A0A077Z0Y5_TRITR Loading...

Histone acetyltransferase

AlphaFold DB , UniProt , Accession A0A077Z0Y5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 520 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	L	82.4	Confident	79.1	Confident	27 Å²	27	50.5 Å²	50.5	14%	0.141	26%	0.261	C	S	.	.				0	-91.9	0	-164.9	72	0	0	0	112.6	R3 T4 F8 V13 W16 N88 F92	L1-R3 PolarHBondContact O-N 3.5Å; L1-T4 PolarHBondContact O-N 3.44Å; L1-T4 VanDerWaalsContact O-N 3.12Å; L1-T4 PolarHBondContact O-OG1 3.03Å; L1-F8 HydrophobicContact CD1-CB 4.07Å; L1-F8 HydrophobicContact CD1-CD1 3.73Å; L1-F8 HydrophobicContact CD1-CD2 3.4Å; L1-F8 HydrophobicContact CD1-CE1 3.95Å; L1-F8 HydrophobicContact CD1-CE2 3.62Å; L1-F8 HydrophobicContact CD1-CG 3.45Å; L1-F8 VanDerWaalsContact CD1-CG 3.45Å; L1-F8 HydrophobicContact CD1-CZ 3.9Å; L1-F8 HydrophobicContact CG-CD2 4.5Å; L1-V13 HydrophobicContact CD1-CG2 4.03Å; L1-V13 HydrophobicContact CD2-CG1 3.78Å; L1-V13 HydrophobicContact CD2-CG2 4.33Å; L1-W16 HydrophobicContact CB-CD2 4.34Å; L1-W16 HydrophobicContact CB-CG 4.48Å; L1-N88 HydrophobicContact CG-CB 4.41Å; L1-F92 HydrophobicContact CD2-CB 4.13Å; L1-F92 HydrophobicContact CD2-CD2 4.05Å; L1-F92 HydrophobicContact CD2-CG 4.49Å
2	L	85.9	Confident	78.5	Confident	15 Å²	15	48.1 Å²	48.1	8%	0.079	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.3	-168.1	-63.2	179	0	0	0	115.6	F85 N88 L89 W125 P127	L2-F85 HydrophobicContact CB-CD2 4.44Å; L2-F85 HydrophobicContact CB-CE2 3.92Å; L2-F85 HydrophobicContact CD2-CE2 4.44Å; L2-F85 WeakPolarHBondContact O-CD2 3.33Å; L2-N88 HydrophobicContact CD2-CB 4.08Å; L2-L89 HydrophobicContact CD1-CD1 4.19Å; L2-L89 HydrophobicContact CD2-CB 4.07Å; L2-L89 HydrophobicContact CD2-CD1 4.39Å; L2-W125 HydrophobicContact CB-CH2 4.24Å; L2-P127 HydrophobicContact CD1-CB 3.92Å; L2-P127 HydrophobicContact CD1-CG 4.19Å
3	R	87.2	Confident	77.9	Confident	39 Å²	39	44.4 Å²	44.4	15%	0.147	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.5	-177.8	-62.8	-154.6	-162.5	144.9	8	115.9	L1 G5 F57 K123 W125	L1-R3 PolarHBondContact O-N 3.5Å; R3-G5 VanDerWaalsContact C-N 3.28Å; R3-G5 PolarHBondContact O-N 3.12Å; R3-F57 WeakPolarHBondContact O-CA 3.15Å; R3-F57 WeakPolarHBondContact O-CB 2.87Å; R3-F57 PolarHBondContact O-N 3.49Å; R3-K123 VanDerWaalsContact NH1-CA 3.3Å; R3-W125 HydrophobicContact CG-CH2 4.06Å; R3-W125 HydrophobicContact CG-CZ2 3.48Å; R3-W125 VanDerWaalsContact CG-CZ2 3.48Å; R3-W125 PolarHBondContact NE-O 3.09Å; R3-W125 PolarHBondContact NH2-O 2.95Å
4	T	82	Confident	77.2	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.055	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-31	-172.9	62.8	0	0	0	0	110.6	L1 N6 F8	L1-T4 PolarHBondContact O-N 3.44Å; L1-T4 VanDerWaalsContact O-N 3.12Å; L1-T4 PolarHBondContact O-OG1 3.03Å; T4-N6 PolarHBondContact O-N 3.27Å; T4-N6 PolarHBondContact O-OD1 3.37Å; T4-N6 PolarHBondContact OG1-N 2.64Å; T4-F8 HydrophobicContact CG2-CZ 4.34Å; T4-F8 VanDerWaalsContact OG1-CE2 3.22Å; T4-F8 WeakPolarHBondContact OG1-CE2 3.28Å
5	G	78	Confident	76.6	Confident	9 Å²	9	56.7 Å²	56.7	9%	0.093	28%	0.28	C	S	.	.			trans	73.2	-3.4	-172	0	0	0	0	0	114.1	R3 F57 N84	R3-G5 VanDerWaalsContact C-N 3.28Å; R3-G5 PolarHBondContact O-N 3.12Å; G5-F57 VanDerWaalsContact CA-CE2 3.5Å; G5-N84 VanDerWaalsContact O-CB 3.24Å; G5-N84 WeakPolarHBondContact O-CB 3.17Å; G5-N84 PolarHBondContact O-ND2 3.2Å
6	N	81.7	Confident	75.9	Confident	85 Å²	85	60.9 Å²	60.9	46%	0.455	29%	0.292	S	S	.	.			trans	-76.5	155.3	178.7	-58.7	-5.3	0	0	0	110.8	T4 F8 N88	T4-N6 PolarHBondContact O-N 3.27Å; T4-N6 PolarHBondContact O-OD1 3.37Å; T4-N6 PolarHBondContact OG1-N 2.64Å; N6-F8 HydrophobicContact CB-CE2 4.17Å; N6-F8 VanDerWaalsContact O-CD2 3.27Å; N6-F8 WeakPolarHBondContact O-CD2 3.02Å; N6-F8 WeakPolarHBondContact O-CE2 3.32Å; N6-N88 PolarHBondContact O-ND2 3.02Å
7	Y	80	Confident	75.2	Confident	110 Å²	110	60.2 Å²	60.2	43%	0.431	29%	0.29	S	S	.	.			trans	-67.2	145	168.1	177	-90.8	0	0	0	111.3	E9 R87	Y7-E9 HydrophobicContact CE1-CG 3.74Å; Y7-R87 VanDerWaalsContact CE2-CZ 3.46Å; Y7-R87 PolarHBondContact OH-NH2 3.2Å
8	F	77.8	Confident	74	Confident	22 Å²	22	59.8 Å²	59.8	10%	0.096	29%	0.293	C	S	.	.			trans	-135.2	142.7	168.8	-65.6	-99.3	0	0	0	110.1	L1 T4 N6 V13 W16 N88 L91	L1-F8 HydrophobicContact CD1-CB 4.07Å; L1-F8 HydrophobicContact CD1-CD1 3.73Å; L1-F8 HydrophobicContact CD1-CD2 3.4Å; L1-F8 HydrophobicContact CD1-CE1 3.95Å; L1-F8 HydrophobicContact CD1-CE2 3.62Å; L1-F8 HydrophobicContact CD1-CG 3.45Å; L1-F8 VanDerWaalsContact CD1-CG 3.45Å; L1-F8 HydrophobicContact CD1-CZ 3.9Å; L1-F8 HydrophobicContact CG-CD2 4.5Å; T4-F8 HydrophobicContact CG2-CZ 4.34Å; T4-F8 VanDerWaalsContact OG1-CE2 3.22Å; T4-F8 WeakPolarHBondContact OG1-CE2 3.28Å; N6-F8 HydrophobicContact CB-CE2 4.17Å; N6-F8 VanDerWaalsContact O-CD2 3.27Å; N6-F8 WeakPolarHBondContact O-CD2 3.02Å; N6-F8 WeakPolarHBondContact O-CE2 3.32Å; F8-V13 HydrophobicContact CB-CG2 3.9Å; F8-W16 HydrophobicContact CE1-CZ2 4.34Å; F8-N88 WeakPolarHBondContact CD2-ND2 3.44Å; F8-N88 PolarHBondContact N-OD1 2.8Å; F8-L91 WeakPolarHBondContact O-CD1 3.47Å
9	E	75.6	Confident	72.8	Confident	134 Å²	134	61.3 Å²	61.3	63%	0.626	31%	0.307	S	S	*	.			trans	-79.5	160.7	166.4	-61.7	-175.9	166.8	0	0	111.1	Y7 G11 G12 V13	Y7-E9 HydrophobicContact CE1-CG 3.74Å; E9-G11 VanDerWaalsContact C-N 3.31Å; E9-G11 PolarHBondContact O-N 3.17Å; E9-G12 WeakPolarHBondContact O-CA 3.47Å; E9-G12 PolarHBondContact O-N 2.84Å; E9-V13 PolarHBondContact O-N 3.42Å
10	E	70.7	Confident	71.5	Confident	60 Å²	60	62 Å²	62	28%	0.28	32%	0.318	S	S	.	.	H	α-helix	trans	-55.7	-44.1	-177.9	-167.3	179.9	140.9	0	0	112.2	G12 V13 R14 L91 K94	E10-G12 VanDerWaalsContact C-N 3.27Å; E10-G12 PolarHBondContact O-N 2.75Å; E10-V13 PolarHBondContact O-N 3.47Å; E10-V13 VanDerWaalsContact O-N 3.1Å; E10-R14 PolarHBondContact O-N 3.43Å; E10-R14 VanDerWaalsContact O-N 3.09Å; E10-R14 IonicContact OE1-CZ 3.22Å; E10-R14 IonicContact OE1-NE 3.64Å; E10-R14 IonicContact OE1-NH2 3.71Å; E10-R14 PolarHBondContact OE1-NH2 3.05Å; E10-L91 HydrophobicContact CB-CD2 4.21Å; E10-L91 HydrophobicContact CG-CD2 4.38Å; E10-K94 IonicContact OE2-NZ 2.91Å; E10-K94 PolarHBondContact OE2-NZ 3.41Å
