	172.7	177.8	-4.7	111.3	L577 K584 I585	L577-R581 WeakPolarHBondContact O-CB 3.35Å; L577-R581 PolarHBondContact O-N 2.99Å; R581-K584 PolarHBondContact O-N 2.87Å; R581-I585 WeakPolarHBondContact O-CD1 3.32Å; R581-I585 WeakPolarHBondContact O-CG1 3.48Å; R581-I585 PolarHBondContact O-N 2.93Å
582	N	51	Low	54.8	Low	104 Å²	104	130.5 Å²	130.5	56%	0.556	60%	0.603	S	S	*	*	H	α-helix	trans	-72.8	-32.3	173	-76	-7	0	0	0	113.5	R578 Y579 K586	R578-N582 WeakPolarHBondContact O-CB 3.47Å; R578-N582 PolarHBondContact O-N 3.06Å; Y579-N582 PolarHBondContact O-N 3.39Å; N582-K586 PolarHBondContact O-N 3.44Å
583	C	45.9	Very low	52.7	Low	64 Å²	64	131.1 Å²	131.1	43%	0.432	60%	0.604	S	S	.	*	H	α-helix	trans	-72.1	-34	170.6	-84.4	0	0	0	0	112.6	Y579 W580 K586 C587	Y579-C583 WeakPolarHBondContact O-CB 3.4Å; Y579-C583 PolarHBondContact O-N 3.33Å; W580-C583 PolarHBondContact O-N 3.13Å; C583-K586 PolarHBondContact O-N 3.29Å; C583-C587 WeakPolarHBondContact O-CB 3.21Å; C583-C587 PolarHBondContact O-N 3.1Å
584	K	45.4	Very low	50.5	Low	150 Å²	150	133.8 Å²	133.8	65%	0.652	62%	0.619	S	S	*	*	H	α-helix	trans	-68.4	-39.3	174.8	-139.6	176.3	-174.6	-175.7	0	111.1	W580 R581 C587 E588	W580-K584 VanDerWaalsContact O-CB 3.3Å; W580-K584 WeakPolarHBondContact O-CB 3.49Å; W580-K584 PolarHBondContact O-N 2.94Å; R581-K584 PolarHBondContact O-N 2.87Å; K584-C587 PolarHBondContact O-N 3.45Å; K584-E588 PolarHBondContact O-N 3.18Å
585	I	51.3	Low	48.7	Very low	86 Å²	86	137.3 Å²	137.3	44%	0.441	63%	0.63	S	S	.	*	H	α-helix	trans	-63.7	-41.3	171.4	-66	162.5	0	0	0	110.7	R581 Y589	R581-I585 WeakPolarHBondContact O-CD1 3.32Å; R581-I585 WeakPolarHBondContact O-CG1 3.48Å; R581-I585 PolarHBondContact O-N 2.93Å; I585-Y589 HydrophobicContact CG2-CD2 4.43Å; I585-Y589 HydrophobicContact CG2-CE2 4.39Å; I585-Y589 WeakPolarHBondContact O-CD2 3.2Å; I585-Y589 PolarHBondContact O-N 3.32Å
586	K	44.2	Very low	47.6	Very low	168 Å²	168	134.4 Å²	134.4	73%	0.73	63%	0.629	S	S	*	*	H	α-helix	trans	-69	-29.6	173.8	-91.1	-176.8	174.1	-179.1	0	114.3	N582 C583 C590	N582-K586 PolarHBondContact O-N 3.44Å; C583-K586 PolarHBondContact O-N 3.29Å; K586-C590 PolarHBondContact O-N 2.96Å
587	C	41.1	Very low	46.8	Very low	90 Å²	90	139.6 Å²	139.6	61%	0.608	65%	0.646	S	S	*	*	H	α-helix	trans	-77.2	-34.7	176.6	-114.2	0	0	0	0	112.8	C583 K584 Y589 C590 Y591	C583-C587 WeakPolarHBondContact O-CB 3.21Å; C583-C587 PolarHBondContact O-N 3.1Å; K584-C587 PolarHBondContact O-N 3.45Å; C587-Y589 VanDerWaalsContact C-N 3.29Å; C587-Y589 PolarHBondContact O-N 3.38Å; C587-C590 PolarHBondContact O-N 3.32Å; C587-Y591 PolarHBondContact O-N 3.44Å; C587-Y591 VanDerWaalsContact O-N 3.12Å
588	E	46.6	Very low	46.4	Very low	135 Å²	135	138.7 Å²	138.7	63%	0.631	65%	0.654	S	S	*	*	H	α-helix	trans	-65.2	-32.2	172.9	-83.3	180	160.4	0	0	112.3	K584 Y591 A592	K584-E588 PolarHBondContact O-N 3.18Å; E588-Y591 PolarHBondContact O-N 3Å; E588-A592 WeakPolarHBondContact O-CB 3.33Å; E588-A592 PolarHBondContact O-N 3.03Å; E588-A592 VanDerWaalsContact O-N 3.07Å
