A0A096NPH6_PAPAN Loading...

Hydroxysteroid 17-beta dehydrogenase 2

AlphaFold DB , UniProt , Accession A0A096NPH6, Species PAPAN (Papio anubis, Olive baboon), Gene HSD17B2, Length 387 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	42.8	Very low	48.1	Very low	245 Å²	245	128.5 Å²	128.5	100%	1.207	66%	0.662	S	S	*	*				0	101.9	0	-119.7	169.4	-179.9	0	0	106.8	T3	M1-T3 PolarHBondContact O-N 3.49Å
2	S	37.8	Very low	48.5	Very low	99 Å²	99	121 Å²	121	69%	0.692	63%	0.628	S	S	*	*			trans	-69.6	123	-164.8	48.5	0	0	0	0	112.7	F4	S2-F4 PolarHBondContact O-N 3.29Å
3	T	44.9	Very low	49	Very low	136 Å²	136	118.3 Å²	118.3	83%	0.834	62%	0.615	S	S	*	*			trans	-67.8	78.6	163.1	47.7	0	0	0	0	109.9	M1 F5	M1-T3 PolarHBondContact O-N 3.49Å; T3-F5 VanDerWaalsContact C-N 3.28Å; T3-F5 PolarHBondContact O-N 2.96Å
4	F	40	Very low	49.6	Very low	179 Å²	179	113.6 Å²	113.6	79%	0.785	60%	0.602	S	S	*	*			trans	-86.9	72.2	164.3	-100.7	-87.5	0	0	0	108.4	S2 S6	S2-F4 PolarHBondContact O-N 3.29Å; F4-S6 PolarHBondContact O-N 3.45Å
5	F	46.3	Very low	50.3	Low	160 Å²	160	110.7 Å²	110.7	70%	0.702	59%	0.59	S	S	*	*			trans	-75.9	92.6	147.5	-91	-87	0	0	0	104.4	T3 T9	T3-F5 VanDerWaalsContact C-N 3.28Å; T3-F5 PolarHBondContact O-N 2.96Å; F5-T9 HydrophobicContact CD1-CG2 4.49Å
6	S	52.6	Low	50.9	Low	44 Å²	44	104.1 Å²	104.1	31%	0.308	56%	0.555	S	S	.	*			trans	-61.3	149.6	-177.4	62.3	0	0	0	0	110.1	F4 T8 T9	F4-S6 PolarHBondContact O-N 3.45Å; S6-T8 VanDerWaalsContact CB-OG1 3.29Å; S6-T8 WeakPolarHBondContact CB-OG1 3.29Å; S6-T8 PolarHBondContact O-N 3.4Å; S6-T8 PolarHBondContact OG-OG1 2.95Å; S6-T9 PolarHBondContact O-N 3.44Å; S6-T9 PolarHBondContact O-OG1 2.63Å
7	D	52.5	Low	51.5	Low	132 Å²	132	103.7 Å²	103.7	71%	0.706	56%	0.558	S	S	*	*	H	α-helix	trans	-53.5	-23.8	176.6	-63.7	-43.2	0	0	0	112.5	T9 W10 I11	D7-T9 PolarHBondContact O-N 3.13Å; D7-W10 PolarHBondContact O-N 2.91Å; D7-I11 VanDerWaalsContact O-CG1 3.31Å; D7-I11 WeakPolarHBondContact O-CG1 3.5Å; D7-I11 PolarHBondContact O-N 2.83Å; D7-I11 VanDerWaalsContact O-N 3.13Å
8	T	52.9	Low	52.2	Low	86 Å²	86	103.2 Å²	103.2	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-59.7	-34.4	170.7	17.7	0	0	0	0	114.2	S6 I11 C12	S6-T8 VanDerWaalsContact CB-OG1 3.29Å; S6-T8 WeakPolarHBondContact CB-OG1 3.29Å; S6-T8 PolarHBondContact O-N 3.4Å; S6-T8 PolarHBondContact OG-OG1 2.95Å; T8-I11 PolarHBondContact O-N 3.22Å; T8-C12 VanDerWaalsContact O-CB 3.28Å; T8-C12 WeakPolarHBondContact O-CB 3.38Å; T8-C12 PolarHBondContact O-N 2.89Å; T8-C12 PolarHBondContact O-SG 3.13Å
9	T	53.2	Low	52.6	Low	52 Å²	52	99.5 Å²	99.5	32%	0.319	54%	0.538	S	S	.	.	H	α-helix	trans	-70.4	-36.3	179.5	-15.6	0	0	0	0	111.9	F5 S6 D7 C12 L13	F5-T9 HydrophobicContact CD1-CG2 4.49Å; S6-T9 PolarHBondContact O-N 3.44Å; S6-T9 PolarHBondContact O-OG1 2.63Å; D7-T9 PolarHBondContact O-N 3.13Å; T9-C12 PolarHBondContact O-N 3.08Å; T9-L13 WeakPolarHBondContact O-CG 3.28Å; T9-L13 PolarHBondContact O-N 3.28Å; T9-L13 VanDerWaalsContact O-N 3.17Å
10	W	50.9	Low	52.9	Low	178 Å²	178	96.8 Å²	96.8	67%	0.674	53%	0.526	S	S	*	.	H	α-helix	trans	-70.3	-39.7	174.7	-73.1	105.8	0	0	0	111.9	D7 C12 L13 A14	D7-W10 PolarHBondContact O-N 2.91Å; W10-C12 VanDerWaalsContact C-N 3.34Å; W10-L13 PolarHBondContact O-N 3.4Å; W10-A14 WeakPolarHBondContact O-CB 3.36Å; W10-A14 PolarHBondContact O-N 2.94Å
11	I	55.2	Low	53.1	Low	102 Å²	102	93.8 Å²	93.8	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-42.3	172.3	-65.8	166.4	0	0	0	110.6	D7 T8 L13 A14 V15	D7-I11 VanDerWaalsContact O-CG1 3.31Å; D7-I11 WeakPolarHBondContact O-CG1 3.5Å; D7-I11 PolarHBondContact O-N 2.83Å; D7-I11 VanDerWaalsContact O-N 3.13Å; T8-I11 PolarHBondContact O-N 3.22Å; I11-L13 VanDerWaalsContact C-N 3.27Å; I11-L13 PolarHBondContact O-N 3.45Å; I11-A14 PolarHBondContact O-N 3.49Å; I11-V15 HydrophobicContact CG2-CG2 4.46Å; I11-V15 WeakPolarHBondContact O-CG2 3.49Å; I11-V15 PolarHBondContact O-N 2.81Å
12	C	52.4	Low	54	Low	39 Å²	39	84.8 Å²	84.8	26%	0.264	48%	0.477	S	S	.	.	H	α-helix	trans	-66.8	-20.9	178.1	-74.8	0	0	0	0	114.2	T8 T9 W10 P16 L58	T8-C12 VanDerWaalsContact O-CB 3.28Å; T8-C12 WeakPolarHBondContact O-CB 3.38Å; T8-C12 PolarHBondContact O-N 2.89Å; T8-C12 PolarHBondContact O-SG 3.13Å; T9-C12 PolarHBondContact O-N 3.08Å; W10-C12 VanDerWaalsContact C-N 3.34Å; C12-P16 WeakPolarHBondContact O-CD 3.46Å; C12-P16 WeakPolarHBondContact O-CG 3.13Å; C12-L58 HydrophobicContact CB-CD1 4.22Å
13	L	55.4	Low	55	Low	86 Å²	86	80.7 Å²	80.7	45%	0.45	45%	0.448	S	S	.	.	H	α-helix	trans	-93	-36.2	173.7	-72.8	168.4	0	0	0	112.3	T9 W10 I11 T17 L58	T9-L13 WeakPolarHBondContact O-CG 3.28Å; T9-L13 PolarHBondContact O-N 3.28Å; T9-L13 VanDerWaalsContact O-N 3.17Å; W10-L13 PolarHBondContact O-N 3.4Å; I11-L13 VanDerWaalsContact C-N 3.27Å; I11-L13 PolarHBondContact O-N 3.45Å; L13-T17 WeakPolarHBondContact O-CB 3.31Å; L13-T17 PolarHBondContact O-N 3.44Å; L13-T17 PolarHBondContact O-OG1 3.43Å; L13-L58 HydrophobicContact CD2-CD2 4.32Å
14	A	58	Low	55.5	Low	53 Å²	53	80.3 Å²	80.3	44%	0.438	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-42.9	-178.3	0	0	0	0	0	112.4	W10 I11 T17 V18	W10-A14 WeakPolarHBondContact O-CB 3.36Å; W10-A14 PolarHBondContact O-N 2.94Å; I11-A14 PolarHBondContact O-N 3.49Å; A14-T17 PolarHBondContact O-N 2.84Å; A14-V18 WeakPolarHBondContact O-CG2 3.38Å; A14-V18 PolarHBondContact O-N 3.41Å
15	V	60.1	Low	56.2	Low	69 Å²	69	76.3 Å²	76.3	42%	0.418	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-53.4	-178.8	173.2	0	0	0	0	112.6	I11 T17 V18 L19	I11-V15 HydrophobicContact CG2-CG2 4.46Å; I11-V15 WeakPolarHBondContact O-CG2 3.49Å; I11-V15 PolarHBondContact O-N 2.81Å; V15-T17 VanDerWaalsContact C-N 3.31Å; V15-T17 PolarHBondContact O-N 3.21Å; V15-V18 PolarHBondContact O-N 2.97Å; V15-L19 HydrophobicContact CG1-CD1 3.78Å; V15-L19 HydrophobicContact CG1-CG 4.46Å; V15-L19 WeakPolarHBondContact O-CB 3.36Å; V15-L19 WeakPolarHBondContact O-CG 3.42Å; V15-L19 PolarHBondContact O-N 3.3Å
16	P	59.3	Low	56.6	Low	6 Å²	6	72.7 Å²	72.7	4%	0.039	41%	0.412	C	S	.	.	H	α-helix	trans	-64.7	-32.4	176.7	15.4	-23.9	0	0	0	113.1	C12 L19 C20 L58 F61	C12-P16 WeakPolarHBondContact O-CD 3.46Å; C12-P16 WeakPolarHBondContact O-CG 3.13Å; P16-L19 PolarHBondContact O-N 3.46Å; P16-C20 WeakPolarHBondContact O-CB 3.35Å; P16-C20 PolarHBondContact O-N 3.04Å; P16-C20 PolarHBondContact O-SG 2.67Å; P16-L58 HydrophobicContact CG-CD2 4.37Å; P16-F61 HydrophobicContact CB-CD1 3.56Å; P16-F61 HydrophobicContact CB-CE1 3.65Å; P16-F61 HydrophobicContact CG-CD1 4.4Å
17	T	61.3	Low	56.8	Low	97 Å²	97	73.5 Å²	73.5	60%	0.595	41%	0.409	S	S	*	.	H	α-helix	trans	-66.3	-41.2	177.1	-48.7	0	0	0	0	111.7	L13 A14 V15 G21	L13-T17 WeakPolarHBondContact O-CB 3.31Å; L13-T17 PolarHBondContact O-N 3.44Å; L13-T17 PolarHBondContact O-OG1 3.43Å; A14-T17 PolarHBondContact O-N 2.84Å; V15-T17 VanDerWaalsContact C-N 3.31Å; V15-T17 PolarHBondContact O-N 3.21Å; T17-G21 PolarHBondContact O-N 3.33Å
18	V	63.8	Low	56.7	Low	95 Å²	95	76.3 Å²	76.3	58%	0.576	42%	0.415	S	S	*	.	H	α-helix	trans	-69.9	-41.3	175.3	173.5	0	0	0	0	111.4	A14 V15 G21 T22	A14-V18 WeakPolarHBondContact O-CG2 3.38Å; A14-V18 PolarHBondContact O-N 3.41Å; V15-V18 PolarHBondContact O-N 2.97Å; V18-G21 PolarHBondContact O-N 3.4Å; V18-T22 HydrophobicContact CG1-CG2 4.43Å; V18-T22 WeakPolarHBondContact O-CB 3.46Å; V18-T22 VanDerWaalsContact O-CG2 3.3Å; V18-T22 WeakPolarHBondContact O-CG2 3.35Å; V18-T22 PolarHBondContact O-N 3.31Å; V18-T22 PolarHBondContact O-OG1 3.44Å
19	L	59.5	Low	56.5	Low	33 Å²	33	81 Å²	81	17%	0.173	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-43.5	176	-72.7	169.9	0	0	0	111.6	V15 P16 T22 V23 C65	V15-L19 HydrophobicContact CG1-CD1 3.78Å; V15-L19 HydrophobicContact CG1-CG 4.46Å; V15-L19 WeakPolarHBondContact O-CB 3.36Å; V15-L19 WeakPolarHBondContact O-CG 3.42Å; V15-L19 PolarHBondContact O-N 3.3Å; P16-L19 PolarHBondContact O-N 3.46Å; L19-T22 WeakPolarHBondContact CA-OG1 3.41Å; L19-T22 PolarHBondContact O-N 2.96Å; L19-T22 PolarHBondContact O-OG1 2.93Å; L19-V23 VanDerWaalsContact O-CB 3.32Å; L19-V23 WeakPolarHBondContact O-CB 3.08Å; L19-V23 WeakPolarHBondContact O-CG2 3.33Å; L19-V23 PolarHBondContact O-N 3.35Å; L19-C65 HydrophobicContact CB-CB 3.9Å; L19-C65 HydrophobicContact CD1-CB 4.4Å
20	C	58.5	Low	56	Low	44 Å²	44	80.6 Å²	80.6	30%	0.297	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-45.6	173.8	-79.6	0	0	0	0	112.3	P16 T22 V23 F24 F61	P16-C20 WeakPolarHBondContact O-CB 3.35Å; P16-C20 PolarHBondContact O-N 3.04Å; P16-C20 PolarHBondContact O-SG 2.67Å; C20-T22 PolarHBondContact O-N 3.42Å; C20-V23 PolarHBondContact O-N 3.4Å; C20-F24 WeakPolarHBondContact O-CB 3.47Å; C20-F24 PolarHBondContact O-N 3.22Å; C20-F61 WeakPolarHBondContact SG-CZ 3.21Å
21	G	58.7	Low	55.8	Low	34 Å²	34	77.2 Å²	77.2	35%	0.351	43%	0.431	S	S	.	.	H	α-helix	trans	-61.7	-41.6	177.5	0	0	0	0	0	112.6	T17 V18 F24 C25	T17-G21 PolarHBondContact O-N 3.33Å; V18-G21 PolarHBondContact O-N 3.4Å; G21-F24 PolarHBondContact O-N 3.39Å; G21-C25 WeakPolarHBondContact O-CB 3.49Å; G21-C25 PolarHBondContact O-N 2.99Å; G21-C25 PolarHBondContact O-SG 3.32Å; G21-C25 VanDerWaalsContact O-SG 3.32Å
22	T	60	Low	55.5	Low	57 Å²	57	75.9 Å²	75.9	35%	0.35	44%	0.442	S	S	.	.	H	α-helix	trans	-72	-37.5	178.6	52.5	0	0	0	0	113	V18 L19 C20 K26	V18-T22 HydrophobicContact CG1-CG2 4.43Å; V18-T22 WeakPolarHBondContact O-CB 3.46Å; V18-T22 VanDerWaalsContact O-CG2 3.3Å; V18-T22 WeakPolarHBondContact O-CG2 3.35Å; V18-T22 PolarHBondContact O-N 3.31Å; V18-T22 PolarHBondContact O-OG1 3.44Å; L19-T22 WeakPolarHBondContact CA-OG1 3.41Å; L19-T22 PolarHBondContact O-N 2.96Å; L19-T22 PolarHBondContact O-OG1 2.93Å; C20-T22 PolarHBondContact O-N 3.42Å; T22-K26 PolarHBondContact O-N 2.94Å; T22-K26 VanDerWaalsContact O-N 3.08Å
23	V	58.6	Low	55.2	Low	13 Å²	13	82.2 Å²	82.2	8%	0.079	47%	0.467	C	S	.	.	H	α-helix	trans	-62	-45	170.5	164.8	0	0	0	0	110.7	L19 C20 K26 Y27 M68 Y69 L72	L19-V23 VanDerWaalsContact O-CB 3.32Å; L19-V23 WeakPolarHBondContact O-CB 3.08Å; L19-V23 WeakPolarHBondContact O-CG2 3.33Å; L19-V23 PolarHBondContact O-N 3.35Å; C20-V23 PolarHBondContact O-N 3.4Å; V23-K26 PolarHBondContact O-N 2.66Å; V23-Y27 VanDerWaalsContact O-CB 3.3Å; V23-Y27 WeakPolarHBondContact O-CB 3.4Å; V23-Y27 PolarHBondContact O-N 3.32Å; V23-M68 HydrophobicContact CG1-CG 4.48Å; V23-M68 HydrophobicContact CG1-SD 3.72Å; V23-Y69 HydrophobicContact CG2-CD2 4.28Å; V23-L72 HydrophobicContact CG1-CD1 3.7Å; V23-L72 HydrophobicContact CG2-CD1 4.49Å
24	F	56.3	Low	55.1	Low	128 Å²	128	79.1 Å²	79.1	56%	0.561	45%	0.451	S	S	*	.	H	α-helix	trans	-65.8	-41.1	179.1	-171.4	-98.2	0	0	0	112.9	C20 G21 Y27 K28	C20-F24 WeakPolarHBondContact O-CB 3.47Å; C20-F24 PolarHBondContact O-N 3.22Å; G21-F24 PolarHBondContact O-N 3.39Å; F24-Y27 WeakPolarHBondContact O-CB 3.24Å; F24-Y27 PolarHBondContact O-N 3.39Å; F24-K28 PolarHBondContact O-N 3.29Å
25	C	55.2	Low	54.6	Low	95 Å²	95	83.6 Å²	83.6	64%	0.642	46%	0.457	S	S	*	.	H	α-helix	trans	-65.6	-38	175	-75.1	0	0	0	0	112.6	G21	G21-C25 WeakPolarHBondContact O-CB 3.49Å; G21-C25 PolarHBondContact O-N 2.99Å; G21-C25 PolarHBondContact O-SG 3.32Å; G21-C25 VanDerWaalsContact O-SG 3.32Å
26	K	54.9	Low	54.3	Low	83 Å²	83	85.8 Å²	85.8	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-72	-33.8	173.5	-79.4	-170.3	174.6	-176.2	0	112.6	T22 V23 K28 K29 Y69 S73	T22-K26 PolarHBondContact O-N 2.94Å; T22-K26 VanDerWaalsContact O-N 3.08Å; V23-K26 PolarHBondContact O-N 2.66Å; K26-K28 VanDerWaalsContact C-N 3.34Å; K26-K28 PolarHBondContact O-N 3.27Å; K26-K29 WeakPolarHBondContact O-CB 3.25Å; K26-K29 PolarHBondContact O-N 3.48Å; K26-K29 VanDerWaalsContact O-N 3.09Å; K26-Y69 HydrophobicContact CD-CE2 4.06Å; K26-Y69 PolarHBondContact NZ-OH 2.94Å; K26-S73 PolarHBondContact NZ-OG 3.39Å
27	Y	56.5	Low	54.2	Low	61 Å²	61	93.1 Å²	93.1	24%	0.239	49%	0.493	C	S	.	.	H	α-helix	trans	-58.4	-40.9	176.2	164.3	-97.7	0	0	0	112.8	V23 F24 K29 S30 M38	V23-Y27 VanDerWaalsContact O-CB 3.3Å; V23-Y27 WeakPolarHBondContact O-CB 3.4Å; V23-Y27 PolarHBondContact O-N 3.32Å; F24-Y27 WeakPolarHBondContact O-CB 3.24Å; F24-Y27 PolarHBondContact O-N 3.39Å; Y27-K29 PolarHBondContact O-N 3.17Å; Y27-S30 PolarHBondContact O-N 3.43Å; Y27-M38 HydrophobicContact CD1-SD 4.49Å; Y27-M38 HydrophobicContact CD2-SD 3.77Å; Y27-M38 HydrophobicContact CE2-SD 3.85Å; Y27-M38 HydrophobicContact CG-SD 4.1Å
28	K	49.8	Very low	54	Low	192 Å²	192	91 Å²	91	84%	0.835	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.5	176.7	-166.6	174.5	179.7	178.6	0	113.3	F24 K26	F24-K28 PolarHBondContact O-N 3.29Å; K26-K28 VanDerWaalsContact C-N 3.34Å; K26-K28 PolarHBondContact O-N 3.27Å
29	K	48	Very low	54	Low	184 Å²	184	90.2 Å²	90.2	80%	0.8	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-8.4	-179	-150.8	176.7	-179.8	-174.4	0	114.3	K26 Y27	K26-K29 WeakPolarHBondContact O-CB 3.25Å; K26-K29 PolarHBondContact O-N 3.48Å; K26-K29 VanDerWaalsContact O-N 3.09Å; Y27-K29 PolarHBondContact O-N 3.17Å
30	S	44.1	Very low	54	Low	44 Å²	44	92.5 Å²	92.5	31%	0.308	49%	0.49	S	S	.	.	S	Bend	trans	-119.7	132.9	-173.5	-170.1	0	0	0	0	112.1	Y27 L34	Y27-S30 PolarHBondContact O-N 3.43Å; S30-L34 WeakPolarHBondContact OG-CD1 3.47Å
31	S	46.9	Very low	54.4	Low	107 Å²	107	92.2 Å²	92.2	75%	0.748	49%	0.486	S	S	*	.			trans	-73.1	134.9	-170.3	43.8	0	0	0	0	115.1	Q33	S31-Q33 VanDerWaalsContact C-N 3.35Å; S31-Q33 PolarHBondContact O-N 2.88Å
32	G	47.7	Very low	54.7	Low	73 Å²	73	93.5 Å²	93.5	75%	0.753	49%	0.493	S	S	*	.	S	Bend	trans	55.4	-53.3	146.1	0	0	0	0	0	121.6	L34	G32-L34 VanDerWaalsContact C-N 3.3Å; G32-L34 PolarHBondContact O-N 3.44Å
33	Q	46.1	Very low	55.1	Low	172 Å²	172	92.4 Å²	92.4	80%	0.804	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-3.7	-163	-153.3	164.3	5.3	0	0	114	S31	S31-Q33 VanDerWaalsContact C-N 3.35Å; S31-Q33 PolarHBondContact O-N 2.88Å
34	L	52.7	Low	55.4	Low	22 Å²	22	96.7 Å²	96.7	12%	0.115	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-7.6	-173.7	-69.7	160.7	0	0	0	114.3	S30 G32 N36 W37 M38 Y71 L72	S30-L34 WeakPolarHBondContact OG-CD1 3.47Å; G32-L34 VanDerWaalsContact C-N 3.3Å; G32-L34 PolarHBondContact O-N 3.44Å; L34-N36 PolarHBondContact O-N 3.31Å; L34-W37 PolarHBondContact O-N 3.32Å; L34-M38 PolarHBondContact O-N 3.5Å; L34-Y71 HydrophobicContact CD2-CE1 4.4Å; L34-L72 HydrophobicContact CD1-CD2 3.51Å; L34-L72 HydrophobicContact CD2-CD2 3.82Å; L34-L72 HydrophobicContact CG-CD2 4.25Å
35	W	49.6	Very low	55.8	Low	147 Å²	147	91.1 Å²	91.1	56%	0.557	49%	0.492	S	S	*	.	H	α-helix	trans	-59.9	-43.9	177.7	-178.3	-106.4	0	0	0	112.3	W37 M38 V39	W35-W37 VanDerWaalsContact C-N 3.27Å; W35-W37 PolarHBondContact O-N 3.02Å; W35-M38 PolarHBondContact O-N 3.31Å; W35-V39 WeakPolarHBondContact O-CG2 3.21Å; W35-V39 PolarHBondContact O-N 3.02Å
36	N	53	Low	56.3	Low	114 Å²	114	89 Å²	89	61%	0.61	48%	0.481	S	S	*	.	H	α-helix	trans	-62	-35.9	178.8	-67.5	-7.4	0	0	0	112	L34 V39 C40	L34-N36 PolarHBondContact O-N 3.31Å; N36-V39 PolarHBondContact O-N 2.97Å; N36-C40 WeakPolarHBondContact O-CB 3.38Å; N36-C40 PolarHBondContact O-N 3.15Å; N36-C40 PolarHBondContact O-SG 2.9Å
37	W	56.2	Low	56.8	Low	160 Å²	160	88.8 Å²	88.8	61%	0.606	49%	0.487	S	S	*	.	H	α-helix	trans	-71.8	-33.7	178.3	-68.4	98.4	0	0	0	112.6	L34 W35 C40 L41 M68	L34-W37 PolarHBondContact O-N 3.32Å; W35-W37 VanDerWaalsContact C-N 3.27Å; W35-W37 PolarHBondContact O-N 3.02Å; W37-C40 PolarHBondContact O-N 3.29Å; W37-L41 WeakPolarHBondContact O-CB 3.33Å; W37-L41 PolarHBondContact O-N 2.99Å; W37-M68 HydrophobicContact CB-CE 4.22Å
38	M	58	Low	57.1	Low	52 Å²	52	86.7 Å²	86.7	26%	0.256	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-41.4	172	-77.5	-177.3	50.3	0	0	112.3	Y27 L34 W35 C40 L41 A42 M68	Y27-M38 HydrophobicContact CD1-SD 4.49Å; Y27-M38 HydrophobicContact CD2-SD 3.77Å; Y27-M38 HydrophobicContact CE2-SD 3.85Å; Y27-M38 HydrophobicContact CG-SD 4.1Å; L34-M38 PolarHBondContact O-N 3.5Å; W35-M38 PolarHBondContact O-N 3.31Å; M38-C40 VanDerWaalsContact C-N 3.32Å; M38-L41 PolarHBondContact O-N 3.2Å; M38-A42 VanDerWaalsContact O-CB 3.29Å; M38-A42 WeakPolarHBondContact O-CB 3.29Å; M38-A42 PolarHBondContact O-N 3.05Å; M38-M68 HydrophobicContact CG-CE 4.05Å
39	V	63.1	Low	57.8	Low	80 Å²	80	82 Å²	82	49%	0.485	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-41.7	174.3	175.8	0	0	0	0	110.4	W35 N36 G43	W35-V39 WeakPolarHBondContact O-CG2 3.21Å; W35-V39 PolarHBondContact O-N 3.02Å; N36-V39 PolarHBondContact O-N 2.97Å; V39-G43 PolarHBondContact O-N 3.12Å
40	C	60.8	Low	58.6	Low	80 Å²	80	80.4 Å²	80.4	54%	0.541	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-43	173.5	-70.5	0	0	0	0	112.5	N36 W37 M38 G43 L44	N36-C40 WeakPolarHBondContact O-CB 3.38Å; N36-C40 PolarHBondContact O-N 3.15Å; N36-C40 PolarHBondContact O-SG 2.9Å; W37-C40 PolarHBondContact O-N 3.29Å; M38-C40 VanDerWaalsContact C-N 3.32Å; C40-G43 PolarHBondContact O-N 2.55Å; C40-L44 VanDerWaalsContact O-CB 3.32Å; C40-L44 WeakPolarHBondContact O-CB 3.29Å; C40-L44 PolarHBondContact O-N 3.12Å
41	L	65.6	Low	59.7	Low	38 Å²	38	84.6 Å²	84.6	20%	0.199	48%	0.482	C	S	.	.	H	α-helix	trans	-65.5	-43.8	179	-150.3	88.9	0	0	0	111	W37 M38 L44 C45 M68	W37-L41 WeakPolarHBondContact O-CB 3.33Å; W37-L41 PolarHBondContact O-N 2.99Å; M38-L41 PolarHBondContact O-N 3.2Å; L41-L44 PolarHBondContact O-N 3.08Å; L41-C45 WeakPolarHBondContact O-CB 3.34Å; L41-C45 PolarHBondContact O-N 3.42Å; L41-C45 PolarHBondContact O-SG 3.15Å; L41-M68 HydrophobicContact CB-CE 4.14Å; L41-M68 HydrophobicContact CD1-CE 4.29Å; L41-M68 HydrophobicContact CD2-CE 4.07Å; L41-M68 HydrophobicContact CD2-SD 3.85Å; L41-M68 HydrophobicContact CG-CE 4.41Å
42	A	66.2	Low	60.6	Low	61 Å²	61	83 Å²	83	50%	0.504	46%	0.464	S	S	.	.	H	α-helix	trans	-64	-41.6	176.1	0	0	0	0	0	111.8	M38 C45 A46	M38-A42 VanDerWaalsContact O-CB 3.29Å; M38-A42 WeakPolarHBondContact O-CB 3.29Å; M38-A42 PolarHBondContact O-N 3.05Å; A42-C45 PolarHBondContact O-N 3.08Å; A42-A46 PolarHBondContact O-N 3.15Å
43	G	67.2	Low	62.1	Low	35 Å²	35	82.3 Å²	82.3	36%	0.361	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-44.3	173.7	0	0	0	0	0	112.6	V39 C40 C45 A46 V47	V39-G43 PolarHBondContact O-N 3.12Å; C40-G43 PolarHBondContact O-N 2.55Å; G43-C45 VanDerWaalsContact C-N 3.28Å; G43-C45 PolarHBondContact O-N 3.31Å; G43-A46 PolarHBondContact O-N 3.37Å; G43-V47 VanDerWaalsContact O-CG2 3.31Å; G43-V47 WeakPolarHBondContact O-CG2 3.23Å; G43-V47 PolarHBondContact O-N 2.98Å
44	L	65.1	Low	63.4	Low	102 Å²	102	78.6 Å²	78.6	53%	0.534	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-36.6	177.4	-153.1	120.7	0	0	0	111.2	C40 L41 V47 C48	C40-L44 VanDerWaalsContact O-CB 3.32Å; C40-L44 WeakPolarHBondContact O-CB 3.29Å; C40-L44 PolarHBondContact O-N 3.12Å; L41-L44 PolarHBondContact O-N 3.08Å; L44-V47 PolarHBondContact O-N 2.96Å; L44-C48 WeakPolarHBondContact O-CB 3.01Å; L44-C48 PolarHBondContact O-N 3.4Å; L44-C48 PolarHBondContact O-SG 3.03Å
45	C	64.9	Low	64.5	Low	12 Å²	12	83.2 Å²	83.2	8%	0.081	46%	0.458	C	S	.	.	H	α-helix	trans	-70.6	-39.9	176.1	-65.7	0	0	0	0	113	L41 A42 G43 V47 C48 L49 F61	L41-C45 WeakPolarHBondContact O-CB 3.34Å; L41-C45 PolarHBondContact O-N 3.42Å; L41-C45 PolarHBondContact O-SG 3.15Å; A42-C45 PolarHBondContact O-N 3.08Å; G43-C45 VanDerWaalsContact C-N 3.28Å; G43-C45 PolarHBondContact O-N 3.31Å; C45-V47 VanDerWaalsContact C-N 3.32Å; C45-V47 PolarHBondContact O-N 2.87Å; C45-C48 PolarHBondContact O-N 3.27Å; C45-L49 WeakPolarHBondContact O-CB 3.44Å; C45-L49 VanDerWaalsContact O-CG 3.29Å; C45-L49 WeakPolarHBondContact O-CG 3.44Å; C45-L49 PolarHBondContact O-N 3.09Å; C45-F61 HydrophobicContact CB-CD2 4.07Å; C45-F61 HydrophobicContact CB-CE2 4.34Å; C45-F61 WeakPolarHBondContact SG-CD2 3.46Å; C45-F61 VanDerWaalsContact SG-CE2 3.57Å
46	A	66.2	Low	65.9	Low	49 Å²	49	83.4 Å²	83.4	41%	0.405	46%	0.459	S	S	.	.	H	α-helix	trans	-60.5	-43.9	172.7	0	0	0	0	0	111	A42 G43 L49 L50	A42-A46 PolarHBondContact O-N 3.15Å; G43-A46 PolarHBondContact O-N 3.37Å; A46-L49 PolarHBondContact O-N 3.27Å; A46-L50 WeakPolarHBondContact O-CB 3.4Å; A46-L50 WeakPolarHBondContact O-CD1 3.25Å; A46-L50 WeakPolarHBondContact O-CG 3.35Å; A46-L50 PolarHBondContact O-N 3.22Å; A46-L50 VanDerWaalsContact O-N 3.08Å
47	V	65.9	Low	67	Low	79 Å²	79	78 Å²	78	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-66.5	-43.2	177.4	174	0	0	0	0	111.7	G43 L44 C45 L49 L50 I51	G43-V47 VanDerWaalsContact O-CG2 3.31Å; G43-V47 WeakPolarHBondContact O-CG2 3.23Å; G43-V47 PolarHBondContact O-N 2.98Å; L44-V47 PolarHBondContact O-N 2.96Å; C45-V47 VanDerWaalsContact C-N 3.32Å; C45-V47 PolarHBondContact O-N 2.87Å; V47-L49 PolarHBondContact O-N 2.87Å; V47-L50 PolarHBondContact O-N 3.17Å; V47-I51 HydrophobicContact CG1-CD1 3.64Å; V47-I51 HydrophobicContact CG1-CG1 4.46Å; V47-I51 WeakPolarHBondContact O-CG1 3.44Å; V47-I51 PolarHBondContact O-N 3Å; V47-I51 VanDerWaalsContact O-N 3.09Å
48	C	62.2	Low	68	Low	18 Å²	18	72 Å²	72	12%	0.122	41%	0.41	C	S	.	.	H	α-helix	trans	-64.4	-37.8	177.2	-72.2	0	0	0	0	112.7	L44 C45 L52 L60	L44-C48 WeakPolarHBondContact O-CB 3.01Å; L44-C48 PolarHBondContact O-N 3.4Å; L44-C48 PolarHBondContact O-SG 3.03Å; C45-C48 PolarHBondContact O-N 3.27Å; C48-L52 HydrophobicContact CB-CD1 4.36Å; C48-L52 VanDerWaalsContact O-CB 3.28Å; C48-L52 WeakPolarHBondContact O-CB 3.39Å; C48-L52 PolarHBondContact O-N 3.43Å; C48-L60 HydrophobicContact CB-CD1 4.4Å
49	L	63.8	Low	69.1	Low	94 Å²	94	72.9 Å²	72.9	49%	0.492	41%	0.414	S	S	.	.	H	α-helix	trans	-74.7	-23.8	177.5	-71.6	169	0	0	0	113.4	C45 A46 V47	C45-L49 WeakPolarHBondContact O-CB 3.44Å; C45-L49 VanDerWaalsContact O-CG 3.29Å; C45-L49 WeakPolarHBondContact O-CG 3.44Å; C45-L49 PolarHBondContact O-N 3.09Å; A46-L49 PolarHBondContact O-N 3.27Å; V47-L49 PolarHBondContact O-N 2.87Å
50	L	65.3	Low	69.8	Low	150 Å²	150	72.3 Å²	72.3	79%	0.785	41%	0.408	S	S	*	.	H	α-helix	trans	-84.9	-29.5	178	-73.2	168.9	0	0	0	113.4	A46 V47	A46-L50 WeakPolarHBondContact O-CB 3.4Å; A46-L50 WeakPolarHBondContact O-CD1 3.25Å; A46-L50 WeakPolarHBondContact O-CG 3.35Å; A46-L50 PolarHBondContact O-N 3.22Å; A46-L50 VanDerWaalsContact O-N 3.08Å; V47-L50 PolarHBondContact O-N 3.17Å
51	I	66.5	Low	70.7	Confident	132 Å²	132	71 Å²	71	68%	0.677	39%	0.393	S	S	*	.	H	α-helix	trans	-104.1	-32	-173.2	-59.9	177.5	0	0	0	112.4	V47	V47-I51 HydrophobicContact CG1-CD1 3.64Å; V47-I51 HydrophobicContact CG1-CG1 4.46Å; V47-I51 WeakPolarHBondContact O-CG1 3.44Å; V47-I51 PolarHBondContact O-N 3Å; V47-I51 VanDerWaalsContact O-N 3.09Å
52	L	66.7	Low	71.4	Confident	72 Å²	72	70.3 Å²	70.3	38%	0.377	39%	0.392	S	S	.	.	S	Bend	trans	-106.3	155.8	-175.7	-60.4	162.1	0	0	0	110.8	C48 W56 L60	C48-L52 HydrophobicContact CB-CD1 4.36Å; C48-L52 VanDerWaalsContact O-CB 3.28Å; C48-L52 WeakPolarHBondContact O-CB 3.39Å; C48-L52 PolarHBondContact O-N 3.43Å; L52-W56 HydrophobicContact CB-CB 4.21Å; L52-L60 HydrophobicContact CD1-CD1 3.44Å; L52-L60 VanDerWaalsContact CD1-CD1 3.44Å
53	S	78.6	Confident	72.3	Confident	59 Å²	59	71.7 Å²	71.7	41%	0.413	39%	0.391	S	S	.	.			trans	-54.5	146.9	171.5	71.8	0	0	0	0	110.4	F55 W56 G57	S53-F55 PolarHBondContact O-N 3.12Å; S53-W56 PolarHBondContact O-N 2.77Å; S53-W56 VanDerWaalsContact OG-CD1 3.24Å; S53-G57 PolarHBondContact O-N 2.91Å; S53-G57 VanDerWaalsContact O-N 3.13Å
54	P	74.2	Confident	72.9	Confident	95 Å²	95	70.8 Å²	70.8	62%	0.617	38%	0.379	S	S	*	.	H	α-helix	trans	-51.7	-31.8	-175.7	-27.3	33.1	0	0	0	114.4	L58	P54-L58 WeakPolarHBondContact O-CB 3.42Å; P54-L58 WeakPolarHBondContact O-CG 3.45Å; P54-L58 PolarHBondContact O-N 3.27Å
55	F	75.9	Confident	73.6	Confident	119 Å²	119	66.1 Å²	66.1	52%	0.522	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-54.1	176.5	-177.3	-102	0	0	0	112.8	S53 G57 L58 I59	S53-F55 PolarHBondContact O-N 3.12Å; F55-G57 VanDerWaalsContact C-N 3.34Å; F55-G57 PolarHBondContact O-N 2.91Å; F55-L58 PolarHBondContact O-N 2.72Å; F55-I59 HydrophobicContact CD1-CD1 3.84Å; F55-I59 HydrophobicContact CE1-CD1 3.4Å; F55-I59 HydrophobicContact CE2-CD1 4.3Å; F55-I59 HydrophobicContact CG-CD1 4.47Å; F55-I59 HydrophobicContact CZ-CD1 3.66Å; F55-I59 WeakPolarHBondContact O-CG1 3.47Å; F55-I59 PolarHBondContact O-N 3.46Å; F55-I59 VanDerWaalsContact O-N 3.13Å
56	W	77.6	Confident	74.3	Confident	151 Å²	151	70.7 Å²	70.7	57%	0.572	37%	0.373	S	S	*	.	H	α-helix	trans	-66.9	-34.5	178.1	-70.5	114.9	0	0	0	112.5	L52 S53 I59 L60	L52-W56 HydrophobicContact CB-CB 4.21Å; S53-W56 PolarHBondContact O-N 2.77Å; S53-W56 VanDerWaalsContact OG-CD1 3.24Å; W56-I59 HydrophobicContact CE3-CD1 4.21Å; W56-I59 HydrophobicContact CZ3-CD1 4.43Å; W56-I59 PolarHBondContact O-N 2.83Å; W56-L60 WeakPolarHBondContact O-CG 3.36Å; W56-L60 PolarHBondContact O-N 3.44Å
57	G	76.2	Confident	74.8	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-61.7	-45.2	174.3	0	0	0	0	0	112.9	S53 F55 L60 F61	S53-G57 PolarHBondContact O-N 2.91Å; S53-G57 VanDerWaalsContact O-N 3.13Å; F55-G57 VanDerWaalsContact C-N 3.34Å; F55-G57 PolarHBondContact O-N 2.91Å; G57-L60 PolarHBondContact O-N 3.24Å; G57-F61 WeakPolarHBondContact O-CB 3.24Å; G57-F61 PolarHBondContact O-N 2.79Å
58	L	77.9	Confident	75.3	Confident	35 Å²	35	70.4 Å²	70.4	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-67.1	-36.1	176.9	-75.5	168.2	0	0	0	112.9	C12 L13 P16 P54 F55 S62	C12-L58 HydrophobicContact CB-CD1 4.22Å; L13-L58 HydrophobicContact CD2-CD2 4.32Å; P16-L58 HydrophobicContact CG-CD2 4.37Å; P54-L58 WeakPolarHBondContact O-CB 3.42Å; P54-L58 WeakPolarHBondContact O-CG 3.45Å; P54-L58 PolarHBondContact O-N 3.27Å; F55-L58 PolarHBondContact O-N 2.72Å; L58-S62 VanDerWaalsContact O-CB 3.3Å; L58-S62 WeakPolarHBondContact O-CB 3.27Å; L58-S62 PolarHBondContact O-N 2.96Å; L58-S62 PolarHBondContact O-OG 3.31Å
59	I	80.8	Confident	75.9	Confident	69 Å²	69	73.2 Å²	73.2	35%	0.354	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-49.6	174.1	-70.9	171.3	0	0	0	110.4	F55 W56 F61 S62 L63	F55-I59 HydrophobicContact CD1-CD1 3.84Å; F55-I59 HydrophobicContact CE1-CD1 3.4Å; F55-I59 HydrophobicContact CE2-CD1 4.3Å; F55-I59 HydrophobicContact CG-CD1 4.47Å; F55-I59 HydrophobicContact CZ-CD1 3.66Å; F55-I59 WeakPolarHBondContact O-CG1 3.47Å; F55-I59 PolarHBondContact O-N 3.46Å; F55-I59 VanDerWaalsContact O-N 3.13Å; W56-I59 HydrophobicContact CE3-CD1 4.21Å; W56-I59 HydrophobicContact CZ3-CD1 4.43Å; W56-I59 PolarHBondContact O-N 2.83Å; I59-F61 VanDerWaalsContact C-N 3.33Å; I59-F61 PolarHBondContact O-N 3.41Å; I59-S62 PolarHBondContact O-N 2.88Å; I59-L63 VanDerWaalsContact O-CB 3.28Å; I59-L63 WeakPolarHBondContact O-CB 3.31Å; I59-L63 PolarHBondContact O-N 2.89Å
60	L	79.1	Confident	76.3	Confident	69 Å²	69	71.9 Å²	71.9	36%	0.361	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-38.1	179.1	-73.3	173.1	0	0	0	112	C48 L52 W56 G57 S64	C48-L60 HydrophobicContact CB-CD1 4.4Å; L52-L60 HydrophobicContact CD1-CD1 3.44Å; L52-L60 VanDerWaalsContact CD1-CD1 3.44Å; W56-L60 WeakPolarHBondContact O-CG 3.36Å; W56-L60 PolarHBondContact O-N 3.44Å; G57-L60 PolarHBondContact O-N 3.24Å; L60-S64 VanDerWaalsContact O-CB 3.26Å; L60-S64 WeakPolarHBondContact O-CB 3.45Å; L60-S64 PolarHBondContact O-N 2.84Å; L60-S64 PolarHBondContact O-OG 2.87Å
61	F	78.7	Confident	76.5	Confident	51 Å²	51	69.6 Å²	69.6	22%	0.224	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-46.8	174.3	179.1	-137.8	0	0	0	112.4	P16 C20 C45 G57 I59 L63 S64 C65	P16-F61 HydrophobicContact CB-CD1 3.56Å; P16-F61 HydrophobicContact CB-CE1 3.65Å; P16-F61 HydrophobicContact CG-CD1 4.4Å; C20-F61 WeakPolarHBondContact SG-CZ 3.21Å; C45-F61 HydrophobicContact CB-CD2 4.07Å; C45-F61 HydrophobicContact CB-CE2 4.34Å; C45-F61 WeakPolarHBondContact SG-CD2 3.46Å; C45-F61 VanDerWaalsContact SG-CE2 3.57Å; G57-F61 WeakPolarHBondContact O-CB 3.24Å; G57-F61 PolarHBondContact O-N 2.79Å; I59-F61 VanDerWaalsContact C-N 3.33Å; I59-F61 PolarHBondContact O-N 3.41Å; F61-L63 VanDerWaalsContact C-N 3.29Å; F61-L63 PolarHBondContact O-N 3.17Å; F61-S64 PolarHBondContact O-N 3.39Å; F61-S64 PolarHBondContact O-OG 3.43Å; F61-C65 VanDerWaalsContact CD2-SG 3.53Å; F61-C65 WeakPolarHBondContact CE2-SG 3.44Å; F61-C65 WeakPolarHBondContact O-CB 3.3Å; F61-C65 PolarHBondContact O-N 2.92Å; F61-C65 PolarHBondContact O-SG 2.92Å; F61-C65 VanDerWaalsContact O-SG 3.34Å
62	S	81.2	Confident	76.6	Confident	25 Å²	25	64.3 Å²	64.3	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-39.9	178.2	-59.6	0	0	0	0	111.1	L58 I59 F66	L58-S62 VanDerWaalsContact O-CB 3.3Å; L58-S62 WeakPolarHBondContact O-CB 3.27Å; L58-S62 PolarHBondContact O-N 2.96Å; L58-S62 PolarHBondContact O-OG 3.31Å; I59-S62 PolarHBondContact O-N 2.88Å; S62-F66 VanDerWaalsContact O-CB 3.27Å; S62-F66 WeakPolarHBondContact O-CB 3.28Å; S62-F66 PolarHBondContact O-N 2.81Å
63	L	83.5	Confident	76.4	Confident	90 Å²	90	62.2 Å²	62.2	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-43.5	173.7	-175	65.7	0	0	0	111.4	I59 F61 F66 L67	I59-L63 VanDerWaalsContact O-CB 3.28Å; I59-L63 WeakPolarHBondContact O-CB 3.31Å; I59-L63 PolarHBondContact O-N 2.89Å; F61-L63 VanDerWaalsContact C-N 3.29Å; F61-L63 PolarHBondContact O-N 3.17Å; L63-F66 PolarHBondContact O-N 3.43Å; L63-L67 HydrophobicContact CD1-CD1 4.5Å; L63-L67 HydrophobicContact CD1-CG 4.49Å; L63-L67 HydrophobicContact CG-CD1 4.06Å; L63-L67 HydrophobicContact CG-CG 4.46Å; L63-L67 WeakPolarHBondContact O-CB 3.42Å; L63-L67 WeakPolarHBondContact O-CG 3.42Å; L63-L67 PolarHBondContact O-N 2.81Å
64	S	80.6	Confident	75.6	Confident	16 Å²	16	59.7 Å²	59.7	11%	0.112	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-40.1	179.5	79.1	0	0	0	0	111.9	L60 F61 L67 M68	L60-S64 VanDerWaalsContact O-CB 3.26Å; L60-S64 WeakPolarHBondContact O-CB 3.45Å; L60-S64 PolarHBondContact O-N 2.84Å; L60-S64 PolarHBondContact O-OG 2.87Å; F61-S64 PolarHBondContact O-N 3.39Å; F61-S64 PolarHBondContact O-OG 3.43Å; S64-L67 PolarHBondContact O-N 3.33Å; S64-M68 VanDerWaalsContact O-CB 3.28Å; S64-M68 WeakPolarHBondContact O-CB 3.3Å; S64-M68 PolarHBondContact O-N 2.88Å