11	G	68.9	Low	69.8	Low	45 Å²	45	64.2 Å²	64.2	46%	0.464	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-34.4	175.1	0	0	0	0	0	113	E9 V13 R14	E9-G11 VanDerWaalsContact C-N 3.31Å; E9-G11 PolarHBondContact O-N 3.17Å; G11-V13 VanDerWaalsContact C-N 3.34Å; G11-V13 PolarHBondContact O-N 3.37Å; G11-R14 PolarHBondContact O-N 2.96Å
12	G	71.2	Confident	67.9	Low	22 Å²	22	69.2 Å²	69.2	23%	0.227	35%	0.354	C	S	.	.	H	α-helix	trans	-66.8	-32.5	174.2	0	0	0	0	0	113.1	E9 E10 W16	E9-G12 WeakPolarHBondContact O-CA 3.47Å; E9-G12 PolarHBondContact O-N 2.84Å; E10-G12 VanDerWaalsContact C-N 3.27Å; E10-G12 PolarHBondContact O-N 2.75Å; G12-W16 PolarHBondContact O-NE1 2.87Å
13	V	71.1	Confident	65.7	Low	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-74.9	-39.7	176.4	-177.1	0	0	0	0	111.6	L1 F8 E9 E10 G11 K15 W16 L91 F92 L95	L1-V13 HydrophobicContact CD1-CG2 4.03Å; L1-V13 HydrophobicContact CD2-CG1 3.78Å; L1-V13 HydrophobicContact CD2-CG2 4.33Å; F8-V13 HydrophobicContact CB-CG2 3.9Å; E9-V13 PolarHBondContact O-N 3.42Å; E10-V13 PolarHBondContact O-N 3.47Å; E10-V13 VanDerWaalsContact O-N 3.1Å; G11-V13 VanDerWaalsContact C-N 3.34Å; G11-V13 PolarHBondContact O-N 3.37Å; V13-K15 PolarHBondContact O-N 2.87Å; V13-W16 WeakPolarHBondContact O-CB 3.49Å; V13-W16 PolarHBondContact O-N 3.29Å; V13-L91 HydrophobicContact CG2-CB 3.93Å; V13-L91 HydrophobicContact CG2-CD1 4.09Å; V13-F92 HydrophobicContact CG1-CB 4.21Å; V13-F92 HydrophobicContact CG1-CD2 4.29Å; V13-L95 HydrophobicContact CB-CD1 4.09Å; V13-L95 HydrophobicContact CG1-CD1 3.52Å
14	R	68.5	Low	63.2	Low	141 Å²	141	75.8 Å²	75.8	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-56.5	-35.7	179.3	-73.7	178.3	-175.7	-89	-2.2	113	E10 G11 W16 I17 L95	E10-R14 PolarHBondContact O-N 3.43Å; E10-R14 VanDerWaalsContact O-N 3.09Å; E10-R14 IonicContact OE1-CZ 3.22Å; E10-R14 IonicContact OE1-NE 3.64Å; E10-R14 IonicContact OE1-NH2 3.71Å; E10-R14 PolarHBondContact OE1-NH2 3.05Å; G11-R14 PolarHBondContact O-N 2.96Å; R14-W16 PolarHBondContact O-N 3.35Å; R14-I17 PolarHBondContact O-N 2.69Å; R14-L95 HydrophobicContact CG-CD1 3.97Å; R14-L95 HydrophobicContact CG-CD2 3.6Å; R14-L95 HydrophobicContact CG-CG 4.47Å
15	K	68.1	Low	60.8	Low	133 Å²	133	79.4 Å²	79.4	58%	0.578	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.6	174.9	-65.1	-179.8	-177.3	179.8	0	113.7	V13	V13-K15 PolarHBondContact O-N 2.87Å
16	W	64.8	Low	58.7	Low	123 Å²	123	83.1 Å²	83.1	47%	0.466	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.3	179	-60.5	82.8	0	0	0	114	L1 F8 G12 V13 R14	L1-W16 HydrophobicContact CB-CD2 4.34Å; L1-W16 HydrophobicContact CB-CG 4.48Å; F8-W16 HydrophobicContact CE1-CZ2 4.34Å; G12-W16 PolarHBondContact O-NE1 2.87Å; V13-W16 WeakPolarHBondContact O-CB 3.49Å; V13-W16 PolarHBondContact O-N 3.29Å; R14-W16 PolarHBondContact O-N 3.35Å
17	I	64.2	Low	56.3	Low	49 Å²	49	90.2 Å²	90.2	25%	0.251	47%	0.471	S	S	.	.	S	Bend	trans	-95.8	124.8	176.7	-58	-172.1	0	0	0	108.2	R14 F92 L95	R14-I17 PolarHBondContact O-N 2.69Å; I17-F92 HydrophobicContact CG1-CE2 4.4Å; I17-L95 HydrophobicContact CD1-CB 3.43Å; I17-L95 VanDerWaalsContact CD1-CB 3.43Å; I17-L95 HydrophobicContact CD1-CD1 3.4Å; I17-L95 HydrophobicContact CD1-CG 3.99Å; I17-L95 HydrophobicContact CG1-CD1 4.23Å
18	P	53.9	Low	54.1	Low	54 Å²	54	94.7 Å²	94.7	35%	0.351	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-54.9	140.8	172.6	-20.1	29.4	0	0	0	110.1	S20 Q22 F23	P18-S20 PolarHBondContact O-N 2.8Å; P18-Q22 HydrophobicContact CB-CB 4.34Å; P18-F23 HydrophobicContact CB-CE2 3.97Å; P18-F23 HydrophobicContact CG-CE2 3.94Å; P18-F23 HydrophobicContact CG-CZ 4.17Å
19	P	50.5	Low	51.8	Low	87 Å²	87	104.5 Å²	104.5	57%	0.565	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-53	136.5	174.1	19.9	-29.1	0	0	0	109.6	N21 Q22	P19-N21 PolarHBondContact O-N 3.2Å; P19-Q22 HydrophobicContact CG-CG 4.43Å; P19-Q22 PolarHBondContact O-N 3.45Å
20	S	46.8	Very low	49.7	Very low	75 Å²	75	100.9 Å²	100.9	52%	0.524	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-49	-28.8	-170.6	49	0	0	0	0	114.3	P18 Q22 F23	P18-S20 PolarHBondContact O-N 2.8Å; S20-Q22 PolarHBondContact O-N 3Å; S20-Q22 VanDerWaalsContact O-N 3.13Å; S20-F23 PolarHBondContact O-N 3.48Å
21	N	37.6	Very low	47.8	Very low	110 Å²	110	106.5 Å²	106.5	59%	0.588	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-63.8	-11.8	176.4	-66	-5.4	0	0	0	114.9	P19	P19-N21 PolarHBondContact O-N 3.2Å
22	Q	41.6	Very low	46.2	Very low	132 Å²	132	113 Å²	113	62%	0.617	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-92	-9.6	176.5	-68.6	-169.4	-1.1	0	0	114.2	P18 P19 S20	P18-Q22 HydrophobicContact CB-CB 4.34Å; P19-Q22 HydrophobicContact CG-CG 4.43Å; P19-Q22 PolarHBondContact O-N 3.45Å; S20-Q22 PolarHBondContact O-N 3Å; S20-Q22 VanDerWaalsContact O-N 3.13Å
23	F	39.5	Very low	44.2	Very low	103 Å²	103	121.8 Å²	121.8	45%	0.452	62%	0.616	S	S	.	*	S	Bend	trans	-83.3	-12.1	179.6	-82	-84.3	0	0	0	113.7	P18 S20 P155	P18-F23 HydrophobicContact CB-CE2 3.97Å; P18-F23 HydrophobicContact CG-CE2 3.94Å; P18-F23 HydrophobicContact CG-CZ 4.17Å; S20-F23 PolarHBondContact O-N 3.48Å; F23-P155 HydrophobicContact CE1-CB 3.87Å; F23-P155 HydrophobicContact CE1-CG 4.5Å
24	N	34.9	Very low	42.4	Very low	88 Å²	88	129.7 Å²	129.7	47%	0.471	66%	0.658	S	S	.	*	S	Bend	trans	-112.1	9.7	-173.1	-88.3	8	0	0	0	116.4
25	S	32	Very low	40.6	Very low	86 Å²	86	131.5 Å²	131.5	60%	0.601	67%	0.673	S	S	*	*			trans	-120.7	68.1	-177.8	56.3	0	0	0	0	113.9	R27	S25-R27 PolarHBondContact O-N 3.41Å
26	G	33.9	Very low	38.7	Very low	87 Å²	87	134.5 Å²	134.5	90%	0.897	69%	0.686	S	S	*	*	S	Bend	trans	-72.1	5.6	162.6	0	0	0	0	0	114.7
27	R	30.1	Very low	37.2	Very low	233 Å²	233	136.9 Å²	136.9	88%	0.879	70%	0.702	S	S	*	*	S	Bend	trans	-146.5	106.5	177.4	-84	-175.8	-179	175.2	-0.2	111.3	S25	S25-R27 PolarHBondContact O-N 3.41Å
28	K	33.6	Very low	35.5	Very low	204 Å²	204	143.6 Å²	143.6	89%	0.887	73%	0.732	S	S	*	*			trans	143.7	104.1	144.5	-80.7	-178.2	178.7	-176.3	0	109.7	G30	K28-G30 PolarHBondContact O-N 2.99Å; K28-G30 VanDerWaalsContact O-N 3.11Å