589	Y	47.3	Very low	45.7	Very low	178 Å²	178	142.1 Å²	142.1	70%	0.698	67%	0.674	S	S	*	*	H	α-helix	trans	-68.1	-33.1	171.8	-89.3	-79.8	0	0	0	113.5	I585 C587 F593	I585-Y589 HydrophobicContact CG2-CD2 4.43Å; I585-Y589 HydrophobicContact CG2-CE2 4.39Å; I585-Y589 WeakPolarHBondContact O-CD2 3.2Å; I585-Y589 PolarHBondContact O-N 3.32Å; C587-Y589 VanDerWaalsContact C-N 3.29Å; C587-Y589 PolarHBondContact O-N 3.38Å; Y589-F593 PolarHBondContact O-N 3.06Å
590	C	40.7	Very low	45.4	Very low	85 Å²	85	140.9 Å²	140.9	57%	0.574	68%	0.675	S	S	*	*	H	α-helix	trans	-73.2	-35.1	174.7	-92.7	0	0	0	0	113.1	K586 C587 F593 L594	K586-C590 PolarHBondContact O-N 2.96Å; C587-C590 PolarHBondContact O-N 3.32Å; C590-F593 PolarHBondContact O-N 3.2Å; C590-L594 PolarHBondContact O-N 3.32Å
591	Y	41.9	Very low	45.3	Very low	191 Å²	191	138.3 Å²	138.3	75%	0.749	67%	0.673	S	S	*	*	H	α-helix	trans	-74.5	-29.2	177.4	-147.6	-94.3	0	0	0	112.2	C587 E588	C587-Y591 PolarHBondContact O-N 3.44Å; C587-Y591 VanDerWaalsContact O-N 3.12Å; E588-Y591 PolarHBondContact O-N 3Å
592	A	50.1	Low	45	Very low	55 Å²	55	135.4 Å²	135.4	46%	0.455	67%	0.67	S	S	.	*	H	α-helix	trans	-73.3	-31.2	172	0	0	0	0	0	113	E588	E588-A592 WeakPolarHBondContact O-CB 3.33Å; E588-A592 PolarHBondContact O-N 3.03Å; E588-A592 VanDerWaalsContact O-N 3.07Å
593	F	44.2	Very low	44.7	Very low	151 Å²	151	137.2 Å²	137.2	66%	0.662	68%	0.677	S	S	*	*	H	α-helix	trans	-72.9	-34.6	179.1	-152.2	-93.4	0	0	0	113	Y589 C590 F597	Y589-F593 PolarHBondContact O-N 3.06Å; C590-F593 PolarHBondContact O-N 3.2Å; F593-F597 HydrophobicContact CE1-CE2 4.36Å
594	L	42.2	Very low	44.6	Very low	135 Å²	135	141.8 Å²	141.8	71%	0.707	69%	0.692	S	S	*	*	H	α-helix	trans	-74.7	-21.3	177.5	-88.6	156.7	0	0	0	114	C590 N596	C590-L594 PolarHBondContact O-N 3.32Å; L594-N596 VanDerWaalsContact C-N 3.35Å
595	K	43.7	Very low	44.5	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-13.9	177.8	-146.3	176.6	-175.2	-179.5	0	113.6
596	N	47.2	Very low	44	Very low	143 Å²	143	145.2 Å²	145.2	77%	0.765	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-2	176.9	-83.7	-17.8	0	0	0	114.3	L594	L594-N596 VanDerWaalsContact C-N 3.35Å
597	F	44.7	Very low	44	Very low	174 Å²	174	143.5 Å²	143.5	76%	0.763	71%	0.711	S	S	*	*	S	Bend	trans	-101.2	2.5	176.2	-107.1	-82.2	0	0	0	114.3	F593	F593-F597 HydrophobicContact CE1-CE2 4.36Å
598	A	45.4	Very low	44.3	Very low	87 Å²	87	147.9 Å²	147.9	72%	0.719	72%	0.72	S	S	*	*			trans	-118.1	52.5	176.8	0	0	0	0	0	111.5
599	K	37.6	Very low	44.1	Very low	270 Å²	270	149.1 Å²	149.1	100%	1.174	73%	0.728	S	S	*	*			trans	-142.7	0	163.5	-123.2	-175.3	-175.8	-176	0	110.5

Retrieved 599 of 599 residues in 737.9 ms (Link to these results)

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