65	C	78.9	Confident	75.5	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.02	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-40.5	171.6	-70.7	0	0	0	0	112.2	L19 F61 M68 Y69	L19-C65 HydrophobicContact CB-CB 3.9Å; L19-C65 HydrophobicContact CD1-CB 4.4Å; F61-C65 VanDerWaalsContact CD2-SG 3.53Å; F61-C65 WeakPolarHBondContact CE2-SG 3.44Å; F61-C65 WeakPolarHBondContact O-CB 3.3Å; F61-C65 PolarHBondContact O-N 2.92Å; F61-C65 PolarHBondContact O-SG 2.92Å; F61-C65 VanDerWaalsContact O-SG 3.34Å; C65-M68 PolarHBondContact O-N 3.46Å; C65-Y69 VanDerWaalsContact O-CB 3.31Å; C65-Y69 WeakPolarHBondContact O-CB 3.08Å; C65-Y69 PolarHBondContact O-N 3.42Å
66	F	80.7	Confident	75.7	Confident	108 Å²	108	56.1 Å²	56.1	47%	0.474	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-46.1	175.5	178.5	-101.4	0	0	0	111.7	S62 L63 M68 Y69 T70	S62-F66 VanDerWaalsContact O-CB 3.27Å; S62-F66 WeakPolarHBondContact O-CB 3.28Å; S62-F66 PolarHBondContact O-N 2.81Å; L63-F66 PolarHBondContact O-N 3.43Å; F66-M68 VanDerWaalsContact C-N 3.32Å; F66-M68 PolarHBondContact O-N 2.99Å; F66-Y69 PolarHBondContact O-N 3.42Å; F66-T70 HydrophobicContact CD1-CG2 4.43Å; F66-T70 HydrophobicContact CE1-CG2 4.04Å; F66-T70 HydrophobicContact CE2-CG2 4.17Å; F66-T70 HydrophobicContact CZ-CG2 3.9Å; F66-T70 WeakPolarHBondContact O-CG2 3.33Å; F66-T70 PolarHBondContact O-N 3.42Å; F66-T70 PolarHBondContact O-OG1 3.13Å; F66-T70 VanDerWaalsContact O-OG1 3.12Å
67	L	77.3	Confident	76.3	Confident	99 Å²	99	53.1 Å²	53.1	52%	0.518	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-41.9	174	-71.3	171.6	0	0	0	111.1	L63 S64 T70 Y71	L63-L67 HydrophobicContact CD1-CD1 4.5Å; L63-L67 HydrophobicContact CD1-CG 4.49Å; L63-L67 HydrophobicContact CG-CD1 4.06Å; L63-L67 HydrophobicContact CG-CG 4.46Å; L63-L67 WeakPolarHBondContact O-CB 3.42Å; L63-L67 WeakPolarHBondContact O-CG 3.42Å; L63-L67 PolarHBondContact O-N 2.81Å; S64-L67 PolarHBondContact O-N 3.33Å; L67-T70 WeakPolarHBondContact CA-OG1 3.47Å; L67-T70 PolarHBondContact O-OG1 3.31Å; L67-Y71 VanDerWaalsContact O-CB 3.26Å; L67-Y71 WeakPolarHBondContact O-CB 3.41Å; L67-Y71 PolarHBondContact O-N 3.13Å
68	M	76.8	Confident	76.9	Confident	23 Å²	23	55.5 Å²	55.5	11%	0.113	28%	0.279	C	S	.	.	H	α-helix	trans	-66.1	-41.8	175.2	-168.5	-172.2	-114.4	0	0	111.8	V23 W37 M38 L41 S64 C65 F66 Y71 L72	V23-M68 HydrophobicContact CG1-CG 4.48Å; V23-M68 HydrophobicContact CG1-SD 3.72Å; W37-M68 HydrophobicContact CB-CE 4.22Å; M38-M68 HydrophobicContact CG-CE 4.05Å; L41-M68 HydrophobicContact CB-CE 4.14Å; L41-M68 HydrophobicContact CD1-CE 4.29Å; L41-M68 HydrophobicContact CD2-CE 4.07Å; L41-M68 HydrophobicContact CD2-SD 3.85Å; L41-M68 HydrophobicContact CG-CE 4.41Å; S64-M68 VanDerWaalsContact O-CB 3.28Å; S64-M68 WeakPolarHBondContact O-CB 3.3Å; S64-M68 PolarHBondContact O-N 2.88Å; C65-M68 PolarHBondContact O-N 3.46Å; F66-M68 VanDerWaalsContact C-N 3.32Å; F66-M68 PolarHBondContact O-N 2.99Å; M68-Y71 PolarHBondContact O-N 3.03Å; M68-L72 HydrophobicContact CG-CD1 3.83Å; M68-L72 HydrophobicContact CG-CG 4.19Å; M68-L72 WeakPolarHBondContact O-CB 3.41Å; M68-L72 VanDerWaalsContact O-CG 3.24Å; M68-L72 WeakPolarHBondContact O-CG 3.41Å; M68-L72 PolarHBondContact O-N 2.96Å; M68-L72 HydrophobicContact SD-CD1 4.28Å
69	Y	74.1	Confident	77.5	Confident	78 Å²	78	58.6 Å²	58.6	31%	0.306	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-44.9	177.2	175.2	-92.7	0	0	0	112	V23 K26 C65 F66 Y71 S73	V23-Y69 HydrophobicContact CG2-CD2 4.28Å; K26-Y69 HydrophobicContact CD-CE2 4.06Å; K26-Y69 PolarHBondContact NZ-OH 2.94Å; C65-Y69 VanDerWaalsContact O-CB 3.31Å; C65-Y69 WeakPolarHBondContact O-CB 3.08Å; C65-Y69 PolarHBondContact O-N 3.42Å; F66-Y69 PolarHBondContact O-N 3.42Å; Y69-Y71 VanDerWaalsContact C-N 3.34Å; Y69-S73 VanDerWaalsContact O-CB 3.24Å; Y69-S73 WeakPolarHBondContact O-CB 3.43Å; Y69-S73 PolarHBondContact O-N 3.44Å; Y69-S73 PolarHBondContact O-OG 3.18Å
70	T	71.1	Confident	78	Confident	66 Å²	66	57 Å²	57	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-40.6	176.8	55.7	0	0	0	0	111.1	F66 L67 G74	F66-T70 HydrophobicContact CD1-CG2 4.43Å; F66-T70 HydrophobicContact CE1-CG2 4.04Å; F66-T70 HydrophobicContact CE2-CG2 4.17Å; F66-T70 HydrophobicContact CZ-CG2 3.9Å; F66-T70 WeakPolarHBondContact O-CG2 3.33Å; F66-T70 PolarHBondContact O-N 3.42Å; F66-T70 PolarHBondContact O-OG1 3.13Å; F66-T70 VanDerWaalsContact O-OG1 3.12Å; L67-T70 WeakPolarHBondContact CA-OG1 3.47Å; L67-T70 PolarHBondContact O-OG1 3.31Å; T70-G74 PolarHBondContact O-N 2.9Å
71	Y	70.4	Confident	78.2	Confident	101 Å²	101	59.4 Å²	59.4	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-52.4	174	-176.9	-93	0	0	0	112.5	L34 L67 M68 Y69 S73 G74 Q75 F335	L34-Y71 HydrophobicContact CD2-CE1 4.4Å; L67-Y71 VanDerWaalsContact O-CB 3.26Å; L67-Y71 WeakPolarHBondContact O-CB 3.41Å; L67-Y71 PolarHBondContact O-N 3.13Å; M68-Y71 PolarHBondContact O-N 3.03Å; Y69-Y71 VanDerWaalsContact C-N 3.34Å; Y71-S73 VanDerWaalsContact C-N 3.35Å; Y71-S73 PolarHBondContact O-N 3.05Å; Y71-G74 WeakPolarHBondContact O-CA 3.35Å; Y71-G74 PolarHBondContact O-N 3.06Å; Y71-Q75 HydrophobicContact CE1-CG 4.34Å; Y71-Q75 PolarHBondContact O-N 3.29Å; Y71-F335 HydrophobicContact CD2-CE1 4.19Å; Y71-F335 HydrophobicContact CD2-CZ 4.18Å; Y71-F335 AromaticContact CE2-CE1 3.77Å; Y71-F335 HydrophobicContact CE2-CE1 3.77Å; Y71-F335 AromaticContact CE2-CZ 3.44Å; Y71-F335 HydrophobicContact CE2-CZ 3.44Å; Y71-F335 VanDerWaalsContact CE2-CZ 3.44Å; Y71-F335 AromaticContact CZ-CZ 3.93Å
72	L	69.3	Low	78.4	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-38.1	-179.6	-72.7	171.7	0	0	0	112.5	V23 L34 M68 G74 Q75	V23-L72 HydrophobicContact CG1-CD1 3.7Å; V23-L72 HydrophobicContact CG2-CD1 4.49Å; L34-L72 HydrophobicContact CD1-CD2 3.51Å; L34-L72 HydrophobicContact CD2-CD2 3.82Å; L34-L72 HydrophobicContact CG-CD2 4.25Å; M68-L72 HydrophobicContact CG-CD1 3.83Å; M68-L72 HydrophobicContact CG-CG 4.19Å; M68-L72 WeakPolarHBondContact O-CB 3.41Å; M68-L72 VanDerWaalsContact O-CG 3.24Å; M68-L72 WeakPolarHBondContact O-CG 3.41Å; M68-L72 PolarHBondContact O-N 2.96Å; M68-L72 HydrophobicContact SD-CD1 4.28Å; L72-G74 PolarHBondContact O-N 3.4Å; L72-Q75 WeakPolarHBondContact O-CB 3.45Å; L72-Q75 PolarHBondContact O-N 2.94Å; L72-Q75 VanDerWaalsContact O-N 3.08Å
73	S	61.3	Low	79.1	Confident	27 Å²	27	62.3 Å²	62.3	19%	0.189	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-24.2	175.2	-59.6	0	0	0	0	112.3	K26 Y69 Y71 Q75	K26-S73 PolarHBondContact NZ-OG 3.39Å; Y69-S73 VanDerWaalsContact O-CB 3.24Å; Y69-S73 WeakPolarHBondContact O-CB 3.43Å; Y69-S73 PolarHBondContact O-N 3.44Å; Y69-S73 PolarHBondContact O-OG 3.18Å; Y71-S73 VanDerWaalsContact C-N 3.35Å; Y71-S73 PolarHBondContact O-N 3.05Å; S73-Q75 VanDerWaalsContact C-N 3.35Å
74	G	62.4	Low	79.8	Confident	6 Å²	6	58.1 Å²	58.1	6%	0.062	30%	0.297	C	S	.	.	H	α-helix	trans	-75.3	-20.3	173.3	0	0	0	0	0	114.5	T70 Y71 L72 E76	T70-G74 PolarHBondContact O-N 2.9Å; Y71-G74 WeakPolarHBondContact O-CA 3.35Å; Y71-G74 PolarHBondContact O-N 3.06Å; L72-G74 PolarHBondContact O-N 3.4Å; G74-E76 VanDerWaalsContact C-N 3.34Å
75	Q	70.8	Confident	80.6	Confident	49 Å²	49	57.3 Å²	57.3	23%	0.229	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.6	-178.2	-61.1	-65.2	-52.4	0	0	113.7	Y71 L72 S73 L77 H327 F335	Y71-Q75 HydrophobicContact CE1-CG 4.34Å; Y71-Q75 PolarHBondContact O-N 3.29Å; L72-Q75 WeakPolarHBondContact O-CB 3.45Å; L72-Q75 PolarHBondContact O-N 2.94Å; L72-Q75 VanDerWaalsContact O-N 3.08Å; S73-Q75 VanDerWaalsContact C-N 3.35Å; Q75-L77 PolarHBondContact O-N 3.13Å; Q75-H327 PolarHBondContact NE2-NE2 2.85Å; Q75-H327 PolarHBondContact OE1-NE2 3.22Å; Q75-H327 VanDerWaalsContact OE1-NE2 3.1Å; Q75-F335 VanDerWaalsContact NE2-CZ 3.34Å
76	E	81.8	Confident	81.6	Confident	90 Å²	90	57.2 Å²	57.2	42%	0.421	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-64.1	120.5	175.7	-175.4	176.7	-154.1	0	0	110.4	G74 K332	G74-E76 VanDerWaalsContact C-N 3.34Å; E76-K332 HydrophobicContact CB-CB 4.47Å; E76-K332 WeakPolarHBondContact O-CB 3.21Å; E76-K332 PolarHBondContact O-N 2.91Å; E76-K332 WeakPolarHBondContact OE2-CD 3.48Å; E76-K332 IonicContact OE2-NZ 3.27Å; E76-K332 PolarHBondContact OE2-NZ 3.16Å
77	L	88.8	Confident	82.5	Confident	89 Å²	89	52 Å²	52	47%	0.466	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-87.8	131.2	177.1	-57.1	-176	0	0	0	110.5	Q75 A331	Q75-L77 PolarHBondContact O-N 3.13Å; L77-A331 HydrophobicContact CD2-CB 4.27Å
78	L	90.4	Very high	83.5	Confident	49 Å²	49	47.5 Å²	47.5	26%	0.257	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-74.6	147.3	173.2	-60	171.9	0	0	0	109.8	W162 S330 K332	L78-W162 HydrophobicContact CD1-CH2 3.66Å; L78-W162 HydrophobicContact CD1-CZ2 3.77Å; L78-S330 VanDerWaalsContact CB-O 3.32Å; L78-S330 WeakPolarHBondContact CB-O 3.28Å; L78-S330 WeakPolarHBondContact CG-O 3.43Å; L78-S330 PolarHBondContact N-O 3.03Å; L78-K332 HydrophobicContact CD2-CB 4.4Å
79	P	90.1	Very high	84.4	Confident	101 Å²	101	47 Å²	47	66%	0.656	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-58.5	146	179.2	25.1	-34.8	0	0	0	111.4	K83	P79-K83 VanDerWaalsContact O-CD 3.27Å; P79-K83 WeakPolarHBondContact O-CD 3.45Å; P79-K83 WeakPolarHBondContact O-CE 3.34Å; P79-K83 PolarHBondContact O-NZ 3.43Å
80	V	90.3	Very high	85.5	Confident	34 Å²	34	43.3 Å²	43.3	21%	0.206	23%	0.231	C	C	.	.			trans	-78.6	-28	-178.7	176.1	0	0	0	0	112.3	Q82 K83 L105 G106 F107	V80-Q82 PolarHBondContact O-N 3.04Å; V80-K83 VanDerWaalsContact O-CB 3.3Å; V80-K83 WeakPolarHBondContact O-CB 3.44Å; V80-K83 PolarHBondContact O-N 3.27Å; V80-K83 VanDerWaalsContact O-N 3.09Å; V80-L105 WeakPolarHBondContact CG1-O 3.32Å; V80-G106 VanDerWaalsContact CG1-C 3.47Å; V80-F107 HydrophobicContact CB-CE1 4.5Å; V80-F107 HydrophobicContact CB-CE2 4.24Å; V80-F107 HydrophobicContact CB-CZ 4.21Å; V80-F107 HydrophobicContact CG1-CB 4.26Å; V80-F107 HydrophobicContact CG1-CD1 3.75Å; V80-F107 HydrophobicContact CG1-CD2 3.45Å; V80-F107 VanDerWaalsContact CG1-CD2 3.45Å; V80-F107 HydrophobicContact CG1-CE1 3.86Å; V80-F107 HydrophobicContact CG1-CE2 3.57Å; V80-F107 HydrophobicContact CG1-CG 3.55Å; V80-F107 HydrophobicContact CG1-CZ 3.78Å; V80-F107 HydrophobicContact CG2-CD2 4.38Å; V80-F107 HydrophobicContact CG2-CE1 4.47Å; V80-F107 HydrophobicContact CG2-CE2 3.67Å; V80-F107 HydrophobicContact CG2-CZ 3.72Å
81	D	84	Confident	86.5	Confident	120 Å²	120	42.1 Å²	42.1	64%	0.642	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	138.1	-171.6	-172.8	28.7	0	0	0	112.6	K83	D81-K83 PolarHBondContact O-N 3.47Å; D81-K83 VanDerWaalsContact O-N 3.16Å
82	Q	81.9	Confident	87.6	Confident	114 Å²	114	39.8 Å²	39.8	53%	0.533	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	10	-177.3	-54.1	-58.3	-55.5	0	0	116.7	V80	V80-Q82 PolarHBondContact O-N 3.04Å
83	K	96.2	Very high	88.7	Confident	23 Å²	23	39.7 Å²	39.7	10%	0.1	22%	0.224	C	C	.	.			trans	-91.3	126.9	177.6	-69.7	173.3	173.4	171.4	0	112.2	P79 V80 D81 F107 T108 W162	P79-K83 VanDerWaalsContact O-CD 3.27Å; P79-K83 WeakPolarHBondContact O-CD 3.45Å; P79-K83 WeakPolarHBondContact O-CE 3.34Å; P79-K83 PolarHBondContact O-NZ 3.43Å; V80-K83 VanDerWaalsContact O-CB 3.3Å; V80-K83 WeakPolarHBondContact O-CB 3.44Å; V80-K83 PolarHBondContact O-N 3.27Å; V80-K83 VanDerWaalsContact O-N 3.09Å; D81-K83 PolarHBondContact O-N 3.47Å; D81-K83 VanDerWaalsContact O-N 3.16Å; K83-F107 HydrophobicContact CB-CD1 3.76Å; K83-F107 HydrophobicContact CB-CE1 3.8Å; K83-F107 HydrophobicContact CD-CE1 4.15Å; K83-T108 PolarHBondContact O-N 3.02Å; K83-W162 HydrophobicContact CB-CB 3.71Å; K83-W162 HydrophobicContact CB-CD2 4.49Å; K83-W162 HydrophobicContact CB-CG 3.72Å; K83-W162 HydrophobicContact CD-CD2 3.74Å; K83-W162 HydrophobicContact CD-CE3 4.44Å; K83-W162 HydrophobicContact CD-CG 3.75Å; K83-W162 HydrophobicContact CD-CZ2 4.33Å; K83-W162 HydrophobicContact CG-CB 3.93Å; K83-W162 HydrophobicContact CG-CD2 3.91Å; K83-W162 HydrophobicContact CG-CE3 4.44Å; K83-W162 HydrophobicContact CG-CG 3.65Å
84	A	98.3	Very high	90.3	Very high	2 Å²	2	39.3 Å²	39.3	2%	0.017	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.4	176.4	0	0	0	0	0	112.8	T108 F110 L156 L161 W162 A163	A84-T108 CarbonylContact C-O 3.56Å; A84-T108 VanDerWaalsContact CA-O 3.22Å; A84-T108 WeakPolarHBondContact CA-O 3.26Å; A84-T108 HydrophobicContact CB-CG2 4.27Å; A84-F110 HydrophobicContact CB-CD2 4.42Å; A84-F110 HydrophobicContact CB-CE2 3.9Å; A84-L156 HydrophobicContact CB-CD1 3.84Å; A84-L156 HydrophobicContact CB-CD2 3.49Å; A84-L156 VanDerWaalsContact CB-CD2 3.49Å; A84-L156 HydrophobicContact CB-CG 4.32Å; A84-L161 HydrophobicContact CB-CD1 3.88Å; A84-L161 VanDerWaalsContact O-CD1 3.27Å; A84-L161 WeakPolarHBondContact O-CD1 3.39Å; A84-W162 WeakPolarHBondContact O-CA 3.37Å; A84-W162 VanDerWaalsContact O-CB 3.27Å; A84-W162 WeakPolarHBondContact O-CB 3.47Å; A84-W162 PolarHBondContact O-N 2.92Å; A84-A163 PolarHBondContact O-N 2.94Å
85	V	98.8	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.7	-177.4	-177.4	0	0	0	0	109.4	V87 L102 F107 T108 V109 F110 A163 V165 I329	V85-V87 HydrophobicContact CG1-CG2 3.98Å; V85-L102 HydrophobicContact CB-CD1 4.21Å; V85-L102 HydrophobicContact CG1-CD1 3.76Å; V85-L102 HydrophobicContact CG2-CD1 4.44Å; V85-F107 HydrophobicContact CG2-CB 4.3Å; V85-F107 HydrophobicContact CG2-CD1 3.53Å; V85-F107 HydrophobicContact CG2-CE1 4.08Å; V85-F107 HydrophobicContact CG2-CG 4.04Å; V85-T108 PolarHBondContact N-O 3.16Å; V85-V109 WeakPolarHBondContact O-CA 3.42Å; V85-F110 PolarHBondContact O-N 3.45Å; V85-A163 CarbonylContact C-O 3.33Å; V85-A163 WeakPolarHBondContact CA-O 3.45Å; V85-A163 HydrophobicContact CB-CB 4.48Å; V85-A163 HydrophobicContact CG1-CB 4.07Å; V85-A163 HydrophobicContact CG2-CB 4.13Å; V85-V165 HydrophobicContact CG1-CG2 3.83Å; V85-I329 HydrophobicContact CG2-CD1 4.11Å
86	L	98.9	Very high	93.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.6	166.3	176.3	70.6	0	0	0	109.1	F110 L135 M137 L161 A163 V164 V165 V199 F203	L86-F110 WeakPolarHBondContact CA-O 3.36Å; L86-F110 HydrophobicContact CB-CB 4.45Å; L86-F110 HydrophobicContact CD1-CB 3.77Å; L86-L135 HydrophobicContact CD1-CD1 4.27Å; L86-M137 HydrophobicContact CD1-SD 4.32Å; L86-M137 HydrophobicContact CD2-CE 4.43Å; L86-M137 HydrophobicContact CD2-SD 4.5Å; L86-L161 HydrophobicContact CB-CD1 4.44Å; L86-L161 HydrophobicContact CB-CD2 3.89Å; L86-A163 PolarHBondContact N-O 2.75Å; L86-V164 HydrophobicContact CB-CG2 4.49Å; L86-V164 HydrophobicContact CD2-CG1 4.35Å; L86-V164 HydrophobicContact CD2-CG2 4.4Å; L86-V165 PolarHBondContact O-N 2.96Å; L86-V199 HydrophobicContact CD2-CG1 4.27Å; L86-F203 HydrophobicContact CD2-CD1 3.85Å; L86-F203 HydrophobicContact CD2-CD2 3.91Å; L86-F203 HydrophobicContact CD2-CE1 3.63Å; L86-F203 HydrophobicContact CD2-CE2 3.71Å; L86-F203 HydrophobicContact CD2-CG 3.97Å; L86-F203 HydrophobicContact CD2-CZ 3.55Å
87	V	98.9	Very high	94	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.3	172.4	-176.7	0	0	0	0	108.5	V85 L98 L102 F110 G112 V165	V85-V87 HydrophobicContact CG1-CG2 3.98Å; V87-L98 HydrophobicContact CG1-CD2 3.94Å; V87-L98 HydrophobicContact CG2-CD2 4.07Å; V87-L98 HydrophobicContact CG2-CG 4.41Å; V87-L102 HydrophobicContact CG2-CD1 4.07Å; V87-F110 PolarHBondContact N-O 3.44Å; V87-G112 WeakPolarHBondContact O-CA 3.47Å; V87-G112 PolarHBondContact O-N 2.89Å; V87-V165 HydrophobicContact CG2-CB 4.28Å; V87-V165 HydrophobicContact CG2-CG2 4.41Å
88	T	98.7	Very high	94.4	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.6	173	58.2	0	0	0	0	111.5	M137 V139 V165 N166 N167 A168 V199	T88-M137 HydrophobicContact CG2-CE 4.31Å; T88-M137 HydrophobicContact CG2-SD 4.17Å; T88-V139 HydrophobicContact CG2-CG1 4.17Å; T88-V165 PolarHBondContact N-O 3.29Å; T88-V165 PolarHBondContact OG1-O 2.97Å; T88-N166 WeakPolarHBondContact OG1-CA 3.36Å; T88-N167 VanDerWaalsContact O-CB 3.29Å; T88-N167 WeakPolarHBondContact O-CB 3.42Å; T88-N167 PolarHBondContact O-ND2 2.91Å; T88-N167 PolarHBondContact OG1-N 3.42Å; T88-A168 PolarHBondContact O-N 3.32Å; T88-A168 PolarHBondContact OG1-N 3.03Å; T88-A168 VanDerWaalsContact OG1-N 3.13Å; T88-V199 HydrophobicContact CG2-CG1 4.11Å; T88-V199 HydrophobicContact CG2-CG2 4.38Å
89	G	96.9	Very high	94.8	Very high	13 Å²	13	28 Å²	28	13%	0.134	17%	0.166	C	C	.	.	S	Bend	trans	68.3	40.6	-176.8	0	0	0	0	0	112.1	D91 G95 G112 N167	G89-D91 PolarHBondContact O-N 2.8Å; G89-G95 WeakPolarHBondContact O-CA 3.27Å; G89-G112 PolarHBondContact N-O 3.47Å; G89-N167 PolarHBondContact O-ND2 2.84Å
90	G	96.6	Very high	95.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.6	179.9	0	0	0	0	0	114.4	H96 G112 L124	G90-H96 VanDerWaalsContact O-CA 3.31Å; G90-H96 WeakPolarHBondContact O-CA 3.42Å; G90-H96 WeakPolarHBondContact O-CB 3.22Å; G90-H96 PolarHBondContact O-CD2 3.47Å; G90-G112 PolarHBondContact N-O 2.69Å; G90-L124 WeakPolarHBondContact O-CD1 3.5Å
91	D	92	Very high	95.6	Very high	41 Å²	41	26.7 Å²	26.7	22%	0.219	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-25.7	-174.3	49.6	-80.1	0	0	0	113.9	G89 V113 G120	G89-D91 PolarHBondContact O-N 2.8Å; D91-V113 HydrophobicContact CB-CB 4.11Å; D91-V113 HydrophobicContact CB-CG1 4.25Å; D91-G120 WeakPolarHBondContact O-CA 3.38Å
92	C	92.8	Very high	96.3	Very high	53 Å²	53	21 Å²	21	36%	0.358	12%	0.116	S	C	.	.	S	Bend	trans	-157.4	175.1	-179.2	61.4	0	0	0	0	113	L94 G95 H96 S268	C92-L94 PolarHBondContact O-N 3.3Å; C92-G95 PolarHBondContact O-N 3.43Å; C92-H96 PolarHBondContact O-N 3Å; C92-S268 WeakPolarHBondContact CB-OG 3.44Å; C92-S268 PolarHBondContact SG-OG 2.56Å
93	G	92.6	Very high	97.1	Very high	20 Å²	20	16 Å²	16	21%	0.206	9%	0.093	C	C	.	.	H	α-helix	trans	55	-134	170.3	0	0	0	0	0	114.3	A97	G93-A97 PolarHBondContact O-N 3.18Å; G93-A97 VanDerWaalsContact O-N 3.14Å
94	L	94.7	Very high	97.1	Very high	19 Å²	19	21.7 Å²	21.7	10%	0.099	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-42.2	-176.2	177.6	64.7	0	0	0	112.6	C92 A97 L98 V217 T267 F318 V321 L322	C92-L94 PolarHBondContact O-N 3.3Å; L94-A97 PolarHBondContact O-N 3.42Å; L94-L98 VanDerWaalsContact O-CB 3.27Å; L94-L98 WeakPolarHBondContact O-CB 3.27Å; L94-L98 PolarHBondContact O-N 2.97Å; L94-V217 HydrophobicContact CD2-CG1 4.34Å; L94-T267 HydrophobicContact CB-CG2 4.32Å; L94-F318 HydrophobicContact CD1-CB 4.3Å; L94-F318 HydrophobicContact CD1-CG 4.3Å; L94-V321 HydrophobicContact CD1-CB 3.82Å; L94-V321 HydrophobicContact CD1-CG1 3.69Å; L94-V321 HydrophobicContact CD1-CG2 4.4Å; L94-V321 HydrophobicContact CD2-CG1 3.71Å; L94-V321 HydrophobicContact CG-CG1 4.32Å; L94-L322 HydrophobicContact CD1-CD2 4.11Å
95	G	96.8	Very high	97	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-40.8	-177.8	0	0	0	0	0	112.2	G89 C92 L98 C99 N167	G89-G95 WeakPolarHBondContact O-CA 3.27Å; C92-G95 PolarHBondContact O-N 3.43Å; G95-L98 PolarHBondContact O-N 3.36Å; G95-C99 PolarHBondContact O-N 2.88Å; G95-C99 PolarHBondContact O-SG 3.21Å; G95-N167 VanDerWaalsContact CA-ND2 3.31Å; G95-N167 WeakPolarHBondContact CA-ND2 3.49Å
96	H	97.7	Very high	96.9	Very high	21 Å²	21	25.5 Å²	25.5	10%	0.097	15%	0.146	C	C	.	.	H	α-helix	trans	-62.9	-48.6	174.8	-176.1	-97.6	0	0	0	112	G90 C92 L98 C99 K100 G120 E123	G90-H96 VanDerWaalsContact O-CA 3.31Å; G90-H96 WeakPolarHBondContact O-CA 3.42Å; G90-H96 WeakPolarHBondContact O-CB 3.22Å; G90-H96 PolarHBondContact O-CD2 3.47Å; C92-H96 PolarHBondContact O-N 3Å; H96-L98 VanDerWaalsContact C-N 3.28Å; H96-L98 PolarHBondContact O-N 3.48Å; H96-C99 PolarHBondContact O-N 3.29Å; H96-K100 PolarHBondContact O-N 2.99Å; H96-G120 PolarHBondContact NE2-O 3.03Å; H96-E123 VanDerWaalsContact CE1-CD 3.47Å; H96-E123 IonicContact CE1-OE1 3.87Å; H96-E123 PolarHBondContact CE1-OE1 3.24Å; H96-E123 IonicContact CE1-OE2 3.49Å; H96-E123 PolarHBondContact CE1-OE2 2.84Å; H96-E123 IonicContact NE2-OE2 3.08Å
97	A	97.8	Very high	96.9	Very high	25 Å²	25	25.5 Å²	25.5	21%	0.207	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-39	176	0	0	0	0	0	112	G93 L94 K100 Y101 F318 L322	G93-A97 PolarHBondContact O-N 3.18Å; G93-A97 VanDerWaalsContact O-N 3.14Å; L94-A97 PolarHBondContact O-N 3.42Å; A97-K100 PolarHBondContact O-N 2.76Å; A97-Y101 VanDerWaalsContact O-CB 3.3Å; A97-Y101 WeakPolarHBondContact O-CB 3.37Å; A97-Y101 PolarHBondContact O-N 3.39Å; A97-F318 HydrophobicContact CB-CD2 3.68Å; A97-F318 HydrophobicContact CB-CE2 4.26Å; A97-L322 HydrophobicContact CB-CD1 4.46Å
98	L	98.5	Very high	96.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.7	-41.6	176.1	-180	66.3	0	0	0	112.3	V87 L94 G95 H96 K100 Y101 L102 V165 L322 I325	V87-L98 HydrophobicContact CG1-CD2 3.94Å; V87-L98 HydrophobicContact CG2-CD2 4.07Å; V87-L98 HydrophobicContact CG2-CG 4.41Å; L94-L98 VanDerWaalsContact O-CB 3.27Å; L94-L98 WeakPolarHBondContact O-CB 3.27Å; L94-L98 PolarHBondContact O-N 2.97Å; G95-L98 PolarHBondContact O-N 3.36Å; H96-L98 VanDerWaalsContact C-N 3.28Å; H96-L98 PolarHBondContact O-N 3.48Å; L98-K100 PolarHBondContact O-N 3.45Å; L98-Y101 PolarHBondContact O-N 3.28Å; L98-L102 HydrophobicContact CD1-CD1 3.92Å; L98-L102 HydrophobicContact CD1-CD2 4.22Å; L98-L102 HydrophobicContact CD1-CG 3.81Å; L98-L102 HydrophobicContact CD2-CD1 4.46Å; L98-L102 HydrophobicContact CG-CD1 3.89Å; L98-L102 HydrophobicContact CG-CG 4.15Å; L98-L102 WeakPolarHBondContact O-CB 3.37Å; L98-L102 VanDerWaalsContact O-CG 3.27Å; L98-L102 WeakPolarHBondContact O-CG 3.29Å; L98-L102 PolarHBondContact O-N 3.34Å; L98-V165 HydrophobicContact CD2-CB 4.44Å; L98-V165 HydrophobicContact CD2-CG1 3.87Å; L98-L322 HydrophobicContact CB-CD2 3.75Å; L98-L322 HydrophobicContact CD1-CD2 3.84Å; L98-L322 HydrophobicContact CG-CD2 4.42Å; L98-I325 HydrophobicContact CD1-CB 4.12Å; L98-I325 HydrophobicContact CD1-CD1 4.36Å; L98-I325 HydrophobicContact CD1-CG2 3.72Å; L98-I325 HydrophobicContact CD2-CD1 3.89Å; L98-I325 HydrophobicContact CD2-CG2 3.92Å; L98-I325 HydrophobicContact CG-CG2 4.48Å
99	C	98.6	Very high	96.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-47.8	177.6	-70	0	0	0	0	111.5	G95 H96 L102 D103 V109 A111 L124 L132	G95-C99 PolarHBondContact O-N 2.88Å; G95-C99 PolarHBondContact O-SG 3.21Å; H96-C99 PolarHBondContact O-N 3.29Å; C99-L102 PolarHBondContact O-N 3.5Å; C99-D103 WeakPolarHBondContact O-CB 3.2Å; C99-D103 PolarHBondContact O-N 2.81Å; C99-V109 HydrophobicContact CB-CG1 4.16Å; C99-A111 HydrophobicContact CB-CB 4.44Å; C99-L124 HydrophobicContact CB-CD1 4.36Å; C99-L124 HydrophobicContact CB-CD2 3.88Å; C99-L132 HydrophobicContact CB-CD1 3.93Å
100	K	98.6	Very high	96.9	Very high	55 Å²	55	26.2 Å²	26.2	24%	0.239	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-47.4	177	-61.9	177	75.9	169.1	0	111.2	H96 A97 L98 L102 D103 E104 E123 L124	H96-K100 PolarHBondContact O-N 2.99Å; A97-K100 PolarHBondContact O-N 2.76Å; L98-K100 PolarHBondContact O-N 3.45Å; K100-L102 PolarHBondContact O-N 2.95Å; K100-D103 PolarHBondContact O-N 2.95Å; K100-E104 WeakPolarHBondContact O-CG 3.22Å; K100-E104 PolarHBondContact O-N 2.95Å; K100-E123 IonicContact NZ-OE1 3.48Å; K100-E123 PolarHBondContact NZ-OE1 3.46Å; K100-L124 HydrophobicContact CD-CD2 4.4Å; K100-L124 HydrophobicContact CG-CD2 3.73Å
101	Y	98.4	Very high	97	Very high	51 Å²	51	26.2 Å²	26.2	20%	0.2	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-41.8	-179.8	-176.1	-117.9	0	0	0	113.2	A97 L98 L105 L322 Q326	A97-Y101 VanDerWaalsContact O-CB 3.3Å; A97-Y101 WeakPolarHBondContact O-CB 3.37Å; A97-Y101 PolarHBondContact O-N 3.39Å; L98-Y101 PolarHBondContact O-N 3.28Å; Y101-L105 HydrophobicContact CD1-CD1 4.03Å; Y101-L105 HydrophobicContact CE1-CD1 3.66Å; Y101-L105 HydrophobicContact CE2-CD1 4.39Å; Y101-L105 VanDerWaalsContact O-CG 3.3Å; Y101-L105 WeakPolarHBondContact O-CG 3.26Å; Y101-L105 PolarHBondContact O-N 3.05Å; Y101-L105 VanDerWaalsContact O-N 3.14Å; Y101-L322 HydrophobicContact CD1-CB 3.74Å; Y101-L322 HydrophobicContact CD1-CD1 4.45Å; Y101-L322 HydrophobicContact CD1-CG 4.48Å; Y101-L322 HydrophobicContact CE1-CB 3.89Å; Y101-L322 HydrophobicContact CG-CB 4.26Å; Y101-L322 HydrophobicContact CG-CD1 4.14Å; Y101-Q326 HydrophobicContact CE1-CB 4.06Å; Y101-Q326 PolarHBondContact OH-OE1 3.02Å
102	L	98.4	Very high	97.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.3	-35.1	177.7	-67.3	-179.1	0	0	0	112.3	V85 V87 L98 C99 K100 L105 G106 F107 V109 I329	V85-L102 HydrophobicContact CB-CD1 4.21Å; V85-L102 HydrophobicContact CG1-CD1 3.76Å; V85-L102 HydrophobicContact CG2-CD1 4.44Å; V87-L102 HydrophobicContact CG2-CD1 4.07Å; L98-L102 HydrophobicContact CD1-CD1 3.92Å; L98-L102 HydrophobicContact CD1-CD2 4.22Å; L98-L102 HydrophobicContact CD1-CG 3.81Å; L98-L102 HydrophobicContact CD2-CD1 4.46Å; L98-L102 HydrophobicContact CG-CD1 3.89Å; L98-L102 HydrophobicContact CG-CG 4.15Å; L98-L102 WeakPolarHBondContact O-CB 3.37Å; L98-L102 VanDerWaalsContact O-CG 3.27Å; L98-L102 WeakPolarHBondContact O-CG 3.29Å; L98-L102 PolarHBondContact O-N 3.34Å; C99-L102 PolarHBondContact O-N 3.5Å; K100-L102 PolarHBondContact O-N 2.95Å; L102-L105 HydrophobicContact CD2-CD1 4.4Å; L102-L105 PolarHBondContact O-N 2.68Å; L102-G106 PolarHBondContact O-N 3.03Å; L102-F107 HydrophobicContact CB-CB 4.31Å; L102-F107 HydrophobicContact CB-CD2 4.2Å; L102-F107 HydrophobicContact CD2-CD2 3.93Å; L102-F107 HydrophobicContact CD2-CE2 4.06Å; L102-F107 WeakPolarHBondContact O-CB 3.27Å; L102-F107 WeakPolarHBondContact O-CD2 3.3Å; L102-F107 PolarHBondContact O-N 2.99Å; L102-V109 HydrophobicContact CB-CG2 3.71Å; L102-I329 HydrophobicContact CD1-CD1 4.3Å; L102-I329 HydrophobicContact CD2-CD1 3.52Å
103	D	98.1	Very high	97.6	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.048	12%	0.12	C	C	.	.	H	α-helix	trans	-64.8	-42.9	174.6	178.3	64.5	0	0	0	112.1	C99 K100 L105 G106 V109 C128 S129 R131 L132	C99-D103 WeakPolarHBondContact O-CB 3.2Å; C99-D103 PolarHBondContact O-N 2.81Å; K100-D103 PolarHBondContact O-N 2.95Å; D103-L105 VanDerWaalsContact C-N 3.28Å; D103-L105 PolarHBondContact O-N 2.87Å; D103-G106 WeakPolarHBondContact O-CA 3.39Å; D103-G106 PolarHBondContact O-N 2.85Å; D103-V109 HydrophobicContact CB-CG2 4.31Å; D103-C128 HydrophobicContact CB-CB 4.33Å; D103-C128 WeakPolarHBondContact OD2-CA 3.48Å; D103-C128 WeakPolarHBondContact OD2-CB 3.26Å; D103-S129 WeakPolarHBondContact OD1-CB 3.34Å; D103-S129 PolarHBondContact OD1-OG 2.81Å; D103-S129 PolarHBondContact OD2-N 3.32Å; D103-R131 PolarHBondContact O-NH2 2.85Å; D103-R131 VanDerWaalsContact O-NH2 3.13Å; D103-L132 HydrophobicContact CB-CD1 4.41Å
104	E	97.1	Very high	97.7	Very high	144 Å²	144	25.4 Å²	25.4	67%	0.673	13%	0.134	S	C	*	.	H	α-helix	trans	-59.6	-37.2	173.8	-74.5	172.1	-170.3	0	0	112.2	K100 G106	K100-E104 WeakPolarHBondContact O-CG 3.22Å; K100-E104 PolarHBondContact O-N 2.95Å; E104-G106 PolarHBondContact O-N 3.09Å
105	L	96.2	Very high	97.8	Very high	56 Å²	56	28.6 Å²	28.6	29%	0.293	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.4	175.2	-69.9	174.7	0	0	0	113.7	V80 Y101 L102 D103 F107 Q326	V80-L105 WeakPolarHBondContact CG1-O 3.32Å; Y101-L105 HydrophobicContact CD1-CD1 4.03Å; Y101-L105 HydrophobicContact CE1-CD1 3.66Å; Y101-L105 HydrophobicContact CE2-CD1 4.39Å; Y101-L105 VanDerWaalsContact O-CG 3.3Å; Y101-L105 WeakPolarHBondContact O-CG 3.26Å; Y101-L105 PolarHBondContact O-N 3.05Å; Y101-L105 VanDerWaalsContact O-N 3.14Å; L102-L105 HydrophobicContact CD2-CD1 4.4Å; L102-L105 PolarHBondContact O-N 2.68Å; D103-L105 VanDerWaalsContact C-N 3.28Å; D103-L105 PolarHBondContact O-N 2.87Å; L105-F107 HydrophobicContact CB-CD2 4.01Å; L105-F107 HydrophobicContact CB-CE2 4.15Å; L105-F107 HydrophobicContact CD1-CE2 4.43Å; L105-Q326 HydrophobicContact CD1-CB 4.45Å; L105-Q326 HydrophobicContact CD1-CG 3.76Å
106	G	96.9	Very high	97.8	Very high	26 Å²	26	31.4 Å²	31.4	27%	0.268	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	9	176.5	0	0	0	0	0	115.4	V80 L102 D103 E104	V80-G106 VanDerWaalsContact CG1-C 3.47Å; L102-G106 PolarHBondContact O-N 3.03Å; D103-G106 WeakPolarHBondContact O-CA 3.39Å; D103-G106 PolarHBondContact O-N 2.85Å; E104-G106 PolarHBondContact O-N 3.09Å
107	F	98	Very high	97.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.			trans	-67.8	153.8	174	-72	-87.8	0	0	0	110.9	V80 K83 V85 L102 L105 V109 I329	V80-F107 HydrophobicContact CB-CE1 4.5Å; V80-F107 HydrophobicContact CB-CE2 4.24Å; V80-F107 HydrophobicContact CB-CZ 4.21Å; V80-F107 HydrophobicContact CG1-CB 4.26Å; V80-F107 HydrophobicContact CG1-CD1 3.75Å; V80-F107 HydrophobicContact CG1-CD2 3.45Å; V80-F107 VanDerWaalsContact CG1-CD2 3.45Å; V80-F107 HydrophobicContact CG1-CE1 3.86Å; V80-F107 HydrophobicContact CG1-CE2 3.57Å; V80-F107 HydrophobicContact CG1-CG 3.55Å; V80-F107 HydrophobicContact CG1-CZ 3.78Å; V80-F107 HydrophobicContact CG2-CD2 4.38Å; V80-F107 HydrophobicContact CG2-CE1 4.47Å; V80-F107 HydrophobicContact CG2-CE2 3.67Å; V80-F107 HydrophobicContact CG2-CZ 3.72Å; K83-F107 HydrophobicContact CB-CD1 3.76Å; K83-F107 HydrophobicContact CB-CE1 3.8Å; K83-F107 HydrophobicContact CD-CE1 4.15Å; V85-F107 HydrophobicContact CG2-CB 4.3Å; V85-F107 HydrophobicContact CG2-CD1 3.53Å; V85-F107 HydrophobicContact CG2-CE1 4.08Å; V85-F107 HydrophobicContact CG2-CG 4.04Å; L102-F107 HydrophobicContact CB-CB 4.31Å; L102-F107 HydrophobicContact CB-CD2 4.2Å; L102-F107 HydrophobicContact CD2-CD2 3.93Å; L102-F107 HydrophobicContact CD2-CE2 4.06Å; L102-F107 WeakPolarHBondContact O-CB 3.27Å; L102-F107 WeakPolarHBondContact O-CD2 3.3Å; L102-F107 PolarHBondContact O-N 2.99Å; L105-F107 HydrophobicContact CB-CD2 4.01Å; L105-F107 HydrophobicContact CB-CE2 4.15Å; L105-F107 HydrophobicContact CD1-CE2 4.43Å; F107-V109 HydrophobicContact CB-CG2 4.08Å; F107-I329 HydrophobicContact CE1-CD1 3.98Å; F107-I329 HydrophobicContact CE2-CD1 3.98Å; F107-I329 HydrophobicContact CZ-CD1 3.65Å; F107-I329 HydrophobicContact CZ-CG1 4.14Å