29	K	30	Very low	34.4	Very low	229 Å²	229	145.6 Å²	145.6	100%	0.996	75%	0.746	S	S	*	*			trans	-61.7	104.8	158.5	-76.1	179.8	174.7	178.9	0	106.6
30	G	32.3	Very low	33.4	Very low	58 Å²	58	146.5 Å²	146.5	60%	0.598	76%	0.755	S	S	*	*			trans	-147.1	121.4	174.1	0	0	0	0	0	108.3	K28 Q32	K28-G30 PolarHBondContact O-N 2.99Å; K28-G30 VanDerWaalsContact O-N 3.11Å; G30-Q32 PolarHBondContact O-N 2.73Å
31	N	29.7	Very low	32.7	Very low	177 Å²	177	147.8 Å²	147.8	95%	0.947	76%	0.764	S	S	*	*			trans	-46.5	105	177.7	-84.3	-21.9	0	0	0	111.3
32	Q	35	Very low	32.5	Very low	182 Å²	182	148 Å²	148	85%	0.85	77%	0.769	S	S	*	*			trans	-119.5	111.7	161.6	-77.4	-172.1	7.9	0	0	108.5	G30 L34	G30-Q32 PolarHBondContact O-N 2.73Å; Q32-L34 PolarHBondContact O-N 2.99Å
33	K	30.3	Very low	32.2	Very low	206 Å²	206	147.9 Å²	147.9	90%	0.896	78%	0.783	S	S	*	*			trans	-46.2	121.6	168.5	-82.9	173.7	171.2	175.8	0	108.8	Q35	K33-Q35 PolarHBondContact O-N 3.07Å
34	L	32.7	Very low	32	Very low	167 Å²	167	146.8 Å²	146.8	87%	0.874	79%	0.788	S	S	*	*			trans	-57	102.6	167.3	-120.4	80.3	0	0	0	108.2	Q32 K36	Q32-L34 PolarHBondContact O-N 2.99Å; L34-K36 PolarHBondContact O-N 3.46Å
35	Q	30.1	Very low	31.9	Very low	179 Å²	179	150.5 Å²	150.5	84%	0.836	80%	0.802	S	S	*	*			trans	-67.6	102.7	163.1	-102.5	178.7	-13.4	0	0	107.4	K33 Q37	K33-Q35 PolarHBondContact O-N 3.07Å; Q35-Q37 PolarHBondContact O-N 3.34Å
36	K	30.2	Very low	32.2	Very low	196 Å²	196	152 Å²	152	85%	0.852	81%	0.81	S	S	*	*			trans	-64.4	94.2	165.4	-76	177.5	176.1	176.7	0	107.8	L34 Q38	L34-K36 PolarHBondContact O-N 3.46Å; K36-Q38 PolarHBondContact O-N 2.97Å
37	Q	32.9	Very low	32.9	Very low	173 Å²	173	152.3 Å²	152.3	81%	0.808	78%	0.784	S	S	*	*			trans	-74.7	113.3	160.3	-86.2	-176.4	-13.9	0	0	108.3	Q35 C39	Q35-Q37 PolarHBondContact O-N 3.34Å; Q37-C39 PolarHBondContact O-N 3.28Å
38	Q	28.4	Very low	33.3	Very low	190 Å²	190	144.7 Å²	144.7	89%	0.888	76%	0.764	S	S	*	*			trans	-64.7	109.1	167.2	-76.6	170.5	-37.6	0	0	108.6	K36	K36-Q38 PolarHBondContact O-N 2.97Å
39	C	31	Very low	33.9	Very low	95 Å²	95	139.1 Å²	139.1	64%	0.642	75%	0.751	S	S	*	*			trans	-92.4	98.3	158.1	-76.8	0	0	0	0	107.9	Q37	Q37-C39 PolarHBondContact O-N 3.28Å
40	S	28.2	Very low	34.5	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	73%	0.729	S	S	*	*			trans	-68	143.2	165.3	42.2	0	0	0	0	110.8
41	S	33.2	Very low	35.3	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	72%	0.72	S	S	*	*	S	Bend	trans	84.1	116.1	172.7	75.4	0	0	0	0	118.3
42	T	32.6	Very low	36.6	Very low	116 Å²	116	127.3 Å²	127.3	71%	0.712	69%	0.693	S	S	*	*	S	Bend	trans	80.9	88.6	168.2	67.9	0	0	0	0	119.3
43	S	34.6	Very low	37.6	Very low	128 Å²	128	122 Å²	122	90%	0.895	68%	0.681	S	S	*	*			trans	54.6	70.8	164.9	78.9	0	0	0	0	117.4
44	S	35.8	Very low	39.5	Very low	81 Å²	81	115.6 Å²	115.6	57%	0.566	67%	0.673	S	S	*	*			trans	-126.2	62.5	172.5	46.2	0	0	0	0	111.2
45	Q	34.2	Very low	41.6	Very low	165 Å²	165	108.3 Å²	108.3	77%	0.771	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-88.1	138.1	156.1	-70.3	-138.2	-20.5	0	0	109.4	R47	Q45-R47 PolarHBondContact O-N 3.04Å
46	P	38.2	Very low	44.3	Very low	118 Å²	118	107.2 Å²	107.2	77%	0.766	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-57.8	116	168.7	24.8	-30.8	0	0	0	107.4	T48	P46-T48 PolarHBondContact O-N 3.44Å
47	R	47.3	Very low	47.1	Very low	94 Å²	94	98.9 Å²	98.9	36%	0.355	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-51.5	119.3	-177.1	-77.2	-171.1	-167.2	-139.8	-0.3	110.1	Q45 D51	Q45-R47 PolarHBondContact O-N 3.04Å; R47-D51 WeakPolarHBondContact CA-OD2 3.31Å; R47-D51 HydrophobicContact CB-CB 3.78Å; R47-D51 WeakPolarHBondContact CB-OD2 3.27Å; R47-D51 HydrophobicContact CG-CB 3.98Å; R47-D51 WeakPolarHBondContact CG-OD2 3.18Å
48	T	39.9	Very low	49.7	Very low	72 Å²	72	95.6 Å²	95.6	44%	0.442	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-66.3	166.1	178.8	60.7	0	0	0	0	109.4	P46 A50 D51	P46-T48 PolarHBondContact O-N 3.44Å; T48-A50 PolarHBondContact O-N 3.23Å; T48-A50 VanDerWaalsContact O-N 3.09Å; T48-D51 PolarHBondContact N-OD2 2.84Å; T48-D51 PolarHBondContact O-N 3.17Å; T48-D51 VanDerWaalsContact O-N 3.12Å
49	S	45.9	Very low	52.6	Low	88 Å²	88	89.4 Å²	89.4	62%	0.615	55%	0.545	S	S	*	.	H	α-helix	trans	-53.8	-27	173.1	45.5	0	0	0	0	112.8	L52 A53	S49-L52 PolarHBondContact O-N 2.92Å; S49-A53 PolarHBondContact O-N 3.34Å
50	A	42.3	Very low	55.6	Low	66 Å²	66	86.8 Å²	86.8	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-40.4	177	0	0	0	0	0	113	T48 L52 A53	T48-A50 PolarHBondContact O-N 3.23Å; T48-A50 VanDerWaalsContact O-N 3.09Å; A50-L52 PolarHBondContact O-N 2.98Å; A50-L52 VanDerWaalsContact O-N 3.15Å; A50-A53 WeakPolarHBondContact O-CB 3.39Å; A50-A53 PolarHBondContact O-N 2.07Å
51	D	49.8	Very low	58.7	Low	77 Å²	77	82 Å²	82	41%	0.412	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-21.5	177.8	-68.5	-35.7	0	0	0	113.3	R47 T48	R47-D51 WeakPolarHBondContact CA-OD2 3.31Å; R47-D51 HydrophobicContact CB-CB 3.78Å; R47-D51 WeakPolarHBondContact CB-OD2 3.27Å; R47-D51 HydrophobicContact CG-CB 3.98Å; R47-D51 WeakPolarHBondContact CG-OD2 3.18Å; T48-D51 PolarHBondContact N-OD2 2.84Å; T48-D51 PolarHBondContact O-N 3.17Å; T48-D51 VanDerWaalsContact O-N 3.12Å
52	L	55.1	Low	61.6	Low	73 Å²	73	77.6 Å²	77.6	38%	0.382	46%	0.463	S	S	.	.	H	α-helix	trans	-84.4	-22.8	175.8	-70.6	166.2	0	0	0	112.4	S49 A50	S49-L52 PolarHBondContact O-N 2.92Å; A50-L52 PolarHBondContact O-N 2.98Å; A50-L52 VanDerWaalsContact O-N 3.15Å
53	A	57.8	Low	64.6	Low	71 Å²	71	74.2 Å²	74.2	59%	0.587	45%	0.451	S	S	*	.	H	α-helix	trans	-69.6	-35.6	177.3	0	0	0	0	0	111.6	S49 A50 C55	S49-A53 PolarHBondContact O-N 3.34Å; A50-A53 WeakPolarHBondContact O-CB 3.39Å; A50-A53 PolarHBondContact O-N 2.07Å; A53-C55 VanDerWaalsContact C-N 3.29Å; A53-C55 PolarHBondContact O-N 3.36Å
54	G	70.2	Confident	67.5	Low	70 Å²	70	72.3 Å²	72.3	72%	0.722	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	10.4	177.3	0	0	0	0	0	115.9	K56	G54-K56 PolarHBondContact O-N 2.91Å; G54-K56 VanDerWaalsContact O-N 3.16Å
55	C	76.4	Confident	70.4	Confident	15 Å²	15	70.9 Å²	70.9	10%	0.101	42%	0.416	C	S	.	.			trans	-70.8	110.7	-178.6	-80.3	0	0	0	0	111.8	A53 F57 R58	A53-C55 VanDerWaalsContact C-N 3.29Å; A53-C55 PolarHBondContact O-N 3.36Å; C55-F57 PolarHBondContact O-N 3.45Å; C55-F57 VanDerWaalsContact O-N 3.11Å; C55-R58 HydrophobicContact CB-CB 4Å; C55-R58 VanDerWaalsContact O-CB 3.32Å; C55-R58 WeakPolarHBondContact O-CB 3.4Å; C55-R58 PolarHBondContact O-N 2.68Å
56	K	85.8	Confident	73.4	Confident	155 Å²	155	63 Å²	63	67%	0.674	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-38.7	179	-174.7	176	179.1	173.8	0	113.9	G54	G54-K56 PolarHBondContact O-N 2.91Å; G54-K56 VanDerWaalsContact O-N 3.16Å
57	F	89.6	Confident	76.2	Confident	21 Å²	21	57.4 Å²	57.4	9%	0.092	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	35.5	-176.8	-52.7	-54.5	0	0	0	111.7	R3 G5 C55 D59 S60 P62 F85 W125	R3-F57 WeakPolarHBondContact O-CA 3.15Å; R3-F57 WeakPolarHBondContact O-CB 2.87Å; R3-F57 PolarHBondContact O-N 3.49Å; G5-F57 VanDerWaalsContact CA-CE2 3.5Å; C55-F57 PolarHBondContact O-N 3.45Å; C55-F57 VanDerWaalsContact O-N 3.11Å; F57-D59 VanDerWaalsContact C-N 3.3Å; F57-D59 PolarHBondContact O-N 2.95Å; F57-S60 CarbonylContact C-O 3.58Å; F57-S60 WeakPolarHBondContact CA-O 3.31Å; F57-S60 WeakPolarHBondContact CB-O 3.49Å; F57-P62 HydrophobicContact CD1-CB 4.14Å; F57-P62 HydrophobicContact CD1-CG 4.33Å; F57-P62 HydrophobicContact CD2-CG 4.46Å; F57-P62 HydrophobicContact CE1-CB 3.59Å; F57-P62 HydrophobicContact CE1-CG 4.01Å; F57-P62 HydrophobicContact CE2-CG 4.14Å; F57-P62 HydrophobicContact CZ-CB 3.79Å; F57-P62 HydrophobicContact CZ-CG 3.9Å; F57-F85 HydrophobicContact CD2-CD2 4.04Å; F57-F85 HydrophobicContact CE2-CB 4.09Å; F57-F85 HydrophobicContact CE2-CD2 4.25Å; F57-W125 PolarHBondContact O-NE1 2.95Å
58	R	87.2	Confident	78.6	Confident	105 Å²	105	58.3 Å²	58.3	40%	0.396	35%	0.349	S	S	.	.	S	Bend	trans	-57.8	-45.3	179.9	-169.9	-175.8	79.1	171.6	-2.7	111.8	C55 W125	C55-R58 HydrophobicContact CB-CB 4Å; C55-R58 VanDerWaalsContact O-CB 3.32Å; C55-R58 WeakPolarHBondContact O-CB 3.4Å; C55-R58 PolarHBondContact O-N 2.68Å; R58-W125 PolarHBondContact O-NE1 3.21Å
59	D	89.9	Confident	81.3	Confident	59 Å²	59	56.6 Å²	56.6	32%	0.316	34%	0.336	S	S	.	.	S	Bend	trans	-95	-32.2	-166.3	-69.7	-0.5	0	0	0	113.1	F57 R117 K124	F57-D59 VanDerWaalsContact C-N 3.3Å; F57-D59 PolarHBondContact O-N 2.95Å; D59-R117 PolarHBondContact O-NH1 2.92Å; D59-K124 HydrophobicContact CB-CD 4.05Å; D59-K124 VanDerWaalsContact OD1-CD 3.25Å; D59-K124 WeakPolarHBondContact OD1-CD 3.32Å; D59-K124 WeakPolarHBondContact OD1-CE 3.23Å; D59-K124 IonicContact OD1-NZ 2.69Å; D59-K124 PolarHBondContact OD1-NZ 3.45Å; D59-K124 VanDerWaalsContact OD1-NZ 3.09Å; D59-K124 IonicContact OD2-NZ 3.59Å; D59-K124 PolarHBondContact OD2-NZ 3.23Å
60	S	92.5	Very high	83.6	Confident	40 Å²	40	60.4 Å²	60.4	28%	0.28	34%	0.344	S	S	.	.	S	Bend	trans	-151.7	156.1	174.5	-64.5	0	0	0	0	110.7	F57 Y75 R117	F57-S60 CarbonylContact C-O 3.58Å; F57-S60 WeakPolarHBondContact CA-O 3.31Å; F57-S60 WeakPolarHBondContact CB-O 3.49Å; S60-Y75 PolarHBondContact OG-OH 2.98Å; S60-R117 PolarHBondContact OG-NH1 3.45Å; S60-R117 PolarHBondContact OG-NH2 2.51Å
61	P	94.1	Very high	86.1	Confident	6 Å²	6	61.8 Å²	61.8	4%	0.039	34%	0.339	C	S	.	.			trans	-59	159.5	164.9	-17.4	30	0	0	0	111.7	Y75 F85 I115 W125	P61-Y75 HydrophobicContact CB-CD1 4.25Å; P61-Y75 HydrophobicContact CB-CD2 4.45Å; P61-Y75 HydrophobicContact CB-CG 4.14Å; P61-Y75 HydrophobicContact CG-CD2 3.99Å; P61-Y75 HydrophobicContact CG-CE2 4.16Å; P61-Y75 HydrophobicContact CG-CG 4.18Å; P61-F85 HydrophobicContact CB-CE2 4.45Å; P61-F85 HydrophobicContact CB-CZ 4.28Å; P61-I115 HydrophobicContact CG-CD1 4.14Å; P61-I115 HydrophobicContact CG-CG2 3.57Å; P61-W125 HydrophobicContact CB-CH2 4.35Å; P61-W125 HydrophobicContact CB-CZ2 4.34Å; P61-W125 HydrophobicContact CG-CD2 4.07Å; P61-W125 HydrophobicContact CG-CE3 4.03Å; P61-W125 HydrophobicContact CG-CH2 3.95Å; P61-W125 HydrophobicContact CG-CZ2 3.96Å; P61-W125 HydrophobicContact CG-CZ3 3.99Å
62	P	94.6	Very high	88.3	Confident	10 Å²	10	58.7 Å²	58.7	7%	0.065	32%	0.323	C	S	.	.	S	Bend	trans	-64.7	167.4	167	27.1	-31.2	0	0	0	111.8	F57 V77 S82 F85	F57-P62 HydrophobicContact CD1-CB 4.14Å; F57-P62 HydrophobicContact CD1-CG 4.33Å; F57-P62 HydrophobicContact CD2-CG 4.46Å; F57-P62 HydrophobicContact CE1-CB 3.59Å; F57-P62 HydrophobicContact CE1-CG 4.01Å; F57-P62 HydrophobicContact CE2-CG 4.14Å; F57-P62 HydrophobicContact CZ-CB 3.79Å; F57-P62 HydrophobicContact CZ-CG 3.9Å; P62-V77 HydrophobicContact CB-CG1 4.25Å; P62-V77 HydrophobicContact CG-CG1 3.83Å; P62-V77 VanDerWaalsContact O-CG2 3.29Å; P62-V77 WeakPolarHBondContact O-CG2 3.38Å; P62-S82 WeakPolarHBondContact CB-OG 3.18Å; P62-F85 VanDerWaalsContact CD-CD2 3.42Å; P62-F85 VanDerWaalsContact CD-CE2 3.49Å; P62-F85 HydrophobicContact CG-CB 3.77Å; P62-F85 HydrophobicContact CG-CD1 3.7Å; P62-F85 HydrophobicContact CG-CD2 3.6Å; P62-F85 HydrophobicContact CG-CE1 4.17Å; P62-F85 HydrophobicContact CG-CE2 4.06Å; P62-F85 HydrophobicContact CG-CG 3.4Å; P62-F85 HydrophobicContact CG-CZ 4.34Å
63	G	94.6	Very high	90.4	Very high	44 Å²	44	55.5 Å²	55.5	45%	0.454	31%	0.306	S	S	.	.	S	Bend	trans	91.6	-165.9	176.7	0	0	0	0	0	112.9	Q76	G63-Q76 VanDerWaalsContact CA-O 3.27Å; G63-Q76 WeakPolarHBondContact CA-O 3.38Å
64	I	95.6	Very high	92.3	Very high	88 Å²	88	52.1 Å²	52.1	45%	0.451	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.1	-174.5	56.8	179.5	0	0	0	110.7	V66 Y75 Q76 N282	I64-V66 HydrophobicContact CG1-CG1 4.35Å; I64-V66 PolarHBondContact O-N 2.84Å; I64-Y75 CarbonylContact O-C 3.59Å; I64-Y75 VanDerWaalsContact O-CA 3.3Å; I64-Y75 WeakPolarHBondContact O-CA 3.24Å; I64-Q76 HydrophobicContact CG1-CB 4.11Å; I64-Q76 PolarHBondContact N-O 3.48Å; I64-Q76 PolarHBondContact O-N 2.76Å; I64-N282 HydrophobicContact CD1-CB 4.33Å; I64-N282 WeakPolarHBondContact CD1-ND2 3.16Å