108	T	98.1	Very high	97.7	Very high	29 Å²	29	35.7 Å²	35.7	18%	0.178	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.7	158.2	-58.1	0	0	0	0	107.9	K83 A84 V85 F110 R131	K83-T108 PolarHBondContact O-N 3.02Å; A84-T108 CarbonylContact C-O 3.56Å; A84-T108 VanDerWaalsContact CA-O 3.22Å; A84-T108 WeakPolarHBondContact CA-O 3.26Å; A84-T108 HydrophobicContact CB-CG2 4.27Å; V85-T108 PolarHBondContact N-O 3.16Å; T108-F110 HydrophobicContact CG2-CE2 4.18Å; T108-F110 HydrophobicContact CG2-CZ 4.18Å; T108-R131 WeakPolarHBondContact CA-O 3.37Å; T108-R131 WeakPolarHBondContact CG2-O 3.1Å
109	V	98.6	Very high	97.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.9	-172	-179.2	0	0	0	0	110	V85 C99 L102 D103 F107 R131 L132 S133	V85-V109 WeakPolarHBondContact O-CA 3.42Å; C99-V109 HydrophobicContact CB-CG1 4.16Å; L102-V109 HydrophobicContact CB-CG2 3.71Å; D103-V109 HydrophobicContact CB-CG2 4.31Å; F107-V109 HydrophobicContact CB-CG2 4.08Å; V109-R131 PolarHBondContact N-O 3.08Å; V109-L132 HydrophobicContact CB-CB 4.28Å; V109-L132 HydrophobicContact CB-CD1 4.01Å; V109-L132 HydrophobicContact CB-CG 4.05Å; V109-L132 HydrophobicContact CG1-CD1 3.86Å; V109-L132 HydrophobicContact CG1-CG 4.18Å; V109-L132 CarbonylContact O-C 3.42Å; V109-L132 VanDerWaalsContact O-CA 3.29Å; V109-L132 WeakPolarHBondContact O-CA 3.21Å; V109-S133 PolarHBondContact O-N 3.42Å
110	F	98.8	Very high	97.4	Very high	1 Å²	1	42 Å²	42	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.1	167.2	-63.5	-71.2	0	0	0	108.3	A84 V85 L86 V87 T108 G112 S133 L135 V152 M155 L156 L161	A84-F110 HydrophobicContact CB-CD2 4.42Å; A84-F110 HydrophobicContact CB-CE2 3.9Å; V85-F110 PolarHBondContact O-N 3.45Å; L86-F110 WeakPolarHBondContact CA-O 3.36Å; L86-F110 HydrophobicContact CB-CB 4.45Å; L86-F110 HydrophobicContact CD1-CB 3.77Å; V87-F110 PolarHBondContact N-O 3.44Å; T108-F110 HydrophobicContact CG2-CE2 4.18Å; T108-F110 HydrophobicContact CG2-CZ 4.18Å; F110-G112 PolarHBondContact O-N 2.9Å; F110-S133 CarbonylContact C-O 3.56Å; F110-S133 WeakPolarHBondContact CA-O 3.36Å; F110-L135 HydrophobicContact CB-CD1 3.85Å; F110-L135 HydrophobicContact CD1-CD1 4.08Å; F110-L135 HydrophobicContact CG-CD1 4.29Å; F110-V152 HydrophobicContact CB-CG2 4.21Å; F110-V152 HydrophobicContact CD1-CG2 3.85Å; F110-V152 HydrophobicContact CD2-CG1 4.03Å; F110-V152 HydrophobicContact CD2-CG2 4Å; F110-V152 HydrophobicContact CE1-CG2 4.2Å; F110-V152 HydrophobicContact CE2-CG1 3.87Å; F110-V152 HydrophobicContact CE2-CG2 4.32Å; F110-V152 HydrophobicContact CG-CG2 3.74Å; F110-V152 HydrophobicContact CZ-CG1 4.32Å; F110-V152 HydrophobicContact CZ-CG2 4.42Å; F110-M155 HydrophobicContact CE1-CB 4.41Å; F110-M155 HydrophobicContact CE1-CE 3.93Å; F110-M155 HydrophobicContact CE1-SD 3.6Å; F110-M155 HydrophobicContact CZ-CB 4.08Å; F110-M155 HydrophobicContact CZ-CE 4.35Å; F110-M155 HydrophobicContact CZ-SD 4.21Å; F110-L156 HydrophobicContact CE2-CD1 3.93Å; F110-L156 HydrophobicContact CE2-CD2 4.01Å; F110-L156 HydrophobicContact CE2-CG 4.04Å; F110-L156 HydrophobicContact CZ-CD2 4.23Å; F110-L156 HydrophobicContact CZ-CG 4.26Å; F110-L161 HydrophobicContact CD2-CD1 4.17Å; F110-L161 HydrophobicContact CE2-CD1 4.44Å
111	A	98.8	Very high	97.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	100.7	179.1	0	0	0	0	0	109.6	C99 V113 L124 L132 S133 V134 L135	C99-A111 HydrophobicContact CB-CB 4.44Å; A111-V113 PolarHBondContact O-N 2.86Å; A111-L124 HydrophobicContact CB-CD1 3.73Å; A111-L132 HydrophobicContact CB-CD2 4.41Å; A111-S133 PolarHBondContact N-O 2.92Å; A111-V134 WeakPolarHBondContact O-CA 3.3Å; A111-L135 PolarHBondContact O-N 3.32Å
112	G	98.6	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	115.1	171.1	0	0	0	0	0	110.5	V87 G89 G90 F110 L135	V87-G112 WeakPolarHBondContact O-CA 3.47Å; V87-G112 PolarHBondContact O-N 2.89Å; G89-G112 PolarHBondContact N-O 3.47Å; G90-G112 PolarHBondContact N-O 2.69Å; F110-G112 PolarHBondContact O-N 2.9Å; G112-L135 WeakPolarHBondContact CA-O 3.32Å
113	V	98.2	Very high	97.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.3	-175.1	-60.3	0	0	0	0	111.4	D91 A111 E116 A121 V134 L135 M137	D91-V113 HydrophobicContact CB-CB 4.11Å; D91-V113 HydrophobicContact CB-CG1 4.25Å; A111-V113 PolarHBondContact O-N 2.86Å; V113-E116 HydrophobicContact CG2-CB 4.17Å; V113-A121 HydrophobicContact CG2-CB 4.15Å; V113-V134 HydrophobicContact CB-CG1 4.44Å; V113-V134 HydrophobicContact CG1-CG1 4.14Å; V113-V134 HydrophobicContact CG2-CG1 3.41Å; V113-V134 VanDerWaalsContact CG2-CG1 3.41Å; V113-L135 PolarHBondContact N-O 2.91Å; V113-M137 PolarHBondContact O-N 3.41Å
114	L	95.4	Very high	97.3	Very high	98 Å²	98	44.8 Å²	44.8	51%	0.513	25%	0.245	S	C	.	.	S	Bend	trans	-67.5	-32.5	177.3	-76.4	172.6	0	0	0	113.9	Q136 D138	L114-Q136 PolarHBondContact O-NE2 2.83Å; L114-Q136 PolarHBondContact O-OE1 2.92Å; L114-D138 HydrophobicContact CD2-CB 4.18Å
115	N	95.8	Very high	97.4	Very high	85 Å²	85	42.8 Å²	42.8	46%	0.455	23%	0.231	S	C	.	.			trans	-138.4	109.2	175.7	179.3	3	0	0	0	108.8	N117 G118	N115-N117 PolarHBondContact O-N 2.86Å; N115-N117 PolarHBondContact OD1-N 2.75Å; N115-G118 PolarHBondContact O-N 2.82Å; N115-G118 PolarHBondContact OD1-N 2.83Å
116	E	96.7	Very high	97.4	Very high	60 Å²	60	48.9 Å²	48.9	28%	0.28	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.1	-180	70.2	-179	-178.5	0	0	113.7	V113 A121 R125 V134 Q136	V113-E116 HydrophobicContact CG2-CB 4.17Å; E116-A121 VanDerWaalsContact O-CB 3.25Å; E116-A121 WeakPolarHBondContact O-CB 3.4Å; E116-R125 PolarHBondContact O-NH1 2.86Å; E116-R125 PolarHBondContact O-NH2 3.49Å; E116-V134 HydrophobicContact CB-CG1 4.21Å; E116-Q136 HydrophobicContact CB-CB 4.09Å; E116-Q136 HydrophobicContact CG-CB 4.08Å; E116-Q136 WeakPolarHBondContact OE2-CB 3.41Å
117	N	97.1	Very high	97.5	Very high	129 Å²	129	50.4 Å²	50.4	69%	0.69	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	9.6	174.5	-58.5	-45	0	0	0	112.1	N115	N115-N117 PolarHBondContact O-N 2.86Å; N115-N117 PolarHBondContact OD1-N 2.75Å
118	G	96.1	Very high	97.4	Very high	7 Å²	7	51.4 Å²	51.4	7%	0.072	26%	0.261	C	S	.	.	S	Bend	trans	-77.6	165.7	178.6	0	0	0	0	0	113.2	N115 G120 A121 E122	N115-G118 PolarHBondContact O-N 2.82Å; N115-G118 PolarHBondContact OD1-N 2.83Å; G118-G120 PolarHBondContact O-N 2.94Å; G118-A121 WeakPolarHBondContact O-CB 3.38Å; G118-A121 PolarHBondContact O-N 3.32Å; G118-E122 PolarHBondContact O-N 2.97Å
119	P	96.1	Very high	97.4	Very high	120 Å²	120	51.4 Å²	51.4	78%	0.779	26%	0.263	S	S	*	.	H	α-helix	trans	-62.1	-39.7	-175.7	23.6	-33.6	0	0	0	113.4	E122 E123	P119-E122 PolarHBondContact O-N 2.72Å; P119-E123 PolarHBondContact O-N 2.95Å
120	G	95.9	Very high	97.3	Very high	12 Å²	12	57.8 Å²	57.8	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-68.2	-36.6	177.3	0	0	0	0	0	113.1	D91 H96 G118 E122 E123 L124	D91-G120 WeakPolarHBondContact O-CA 3.38Å; H96-G120 PolarHBondContact NE2-O 3.03Å; G118-G120 PolarHBondContact O-N 2.94Å; G120-E122 VanDerWaalsContact C-N 3.34Å; G120-E123 PolarHBondContact O-N 2.87Å; G120-L124 WeakPolarHBondContact O-CG 3.37Å; G120-L124 PolarHBondContact O-N 3.15Å
121	A	97.6	Very high	97.2	Very high	1 Å²	1	63 Å²	63	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-42.3	173.1	0	0	0	0	0	111.6	V113 E116 G118 L124 R125 V134	V113-A121 HydrophobicContact CG2-CB 4.15Å; E116-A121 VanDerWaalsContact O-CB 3.25Å; E116-A121 WeakPolarHBondContact O-CB 3.4Å; G118-A121 WeakPolarHBondContact O-CB 3.38Å; G118-A121 PolarHBondContact O-N 3.32Å; A121-L124 PolarHBondContact O-N 3.42Å; A121-R125 WeakPolarHBondContact O-CG 3.32Å; A121-R125 PolarHBondContact O-N 2.89Å; A121-R125 VanDerWaalsContact O-N 3.12Å; A121-V134 HydrophobicContact CB-CG1 3.91Å
122	E	97.7	Very high	97.1	Very high	102 Å²	102	63.8 Å²	63.8	48%	0.477	33%	0.328	S	S	.	.	H	α-helix	trans	-68.1	-39.3	177.7	-170.2	55.1	-155.1	0	0	112.5	G118 P119 G120 L124 R125 R126	G118-E122 PolarHBondContact O-N 2.97Å; P119-E122 PolarHBondContact O-N 2.72Å; G120-E122 VanDerWaalsContact C-N 3.34Å; E122-L124 VanDerWaalsContact C-N 3.34Å; E122-L124 PolarHBondContact O-N 2.9Å; E122-R125 PolarHBondContact O-N 3.27Å; E122-R125 IonicContact OE2-NH1 2.84Å; E122-R125 PolarHBondContact OE2-NH1 2.82Å; E122-R126 WeakPolarHBondContact O-CB 3.3Å; E122-R126 PolarHBondContact O-N 3.28Å
123	E	97.9	Very high	97.1	Very high	71 Å²	71	65.2 Å²	65.2	33%	0.332	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-44	173.7	-167.2	-166.6	147.7	0	0	111.6	H96 K100 P119 G120 R125 R126 T127	H96-E123 VanDerWaalsContact CE1-CD 3.47Å; H96-E123 IonicContact CE1-OE1 3.87Å; H96-E123 PolarHBondContact CE1-OE1 3.24Å; H96-E123 IonicContact CE1-OE2 3.49Å; H96-E123 PolarHBondContact CE1-OE2 2.84Å; H96-E123 IonicContact NE2-OE2 3.08Å; K100-E123 IonicContact NZ-OE1 3.48Å; K100-E123 PolarHBondContact NZ-OE1 3.46Å; P119-E123 PolarHBondContact O-N 2.95Å; G120-E123 PolarHBondContact O-N 2.87Å; E123-R125 PolarHBondContact O-N 3.08Å; E123-R126 PolarHBondContact O-N 3.04Å; E123-T127 HydrophobicContact CG-CG2 4.15Å; E123-T127 WeakPolarHBondContact O-CB 3.44Å; E123-T127 WeakPolarHBondContact O-CG2 3.09Å; E123-T127 PolarHBondContact O-N 3.43Å; E123-T127 PolarHBondContact O-OG1 2.95Å
124	L	98.3	Very high	97.1	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-58.6	-47.6	175.8	-72.1	177.1	0	0	0	111.5	G90 C99 K100 A111 G120 A121 E122 R126 T127 C128 L132 V134	G90-L124 WeakPolarHBondContact O-CD1 3.5Å; C99-L124 HydrophobicContact CB-CD1 4.36Å; C99-L124 HydrophobicContact CB-CD2 3.88Å; K100-L124 HydrophobicContact CD-CD2 4.4Å; K100-L124 HydrophobicContact CG-CD2 3.73Å; A111-L124 HydrophobicContact CB-CD1 3.73Å; G120-L124 WeakPolarHBondContact O-CG 3.37Å; G120-L124 PolarHBondContact O-N 3.15Å; A121-L124 PolarHBondContact O-N 3.42Å; E122-L124 VanDerWaalsContact C-N 3.34Å; E122-L124 PolarHBondContact O-N 2.9Å; L124-R126 VanDerWaalsContact C-N 3.29Å; L124-R126 PolarHBondContact O-N 3.27Å; L124-T127 PolarHBondContact O-N 2.75Å; L124-C128 VanDerWaalsContact O-CB 3.23Å; L124-C128 WeakPolarHBondContact O-CB 3.24Å; L124-C128 PolarHBondContact O-N 3.24Å; L124-L132 HydrophobicContact CB-CD2 3.96Å; L124-L132 HydrophobicContact CD2-CD1 4.26Å; L124-V134 HydrophobicContact CB-CG2 4.19Å; L124-V134 HydrophobicContact CD1-CG2 4.46Å
125	R	97.8	Very high	97.3	Very high	102 Å²	102	61.9 Å²	61.9	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-38.3	177.7	-69.5	-173.7	-168.9	100.8	3.8	112.7	E116 A121 E122 E123 V134	E116-R125 PolarHBondContact O-NH1 2.86Å; E116-R125 PolarHBondContact O-NH2 3.49Å; A121-R125 WeakPolarHBondContact O-CG 3.32Å; A121-R125 PolarHBondContact O-N 2.89Å; A121-R125 VanDerWaalsContact O-N 3.12Å; E122-R125 PolarHBondContact O-N 3.27Å; E122-R125 IonicContact OE2-NH1 2.84Å; E122-R125 PolarHBondContact OE2-NH1 2.82Å; E123-R125 PolarHBondContact O-N 3.08Å; R125-V134 HydrophobicContact CG-CG2 3.95Å
126	R	97.6	Very high	97.4	Very high	183 Å²	183	59.9 Å²	59.9	69%	0.691	31%	0.309	S	S	*	.	H	α-helix	trans	-75.3	-33.6	-177.4	-172.6	-178.6	63.3	78	1.5	113	E122 E123 L124	E122-R126 WeakPolarHBondContact O-CB 3.3Å; E122-R126 PolarHBondContact O-N 3.28Å; E123-R126 PolarHBondContact O-N 3.04Å; L124-R126 VanDerWaalsContact C-N 3.29Å; L124-R126 PolarHBondContact O-N 3.27Å
127	T	97.7	Very high	97.5	Very high	58 Å²	58	57.2 Å²	57.2	36%	0.356	30%	0.297	S	S	.	.	H	α-helix	trans	-106.1	-23.7	-168.5	59.8	0	0	0	0	114.4	E123 L124	E123-T127 HydrophobicContact CG-CG2 4.15Å; E123-T127 WeakPolarHBondContact O-CB 3.44Å; E123-T127 WeakPolarHBondContact O-CG2 3.09Å; E123-T127 PolarHBondContact O-N 3.43Å; E123-T127 PolarHBondContact O-OG1 2.95Å; L124-T127 PolarHBondContact O-N 2.75Å
128	C	97.9	Very high	97.5	Very high	21 Å²	21	52.3 Å²	52.3	14%	0.142	27%	0.27	C	S	.	.	S	Bend	trans	-93	163.9	-180	-65.4	0	0	0	0	112.4	D103 L124 L132	D103-C128 HydrophobicContact CB-CB 4.33Å; D103-C128 WeakPolarHBondContact OD2-CA 3.48Å; D103-C128 WeakPolarHBondContact OD2-CB 3.26Å; L124-C128 VanDerWaalsContact O-CB 3.23Å; L124-C128 WeakPolarHBondContact O-CB 3.24Å; L124-C128 PolarHBondContact O-N 3.24Å; C128-L132 HydrophobicContact CB-CB 3.77Å; C128-L132 HydrophobicContact CB-CD1 3.85Å; C128-L132 HydrophobicContact CB-CD2 4.37Å; C128-L132 HydrophobicContact CB-CG 4.2Å
129	S	97.3	Very high	97.6	Very high	30 Å²	30	52.4 Å²	52.4	21%	0.21	27%	0.269	C	S	.	.			trans	-70.4	168.2	177.8	89.5	0	0	0	0	112.2	D103 R131 L132	D103-S129 WeakPolarHBondContact OD1-CB 3.34Å; D103-S129 PolarHBondContact OD1-OG 2.81Å; D103-S129 PolarHBondContact OD2-N 3.32Å; S129-R131 PolarHBondContact O-N 2.82Å; S129-R131 WeakPolarHBondContact OG-CB 3.28Å; S129-R131 PolarHBondContact OG-N 3.35Å; S129-R131 PolarHBondContact OG-NH2 3.42Å; S129-L132 PolarHBondContact O-N 2.84Å
130	P	96.6	Very high	97.7	Very high	134 Å²	134	49.5 Å²	49.5	87%	0.87	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-10	173.8	-24.3	35	0	0	0	115.1	L132	P130-L132 VanDerWaalsContact C-N 3.28Å
131	R	95.7	Very high	97.9	Very high	110 Å²	110	53.7 Å²	53.7	42%	0.415	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-13.9	174.7	-62.4	-175.7	-62.9	-85.6	-3.4	112.8	D103 T108 V109 S129	D103-R131 PolarHBondContact O-NH2 2.85Å; D103-R131 VanDerWaalsContact O-NH2 3.13Å; T108-R131 WeakPolarHBondContact CA-O 3.37Å; T108-R131 WeakPolarHBondContact CG2-O 3.1Å; V109-R131 PolarHBondContact N-O 3.08Å; S129-R131 PolarHBondContact O-N 2.82Å; S129-R131 WeakPolarHBondContact OG-CB 3.28Å; S129-R131 PolarHBondContact OG-N 3.35Å; S129-R131 PolarHBondContact OG-NH2 3.42Å
132	L	97.9	Very high	97.9	Very high	17 Å²	17	56.5 Å²	56.5	9%	0.089	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.7	173.3	-173.5	147.3	0	0	0	110.5	C99 D103 V109 A111 L124 C128 S129 P130 V134	C99-L132 HydrophobicContact CB-CD1 3.93Å; D103-L132 HydrophobicContact CB-CD1 4.41Å; V109-L132 HydrophobicContact CB-CB 4.28Å; V109-L132 HydrophobicContact CB-CD1 4.01Å; V109-L132 HydrophobicContact CB-CG 4.05Å; V109-L132 HydrophobicContact CG1-CD1 3.86Å; V109-L132 HydrophobicContact CG1-CG 4.18Å; V109-L132 CarbonylContact O-C 3.42Å; V109-L132 VanDerWaalsContact O-CA 3.29Å; V109-L132 WeakPolarHBondContact O-CA 3.21Å; A111-L132 HydrophobicContact CB-CD2 4.41Å; L124-L132 HydrophobicContact CB-CD2 3.96Å; L124-L132 HydrophobicContact CD2-CD1 4.26Å; C128-L132 HydrophobicContact CB-CB 3.77Å; C128-L132 HydrophobicContact CB-CD1 3.85Å; C128-L132 HydrophobicContact CB-CD2 4.37Å; C128-L132 HydrophobicContact CB-CG 4.2Å; S129-L132 PolarHBondContact O-N 2.84Å; P130-L132 VanDerWaalsContact C-N 3.28Å; L132-V134 HydrophobicContact CD2-CG2 4.03Å
133	S	98.1	Very high	97.9	Very high	30 Å²	30	56.5 Å²	56.5	21%	0.21	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.7	175.3	-66	0	0	0	0	110.3	V109 F110 A111	V109-S133 PolarHBondContact O-N 3.42Å; F110-S133 CarbonylContact C-O 3.56Å; F110-S133 WeakPolarHBondContact CA-O 3.36Å; A111-S133 PolarHBondContact N-O 2.92Å
134	V	98.6	Very high	98	Very high	21 Å²	21	55 Å²	55	13%	0.127	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.5	175.3	176.7	0	0	0	0	110	A111 V113 E116 A121 L124 R125 L132	A111-V134 WeakPolarHBondContact O-CA 3.3Å; V113-V134 HydrophobicContact CB-CG1 4.44Å; V113-V134 HydrophobicContact CG1-CG1 4.14Å; V113-V134 HydrophobicContact CG2-CG1 3.41Å; V113-V134 VanDerWaalsContact CG2-CG1 3.41Å; E116-V134 HydrophobicContact CB-CG1 4.21Å; A121-V134 HydrophobicContact CB-CG1 3.91Å; L124-V134 HydrophobicContact CB-CG2 4.19Å; L124-V134 HydrophobicContact CD1-CG2 4.46Å; R125-V134 HydrophobicContact CG-CG2 3.95Å; L132-V134 HydrophobicContact CD2-CG2 4.03Å
135	L	98.4	Very high	98	Very high	7 Å²	7	55 Å²	55	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.5	178.4	-57.7	175.9	0	0	0	110.3	L86 F110 A111 G112 V113 M137 A148 K151 V152	L86-L135 HydrophobicContact CD1-CD1 4.27Å; F110-L135 HydrophobicContact CB-CD1 3.85Å; F110-L135 HydrophobicContact CD1-CD1 4.08Å; F110-L135 HydrophobicContact CG-CD1 4.29Å; A111-L135 PolarHBondContact O-N 3.32Å; G112-L135 WeakPolarHBondContact CA-O 3.32Å; V113-L135 PolarHBondContact N-O 2.91Å; L135-M137 PolarHBondContact O-N 3.34Å; L135-M137 VanDerWaalsContact O-N 3.14Å; L135-A148 HydrophobicContact CD1-CB 4.24Å; L135-K151 HydrophobicContact CD2-CB 4.14Å; L135-K151 HydrophobicContact CD2-CD 3.87Å; L135-V152 HydrophobicContact CD1-CG2 3.55Å
136	Q	98.4	Very high	98	Very high	43 Å²	43	56 Å²	56	20%	0.201	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	114.2	164.8	178.9	58.9	51.7	0	0	110.2	L114 E116	L114-Q136 PolarHBondContact O-NE2 2.83Å; L114-Q136 PolarHBondContact O-OE1 2.92Å; E116-Q136 HydrophobicContact CB-CB 4.09Å; E116-Q136 HydrophobicContact CG-CB 4.08Å; E116-Q136 WeakPolarHBondContact OE2-CB 3.41Å
137	M	98.3	Very high	98.1	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.02	28%	0.278	C	S	.	.			trans	-154.9	86.9	-173.8	-166.6	177.9	-174.4	0	0	112.4	L86 T88 V113 L135 I145 A148 V199 F203	L86-M137 HydrophobicContact CD1-SD 4.32Å; L86-M137 HydrophobicContact CD2-CE 4.43Å; L86-M137 HydrophobicContact CD2-SD 4.5Å; T88-M137 HydrophobicContact CG2-CE 4.31Å; T88-M137 HydrophobicContact CG2-SD 4.17Å; V113-M137 PolarHBondContact O-N 3.41Å; L135-M137 PolarHBondContact O-N 3.34Å; L135-M137 VanDerWaalsContact O-N 3.14Å; M137-I145 HydrophobicContact CE-CB 4.2Å; M137-I145 HydrophobicContact CE-CG1 4.02Å; M137-I145 HydrophobicContact CE-CG2 3.87Å; M137-A148 HydrophobicContact CB-CB 4.47Å; M137-A148 HydrophobicContact CE-CB 4.47Å; M137-A148 HydrophobicContact CG-CB 4.2Å; M137-A148 HydrophobicContact SD-CB 3.96Å; M137-V199 HydrophobicContact CE-CB 4.31Å; M137-V199 HydrophobicContact CE-CG1 3.91Å; M137-V199 HydrophobicContact CE-CG2 3.5Å; M137-F203 HydrophobicContact CE-CE2 3.76Å; M137-F203 HydrophobicContact CE-CZ 4.39Å
138	D	98.3	Very high	98.1	Very high	25 Å²	25	48.7 Å²	48.7	13%	0.134	26%	0.262	C	S	.	.			trans	-79.2	114	162.6	-176.5	-15.1	0	0	0	109.8	L114 T140 K141	L114-D138 HydrophobicContact CD2-CB 4.18Å; D138-T140 VanDerWaalsContact CG-OG1 3.26Å; D138-T140 PolarHBondContact O-N 3.04Å; D138-T140 VanDerWaalsContact O-N 3.09Å; D138-T140 WeakPolarHBondContact OD1-CB 3.26Å; D138-T140 PolarHBondContact OD1-N 3.18Å; D138-T140 PolarHBondContact OD1-OG1 3.06Å; D138-T140 PolarHBondContact OD2-OG1 2.94Å; D138-K141 HydrophobicContact CB-CB 4.24Å; D138-K141 HydrophobicContact CB-CD 3.97Å; D138-K141 HydrophobicContact CB-CG 4.1Å; D138-K141 PolarHBondContact O-N 3.46Å; D138-K141 WeakPolarHBondContact OD2-CD 3.33Å; D138-K141 WeakPolarHBondContact OD2-CE 3.21Å; D138-K141 IonicContact OD2-NZ 3.42Å; D138-K141 PolarHBondContact OD2-NZ 3.47Å
139	V	98.5	Very high	98.2	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.055	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.8	-177.5	-58.4	0	0	0	0	113.5	T88 I145 A168 V191 G195 V199	T88-V139 HydrophobicContact CG2-CG1 4.17Å; V139-I145 WeakPolarHBondContact O-CD1 3.42Å; V139-A168 HydrophobicContact CG1-CB 3.94Å; V139-A168 HydrophobicContact CG2-CB 4.14Å; V139-V191 HydrophobicContact CG2-CG1 3.93Å; V139-G195 VanDerWaalsContact O-CA 3.29Å; V139-G195 WeakPolarHBondContact O-CA 3.46Å; V139-V199 HydrophobicContact CB-CG2 4.3Å; V139-V199 HydrophobicContact CG1-CG2 3.92Å
140	T	98.3	Very high	98.2	Very high	59 Å²	59	52.7 Å²	52.7	36%	0.362	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.3	172.9	70.9	0	0	0	0	113	D138 P142 A190 V191	D138-T140 VanDerWaalsContact CG-OG1 3.26Å; D138-T140 PolarHBondContact O-N 3.04Å; D138-T140 VanDerWaalsContact O-N 3.09Å; D138-T140 WeakPolarHBondContact OD1-CB 3.26Å; D138-T140 PolarHBondContact OD1-N 3.18Å; D138-T140 PolarHBondContact OD1-OG1 3.06Å; D138-T140 PolarHBondContact OD2-OG1 2.94Å; T140-P142 WeakPolarHBondContact O-CD 3.19Å; T140-A190 HydrophobicContact CG2-CB 4.41Å; T140-V191 HydrophobicContact CG2-CB 4.49Å; T140-V191 HydrophobicContact CG2-CG2 3.68Å
141	K	98.6	Very high	98.3	Very high	101 Å²	101	51.1 Å²	51.1	44%	0.439	26%	0.26	S	S	.	.			trans	-114.6	98.8	-176.3	-65	-178.5	-175.3	162.8	0	110.8	D138 V143 Q144 I145	D138-K141 HydrophobicContact CB-CB 4.24Å; D138-K141 HydrophobicContact CB-CD 3.97Å; D138-K141 HydrophobicContact CB-CG 4.1Å; D138-K141 PolarHBondContact O-N 3.46Å; D138-K141 WeakPolarHBondContact OD2-CD 3.33Å; D138-K141 WeakPolarHBondContact OD2-CE 3.21Å; D138-K141 IonicContact OD2-NZ 3.42Å; D138-K141 PolarHBondContact OD2-NZ 3.47Å; K141-V143 PolarHBondContact O-N 3.41Å; K141-Q144 HydrophobicContact CB-CB 4.28Å; K141-Q144 HydrophobicContact CB-CG 4.09Å; K141-Q144 HydrophobicContact CD-CG 4.46Å; K141-Q144 PolarHBondContact O-N 3.09Å; K141-I145 PolarHBondContact O-N 3.22Å
142	P	98.2	Very high	98.4	Very high	60 Å²	60	45.9 Å²	45.9	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-55	-31.5	-178.1	-28.8	35.7	0	0	0	114.6	T140 I145 K146	T140-P142 WeakPolarHBondContact O-CD 3.19Å; P142-I145 PolarHBondContact O-N 3.49Å; P142-K146 WeakPolarHBondContact O-CG 3.45Å; P142-K146 PolarHBondContact O-N 2.92Å
143	V	98.5	Very high	98.4	Very high	101 Å²	101	46.2 Å²	46.2	61%	0.612	25%	0.246	S	C	*	.	H	α-helix	trans	-62.5	-48.3	176.3	-179.8	0	0	0	0	110.9	K141 I145 K146 D147	K141-V143 PolarHBondContact O-N 3.41Å; V143-I145 VanDerWaalsContact C-N 3.32Å; V143-I145 PolarHBondContact O-N 3Å; V143-K146 PolarHBondContact O-N 2.96Å; V143-D147 VanDerWaalsContact O-CG 3.26Å; V143-D147 PolarHBondContact O-N 2.91Å
144	Q	98.6	Very high	98.4	Very high	40 Å²	40	48.2 Å²	48.2	19%	0.187	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-35.2	179.1	-63.3	-167.6	8.3	0	0	112.1	K141 D147 A148	K141-Q144 HydrophobicContact CB-CB 4.28Å; K141-Q144 HydrophobicContact CB-CG 4.09Å; K141-Q144 HydrophobicContact CD-CG 4.46Å; K141-Q144 PolarHBondContact O-N 3.09Å; Q144-D147 PolarHBondContact O-N 2.91Å; Q144-A148 WeakPolarHBondContact O-CB 3.28Å; Q144-A148 PolarHBondContact O-N 3.13Å
145	I	98.8	Very high	98.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-43.5	174.8	-60.1	172.6	0	0	0	110.6	M137 V139 K141 P142 V143 Y149 E198 V199 T202 F203	M137-I145 HydrophobicContact CE-CB 4.2Å; M137-I145 HydrophobicContact CE-CG1 4.02Å; M137-I145 HydrophobicContact CE-CG2 3.87Å; V139-I145 WeakPolarHBondContact O-CD1 3.42Å; K141-I145 PolarHBondContact O-N 3.22Å; P142-I145 PolarHBondContact O-N 3.49Å; V143-I145 VanDerWaalsContact C-N 3.32Å; V143-I145 PolarHBondContact O-N 3Å; I145-Y149 WeakPolarHBondContact O-CB 3.29Å; I145-Y149 PolarHBondContact O-N 2.72Å; I145-E198 HydrophobicContact CD1-CB 3.94Å; I145-E198 HydrophobicContact CD1-CG 3.6Å; I145-V199 HydrophobicContact CD1-CG2 3.95Å; I145-V199 HydrophobicContact CG1-CG2 4.21Å; I145-V199 HydrophobicContact CG2-CG2 4.2Å; I145-T202 HydrophobicContact CG2-CG2 3.95Å; I145-F203 HydrophobicContact CG2-CE2 4.25Å
146	K	98.7	Very high	98.2	Very high	124 Å²	124	51.4 Å²	51.4	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-67.1	-39.4	176.8	-73.9	175	-178.9	179.2	0	112.4	P142 V143 Y149 S150	P142-K146 WeakPolarHBondContact O-CG 3.45Å; P142-K146 PolarHBondContact O-N 2.92Å; V143-K146 PolarHBondContact O-N 2.96Å; K146-Y149 WeakPolarHBondContact O-CB 3.01Å; K146-Y149 PolarHBondContact O-N 3.27Å; K146-S150 PolarHBondContact O-N 2.8Å; K146-S150 PolarHBondContact O-OG 3.36Å; K146-S150 VanDerWaalsContact O-OG 3.13Å
147	D	98.6	Very high	97.8	Very high	85 Å²	85	56.3 Å²	56.3	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-44.1	176.4	-66.8	-20.5	0	0	0	111.2	V143 Q144 Y149 S150 K151	V143-D147 VanDerWaalsContact O-CG 3.26Å; V143-D147 PolarHBondContact O-N 2.91Å; Q144-D147 PolarHBondContact O-N 2.91Å; D147-Y149 VanDerWaalsContact C-N 3.32Å; D147-Y149 PolarHBondContact O-N 3.36Å; D147-S150 PolarHBondContact O-N 2.8Å; D147-K151 WeakPolarHBondContact O-CG 3.28Å; D147-K151 PolarHBondContact O-N 2.85Å
148	A	98.6	Very high	97.5	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-43.6	173.2	0	0	0	0	0	111.2	L135 M137 Q144 S150 K151 V152 F203	L135-A148 HydrophobicContact CD1-CB 4.24Å; M137-A148 HydrophobicContact CB-CB 4.47Å; M137-A148 HydrophobicContact CE-CB 4.47Å; M137-A148 HydrophobicContact CG-CB 4.2Å; M137-A148 HydrophobicContact SD-CB 3.96Å; Q144-A148 WeakPolarHBondContact O-CB 3.28Å; Q144-A148 PolarHBondContact O-N 3.13Å; A148-S150 PolarHBondContact O-N 3.1Å; A148-K151 PolarHBondContact O-N 3.06Å; A148-V152 VanDerWaalsContact O-CG2 3.28Å; A148-V152 WeakPolarHBondContact O-CG2 3.35Å; A148-V152 PolarHBondContact O-N 3.34Å; A148-F203 HydrophobicContact CB-CZ 4.35Å
149	Y	98.8	Very high	97.2	Very high	63 Å²	63	67 Å²	67	25%	0.247	35%	0.35	C	S	.	.	H	α-helix	trans	-57.5	-47.9	174.5	171.2	-89.3	0	0	0	112.2	I145 K146 D147 K151 V152 A153 T202 F203 L206	I145-Y149 WeakPolarHBondContact O-CB 3.29Å; I145-Y149 PolarHBondContact O-N 2.72Å; K146-Y149 WeakPolarHBondContact O-CB 3.01Å; K146-Y149 PolarHBondContact O-N 3.27Å; D147-Y149 VanDerWaalsContact C-N 3.32Å; D147-Y149 PolarHBondContact O-N 3.36Å; Y149-K151 VanDerWaalsContact C-N 3.34Å; Y149-K151 PolarHBondContact O-N 3.11Å; Y149-V152 PolarHBondContact O-N 2.75Å; Y149-A153 HydrophobicContact CE1-CB 4.34Å; Y149-A153 VanDerWaalsContact O-CB 3.24Å; Y149-A153 WeakPolarHBondContact O-CB 3.47Å; Y149-A153 PolarHBondContact O-N 2.8Å; Y149-T202 HydrophobicContact CD2-CG2 3.97Å; Y149-T202 VanDerWaalsContact CD2-O 3.25Å; Y149-T202 WeakPolarHBondContact CD2-O 3.38Å; Y149-T202 WeakPolarHBondContact CE2-O 3.13Å; Y149-T202 HydrophobicContact CG-CG2 3.9Å; Y149-F203 VanDerWaalsContact CA-CZ 3.48Å; Y149-F203 HydrophobicContact CD2-CD1 4.11Å; Y149-F203 HydrophobicContact CD2-CE1 4.26Å; Y149-F203 HydrophobicContact CD2-CG 4.31Å; Y149-L206 HydrophobicContact CD2-CD1 4Å; Y149-L206 HydrophobicContact CD2-CG 4.42Å; Y149-L206 HydrophobicContact CE2-CD1 3.81Å; Y149-L206 HydrophobicContact CE2-CG 3.73Å
150	S	98.5	Very high	97.1	Very high	71 Å²	71	66.9 Å²	66.9	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-43.5	179.7	-63.4	0	0	0	0	111.9	K146 D147 A148 A153 A154	K146-S150 PolarHBondContact O-N 2.8Å; K146-S150 PolarHBondContact O-OG 3.36Å; K146-S150 VanDerWaalsContact O-OG 3.13Å; D147-S150 PolarHBondContact O-N 2.8Å; A148-S150 PolarHBondContact O-N 3.1Å; S150-A153 PolarHBondContact O-N 2.98Å; S150-A154 WeakPolarHBondContact O-CB 3.2Å; S150-A154 PolarHBondContact O-N 2.83Å
151	K	98.3	Very high	97.1	Very high	101 Å²	101	64 Å²	64	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-48.6	176	-70.3	174.4	-179.6	-179.8	0	111.5	L135 D147 A148 Y149 A154 M155	L135-K151 HydrophobicContact CD2-CB 4.14Å; L135-K151 HydrophobicContact CD2-CD 3.87Å; D147-K151 WeakPolarHBondContact O-CG 3.28Å; D147-K151 PolarHBondContact O-N 2.85Å; A148-K151 PolarHBondContact O-N 3.06Å; Y149-K151 VanDerWaalsContact C-N 3.34Å; Y149-K151 PolarHBondContact O-N 3.11Å; K151-A154 PolarHBondContact O-N 3.24Å; K151-M155 WeakPolarHBondContact O-CG 3.3Å; K151-M155 PolarHBondContact O-N 3Å
152	V	98.4	Very high	97.1	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-44.8	178.9	173.3	0	0	0	0	111.2	F110 L135 A148 Y149 A154 M155 L156 L161 F203 L206	F110-V152 HydrophobicContact CB-CG2 4.21Å; F110-V152 HydrophobicContact CD1-CG2 3.85Å; F110-V152 HydrophobicContact CD2-CG1 4.03Å; F110-V152 HydrophobicContact CD2-CG2 4Å; F110-V152 HydrophobicContact CE1-CG2 4.2Å; F110-V152 HydrophobicContact CE2-CG1 3.87Å; F110-V152 HydrophobicContact CE2-CG2 4.32Å; F110-V152 HydrophobicContact CG-CG2 3.74Å; F110-V152 HydrophobicContact CZ-CG1 4.32Å; F110-V152 HydrophobicContact CZ-CG2 4.42Å; L135-V152 HydrophobicContact CD1-CG2 3.55Å; A148-V152 VanDerWaalsContact O-CG2 3.28Å; A148-V152 WeakPolarHBondContact O-CG2 3.35Å; A148-V152 PolarHBondContact O-N 3.34Å; Y149-V152 PolarHBondContact O-N 2.75Å; V152-A154 VanDerWaalsContact C-N 3.32Å; V152-A154 PolarHBondContact O-N 3.46Å; V152-M155 PolarHBondContact O-N 3.47Å; V152-L156 HydrophobicContact CG1-CD1 3.52Å; V152-L156 HydrophobicContact CG1-CG 4.2Å; V152-L156 WeakPolarHBondContact O-CB 3.5Å; V152-L156 VanDerWaalsContact O-CG 3.32Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 2.86Å; V152-L161 HydrophobicContact CG1-CD1 4.18Å; V152-F203 HydrophobicContact CB-CE1 4.04Å; V152-F203 HydrophobicContact CG1-CE1 4.17Å; V152-F203 HydrophobicContact CG2-CE1 4.08Å; V152-L206 HydrophobicContact CG1-CD1 3.88Å
153	A	98	Very high	97.1	Very high	25 Å²	25	57.7 Å²	57.7	21%	0.207	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-41.2	178.9	0	0	0	0	0	111.8	Y149 S150 M155 L156 Q157 L206	Y149-A153 HydrophobicContact CE1-CB 4.34Å; Y149-A153 VanDerWaalsContact O-CB 3.24Å; Y149-A153 WeakPolarHBondContact O-CB 3.47Å; Y149-A153 PolarHBondContact O-N 2.8Å; S150-A153 PolarHBondContact O-N 2.98Å; A153-M155 PolarHBondContact O-N 3.19Å; A153-L156 PolarHBondContact O-N 3.41Å; A153-Q157 PolarHBondContact O-N 2.93Å; A153-L206 HydrophobicContact CB-CD1 4.29Å; A153-L206 HydrophobicContact CB-CD2 4.18Å
154	A	97.3	Very high	97.2	Very high	72 Å²	72	52.9 Å²	52.9	60%	0.595	27%	0.269	S	S	*	.	H	α-helix	trans	-62.8	-40.8	176.3	0	0	0	0	0	112.5	S150 K151 V152	S150-A154 WeakPolarHBondContact O-CB 3.2Å; S150-A154 PolarHBondContact O-N 2.83Å; K151-A154 PolarHBondContact O-N 3.24Å; V152-A154 VanDerWaalsContact C-N 3.32Å; V152-A154 PolarHBondContact O-N 3.46Å
155	M	95.8	Very high	97.2	Very high	93 Å²	93	51 Å²	51	46%	0.458	26%	0.261	S	S	.	.	H	α-helix	trans	-74.8	-28.7	-179.8	-68	-179.9	70.7	0	0	113.6	F110 K151 V152 A153 R159	F110-M155 HydrophobicContact CE1-CB 4.41Å; F110-M155 HydrophobicContact CE1-CE 3.93Å; F110-M155 HydrophobicContact CE1-SD 3.6Å; F110-M155 HydrophobicContact CZ-CB 4.08Å; F110-M155 HydrophobicContact CZ-CE 4.35Å; F110-M155 HydrophobicContact CZ-SD 4.21Å; K151-M155 WeakPolarHBondContact O-CG 3.3Å; K151-M155 PolarHBondContact O-N 3Å; V152-M155 PolarHBondContact O-N 3.47Å; A153-M155 PolarHBondContact O-N 3.19Å; M155-R159 PolarHBondContact O-NH2 3.36Å