65	I	96.9	Very high	93.6	Very high	51 Å²	51	49.2 Å²	49.2	26%	0.262	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	127.5	175.6	-56.9	174.7	0	0	0	108.2	Y67 K68 Y75 I280	I65-Y67 WeakPolarHBondContact CG2-O 3.47Å; I65-K68 HydrophobicContact CG2-CB 4.15Å; I65-Y75 HydrophobicContact CD1-CE1 4.33Å; I65-Y75 HydrophobicContact CD1-CE2 4.48Å; I65-Y75 WeakPolarHBondContact CD1-OH 2.81Å; I65-Y75 HydrophobicContact CG1-CD1 4.15Å; I65-Y75 HydrophobicContact CG1-CD2 4.49Å; I65-Y75 HydrophobicContact CG1-CE1 3.54Å; I65-Y75 HydrophobicContact CG1-CE2 3.92Å; I65-Y75 VanDerWaalsContact CG1-CZ 3.4Å; I65-I280 HydrophobicContact CG2-CD1 4.11Å
66	V	97.4	Very high	94.5	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-9.2	177.1	-64.9	0	0	0	0	112.9	I64 I74 Q76 Y112 F169 V279 I280 M285	I64-V66 HydrophobicContact CG1-CG1 4.35Å; I64-V66 PolarHBondContact O-N 2.84Å; V66-I74 HydrophobicContact CG2-CB 4.09Å; V66-I74 HydrophobicContact CG2-CG2 3.8Å; V66-I74 WeakPolarHBondContact CG2-O 3.38Å; V66-I74 PolarHBondContact N-O 3.34Å; V66-Q76 HydrophobicContact CG1-CB 3.68Å; V66-Q76 HydrophobicContact CG2-CB 4.27Å; V66-Y112 HydrophobicContact CG2-CD1 4.09Å; V66-Y112 HydrophobicContact CG2-CE1 4.33Å; V66-F169 HydrophobicContact CB-CZ 4.05Å; V66-F169 HydrophobicContact CG2-CE1 3.92Å; V66-F169 HydrophobicContact CG2-CZ 3.56Å; V66-V279 WeakPolarHBondContact O-CG1 3.4Å; V66-I280 PolarHBondContact O-N 3.09Å; V66-M285 HydrophobicContact CB-SD 4.02Å; V66-M285 HydrophobicContact CG1-SD 3.94Å
67	Y	98.1	Very high	95	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	137.1	171.6	-178.1	-101.8	0	0	0	109.2	I65 E69 E73 I74 I274 K275 C278 V279	I65-Y67 WeakPolarHBondContact CG2-O 3.47Å; Y67-E69 HydrophobicContact CE1-CB 3.58Å; Y67-E69 VanDerWaalsContact OH-CD 3.3Å; Y67-E69 PolarHBondContact OH-OE2 2.83Å; Y67-E73 CarbonylContact O-C 3.48Å; Y67-E73 VanDerWaalsContact O-CA 3.26Å; Y67-E73 WeakPolarHBondContact O-CA 3.32Å; Y67-I74 HydrophobicContact CD1-CD1 4.15Å; Y67-I74 HydrophobicContact CD1-CG1 4.14Å; Y67-I74 HydrophobicContact CG-CD1 4.17Å; Y67-I74 HydrophobicContact CG-CG1 4.36Å; Y67-I74 PolarHBondContact N-O 2.84Å; Y67-I74 PolarHBondContact O-N 3.26Å; Y67-I274 HydrophobicContact CD1-CD1 4.35Å; Y67-I274 HydrophobicContact CD2-CD1 3.89Å; Y67-I274 HydrophobicContact CD2-CG2 4.25Å; Y67-I274 HydrophobicContact CE1-CD1 4.17Å; Y67-I274 HydrophobicContact CE2-CB 4.46Å; Y67-I274 HydrophobicContact CE2-CD1 3.66Å; Y67-I274 HydrophobicContact CE2-CG2 3.89Å; Y67-I274 HydrophobicContact CG-CD1 4.2Å; Y67-K275 PolarHBondContact OH-N 3.41Å; Y67-C278 WeakPolarHBondContact CA-O 3.38Å; Y67-C278 HydrophobicContact CD2-CB 4.01Å; Y67-C278 HydrophobicContact CE2-CB 3.54Å; Y67-V279 HydrophobicContact CD2-CG2 3.8Å; Y67-V279 HydrophobicContact CE2-CG2 4.28Å
68	K	97.4	Very high	95	Very high	114 Å²	114	42.6 Å²	42.6	50%	0.496	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	114.1	174.9	-177.8	171.1	-175.2	-174.6	0	110.6	I65 E73 C278	I65-K68 HydrophobicContact CG2-CB 4.15Å; K68-E73 HydrophobicContact CB-CG 4.32Å; K68-E73 HydrophobicContact CD-CG 4.42Å; K68-E73 WeakPolarHBondContact CE-OE1 3Å; K68-E73 HydrophobicContact CG-CG 3.95Å; K68-C278 PolarHBondContact N-O 2.79Å; K68-C278 WeakPolarHBondContact O-CB 3.3Å
69	E	96	Very high	95.1	Very high	36 Å²	36	38.1 Å²	38.1	17%	0.168	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	115.1	176.6	-179.3	-166.7	-163.1	0	0	108.4	Y67 E71 I72 K275 C278	Y67-E69 HydrophobicContact CE1-CB 3.58Å; Y67-E69 VanDerWaalsContact OH-CD 3.3Å; Y67-E69 PolarHBondContact OH-OE2 2.83Å; E69-E71 PolarHBondContact O-N 3.28Å; E69-E71 VanDerWaalsContact O-N 3.15Å; E69-I72 PolarHBondContact N-O 3.02Å; E69-I72 PolarHBondContact O-N 3.13Å; E69-K275 HydrophobicContact CG-CD 4.41Å; E69-K275 VanDerWaalsContact OE1-CD 3.22Å; E69-K275 WeakPolarHBondContact OE1-CD 3.43Å; E69-K275 WeakPolarHBondContact OE1-CE 3.05Å; E69-K275 IonicContact OE1-NZ 3.45Å; E69-K275 PolarHBondContact OE1-NZ 3.16Å; E69-C278 HydrophobicContact CB-CB 4.26Å
70	E	94.1	Very high	94.9	Very high	167 Å²	167	39.9 Å²	39.9	78%	0.78	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	-117.5	-179.2	-58.5	174.5	-178.5	0	0	112.3
71	E	95	Very high	94.6	Very high	95 Å²	95	41.6 Å²	41.6	44%	0.444	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.7	178.8	-57.3	-173.4	143.4	0	0	113.4	E69 K116 R117	E69-E71 PolarHBondContact O-N 3.28Å; E69-E71 VanDerWaalsContact O-N 3.15Å; E71-K116 HydrophobicContact CB-CG 4.43Å; E71-K116 CarbonylContact O-C 3.57Å; E71-K116 WeakPolarHBondContact O-CA 3.3Å; E71-K116 WeakPolarHBondContact OE2-CE 3.38Å; E71-K116 IonicContact OE2-NZ 2.75Å; E71-K116 PolarHBondContact OE2-NZ 3.21Å; E71-R117 HydrophobicContact CB-CB 4.42Å; E71-R117 PolarHBondContact O-N 2.86Å
72	I	96.7	Very high	94.5	Very high	13 Å²	13	42 Å²	42	7%	0.067	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.1	-173.3	-60.7	-61.3	0	0	0	110.7	E69 L114 I115 K116 Y162 L165	E69-I72 PolarHBondContact N-O 3.02Å; E69-I72 PolarHBondContact O-N 3.13Å; I72-L114 HydrophobicContact CG2-CD1 3.32Å; I72-L114 HydrophobicContact CG2-CG 4.35Å; I72-I115 WeakPolarHBondContact CA-O 3.29Å; I72-K116 HydrophobicContact CD1-CB 3.77Å; I72-K116 HydrophobicContact CD1-CD 4.23Å; I72-K116 HydrophobicContact CD1-CG 3.97Å; I72-Y162 HydrophobicContact CD1-CE1 3.67Å; I72-Y162 HydrophobicContact CG1-CE1 4.28Å; I72-L165 HydrophobicContact CG2-CD2 4.13Å
73	E	98.1	Very high	94.2	Very high	5 Å²	5	43.9 Å²	43.9	2%	0.023	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143.2	178.9	-65.5	169.9	-177.8	0	0	110.6	Y67 K68 Y75 L114 I115 R117	Y67-E73 CarbonylContact O-C 3.48Å; Y67-E73 VanDerWaalsContact O-CA 3.26Å; Y67-E73 WeakPolarHBondContact O-CA 3.32Å; K68-E73 HydrophobicContact CB-CG 4.32Å; K68-E73 HydrophobicContact CD-CG 4.42Å; K68-E73 WeakPolarHBondContact CE-OE1 3Å; K68-E73 HydrophobicContact CG-CG 3.95Å; E73-Y75 HydrophobicContact CB-CD2 4.32Å; E73-Y75 HydrophobicContact CB-CE2 3.88Å; E73-Y75 WeakPolarHBondContact OE2-CE2 3.27Å; E73-Y75 PolarHBondContact OE2-OH 2.94Å; E73-L114 WeakPolarHBondContact O-CA 2.86Å; E73-I115 HydrophobicContact CB-CD1 4.23Å; E73-I115 HydrophobicContact CB-CG1 3.79Å; E73-I115 PolarHBondContact N-O 2.88Å; E73-I115 VanDerWaalsContact N-O 3.1Å; E73-I115 PolarHBondContact O-N 3.29Å; E73-R117 VanDerWaalsContact CD-NE 3.26Å; E73-R117 IonicContact OE1-CZ 2.73Å; E73-R117 IonicContact OE1-NE 3.31Å; E73-R117 PolarHBondContact OE1-NE 2.69Å; E73-R117 IonicContact OE1-NH2 2.8Å; E73-R117 IonicContact OE2-CZ 2.96Å; E73-R117 IonicContact OE2-NE 3.29Å; E73-R117 PolarHBondContact OE2-NE 3.38Å; E73-R117 IonicContact OE2-NH2 3.51Å; E73-R117 PolarHBondContact OE2-NH2 3.25Å