156	L	95.8	Very high	97.2	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-96	-22.9	-177	-62	-179.7	0	0	0	113.8	A84 F110 V152 A153 D158 R159 G160 L161	A84-L156 HydrophobicContact CB-CD1 3.84Å; A84-L156 HydrophobicContact CB-CD2 3.49Å; A84-L156 VanDerWaalsContact CB-CD2 3.49Å; A84-L156 HydrophobicContact CB-CG 4.32Å; F110-L156 HydrophobicContact CE2-CD1 3.93Å; F110-L156 HydrophobicContact CE2-CD2 4.01Å; F110-L156 HydrophobicContact CE2-CG 4.04Å; F110-L156 HydrophobicContact CZ-CD2 4.23Å; F110-L156 HydrophobicContact CZ-CG 4.26Å; V152-L156 HydrophobicContact CG1-CD1 3.52Å; V152-L156 HydrophobicContact CG1-CG 4.2Å; V152-L156 WeakPolarHBondContact O-CB 3.5Å; V152-L156 VanDerWaalsContact O-CG 3.32Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 2.86Å; A153-L156 PolarHBondContact O-N 3.41Å; L156-D158 PolarHBondContact O-N 3.19Å; L156-D158 VanDerWaalsContact O-N 3.15Å; L156-R159 WeakPolarHBondContact O-CB 3.4Å; L156-R159 PolarHBondContact O-N 3.1Å; L156-G160 WeakPolarHBondContact CD1-O 3.29Å; L156-L161 HydrophobicContact CD1-CB 3.91Å; L156-L161 HydrophobicContact CD1-CD1 3.73Å; L156-L161 HydrophobicContact CD1-CG 4.44Å
157	Q	91.5	Very high	97.2	Very high	145 Å²	145	46.2 Å²	46.2	68%	0.678	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	-116.3	-178.3	-56.8	176	-2.9	0	0	110.9	A153 K209	A153-Q157 PolarHBondContact O-N 2.93Å; Q157-K209 PolarHBondContact O-NZ 2.8Å; Q157-K209 VanDerWaalsContact O-NZ 3.08Å
158	D	91.1	Very high	97.1	Very high	134 Å²	134	42.9 Å²	42.9	72%	0.717	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-6.8	-179.1	-71.1	-37.3	0	0	0	115.1	L156 G160 K209	L156-D158 PolarHBondContact O-N 3.19Å; L156-D158 VanDerWaalsContact O-N 3.15Å; D158-G160 PolarHBondContact O-N 2.79Å; D158-K209 IonicContact OD1-NZ 2.81Å; D158-K209 PolarHBondContact OD1-NZ 3.43Å
159	R	92.7	Very high	96.9	Very high	121 Å²	121	44 Å²	44	46%	0.457	24%	0.237	S	C	.	.	S	Bend	trans	-63.9	-29	175.5	-64.4	-175	-69.3	164.1	0.1	112.4	M155 L156	M155-R159 PolarHBondContact O-NH2 3.36Å; L156-R159 WeakPolarHBondContact O-CB 3.4Å; L156-R159 PolarHBondContact O-N 3.1Å
160	G	96.2	Very high	96.7	Very high	5 Å²	5	43.1 Å²	43.1	5%	0.052	24%	0.238	C	C	.	.			trans	71	176.9	-173.1	0	0	0	0	0	112.8	L156 D158 L206	L156-G160 WeakPolarHBondContact CD1-O 3.29Å; D158-G160 PolarHBondContact O-N 2.79Å; G160-L206 WeakPolarHBondContact CA-O 3.39Å
161	L	98.4	Very high	96.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.			trans	-98	126.7	-179.9	-177.9	67.4	0	0	0	108.9	A84 L86 F110 V152 L156 A163 V164 F203 L206 L207 S210	A84-L161 HydrophobicContact CB-CD1 3.88Å; A84-L161 VanDerWaalsContact O-CD1 3.27Å; A84-L161 WeakPolarHBondContact O-CD1 3.39Å; L86-L161 HydrophobicContact CB-CD1 4.44Å; L86-L161 HydrophobicContact CB-CD2 3.89Å; F110-L161 HydrophobicContact CD2-CD1 4.17Å; F110-L161 HydrophobicContact CE2-CD1 4.44Å; V152-L161 HydrophobicContact CG1-CD1 4.18Å; L156-L161 HydrophobicContact CD1-CB 3.91Å; L156-L161 HydrophobicContact CD1-CD1 3.73Å; L156-L161 HydrophobicContact CD1-CG 4.44Å; L161-A163 WeakPolarHBondContact CG-O 3.37Å; L161-V164 HydrophobicContact CD2-CG2 3.47Å; L161-V164 VanDerWaalsContact CD2-CG2 3.47Å; L161-F203 HydrophobicContact CD2-CD1 3.7Å; L161-F203 HydrophobicContact CD2-CE1 4.41Å; L161-F203 HydrophobicContact CD2-CG 4.47Å; L161-L206 HydrophobicContact CB-CB 3.63Å; L161-L206 HydrophobicContact CB-CD1 4.35Å; L161-L206 PolarHBondContact N-O 2.95Å; L161-L206 VanDerWaalsContact N-O 3.08Å; L161-L207 WeakPolarHBondContact O-CD2 3.48Å; L161-S210 WeakPolarHBondContact O-CB 3.34Å; L161-S210 PolarHBondContact O-OG 3.3Å
162	W	98.6	Very high	95.7	Very high	28 Å²	28	36.1 Å²	36.1	11%	0.106	20%	0.202	C	C	.	.	S	Bend	trans	-73.1	-42.7	-177.8	174.3	-108.2	0	0	0	112.2	L78 K83 A84 G212 R213 I329	L78-W162 HydrophobicContact CD1-CH2 3.66Å; L78-W162 HydrophobicContact CD1-CZ2 3.77Å; K83-W162 HydrophobicContact CB-CB 3.71Å; K83-W162 HydrophobicContact CB-CD2 4.49Å; K83-W162 HydrophobicContact CB-CG 3.72Å; K83-W162 HydrophobicContact CD-CD2 3.74Å; K83-W162 HydrophobicContact CD-CE3 4.44Å; K83-W162 HydrophobicContact CD-CG 3.75Å; K83-W162 HydrophobicContact CD-CZ2 4.33Å; K83-W162 HydrophobicContact CG-CB 3.93Å; K83-W162 HydrophobicContact CG-CD2 3.91Å; K83-W162 HydrophobicContact CG-CE3 4.44Å; K83-W162 HydrophobicContact CG-CG 3.65Å; A84-W162 WeakPolarHBondContact O-CA 3.37Å; A84-W162 VanDerWaalsContact O-CB 3.27Å; A84-W162 WeakPolarHBondContact O-CB 3.47Å; A84-W162 PolarHBondContact O-N 2.92Å; W162-G212 CarbonylContact O-C 3.56Å; W162-G212 WeakPolarHBondContact O-CA 3.25Å; W162-R213 HydrophobicContact CZ2-CG 4.07Å; W162-R213 VanDerWaalsContact CZ2-CZ 3.49Å; W162-R213 PolarHBondContact O-N 3.15Å; W162-I329 WeakPolarHBondContact CZ2-O 3.3Å; W162-I329 PolarHBondContact NE1-O 2.95Å
163	A	98.8	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	147.8	179.3	0	0	0	0	0	113.6	A84 V85 L86 L161 R213 I329	A84-A163 PolarHBondContact O-N 2.94Å; V85-A163 CarbonylContact C-O 3.33Å; V85-A163 WeakPolarHBondContact CA-O 3.45Å; V85-A163 HydrophobicContact CB-CB 4.48Å; V85-A163 HydrophobicContact CG1-CB 4.07Å; V85-A163 HydrophobicContact CG2-CB 4.13Å; L86-A163 PolarHBondContact N-O 2.75Å; L161-A163 WeakPolarHBondContact CG-O 3.37Å; A163-R213 CarbonylContact C-O 3.51Å; A163-R213 WeakPolarHBondContact CA-O 3.28Å; A163-R213 HydrophobicContact CB-CB 3.86Å; A163-I329 HydrophobicContact CB-CB 4.35Å; A163-I329 HydrophobicContact CB-CG2 3.86Å
164	V	98.9	Very high	94.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.8	162.7	175.5	0	0	0	0	107.4	L86 L161 V199 F203 L207 R213 L214 V215	L86-V164 HydrophobicContact CB-CG2 4.49Å; L86-V164 HydrophobicContact CD2-CG1 4.35Å; L86-V164 HydrophobicContact CD2-CG2 4.4Å; L161-V164 HydrophobicContact CD2-CG2 3.47Å; L161-V164 VanDerWaalsContact CD2-CG2 3.47Å; V164-V199 HydrophobicContact CG1-CG1 4.01Å; V164-F203 HydrophobicContact CG2-CB 3.74Å; V164-F203 HydrophobicContact CG2-CG 4.32Å; V164-L207 HydrophobicContact CB-CD1 4.36Å; V164-L207 HydrophobicContact CG2-CD1 3.95Å; V164-L207 HydrophobicContact CG2-CD2 4.08Å; V164-L207 HydrophobicContact CG2-CG 4.11Å; V164-R213 PolarHBondContact N-O 2.91Å; V164-L214 HydrophobicContact CB-CD1 4.12Å; V164-L214 HydrophobicContact CG1-CD1 4.25Å; V164-V215 PolarHBondContact O-N 3.13Å
165	V	98.9	Very high	93.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	99.7	172.5	-171.3	0	0	0	0	108.3	V85 L86 V87 T88 L98 N167 V215 V217 I325 I329	V85-V165 HydrophobicContact CG1-CG2 3.83Å; L86-V165 PolarHBondContact O-N 2.96Å; V87-V165 HydrophobicContact CG2-CB 4.28Å; V87-V165 HydrophobicContact CG2-CG2 4.41Å; T88-V165 PolarHBondContact N-O 3.29Å; T88-V165 PolarHBondContact OG1-O 2.97Å; L98-V165 HydrophobicContact CD2-CB 4.44Å; L98-V165 HydrophobicContact CD2-CG1 3.87Å; V165-N167 HydrophobicContact CG1-CB 4.32Å; V165-N167 PolarHBondContact O-N 3.3Å; V165-N167 VanDerWaalsContact O-N 3.11Å; V165-V215 CarbonylContact C-O 3.56Å; V165-V215 VanDerWaalsContact CA-O 3.29Å; V165-V215 WeakPolarHBondContact CA-O 3.29Å; V165-V215 HydrophobicContact CG1-CB 4.4Å; V165-V215 HydrophobicContact CG1-CG1 4.36Å; V165-V215 HydrophobicContact CG2-CB 4.25Å; V165-V217 HydrophobicContact CG1-CG2 4.15Å; V165-I325 HydrophobicContact CG1-CG2 4.48Å; V165-I325 HydrophobicContact CG2-CG2 4.37Å; V165-I329 HydrophobicContact CG2-CG2 4.49Å
166	N	98.8	Very high	93.6	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.011	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	93.2	173	-69.2	-47.7	0	0	0	109	T88 T196 V199 T200 V215 N216 V217	T88-N166 WeakPolarHBondContact OG1-CA 3.36Å; N166-T196 HydrophobicContact CB-CG2 3.92Å; N166-V199 VanDerWaalsContact OD1-CG1 3.26Å; N166-V199 WeakPolarHBondContact OD1-CG1 3.32Å; N166-T200 PolarHBondContact ND2-OG1 3.45Å; N166-V215 PolarHBondContact N-O 3.35Å; N166-N216 WeakPolarHBondContact CB-OD1 3.11Å; N166-N216 PolarHBondContact ND2-OD1 3.17Å; N166-V217 WeakPolarHBondContact O-CB 3.43Å; N166-V217 PolarHBondContact O-N 2.74Å
167	N	98.4	Very high	93.4	Very high	22 Å²	22	30.2 Å²	30.2	12%	0.118	17%	0.166	C	C	.	.			trans	-110.4	-25.2	-178.5	162.5	87.3	0	0	0	112.9	T88 G89 G95 V165 G169 V217	T88-N167 VanDerWaalsContact O-CB 3.29Å; T88-N167 WeakPolarHBondContact O-CB 3.42Å; T88-N167 PolarHBondContact O-ND2 2.91Å; T88-N167 PolarHBondContact OG1-N 3.42Å; G89-N167 PolarHBondContact O-ND2 2.84Å; G95-N167 VanDerWaalsContact CA-ND2 3.31Å; G95-N167 WeakPolarHBondContact CA-ND2 3.49Å; V165-N167 HydrophobicContact CG1-CB 4.32Å; V165-N167 PolarHBondContact O-N 3.3Å; V165-N167 VanDerWaalsContact O-N 3.11Å; N167-G169 PolarHBondContact O-N 3.22Å; N167-V217 HydrophobicContact CB-CB 4.43Å; N167-V217 HydrophobicContact CB-CG2 3.92Å
168	A	97	Very high	93.5	Very high	15 Å²	15	28.8 Å²	28.8	12%	0.124	16%	0.16	C	C	.	.			trans	-50.3	131.9	179.1	0	0	0	0	0	111.6	T88 V139	T88-A168 PolarHBondContact O-N 3.32Å; T88-A168 PolarHBondContact OG1-N 3.03Å; T88-A168 VanDerWaalsContact OG1-N 3.13Å; V139-A168 HydrophobicContact CG1-CB 3.94Å; V139-A168 HydrophobicContact CG2-CB 4.14Å
169	G	95.3	Very high	93.5	Very high	25 Å²	25	22.4 Å²	22.4	26%	0.258	13%	0.125	S	C	.	.			trans	-171.5	161.3	178.5	0	0	0	0	0	114.5	N167 N192	N167-G169 PolarHBondContact O-N 3.22Å; G169-N192 WeakPolarHBondContact CA-OD1 3.43Å
170	V	93.6	Very high	93.3	Very high	44 Å²	44	17.2 Å²	17.2	27%	0.267	11%	0.106	S	C	.	.			trans	-128.1	146.5	177.2	-64.3	0	0	0	0	109.7	Q187 V191 N192 Y232	V170-Q187 HydrophobicContact CG2-CG 4.45Å; V170-V191 HydrophobicContact CG1-CB 4.45Å; V170-V191 HydrophobicContact CG1-CG1 4.24Å; V170-V191 HydrophobicContact CG1-CG2 4.28Å; V170-V191 HydrophobicContact CG2-CB 4.01Å; V170-V191 HydrophobicContact CG2-CG1 4.49Å; V170-V191 HydrophobicContact CG2-CG2 4.17Å; V170-N192 PolarHBondContact N-OD1 3.31Å; V170-N192 PolarHBondContact O-ND2 2.87Å; V170-N192 PolarHBondContact O-OD1 3.44Å; V170-Y232 WeakPolarHBondContact O-CD2 3.49Å; V170-Y232 WeakPolarHBondContact O-CE2 3.45Å
171	L	89.6	Confident	93	Very high	12 Å²	12	18.2 Å²	18.2	6%	0.063	11%	0.112	C	C	.	.			trans	-83.2	-28.7	176.7	-175.6	64.4	0	0	0	112.4	P174 L229 Y232 I269 A270 L307	L171-P174 HydrophobicContact CD2-CG 3.93Å; L171-P174 HydrophobicContact CG-CG 4.3Å; L171-L229 HydrophobicContact CD1-CD2 3.86Å; L171-Y232 HydrophobicContact CD1-CD1 3.84Å; L171-Y232 HydrophobicContact CD1-CD2 3.91Å; L171-Y232 HydrophobicContact CD1-CE1 4.11Å; L171-Y232 HydrophobicContact CD1-CE2 4.17Å; L171-Y232 HydrophobicContact CD1-CG 3.72Å; L171-Y232 WeakPolarHBondContact O-CB 3.38Å; L171-I269 HydrophobicContact CB-CG1 4.17Å; L171-I269 HydrophobicContact CB-CG2 4.42Å; L171-I269 WeakPolarHBondContact CB-O 3.07Å; L171-A270 HydrophobicContact CD2-CB 4.26Å; L171-L307 HydrophobicContact CD2-CD2 3.97Å
172	G	86.1	Confident	92.6	Very high	13 Å²	13	24 Å²	24	13%	0.134	14%	0.141	C	C	.	.			trans	68.5	-168.7	-163.6	0	0	0	0	0	111.7	D184 W276	G172-D184 WeakPolarHBondContact CA-OD1 3.49Å; G172-W276 WeakPolarHBondContact O-CH2 3.26Å
173	F	83	Confident	92.2	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.022	16%	0.161	C	C	.	.			trans	-85	126.8	171.8	-173.2	-107.1	0	0	0	110.2	S175 L180 D184 W276 L279 I283 Q303	F173-S175 PolarHBondContact O-N 2.7Å; F173-L180 HydrophobicContact CB-CD2 4.19Å; F173-L180 HydrophobicContact CD1-CD2 4.14Å; F173-L180 WeakPolarHBondContact O-CD2 3.45Å; F173-D184 PolarHBondContact N-OD1 3.43Å; F173-W276 HydrophobicContact CD2-CE3 4.18Å; F173-W276 HydrophobicContact CD2-CZ3 4.45Å; F173-L279 HydrophobicContact CB-CB 4.47Å; F173-L279 HydrophobicContact CB-CD1 4.39Å; F173-L279 HydrophobicContact CD2-CB 4.16Å; F173-L279 HydrophobicContact CG-CB 4.5Å; F173-I283 HydrophobicContact CB-CD1 4.42Å; F173-I283 HydrophobicContact CD1-CD1 3.13Å; F173-I283 HydrophobicContact CE1-CD1 3.33Å; F173-I283 HydrophobicContact CG-CD1 3.83Å; F173-I283 HydrophobicContact CZ-CD1 4.17Å; F173-Q303 HydrophobicContact CE1-CB 4.38Å
174	P	84.8	Confident	91.8	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	16%	0.164	C	C	.	.			trans	-76.7	114.7	173.4	-19.5	34.8	0	0	0	111.3	L171 K228 L229 F306 L307	L171-P174 HydrophobicContact CD2-CG 3.93Å; L171-P174 HydrophobicContact CG-CG 4.3Å; P174-K228 CarbonylContact C-O 3.51Å; P174-K228 WeakPolarHBondContact CA-O 3.29Å; P174-K228 HydrophobicContact CB-CB 4.38Å; P174-L229 HydrophobicContact CB-CD2 4.42Å; P174-F306 HydrophobicContact CB-CD1 3.46Å; P174-F306 VanDerWaalsContact CB-CD1 3.46Å; P174-F306 HydrophobicContact CB-CE1 4Å; P174-F306 HydrophobicContact CB-CG 4.48Å; P174-F306 HydrophobicContact CG-CD1 4.23Å; P174-L307 HydrophobicContact CG-CD2 3.52Å; P174-L307 HydrophobicContact CG-CG 3.85Å
175	S	88.4	Confident	91.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-159.8	165.6	177.4	-163	0	0	0	0	110	F173 L179 K228 Q303	F173-S175 PolarHBondContact O-N 2.7Å; S175-L179 WeakPolarHBondContact OG-CB 3.45Å; S175-K228 PolarHBondContact N-O 3.45Å; S175-K228 VanDerWaalsContact N-O 3.13Å; S175-K228 CarbonylContact O-C 3.59Å; S175-K228 VanDerWaalsContact O-CA 3.24Å; S175-K228 WeakPolarHBondContact O-CA 3.31Å; S175-Q303 WeakPolarHBondContact OG-CG 3.5Å
176	D	90.6	Very high	91.5	Very high	33 Å²	33	36.7 Å²	36.7	18%	0.176	20%	0.204	C	C	.	.			trans	-53.3	143.7	171.7	-73	-7.1	0	0	0	111.3	E178 L179 L180 Y299	D176-E178 PolarHBondContact O-N 3.39Å; D176-E178 VanDerWaalsContact O-N 3.13Å; D176-L179 HydrophobicContact CB-CD1 4.14Å; D176-L179 HydrophobicContact CB-CG 4.15Å; D176-L179 PolarHBondContact O-N 3.35Å; D176-L180 PolarHBondContact O-N 3.1Å; D176-Y299 PolarHBondContact OD2-OH 2.84Å
177	G	91.5	Very high	91.3	Very high	29 Å²	29	41.5 Å²	41.5	30%	0.299	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-32	-168.7	0	0	0	0	0	114.2	Y185	G177-Y185 VanDerWaalsContact CA-OH 3.27Å; G177-Y185 WeakPolarHBondContact CA-OH 3.46Å; G177-Y185 PolarHBondContact O-OH 3.32Å
178	E	92.6	Very high	91.3	Very high	116 Å²	116	40.4 Å²	40.4	54%	0.542	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-31.8	176.2	-178.5	172.6	-151.4	0	0	112.7	D176 L180 V291 Y295	D176-E178 PolarHBondContact O-N 3.39Å; D176-E178 VanDerWaalsContact O-N 3.13Å; E178-L180 VanDerWaalsContact C-N 3.27Å; E178-L180 PolarHBondContact O-N 2.84Å; E178-V291 HydrophobicContact CG-CG1 4.44Å; E178-Y295 VanDerWaalsContact OE2-CE2 3.26Å; E178-Y295 WeakPolarHBondContact OE2-CE2 3.29Å; E178-Y295 PolarHBondContact OE2-OH 2.96Å
179	L	90.7	Very high	91.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-16	-178.9	-60.1	-177.7	0	0	0	112.7	S175 D176 L287 V291 Y295 Y299 I300 Q303	S175-L179 WeakPolarHBondContact OG-CB 3.45Å; D176-L179 HydrophobicContact CB-CD1 4.14Å; D176-L179 HydrophobicContact CB-CG 4.15Å; D176-L179 PolarHBondContact O-N 3.35Å; L179-L287 HydrophobicContact CD2-CD1 4.05Å; L179-L287 HydrophobicContact CD2-CD2 4.2Å; L179-V291 HydrophobicContact CD2-CG1 3.81Å; L179-Y295 HydrophobicContact CD1-CD1 4.31Å; L179-Y295 HydrophobicContact CD2-CD1 4.27Å; L179-Y295 HydrophobicContact CD2-CD2 3.85Å; L179-Y295 HydrophobicContact CD2-CE1 4.49Å; L179-Y295 HydrophobicContact CD2-CE2 4.11Å; L179-Y295 HydrophobicContact CD2-CG 3.91Å; L179-Y299 HydrophobicContact CD1-CD1 4.28Å; L179-Y299 HydrophobicContact CD1-CE1 4.17Å; L179-I300 HydrophobicContact CD1-CG1 4.22Å; L179-I300 HydrophobicContact CD2-CG1 4.33Å; L179-Q303 HydrophobicContact CD1-CG 4.16Å
180	L	89.7	Confident	91.5	Very high	11 Å²	11	42.4 Å²	42.4	6%	0.058	23%	0.226	C	C	.	.	S	Bend	trans	-80.4	128.9	-177.9	-69.4	174.5	0	0	0	112	F173 D176 E178 Y185 A230	F173-L180 HydrophobicContact CB-CD2 4.19Å; F173-L180 HydrophobicContact CD1-CD2 4.14Å; F173-L180 WeakPolarHBondContact O-CD2 3.45Å; D176-L180 PolarHBondContact O-N 3.1Å; E178-L180 VanDerWaalsContact C-N 3.27Å; E178-L180 PolarHBondContact O-N 2.84Å; L180-Y185 HydrophobicContact CB-CD2 4.3Å; L180-Y185 HydrophobicContact CB-CE2 3.6Å; L180-Y185 HydrophobicContact CD1-CE2 4.39Å; L180-A230 HydrophobicContact CD1-CB 4.23Å
181	P	89	Confident	91.7	Very high	27 Å²	27	41 Å²	41	18%	0.175	22%	0.218	C	C	.	.			trans	-70	150.5	174.9	30.3	-35.4	0	0	0	110.6	T183 D184 I283	P181-T183 WeakPolarHBondContact CB-OG1 3.32Å; P181-T183 PolarHBondContact O-N 2.94Å; P181-D184 HydrophobicContact CG-CB 4.36Å; P181-D184 WeakPolarHBondContact O-CB 3.41Å; P181-D184 PolarHBondContact O-N 2.97Å; P181-I283 HydrophobicContact CG-CG1 4.44Å
182	M	90.8	Very high	92.1	Very high	121 Å²	121	40.5 Å²	40.5	60%	0.596	22%	0.215	S	C	*	.	H	α-helix	trans	-59.6	-21.7	178.5	-78.5	-55.6	-54.2	0	0	113.9	D184 Y185 K186	M182-D184 VanDerWaalsContact C-N 3.31Å; M182-Y185 HydrophobicContact SD-CD2 4.11Å; M182-Y185 HydrophobicContact SD-CG 4.5Å; M182-K186 WeakPolarHBondContact O-CB 3.38Å; M182-K186 VanDerWaalsContact O-CG 3.25Å; M182-K186 WeakPolarHBondContact O-CG 3.47Å; M182-K186 PolarHBondContact O-N 3.35Å
183	T	90.4	Very high	92.7	Very high	88 Å²	88	41.8 Å²	41.8	54%	0.54	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-39.2	172.5	46.1	0	0	0	0	111.7	P181 K186 Q187	P181-T183 WeakPolarHBondContact CB-OG1 3.32Å; P181-T183 PolarHBondContact O-N 2.94Å; T183-K186 PolarHBondContact O-N 3.27Å; T183-Q187 VanDerWaalsContact O-CB 3.28Å; T183-Q187 WeakPolarHBondContact O-CB 3.41Å; T183-Q187 PolarHBondContact O-N 3.47Å
184	D	90.7	Very high	93.5	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.053	24%	0.241	C	C	.	.	H	α-helix	trans	-68.2	-45.9	178.3	-167.9	81	0	0	0	111.4	G172 F173 P181 M182 K186 Q187 C188 S231	G172-D184 WeakPolarHBondContact CA-OD1 3.49Å; F173-D184 PolarHBondContact N-OD1 3.43Å; P181-D184 HydrophobicContact CG-CB 4.36Å; P181-D184 WeakPolarHBondContact O-CB 3.41Å; P181-D184 PolarHBondContact O-N 2.97Å; M182-D184 VanDerWaalsContact C-N 3.31Å; D184-K186 PolarHBondContact O-N 2.85Å; D184-Q187 PolarHBondContact O-N 2.87Å; D184-C188 WeakPolarHBondContact O-CB 3.2Å; D184-C188 PolarHBondContact O-N 2.87Å; D184-S231 WeakPolarHBondContact OD2-CB 3.49Å; D184-S231 PolarHBondContact OD2-OG 3.35Å
185	Y	94.3	Very high	94.1	Very high	54 Å²	54	47.3 Å²	47.3	21%	0.212	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-48.2	172.7	-73.8	-86.4	0	0	0	112.3	G177 L180 M182 Q187 M189 A230	G177-Y185 VanDerWaalsContact CA-OH 3.27Å; G177-Y185 WeakPolarHBondContact CA-OH 3.46Å; G177-Y185 PolarHBondContact O-OH 3.32Å; L180-Y185 HydrophobicContact CB-CD2 4.3Å; L180-Y185 HydrophobicContact CB-CE2 3.6Å; L180-Y185 HydrophobicContact CD1-CE2 4.39Å; M182-Y185 HydrophobicContact SD-CD2 4.11Å; M182-Y185 HydrophobicContact SD-CG 4.5Å; Y185-Q187 VanDerWaalsContact C-N 3.34Å; Y185-Q187 PolarHBondContact O-N 3.35Å; Y185-M189 WeakPolarHBondContact O-CB 3.42Å; Y185-M189 WeakPolarHBondContact O-CG 3.35Å; Y185-M189 PolarHBondContact O-N 3.09Å; Y185-A230 HydrophobicContact CE1-CB 4.26Å; Y185-A230 WeakPolarHBondContact OH-CB 3.45Å
186	K	96.4	Very high	94.6	Very high	143 Å²	143	47.7 Å²	47.7	62%	0.622	24%	0.243	S	C	*	.	H	α-helix	trans	-62.3	-42	178.7	-74.7	172.3	-177.4	177	0	111.3	M182 T183 D184 M189 A190	M182-K186 WeakPolarHBondContact O-CB 3.38Å; M182-K186 VanDerWaalsContact O-CG 3.25Å; M182-K186 WeakPolarHBondContact O-CG 3.47Å; M182-K186 PolarHBondContact O-N 3.35Å; T183-K186 PolarHBondContact O-N 3.27Å; D184-K186 PolarHBondContact O-N 2.85Å; K186-M189 PolarHBondContact O-N 3.3Å; K186-A190 WeakPolarHBondContact O-CB 3.12Å; K186-A190 PolarHBondContact O-N 2.85Å
187	Q	95.4	Very high	95	Very high	102 Å²	102	47.5 Å²	47.5	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-47.4	179.7	-175.6	61.9	19.6	0	0	111.9	V170 T183 D184 Y185 M189 A190 V191	V170-Q187 HydrophobicContact CG2-CG 4.45Å; T183-Q187 VanDerWaalsContact O-CB 3.28Å; T183-Q187 WeakPolarHBondContact O-CB 3.41Å; T183-Q187 PolarHBondContact O-N 3.47Å; D184-Q187 PolarHBondContact O-N 2.87Å; Y185-Q187 VanDerWaalsContact C-N 3.34Å; Y185-Q187 PolarHBondContact O-N 3.35Å; Q187-M189 VanDerWaalsContact C-N 3.31Å; Q187-M189 PolarHBondContact O-N 2.95Å; Q187-A190 PolarHBondContact O-N 3.4Å; Q187-V191 PolarHBondContact O-N 2.89Å
188	C	96.5	Very high	95.4	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-45	174.5	-81.1	0	0	0	0	111.1	D184 N192	D184-C188 WeakPolarHBondContact O-CB 3.2Å; D184-C188 PolarHBondContact O-N 2.87Å; C188-N192 WeakPolarHBondContact O-CB 3.29Å; C188-N192 VanDerWaalsContact O-CG 3.29Å; C188-N192 PolarHBondContact O-N 3.4Å
189	M	98.4	Very high	95.7	Very high	52 Å²	52	43.4 Å²	43.4	26%	0.256	22%	0.217	S	C	.	.	I	π-helix	trans	-66.6	-42.8	176.1	-74.1	-62	-71.8	0	0	113	Y185 K186 Q187 V191 F193 F194 A238	Y185-M189 WeakPolarHBondContact O-CB 3.42Å; Y185-M189 WeakPolarHBondContact O-CG 3.35Å; Y185-M189 PolarHBondContact O-N 3.09Å; K186-M189 PolarHBondContact O-N 3.3Å; Q187-M189 VanDerWaalsContact C-N 3.31Å; Q187-M189 PolarHBondContact O-N 2.95Å; M189-V191 PolarHBondContact O-N 2.94Å; M189-F193 HydrophobicContact CE-CB 4.04Å; M189-F193 HydrophobicContact CE-CD1 3.45Å; M189-F193 VanDerWaalsContact CE-CD1 3.45Å; M189-F193 HydrophobicContact CE-CE1 4.18Å; M189-F193 HydrophobicContact CE-CG 3.95Å; M189-F193 WeakPolarHBondContact O-CB 3.43Å; M189-F193 PolarHBondContact O-N 3.36Å; M189-F193 VanDerWaalsContact O-N 3.13Å; M189-F193 HydrophobicContact SD-CB 4.12Å; M189-F194 HydrophobicContact CB-CD2 4.28Å; M189-F194 HydrophobicContact CB-CE2 4.02Å; M189-F194 HydrophobicContact CE-CZ 4.32Å; M189-F194 WeakPolarHBondContact O-CD2 3.1Å; M189-F194 PolarHBondContact O-N 2.98Å; M189-A238 HydrophobicContact CE-CB 4.46Å
190	A	98.5	Very high	96	Very high	29 Å²	29	43.4 Å²	43.4	24%	0.24	22%	0.217	C	C	.	.	I	π-helix	trans	-58.4	-48.7	179.2	0	0	0	0	0	112.1	T140 K186 Q187 G195	T140-A190 HydrophobicContact CG2-CB 4.41Å; K186-A190 WeakPolarHBondContact O-CB 3.12Å; K186-A190 PolarHBondContact O-N 2.85Å; Q187-A190 PolarHBondContact O-N 3.4Å; A190-G195 PolarHBondContact O-N 3.42Å
191	V	98.1	Very high	96.5	Very high	16 Å²	16	49 Å²	49	10%	0.097	24%	0.24	C	C	.	.	I	π-helix	trans	-81.2	-56.4	-177.4	-176.6	0	0	0	0	111.2	V139 T140 V170 Q187 M189	V139-V191 HydrophobicContact CG2-CG1 3.93Å; T140-V191 HydrophobicContact CG2-CB 4.49Å; T140-V191 HydrophobicContact CG2-CG2 3.68Å; V170-V191 HydrophobicContact CG1-CB 4.45Å; V170-V191 HydrophobicContact CG1-CG1 4.24Å; V170-V191 HydrophobicContact CG1-CG2 4.28Å; V170-V191 HydrophobicContact CG2-CB 4.01Å; V170-V191 HydrophobicContact CG2-CG1 4.49Å; V170-V191 HydrophobicContact CG2-CG2 4.17Å; Q187-V191 PolarHBondContact O-N 2.89Å; M189-V191 PolarHBondContact O-N 2.94Å
192	N	98.4	Very high	96.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-72.3	-41	-167.6	-58.8	-17.2	0	0	0	111.5	G169 V170 C188 T196 S235 V239	G169-N192 WeakPolarHBondContact CA-OD1 3.43Å; V170-N192 PolarHBondContact N-OD1 3.31Å; V170-N192 PolarHBondContact O-ND2 2.87Å; V170-N192 PolarHBondContact O-OD1 3.44Å; C188-N192 WeakPolarHBondContact O-CB 3.29Å; C188-N192 VanDerWaalsContact O-CG 3.29Å; C188-N192 PolarHBondContact O-N 3.4Å; N192-T196 WeakPolarHBondContact O-CB 3.4Å; N192-T196 PolarHBondContact O-OG1 2.66Å; N192-S235 WeakPolarHBondContact CB-OG 3.45Å; N192-S235 PolarHBondContact ND2-OG 3.09Å; N192-V239 WeakPolarHBondContact O-CG2 3.31Å
193	F	98.8	Very high	97.3	Very high	41 Å²	41	43.1 Å²	43.1	18%	0.18	21%	0.211	C	C	.	.	I	π-helix	trans	-100.9	-64.9	-174.1	178.8	-112.8	0	0	0	112.8	M189 G195 T196 V197 A238 V239 F242	M189-F193 HydrophobicContact CE-CB 4.04Å; M189-F193 HydrophobicContact CE-CD1 3.45Å; M189-F193 VanDerWaalsContact CE-CD1 3.45Å; M189-F193 HydrophobicContact CE-CE1 4.18Å; M189-F193 HydrophobicContact CE-CG 3.95Å; M189-F193 WeakPolarHBondContact O-CB 3.43Å; M189-F193 PolarHBondContact O-N 3.36Å; M189-F193 VanDerWaalsContact O-N 3.13Å; M189-F193 HydrophobicContact SD-CB 4.12Å; F193-G195 VanDerWaalsContact C-N 3.32Å; F193-G195 PolarHBondContact O-N 2.77Å; F193-T196 WeakPolarHBondContact O-CB 3.42Å; F193-T196 PolarHBondContact O-N 3.34Å; F193-T196 VanDerWaalsContact O-N 3.1Å; F193-V197 HydrophobicContact CD2-CG2 4.28Å; F193-V197 HydrophobicContact CE1-CG2 4.43Å; F193-V197 HydrophobicContact CE2-CG2 3.9Å; F193-V197 HydrophobicContact CZ-CG2 3.99Å; F193-V197 WeakPolarHBondContact O-CG2 3.36Å; F193-V197 PolarHBondContact O-N 3.14Å; F193-A238 HydrophobicContact CB-CB 4.37Å; F193-A238 HydrophobicContact CD1-CB 4.45Å; F193-A238 HydrophobicContact CD2-CB 3.51Å; F193-A238 HydrophobicContact CE2-CB 3.81Å; F193-A238 HydrophobicContact CG-CB 3.85Å; F193-A238 HydrophobicContact CZ-CB 4.4Å; F193-V239 HydrophobicContact CB-CG2 4.39Å; F193-V239 HydrophobicContact CD2-CG2 4.19Å; F193-F242 HydrophobicContact CE2-CB 3.94Å; F193-F242 HydrophobicContact CE2-CG 4.4Å
194	F	98.8	Very high	97.7	Very high	120 Å²	120	39.7 Å²	39.7	53%	0.526	19%	0.189	S	C	.	.	I	π-helix	trans	-62	-40.2	-175.6	-64.1	-50.3	0	0	0	111.8	M189 T196 V197 E198	M189-F194 HydrophobicContact CB-CD2 4.28Å; M189-F194 HydrophobicContact CB-CE2 4.02Å; M189-F194 HydrophobicContact CE-CZ 4.32Å; M189-F194 WeakPolarHBondContact O-CD2 3.1Å; M189-F194 PolarHBondContact O-N 2.98Å; F194-T196 PolarHBondContact O-N 3.08Å; F194-V197 PolarHBondContact O-N 3.3Å; F194-E198 WeakPolarHBondContact O-CB 3.4Å; F194-E198 PolarHBondContact O-N 2.88Å
195	G	98.8	Very high	98.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.01	20%	0.201	C	C	.	.	I	π-helix	trans	-57.8	-47.8	171.9	0	0	0	0	0	112.8	V139 A190 F193 V197 E198 V199	V139-G195 VanDerWaalsContact O-CA 3.29Å; V139-G195 WeakPolarHBondContact O-CA 3.46Å; A190-G195 PolarHBondContact O-N 3.42Å; F193-G195 VanDerWaalsContact C-N 3.32Å; F193-G195 PolarHBondContact O-N 2.77Å; G195-V197 VanDerWaalsContact C-N 3.3Å; G195-V197 PolarHBondContact O-N 3.44Å; G195-E198 PolarHBondContact O-N 2.83Å; G195-V199 WeakPolarHBondContact O-CB 3.38Å; G195-V199 VanDerWaalsContact O-CG2 3.3Å; G195-V199 WeakPolarHBondContact O-CG2 3.27Å; G195-V199 PolarHBondContact O-N 2.99Å
196	T	98.8	Very high	98.3	Very high	8 Å²	8	39.1 Å²	39.1	5%	0.049	19%	0.192	C	C	.	.	H	α-helix	trans	-56.6	-44	174.7	-68.5	0	0	0	0	111.8	N166 N192 F193 F194 T200 V239 F242	N166-T196 HydrophobicContact CB-CG2 3.92Å; N192-T196 WeakPolarHBondContact O-CB 3.4Å; N192-T196 PolarHBondContact O-OG1 2.66Å; F193-T196 WeakPolarHBondContact O-CB 3.42Å; F193-T196 PolarHBondContact O-N 3.34Å; F193-T196 VanDerWaalsContact O-N 3.1Å; F194-T196 PolarHBondContact O-N 3.08Å; T196-T200 VanDerWaalsContact O-CB 3.22Å; T196-T200 WeakPolarHBondContact O-CB 3.31Å; T196-T200 PolarHBondContact O-N 3.48Å; T196-T200 PolarHBondContact O-OG1 3.45Å; T196-V239 HydrophobicContact CG2-CG1 4.43Å; T196-F242 HydrophobicContact CG2-CD1 4.33Å; T196-F242 HydrophobicContact CG2-CE1 4.24Å
197	V	98.9	Very high	98.4	Very high	29 Å²	29	32.3 Å²	32.3	18%	0.176	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-47.4	179.1	172.8	0	0	0	0	111	F193 F194 G195 T200 K201 F242	F193-V197 HydrophobicContact CD2-CG2 4.28Å; F193-V197 HydrophobicContact CE1-CG2 4.43Å; F193-V197 HydrophobicContact CE2-CG2 3.9Å; F193-V197 HydrophobicContact CZ-CG2 3.99Å; F193-V197 WeakPolarHBondContact O-CG2 3.36Å; F193-V197 PolarHBondContact O-N 3.14Å; F194-V197 PolarHBondContact O-N 3.3Å; G195-V197 VanDerWaalsContact C-N 3.3Å; G195-V197 PolarHBondContact O-N 3.44Å; V197-T200 PolarHBondContact O-N 2.85Å; V197-K201 HydrophobicContact CG1-CD 3.78Å; V197-K201 HydrophobicContact CG1-CG 4.41Å; V197-K201 WeakPolarHBondContact O-CB 3.38Å; V197-K201 WeakPolarHBondContact O-CG 3.16Å; V197-K201 PolarHBondContact O-N 3.43Å; V197-F242 HydrophobicContact CB-CZ 4.42Å; V197-F242 HydrophobicContact CG1-CE2 4.48Å; V197-F242 HydrophobicContact CG2-CD1 4.29Å; V197-F242 HydrophobicContact CG2-CD2 4.09Å; V197-F242 HydrophobicContact CG2-CE1 4.13Å; V197-F242 HydrophobicContact CG2-CE2 3.92Å; V197-F242 HydrophobicContact CG2-CG 4.27Å; V197-F242 HydrophobicContact CG2-CZ 3.94Å
198	E	98.8	Very high	98.5	Very high	60 Å²	60	32.3 Å²	32.3	28%	0.28	16%	0.158	S	C	.	.	H	α-helix	trans	-66.2	-43.8	-176.8	-167.8	68.5	-178.9	0	0	111.8	I145 F194 G195 K201 T202	I145-E198 HydrophobicContact CD1-CB 3.94Å; I145-E198 HydrophobicContact CD1-CG 3.6Å; F194-E198 WeakPolarHBondContact O-CB 3.4Å; F194-E198 PolarHBondContact O-N 2.88Å; G195-E198 PolarHBondContact O-N 2.83Å; E198-K201 PolarHBondContact O-N 3.05Å; E198-T202 WeakPolarHBondContact O-CB 3.39Å; E198-T202 PolarHBondContact O-N 3.03Å; E198-T202 PolarHBondContact O-OG1 3.44Å
199	V	98.9	Very high	98.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-47.4	174	174.8	0	0	0	0	110.6	L86 T88 M137 V139 I145 V164 N166 G195 K201 T202 F203	L86-V199 HydrophobicContact CD2-CG1 4.27Å; T88-V199 HydrophobicContact CG2-CG1 4.11Å; T88-V199 HydrophobicContact CG2-CG2 4.38Å; M137-V199 HydrophobicContact CE-CB 4.31Å; M137-V199 HydrophobicContact CE-CG1 3.91Å; M137-V199 HydrophobicContact CE-CG2 3.5Å; V139-V199 HydrophobicContact CB-CG2 4.3Å; V139-V199 HydrophobicContact CG1-CG2 3.92Å; I145-V199 HydrophobicContact CD1-CG2 3.95Å; I145-V199 HydrophobicContact CG1-CG2 4.21Å; I145-V199 HydrophobicContact CG2-CG2 4.2Å; V164-V199 HydrophobicContact CG1-CG1 4.01Å; N166-V199 VanDerWaalsContact OD1-CG1 3.26Å; N166-V199 WeakPolarHBondContact OD1-CG1 3.32Å; G195-V199 WeakPolarHBondContact O-CB 3.38Å; G195-V199 VanDerWaalsContact O-CG2 3.3Å; G195-V199 WeakPolarHBondContact O-CG2 3.27Å; G195-V199 PolarHBondContact O-N 2.99Å; V199-K201 PolarHBondContact O-N 2.9Å; V199-T202 PolarHBondContact O-N 3.49Å; V199-F203 HydrophobicContact CG1-CD2 4.03Å; V199-F203 HydrophobicContact CG1-CE2 4.44Å; V199-F203 WeakPolarHBondContact O-CD2 3.29Å; V199-F203 PolarHBondContact O-N 2.95Å