74	I	98.3	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.2	168.9	-56.3	174.5	0	0	0	108.7	V66 Y67 Y112 V113 L114 F169 I274	V66-I74 HydrophobicContact CG2-CB 4.09Å; V66-I74 HydrophobicContact CG2-CG2 3.8Å; V66-I74 WeakPolarHBondContact CG2-O 3.38Å; V66-I74 PolarHBondContact N-O 3.34Å; Y67-I74 HydrophobicContact CD1-CD1 4.15Å; Y67-I74 HydrophobicContact CD1-CG1 4.14Å; Y67-I74 HydrophobicContact CG-CD1 4.17Å; Y67-I74 HydrophobicContact CG-CG1 4.36Å; Y67-I74 PolarHBondContact N-O 2.84Å; Y67-I74 PolarHBondContact O-N 3.26Å; I74-Y112 HydrophobicContact CG2-CD1 4.32Å; I74-V113 WeakPolarHBondContact CA-O 3.49Å; I74-L114 HydrophobicContact CD1-CD1 4.28Å; I74-L114 HydrophobicContact CG1-CD1 3.62Å; I74-F169 HydrophobicContact CD1-CB 4.1Å; I74-F169 HydrophobicContact CD1-CD1 4.1Å; I74-F169 HydrophobicContact CD1-CD2 3.89Å; I74-F169 HydrophobicContact CD1-CE2 4.33Å; I74-F169 HydrophobicContact CD1-CG 3.75Å; I74-F169 HydrophobicContact CG2-CD1 4.47Å; I74-F169 HydrophobicContact CG2-CE1 4.22Å; I74-I274 HydrophobicContact CD1-CD1 4.21Å
75	Y	97.9	Very high	93.8	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.035	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.1	174.9	-77.9	-106.1	0	0	0	110.4	S60 P61 I64 I65 E73 Y112 V113 I115 R117	S60-Y75 PolarHBondContact OG-OH 2.98Å; P61-Y75 HydrophobicContact CB-CD1 4.25Å; P61-Y75 HydrophobicContact CB-CD2 4.45Å; P61-Y75 HydrophobicContact CB-CG 4.14Å; P61-Y75 HydrophobicContact CG-CD2 3.99Å; P61-Y75 HydrophobicContact CG-CE2 4.16Å; P61-Y75 HydrophobicContact CG-CG 4.18Å; I64-Y75 CarbonylContact O-C 3.59Å; I64-Y75 VanDerWaalsContact O-CA 3.3Å; I64-Y75 WeakPolarHBondContact O-CA 3.24Å; I65-Y75 HydrophobicContact CD1-CE1 4.33Å; I65-Y75 HydrophobicContact CD1-CE2 4.48Å; I65-Y75 WeakPolarHBondContact CD1-OH 2.81Å; I65-Y75 HydrophobicContact CG1-CD1 4.15Å; I65-Y75 HydrophobicContact CG1-CD2 4.49Å; I65-Y75 HydrophobicContact CG1-CE1 3.54Å; I65-Y75 HydrophobicContact CG1-CE2 3.92Å; I65-Y75 VanDerWaalsContact CG1-CZ 3.4Å; E73-Y75 HydrophobicContact CB-CD2 4.32Å; E73-Y75 HydrophobicContact CB-CE2 3.88Å; E73-Y75 WeakPolarHBondContact OE2-CE2 3.27Å; E73-Y75 PolarHBondContact OE2-OH 2.94Å; Y75-Y112 CarbonylContact O-C 3.47Å; Y75-Y112 WeakPolarHBondContact O-CA 3.47Å; Y75-V113 PolarHBondContact N-O 2.6Å; Y75-V113 PolarHBondContact O-N 3.27Å; Y75-I115 HydrophobicContact CD2-CD1 4.28Å; Y75-I115 HydrophobicContact CD2-CG1 4.14Å; Y75-I115 HydrophobicContact CE2-CD1 3.68Å; Y75-I115 HydrophobicContact CE2-CG1 3.97Å; Y75-R117 PolarHBondContact OH-NH2 2.81Å
76	Q	96	Very high	93.6	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.056	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	115	164.2	-173.8	-173.3	52.1	0	0	108.9	G63 I64 V66 F110 F111 Y112 N282	G63-Q76 VanDerWaalsContact CA-O 3.27Å; G63-Q76 WeakPolarHBondContact CA-O 3.38Å; I64-Q76 HydrophobicContact CG1-CB 4.11Å; I64-Q76 PolarHBondContact N-O 3.48Å; I64-Q76 PolarHBondContact O-N 2.76Å; V66-Q76 HydrophobicContact CG1-CB 3.68Å; V66-Q76 HydrophobicContact CG2-CB 4.27Å; Q76-F110 HydrophobicContact CG-CD1 4.27Å; Q76-F111 CarbonylContact C-O 3.57Å; Q76-F111 WeakPolarHBondContact CA-O 3.26Å; Q76-Y112 HydrophobicContact CB-CD1 4.22Å; Q76-Y112 HydrophobicContact CB-CE1 4.03Å; Q76-Y112 HydrophobicContact CG-CD1 4.37Å; Q76-Y112 HydrophobicContact CG-CE1 3.88Å; Q76-Y112 PolarHBondContact NE2-OH 2.64Å; Q76-N282 PolarHBondContact OE1-ND2 3.39Å
77	V	94.5	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.4	-178.5	-166.1	0	0	0	0	109.7	P62 F85 F111 V113	P62-V77 HydrophobicContact CB-CG1 4.25Å; P62-V77 HydrophobicContact CG-CG1 3.83Å; P62-V77 VanDerWaalsContact O-CG2 3.29Å; P62-V77 WeakPolarHBondContact O-CG2 3.38Å; V77-F85 HydrophobicContact CG1-CD1 3.98Å; V77-F85 HydrophobicContact CG1-CE1 4.35Å; V77-F85 HydrophobicContact CG2-CE1 4.17Å; V77-F111 HydrophobicContact CB-CB 4.25Å; V77-F111 PolarHBondContact N-O 3.45Å; V77-F111 PolarHBondContact O-N 3.45Å; V77-F111 VanDerWaalsContact O-N 3.13Å; V77-V113 HydrophobicContact CG2-CB 4.46Å; V77-V113 HydrophobicContact CG2-CG2 3.81Å
78	D	91.1	Very high	92.8	Very high	40 Å²	40	42.6 Å²	42.6	21%	0.214	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	131.5	174.4	-161.9	-45.4	0	0	0	110	S80 A81 S82 R135	D78-S80 VanDerWaalsContact C-N 3.25Å; D78-S80 PolarHBondContact O-N 3.37Å; D78-S80 WeakPolarHBondContact OD1-CB 3.14Å; D78-S80 PolarHBondContact OD1-N 3.14Å; D78-S80 PolarHBondContact OD1-OG 3.14Å; D78-A81 PolarHBondContact O-N 3.21Å; D78-S82 PolarHBondContact O-N 3.22Å; D78-R135 IonicContact OD1-CZ 3.68Å; D78-R135 IonicContact OD1-NH1 3.93Å; D78-R135 IonicContact OD1-NH2 2.8Å; D78-R135 PolarHBondContact OD1-NH2 3.17Å; D78-R135 IonicContact OD2-CZ 3.35Å; D78-R135 IonicContact OD2-NH1 3.07Å; D78-R135 PolarHBondContact OD2-NH1 2.94Å; D78-R135 VanDerWaalsContact OD2-NH1 3.07Å; D78-R135 IonicContact OD2-NH2 2.73Å; D78-R135 PolarHBondContact OD2-NH2 3.12Å
79	N	88.1	Confident	92.5	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.064	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-34	176.3	-170.5	66.1	0	0	0	112.5	A81 S82 A83 C86 L106 N107	N79-A81 VanDerWaalsContact C-N 3.27Å; N79-A81 PolarHBondContact O-N 2.99Å; N79-S82 CarbonylContact O-C 3.55Å; N79-S82 PolarHBondContact O-N 3.37Å; N79-A83 VanDerWaalsContact O-CA 3.29Å; N79-A83 WeakPolarHBondContact O-CA 3.35Å; N79-A83 PolarHBondContact O-N 2.97Å; N79-A83 WeakPolarHBondContact OD1-CA 3.32Å; N79-C86 HydrophobicContact CB-CB 4.38Å; N79-C86 VanDerWaalsContact OD1-CB 3.23Å; N79-C86 WeakPolarHBondContact OD1-CB 3.41Å; N79-L106 HydrophobicContact CB-CB 4.18Å; N79-L106 VanDerWaalsContact CG-CB 3.41Å; N79-L106 WeakPolarHBondContact OD1-CB 3.38Å; N79-N107 PolarHBondContact ND2-OD1 2.81Å