200	T	98.8	Very high	98.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-54.5	-55.9	177.1	-63.4	0	0	0	0	110.7	N166 T196 V197 T202 F203 L204 L214 F242 M246	N166-T200 PolarHBondContact ND2-OG1 3.45Å; T196-T200 VanDerWaalsContact O-CB 3.22Å; T196-T200 WeakPolarHBondContact O-CB 3.31Å; T196-T200 PolarHBondContact O-N 3.48Å; T196-T200 PolarHBondContact O-OG1 3.45Å; V197-T200 PolarHBondContact O-N 2.85Å; T200-T202 VanDerWaalsContact C-N 3.3Å; T200-T202 PolarHBondContact O-N 3.42Å; T200-F203 PolarHBondContact O-N 2.92Å; T200-L204 HydrophobicContact CG2-CG 4.35Å; T200-L204 VanDerWaalsContact O-CG 3.29Å; T200-L204 WeakPolarHBondContact O-CG 3.41Å; T200-L204 PolarHBondContact O-N 3.25Å; T200-L214 HydrophobicContact CG2-CD1 4.03Å; T200-L214 HydrophobicContact CG2-CD2 3.51Å; T200-L214 HydrophobicContact CG2-CG 4.44Å; T200-F242 HydrophobicContact CG2-CE1 4.31Å; T200-F242 HydrophobicContact CG2-CZ 4.05Å; T200-M246 HydrophobicContact CG2-CE 4.17Å
201	K	98.6	Very high	98.3	Very high	128 Å²	128	41.3 Å²	41.3	56%	0.557	19%	0.194	S	C	*	.	H	α-helix	trans	-58.7	-41.9	-177.7	-73.3	172.3	67.1	-171.7	0	112.1	V197 E198 V199	V197-K201 HydrophobicContact CG1-CD 3.78Å; V197-K201 HydrophobicContact CG1-CG 4.41Å; V197-K201 WeakPolarHBondContact O-CB 3.38Å; V197-K201 WeakPolarHBondContact O-CG 3.16Å; V197-K201 PolarHBondContact O-N 3.43Å; E198-K201 PolarHBondContact O-N 3.05Å; V199-K201 PolarHBondContact O-N 2.9Å
202	T	98.9	Very high	98.3	Very high	25 Å²	25	40.6 Å²	40.6	15%	0.153	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-41.7	-178.3	-56.7	0	0	0	0	111.8	I145 Y149 E198 V199 T200 P205	I145-T202 HydrophobicContact CG2-CG2 3.95Å; Y149-T202 HydrophobicContact CD2-CG2 3.97Å; Y149-T202 VanDerWaalsContact CD2-O 3.25Å; Y149-T202 WeakPolarHBondContact CD2-O 3.38Å; Y149-T202 WeakPolarHBondContact CE2-O 3.13Å; Y149-T202 HydrophobicContact CG-CG2 3.9Å; E198-T202 WeakPolarHBondContact O-CB 3.39Å; E198-T202 PolarHBondContact O-N 3.03Å; E198-T202 PolarHBondContact O-OG1 3.44Å; V199-T202 PolarHBondContact O-N 3.49Å; T200-T202 VanDerWaalsContact C-N 3.3Å; T200-T202 PolarHBondContact O-N 3.42Å; T202-P205 VanDerWaalsContact O-CD 3.29Å; T202-P205 WeakPolarHBondContact O-CD 3.47Å
203	F	98.8	Very high	98.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-90.8	-7.4	-175.5	-76.8	-94.8	0	0	0	114.6	L86 M137 I145 A148 Y149 V152 L161 V164 V199 T200 P205 L206 L207	L86-F203 HydrophobicContact CD2-CD1 3.85Å; L86-F203 HydrophobicContact CD2-CD2 3.91Å; L86-F203 HydrophobicContact CD2-CE1 3.63Å; L86-F203 HydrophobicContact CD2-CE2 3.71Å; L86-F203 HydrophobicContact CD2-CG 3.97Å; L86-F203 HydrophobicContact CD2-CZ 3.55Å; M137-F203 HydrophobicContact CE-CE2 3.76Å; M137-F203 HydrophobicContact CE-CZ 4.39Å; I145-F203 HydrophobicContact CG2-CE2 4.25Å; A148-F203 HydrophobicContact CB-CZ 4.35Å; Y149-F203 VanDerWaalsContact CA-CZ 3.48Å; Y149-F203 HydrophobicContact CD2-CD1 4.11Å; Y149-F203 HydrophobicContact CD2-CE1 4.26Å; Y149-F203 HydrophobicContact CD2-CG 4.31Å; V152-F203 HydrophobicContact CB-CE1 4.04Å; V152-F203 HydrophobicContact CG1-CE1 4.17Å; V152-F203 HydrophobicContact CG2-CE1 4.08Å; L161-F203 HydrophobicContact CD2-CD1 3.7Å; L161-F203 HydrophobicContact CD2-CE1 4.41Å; L161-F203 HydrophobicContact CD2-CG 4.47Å; V164-F203 HydrophobicContact CG2-CB 3.74Å; V164-F203 HydrophobicContact CG2-CG 4.32Å; V199-F203 HydrophobicContact CG1-CD2 4.03Å; V199-F203 HydrophobicContact CG1-CE2 4.44Å; V199-F203 WeakPolarHBondContact O-CD2 3.29Å; V199-F203 PolarHBondContact O-N 2.95Å; T200-F203 PolarHBondContact O-N 2.92Å; F203-P205 VanDerWaalsContact C-N 3.34Å; F203-L206 HydrophobicContact CD1-CD1 4.08Å; F203-L206 HydrophobicContact CE1-CD1 4.45Å; F203-L206 PolarHBondContact O-N 2.79Å; F203-L207 PolarHBondContact O-N 2.79Å; F203-L207 VanDerWaalsContact O-N 3.15Å
204	L	98.6	Very high	98.3	Very high	16 Å²	16	39.2 Å²	39.2	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-50.3	-42	176.6	-90.4	176.5	0	0	0	114.7	T200 L206 L207 R208 M246 L250 I255	T200-L204 HydrophobicContact CG2-CG 4.35Å; T200-L204 VanDerWaalsContact O-CG 3.29Å; T200-L204 WeakPolarHBondContact O-CG 3.41Å; T200-L204 PolarHBondContact O-N 3.25Å; L204-L206 VanDerWaalsContact C-N 3.26Å; L204-L206 PolarHBondContact O-N 3.02Å; L204-L207 HydrophobicContact CD2-CD1 4.46Å; L204-L207 PolarHBondContact O-N 3.46Å; L204-R208 WeakPolarHBondContact O-CG 3.41Å; L204-R208 PolarHBondContact O-N 2.88Å; L204-M246 HydrophobicContact CD1-CE 4.14Å; L204-L250 HydrophobicContact CD1-CD2 4.31Å; L204-L250 HydrophobicContact CD2-CD1 3.67Å; L204-L250 HydrophobicContact CD2-CD2 3.68Å; L204-L250 HydrophobicContact CD2-CG 4.35Å; L204-I255 HydrophobicContact CD2-CD1 3.98Å
205	P	98.3	Very high	98.3	Very high	48 Å²	48	33.5 Å²	33.5	31%	0.312	16%	0.158	S	C	.	.	H	α-helix	trans	-56.3	-39.4	177.2	-26.3	36.2	0	0	0	113.2	T202 F203 R208 K209	T202-P205 VanDerWaalsContact O-CD 3.29Å; T202-P205 WeakPolarHBondContact O-CD 3.47Å; F203-P205 VanDerWaalsContact C-N 3.34Å; P205-R208 PolarHBondContact O-N 2.83Å; P205-K209 PolarHBondContact O-N 2.88Å
206	L	98.5	Very high	98.3	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-74.1	-36	178.1	-63.1	178	0	0	0	112.3	Y149 V152 A153 G160 L161 F203 L204 R208 K209	Y149-L206 HydrophobicContact CD2-CD1 4Å; Y149-L206 HydrophobicContact CD2-CG 4.42Å; Y149-L206 HydrophobicContact CE2-CD1 3.81Å; Y149-L206 HydrophobicContact CE2-CG 3.73Å; V152-L206 HydrophobicContact CG1-CD1 3.88Å; A153-L206 HydrophobicContact CB-CD1 4.29Å; A153-L206 HydrophobicContact CB-CD2 4.18Å; G160-L206 WeakPolarHBondContact CA-O 3.39Å; L161-L206 HydrophobicContact CB-CB 3.63Å; L161-L206 HydrophobicContact CB-CD1 4.35Å; L161-L206 PolarHBondContact N-O 2.95Å; L161-L206 VanDerWaalsContact N-O 3.08Å; F203-L206 HydrophobicContact CD1-CD1 4.08Å; F203-L206 HydrophobicContact CE1-CD1 4.45Å; F203-L206 PolarHBondContact O-N 2.79Å; L204-L206 VanDerWaalsContact C-N 3.26Å; L204-L206 PolarHBondContact O-N 3.02Å; L206-R208 VanDerWaalsContact C-N 3.32Å; L206-K209 PolarHBondContact O-N 2.91Å
207	L	98.4	Very high	98.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.7	-33.5	174	-70.7	178.9	0	0	0	112.3	L161 V164 F203 L204 S210 K211 G212 L214 I255	L161-L207 WeakPolarHBondContact O-CD2 3.48Å; V164-L207 HydrophobicContact CB-CD1 4.36Å; V164-L207 HydrophobicContact CG2-CD1 3.95Å; V164-L207 HydrophobicContact CG2-CD2 4.08Å; V164-L207 HydrophobicContact CG2-CG 4.11Å; F203-L207 PolarHBondContact O-N 2.79Å; F203-L207 VanDerWaalsContact O-N 3.15Å; L204-L207 HydrophobicContact CD2-CD1 4.46Å; L204-L207 PolarHBondContact O-N 3.46Å; L207-S210 PolarHBondContact O-N 2.97Å; L207-S210 PolarHBondContact O-OG 3.13Å; L207-S210 VanDerWaalsContact O-OG 3.12Å; L207-K211 WeakPolarHBondContact O-CA 3.41Å; L207-K211 PolarHBondContact O-N 3.18Å; L207-G212 PolarHBondContact O-N 2.96Å; L207-G212 VanDerWaalsContact O-N 3.08Å; L207-L214 HydrophobicContact CD1-CB 4.38Å; L207-I255 HydrophobicContact CB-CD1 3.87Å; L207-I255 HydrophobicContact CB-CG1 4.34Å
208	R	97.6	Very high	98	Very high	102 Å²	102	32.2 Å²	32.2	39%	0.385	15%	0.15	S	C	.	.	H	α-helix	trans	-65.5	-38.7	176.5	-72.5	178.6	-140	158.4	5.2	112	L204 P205 L206 S210 K211 W253 I255	L204-R208 WeakPolarHBondContact O-CG 3.41Å; L204-R208 PolarHBondContact O-N 2.88Å; P205-R208 PolarHBondContact O-N 2.83Å; L206-R208 VanDerWaalsContact C-N 3.32Å; R208-S210 VanDerWaalsContact C-N 3.3Å; R208-S210 PolarHBondContact O-N 2.89Å; R208-K211 PolarHBondContact O-N 2.85Å; R208-W253 HydrophobicContact CG-CB 4.46Å; R208-W253 HydrophobicContact CG-CD2 4.26Å; R208-W253 HydrophobicContact CG-CE3 3.97Å; R208-I255 HydrophobicContact CG-CD1 3.88Å
209	K	96.9	Very high	97.7	Very high	105 Å²	105	30.1 Å²	30.1	46%	0.457	14%	0.142	S	C	.	.	H	α-helix	trans	-59.3	-41.8	176.7	-69.9	-169	-179.7	-167.8	0	111.6	Q157 D158 P205 L206	Q157-K209 PolarHBondContact O-NZ 2.8Å; Q157-K209 VanDerWaalsContact O-NZ 3.08Å; D158-K209 IonicContact OD1-NZ 2.81Å; D158-K209 PolarHBondContact OD1-NZ 3.43Å; P205-K209 PolarHBondContact O-N 2.88Å; L206-K209 PolarHBondContact O-N 2.91Å
210	S	95.9	Very high	97.3	Very high	26 Å²	26	31.3 Å²	31.3	18%	0.182	15%	0.148	C	C	.	.	H	α-helix	trans	-90.7	-11.1	-176.4	69.1	0	0	0	0	114.7	L161 L207 R208 G212	L161-S210 WeakPolarHBondContact O-CB 3.34Å; L161-S210 PolarHBondContact O-OG 3.3Å; L207-S210 PolarHBondContact O-N 2.97Å; L207-S210 PolarHBondContact O-OG 3.13Å; L207-S210 VanDerWaalsContact O-OG 3.12Å; R208-S210 VanDerWaalsContact C-N 3.3Å; R208-S210 PolarHBondContact O-N 2.89Å; S210-G212 PolarHBondContact O-N 2.99Å; S210-G212 WeakPolarHBondContact OG-CA 3.49Å; S210-G212 PolarHBondContact OG-N 3.24Å; S210-G212 VanDerWaalsContact OG-N 3.12Å
211	K	96.9	Very high	96.6	Very high	139 Å²	139	31.6 Å²	31.6	60%	0.604	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	46.4	-165	-58.4	177.9	-177.8	175.8	0	111	L207 R208 R213	L207-K211 WeakPolarHBondContact O-CA 3.41Å; L207-K211 PolarHBondContact O-N 3.18Å; R208-K211 PolarHBondContact O-N 2.85Å; K211-R213 PolarHBondContact O-NH1 2.97Å
212	G	97.1	Very high	95.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.			trans	-77.3	-144.5	-164.7	0	0	0	0	0	115.3	W162 L207 S210 K256	W162-G212 CarbonylContact O-C 3.56Å; W162-G212 WeakPolarHBondContact O-CA 3.25Å; L207-G212 PolarHBondContact O-N 2.96Å; L207-G212 VanDerWaalsContact O-N 3.08Å; S210-G212 PolarHBondContact O-N 2.99Å; S210-G212 WeakPolarHBondContact OG-CA 3.49Å; S210-G212 PolarHBondContact OG-N 3.24Å; S210-G212 VanDerWaalsContact OG-N 3.12Å; G212-K256 PolarHBondContact O-N 3.33Å; G212-K256 VanDerWaalsContact O-N 3.15Å
213	R	98.3	Very high	95.1	Very high	12 Å²	12	25.5 Å²	25.5	5%	0.045	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	131.7	-172.2	-55.5	-68.3	-175.5	-86.9	-0.1	110.3	W162 A163 V164 K211 V215 K256 A331	W162-R213 HydrophobicContact CZ2-CG 4.07Å; W162-R213 VanDerWaalsContact CZ2-CZ 3.49Å; W162-R213 PolarHBondContact O-N 3.15Å; A163-R213 CarbonylContact C-O 3.51Å; A163-R213 WeakPolarHBondContact CA-O 3.28Å; A163-R213 HydrophobicContact CB-CB 3.86Å; V164-R213 PolarHBondContact N-O 2.91Å; K211-R213 PolarHBondContact O-NH1 2.97Å; R213-V215 HydrophobicContact CB-CG2 4.45Å; R213-K256 CarbonylContact C-O 3.52Å; R213-K256 WeakPolarHBondContact CA-O 3.4Å; R213-A331 PolarHBondContact NH2-O 3.07Å; R213-A331 VanDerWaalsContact NH2-O 3.09Å
214	L	98.8	Very high	94.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.4	166.2	179	64.9	0	0	0	107.6	V164 T200 L207 M246 L250 I255 K256 V257 V258	V164-L214 HydrophobicContact CB-CD1 4.12Å; V164-L214 HydrophobicContact CG1-CD1 4.25Å; T200-L214 HydrophobicContact CG2-CD1 4.03Å; T200-L214 HydrophobicContact CG2-CD2 3.51Å; T200-L214 HydrophobicContact CG2-CG 4.44Å; L207-L214 HydrophobicContact CD1-CB 4.38Å; L214-M246 HydrophobicContact CD2-CB 4.48Å; L214-L250 HydrophobicContact CD2-CD1 4.17Å; L214-I255 HydrophobicContact CB-CG2 4.48Å; L214-K256 PolarHBondContact N-O 3.24Å; L214-V257 HydrophobicContact CB-CG1 4.26Å; L214-V257 HydrophobicContact CB-CG2 4.15Å; L214-V257 HydrophobicContact CD2-CG1 3.98Å; L214-V257 HydrophobicContact CD2-CG2 4.23Å; L214-V257 HydrophobicContact CG-CG1 4.22Å; L214-V257 CarbonylContact O-C 3.59Å; L214-V257 VanDerWaalsContact O-CA 3.29Å; L214-V257 WeakPolarHBondContact O-CA 3.5Å; L214-V258 PolarHBondContact O-N 3.38Å
215	V	98.8	Very high	94.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117	-179.8	-176	0	0	0	0	108	V164 V165 N166 R213 V258 I260 A328 I329	V164-V215 PolarHBondContact O-N 3.13Å; V165-V215 CarbonylContact C-O 3.56Å; V165-V215 VanDerWaalsContact CA-O 3.29Å; V165-V215 WeakPolarHBondContact CA-O 3.29Å; V165-V215 HydrophobicContact CG1-CB 4.4Å; V165-V215 HydrophobicContact CG1-CG1 4.36Å; V165-V215 HydrophobicContact CG2-CB 4.25Å; N166-V215 PolarHBondContact N-O 3.35Å; R213-V215 HydrophobicContact CB-CG2 4.45Å; V215-V258 WeakPolarHBondContact CA-O 3.43Å; V215-V258 HydrophobicContact CG2-CB 4.38Å; V215-I260 HydrophobicContact CG1-CD1 4.09Å; V215-I260 HydrophobicContact CG1-CG1 3.59Å; V215-A328 HydrophobicContact CG2-CB 4.17Å; V215-I329 HydrophobicContact CG2-CG2 3.74Å
216	N	98.8	Very high	93.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.3	178.4	-66	-26.1	0	0	0	109.5	N166 S218 V239 S243 V258 S259 I260	N166-N216 WeakPolarHBondContact CB-OD1 3.11Å; N166-N216 PolarHBondContact ND2-OD1 3.17Å; N216-S218 PolarHBondContact O-N 2.98Å; N216-V239 HydrophobicContact CB-CG1 3.92Å; N216-S243 VanDerWaalsContact CB-OG 3.31Å; N216-S243 WeakPolarHBondContact CB-OG 3.47Å; N216-S243 PolarHBondContact ND2-OG 3.4Å; N216-V258 PolarHBondContact N-O 2.59Å; N216-S259 WeakPolarHBondContact O-CA 3.49Å; N216-I260 PolarHBondContact O-N 3.36Å
217	V	98	Very high	93.1	Very high	9 Å²	9	30.6 Å²	30.6	6%	0.055	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	97.2	176	-172.8	0	0	0	0	108.7	L94 V165 N166 N167 K236 P262 I325	L94-V217 HydrophobicContact CD2-CG1 4.34Å; V165-V217 HydrophobicContact CG1-CG2 4.15Å; N166-V217 WeakPolarHBondContact O-CB 3.43Å; N166-V217 PolarHBondContact O-N 2.74Å; N167-V217 HydrophobicContact CB-CB 4.43Å; N167-V217 HydrophobicContact CB-CG2 3.92Å; V217-K236 PolarHBondContact O-NZ 3.35Å; V217-P262 HydrophobicContact CG1-CG 3.94Å; V217-I325 HydrophobicContact CG2-CD1 4.33Å
218	S	95.4	Very high	92.6	Very high	3 Å²	3	31 Å²	31	2%	0.021	17%	0.168	C	C	.	.			trans	-82.2	-141.4	170.3	-172.8	0	0	0	0	109.9	N216 K236 T240 I260	N216-S218 PolarHBondContact O-N 2.98Å; S218-K236 PolarHBondContact OG-O 3.31Å; S218-T240 PolarHBondContact OG-OG1 3.43Å; S218-I260 CarbonylContact C-O 3.51Å; S218-I260 WeakPolarHBondContact CA-O 3.44Å; S218-I260 WeakPolarHBondContact CB-O 3.41Å; S218-I260 PolarHBondContact N-O 3.5Å
219	S	92.4	Very high	92.3	Very high	16 Å²	16	26.9 Å²	26.9	11%	0.112	15%	0.153	C	C	.	.			trans	-160	157.8	175.2	-176.6	0	0	0	0	109.5	G221 G222 G223 Y232	S219-G221 PolarHBondContact O-N 3.22Å; S219-G221 PolarHBondContact OG-N 3.4Å; S219-G222 WeakPolarHBondContact O-CA 2.97Å; S219-G222 PolarHBondContact O-N 3.1Å; S219-G223 PolarHBondContact O-N 2.66Å; S219-Y232 WeakPolarHBondContact CB-OH 3.27Å; S219-Y232 PolarHBondContact OG-OH 3.41Å
220	M	88.9	Confident	92.1	Very high	24 Å²	24	23.3 Å²	23.3	12%	0.118	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-52.6	-38.9	164.4	-178.1	-174.5	79.6	0	0	111.9	G222 G223 A224 M226 P262 A344 W347 L348	M220-G222 PolarHBondContact O-N 2.92Å; M220-G222 VanDerWaalsContact O-N 3.16Å; M220-G223 PolarHBondContact O-N 3.27Å; M220-A224 PolarHBondContact O-N 2.67Å; M220-M226 HydrophobicContact CE-CE 3.44Å; M220-M226 VanDerWaalsContact CE-CE 3.44Å; M220-M226 HydrophobicContact CE-SD 3.51Å; M220-M226 VanDerWaalsContact CE-SD 3.51Å; M220-P262 PolarHBondContact N-O 2.98Å; M220-P262 VanDerWaalsContact N-O 3.09Å; M220-A344 VanDerWaalsContact SD-CA 3.58Å; M220-A344 HydrophobicContact SD-CB 4.13Å; M220-W347 HydrophobicContact CE-CB 4.37Å; M220-W347 HydrophobicContact CE-CG 4.09Å; M220-W347 HydrophobicContact CG-CB 4.23Å; M220-W347 HydrophobicContact CG-CG 4.35Å; M220-W347 HydrophobicContact SD-CB 3.5Å; M220-W347 WeakPolarHBondContact SD-CB 3.13Å; M220-W347 HydrophobicContact SD-CG 3.8Å; M220-L348 HydrophobicContact CG-CD2 4.45Å; M220-L348 HydrophobicContact CG-CG 4.28Å
221	G	84.2	Confident	92.1	Very high	6 Å²	6	22.1 Å²	22.1	6%	0.062	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-68.5	-8	175.7	0	0	0	0	0	114.7	S219 G233	S219-G221 PolarHBondContact O-N 3.22Å; S219-G221 PolarHBondContact OG-N 3.4Å; G221-G233 WeakPolarHBondContact O-CA 3.13Å
222	G	83.8	Confident	92	Very high	8 Å²	8	16.6 Å²	16.6	8%	0.082	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-97.1	-4.4	168.7	0	0	0	0	0	113.8	S219 M220 A237	S219-G222 WeakPolarHBondContact O-CA 2.97Å; S219-G222 PolarHBondContact O-N 3.1Å; M220-G222 PolarHBondContact O-N 2.92Å; M220-G222 VanDerWaalsContact O-N 3.16Å; G222-A237 WeakPolarHBondContact O-CA 3.23Å; G222-A237 WeakPolarHBondContact O-CB 3.49Å
223	G	83.8	Confident	91.9	Very high	18 Å²	18	17 Å²	17	19%	0.186	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-23.8	176.9	0	0	0	0	0	113.6	S219 M220 L348 F352	S219-G223 PolarHBondContact O-N 2.66Å; M220-G223 PolarHBondContact O-N 3.27Å; G223-L348 VanDerWaalsContact C-CD2 3.44Å; G223-F352 WeakPolarHBondContact O-CZ 3.49Å
224	A	87.4	Confident	91.8	Very high	3 Å²	3	19.8 Å²	19.8	3%	0.025	14%	0.136	C	C	.	.	S	Bend	trans	-137.2	143.4	176.9	0	0	0	0	0	110	M220 L348 A351	M220-A224 PolarHBondContact O-N 2.67Å; A224-L348 HydrophobicContact CB-CD2 3.99Å; A224-A351 HydrophobicContact CB-CB 3.47Å; A224-A351 VanDerWaalsContact CB-CB 3.47Å
225	P	88.2	Confident	91.8	Very high	90 Å²	90	19.8 Å²	19.8	58%	0.584	14%	0.136	S	C	*	.			trans	-56	142.5	175.7	-24.5	33.9	0	0	0	112.5	Y359	P225-Y359 HydrophobicContact CB-CE1 4.2Å; P225-Y359 WeakPolarHBondContact CD-OH 3.31Å; P225-Y359 HydrophobicContact CG-CE1 4.26Å; P225-Y359 PolarHBondContact O-OH 3.1Å
226	M	87.3	Confident	91.7	Very high	33 Å²	33	20.1 Å²	20.1	16%	0.163	14%	0.137	C	C	.	.			trans	-142.5	129.4	173.1	-64.7	-177.4	80.2	0	0	107.4	M220 L229 F367	M220-M226 HydrophobicContact CE-CE 3.44Å; M220-M226 VanDerWaalsContact CE-CE 3.44Å; M220-M226 HydrophobicContact CE-SD 3.51Å; M220-M226 VanDerWaalsContact CE-SD 3.51Å; M226-L229 HydrophobicContact CB-CB 4.37Å; M226-L229 HydrophobicContact CB-CD1 3.91Å; M226-L229 HydrophobicContact CB-CG 4.43Å; M226-L229 HydrophobicContact CE-CD1 4.46Å; M226-L229 PolarHBondContact O-N 2.87Å; M226-L229 HydrophobicContact SD-CD1 3.99Å; M226-F367 HydrophobicContact CE-CE1 3.64Å; M226-F367 HydrophobicContact CE-CE2 4.06Å; M226-F367 HydrophobicContact CE-CZ 3.29Å
227	A	87.9	Confident	91.6	Very high	48 Å²	48	22 Å²	22	40%	0.397	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	149.1	173.7	0	0	0	0	0	109.8	L229 F367	A227-L229 PolarHBondContact O-N 3.02Å; A227-L229 VanDerWaalsContact O-N 3.16Å; A227-F367 HydrophobicContact CB-CB 4.33Å
228	K	88.5	Confident	91.7	Very high	10 Å²	10	22.8 Å²	22.8	4%	0.043	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	7.4	178.1	-55.3	168.1	-173.6	151.4	0	116.5	P174 S175 F306 F367 E371	P174-K228 CarbonylContact C-O 3.51Å; P174-K228 WeakPolarHBondContact CA-O 3.29Å; P174-K228 HydrophobicContact CB-CB 4.38Å; S175-K228 PolarHBondContact N-O 3.45Å; S175-K228 VanDerWaalsContact N-O 3.13Å; S175-K228 CarbonylContact O-C 3.59Å; S175-K228 VanDerWaalsContact O-CA 3.24Å; S175-K228 WeakPolarHBondContact O-CA 3.31Å; K228-F306 HydrophobicContact CB-CD1 3.97Å; K228-F306 HydrophobicContact CB-CE1 4Å; K228-F306 HydrophobicContact CB-CG 4.2Å; K228-F306 HydrophobicContact CB-CZ 4.33Å; K228-F306 HydrophobicContact CD-CB 3.65Å; K228-F306 HydrophobicContact CD-CD1 4.22Å; K228-F306 HydrophobicContact CD-CD2 3.68Å; K228-F306 HydrophobicContact CD-CE2 4.32Å; K228-F306 HydrophobicContact CD-CG 3.6Å; K228-F367 PolarHBondContact NZ-O 2.72Å; K228-E371 WeakPolarHBondContact CE-OE1 3.33Å; K228-E371 VanDerWaalsContact CE-OE2 3.25Å; K228-E371 WeakPolarHBondContact CE-OE2 3.45Å; K228-E371 IonicContact NZ-OE1 2.57Å; K228-E371 PolarHBondContact NZ-OE1 3.15Å; K228-E371 IonicContact NZ-OE2 2.68Å; K228-E371 PolarHBondContact NZ-OE2 2.89Å
229	L	90.9	Very high	91.8	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.073	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-119.9	34.9	179.2	-65	-178.4	0	0	0	111.5	L171 P174 M226 A227 Y232 G233 F306	L171-L229 HydrophobicContact CD1-CD2 3.86Å; P174-L229 HydrophobicContact CB-CD2 4.42Å; M226-L229 HydrophobicContact CB-CB 4.37Å; M226-L229 HydrophobicContact CB-CD1 3.91Å; M226-L229 HydrophobicContact CB-CG 4.43Å; M226-L229 HydrophobicContact CE-CD1 4.46Å; M226-L229 PolarHBondContact O-N 2.87Å; M226-L229 HydrophobicContact SD-CD1 3.99Å; A227-L229 PolarHBondContact O-N 3.02Å; A227-L229 VanDerWaalsContact O-N 3.16Å; L229-Y232 HydrophobicContact CD1-CD1 4.36Å; L229-Y232 HydrophobicContact CD2-CD1 4.25Å; L229-G233 VanDerWaalsContact O-CA 3.23Å; L229-G233 WeakPolarHBondContact O-CA 3.43Å; L229-G233 PolarHBondContact O-N 2.89Å; L229-F306 HydrophobicContact CD1-CE1 4.44Å; L229-F306 HydrophobicContact CD1-CZ 4.47Å; L229-F306 HydrophobicContact CD2-CE1 3.94Å; L229-F306 HydrophobicContact CG-CE1 3.98Å; L229-F306 HydrophobicContact CG-CZ 4.28Å
230	A	93.6	Very high	92	Very high	30 Å²	30	22.9 Å²	22.9	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-49.7	-173.7	0	0	0	0	0	112.7	L180 Y185 S234	L180-A230 HydrophobicContact CD1-CB 4.23Å; Y185-A230 HydrophobicContact CE1-CB 4.26Å; Y185-A230 WeakPolarHBondContact OH-CB 3.45Å; A230-S234 WeakPolarHBondContact O-CB 3.27Å; A230-S234 PolarHBondContact O-N 3.35Å; A230-S234 PolarHBondContact O-OG 3.3Å
231	S	94.4	Very high	92.4	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.014	18%	0.184	C	C	.	.	H	α-helix	trans	-68.4	-52.4	178.3	60	0	0	0	0	112.1	D184 S235	D184-S231 WeakPolarHBondContact OD2-CB 3.49Å; D184-S231 PolarHBondContact OD2-OG 3.35Å; S231-S235 PolarHBondContact O-N 3.29Å; S231-S235 VanDerWaalsContact O-N 3.1Å
232	Y	94.9	Very high	93.1	Very high	22 Å²	22	29 Å²	29	9%	0.086	19%	0.188	C	C	.	.	H	α-helix	trans	-60.6	-55	179.6	178	-108.4	0	0	0	112.9	V170 L171 S219 L229 S234 S235 K236 I269	V170-Y232 WeakPolarHBondContact O-CD2 3.49Å; V170-Y232 WeakPolarHBondContact O-CE2 3.45Å; L171-Y232 HydrophobicContact CD1-CD1 3.84Å; L171-Y232 HydrophobicContact CD1-CD2 3.91Å; L171-Y232 HydrophobicContact CD1-CE1 4.11Å; L171-Y232 HydrophobicContact CD1-CE2 4.17Å; L171-Y232 HydrophobicContact CD1-CG 3.72Å; L171-Y232 WeakPolarHBondContact O-CB 3.38Å; S219-Y232 WeakPolarHBondContact CB-OH 3.27Å; S219-Y232 PolarHBondContact OG-OH 3.41Å; L229-Y232 HydrophobicContact CD1-CD1 4.36Å; L229-Y232 HydrophobicContact CD2-CD1 4.25Å; Y232-S234 VanDerWaalsContact C-N 3.31Å; Y232-S234 PolarHBondContact O-N 3.14Å; Y232-S235 PolarHBondContact O-N 3.32Å; Y232-S235 VanDerWaalsContact O-N 3.1Å; Y232-S235 PolarHBondContact O-OG 2.75Å; Y232-K236 HydrophobicContact CD1-CG 4.41Å; Y232-K236 HydrophobicContact CD2-CG 4.19Å; Y232-K236 HydrophobicContact CE1-CG 3.96Å; Y232-K236 HydrophobicContact CE2-CD 4.25Å; Y232-K236 HydrophobicContact CE2-CG 3.74Å; Y232-K236 PolarHBondContact O-N 2.74Å; Y232-K236 WeakPolarHBondContact OH-CE 3.17Å; Y232-I269 HydrophobicContact CE2-CD1 4.32Å
233	G	95.4	Very high	93.8	Very high	9 Å²	9	28.6 Å²	28.6	9%	0.093	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-43.5	-177.5	0	0	0	0	0	111.2	G221 L229 S235 K236 A237	G221-G233 WeakPolarHBondContact O-CA 3.13Å; L229-G233 VanDerWaalsContact O-CA 3.23Å; L229-G233 WeakPolarHBondContact O-CA 3.43Å; L229-G233 PolarHBondContact O-N 2.89Å; G233-S235 PolarHBondContact O-N 3.48Å; G233-K236 PolarHBondContact O-N 3.49Å; G233-A237 VanDerWaalsContact O-CB 3.32Å; G233-A237 WeakPolarHBondContact O-CB 3.37Å; G233-A237 PolarHBondContact O-N 3.46Å
234	S	96.9	Very high	94.5	Very high	70 Å²	70	28.8 Å²	28.8	49%	0.49	18%	0.183	S	C	.	.	H	α-helix	trans	-59.4	-45.5	174.1	-63.3	0	0	0	0	112.2	A230 Y232 K236 A237 A238	A230-S234 WeakPolarHBondContact O-CB 3.27Å; A230-S234 PolarHBondContact O-N 3.35Å; A230-S234 PolarHBondContact O-OG 3.3Å; Y232-S234 VanDerWaalsContact C-N 3.31Å; Y232-S234 PolarHBondContact O-N 3.14Å; S234-K236 PolarHBondContact O-N 3.16Å; S234-A237 PolarHBondContact O-N 2.95Å; S234-A238 PolarHBondContact O-N 3.03Å
235	S	98.1	Very high	95	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-37.8	177.8	77	0	0	0	0	113	N192 S231 Y232 G233 A238 V239	N192-S235 WeakPolarHBondContact CB-OG 3.45Å; N192-S235 PolarHBondContact ND2-OG 3.09Å; S231-S235 PolarHBondContact O-N 3.29Å; S231-S235 VanDerWaalsContact O-N 3.1Å; Y232-S235 PolarHBondContact O-N 3.32Å; Y232-S235 VanDerWaalsContact O-N 3.1Å; Y232-S235 PolarHBondContact O-OG 2.75Å; G233-S235 PolarHBondContact O-N 3.48Å; S235-A238 WeakPolarHBondContact O-CB 3.36Å; S235-A238 PolarHBondContact O-N 2.94Å; S235-V239 WeakPolarHBondContact O-CG2 3.43Å; S235-V239 PolarHBondContact O-N 3.09Å
236	K	97.2	Very high	95.5	Very high	7 Å²	7	28.1 Å²	28.1	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-74.9	-32.9	176.8	-68.5	-62.1	-168.5	177	0	112.1	V217 S218 Y232 G233 S234 A238 V239 T240	V217-K236 PolarHBondContact O-NZ 3.35Å; S218-K236 PolarHBondContact OG-O 3.31Å; Y232-K236 HydrophobicContact CD1-CG 4.41Å; Y232-K236 HydrophobicContact CD2-CG 4.19Å; Y232-K236 HydrophobicContact CE1-CG 3.96Å; Y232-K236 HydrophobicContact CE2-CD 4.25Å; Y232-K236 HydrophobicContact CE2-CG 3.74Å; Y232-K236 PolarHBondContact O-N 2.74Å; Y232-K236 WeakPolarHBondContact OH-CE 3.17Å; G233-K236 PolarHBondContact O-N 3.49Å; S234-K236 PolarHBondContact O-N 3.16Å; K236-A238 VanDerWaalsContact C-N 3.34Å; K236-V239 PolarHBondContact O-N 3.43Å; K236-T240 PolarHBondContact O-N 2.92Å; K236-T240 PolarHBondContact O-OG1 2.87Å; K236-T240 VanDerWaalsContact O-OG1 3.1Å
237	A	97.4	Very high	96	Very high	41 Å²	41	29.4 Å²	29.4	34%	0.339	18%	0.179	S	C	.	.	H	α-helix	trans	-62.8	-41.8	170.8	0	0	0	0	0	111.5	G222 G233 S234 V239 T240 M241	G222-A237 WeakPolarHBondContact O-CA 3.23Å; G222-A237 WeakPolarHBondContact O-CB 3.49Å; G233-A237 VanDerWaalsContact O-CB 3.32Å; G233-A237 WeakPolarHBondContact O-CB 3.37Å; G233-A237 PolarHBondContact O-N 3.46Å; S234-A237 PolarHBondContact O-N 2.95Å; A237-V239 VanDerWaalsContact C-N 3.32Å; A237-V239 PolarHBondContact O-N 3.39Å; A237-T240 WeakPolarHBondContact O-CB 3.42Å; A237-T240 PolarHBondContact O-N 2.88Å; A237-M241 PolarHBondContact O-N 3.34Å
238	A	98.5	Very high	96.5	Very high	25 Å²	25	33.3 Å²	33.3	21%	0.207	19%	0.191	C	C	.	.	H	α-helix	trans	-58.9	-42.5	173	0	0	0	0	0	111.9	M189 F193 S234 S235 K236 M241 F242	M189-A238 HydrophobicContact CE-CB 4.46Å; F193-A238 HydrophobicContact CB-CB 4.37Å; F193-A238 HydrophobicContact CD1-CB 4.45Å; F193-A238 HydrophobicContact CD2-CB 3.51Å; F193-A238 HydrophobicContact CE2-CB 3.81Å; F193-A238 HydrophobicContact CG-CB 3.85Å; F193-A238 HydrophobicContact CZ-CB 4.4Å; S234-A238 PolarHBondContact O-N 3.03Å; S235-A238 WeakPolarHBondContact O-CB 3.36Å; S235-A238 PolarHBondContact O-N 2.94Å; K236-A238 VanDerWaalsContact C-N 3.34Å; A238-M241 PolarHBondContact O-N 3.08Å; A238-F242 VanDerWaalsContact O-CB 3.26Å; A238-F242 WeakPolarHBondContact O-CB 3.36Å; A238-F242 PolarHBondContact O-N 3.16Å
239	V	98.5	Very high	97	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-42.5	174.3	173.6	0	0	0	0	112.1	N192 F193 T196 N216 S235 K236 A237 F242 S243	N192-V239 WeakPolarHBondContact O-CG2 3.31Å; F193-V239 HydrophobicContact CB-CG2 4.39Å; F193-V239 HydrophobicContact CD2-CG2 4.19Å; T196-V239 HydrophobicContact CG2-CG1 4.43Å; N216-V239 HydrophobicContact CB-CG1 3.92Å; S235-V239 WeakPolarHBondContact O-CG2 3.43Å; S235-V239 PolarHBondContact O-N 3.09Å; K236-V239 PolarHBondContact O-N 3.43Å; A237-V239 VanDerWaalsContact C-N 3.32Å; A237-V239 PolarHBondContact O-N 3.39Å; V239-F242 PolarHBondContact O-N 3.29Å; V239-S243 WeakPolarHBondContact O-CB 3.47Å; V239-S243 PolarHBondContact O-N 3.28Å; V239-S243 PolarHBondContact O-OG 3.28Å
240	T	96.7	Very high	97.3	Very high	20 Å²	20	37.4 Å²	37.4	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-47.5	176.8	-60.2	0	0	0	0	111.1	S218 K236 A237 S243 S244 Y337	S218-T240 PolarHBondContact OG-OG1 3.43Å; K236-T240 PolarHBondContact O-N 2.92Å; K236-T240 PolarHBondContact O-OG1 2.87Å; K236-T240 VanDerWaalsContact O-OG1 3.1Å; A237-T240 WeakPolarHBondContact O-CB 3.42Å; A237-T240 PolarHBondContact O-N 2.88Å; T240-S243 PolarHBondContact O-N 3.33Å; T240-S244 PolarHBondContact O-N 3.14Å; T240-S244 VanDerWaalsContact O-N 3.15Å; T240-S244 PolarHBondContact O-OG 3.4Å; T240-Y337 HydrophobicContact CG2-CE1 4.43Å
241	M	97.8	Very high	97.5	Very high	125 Å²	125	39.7 Å²	39.7	62%	0.616	23%	0.225	S	C	*	.	H	α-helix	trans	-65	-47.9	178.7	-176.3	55.4	70	0	0	111.2	A237 A238 S243 S244 V245	A237-M241 PolarHBondContact O-N 3.34Å; A238-M241 PolarHBondContact O-N 3.08Å; M241-S243 VanDerWaalsContact C-N 3.3Å; M241-S243 PolarHBondContact O-N 2.98Å; M241-S244 WeakPolarHBondContact O-CB 3.33Å; M241-S244 PolarHBondContact O-N 3.15Å; M241-V245 PolarHBondContact O-N 3.12Å; M241-V245 HydrophobicContact SD-CG2 4.45Å
242	F	98.6	Very high	97.6	Very high	32 Å²	32	47.5 Å²	47.5	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-54.9	-45.1	175.6	172.1	-108.3	0	0	0	112.1	F193 T196 V197 T200 A238 V239 S244 V245 M246	F193-F242 HydrophobicContact CE2-CB 3.94Å; F193-F242 HydrophobicContact CE2-CG 4.4Å; T196-F242 HydrophobicContact CG2-CD1 4.33Å; T196-F242 HydrophobicContact CG2-CE1 4.24Å; V197-F242 HydrophobicContact CB-CZ 4.42Å; V197-F242 HydrophobicContact CG1-CE2 4.48Å; V197-F242 HydrophobicContact CG2-CD1 4.29Å; V197-F242 HydrophobicContact CG2-CD2 4.09Å; V197-F242 HydrophobicContact CG2-CE1 4.13Å; V197-F242 HydrophobicContact CG2-CE2 3.92Å; V197-F242 HydrophobicContact CG2-CG 4.27Å; V197-F242 HydrophobicContact CG2-CZ 3.94Å; T200-F242 HydrophobicContact CG2-CE1 4.31Å; T200-F242 HydrophobicContact CG2-CZ 4.05Å; A238-F242 VanDerWaalsContact O-CB 3.26Å; A238-F242 WeakPolarHBondContact O-CB 3.36Å; A238-F242 PolarHBondContact O-N 3.16Å; V239-F242 PolarHBondContact O-N 3.29Å; F242-S244 VanDerWaalsContact C-N 3.26Å; F242-S244 PolarHBondContact O-N 2.94Å; F242-V245 PolarHBondContact O-N 3.13Å; F242-M246 HydrophobicContact CD1-CG 4.23Å; F242-M246 HydrophobicContact CD2-CG 3.82Å; F242-M246 HydrophobicContact CD2-SD 4.32Å; F242-M246 HydrophobicContact CE1-CG 3.87Å; F242-M246 HydrophobicContact CE2-CG 3.41Å; F242-M246 VanDerWaalsContact CE2-CG 3.41Å; F242-M246 HydrophobicContact CE2-SD 3.55Å; F242-M246 VanDerWaalsContact CE2-SD 3.55Å; F242-M246 HydrophobicContact CG-CG 4.22Å; F242-M246 HydrophobicContact CZ-CE 4.41Å; F242-M246 HydrophobicContact CZ-CG 3.45Å; F242-M246 VanDerWaalsContact CZ-CG 3.45Å; F242-M246 HydrophobicContact CZ-SD 3.84Å; F242-M246 WeakPolarHBondContact O-CB 3.42Å; F242-M246 VanDerWaalsContact O-CG 3.25Å; F242-M246 WeakPolarHBondContact O-CG 3.37Å; F242-M246 PolarHBondContact O-N 3.44Å
243	S	98.3	Very high	97.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-37.1	177.7	-55.7	0	0	0	0	112.4	N216 V239 T240 M241 R247 V257	N216-S243 VanDerWaalsContact CB-OG 3.31Å; N216-S243 WeakPolarHBondContact CB-OG 3.47Å; N216-S243 PolarHBondContact ND2-OG 3.4Å; V239-S243 WeakPolarHBondContact O-CB 3.47Å; V239-S243 PolarHBondContact O-N 3.28Å; V239-S243 PolarHBondContact O-OG 3.28Å; T240-S243 PolarHBondContact O-N 3.33Å; M241-S243 VanDerWaalsContact C-N 3.3Å; M241-S243 PolarHBondContact O-N 2.98Å; S243-R247 WeakPolarHBondContact O-CB 3.46Å; S243-R247 PolarHBondContact O-N 3.23Å; S243-V257 WeakPolarHBondContact O-CG1 3.32Å
244	S	97.2	Very high	97.8	Very high	23 Å²	23	53 Å²	53	16%	0.161	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-43.8	178.7	-55.4	0	0	0	0	111.7	T240 M241 F242 R247 Y337	T240-S244 PolarHBondContact O-N 3.14Å; T240-S244 VanDerWaalsContact O-N 3.15Å; T240-S244 PolarHBondContact O-OG 3.4Å; M241-S244 WeakPolarHBondContact O-CB 3.33Å; M241-S244 PolarHBondContact O-N 3.15Å; F242-S244 VanDerWaalsContact C-N 3.26Å; F242-S244 PolarHBondContact O-N 2.94Å; S244-R247 WeakPolarHBondContact O-CB 3.48Å; S244-R247 PolarHBondContact O-N 2.87Å; S244-Y337 PolarHBondContact OG-OH 3.36Å
245	V	98.4	Very high	97.9	Very high	63 Å²	63	49.9 Å²	49.9	38%	0.382	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-50.6	175.1	174.5	0	0	0	0	110.8	M241 F242 R247 I248 E249	M241-V245 PolarHBondContact O-N 3.12Å; M241-V245 HydrophobicContact SD-CG2 4.45Å; F242-V245 PolarHBondContact O-N 3.13Å; V245-R247 PolarHBondContact O-N 2.78Å; V245-I248 WeakPolarHBondContact O-CB 3.23Å; V245-I248 PolarHBondContact O-N 3.31Å; V245-E249 HydrophobicContact CG1-CG 4.26Å; V245-E249 WeakPolarHBondContact CG1-OE1 3.39Å; V245-E249 PolarHBondContact O-N 3.22Å
246	M	98.5	Very high	97.9	Very high	16 Å²	16	54.4 Å²	54.4	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-30.5	179.4	-66.7	-57	-67.3	0	0	112.2	T200 L204 L214 F242 I248 E249 L250 V257	T200-M246 HydrophobicContact CG2-CE 4.17Å; L204-M246 HydrophobicContact CD1-CE 4.14Å; L214-M246 HydrophobicContact CD2-CB 4.48Å; F242-M246 HydrophobicContact CD1-CG 4.23Å; F242-M246 HydrophobicContact CD2-CG 3.82Å; F242-M246 HydrophobicContact CD2-SD 4.32Å; F242-M246 HydrophobicContact CE1-CG 3.87Å; F242-M246 HydrophobicContact CE2-CG 3.41Å; F242-M246 VanDerWaalsContact CE2-CG 3.41Å; F242-M246 HydrophobicContact CE2-SD 3.55Å; F242-M246 VanDerWaalsContact CE2-SD 3.55Å; F242-M246 HydrophobicContact CG-CG 4.22Å; F242-M246 HydrophobicContact CZ-CE 4.41Å; F242-M246 HydrophobicContact CZ-CG 3.45Å; F242-M246 VanDerWaalsContact CZ-CG 3.45Å; F242-M246 HydrophobicContact CZ-SD 3.84Å; F242-M246 WeakPolarHBondContact O-CB 3.42Å; F242-M246 VanDerWaalsContact O-CG 3.25Å; F242-M246 WeakPolarHBondContact O-CG 3.37Å; F242-M246 PolarHBondContact O-N 3.44Å; M246-I248 VanDerWaalsContact C-N 3.3Å; M246-I248 PolarHBondContact O-N 3.18Å; M246-E249 PolarHBondContact O-N 2.94Å; M246-L250 HydrophobicContact CB-CD1 4.27Å; M246-L250 HydrophobicContact CE-CD1 3.68Å; M246-L250 HydrophobicContact CE-CD2 3.96Å; M246-L250 HydrophobicContact CE-CG 3.79Å; M246-L250 WeakPolarHBondContact O-CB 3.47Å; M246-L250 VanDerWaalsContact O-CG 3.23Å; M246-L250 WeakPolarHBondContact O-CG 3.44Å; M246-L250 PolarHBondContact O-N 3.44Å; M246-V257 HydrophobicContact CB-CG1 4.36Å; M246-V257 HydrophobicContact CB-CG2 4.32Å
247	R	98.3	Very high	98	Very high	60 Å²	60	54.3 Å²	54.3	23%	0.226	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-41.1	174.2	-166.9	-176	-60.3	130.5	3	112.1	S243 S244 V245 S251 V257 A336 Y337	S243-R247 WeakPolarHBondContact O-CB 3.46Å; S243-R247 PolarHBondContact O-N 3.23Å; S244-R247 WeakPolarHBondContact O-CB 3.48Å; S244-R247 PolarHBondContact O-N 2.87Å; V245-R247 PolarHBondContact O-N 2.78Å; R247-S251 PolarHBondContact O-N 3.46Å; R247-V257 HydrophobicContact CB-CB 3.88Å; R247-V257 HydrophobicContact CB-CG2 4.42Å; R247-V257 HydrophobicContact CG-CB 4.22Å; R247-V257 PolarHBondContact NE-O 2.95Å; R247-A336 PolarHBondContact NH2-O 3.04Å; R247-Y337 PolarHBondContact NH1-OH 3.17Å
248	I	98.3	Very high	98	Very high	129 Å²	129	52.4 Å²	52.4	66%	0.662	27%	0.267	S	S	*	.	H	α-helix	trans	-71.3	-51.9	178.4	-60.4	168.6	0	0	0	109	V245 M246 L250 S251	V245-I248 WeakPolarHBondContact O-CB 3.23Å; V245-I248 PolarHBondContact O-N 3.31Å; M246-I248 VanDerWaalsContact C-N 3.3Å; M246-I248 PolarHBondContact O-N 3.18Å; I248-L250 PolarHBondContact O-N 3.05Å; I248-S251 WeakPolarHBondContact O-CB 3.37Å; I248-S251 PolarHBondContact O-N 3.32Å; I248-S251 PolarHBondContact O-OG 3.45Å
249	E	98.3	Very high	97.9	Very high	103 Å²	103	51.2 Å²	51.2	48%	0.481	26%	0.257	S	S	.	.	H	α-helix	trans	-65.5	-37.3	-174.9	-66.3	-175.9	-178.9	0	0	113.7	V245 M246 K252	V245-E249 HydrophobicContact CG1-CG 4.26Å; V245-E249 WeakPolarHBondContact CG1-OE1 3.39Å; V245-E249 PolarHBondContact O-N 3.22Å; M246-E249 PolarHBondContact O-N 2.94Å; E249-K252 WeakPolarHBondContact O-CE 3.49Å; E249-K252 WeakPolarHBondContact O-CG 3.25Å
250	L	98.4	Very high	97.8	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-85.9	-8.3	-177.7	-60.7	-178.4	0	0	0	114	L204 L214 M246 I248 K252 W253 G254 I255 V257	L204-L250 HydrophobicContact CD1-CD2 4.31Å; L204-L250 HydrophobicContact CD2-CD1 3.67Å; L204-L250 HydrophobicContact CD2-CD2 3.68Å; L204-L250 HydrophobicContact CD2-CG 4.35Å; L214-L250 HydrophobicContact CD2-CD1 4.17Å; M246-L250 HydrophobicContact CB-CD1 4.27Å; M246-L250 HydrophobicContact CE-CD1 3.68Å; M246-L250 HydrophobicContact CE-CD2 3.96Å; M246-L250 HydrophobicContact CE-CG 3.79Å; M246-L250 WeakPolarHBondContact O-CB 3.47Å; M246-L250 VanDerWaalsContact O-CG 3.23Å; M246-L250 WeakPolarHBondContact O-CG 3.44Å; M246-L250 PolarHBondContact O-N 3.44Å; I248-L250 PolarHBondContact O-N 3.05Å; L250-K252 VanDerWaalsContact C-N 3.29Å; L250-K252 PolarHBondContact O-N 2.77Å; L250-W253 WeakPolarHBondContact O-CA 3.44Å; L250-W253 WeakPolarHBondContact O-CB 3.47Å; L250-W253 PolarHBondContact O-N 2.77Å; L250-G254 PolarHBondContact O-N 3.19Å; L250-I255 HydrophobicContact CB-CB 4.11Å; L250-I255 HydrophobicContact CB-CG2 4.46Å; L250-I255 HydrophobicContact CD1-CG2 4.13Å; L250-I255 PolarHBondContact O-N 2.96Å; L250-V257 HydrophobicContact CB-CG2 4.24Å; L250-V257 HydrophobicContact CD1-CG2 3.83Å
251	S	97.1	Very high	97.7	Very high	78 Å²	78	50.8 Å²	50.8	55%	0.545	25%	0.254	S	S	.	.	H	α-helix	trans	-56.7	-41.4	179.1	66.7	0	0	0	0	112.5	R247 I248 W253 G254	R247-S251 PolarHBondContact O-N 3.46Å; I248-S251 WeakPolarHBondContact O-CB 3.37Å; I248-S251 PolarHBondContact O-N 3.32Å; I248-S251 PolarHBondContact O-OG 3.45Å; S251-W253 PolarHBondContact O-N 3.4Å; S251-G254 PolarHBondContact O-N 3.23Å
252	K	96.7	Very high	97.5	Very high	166 Å²	166	45.6 Å²	45.6	72%	0.722	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.5	176.5	68.7	-171.4	171.7	-174.4	0	113.8	E249 L250	E249-K252 WeakPolarHBondContact O-CE 3.49Å; E249-K252 WeakPolarHBondContact O-CG 3.25Å; L250-K252 VanDerWaalsContact C-N 3.29Å; L250-K252 PolarHBondContact O-N 2.77Å
253	W	97.6	Very high	97	Very high	118 Å²	118	44.4 Å²	44.4	45%	0.447	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-0.9	176.5	-59.7	96.5	0	0	0	112.6	R208 L250 S251 I255	R208-W253 HydrophobicContact CG-CB 4.46Å; R208-W253 HydrophobicContact CG-CD2 4.26Å; R208-W253 HydrophobicContact CG-CE3 3.97Å; L250-W253 WeakPolarHBondContact O-CA 3.44Å; L250-W253 WeakPolarHBondContact O-CB 3.47Å; L250-W253 PolarHBondContact O-N 2.77Å; S251-W253 PolarHBondContact O-N 3.4Å; W253-I255 HydrophobicContact CB-CD1 4.1Å; W253-I255 HydrophobicContact CB-CG1 4.26Å; W253-I255 PolarHBondContact O-N 3.12Å
254	G	97.4	Very high	96.2	Very high	29 Å²	29	46.5 Å²	46.5	30%	0.299	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	6	-176.4	0	0	0	0	0	114.5	L250 S251	L250-G254 PolarHBondContact O-N 3.19Å; S251-G254 PolarHBondContact O-N 3.23Å
255	I	98.4	Very high	95.6	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.015	25%	0.245	C	C	.	.			trans	-81.5	129.5	178.4	-61.5	165.9	0	0	0	108.6	L204 L207 R208 L214 L250 W253	L204-I255 HydrophobicContact CD2-CD1 3.98Å; L207-I255 HydrophobicContact CB-CD1 3.87Å; L207-I255 HydrophobicContact CB-CG1 4.34Å; R208-I255 HydrophobicContact CG-CD1 3.88Å; L214-I255 HydrophobicContact CB-CG2 4.48Å; L250-I255 HydrophobicContact CB-CB 4.11Å; L250-I255 HydrophobicContact CB-CG2 4.46Å; L250-I255 HydrophobicContact CD1-CG2 4.13Å; L250-I255 PolarHBondContact O-N 2.96Å; W253-I255 HydrophobicContact CB-CD1 4.1Å; W253-I255 HydrophobicContact CB-CG1 4.26Å; W253-I255 PolarHBondContact O-N 3.12Å
256	K	98.2	Very high	94.8	Very high	95 Å²	95	50.8 Å²	50.8	41%	0.413	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.2	174.8	-51.5	-61.4	-175.9	177.5	0	110	G212 R213 L214 P334	G212-K256 PolarHBondContact O-N 3.33Å; G212-K256 VanDerWaalsContact O-N 3.15Å; R213-K256 CarbonylContact C-O 3.52Å; R213-K256 WeakPolarHBondContact CA-O 3.4Å; L214-K256 PolarHBondContact N-O 3.24Å; K256-P334 HydrophobicContact CB-CG 4.07Å; K256-P334 HydrophobicContact CG-CG 4.36Å
257	V	98.6	Very high	93.9	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.7	179.2	-171.4	0	0	0	0	110.3	L214 S243 M246 R247 L250	L214-V257 HydrophobicContact CB-CG1 4.26Å; L214-V257 HydrophobicContact CB-CG2 4.15Å; L214-V257 HydrophobicContact CD2-CG1 3.98Å; L214-V257 HydrophobicContact CD2-CG2 4.23Å; L214-V257 HydrophobicContact CG-CG1 4.22Å; L214-V257 CarbonylContact O-C 3.59Å; L214-V257 VanDerWaalsContact O-CA 3.29Å; L214-V257 WeakPolarHBondContact O-CA 3.5Å; S243-V257 WeakPolarHBondContact O-CG1 3.32Å; M246-V257 HydrophobicContact CB-CG1 4.36Å; M246-V257 HydrophobicContact CB-CG2 4.32Å; R247-V257 HydrophobicContact CB-CB 3.88Å; R247-V257 HydrophobicContact CB-CG2 4.42Å; R247-V257 HydrophobicContact CG-CB 4.22Å; R247-V257 PolarHBondContact NE-O 2.95Å; L250-V257 HydrophobicContact CB-CG2 4.24Å; L250-V257 HydrophobicContact CD1-CG2 3.83Å
258	V	97.9	Very high	92.9	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.1	-175.6	-178.8	0	0	0	0	109.8	L214 V215 N216 I260 A328 P334 F335 Y338	L214-V258 PolarHBondContact O-N 3.38Å; V215-V258 WeakPolarHBondContact CA-O 3.43Å; V215-V258 HydrophobicContact CG2-CB 4.38Å; N216-V258 PolarHBondContact N-O 2.59Å; V258-I260 HydrophobicContact CG1-CD1 3.77Å; V258-A328 HydrophobicContact CB-CB 4.18Å; V258-A328 HydrophobicContact CG1-CB 3.79Å; V258-A328 HydrophobicContact CG2-CB 4.14Å; V258-P334 HydrophobicContact CG2-CB 3.96Å; V258-P334 HydrophobicContact CG2-CG 4.02Å; V258-F335 WeakPolarHBondContact CG2-O 3.31Å; V258-Y338 HydrophobicContact CG1-CD2 3.36Å; V258-Y338 HydrophobicContact CG1-CE2 3.4Å
259	S	97.3	Very high	91.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124	170.7	-179.9	0	0	0	0	109.6	N216 A336 Y337 Y338	N216-S259 WeakPolarHBondContact O-CA 3.49Å; S259-A336 PolarHBondContact N-O 3.45Å; S259-Y337 VanDerWaalsContact O-CA 3.31Å; S259-Y337 WeakPolarHBondContact O-CA 3.48Å; S259-Y338 PolarHBondContact O-N 3.44Å
260	I	96.5	Very high	90.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.9	171.7	-46.3	-63.3	0	0	0	107.5	V215 N216 S218 V258 P262 V321 I325 A328 Y338 P340	V215-I260 HydrophobicContact CG1-CD1 4.09Å; V215-I260 HydrophobicContact CG1-CG1 3.59Å; N216-I260 PolarHBondContact O-N 3.36Å; S218-I260 CarbonylContact C-O 3.51Å; S218-I260 WeakPolarHBondContact CA-O 3.44Å; S218-I260 WeakPolarHBondContact CB-O 3.41Å; S218-I260 PolarHBondContact N-O 3.5Å; V258-I260 HydrophobicContact CG1-CD1 3.77Å; I260-P262 HydrophobicContact CG2-CG 4Å; I260-P262 WeakPolarHBondContact O-CD 3.23Å; I260-V321 HydrophobicContact CG2-CG1 4.34Å; I260-I325 HydrophobicContact CD1-CG1 4.28Å; I260-I325 HydrophobicContact CG1-CG1 3.97Å; I260-A328 HydrophobicContact CD1-CB 4.17Å; I260-Y338 CarbonylContact C-O 3.58Å; I260-Y338 HydrophobicContact CD1-CD2 3.62Å; I260-Y338 HydrophobicContact CD1-CG 3.8Å; I260-P340 HydrophobicContact CG2-CG 3.84Å
261	Q	94.4	Very high	89.2	Confident	13 Å²	13	44.8 Å²	44.8	6%	0.061	24%	0.244	C	C	.	.			trans	-122.9	76.9	-179.1	-69.7	174.9	-9.1	0	0	109.8	Y338 T339 L348	Q261-Y338 PolarHBondContact N-O 3.43Å; Q261-T339 HydrophobicContact CB-CG2 4.25Å; Q261-L348 VanDerWaalsContact OE1-CD1 3.26Å
262	P	92.2	Very high	88	Confident	16 Å²	16	44.6 Å²	44.6	10%	0.104	24%	0.24	C	C	.	.			trans	-66.7	146.7	179.1	-16.9	31.3	0	0	0	112	V217 M220 I260 F265 V321 P340	V217-P262 HydrophobicContact CG1-CG 3.94Å; M220-P262 PolarHBondContact N-O 2.98Å; M220-P262 VanDerWaalsContact N-O 3.09Å; I260-P262 HydrophobicContact CG2-CG 4Å; I260-P262 WeakPolarHBondContact O-CD 3.23Å; P262-F265 HydrophobicContact CB-CD2 3.84Å; P262-F265 HydrophobicContact CB-CE2 3.97Å; P262-V321 HydrophobicContact CB-CG2 4.36Å; P262-V321 HydrophobicContact CG-CG1 4.19Å; P262-P340 WeakPolarHBondContact CA-O 3.36Å; P262-P340 HydrophobicContact CB-CG 4.28Å; P262-P340 HydrophobicContact CG-CG 4.32Å
263	G	88	Confident	86.9	Confident	6 Å²	6	40.2 Å²	40.2	6%	0.062	23%	0.23	C	C	.	.			trans	-128	127.9	169.1	0	0	0	0	0	112.2	F265 P340 G341	G263-F265 WeakPolarHBondContact O-CD2 3.41Å; G263-F265 WeakPolarHBondContact O-CE2 3.4Å; G263-P340 PolarHBondContact N-O 3.45Å; G263-G341 WeakPolarHBondContact O-CA 3.31Å
264	G	81.6	Confident	85.8	Confident	44 Å²	44	39.1 Å²	39.1	45%	0.454	23%	0.233	S	C	.	.	S	Bend	trans	68.8	54.2	167.8	0	0	0	0	0	115.4	A314 S315	G264-A314 CarbonylContact O-C 3.56Å; G264-A314 WeakPolarHBondContact O-CA 3.16Å; G264-S315 PolarHBondContact O-N 2.79Å
265	F	85.3	Confident	84.8	Confident	28 Å²	28	43.9 Å²	43.9	12%	0.123	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-116.8	136.1	172.6	-67.4	-83.6	0	0	0	111.2	P262 G263 T267 S315 D317 F318 P320 V321 P340	P262-F265 HydrophobicContact CB-CD2 3.84Å; P262-F265 HydrophobicContact CB-CE2 3.97Å; G263-F265 WeakPolarHBondContact O-CD2 3.41Å; G263-F265 WeakPolarHBondContact O-CE2 3.4Å; F265-T267 PolarHBondContact O-N 3.34Å; F265-S315 WeakPolarHBondContact CA-O 3.37Å; F265-D317 WeakPolarHBondContact CD1-O 3.36Å; F265-D317 WeakPolarHBondContact CE1-O 3.46Å; F265-F318 HydrophobicContact CB-CD1 4.14Å; F265-F318 HydrophobicContact CB-CE1 3.98Å; F265-F318 AromaticContact CD1-CD1 3.97Å; F265-F318 HydrophobicContact CD1-CD1 3.97Å; F265-F318 HydrophobicContact CG-CD1 4.37Å; F265-P320 HydrophobicContact CE1-CG 4.44Å; F265-P320 HydrophobicContact CZ-CB 4.28Å; F265-V321 HydrophobicContact CD1-CG2 4.05Å; F265-V321 HydrophobicContact CD2-CG2 3.69Å; F265-V321 HydrophobicContact CE1-CG2 3.67Å; F265-V321 HydrophobicContact CE2-CG2 3.26Å; F265-V321 HydrophobicContact CG-CG2 4.06Å; F265-V321 HydrophobicContact CZ-CG2 3.26Å; F265-P340 HydrophobicContact CE2-CB 4.34Å; F265-P340 WeakPolarHBondContact CE2-O 3.25Å; F265-P340 HydrophobicContact CZ-CB 4.28Å
266	R	82.6	Confident	83.6	Confident	149 Å²	149	45.7 Å²	45.7	56%	0.562	25%	0.253	S	S	*	.			trans	-81.1	103.7	-175.6	-174.6	172.5	171.7	177.8	-2.7	108.8	A314 S315 T316 F318	R266-A314 HydrophobicContact CB-CB 3.86Å; R266-S315 PolarHBondContact N-O 3.45Å; R266-T316 HydrophobicContact CB-CG2 4.35Å; R266-F318 WeakPolarHBondContact O-CE1 3.41Å; R266-F318 WeakPolarHBondContact O-CZ 3.21Å
267	T	78.9	Confident	82.6	Confident	36 Å²	36	47.4 Å²	47.4	22%	0.221	26%	0.262	C	S	.	.			trans	-124.8	168.8	178.8	65.6	0	0	0	0	110.2	L94 F265 I269 F318	L94-T267 HydrophobicContact CB-CG2 4.32Å; F265-T267 PolarHBondContact O-N 3.34Å; T267-I269 PolarHBondContact O-N 2.99Å; T267-I269 WeakPolarHBondContact OG1-CB 3.17Å; T267-I269 WeakPolarHBondContact OG1-CG2 3.22Å; T267-I269 PolarHBondContact OG1-N 3.21Å; T267-F318 HydrophobicContact CG2-CE1 3.73Å; T267-F318 HydrophobicContact CG2-CZ 3.75Å
268	S	77.5	Confident	81.6	Confident	60 Å²	60	54.7 Å²	54.7	42%	0.42	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-71.2	2	170.5	42.9	0	0	0	0	113.8	C92 A270 G271	C92-S268 WeakPolarHBondContact CB-OG 3.44Å; C92-S268 PolarHBondContact SG-OG 2.56Å; S268-A270 PolarHBondContact O-N 3.46Å; S268-G271 PolarHBondContact O-N 3.47Å; S268-G271 VanDerWaalsContact O-N 3.08Å
269	I	77	Confident	80.5	Confident	56 Å²	56	56.9 Å²	56.9	29%	0.287	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.7	-26.8	179.8	-153.6	174.5	0	0	0	112.1	L171 Y232 T267 G271	L171-I269 HydrophobicContact CB-CG1 4.17Å; L171-I269 HydrophobicContact CB-CG2 4.42Å; L171-I269 WeakPolarHBondContact CB-O 3.07Å; Y232-I269 HydrophobicContact CE2-CD1 4.32Å; T267-I269 PolarHBondContact O-N 2.99Å; T267-I269 WeakPolarHBondContact OG1-CB 3.17Å; T267-I269 WeakPolarHBondContact OG1-CG2 3.22Å; T267-I269 PolarHBondContact OG1-N 3.21Å; I269-G271 PolarHBondContact O-N 3.21Å
270	A	68.3	Low	79.6	Confident	10 Å²	10	58.6 Å²	58.6	8%	0.083	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-82.5	31.6	173.4	0	0	0	0	0	112.5	L171 S268 W276 L307	L171-A270 HydrophobicContact CD2-CB 4.26Å; S268-A270 PolarHBondContact O-N 3.46Å; A270-W276 HydrophobicContact CB-CZ2 4.35Å; A270-W276 WeakPolarHBondContact O-CZ2 3.37Å; A270-W276 PolarHBondContact O-NE1 3.46Å; A270-W276 VanDerWaalsContact O-NE1 3.07Å; A270-L307 HydrophobicContact CB-CD2 4.13Å
271	G	71.6	Confident	78.8	Confident	27 Å²	27	64.8 Å²	64.8	28%	0.278	34%	0.34	S	S	.	.			trans	56.3	-157.6	163.7	0	0	0	0	0	116.5	S268 I269	S268-G271 PolarHBondContact O-N 3.47Å; S268-G271 VanDerWaalsContact O-N 3.08Å; I269-G271 PolarHBondContact O-N 3.21Å
272	T	72.3	Confident	78.2	Confident	75 Å²	75	66.5 Å²	66.5	46%	0.46	35%	0.349	S	S	.	.			trans	-128	158.2	177.3	58.6	0	0	0	0	109.1	D274 K275 W276	T272-D274 PolarHBondContact O-N 2.94Å; T272-K275 WeakPolarHBondContact O-CB 3.44Å; T272-K275 PolarHBondContact O-N 3.43Å; T272-W276 VanDerWaalsContact C-CD1 3.49Å; T272-W276 VanDerWaalsContact O-CG 3.23Å; T272-W276 PolarHBondContact O-N 3.23Å; T272-W276 VanDerWaalsContact O-N 3.16Å; T272-W276 PolarHBondContact O-NE1 3.14Å
273	S	73.2	Confident	77.6	Confident	73 Å²	73	66 Å²	66	51%	0.51	35%	0.345	S	S	.	.	H	α-helix	trans	-45.8	-46.1	174.6	45.9	0	0	0	0	112.5	K275 W276 E277	S273-K275 VanDerWaalsContact C-N 3.32Å; S273-K275 PolarHBondContact O-N 3.37Å; S273-W276 CarbonylContact O-C 3.6Å; S273-W276 WeakPolarHBondContact O-CA 3.48Å; S273-W276 VanDerWaalsContact O-CB 3.28Å; S273-W276 WeakPolarHBondContact O-CB 3.5Å; S273-W276 PolarHBondContact O-N 3.36Å; S273-E277 PolarHBondContact O-N 3.48Å
274	D	75.6	Confident	77.2	Confident	96 Å²	96	67.2 Å²	67.2	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-68.6	-31.9	-175.3	-48.6	-4.7	0	0	0	112.5	T272 W276 K278	T272-D274 PolarHBondContact O-N 2.94Å; D274-W276 VanDerWaalsContact C-N 3.26Å; D274-K278 WeakPolarHBondContact O-CG 3.35Å; D274-K278 PolarHBondContact O-N 3.46Å
275	K	74.5	Confident	77.3	Confident	128 Å²	128	70 Å²	70	56%	0.557	36%	0.355	S	S	*	.	H	α-helix	trans	-67.5	-35	172	-75.6	-175.5	177.4	-177.7	0	110.3	T272 S273 L279	T272-K275 WeakPolarHBondContact O-CB 3.44Å; T272-K275 PolarHBondContact O-N 3.43Å; S273-K275 VanDerWaalsContact C-N 3.32Å; S273-K275 PolarHBondContact O-N 3.37Å; K275-L279 WeakPolarHBondContact O-CB 3.27Å; K275-L279 WeakPolarHBondContact O-CD1 3.38Å; K275-L279 VanDerWaalsContact O-CG 3.3Å; K275-L279 WeakPolarHBondContact O-CG 3.3Å; K275-L279 PolarHBondContact O-N 2.94Å
276	W	73.9	Confident	77.1	Confident	42 Å²	42	74.9 Å²	74.9	16%	0.159	38%	0.378	C	S	.	.	H	α-helix	trans	-71.3	-44.6	179.8	-53.5	144.2	0	0	0	112.8	G172 F173 A270 T272 S273 D274 K278 L279 E280 L307	G172-W276 WeakPolarHBondContact O-CH2 3.26Å; F173-W276 HydrophobicContact CD2-CE3 4.18Å; F173-W276 HydrophobicContact CD2-CZ3 4.45Å; A270-W276 HydrophobicContact CB-CZ2 4.35Å; A270-W276 WeakPolarHBondContact O-CZ2 3.37Å; A270-W276 PolarHBondContact O-NE1 3.46Å; A270-W276 VanDerWaalsContact O-NE1 3.07Å; T272-W276 VanDerWaalsContact C-CD1 3.49Å; T272-W276 VanDerWaalsContact O-CG 3.23Å; T272-W276 PolarHBondContact O-N 3.23Å; T272-W276 VanDerWaalsContact O-N 3.16Å; T272-W276 PolarHBondContact O-NE1 3.14Å; S273-W276 CarbonylContact O-C 3.6Å; S273-W276 WeakPolarHBondContact O-CA 3.48Å; S273-W276 VanDerWaalsContact O-CB 3.28Å; S273-W276 WeakPolarHBondContact O-CB 3.5Å; S273-W276 PolarHBondContact O-N 3.36Å; D274-W276 VanDerWaalsContact C-N 3.26Å; W276-K278 PolarHBondContact O-N 2.58Å; W276-L279 HydrophobicContact CE3-CD1 3.57Å; W276-L279 HydrophobicContact CZ3-CD1 3.54Å; W276-L279 PolarHBondContact O-N 3.13Å; W276-L279 VanDerWaalsContact O-N 3.15Å; W276-E280 VanDerWaalsContact O-CB 3.3Å; W276-E280 WeakPolarHBondContact O-CB 3.49Å; W276-E280 PolarHBondContact O-N 3.45Å; W276-L307 HydrophobicContact CD2-CD1 4.06Å; W276-L307 HydrophobicContact CG-CD1 4.32Å; W276-L307 HydrophobicContact CH2-CD1 4.42Å; W276-L307 HydrophobicContact CH2-CD2 4.5Å; W276-L307 HydrophobicContact CZ2-CD1 3.77Å; W276-L307 HydrophobicContact CZ2-CD2 3.94Å
277	E	77.4	Confident	77.2	Confident	130 Å²	130	68.6 Å²	68.6	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-58.8	-39.7	174.5	-70.2	176.1	-174.3	0	0	111.8	S273 K281	S273-E277 PolarHBondContact O-N 3.48Å; E277-K281 WeakPolarHBondContact O-CB 3.42Å; E277-K281 PolarHBondContact O-N 2.98Å
278	K	78.2	Confident	77.7	Confident	158 Å²	158	70.6 Å²	70.6	69%	0.687	37%	0.369	S	S	*	.	H	α-helix	trans	-65.8	-43.1	175.5	-72.4	177.6	-176.1	-177.9	0	112.6	D274 W276 D282	D274-K278 WeakPolarHBondContact O-CG 3.35Å; D274-K278 PolarHBondContact O-N 3.46Å; W276-K278 PolarHBondContact O-N 2.58Å; K278-D282 WeakPolarHBondContact O-CB 3.5Å; K278-D282 PolarHBondContact O-N 2.98Å
279	L	74.9	Confident	78.3	Confident	48 Å²	48	71.6 Å²	71.6	25%	0.251	38%	0.381	S	S	.	.	H	α-helix	trans	-71.1	-38.3	179.9	-76.2	164.5	0	0	0	112.1	F173 K275 W276 K281 D282 I283	F173-L279 HydrophobicContact CB-CB 4.47Å; F173-L279 HydrophobicContact CB-CD1 4.39Å; F173-L279 HydrophobicContact CD2-CB 4.16Å; F173-L279 HydrophobicContact CG-CB 4.5Å; K275-L279 WeakPolarHBondContact O-CB 3.27Å; K275-L279 WeakPolarHBondContact O-CD1 3.38Å; K275-L279 VanDerWaalsContact O-CG 3.3Å; K275-L279 WeakPolarHBondContact O-CG 3.3Å; K275-L279 PolarHBondContact O-N 2.94Å; W276-L279 HydrophobicContact CE3-CD1 3.57Å; W276-L279 HydrophobicContact CZ3-CD1 3.54Å; W276-L279 PolarHBondContact O-N 3.13Å; W276-L279 VanDerWaalsContact O-N 3.15Å; L279-K281 VanDerWaalsContact C-N 3.35Å; L279-D282 PolarHBondContact O-N 3.42Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.3Å; L279-I283 PolarHBondContact O-N 3.09Å
280	E	77.8	Confident	78.9	Confident	35 Å²	35	75.8 Å²	75.8	16%	0.164	40%	0.399	C	S	.	.	H	α-helix	trans	-60.7	-46	173.8	-174.8	179.3	112.4	0	0	110.5	W276 I283 L284 L301 R304	W276-E280 VanDerWaalsContact O-CB 3.3Å; W276-E280 WeakPolarHBondContact O-CB 3.49Å; W276-E280 PolarHBondContact O-N 3.45Å; E280-I283 PolarHBondContact O-N 2.95Å; E280-L284 WeakPolarHBondContact O-CG 3.42Å; E280-L284 PolarHBondContact O-N 2.91Å; E280-L301 HydrophobicContact CG-CD2 3.64Å; E280-L301 WeakPolarHBondContact OE1-CD2 3.4Å; E280-R304 IonicContact OE1-NH1 3.39Å; E280-R304 PolarHBondContact OE1-NH1 2.87Å; E280-R304 WeakPolarHBondContact OE2-CD 3.33Å; E280-R304 IonicContact OE2-CZ 3.7Å; E280-R304 IonicContact OE2-NE 3.91Å; E280-R304 IonicContact OE2-NH1 2.83Å; E280-R304 PolarHBondContact OE2-NH1 3.33Å
281	K	80.5	Confident	80	Confident	131 Å²	131	76.1 Å²	76.1	57%	0.57	40%	0.4	S	S	*	.	H	α-helix	trans	-62.3	-44.9	174	-175.6	177.6	177.9	-178	0	112	E277 L279 I283 L284 D285	E277-K281 WeakPolarHBondContact O-CB 3.42Å; E277-K281 PolarHBondContact O-N 2.98Å; L279-K281 VanDerWaalsContact C-N 3.35Å; K281-I283 VanDerWaalsContact C-N 3.28Å; K281-I283 PolarHBondContact O-N 3.02Å; K281-L284 PolarHBondContact O-N 2.61Å; K281-D285 WeakPolarHBondContact CE-OD2 3.35Å; K281-D285 WeakPolarHBondContact CG-OD2 3.41Å; K281-D285 WeakPolarHBondContact O-CB 3.31Å; K281-D285 VanDerWaalsContact O-CG 3.23Å; K281-D285 PolarHBondContact O-N 3Å
282	D	80.6	Confident	80.8	Confident	49 Å²	49	78 Å²	78	26%	0.262	40%	0.402	S	S	.	.	H	α-helix	trans	-59.2	-40.5	178.7	-167.5	60.6	0	0	0	111.9	K278 L279 D285 H286	K278-D282 WeakPolarHBondContact O-CB 3.5Å; K278-D282 PolarHBondContact O-N 2.98Å; L279-D282 PolarHBondContact O-N 3.42Å; D282-D285 PolarHBondContact O-N 3.16Å; D282-H286 WeakPolarHBondContact O-CB 3.44Å; D282-H286 PolarHBondContact O-N 3.47Å; D282-H286 VanDerWaalsContact O-N 3.1Å; D282-H286 PolarHBondContact O-ND1 2.84Å; D282-H286 IonicContact OD1-CE1 3.41Å; D282-H286 PolarHBondContact OD1-CE1 3.36Å; D282-H286 IonicContact OD1-ND1 3.01Å; D282-H286 PolarHBondContact OD1-ND1 3.14Å; D282-H286 VanDerWaalsContact OD1-ND1 3.08Å
283	I	79.6	Confident	81.7	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.021	41%	0.41	C	S	.	.	H	α-helix	trans	-62.7	-51.2	174.9	-71.8	164.5	0	0	0	110.5	F173 P181 L279 E280 K281 D285 H286 L287 I300	F173-I283 HydrophobicContact CB-CD1 4.42Å; F173-I283 HydrophobicContact CD1-CD1 3.13Å; F173-I283 HydrophobicContact CE1-CD1 3.33Å; F173-I283 HydrophobicContact CG-CD1 3.83Å; F173-I283 HydrophobicContact CZ-CD1 4.17Å; P181-I283 HydrophobicContact CG-CG1 4.44Å; L279-I283 VanDerWaalsContact O-CG1 3.27Å; L279-I283 WeakPolarHBondContact O-CG1 3.3Å; L279-I283 PolarHBondContact O-N 3.09Å; E280-I283 PolarHBondContact O-N 2.95Å; K281-I283 VanDerWaalsContact C-N 3.28Å; K281-I283 PolarHBondContact O-N 3.02Å; I283-D285 VanDerWaalsContact C-N 3.3Å; I283-D285 PolarHBondContact O-N 3.41Å; I283-H286 PolarHBondContact O-N 3.39Å; I283-L287 HydrophobicContact CG2-CD1 3.4Å; I283-L287 VanDerWaalsContact CG2-CD1 3.4Å; I283-L287 HydrophobicContact CG2-CG 3.95Å; I283-L287 WeakPolarHBondContact O-CB 3.35Å; I283-L287 WeakPolarHBondContact O-CG 3.43Å; I283-L287 PolarHBondContact O-N 2.87Å; I283-I300 HydrophobicContact CG2-CG2 4.02Å
284	L	80.3	Confident	82.6	Confident	32 Å²	32	80.9 Å²	80.9	17%	0.168	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-34.7	-179.8	-68.8	172.5	0	0	0	112.8	E280 K281 Q292 Q297 I300 L301	E280-L284 WeakPolarHBondContact O-CG 3.42Å; E280-L284 PolarHBondContact O-N 2.91Å; K281-L284 PolarHBondContact O-N 2.61Å; L284-Q292 PolarHBondContact O-NE2 3.09Å; L284-Q297 HydrophobicContact CD2-CG 4.34Å; L284-I300 HydrophobicContact CD2-CB 4.47Å; L284-I300 HydrophobicContact CD2-CD1 4.34Å; L284-I300 HydrophobicContact CD2-CG2 3.89Å; L284-L301 HydrophobicContact CD1-CD2 4.19Å
285	D	82.9	Confident	83.4	Confident	104 Å²	104	78.2 Å²	78.2	56%	0.556	39%	0.387	S	S	*	.	H	α-helix	trans	-76.1	-27.4	-178.5	-71.9	-11.8	0	0	0	112.5	K281 D282 I283	K281-D285 WeakPolarHBondContact CE-OD2 3.35Å; K281-D285 WeakPolarHBondContact CG-OD2 3.41Å; K281-D285 WeakPolarHBondContact O-CB 3.31Å; K281-D285 VanDerWaalsContact O-CG 3.23Å; K281-D285 PolarHBondContact O-N 3Å; D282-D285 PolarHBondContact O-N 3.16Å; I283-D285 VanDerWaalsContact C-N 3.3Å; I283-D285 PolarHBondContact O-N 3.41Å
286	H	80.9	Confident	84.1	Confident	129 Å²	129	72.2 Å²	72.2	60%	0.597	36%	0.362	S	S	*	.	H	α-helix	trans	-111.7	-8.2	-174	-62.6	94	0	0	0	115.1	D282 I283	D282-H286 WeakPolarHBondContact O-CB 3.44Å; D282-H286 PolarHBondContact O-N 3.47Å; D282-H286 VanDerWaalsContact O-N 3.1Å; D282-H286 PolarHBondContact O-ND1 2.84Å; D282-H286 IonicContact OD1-CE1 3.41Å; D282-H286 PolarHBondContact OD1-CE1 3.36Å; D282-H286 IonicContact OD1-ND1 3.01Å; D282-H286 PolarHBondContact OD1-ND1 3.14Å; D282-H286 VanDerWaalsContact OD1-ND1 3.08Å; I283-H286 PolarHBondContact O-N 3.39Å
287	L	86.3	Confident	84.8	Confident	18 Å²	18	75.3 Å²	75.3	9%	0.094	38%	0.378	C	S	.	.	S	Bend	trans	-66.7	135.9	174.9	-84.2	171.7	0	0	0	110.9	L179 I283 V291 Q292 I300	L179-L287 HydrophobicContact CD2-CD1 4.05Å; L179-L287 HydrophobicContact CD2-CD2 4.2Å; I283-L287 HydrophobicContact CG2-CD1 3.4Å; I283-L287 VanDerWaalsContact CG2-CD1 3.4Å; I283-L287 HydrophobicContact CG2-CG 3.95Å; I283-L287 WeakPolarHBondContact O-CB 3.35Å; I283-L287 WeakPolarHBondContact O-CG 3.43Å; I283-L287 PolarHBondContact O-N 2.87Å; L287-V291 HydrophobicContact CD2-CG1 3.96Å; L287-Q292 HydrophobicContact CB-CG 3.61Å; L287-Q292 HydrophobicContact CD1-CG 4.46Å; L287-Q292 PolarHBondContact O-NE2 3.36Å; L287-I300 HydrophobicContact CD1-CD1 3.88Å; L287-I300 HydrophobicContact CD1-CG2 4.47Å
288	P	89	Confident	85.3	Confident	77 Å²	77	75 Å²	75	50%	0.5	38%	0.381	S	S	.	.			trans	-55.3	141.7	171.9	-22.9	32.8	0	0	0	111.3	E290 V291 Q292	P288-E290 PolarHBondContact O-N 2.85Å; P288-V291 HydrophobicContact CB-CB 4.49Å; P288-V291 HydrophobicContact CB-CG2 4.09Å; P288-V291 HydrophobicContact CG-CG2 4.12Å; P288-V291 PolarHBondContact O-N 2.91Å; P288-Q292 PolarHBondContact O-N 2.95Å
289	A	88.7	Confident	85.8	Confident	82 Å²	82	68.5 Å²	68.5	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-55.7	-37.8	-177.5	0	0	0	0	0	112.8	Q292 E293	A289-Q292 PolarHBondContact O-N 3.38Å; A289-E293 PolarHBondContact O-N 3.39Å
290	E	90.9	Very high	86.4	Confident	144 Å²	144	66.5 Å²	66.5	67%	0.673	34%	0.342	S	S	*	.	H	α-helix	trans	-59.2	-47.4	175.1	-176.6	175.2	-164.6	0	0	111.9	P288 Q292 E293 D294	P288-E290 PolarHBondContact O-N 2.85Å; E290-Q292 VanDerWaalsContact C-N 3.34Å; E290-Q292 PolarHBondContact O-N 3.11Å; E290-E293 PolarHBondContact O-N 3.4Å; E290-D294 WeakPolarHBondContact O-CB 3.41Å; E290-D294 PolarHBondContact O-N 3.44Å
291	V	91	Very high	86.7	Confident	17 Å²	17	66.7 Å²	66.7	10%	0.103	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-39	178	-178.9	0	0	0	0	110.9	E178 L179 L287 P288 E293 D294 Y295	E178-V291 HydrophobicContact CG-CG1 4.44Å; L179-V291 HydrophobicContact CD2-CG1 3.81Å; L287-V291 HydrophobicContact CD2-CG1 3.96Å; P288-V291 HydrophobicContact CB-CB 4.49Å; P288-V291 HydrophobicContact CB-CG2 4.09Å; P288-V291 HydrophobicContact CG-CG2 4.12Å; P288-V291 PolarHBondContact O-N 2.91Å; V291-E293 VanDerWaalsContact C-N 3.31Å; V291-E293 PolarHBondContact O-N 3.14Å; V291-D294 PolarHBondContact O-N 3.18Å; V291-Y295 HydrophobicContact CG1-CD2 3.64Å; V291-Y295 HydrophobicContact CG1-CE2 3.88Å; V291-Y295 WeakPolarHBondContact O-CD2 3.15Å; V291-Y295 PolarHBondContact O-N 3.43Å