80	S	86.3	Confident	92.2	Very high	95 Å²	95	35.7 Å²	35.7	66%	0.664	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-37.3	179.3	57.6	0	0	0	0	112.6	D78	D78-S80 VanDerWaalsContact C-N 3.25Å; D78-S80 PolarHBondContact O-N 3.37Å; D78-S80 WeakPolarHBondContact OD1-CB 3.14Å; D78-S80 PolarHBondContact OD1-N 3.14Å; D78-S80 PolarHBondContact OD1-OG 3.14Å
81	A	87.2	Confident	91.8	Very high	76 Å²	76	28.2 Å²	28.2	63%	0.628	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-22.3	179.6	0	0	0	0	0	113.4	D78 N79	D78-A81 PolarHBondContact O-N 3.21Å; N79-A81 VanDerWaalsContact C-N 3.27Å; N79-A81 PolarHBondContact O-N 2.99Å
82	S	90.4	Very high	91.5	Very high	16 Å²	16	25.4 Å²	25.4	11%	0.112	15%	0.152	C	C	.	.			trans	-149	53.3	-169.7	-72.8	0	0	0	0	113.4	P62 D78 N79 N84 F85 C86	P62-S82 WeakPolarHBondContact CB-OG 3.18Å; D78-S82 PolarHBondContact O-N 3.22Å; N79-S82 CarbonylContact O-C 3.55Å; N79-S82 PolarHBondContact O-N 3.37Å; S82-N84 PolarHBondContact O-N 3.34Å; S82-F85 WeakPolarHBondContact O-CB 3.49Å; S82-F85 PolarHBondContact O-N 3.35Å; S82-C86 PolarHBondContact O-N 3.49Å; S82-C86 VanDerWaalsContact O-N 3.11Å
83	A	89.1	Confident	91.1	Very high	49 Å²	49	24.8 Å²	24.8	41%	0.405	15%	0.149	S	C	.	.	H	α-helix	trans	-53.2	-47.2	-175.2	0	0	0	0	0	113.9	N79 F85 C86 R87	N79-A83 VanDerWaalsContact O-CA 3.29Å; N79-A83 WeakPolarHBondContact O-CA 3.35Å; N79-A83 PolarHBondContact O-N 2.97Å; N79-A83 WeakPolarHBondContact OD1-CA 3.32Å; A83-F85 VanDerWaalsContact C-N 3.31Å; A83-F85 PolarHBondContact O-N 3.32Å; A83-C86 PolarHBondContact O-N 3.04Å; A83-R87 WeakPolarHBondContact O-CB 3.43Å; A83-R87 PolarHBondContact O-N 3.36Å
84	N	89.6	Confident	90.4	Very high	66 Å²	66	28 Å²	28	35%	0.353	16%	0.163	S	C	.	.	H	α-helix	trans	-61.7	-39	179	-72.8	-19.6	0	0	0	112.4	G5 S82 N88	G5-N84 VanDerWaalsContact O-CB 3.24Å; G5-N84 WeakPolarHBondContact O-CB 3.17Å; G5-N84 PolarHBondContact O-ND2 3.2Å; S82-N84 PolarHBondContact O-N 3.34Å; N84-N88 WeakPolarHBondContact O-CB 3.49Å; N84-N88 PolarHBondContact O-N 3.45Å; N84-N88 PolarHBondContact O-ND2 3.26Å; N84-N88 VanDerWaalsContact O-ND2 3.08Å; N84-N88 PolarHBondContact O-OD1 2.76Å
85	F	92.5	Very high	89.7	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-49.6	177.7	179.4	-84.5	0	0	0	110.9	L2 F57 P61 P62 V77 S82 A83 R87 N88 L89 V113 W125	L2-F85 HydrophobicContact CB-CD2 4.44Å; L2-F85 HydrophobicContact CB-CE2 3.92Å; L2-F85 HydrophobicContact CD2-CE2 4.44Å; L2-F85 WeakPolarHBondContact O-CD2 3.33Å; F57-F85 HydrophobicContact CD2-CD2 4.04Å; F57-F85 HydrophobicContact CE2-CB 4.09Å; F57-F85 HydrophobicContact CE2-CD2 4.25Å; P61-F85 HydrophobicContact CB-CE2 4.45Å; P61-F85 HydrophobicContact CB-CZ 4.28Å; P62-F85 VanDerWaalsContact CD-CD2 3.42Å; P62-F85 VanDerWaalsContact CD-CE2 3.49Å; P62-F85 HydrophobicContact CG-CB 3.77Å; P62-F85 HydrophobicContact CG-CD1 3.7Å; P62-F85 HydrophobicContact CG-CD2 3.6Å; P62-F85 HydrophobicContact CG-CE1 4.17Å; P62-F85 HydrophobicContact CG-CE2 4.06Å; P62-F85 HydrophobicContact CG-CG 3.4Å; P62-F85 HydrophobicContact CG-CZ 4.34Å; V77-F85 HydrophobicContact CG1-CD1 3.98Å; V77-F85 HydrophobicContact CG1-CE1 4.35Å; V77-F85 HydrophobicContact CG2-CE1 4.17Å; S82-F85 WeakPolarHBondContact O-CB 3.49Å; S82-F85 PolarHBondContact O-N 3.35Å; A83-F85 VanDerWaalsContact C-N 3.31Å; A83-F85 PolarHBondContact O-N 3.32Å; F85-R87 VanDerWaalsContact C-N 3.34Å; F85-R87 PolarHBondContact O-N 2.9Å; F85-N88 PolarHBondContact O-N 3.43Å; F85-L89 HydrophobicContact CE1-CD2 4.26Å; F85-L89 WeakPolarHBondContact O-CB 3.47Å; F85-L89 PolarHBondContact O-N 2.7Å; F85-V113 HydrophobicContact CE1-CG2 4.04Å; F85-V113 HydrophobicContact CZ-CG2 4.42Å; F85-W125 HydrophobicContact CE2-CH2 4.28Å
86	C	91.9	Very high	88.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-40.8	179.3	-66.8	0	0	0	0	111.8	N79 S82 A83 L89 C90 L106 F111	N79-C86 HydrophobicContact CB-CB 4.38Å; N79-C86 VanDerWaalsContact OD1-CB 3.23Å; N79-C86 WeakPolarHBondContact OD1-CB 3.41Å; S82-C86 PolarHBondContact O-N 3.49Å; S82-C86 VanDerWaalsContact O-N 3.11Å; A83-C86 PolarHBondContact O-N 3.04Å; C86-L89 PolarHBondContact O-N 3.18Å; C86-C90 PolarHBondContact O-N 3.41Å; C86-L106 HydrophobicContact CB-CD1 4.42Å; C86-F111 HydrophobicContact CB-CD2 4.15Å; C86-F111 HydrophobicContact CB-CE2 3.88Å; C86-F111 HydrophobicContact CB-CZ 4.31Å
87	R	89.2	Confident	88.1	Confident	89 Å²	89	33.1 Å²	33.1	34%	0.336	19%	0.19	S	C	.	.	H	α-helix	trans	-60.8	-50.7	174.4	-173.7	-178.7	-179	110.4	-9.2	111.5	Y7 A83 F85 L89 C90 L91 L106	Y7-R87 VanDerWaalsContact CE2-CZ 3.46Å; Y7-R87 PolarHBondContact OH-NH2 3.2Å; A83-R87 WeakPolarHBondContact O-CB 3.43Å; A83-R87 PolarHBondContact O-N 3.36Å; F85-R87 VanDerWaalsContact C-N 3.34Å; F85-R87 PolarHBondContact O-N 2.9Å; R87-L89 VanDerWaalsContact C-N 3.27Å; R87-L89 PolarHBondContact O-N 3.02Å; R87-C90 PolarHBondContact O-N 3.3Å; R87-C90 VanDerWaalsContact O-N 3.16Å; R87-L91 HydrophobicContact CG-CD1 4.14Å; R87-L91 HydrophobicContact CG-CG 4.42Å; R87-L91 WeakPolarHBondContact O-CG 3.22Å; R87-L91 PolarHBondContact O-N 3.38Å; R87-L106 HydrophobicContact CB-CD1 3.79Å; R87-L106 HydrophobicContact CG-CD1 4.41Å
88	N	90	Very high	86.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-36.8	178.9	-67.1	-21.2	0	0	0	112.4	L1 L2 N6 F8 N84 F85 F92	L1-N88 HydrophobicContact CG-CB 4.41Å; L2-N88 HydrophobicContact CD2-CB 4.08Å; N6-N88 PolarHBondContact O-ND2 3.02Å; F8-N88 WeakPolarHBondContact CD2-ND2 3.44Å; F8-N88 PolarHBondContact N-OD1 2.8Å; N84-N88 WeakPolarHBondContact O-CB 3.49Å; N84-N88 PolarHBondContact O-N 3.45Å; N84-N88 PolarHBondContact O-ND2 3.26Å; N84-N88 VanDerWaalsContact O-ND2 3.08Å; N84-N88 PolarHBondContact O-OD1 2.76Å; F85-N88 PolarHBondContact O-N 3.43Å; N88-F92 VanDerWaalsContact O-CB 3.29Å; N88-F92 WeakPolarHBondContact O-CB 3.32Å; N88-F92 PolarHBondContact O-N 2.78Å