292	Q	88.8	Confident	87	Confident	65 Å²	65	61 Å²	61	30%	0.304	32%	0.32	S	S	.	.	H	α-helix	trans	-64	-37.2	175.3	-63.3	-169.7	33.6	0	0	112.3	L284 L287 P288 A289 E290 G296	L284-Q292 PolarHBondContact O-NE2 3.09Å; L287-Q292 HydrophobicContact CB-CG 3.61Å; L287-Q292 HydrophobicContact CD1-CG 4.46Å; L287-Q292 PolarHBondContact O-NE2 3.36Å; P288-Q292 PolarHBondContact O-N 2.95Å; A289-Q292 PolarHBondContact O-N 3.38Å; E290-Q292 VanDerWaalsContact C-N 3.34Å; E290-Q292 PolarHBondContact O-N 3.11Å; Q292-G296 VanDerWaalsContact O-CA 3.25Å; Q292-G296 WeakPolarHBondContact O-CA 3.2Å; Q292-G296 PolarHBondContact O-N 3.37Å
293	E	90.6	Very high	87.1	Confident	135 Å²	135	58.7 Å²	58.7	63%	0.631	31%	0.308	S	S	*	.	H	α-helix	trans	-68.6	-45.9	176.3	-172.5	172.9	-176.4	0	0	111.4	A289 E290 V291 R375	A289-E293 PolarHBondContact O-N 3.39Å; E290-E293 PolarHBondContact O-N 3.4Å; V291-E293 VanDerWaalsContact C-N 3.31Å; V291-E293 PolarHBondContact O-N 3.14Å; E293-R375 WeakPolarHBondContact O-CD 3.32Å
294	D	92.9	Very high	87	Confident	74 Å²	74	64 Å²	64	40%	0.396	33%	0.327	S	S	.	.	H	α-helix	trans	-65.7	-46.3	-177.6	-82.5	-16.5	0	0	0	113	E290 V291 R375 A376	E290-D294 WeakPolarHBondContact O-CB 3.41Å; E290-D294 PolarHBondContact O-N 3.44Å; V291-D294 PolarHBondContact O-N 3.18Å; D294-R375 CarbonylContact O-C 3.48Å; D294-R375 PolarHBondContact O-N 3Å; D294-A376 HydrophobicContact CB-CB 4.29Å; D294-A376 WeakPolarHBondContact O-CB 3.35Å; D294-A376 PolarHBondContact O-N 3.41Å
295	Y	91.3	Very high	87.1	Confident	40 Å²	40	66.2 Å²	66.2	16%	0.157	34%	0.339	C	S	.	.	H	α-helix	trans	-80.6	-39.1	179.5	-76.3	-90.5	0	0	0	111.6	E178 L179 V291 Y299 P374 R375	E178-Y295 VanDerWaalsContact OE2-CE2 3.26Å; E178-Y295 WeakPolarHBondContact OE2-CE2 3.29Å; E178-Y295 PolarHBondContact OE2-OH 2.96Å; L179-Y295 HydrophobicContact CD1-CD1 4.31Å; L179-Y295 HydrophobicContact CD2-CD1 4.27Å; L179-Y295 HydrophobicContact CD2-CD2 3.85Å; L179-Y295 HydrophobicContact CD2-CE1 4.49Å; L179-Y295 HydrophobicContact CD2-CE2 4.11Å; L179-Y295 HydrophobicContact CD2-CG 3.91Å; V291-Y295 HydrophobicContact CG1-CD2 3.64Å; V291-Y295 HydrophobicContact CG1-CE2 3.88Å; V291-Y295 WeakPolarHBondContact O-CD2 3.15Å; V291-Y295 PolarHBondContact O-N 3.43Å; Y295-Y299 AromaticContact CD1-CD1 3.47Å; Y295-Y299 HydrophobicContact CD1-CD1 3.47Å; Y295-Y299 VanDerWaalsContact CD1-CD1 3.47Å; Y295-Y299 AromaticContact CD1-CE1 3.44Å; Y295-Y299 HydrophobicContact CD1-CE1 3.44Å; Y295-Y299 VanDerWaalsContact CD1-CE1 3.44Å; Y295-Y299 HydrophobicContact CD1-CG 4.39Å; Y295-Y299 HydrophobicContact CE1-CD1 4.35Å; Y295-Y299 AromaticContact CE1-CE1 3.87Å; Y295-Y299 HydrophobicContact CE1-CE1 3.87Å; Y295-Y299 HydrophobicContact CG-CD1 4.26Å; Y295-Y299 WeakPolarHBondContact O-CB 3.4Å; Y295-P374 HydrophobicContact CD1-CB 4.1Å; Y295-P374 HydrophobicContact CD1-CG 4.04Å; Y295-P374 HydrophobicContact CE1-CG 4.25Å; Y295-R375 PolarHBondContact O-N 3.01Å
296	G	90.6	Very high	87	Confident	2 Å²	2	61.5 Å²	61.5	2%	0.021	31%	0.314	C	S	.	.			trans	76.5	147	-173.6	0	0	0	0	0	113	Q292 D298 Y299 I300	Q292-G296 VanDerWaalsContact O-CA 3.25Å; Q292-G296 WeakPolarHBondContact O-CA 3.2Å; Q292-G296 PolarHBondContact O-N 3.37Å; G296-D298 VanDerWaalsContact C-N 3.33Å; G296-D298 PolarHBondContact O-N 2.82Å; G296-Y299 WeakPolarHBondContact O-CB 3.37Å; G296-Y299 PolarHBondContact O-N 3.08Å; G296-Y299 VanDerWaalsContact O-N 3.17Å; G296-I300 WeakPolarHBondContact O-CG1 3.3Å; G296-I300 PolarHBondContact O-N 3.46Å
297	Q	87.1	Confident	86.9	Confident	107 Å²	107	55.9 Å²	55.9	50%	0.5	29%	0.288	S	S	.	.	H	α-helix	trans	-60.9	-38.8	-173.4	-166.7	170.1	8	0	0	113.2	L284 Y299 I300 L301	L284-Q297 HydrophobicContact CD2-CG 4.34Å; Q297-Y299 VanDerWaalsContact C-N 3.28Å; Q297-Y299 PolarHBondContact O-N 3.43Å; Q297-I300 PolarHBondContact O-N 3.31Å; Q297-L301 HydrophobicContact CG-CD1 3.9Å; Q297-L301 HydrophobicContact CG-CG 4.16Å; Q297-L301 WeakPolarHBondContact O-CB 3.44Å; Q297-L301 VanDerWaalsContact O-CG 3.23Å; Q297-L301 WeakPolarHBondContact O-CG 3.48Å; Q297-L301 PolarHBondContact O-N 3.37Å
298	D	87.4	Confident	86.4	Confident	124 Å²	124	60.6 Å²	60.6	66%	0.663	31%	0.313	S	S	*	.	H	α-helix	trans	-60.1	-38.4	178.7	-60.9	-33.5	0	0	0	112.4	G296 S302	G296-D298 VanDerWaalsContact C-N 3.33Å; G296-D298 PolarHBondContact O-N 2.82Å; D298-S302 WeakPolarHBondContact O-CB 3.32Å; D298-S302 PolarHBondContact O-N 2.89Å
299	Y	89.1	Confident	85.9	Confident	22 Å²	22	61.7 Å²	61.7	9%	0.086	31%	0.31	C	S	.	.	H	α-helix	trans	-69.3	-45.4	176.8	-175.2	-90.3	0	0	0	112.1	D176 L179 Y295 G296 Q297 L301 S302 Q303 P372 P374	D176-Y299 PolarHBondContact OD2-OH 2.84Å; L179-Y299 HydrophobicContact CD1-CD1 4.28Å; L179-Y299 HydrophobicContact CD1-CE1 4.17Å; Y295-Y299 AromaticContact CD1-CD1 3.47Å; Y295-Y299 HydrophobicContact CD1-CD1 3.47Å; Y295-Y299 VanDerWaalsContact CD1-CD1 3.47Å; Y295-Y299 AromaticContact CD1-CE1 3.44Å; Y295-Y299 HydrophobicContact CD1-CE1 3.44Å; Y295-Y299 VanDerWaalsContact CD1-CE1 3.44Å; Y295-Y299 HydrophobicContact CD1-CG 4.39Å; Y295-Y299 HydrophobicContact CE1-CD1 4.35Å; Y295-Y299 AromaticContact CE1-CE1 3.87Å; Y295-Y299 HydrophobicContact CE1-CE1 3.87Å; Y295-Y299 HydrophobicContact CG-CD1 4.26Å; Y295-Y299 WeakPolarHBondContact O-CB 3.4Å; G296-Y299 WeakPolarHBondContact O-CB 3.37Å; G296-Y299 PolarHBondContact O-N 3.08Å; G296-Y299 VanDerWaalsContact O-N 3.17Å; Q297-Y299 VanDerWaalsContact C-N 3.28Å; Q297-Y299 PolarHBondContact O-N 3.43Å; Y299-L301 VanDerWaalsContact C-N 3.3Å; Y299-L301 PolarHBondContact O-N 3.34Å; Y299-S302 PolarHBondContact O-N 3.03Å; Y299-S302 PolarHBondContact O-OG 3.21Å; Y299-Q303 WeakPolarHBondContact O-CG 3.45Å; Y299-Q303 PolarHBondContact O-N 2.97Å; Y299-Q303 PolarHBondContact O-NE2 3.26Å; Y299-Q303 PolarHBondContact OH-NE2 3.38Å; Y299-P372 HydrophobicContact CD2-CG 4.16Å; Y299-P372 WeakPolarHBondContact CD2-O 3.46Å; Y299-P372 WeakPolarHBondContact CE2-O 3.18Å; Y299-P374 HydrophobicContact CD2-CG 4.15Å; Y299-P374 HydrophobicContact CE1-CG 4.4Å; Y299-P374 HydrophobicContact CE2-CG 3.91Å
300	I	87.5	Confident	85.4	Confident	6 Å²	6	60.1 Å²	60.1	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-44.3	179.4	-64.2	165.7	0	0	0	109.7	L179 I283 L284 L287 G296 Q297 S302 Q303	L179-I300 HydrophobicContact CD1-CG1 4.22Å; L179-I300 HydrophobicContact CD2-CG1 4.33Å; I283-I300 HydrophobicContact CG2-CG2 4.02Å; L284-I300 HydrophobicContact CD2-CB 4.47Å; L284-I300 HydrophobicContact CD2-CD1 4.34Å; L284-I300 HydrophobicContact CD2-CG2 3.89Å; L287-I300 HydrophobicContact CD1-CD1 3.88Å; L287-I300 HydrophobicContact CD1-CG2 4.47Å; G296-I300 WeakPolarHBondContact O-CG1 3.3Å; G296-I300 PolarHBondContact O-N 3.46Å; Q297-I300 PolarHBondContact O-N 3.31Å; I300-S302 VanDerWaalsContact C-N 3.33Å; I300-S302 PolarHBondContact O-N 2.85Å; I300-Q303 WeakPolarHBondContact O-CB 3.12Å; I300-Q303 VanDerWaalsContact O-CG 3.25Å; I300-Q303 WeakPolarHBondContact O-CG 3.49Å; I300-Q303 PolarHBondContact O-N 3.1Å
301	L	84.9	Confident	84.8	Confident	39 Å²	39	55.9 Å²	55.9	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-68.9	-28.8	178.2	-67.5	179.6	0	0	0	112.9	E280 L284 Q297 Y299 Q303 R304	E280-L301 HydrophobicContact CG-CD2 3.64Å; E280-L301 WeakPolarHBondContact OE1-CD2 3.4Å; L284-L301 HydrophobicContact CD1-CD2 4.19Å; Q297-L301 HydrophobicContact CG-CD1 3.9Å; Q297-L301 HydrophobicContact CG-CG 4.16Å; Q297-L301 WeakPolarHBondContact O-CB 3.44Å; Q297-L301 VanDerWaalsContact O-CG 3.23Å; Q297-L301 WeakPolarHBondContact O-CG 3.48Å; Q297-L301 PolarHBondContact O-N 3.37Å; Y299-L301 VanDerWaalsContact C-N 3.3Å; Y299-L301 PolarHBondContact O-N 3.34Å; L301-Q303 PolarHBondContact O-N 3.37Å; L301-R304 WeakPolarHBondContact O-CD 3.36Å; L301-R304 VanDerWaalsContact O-CG 3.32Å; L301-R304 WeakPolarHBondContact O-CG 3.44Å
302	S	86.2	Confident	84.1	Confident	11 Å²	11	59.7 Å²	59.7	8%	0.077	30%	0.299	C	S	.	.	H	α-helix	trans	-69.9	-19.5	177.6	69	0	0	0	0	113.4	D298 Y299 I300 R304 N305 P372	D298-S302 WeakPolarHBondContact O-CB 3.32Å; D298-S302 PolarHBondContact O-N 2.89Å; Y299-S302 PolarHBondContact O-N 3.03Å; Y299-S302 PolarHBondContact O-OG 3.21Å; I300-S302 VanDerWaalsContact C-N 3.33Å; I300-S302 PolarHBondContact O-N 2.85Å; S302-R304 PolarHBondContact O-N 2.94Å; S302-R304 VanDerWaalsContact O-N 3.13Å; S302-N305 WeakPolarHBondContact O-CB 3.5Å; S302-N305 VanDerWaalsContact O-CG 3.27Å; S302-N305 PolarHBondContact O-N 2.94Å; S302-N305 PolarHBondContact O-ND2 3.35Å; S302-P372 WeakPolarHBondContact OG-CD 3.4Å; S302-P372 VanDerWaalsContact OG-CG 3.31Å; S302-P372 WeakPolarHBondContact OG-CG 3.32Å
303	Q	82.8	Confident	83.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.7	-178.9	-61.6	-61.4	-44.5	0	0	112.8	F173 S175 L179 Y299 I300 L301 N305 F306	F173-Q303 HydrophobicContact CE1-CB 4.38Å; S175-Q303 WeakPolarHBondContact OG-CG 3.5Å; L179-Q303 HydrophobicContact CD1-CG 4.16Å; Y299-Q303 WeakPolarHBondContact O-CG 3.45Å; Y299-Q303 PolarHBondContact O-N 2.97Å; Y299-Q303 PolarHBondContact O-NE2 3.26Å; Y299-Q303 PolarHBondContact OH-NE2 3.38Å; I300-Q303 WeakPolarHBondContact O-CB 3.12Å; I300-Q303 VanDerWaalsContact O-CG 3.25Å; I300-Q303 WeakPolarHBondContact O-CG 3.49Å; I300-Q303 PolarHBondContact O-N 3.1Å; L301-Q303 PolarHBondContact O-N 3.37Å; Q303-N305 PolarHBondContact O-N 3.37Å; Q303-N305 VanDerWaalsContact O-N 3.16Å; Q303-F306 VanDerWaalsContact O-CB 3.31Å; Q303-F306 WeakPolarHBondContact O-CB 3.48Å; Q303-F306 PolarHBondContact O-N 3.4Å; Q303-F306 VanDerWaalsContact O-N 3.15Å
304	R	78.8	Confident	83.2	Confident	116 Å²	116	54 Å²	54	44%	0.438	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.8	177.1	77.1	-164.9	174.8	-177.6	-2.7	113.9	E280 L301 S302 F306 L307	E280-R304 IonicContact OE1-NH1 3.39Å; E280-R304 PolarHBondContact OE1-NH1 2.87Å; E280-R304 WeakPolarHBondContact OE2-CD 3.33Å; E280-R304 IonicContact OE2-CZ 3.7Å; E280-R304 IonicContact OE2-NE 3.91Å; E280-R304 IonicContact OE2-NH1 2.83Å; E280-R304 PolarHBondContact OE2-NH1 3.33Å; L301-R304 WeakPolarHBondContact O-CD 3.36Å; L301-R304 VanDerWaalsContact O-CG 3.32Å; L301-R304 WeakPolarHBondContact O-CG 3.44Å; S302-R304 PolarHBondContact O-N 2.94Å; S302-R304 VanDerWaalsContact O-N 3.13Å; R304-F306 PolarHBondContact O-N 3.5Å; R304-F306 VanDerWaalsContact O-N 3.16Å; R304-L307 WeakPolarHBondContact O-CB 3.34Å; R304-L307 PolarHBondContact O-N 3.42Å
305	N	82.3	Confident	83	Confident	78 Å²	78	52.3 Å²	52.3	42%	0.417	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-25.6	177.8	-65.8	-21	0	0	0	111.5	S302 Q303 L307 L308 F309	S302-N305 WeakPolarHBondContact O-CB 3.5Å; S302-N305 VanDerWaalsContact O-CG 3.27Å; S302-N305 PolarHBondContact O-N 2.94Å; S302-N305 PolarHBondContact O-ND2 3.35Å; Q303-N305 PolarHBondContact O-N 3.37Å; Q303-N305 VanDerWaalsContact O-N 3.16Å; N305-L307 VanDerWaalsContact C-N 3.25Å; N305-L307 PolarHBondContact O-N 2.93Å; N305-L308 WeakPolarHBondContact O-CB 3.38Å; N305-L308 PolarHBondContact O-N 3.19Å; N305-L308 VanDerWaalsContact O-N 3.12Å; N305-F309 PolarHBondContact O-N 3.05Å
306	F	81	Confident	82.8	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.022	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-31.9	174.4	-173.6	-107.9	0	0	0	113.2	P174 K228 L229 Q303 R304 F309 I310 F367	P174-F306 HydrophobicContact CB-CD1 3.46Å; P174-F306 VanDerWaalsContact CB-CD1 3.46Å; P174-F306 HydrophobicContact CB-CE1 4Å; P174-F306 HydrophobicContact CB-CG 4.48Å; P174-F306 HydrophobicContact CG-CD1 4.23Å; K228-F306 HydrophobicContact CB-CD1 3.97Å; K228-F306 HydrophobicContact CB-CE1 4Å; K228-F306 HydrophobicContact CB-CG 4.2Å; K228-F306 HydrophobicContact CB-CZ 4.33Å; K228-F306 HydrophobicContact CD-CB 3.65Å; K228-F306 HydrophobicContact CD-CD1 4.22Å; K228-F306 HydrophobicContact CD-CD2 3.68Å; K228-F306 HydrophobicContact CD-CE2 4.32Å; K228-F306 HydrophobicContact CD-CG 3.6Å; L229-F306 HydrophobicContact CD1-CE1 4.44Å; L229-F306 HydrophobicContact CD1-CZ 4.47Å; L229-F306 HydrophobicContact CD2-CE1 3.94Å; L229-F306 HydrophobicContact CG-CE1 3.98Å; L229-F306 HydrophobicContact CG-CZ 4.28Å; Q303-F306 VanDerWaalsContact O-CB 3.31Å; Q303-F306 WeakPolarHBondContact O-CB 3.48Å; Q303-F306 PolarHBondContact O-N 3.4Å; Q303-F306 VanDerWaalsContact O-N 3.15Å; R304-F306 PolarHBondContact O-N 3.5Å; R304-F306 VanDerWaalsContact O-N 3.16Å; F306-F309 HydrophobicContact CD2-CD1 4.34Å; F306-F309 HydrophobicContact CE2-CD1 4.34Å; F306-F309 WeakPolarHBondContact O-CB 3.24Å; F306-F309 PolarHBondContact O-N 2.71Å; F306-I310 HydrophobicContact CD1-CD1 3.55Å; F306-I310 HydrophobicContact CD1-CG1 4.21Å; F306-I310 HydrophobicContact CE1-CD1 3.17Å; F306-I310 HydrophobicContact CE1-CG1 3.95Å; F306-I310 HydrophobicContact CG-CD1 4.47Å; F306-I310 HydrophobicContact CZ-CD1 3.78Å; F306-I310 HydrophobicContact CZ-CG1 4.15Å; F306-I310 WeakPolarHBondContact O-CG1 3.08Å; F306-I310 PolarHBondContact O-N 3.32Å; F306-F367 HydrophobicContact CE2-CB 4.32Å; F306-F367 AromaticContact CE2-CD1 3.73Å; F306-F367 HydrophobicContact CE2-CD1 3.73Å; F306-F367 HydrophobicContact CE2-CG 4.32Å; F306-F367 HydrophobicContact CZ-CD1 4.41Å
307	L	77.3	Confident	82.9	Confident	11 Å²	11	59 Å²	59	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-66.1	-39.6	174.2	-73.4	167.4	0	0	0	111.8	L171 P174 A270 W276 R304 N305 F309 I310 N311	L171-L307 HydrophobicContact CD2-CD2 3.97Å; P174-L307 HydrophobicContact CG-CD2 3.52Å; P174-L307 HydrophobicContact CG-CG 3.85Å; A270-L307 HydrophobicContact CB-CD2 4.13Å; W276-L307 HydrophobicContact CD2-CD1 4.06Å; W276-L307 HydrophobicContact CG-CD1 4.32Å; W276-L307 HydrophobicContact CH2-CD1 4.42Å; W276-L307 HydrophobicContact CH2-CD2 4.5Å; W276-L307 HydrophobicContact CZ2-CD1 3.77Å; W276-L307 HydrophobicContact CZ2-CD2 3.94Å; R304-L307 WeakPolarHBondContact O-CB 3.34Å; R304-L307 PolarHBondContact O-N 3.42Å; N305-L307 VanDerWaalsContact C-N 3.25Å; N305-L307 PolarHBondContact O-N 2.93Å; L307-F309 VanDerWaalsContact C-N 3.3Å; L307-I310 PolarHBondContact O-N 3.19Å; L307-N311 WeakPolarHBondContact O-CB 3.45Å; L307-N311 PolarHBondContact O-N 2.9Å; L307-N311 PolarHBondContact O-ND2 3.44Å
308	L	76.6	Confident	83.2	Confident	118 Å²	118	55.5 Å²	55.5	62%	0.618	31%	0.312	S	S	*	.	H	α-helix	trans	-63.7	-41	175.1	-61.5	175.1	0	0	0	110.6	N305 N311 S312	N305-L308 WeakPolarHBondContact O-CB 3.38Å; N305-L308 PolarHBondContact O-N 3.19Å; N305-L308 VanDerWaalsContact O-N 3.12Å; L308-N311 PolarHBondContact O-N 2.84Å; L308-S312 WeakPolarHBondContact O-CB 3.44Å; L308-S312 PolarHBondContact O-N 3.01Å; L308-S312 PolarHBondContact O-OG 3.31Å
309	F	78.3	Confident	83.5	Confident	99 Å²	99	51.7 Å²	51.7	43%	0.434	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-48.6	175.1	174.8	-96.2	0	0	0	112.5	N305 F306 L307 N311 S312 G313 N366 F367	N305-F309 PolarHBondContact O-N 3.05Å; F306-F309 HydrophobicContact CD2-CD1 4.34Å; F306-F309 HydrophobicContact CE2-CD1 4.34Å; F306-F309 WeakPolarHBondContact O-CB 3.24Å; F306-F309 PolarHBondContact O-N 2.71Å; L307-F309 VanDerWaalsContact C-N 3.3Å; F309-N311 VanDerWaalsContact C-N 3.32Å; F309-N311 PolarHBondContact O-N 3.01Å; F309-S312 PolarHBondContact O-N 3.21Å; F309-S312 PolarHBondContact O-OG 3.08Å; F309-G313 PolarHBondContact O-N 3.22Å; F309-N366 WeakPolarHBondContact CZ-O 3.12Å; F309-F367 AromaticContact CE1-CD1 3.81Å; F309-F367 HydrophobicContact CE1-CD1 3.81Å; F309-F367 AromaticContact CE1-CE1 3.91Å; F309-F367 HydrophobicContact CE1-CE1 3.91Å; F309-F367 HydrophobicContact CZ-CD1 4.45Å
310	I	77.9	Confident	83.7	Confident	49 Å²	49	52.2 Å²	52.2	25%	0.251	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-46.2	176.6	-71.9	171.1	0	0	0	110.3	F306 L307 S312 G313 A314	F306-I310 HydrophobicContact CD1-CD1 3.55Å; F306-I310 HydrophobicContact CD1-CG1 4.21Å; F306-I310 HydrophobicContact CE1-CD1 3.17Å; F306-I310 HydrophobicContact CE1-CG1 3.95Å; F306-I310 HydrophobicContact CG-CD1 4.47Å; F306-I310 HydrophobicContact CZ-CD1 3.78Å; F306-I310 HydrophobicContact CZ-CG1 4.15Å; F306-I310 WeakPolarHBondContact O-CG1 3.08Å; F306-I310 PolarHBondContact O-N 3.32Å; L307-I310 PolarHBondContact O-N 3.19Å; I310-S312 PolarHBondContact O-N 3.23Å; I310-G313 PolarHBondContact O-N 2.95Å; I310-A314 WeakPolarHBondContact O-CB 3.17Å; I310-A314 PolarHBondContact O-N 3.48Å; I310-A314 VanDerWaalsContact O-N 3.16Å
311	N	77.7	Confident	84.1	Confident	55 Å²	55	52 Å²	52	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-68.2	-34.1	-176.3	-82.2	-32.4	0	0	0	113.3	L307 L308 F309	L307-N311 WeakPolarHBondContact O-CB 3.45Å; L307-N311 PolarHBondContact O-N 2.9Å; L307-N311 PolarHBondContact O-ND2 3.44Å; L308-N311 PolarHBondContact O-N 2.84Å; F309-N311 VanDerWaalsContact C-N 3.32Å; F309-N311 PolarHBondContact O-N 3.01Å
312	S	78.2	Confident	84.6	Confident	98 Å²	98	50.9 Å²	50.9	69%	0.685	29%	0.294	S	S	*	.	H	α-helix	trans	-72	-34.9	179.2	68.9	0	0	0	0	112.6	L308 F309 I310	L308-S312 WeakPolarHBondContact O-CB 3.44Å; L308-S312 PolarHBondContact O-N 3.01Å; L308-S312 PolarHBondContact O-OG 3.31Å; F309-S312 PolarHBondContact O-N 3.21Å; F309-S312 PolarHBondContact O-OG 3.08Å; I310-S312 PolarHBondContact O-N 3.23Å
313	G	76.1	Confident	85	Confident	66 Å²	66	56.4 Å²	56.4	68%	0.68	31%	0.314	S	S	*	.	H	α-helix	trans	-83.1	-9.2	176.4	0	0	0	0	0	114.8	F309 I310	F309-G313 PolarHBondContact O-N 3.22Å; I310-G313 PolarHBondContact O-N 2.95Å
314	A	83.9	Confident	85.6	Confident	15 Å²	15	58.4 Å²	58.4	12%	0.124	32%	0.324	C	S	.	.			trans	-82.8	134.4	-171.3	0	0	0	0	0	113.7	G264 R266 I310	G264-A314 CarbonylContact O-C 3.56Å; G264-A314 WeakPolarHBondContact O-CA 3.16Å; R266-A314 HydrophobicContact CB-CB 3.86Å; I310-A314 WeakPolarHBondContact O-CB 3.17Å; I310-A314 PolarHBondContact O-N 3.48Å; I310-A314 VanDerWaalsContact O-N 3.16Å
315	S	87.4	Confident	86.5	Confident	37 Å²	37	52.9 Å²	52.9	26%	0.259	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-71.7	134.2	173.8	-176.9	0	0	0	0	111.5	G264 F265 R266 D317	G264-S315 PolarHBondContact O-N 2.79Å; F265-S315 WeakPolarHBondContact CA-O 3.37Å; R266-S315 PolarHBondContact N-O 3.45Å; S315-D317 PolarHBondContact OG-N 3.01Å; S315-D317 PolarHBondContact OG-O 3.43Å
316	T	88.8	Confident	87.2	Confident	109 Å²	109	51 Å²	51	67%	0.669	29%	0.292	S	S	*	.	S	Bend	trans	-83.6	-17.1	168.4	51	0	0	0	0	112.8	R266 F318	R266-T316 HydrophobicContact CB-CG2 4.35Å; T316-F318 PolarHBondContact O-N 3.13Å
317	D	91.9	Very high	87.9	Confident	75 Å²	75	52 Å²	52	40%	0.401	30%	0.296	S	S	.	.			trans	-81	110.5	175.2	176.5	25.2	0	0	0	110.1	F265 S315 S319	F265-D317 WeakPolarHBondContact CD1-O 3.36Å; F265-D317 WeakPolarHBondContact CE1-O 3.46Å; S315-D317 PolarHBondContact OG-N 3.01Å; S315-D317 PolarHBondContact OG-O 3.43Å; D317-S319 WeakPolarHBondContact OD1-CB 3.43Å; D317-S319 PolarHBondContact OD1-N 3.19Å; D317-S319 PolarHBondContact OD1-OG 2.88Å
318	F	94.3	Very high	88.8	Confident	33 Å²	33	51.4 Å²	51.4	15%	0.145	29%	0.294	C	S	.	.			trans	-83.9	-8.6	174.7	-64	-35.1	0	0	0	113.7	L94 A97 F265 R266 T267 T316 P320 V321 L322	L94-F318 HydrophobicContact CD1-CB 4.3Å; L94-F318 HydrophobicContact CD1-CG 4.3Å; A97-F318 HydrophobicContact CB-CD2 3.68Å; A97-F318 HydrophobicContact CB-CE2 4.26Å; F265-F318 HydrophobicContact CB-CD1 4.14Å; F265-F318 HydrophobicContact CB-CE1 3.98Å; F265-F318 AromaticContact CD1-CD1 3.97Å; F265-F318 HydrophobicContact CD1-CD1 3.97Å; F265-F318 HydrophobicContact CG-CD1 4.37Å; R266-F318 WeakPolarHBondContact O-CE1 3.41Å; R266-F318 WeakPolarHBondContact O-CZ 3.21Å; T267-F318 HydrophobicContact CG2-CE1 3.73Å; T267-F318 HydrophobicContact CG2-CZ 3.75Å; T316-F318 PolarHBondContact O-N 3.13Å; F318-P320 VanDerWaalsContact C-N 3.28Å; F318-P320 VanDerWaalsContact O-N 3.09Å; F318-V321 PolarHBondContact O-N 3.29Å; F318-L322 HydrophobicContact CB-CD1 4.18Å; F318-L322 HydrophobicContact CB-CG 4.12Å; F318-L322 WeakPolarHBondContact O-CG 3.24Å; F318-L322 PolarHBondContact O-N 2.88Å
319	S	93.8	Very high	89.8	Confident	44 Å²	44	45.8 Å²	45.8	31%	0.308	26%	0.264	S	S	.	.	H	α-helix	trans	-51	-38.1	-173.8	-51.5	0	0	0	0	114.3	D317 V321 L322 R323	D317-S319 WeakPolarHBondContact OD1-CB 3.43Å; D317-S319 PolarHBondContact OD1-N 3.19Å; D317-S319 PolarHBondContact OD1-OG 2.88Å; S319-V321 PolarHBondContact O-N 2.84Å; S319-L322 PolarHBondContact O-N 3.24Å; S319-R323 VanDerWaalsContact CB-NH1 3.25Å; S319-R323 WeakPolarHBondContact O-CB 3.41Å; S319-R323 VanDerWaalsContact O-CG 3.31Å; S319-R323 WeakPolarHBondContact O-CG 3.23Å; S319-R323 PolarHBondContact O-N 2.96Å
320	P	92.8	Very high	90.6	Very high	33 Å²	33	41.2 Å²	41.2	21%	0.214	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-45	174.5	-24.5	35.2	0	0	0	113.2	F265 F318 D324 P340	F265-P320 HydrophobicContact CE1-CG 4.44Å; F265-P320 HydrophobicContact CZ-CB 4.28Å; F318-P320 VanDerWaalsContact C-N 3.28Å; F318-P320 VanDerWaalsContact O-N 3.09Å; P320-D324 WeakPolarHBondContact O-CB 3.19Å; P320-D324 PolarHBondContact O-N 2.8Å; P320-D324 VanDerWaalsContact O-N 3.08Å; P320-P340 HydrophobicContact CB-CB 4.24Å
321	V	94.6	Very high	91.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.4	-41.6	179.4	-168	0	0	0	0	110.8	L94 I260 P262 F265 F318 S319 R323 D324 I325 P340	L94-V321 HydrophobicContact CD1-CB 3.82Å; L94-V321 HydrophobicContact CD1-CG1 3.69Å; L94-V321 HydrophobicContact CD1-CG2 4.4Å; L94-V321 HydrophobicContact CD2-CG1 3.71Å; L94-V321 HydrophobicContact CG-CG1 4.32Å; I260-V321 HydrophobicContact CG2-CG1 4.34Å; P262-V321 HydrophobicContact CB-CG2 4.36Å; P262-V321 HydrophobicContact CG-CG1 4.19Å; F265-V321 HydrophobicContact CD1-CG2 4.05Å; F265-V321 HydrophobicContact CD2-CG2 3.69Å; F265-V321 HydrophobicContact CE1-CG2 3.67Å; F265-V321 HydrophobicContact CE2-CG2 3.26Å; F265-V321 HydrophobicContact CG-CG2 4.06Å; F265-V321 HydrophobicContact CZ-CG2 3.26Å; F318-V321 PolarHBondContact O-N 3.29Å; S319-V321 PolarHBondContact O-N 2.84Å; V321-R323 PolarHBondContact O-N 3.41Å; V321-D324 PolarHBondContact O-N 3.23Å; V321-I325 HydrophobicContact CG1-CD1 3.92Å; V321-I325 HydrophobicContact CG1-CG1 4.42Å; V321-I325 WeakPolarHBondContact O-CG1 3.33Å; V321-I325 PolarHBondContact O-N 2.58Å; V321-P340 HydrophobicContact CB-CB 4.32Å; V321-P340 HydrophobicContact CB-CG 4.15Å; V321-P340 HydrophobicContact CG1-CG 4.06Å; V321-P340 HydrophobicContact CG2-CB 3.87Å; V321-P340 HydrophobicContact CG2-CG 3.85Å
322	L	96.7	Very high	92	Very high	16 Å²	16	41.7 Å²	41.7	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-44	179.6	-63	-177.3	0	0	0	111.7	L94 A97 L98 Y101 F318 S319 I325 Q326	L94-L322 HydrophobicContact CD1-CD2 4.11Å; A97-L322 HydrophobicContact CB-CD1 4.46Å; L98-L322 HydrophobicContact CB-CD2 3.75Å; L98-L322 HydrophobicContact CD1-CD2 3.84Å; L98-L322 HydrophobicContact CG-CD2 4.42Å; Y101-L322 HydrophobicContact CD1-CB 3.74Å; Y101-L322 HydrophobicContact CD1-CD1 4.45Å; Y101-L322 HydrophobicContact CD1-CG 4.48Å; Y101-L322 HydrophobicContact CE1-CB 3.89Å; Y101-L322 HydrophobicContact CG-CB 4.26Å; Y101-L322 HydrophobicContact CG-CD1 4.14Å; F318-L322 HydrophobicContact CB-CD1 4.18Å; F318-L322 HydrophobicContact CB-CG 4.12Å; F318-L322 WeakPolarHBondContact O-CG 3.24Å; F318-L322 PolarHBondContact O-N 2.88Å; S319-L322 PolarHBondContact O-N 3.24Å; L322-I325 PolarHBondContact O-N 3.09Å; L322-Q326 WeakPolarHBondContact O-CB 3.09Å; L322-Q326 PolarHBondContact O-N 2.76Å
323	R	94.8	Very high	92.5	Very high	128 Å²	128	40.4 Å²	40.4	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-66	-40.5	175.7	-72.6	-171.8	-58.7	-100.3	-0.1	112.5	S319 V321 Q326 H327	S319-R323 VanDerWaalsContact CB-NH1 3.25Å; S319-R323 WeakPolarHBondContact O-CB 3.41Å; S319-R323 VanDerWaalsContact O-CG 3.31Å; S319-R323 WeakPolarHBondContact O-CG 3.23Å; S319-R323 PolarHBondContact O-N 2.96Å; V321-R323 PolarHBondContact O-N 3.41Å; R323-Q326 PolarHBondContact O-N 3.29Å; R323-H327 WeakPolarHBondContact O-CB 3.35Å; R323-H327 PolarHBondContact O-N 3.4Å
324	D	95.2	Very high	93.3	Very high	42 Å²	42	38.1 Å²	38.1	23%	0.225	21%	0.206	C	C	.	.	H	α-helix	trans	-64.8	-41.7	177.1	-81.1	1.7	0	0	0	111.5	P320 V321 H327 A328 Y338 P340	P320-D324 WeakPolarHBondContact O-CB 3.19Å; P320-D324 PolarHBondContact O-N 2.8Å; P320-D324 VanDerWaalsContact O-N 3.08Å; V321-D324 PolarHBondContact O-N 3.23Å; D324-H327 PolarHBondContact O-N 2.82Å; D324-A328 WeakPolarHBondContact O-CB 3.34Å; D324-A328 PolarHBondContact O-N 3.07Å; D324-Y338 HydrophobicContact CB-CD1 3.72Å; D324-Y338 HydrophobicContact CB-CG 4.13Å; D324-P340 HydrophobicContact CB-CG 4.47Å; D324-P340 WeakPolarHBondContact OD2-CB 3.39Å; D324-P340 WeakPolarHBondContact OD2-CD 3.33Å
325	I	97.6	Very high	93.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.4	-43.2	174.5	-67.9	173.1	0	0	0	110.8	L98 V165 V217 I260 V321 L322 H327 A328 I329	L98-I325 HydrophobicContact CD1-CB 4.12Å; L98-I325 HydrophobicContact CD1-CD1 4.36Å; L98-I325 HydrophobicContact CD1-CG2 3.72Å; L98-I325 HydrophobicContact CD2-CD1 3.89Å; L98-I325 HydrophobicContact CD2-CG2 3.92Å; L98-I325 HydrophobicContact CG-CG2 4.48Å; V165-I325 HydrophobicContact CG1-CG2 4.48Å; V165-I325 HydrophobicContact CG2-CG2 4.37Å; V217-I325 HydrophobicContact CG2-CD1 4.33Å; I260-I325 HydrophobicContact CD1-CG1 4.28Å; I260-I325 HydrophobicContact CG1-CG1 3.97Å; V321-I325 HydrophobicContact CG1-CD1 3.92Å; V321-I325 HydrophobicContact CG1-CG1 4.42Å; V321-I325 WeakPolarHBondContact O-CG1 3.33Å; V321-I325 PolarHBondContact O-N 2.58Å; L322-I325 PolarHBondContact O-N 3.09Å; I325-H327 VanDerWaalsContact C-N 3.32Å; I325-H327 PolarHBondContact O-N 3.43Å; I325-A328 WeakPolarHBondContact O-CB 3.43Å; I325-A328 PolarHBondContact O-N 3.49Å; I325-A328 VanDerWaalsContact O-N 3.17Å; I325-I329 WeakPolarHBondContact O-CG1 3.27Å; I325-I329 PolarHBondContact O-N 3.28Å
326	Q	96.6	Very high	93.8	Very high	38 Å²	38	40.9 Å²	40.9	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-47.2	174.1	179.2	-163.9	6	0	0	111	Y101 L105 L322 R323 I329 S330	Y101-Q326 HydrophobicContact CE1-CB 4.06Å; Y101-Q326 PolarHBondContact OH-OE1 3.02Å; L105-Q326 HydrophobicContact CD1-CB 4.45Å; L105-Q326 HydrophobicContact CD1-CG 3.76Å; L322-Q326 WeakPolarHBondContact O-CB 3.09Å; L322-Q326 PolarHBondContact O-N 2.76Å; R323-Q326 PolarHBondContact O-N 3.29Å; Q326-I329 VanDerWaalsContact O-CG1 3.29Å; Q326-I329 WeakPolarHBondContact O-CG1 3.37Å; Q326-I329 PolarHBondContact O-N 2.92Å; Q326-S330 WeakPolarHBondContact O-CB 3.47Å; Q326-S330 PolarHBondContact O-N 2.8Å; Q326-S330 PolarHBondContact O-OG 3.31Å
327	H	95.3	Very high	93.9	Very high	25 Å²	25	40.4 Å²	40.4	12%	0.116	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-43.6	176.8	-176	-62.7	0	0	0	110.6	Q75 R323 D324 I325 I329 S330 A331 Y338	Q75-H327 PolarHBondContact NE2-NE2 2.85Å; Q75-H327 PolarHBondContact OE1-NE2 3.22Å; Q75-H327 VanDerWaalsContact OE1-NE2 3.1Å; R323-H327 WeakPolarHBondContact O-CB 3.35Å; R323-H327 PolarHBondContact O-N 3.4Å; D324-H327 PolarHBondContact O-N 2.82Å; I325-H327 VanDerWaalsContact C-N 3.32Å; I325-H327 PolarHBondContact O-N 3.43Å; H327-I329 VanDerWaalsContact C-N 3.27Å; H327-I329 PolarHBondContact O-N 3.04Å; H327-S330 PolarHBondContact O-N 3.15Å; H327-A331 WeakPolarHBondContact CE1-CB 3.46Å; H327-A331 WeakPolarHBondContact ND1-CB 2.81Å; H327-A331 WeakPolarHBondContact O-CB 3.25Å; H327-A331 PolarHBondContact O-N 3.32Å; H327-Y338 HydrophobicContact CB-CE1 4.25Å; H327-Y338 PolarHBondContact CE1-OH 2.94Å; H327-Y338 VanDerWaalsContact CE1-OH 3.22Å; H327-Y338 AromaticContact ND1-CE1 3.8Å; H327-Y338 AromaticContact ND1-CZ 3.61Å; H327-Y338 PolarHBondContact ND1-OH 3.49Å
328	A	96.8	Very high	94	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.3	-39.2	177.7	0	0	0	0	0	112.7	V215 V258 I260 D324 I325 Y338	V215-A328 HydrophobicContact CG2-CB 4.17Å; V258-A328 HydrophobicContact CB-CB 4.18Å; V258-A328 HydrophobicContact CG1-CB 3.79Å; V258-A328 HydrophobicContact CG2-CB 4.14Å; I260-A328 HydrophobicContact CD1-CB 4.17Å; D324-A328 WeakPolarHBondContact O-CB 3.34Å; D324-A328 PolarHBondContact O-N 3.07Å; I325-A328 WeakPolarHBondContact O-CB 3.43Å; I325-A328 PolarHBondContact O-N 3.49Å; I325-A328 VanDerWaalsContact O-N 3.17Å; A328-Y338 HydrophobicContact CB-CD2 4.45Å; A328-Y338 HydrophobicContact CB-CE2 3.97Å
329	I	97	Very high	93.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-86	-27.1	179.8	68.7	176.1	0	0	0	113.7	V85 L102 F107 W162 A163 V165 V215 I325 Q326 H327	V85-I329 HydrophobicContact CG2-CD1 4.11Å; L102-I329 HydrophobicContact CD1-CD1 4.3Å; L102-I329 HydrophobicContact CD2-CD1 3.52Å; F107-I329 HydrophobicContact CE1-CD1 3.98Å; F107-I329 HydrophobicContact CE2-CD1 3.98Å; F107-I329 HydrophobicContact CZ-CD1 3.65Å; F107-I329 HydrophobicContact CZ-CG1 4.14Å; W162-I329 WeakPolarHBondContact CZ2-O 3.3Å; W162-I329 PolarHBondContact NE1-O 2.95Å; A163-I329 HydrophobicContact CB-CB 4.35Å; A163-I329 HydrophobicContact CB-CG2 3.86Å; V165-I329 HydrophobicContact CG2-CG2 4.49Å; V215-I329 HydrophobicContact CG2-CG2 3.74Å; I325-I329 WeakPolarHBondContact O-CG1 3.27Å; I325-I329 PolarHBondContact O-N 3.28Å; Q326-I329 VanDerWaalsContact O-CG1 3.29Å; Q326-I329 WeakPolarHBondContact O-CG1 3.37Å; Q326-I329 PolarHBondContact O-N 2.92Å; H327-I329 VanDerWaalsContact C-N 3.27Å; H327-I329 PolarHBondContact O-N 3.04Å
330	S	95.5	Very high	93.7	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-101.1	-27.2	-171.5	-55.7	0	0	0	0	113	L78 Q326 H327	L78-S330 VanDerWaalsContact CB-O 3.32Å; L78-S330 WeakPolarHBondContact CB-O 3.28Å; L78-S330 WeakPolarHBondContact CG-O 3.43Å; L78-S330 PolarHBondContact N-O 3.03Å; Q326-S330 WeakPolarHBondContact O-CB 3.47Å; Q326-S330 PolarHBondContact O-N 2.8Å; Q326-S330 PolarHBondContact O-OG 3.31Å; H327-S330 PolarHBondContact O-N 3.15Å
331	A	93.1	Very high	93.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-65.5	143.9	-177.2	0	0	0	0	0	112.5	L77 R213 H327 S333 P334	L77-A331 HydrophobicContact CD2-CB 4.27Å; R213-A331 PolarHBondContact NH2-O 3.07Å; R213-A331 VanDerWaalsContact NH2-O 3.09Å; H327-A331 WeakPolarHBondContact CE1-CB 3.46Å; H327-A331 WeakPolarHBondContact ND1-CB 2.81Å; H327-A331 WeakPolarHBondContact O-CB 3.25Å; H327-A331 PolarHBondContact O-N 3.32Å; A331-S333 VanDerWaalsContact C-N 3.31Å; A331-P334 HydrophobicContact CB-CB 4.25Å
332	K	91.1	Very high	92.5	Very high	115 Å²	115	44.7 Å²	44.7	50%	0.5	22%	0.22	S	C	.	.	S	Bend	trans	-62.9	-40.6	172.1	-173.8	177.2	-174.9	174.2	0	111.4	E76 L78	E76-K332 HydrophobicContact CB-CB 4.47Å; E76-K332 WeakPolarHBondContact O-CB 3.21Å; E76-K332 PolarHBondContact O-N 2.91Å; E76-K332 WeakPolarHBondContact OE2-CD 3.48Å; E76-K332 IonicContact OE2-NZ 3.27Å; E76-K332 PolarHBondContact OE2-NZ 3.16Å; L78-K332 HydrophobicContact CD2-CB 4.4Å
333	S	89.1	Confident	91.7	Very high	70 Å²	70	47.1 Å²	47.1	49%	0.49	24%	0.242	S	C	.	.	S	Bend	trans	-132.1	83.3	174.3	-170.3	0	0	0	0	110.1	A331	A331-S333 VanDerWaalsContact C-N 3.31Å
334	P	93.1	Very high	91.1	Very high	18 Å²	18	41 Å²	41	12%	0.117	22%	0.219	C	C	.	.			trans	-67.2	156	179.2	30.4	-35.3	0	0	0	111.2	K256 V258 A331	K256-P334 HydrophobicContact CB-CG 4.07Å; K256-P334 HydrophobicContact CG-CG 4.36Å; V258-P334 HydrophobicContact CG2-CB 3.96Å; V258-P334 HydrophobicContact CG2-CG 4.02Å; A331-P334 HydrophobicContact CB-CB 4.25Å
335	F	90.7	Very high	90.5	Very high	78 Å²	78	46.2 Å²	46.2	34%	0.342	24%	0.237	S	C	.	.			trans	-68	155.8	170.9	-58.4	-67.2	0	0	0	110.8	Y71 Q75 V258 Y337 Y338	Y71-F335 HydrophobicContact CD2-CE1 4.19Å; Y71-F335 HydrophobicContact CD2-CZ 4.18Å; Y71-F335 AromaticContact CE2-CE1 3.77Å; Y71-F335 HydrophobicContact CE2-CE1 3.77Å; Y71-F335 AromaticContact CE2-CZ 3.44Å; Y71-F335 HydrophobicContact CE2-CZ 3.44Å; Y71-F335 VanDerWaalsContact CE2-CZ 3.44Å; Y71-F335 AromaticContact CZ-CZ 3.93Å; Q75-F335 VanDerWaalsContact NE2-CZ 3.34Å; V258-F335 WeakPolarHBondContact CG2-O 3.31Å; F335-Y337 VanDerWaalsContact C-N 3.33Å; F335-Y338 HydrophobicContact CB-CD2 4.42Å; F335-Y338 HydrophobicContact CB-CE2 3.78Å; F335-Y338 AromaticContact CD2-CE1 3.72Å; F335-Y338 HydrophobicContact CD2-CE1 3.72Å; F335-Y338 HydrophobicContact CD2-CE2 4.45Å; F335-Y338 AromaticContact CD2-CZ 3.65Å; F335-Y338 WeakPolarHBondContact CD2-OH 3.49Å; F335-Y338 PolarHBondContact N-OH 2.95Å; F335-Y338 WeakPolarHBondContact O-CE2 3.48Å
336	A	91.4	Very high	89.9	Confident	33 Å²	33	51.1 Å²	51.1	27%	0.273	26%	0.262	S	S	.	.	S	Bend	trans	-65.4	-38.9	172.9	0	0	0	0	0	112.2	R247 S259	R247-A336 PolarHBondContact NH2-O 3.04Å; S259-A336 PolarHBondContact N-O 3.45Å
337	Y	91.6	Very high	89.4	Confident	98 Å²	98	50.3 Å²	50.3	38%	0.384	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	139.9	-174.5	-55	-80.7	0	0	0	110.4	T240 S244 R247 S259 F335	T240-Y337 HydrophobicContact CG2-CE1 4.43Å; S244-Y337 PolarHBondContact OG-OH 3.36Å; R247-Y337 PolarHBondContact NH1-OH 3.17Å; S259-Y337 VanDerWaalsContact O-CA 3.31Å; S259-Y337 WeakPolarHBondContact O-CA 3.48Å; F335-Y337 VanDerWaalsContact C-N 3.33Å
338	Y	92.6	Very high	88.9	Confident	14 Å²	14	49.6 Å²	49.6	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.5	168.8	-65.3	-104.2	0	0	0	108	V258 S259 I260 Q261 D324 H327 A328 F335 P340	V258-Y338 HydrophobicContact CG1-CD2 3.36Å; V258-Y338 HydrophobicContact CG1-CE2 3.4Å; S259-Y338 PolarHBondContact O-N 3.44Å; I260-Y338 CarbonylContact C-O 3.58Å; I260-Y338 HydrophobicContact CD1-CD2 3.62Å; I260-Y338 HydrophobicContact CD1-CG 3.8Å; Q261-Y338 PolarHBondContact N-O 3.43Å; D324-Y338 HydrophobicContact CB-CD1 3.72Å; D324-Y338 HydrophobicContact CB-CG 4.13Å; H327-Y338 HydrophobicContact CB-CE1 4.25Å; H327-Y338 PolarHBondContact CE1-OH 2.94Å; H327-Y338 VanDerWaalsContact CE1-OH 3.22Å; H327-Y338 AromaticContact ND1-CE1 3.8Å; H327-Y338 AromaticContact ND1-CZ 3.61Å; H327-Y338 PolarHBondContact ND1-OH 3.49Å; A328-Y338 HydrophobicContact CB-CD2 4.45Å; A328-Y338 HydrophobicContact CB-CE2 3.97Å; F335-Y338 HydrophobicContact CB-CD2 4.42Å; F335-Y338 HydrophobicContact CB-CE2 3.78Å; F335-Y338 AromaticContact CD2-CE1 3.72Å; F335-Y338 HydrophobicContact CD2-CE1 3.72Å; F335-Y338 HydrophobicContact CD2-CE2 4.45Å; F335-Y338 AromaticContact CD2-CZ 3.65Å; F335-Y338 WeakPolarHBondContact CD2-OH 3.49Å; F335-Y338 PolarHBondContact N-OH 2.95Å; F335-Y338 WeakPolarHBondContact O-CE2 3.48Å; Y338-P340 WeakPolarHBondContact O-CD 3.37Å
339	T	92.4	Very high	88.3	Confident	35 Å²	35	50.9 Å²	50.9	22%	0.215	26%	0.264	C	S	.	.			trans	-127.3	63.6	-175.4	56.2	0	0	0	0	110.2	Q261 Y345 L348	Q261-T339 HydrophobicContact CB-CG2 4.25Å; T339-Y345 HydrophobicContact CG2-CD2 4.46Å; T339-L348 HydrophobicContact CG2-CD1 3.51Å
340	P	90.7	Very high	87.7	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.039	27%	0.273	C	S	.	.			trans	-66.4	145.7	180	26.5	-31.9	0	0	0	110.2	I260 P262 G263 F265 P320 V321 D324 Y338	I260-P340 HydrophobicContact CG2-CG 3.84Å; P262-P340 WeakPolarHBondContact CA-O 3.36Å; P262-P340 HydrophobicContact CB-CG 4.28Å; P262-P340 HydrophobicContact CG-CG 4.32Å; G263-P340 PolarHBondContact N-O 3.45Å; F265-P340 HydrophobicContact CE2-CB 4.34Å; F265-P340 WeakPolarHBondContact CE2-O 3.25Å; F265-P340 HydrophobicContact CZ-CB 4.28Å; P320-P340 HydrophobicContact CB-CB 4.24Å; V321-P340 HydrophobicContact CB-CB 4.32Å; V321-P340 HydrophobicContact CB-CG 4.15Å; V321-P340 HydrophobicContact CG1-CG 4.06Å; V321-P340 HydrophobicContact CG2-CB 3.87Å; V321-P340 HydrophobicContact CG2-CG 3.85Å; D324-P340 HydrophobicContact CB-CG 4.47Å; D324-P340 WeakPolarHBondContact OD2-CB 3.39Å; D324-P340 WeakPolarHBondContact OD2-CD 3.33Å; Y338-P340 WeakPolarHBondContact O-CD 3.37Å
341	G	84.1	Confident	87.3	Confident	24 Å²	24	54 Å²	54	25%	0.247	28%	0.284	C	S	.	.	S	Bend	trans	118.2	150	178.7	0	0	0	0	0	113	G263 A343 A344	G263-G341 WeakPolarHBondContact O-CA 3.31Å; G341-A343 PolarHBondContact O-N 2.93Å; G341-A344 PolarHBondContact O-N 3.07Å
342	K	78.1	Confident	86.9	Confident	196 Å²	196	60.8 Å²	60.8	85%	0.852	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	131	-179.8	-70.2	179.8	-179	176.8	0	109.4	A344	K342-A344 PolarHBondContact O-N 2.91Å
343	A	78.4	Confident	86.7	Confident	68 Å²	68	64 Å²	64	56%	0.562	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	6.1	179.5	0	0	0	0	0	116.4	G341 Y345 L346 W347	G341-A343 PolarHBondContact O-N 2.93Å; A343-Y345 PolarHBondContact O-N 3.01Å; A343-L346 PolarHBondContact O-N 3.21Å; A343-W347 PolarHBondContact O-N 3.45Å
344	A	82.8	Confident	86.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-47.4	-178	0	0	0	0	0	111.9	M220 G341 K342 W347 L348	M220-A344 VanDerWaalsContact SD-CA 3.58Å; M220-A344 HydrophobicContact SD-CB 4.13Å; G341-A344 PolarHBondContact O-N 3.07Å; K342-A344 PolarHBondContact O-N 2.91Å; A344-W347 PolarHBondContact O-N 2.83Å; A344-L348 WeakPolarHBondContact O-CG 3.36Å; A344-L348 PolarHBondContact O-N 3.48Å
345	Y	83.6	Confident	86.6	Confident	151 Å²	151	66.5 Å²	66.5	59%	0.592	34%	0.335	S	S	*	.	H	α-helix	trans	-61.9	-43.9	174.5	-176.2	-104.7	0	0	0	112.4	T339 A343 W347 L348 C349	T339-Y345 HydrophobicContact CG2-CD2 4.46Å; A343-Y345 PolarHBondContact O-N 3.01Å; Y345-W347 VanDerWaalsContact C-N 3.34Å; Y345-W347 PolarHBondContact O-N 2.8Å; Y345-L348 PolarHBondContact O-N 3.17Å; Y345-C349 WeakPolarHBondContact CE1-SG 3.33Å; Y345-C349 VanDerWaalsContact CZ-SG 3.53Å; Y345-C349 PolarHBondContact O-N 3.19Å; Y345-C349 PolarHBondContact O-SG 3.25Å; Y345-C349 VanDerWaalsContact O-SG 3.34Å
346	L	84.3	Confident	86.5	Confident	102 Å²	102	68.5 Å²	68.5	53%	0.534	35%	0.348	S	S	.	.	H	α-helix	trans	-60.5	-44.8	179.8	179.4	62.2	0	0	0	110.8	A343 L348 C349 L350	A343-L346 PolarHBondContact O-N 3.21Å; L346-L348 VanDerWaalsContact C-N 3.32Å; L346-L348 PolarHBondContact O-N 3.31Å; L346-C349 WeakPolarHBondContact O-CB 3.3Å; L346-C349 PolarHBondContact O-N 3.35Å; L346-C349 VanDerWaalsContact O-N 3.12Å; L346-L350 HydrophobicContact CD1-CG 4.49Å; L346-L350 HydrophobicContact CG-CD1 4.46Å; L346-L350 HydrophobicContact CG-CG 4.47Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.45Å
347	W	86	Confident	86.4	Confident	22 Å²	22	69.2 Å²	69.2	8%	0.083	36%	0.359	C	S	.	.	H	α-helix	trans	-59.1	-43.6	178.6	-167.9	-105	0	0	0	112.6	M220 A343 A344 Y345 L350 A351 Y359 A363 F367	M220-W347 HydrophobicContact CE-CB 4.37Å; M220-W347 HydrophobicContact CE-CG 4.09Å; M220-W347 HydrophobicContact CG-CB 4.23Å; M220-W347 HydrophobicContact CG-CG 4.35Å; M220-W347 HydrophobicContact SD-CB 3.5Å; M220-W347 WeakPolarHBondContact SD-CB 3.13Å; M220-W347 HydrophobicContact SD-CG 3.8Å; A343-W347 PolarHBondContact O-N 3.45Å; A344-W347 PolarHBondContact O-N 2.83Å; Y345-W347 VanDerWaalsContact C-N 3.34Å; Y345-W347 PolarHBondContact O-N 2.8Å; W347-L350 HydrophobicContact CE3-CD1 4.03Å; W347-L350 HydrophobicContact CZ3-CD1 4.24Å; W347-L350 PolarHBondContact O-N 3.43Å; W347-A351 PolarHBondContact O-N 3.16Å; W347-A351 VanDerWaalsContact O-N 3.09Å; W347-Y359 HydrophobicContact CH2-CE2 4.37Å; W347-Y359 AromaticContact CZ2-CE2 3.79Å; W347-Y359 HydrophobicContact CZ2-CE2 3.79Å; W347-Y359 AromaticContact CZ2-CZ 3.86Å; W347-Y359 PolarHBondContact NE1-OH 3.24Å; W347-A363 HydrophobicContact CH2-CB 4.16Å; W347-A363 HydrophobicContact CZ2-CB 4.2Å; W347-F367 AromaticContact CH2-CE2 3.67Å; W347-F367 HydrophobicContact CH2-CE2 3.67Å; W347-F367 HydrophobicContact CH2-CZ 4.4Å; W347-F367 HydrophobicContact CZ2-CD2 4.46Å; W347-F367 AromaticContact CZ2-CE2 3.49Å; W347-F367 HydrophobicContact CZ2-CE2 3.49Å; W347-F367 VanDerWaalsContact CZ2-CE2 3.49Å; W347-F367 HydrophobicContact CZ2-CZ 4.24Å; W347-F367 HydrophobicContact CZ3-CE2 4.42Å
348	L	85.1	Confident	86.3	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-44.7	174.4	-66.7	165.9	0	0	0	110.8	M220 G223 A224 Q261 T339 A344 Y345 L346 L350 A351 F352	M220-L348 HydrophobicContact CG-CD2 4.45Å; M220-L348 HydrophobicContact CG-CG 4.28Å; G223-L348 VanDerWaalsContact C-CD2 3.44Å; A224-L348 HydrophobicContact CB-CD2 3.99Å; Q261-L348 VanDerWaalsContact OE1-CD1 3.26Å; T339-L348 HydrophobicContact CG2-CD1 3.51Å; A344-L348 WeakPolarHBondContact O-CG 3.36Å; A344-L348 PolarHBondContact O-N 3.48Å; Y345-L348 PolarHBondContact O-N 3.17Å; L346-L348 VanDerWaalsContact C-N 3.32Å; L346-L348 PolarHBondContact O-N 3.31Å; L348-L350 VanDerWaalsContact C-N 3.32Å; L348-L350 PolarHBondContact O-N 3.32Å; L348-A351 PolarHBondContact O-N 3Å; L348-A351 VanDerWaalsContact O-N 3.16Å; L348-F352 HydrophobicContact CB-CD2 4.36Å; L348-F352 HydrophobicContact CB-CE2 4.4Å; L348-F352 HydrophobicContact CD2-CE2 4.29Å; L348-F352 WeakPolarHBondContact O-CD2 3.1Å; L348-F352 PolarHBondContact O-N 3.16Å
349	C	83.3	Confident	86.1	Confident	27 Å²	27	68 Å²	68	18%	0.182	36%	0.358	C	S	.	.	H	α-helix	trans	-59	-42	175.3	-69.4	0	0	0	0	112.6	Y345 L346 A351 F352 Y353	Y345-C349 WeakPolarHBondContact CE1-SG 3.33Å; Y345-C349 VanDerWaalsContact CZ-SG 3.53Å; Y345-C349 PolarHBondContact O-N 3.19Å; Y345-C349 PolarHBondContact O-SG 3.25Å; Y345-C349 VanDerWaalsContact O-SG 3.34Å; L346-C349 WeakPolarHBondContact O-CB 3.3Å; L346-C349 PolarHBondContact O-N 3.35Å; L346-C349 VanDerWaalsContact O-N 3.12Å; C349-A351 VanDerWaalsContact C-N 3.3Å; C349-A351 PolarHBondContact O-N 3.13Å; C349-F352 PolarHBondContact O-N 3.15Å; C349-Y353 HydrophobicContact CB-CD2 4.02Å; C349-Y353 HydrophobicContact CB-CE2 4.39Å; C349-Y353 WeakPolarHBondContact O-CB 3.05Å; C349-Y353 VanDerWaalsContact O-CD2 3.27Å; C349-Y353 WeakPolarHBondContact O-CD2 3.25Å; C349-Y353 PolarHBondContact O-N 3.44Å
350	L	85.1	Confident	85.9	Confident	37 Å²	37	69.5 Å²	69.5	19%	0.194	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-43.8	176.4	-64.3	173.6	0	0	0	110.6	L346 W347 L348 L354 Y359	L346-L350 HydrophobicContact CD1-CG 4.49Å; L346-L350 HydrophobicContact CG-CD1 4.46Å; L346-L350 HydrophobicContact CG-CG 4.47Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.45Å; W347-L350 HydrophobicContact CE3-CD1 4.03Å; W347-L350 HydrophobicContact CZ3-CD1 4.24Å; W347-L350 PolarHBondContact O-N 3.43Å; L348-L350 VanDerWaalsContact C-N 3.32Å; L348-L350 PolarHBondContact O-N 3.32Å; L350-L354 HydrophobicContact CB-CD1 4.05Å; L350-L354 HydrophobicContact CD2-CD1 3.33Å; L350-L354 HydrophobicContact CD2-CG 4.19Å; L350-L354 HydrophobicContact CG-CD1 4.25Å; L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 2.97Å; L350-L354 VanDerWaalsContact O-N 3.15Å; L350-Y359 HydrophobicContact CB-CD2 4.19Å
351	A	85.8	Confident	85.7	Confident	30 Å²	30	75.1 Å²	75.1	25%	0.248	39%	0.387	C	S	.	.	H	α-helix	trans	-67.7	-37.8	179.4	0	0	0	0	0	113.5	A224 W347 L348 C349 Y359	A224-A351 HydrophobicContact CB-CB 3.47Å; A224-A351 VanDerWaalsContact CB-CB 3.47Å; W347-A351 PolarHBondContact O-N 3.16Å; W347-A351 VanDerWaalsContact O-N 3.09Å; L348-A351 PolarHBondContact O-N 3Å; L348-A351 VanDerWaalsContact O-N 3.16Å; C349-A351 VanDerWaalsContact C-N 3.3Å; C349-A351 PolarHBondContact O-N 3.13Å; A351-Y359 HydrophobicContact CB-CD2 4.08Å; A351-Y359 HydrophobicContact CB-CE2 3.57Å
352	F	85.7	Confident	85.8	Confident	142 Å²	142	77.6 Å²	77.6	62%	0.623	39%	0.391	S	S	*	.	H	α-helix	trans	-84.6	-28.8	-176	-76.1	-65.5	0	0	0	114.3	G223 L348 C349	G223-F352 WeakPolarHBondContact O-CZ 3.49Å; L348-F352 HydrophobicContact CB-CD2 4.36Å; L348-F352 HydrophobicContact CB-CE2 4.4Å; L348-F352 HydrophobicContact CD2-CE2 4.29Å; L348-F352 WeakPolarHBondContact O-CD2 3.1Å; L348-F352 PolarHBondContact O-N 3.16Å; C349-F352 PolarHBondContact O-N 3.15Å
353	Y	87	Confident	86.1	Confident	183 Å²	183	69 Å²	69	72%	0.718	36%	0.356	S	S	*	.	H	α-helix	trans	-114.8	-18	-170.2	-60.5	-67.3	0	0	0	114.7	C349	C349-Y353 HydrophobicContact CB-CD2 4.02Å; C349-Y353 HydrophobicContact CB-CE2 4.39Å; C349-Y353 WeakPolarHBondContact O-CB 3.05Å; C349-Y353 VanDerWaalsContact O-CD2 3.27Å; C349-Y353 WeakPolarHBondContact O-CD2 3.25Å; C349-Y353 PolarHBondContact O-N 3.44Å
354	L	87.5	Confident	86.3	Confident	59 Å²	59	72.1 Å²	72.1	31%	0.309	36%	0.359	S	S	.	.	S	Bend	trans	-89.5	148.8	177.7	-64	-179.3	0	0	0	112.4	L350 I358 F362	L350-L354 HydrophobicContact CB-CD1 4.05Å; L350-L354 HydrophobicContact CD2-CD1 3.33Å; L350-L354 HydrophobicContact CD2-CG 4.19Å; L350-L354 HydrophobicContact CG-CD1 4.25Å; L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 2.97Å; L350-L354 VanDerWaalsContact O-N 3.15Å; L354-I358 HydrophobicContact CB-CB 4.46Å; L354-I358 HydrophobicContact CD1-CG2 3.87Å; L354-F362 HydrophobicContact CD1-CD2 4.46Å; L354-F362 HydrophobicContact CD1-CE2 4.45Å
355	P	91.9	Very high	86.2	Confident	82 Å²	82	78.3 Å²	78.3	53%	0.532	38%	0.383	S	S	.	.			trans	-53.4	141.6	164.1	-23.6	32.3	0	0	0	111.6	G357 I358 Y359	P355-G357 VanDerWaalsContact C-N 3.26Å; P355-G357 PolarHBondContact O-N 3.25Å; P355-G357 VanDerWaalsContact O-N 3.13Å; P355-I358 HydrophobicContact CB-CD1 4.5Å; P355-I358 HydrophobicContact CB-CG1 4.4Å; P355-I358 HydrophobicContact CG-CD1 4.15Å; P355-I358 PolarHBondContact O-N 3.37Å; P355-Y359 PolarHBondContact O-N 3.32Å; P355-Y359 VanDerWaalsContact O-N 3.14Å
356	I	89.7	Confident	85.9	Confident	119 Å²	119	75 Å²	75	61%	0.61	38%	0.375	S	S	*	.	H	α-helix	trans	-54.3	-37.7	-173.5	-169.7	61.9	0	0	0	113.7	I358 Y359 N360	I356-I358 PolarHBondContact O-N 3.21Å; I356-Y359 HydrophobicContact CD1-CD1 4.35Å; I356-Y359 PolarHBondContact O-N 2.94Å; I356-N360 WeakPolarHBondContact O-CB 3.45Å; I356-N360 PolarHBondContact O-N 3.49Å; I356-N360 PolarHBondContact O-OD1 2.89Å
357	G	89.1	Confident	85.4	Confident	49 Å²	49	71.5 Å²	71.5	51%	0.505	36%	0.356	S	S	.	.	H	α-helix	trans	-65.1	-36.5	178.5	0	0	0	0	0	113.5	P355 Y361	P355-G357 VanDerWaalsContact C-N 3.26Å; P355-G357 PolarHBondContact O-N 3.25Å; P355-G357 VanDerWaalsContact O-N 3.13Å; G357-Y361 PolarHBondContact O-N 3.4Å; G357-Y361 VanDerWaalsContact O-N 3.09Å
358	I	88.4	Confident	84.3	Confident	78 Å²	78	72.2 Å²	72.2	40%	0.4	37%	0.37	S	S	.	.	H	α-helix	trans	-71.2	-42.7	177	-55.1	-174.8	0	0	0	109.6	L354 P355 I356 Y361 F362	L354-I358 HydrophobicContact CB-CB 4.46Å; L354-I358 HydrophobicContact CD1-CG2 3.87Å; P355-I358 HydrophobicContact CB-CD1 4.5Å; P355-I358 HydrophobicContact CB-CG1 4.4Å; P355-I358 HydrophobicContact CG-CD1 4.15Å; P355-I358 PolarHBondContact O-N 3.37Å; I356-I358 PolarHBondContact O-N 3.21Å; I358-Y361 PolarHBondContact O-N 3.01Å; I358-F362 HydrophobicContact CG2-CD2 3.9Å; I358-F362 HydrophobicContact CG2-CE2 3.63Å; I358-F362 WeakPolarHBondContact O-CD2 3.38Å; I358-F362 PolarHBondContact O-N 3.35Å; I358-F362 VanDerWaalsContact O-N 3.14Å
359	Y	88.3	Confident	83.1	Confident	7 Å²	7	78.4 Å²	78.4	3%	0.027	40%	0.396	C	S	.	.	H	α-helix	trans	-59.3	-49.1	176	177.7	-100.5	0	0	0	112	P225 W347 L350 A351 P355 I356 Y361 F362 A363	P225-Y359 HydrophobicContact CB-CE1 4.2Å; P225-Y359 WeakPolarHBondContact CD-OH 3.31Å; P225-Y359 HydrophobicContact CG-CE1 4.26Å; P225-Y359 PolarHBondContact O-OH 3.1Å; W347-Y359 HydrophobicContact CH2-CE2 4.37Å; W347-Y359 AromaticContact CZ2-CE2 3.79Å; W347-Y359 HydrophobicContact CZ2-CE2 3.79Å; W347-Y359 AromaticContact CZ2-CZ 3.86Å; W347-Y359 PolarHBondContact NE1-OH 3.24Å; L350-Y359 HydrophobicContact CB-CD2 4.19Å; A351-Y359 HydrophobicContact CB-CD2 4.08Å; A351-Y359 HydrophobicContact CB-CE2 3.57Å; P355-Y359 PolarHBondContact O-N 3.32Å; P355-Y359 VanDerWaalsContact O-N 3.14Å; I356-Y359 HydrophobicContact CD1-CD1 4.35Å; I356-Y359 PolarHBondContact O-N 2.94Å; Y359-Y361 VanDerWaalsContact C-N 3.32Å; Y359-Y361 PolarHBondContact O-N 3.18Å; Y359-F362 PolarHBondContact O-N 2.99Å; Y359-F362 VanDerWaalsContact O-N 3.11Å; Y359-A363 HydrophobicContact CE1-CB 4.47Å; Y359-A363 PolarHBondContact O-N 3.46Å
360	N	88.4	Confident	82.2	Confident	67 Å²	67	84.4 Å²	84.4	36%	0.358	43%	0.427	S	S	.	.	H	α-helix	trans	-60	-42.2	178.9	-71.4	-2.6	0	0	0	111.5	I356 F362 A363 E364	I356-N360 WeakPolarHBondContact O-CB 3.45Å; I356-N360 PolarHBondContact O-N 3.49Å; I356-N360 PolarHBondContact O-OD1 2.89Å; N360-F362 VanDerWaalsContact C-N 3.33Å; N360-F362 PolarHBondContact O-N 2.68Å; N360-A363 PolarHBondContact O-N 2.57Å; N360-A363 VanDerWaalsContact O-N 3.14Å; N360-E364 WeakPolarHBondContact O-CB 3.2Å; N360-E364 WeakPolarHBondContact O-CG 3.36Å; N360-E364 PolarHBondContact O-N 3.03Å
361	Y	87	Confident	81.4	Confident	124 Å²	124	84.9 Å²	84.9	49%	0.486	43%	0.428	S	S	.	.	H	α-helix	trans	-56.4	-45.2	174	175.2	-95.6	0	0	0	112.5	G357 I358 Y359 R365	G357-Y361 PolarHBondContact O-N 3.4Å; G357-Y361 VanDerWaalsContact O-N 3.09Å; I358-Y361 PolarHBondContact O-N 3.01Å; Y359-Y361 VanDerWaalsContact C-N 3.32Å; Y359-Y361 PolarHBondContact O-N 3.18Å; Y361-R365 VanDerWaalsContact O-CB 3.23Å; Y361-R365 WeakPolarHBondContact O-CB 3.37Å; Y361-R365 PolarHBondContact O-N 3.24Å; Y361-R365 VanDerWaalsContact O-N 3.09Å; Y361-R365 PolarHBondContact OH-NH1 3.42Å
362	F	85.7	Confident	81.1	Confident	77 Å²	77	86.1 Å²	86.1	34%	0.338	43%	0.433	S	S	.	.	H	α-helix	trans	-68.2	-39.3	175.8	-77.1	-66.6	0	0	0	112.2	L354 I358 Y359 N360 R365 N366	L354-F362 HydrophobicContact CD1-CD2 4.46Å; L354-F362 HydrophobicContact CD1-CE2 4.45Å; I358-F362 HydrophobicContact CG2-CD2 3.9Å; I358-F362 HydrophobicContact CG2-CE2 3.63Å; I358-F362 WeakPolarHBondContact O-CD2 3.38Å; I358-F362 PolarHBondContact O-N 3.35Å; I358-F362 VanDerWaalsContact O-N 3.14Å; Y359-F362 PolarHBondContact O-N 2.99Å; Y359-F362 VanDerWaalsContact O-N 3.11Å; N360-F362 VanDerWaalsContact C-N 3.33Å; N360-F362 PolarHBondContact O-N 2.68Å; F362-R365 PolarHBondContact O-N 3.41Å; F362-N366 WeakPolarHBondContact O-CB 3.28Å; F362-N366 PolarHBondContact O-N 3.49Å; F362-N366 PolarHBondContact O-ND2 3.18Å
363	A	84.2	Confident	81.1	Confident	15 Å²	15	85 Å²	85	12%	0.124	43%	0.431	C	S	.	.	H	α-helix	trans	-62.7	-49.8	178	0	0	0	0	0	111.9	W347 Y359 N360 R365 N366 F367	W347-A363 HydrophobicContact CH2-CB 4.16Å; W347-A363 HydrophobicContact CZ2-CB 4.2Å; Y359-A363 HydrophobicContact CE1-CB 4.47Å; Y359-A363 PolarHBondContact O-N 3.46Å; N360-A363 PolarHBondContact O-N 2.57Å; N360-A363 VanDerWaalsContact O-N 3.14Å; A363-R365 VanDerWaalsContact C-N 3.34Å; A363-R365 PolarHBondContact O-N 3.31Å; A363-N366 PolarHBondContact O-N 3.16Å; A363-F367 VanDerWaalsContact O-CD2 3.24Å; A363-F367 WeakPolarHBondContact O-CD2 3.23Å; A363-F367 PolarHBondContact O-N 3.04Å
364	E	82.6	Confident	81.2	Confident	133 Å²	133	77.2 Å²	77.2	62%	0.621	40%	0.403	S	S	*	.	H	α-helix	trans	-59.9	-44.7	177.1	-71.3	169.1	-165.5	0	0	111.3	N360 N366 G368	N360-E364 WeakPolarHBondContact O-CB 3.2Å; N360-E364 WeakPolarHBondContact O-CG 3.36Å; N360-E364 PolarHBondContact O-N 3.03Å; E364-N366 VanDerWaalsContact C-N 3.35Å; E364-N366 PolarHBondContact O-N 3.49Å; E364-G368 WeakPolarHBondContact O-CA 3.38Å; E364-G368 PolarHBondContact O-N 3.29Å
365	R	81.7	Confident	81.4	Confident	131 Å²	131	79.6 Å²	79.6	49%	0.494	41%	0.408	S	S	.	.	H	α-helix	trans	-66	-32.9	179.8	-176.2	172.4	177.3	137.5	1.7	113.8	Y361 F362 A363	Y361-R365 VanDerWaalsContact O-CB 3.23Å; Y361-R365 WeakPolarHBondContact O-CB 3.37Å; Y361-R365 PolarHBondContact O-N 3.24Å; Y361-R365 VanDerWaalsContact O-N 3.09Å; Y361-R365 PolarHBondContact OH-NH1 3.42Å; F362-R365 PolarHBondContact O-N 3.41Å; A363-R365 VanDerWaalsContact C-N 3.34Å; A363-R365 PolarHBondContact O-N 3.31Å
366	N	76.9	Confident	81.3	Confident	81 Å²	81	76.8 Å²	76.8	43%	0.433	39%	0.392	S	S	.	.	H	α-helix	trans	-88.4	-27.2	-178.4	-76.8	-81.2	0	0	0	113.1	F309 F362 A363 E364	F309-N366 WeakPolarHBondContact CZ-O 3.12Å; F362-N366 WeakPolarHBondContact O-CB 3.28Å; F362-N366 PolarHBondContact O-N 3.49Å; F362-N366 PolarHBondContact O-ND2 3.18Å; A363-N366 PolarHBondContact O-N 3.16Å; E364-N366 VanDerWaalsContact C-N 3.35Å; E364-N366 PolarHBondContact O-N 3.49Å
367	F	73.3	Confident	81.2	Confident	29 Å²	29	75 Å²	75	13%	0.127	38%	0.383	C	S	.	.	H	α-helix	trans	-118.5	-6.4	-172.9	-56.2	-61.7	0	0	0	115.6	M226 A227 K228 F306 F309 W347 A363	M226-F367 HydrophobicContact CE-CE1 3.64Å; M226-F367 HydrophobicContact CE-CE2 4.06Å; M226-F367 HydrophobicContact CE-CZ 3.29Å; A227-F367 HydrophobicContact CB-CB 4.33Å; K228-F367 PolarHBondContact NZ-O 2.72Å; F306-F367 HydrophobicContact CE2-CB 4.32Å; F306-F367 AromaticContact CE2-CD1 3.73Å; F306-F367 HydrophobicContact CE2-CD1 3.73Å; F306-F367 HydrophobicContact CE2-CG 4.32Å; F306-F367 HydrophobicContact CZ-CD1 4.41Å; F309-F367 AromaticContact CE1-CD1 3.81Å; F309-F367 HydrophobicContact CE1-CD1 3.81Å; F309-F367 AromaticContact CE1-CE1 3.91Å; F309-F367 HydrophobicContact CE1-CE1 3.91Å; F309-F367 HydrophobicContact CZ-CD1 4.45Å; W347-F367 AromaticContact CH2-CE2 3.67Å; W347-F367 HydrophobicContact CH2-CE2 3.67Å; W347-F367 HydrophobicContact CH2-CZ 4.4Å; W347-F367 HydrophobicContact CZ2-CD2 4.46Å; W347-F367 AromaticContact CZ2-CE2 3.49Å; W347-F367 HydrophobicContact CZ2-CE2 3.49Å; W347-F367 VanDerWaalsContact CZ2-CE2 3.49Å; W347-F367 HydrophobicContact CZ2-CZ 4.24Å; W347-F367 HydrophobicContact CZ3-CE2 4.42Å; A363-F367 VanDerWaalsContact O-CD2 3.24Å; A363-F367 WeakPolarHBondContact O-CD2 3.23Å; A363-F367 PolarHBondContact O-N 3.04Å
368	G	63.6	Low	80.8	Confident	37 Å²	37	76.5 Å²	76.5	38%	0.381	39%	0.386	S	S	.	.	S	Bend	trans	-126.3	11.4	-176	0	0	0	0	0	115.7	E364 D370	E364-G368 WeakPolarHBondContact O-CA 3.38Å; E364-G368 PolarHBondContact O-N 3.29Å; G368-D370 VanDerWaalsContact C-N 3.31Å; G368-D370 PolarHBondContact O-N 3.18Å; G368-D370 VanDerWaalsContact O-N 3.15Å
369	K	59.7	Low	79.9	Confident	139 Å²	139	78.1 Å²	78.1	60%	0.604	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.3	-161.2	-146.2	-177.4	173.6	-161.6	0	116.7
370	D	64.1	Low	78.6	Confident	154 Å²	154	83 Å²	83	82%	0.824	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	27.3	-172.5	-62.4	-60.8	0	0	0	113.3	G368	G368-D370 VanDerWaalsContact C-N 3.31Å; G368-D370 PolarHBondContact O-N 3.18Å; G368-D370 VanDerWaalsContact O-N 3.15Å
371	E	68.9	Low	77	Confident	47 Å²	47	85 Å²	85	22%	0.22	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-97.5	147.1	-177.1	-76.7	-176.8	167.4	0	0	113.7	K228	K228-E371 WeakPolarHBondContact CE-OE1 3.33Å; K228-E371 VanDerWaalsContact CE-OE2 3.25Å; K228-E371 WeakPolarHBondContact CE-OE2 3.45Å; K228-E371 IonicContact NZ-OE1 2.57Å; K228-E371 PolarHBondContact NZ-OE1 3.15Å; K228-E371 IonicContact NZ-OE2 2.68Å; K228-E371 PolarHBondContact NZ-OE2 2.89Å
372	P	78.9	Confident	75.2	Confident	55 Å²	55	85.1 Å²	85.1	36%	0.357	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-56.5	153.3	167.1	27.1	-34.2	0	0	0	109.5	Y299 S302	Y299-P372 HydrophobicContact CD2-CG 4.16Å; Y299-P372 WeakPolarHBondContact CD2-O 3.46Å; Y299-P372 WeakPolarHBondContact CE2-O 3.18Å; S302-P372 WeakPolarHBondContact OG-CD 3.4Å; S302-P372 VanDerWaalsContact OG-CG 3.31Å; S302-P372 WeakPolarHBondContact OG-CG 3.32Å
373	M	86.1	Confident	73.4	Confident	119 Å²	119	90 Å²	90	59%	0.586	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-80.3	149.3	169.4	-69.6	-65.3	-65.9	0	0	109.6	R375 L377	M373-R375 PolarHBondContact O-N 2.83Å; M373-L377 HydrophobicContact CE-CB 4.12Å; M373-L377 HydrophobicContact CE-CD1 3.72Å
374	P	90.1	Very high	71.5	Confident	20 Å²	20	98.4 Å²	98.4	13%	0.13	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-47.6	139	166.2	-28.8	35.7	0	0	0	111.4	Y295 Y299 A376 L377 S378	Y295-P374 HydrophobicContact CD1-CB 4.1Å; Y295-P374 HydrophobicContact CD1-CG 4.04Å; Y295-P374 HydrophobicContact CE1-CG 4.25Å; Y299-P374 HydrophobicContact CD2-CG 4.15Å; Y299-P374 HydrophobicContact CE1-CG 4.4Å; Y299-P374 HydrophobicContact CE2-CG 3.91Å; P374-A376 VanDerWaalsContact C-N 3.29Å; P374-A376 PolarHBondContact O-N 2.9Å; P374-L377 HydrophobicContact CB-CD1 4.3Å; P374-L377 HydrophobicContact CB-CG 4.34Å; P374-L377 HydrophobicContact CG-CD1 4.15Å; P374-L377 WeakPolarHBondContact O-CB 3.31Å; P374-L377 PolarHBondContact O-N 3.36Å; P374-S378 PolarHBondContact O-N 2.94Å
375	R	90.2	Very high	69.6	Low	108 Å²	108	101.4 Å²	101.4	41%	0.408	50%	0.498	S	S	.	.	H	α-helix	trans	-54	-41.9	-175	-176.3	-177.8	-68.3	162.1	-4.7	113.1	E293 D294 Y295 M373 L377 S378 M379	E293-R375 WeakPolarHBondContact O-CD 3.32Å; D294-R375 CarbonylContact O-C 3.48Å; D294-R375 PolarHBondContact O-N 3Å; Y295-R375 PolarHBondContact O-N 3.01Å; M373-R375 PolarHBondContact O-N 2.83Å; R375-L377 PolarHBondContact O-N 2.92Å; R375-S378 PolarHBondContact O-N 3.39Å; R375-S378 PolarHBondContact O-OG 3.33Å; R375-M379 WeakPolarHBondContact O-CG 3.41Å; R375-M379 PolarHBondContact O-N 3.03Å
376	A	90.4	Very high	67.9	Low	24 Å²	24	99.2 Å²	99.2	20%	0.198	51%	0.507	C	S	.	.	H	α-helix	trans	-58.2	-32.2	177.5	0	0	0	0	0	112.5	D294 P374 Y382	D294-A376 HydrophobicContact CB-CB 4.29Å; D294-A376 WeakPolarHBondContact O-CB 3.35Å; D294-A376 PolarHBondContact O-N 3.41Å; P374-A376 VanDerWaalsContact C-N 3.29Å; P374-A376 PolarHBondContact O-N 2.9Å; A376-Y382 VanDerWaalsContact O-CB 3.3Å; A376-Y382 WeakPolarHBondContact O-CB 3.41Å
377	L	87.8	Confident	66.2	Low	80 Å²	80	104.1 Å²	104.1	42%	0.419	54%	0.54	S	S	.	.	H	α-helix	trans	-86.4	-20.5	-178.8	-59.6	-178.4	0	0	0	113.5	M373 P374 R375 Y382	M373-L377 HydrophobicContact CE-CB 4.12Å; M373-L377 HydrophobicContact CE-CD1 3.72Å; P374-L377 HydrophobicContact CB-CD1 4.3Å; P374-L377 HydrophobicContact CB-CG 4.34Å; P374-L377 HydrophobicContact CG-CD1 4.15Å; P374-L377 WeakPolarHBondContact O-CB 3.31Å; P374-L377 PolarHBondContact O-N 3.36Å; R375-L377 PolarHBondContact O-N 2.92Å; L377-Y382 HydrophobicContact CD2-CD1 3.72Å; L377-Y382 HydrophobicContact CD2-CE1 3.31Å; L377-Y382 HydrophobicContact CD2-CE2 4.34Å; L377-Y382 HydrophobicContact CD2-CG 4.38Å
378	S	79.6	Confident	65.8	Low	81 Å²	81	107.9 Å²	107.9	57%	0.566	56%	0.561	S	S	*	*	H	α-helix	trans	-86.2	-10.8	176.1	61.9	0	0	0	0	113.3	P374 R375	P374-S378 PolarHBondContact O-N 2.94Å; R375-S378 PolarHBondContact O-N 3.39Å; R375-S378 PolarHBondContact O-OG 3.33Å
379	M	70.8	Confident	66	Low	113 Å²	113	111.6 Å²	111.6	56%	0.557	57%	0.571	S	S	*	*	S	Bend	trans	-74.1	131.5	179.1	-74.3	-95.2	-94	0	0	112.6	R375 N381 Y382	R375-M379 WeakPolarHBondContact O-CG 3.41Å; R375-M379 PolarHBondContact O-N 3.03Å; M379-N381 PolarHBondContact O-N 3.12Å; M379-Y382 PolarHBondContact O-N 3.04Å
380	P	60.5	Low	66.3	Low	109 Å²	109	110.1 Å²	110.1	71%	0.708	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-24.1	-177.1	-23.8	30.4	0	0	0	115.3
381	N	54.9	Low	66.4	Low	108 Å²	108	107.5 Å²	107.5	58%	0.578	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-12.2	-174.7	-73.5	-24.4	0	0	0	114.4	M379 R384	M379-N381 PolarHBondContact O-N 3.12Å; N381-R384 PolarHBondContact O-N 3.32Å
382	Y	48.8	Very low	66.3	Low	128 Å²	128	111.3 Å²	111.3	50%	0.502	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-68.6	-35.9	179.8	-169.1	-96.2	0	0	0	112	A376 L377 M379 R384 K385	A376-Y382 VanDerWaalsContact O-CB 3.3Å; A376-Y382 WeakPolarHBondContact O-CB 3.41Å; L377-Y382 HydrophobicContact CD2-CD1 3.72Å; L377-Y382 HydrophobicContact CD2-CE1 3.31Å; L377-Y382 HydrophobicContact CD2-CE2 4.34Å; L377-Y382 HydrophobicContact CD2-CG 4.38Å; M379-Y382 PolarHBondContact O-N 3.04Å; Y382-R384 PolarHBondContact O-N 2.95Å; Y382-K385 PolarHBondContact O-N 2.99Å
383	K	47.3	Very low	65.4	Low	180 Å²	180	115.1 Å²	115.1	78%	0.783	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-62.1	-13.7	175.9	-71	-172	177.9	-179	0	114.4
384	R	44.4	Very low	64	Low	190 Å²	190	114.8 Å²	114.8	72%	0.717	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-93.3	-12.6	-179.6	-99.7	-173.3	-104.6	-176.6	-4.9	114.8	N381 Y382	N381-R384 PolarHBondContact O-N 3.32Å; Y382-R384 PolarHBondContact O-N 2.95Å
385	K	43.1	Very low	61.9	Low	197 Å²	197	122.1 Å²	122.1	86%	0.857	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-7.3	179.2	-79.6	-172.4	175.9	-178.3	0	114.2	Y382	Y382-K385 PolarHBondContact O-N 2.99Å
386	A	47	Very low	59.6	Low	84 Å²	84	123.3 Å²	123.3	69%	0.694	64%	0.643	S	S	*	*			trans	-105.8	10.9	-176.5	0	0	0	0	0	114.2
387	T	40.4	Very low	56.8	Low	185 Å²	185	132.3 Å²	132.3	100%	1.135	68%	0.683	S	S	*	*			trans	-95.9	0	171.8	48.9	0	0	0	0	111.7

Retrieved 387 of 387 residues in 301.4 ms (Link to these results)

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