89	L	91.3	Very high	85.8	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-45.8	174.8	-178	62.6	0	0	0	111.1	L2 F85 C86 R87 F92 A93 F111 V113 Y130	L2-L89 HydrophobicContact CD1-CD1 4.19Å; L2-L89 HydrophobicContact CD2-CB 4.07Å; L2-L89 HydrophobicContact CD2-CD1 4.39Å; F85-L89 HydrophobicContact CE1-CD2 4.26Å; F85-L89 WeakPolarHBondContact O-CB 3.47Å; F85-L89 PolarHBondContact O-N 2.7Å; C86-L89 PolarHBondContact O-N 3.18Å; R87-L89 VanDerWaalsContact C-N 3.27Å; R87-L89 PolarHBondContact O-N 3.02Å; L89-F92 PolarHBondContact O-N 3.48Å; L89-A93 VanDerWaalsContact O-CB 3.32Å; L89-A93 WeakPolarHBondContact O-CB 3.4Å; L89-A93 PolarHBondContact O-N 3.47Å; L89-F111 HydrophobicContact CD2-CD1 4.05Å; L89-V113 HydrophobicContact CD2-CG2 3.85Å; L89-Y130 HydrophobicContact CD1-CD1 3.71Å; L89-Y130 HydrophobicContact CD1-CE1 4.05Å; L89-Y130 HydrophobicContact CD1-CG 4.1Å; L89-Y130 HydrophobicContact CD2-CD1 4.2Å; L89-Y130 HydrophobicContact CD2-CD2 3.77Å; L89-Y130 HydrophobicContact CD2-CE2 4.23Å; L89-Y130 HydrophobicContact CD2-CG 3.77Å; L89-Y130 HydrophobicContact CG-CD1 4.02Å; L89-Y130 HydrophobicContact CG-CD2 4.28Å; L89-Y130 HydrophobicContact CG-CE1 4.11Å; L89-Y130 HydrophobicContact CG-CE2 4.37Å; L89-Y130 HydrophobicContact CG-CG 4.11Å
90	C	89.7	Confident	85.3	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-45.1	176.5	-80	0	0	0	0	112.8	C86 R87 F92 A93 K94 K100 L106 F111	C86-C90 PolarHBondContact O-N 3.41Å; R87-C90 PolarHBondContact O-N 3.3Å; R87-C90 VanDerWaalsContact O-N 3.16Å; C90-F92 VanDerWaalsContact C-N 3.33Å; C90-F92 PolarHBondContact O-N 2.95Å; C90-A93 PolarHBondContact O-N 3.31Å; C90-A93 VanDerWaalsContact O-N 3.14Å; C90-K94 WeakPolarHBondContact O-CB 3.5Å; C90-K94 PolarHBondContact O-N 2.98Å; C90-K100 VanDerWaalsContact O-CE 3.25Å; C90-K100 WeakPolarHBondContact O-CE 3.29Å; C90-K100 PolarHBondContact SG-NZ 3.21Å; C90-L106 HydrophobicContact CB-CD2 3.99Å; C90-L106 WeakPolarHBondContact SG-CD2 3.48Å; C90-F111 VanDerWaalsContact SG-CE1 3.55Å
91	L	86.1	Confident	84.3	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-45.5	175.8	-71.7	174.4	0	0	0	111	F8 E10 V13 R87 A93 K94 L95	F8-L91 WeakPolarHBondContact O-CD1 3.47Å; E10-L91 HydrophobicContact CB-CD2 4.21Å; E10-L91 HydrophobicContact CG-CD2 4.38Å; V13-L91 HydrophobicContact CG2-CB 3.93Å; V13-L91 HydrophobicContact CG2-CD1 4.09Å; R87-L91 HydrophobicContact CG-CD1 4.14Å; R87-L91 HydrophobicContact CG-CG 4.42Å; R87-L91 WeakPolarHBondContact O-CG 3.22Å; R87-L91 PolarHBondContact O-N 3.38Å; L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 2.69Å; L91-K94 PolarHBondContact O-N 3.36Å; L91-L95 WeakPolarHBondContact O-CG 3.29Å; L91-L95 PolarHBondContact O-N 2.87Å
92	F	87.2	Confident	83	Confident	37 Å²	37	39.8 Å²	39.8	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-42.5	175.2	-176.3	-86	0	0	0	111.7	L1 V13 I17 N88 L89 C90 L95 L96 L152 M154	L1-F92 HydrophobicContact CD2-CB 4.13Å; L1-F92 HydrophobicContact CD2-CD2 4.05Å; L1-F92 HydrophobicContact CD2-CG 4.49Å; V13-F92 HydrophobicContact CG1-CB 4.21Å; V13-F92 HydrophobicContact CG1-CD2 4.29Å; I17-F92 HydrophobicContact CG1-CE2 4.4Å; N88-F92 VanDerWaalsContact O-CB 3.29Å; N88-F92 WeakPolarHBondContact O-CB 3.32Å; N88-F92 PolarHBondContact O-N 2.78Å; L89-F92 PolarHBondContact O-N 3.48Å; C90-F92 VanDerWaalsContact C-N 3.33Å; C90-F92 PolarHBondContact O-N 2.95Å; F92-L95 WeakPolarHBondContact O-CB 3.22Å; F92-L95 PolarHBondContact O-N 3.41Å; F92-L96 HydrophobicContact CD1-CD1 4.19Å; F92-L96 HydrophobicContact CE1-CD1 3.4Å; F92-L96 VanDerWaalsContact CE1-CD1 3.4Å; F92-L96 HydrophobicContact CE1-CG 4.41Å; F92-L96 HydrophobicContact CZ-CD1 3.91Å; F92-L152 HydrophobicContact CD1-CD2 4.17Å; F92-L152 HydrophobicContact CE1-CD2 4.27Å; F92-M154 HydrophobicContact CD1-CE 3.75Å; F92-M154 HydrophobicContact CD1-SD 3.97Å; F92-M154 HydrophobicContact CE1-CE 3.59Å; F92-M154 HydrophobicContact CE1-SD 3.16Å; F92-M154 WeakPolarHBondContact CE1-SD 3.42Å; F92-M154 HydrophobicContact CZ-CE 4.49Å; F92-M154 HydrophobicContact CZ-SD 3.71Å
93	A	88.4	Confident	81.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-36.4	-179.6	0	0	0	0	0	113.4	L89 C90 L91 L95 L96 I97 K100 Y130 L152	L89-A93 VanDerWaalsContact O-CB 3.32Å; L89-A93 WeakPolarHBondContact O-CB 3.4Å; L89-A93 PolarHBondContact O-N 3.47Å; C90-A93 PolarHBondContact O-N 3.31Å; C90-A93 VanDerWaalsContact O-N 3.14Å; L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 2.69Å; A93-L95 PolarHBondContact O-N 2.87Å; A93-L96 CarbonylContact O-C 3.6Å; A93-L96 PolarHBondContact O-N 3.21Å; A93-I97 HydrophobicContact CB-CD1 4.37Å; A93-I97 WeakPolarHBondContact O-CB 3.3Å; A93-I97 PolarHBondContact O-N 3.37Å; A93-K100 HydrophobicContact CB-CD 3.86Å; A93-Y130 HydrophobicContact CB-CE1 3.63Å; A93-Y130 WeakPolarHBondContact CB-OH 3.48Å; A93-L152 HydrophobicContact CB-CD2 3.89Å
94	K	84.9	Confident	80.2	Confident	71 Å²	71	46.7 Å²	46.7	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-29.7	176.5	180	177.1	173.9	-164.7	0	112.3	E10 C90 L91 L96 K100 D103	E10-K94 IonicContact OE2-NZ 2.91Å; E10-K94 PolarHBondContact OE2-NZ 3.41Å; C90-K94 WeakPolarHBondContact O-CB 3.5Å; C90-K94 PolarHBondContact O-N 2.98Å; L91-K94 PolarHBondContact O-N 3.36Å; K94-L96 PolarHBondContact O-N 3.25Å; K94-K100 HydrophobicContact CB-CD 4.32Å; K94-D103 WeakPolarHBondContact CD-OD2 3.24Å; K94-D103 WeakPolarHBondContact CE-OD2 3.45Å; K94-D103 IonicContact NZ-OD2 2.78Å; K94-D103 PolarHBondContact NZ-OD2 3.05Å
95	L	82.5	Confident	79.3	Confident	34 Å²	34	47 Å²	47	18%	0.178	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-16.5	174.2	-60.3	172.4	0	0	0	113.4	V13 R14 I17 L91 F92 A93	V13-L95 HydrophobicContact CB-CD1 4.09Å; V13-L95 HydrophobicContact CG1-CD1 3.52Å; R14-L95 HydrophobicContact CG-CD1 3.97Å; R14-L95 HydrophobicContact CG-CD2 3.6Å; R14-L95 HydrophobicContact CG-CG 4.47Å; I17-L95 HydrophobicContact CD1-CB 3.43Å; I17-L95 VanDerWaalsContact CD1-CB 3.43Å; I17-L95 HydrophobicContact CD1-CD1 3.4Å; I17-L95 HydrophobicContact CD1-CG 3.99Å; I17-L95 HydrophobicContact CG1-CD1 4.23Å; L91-L95 WeakPolarHBondContact O-CG 3.29Å; L91-L95 PolarHBondContact O-N 2.87Å; F92-L95 WeakPolarHBondContact O-CB 3.22Å; F92-L95 PolarHBondContact O-N 3.41Å; A93-L95 PolarHBondContact O-N 2.87Å
96	L	81.8	Confident	78.7	Confident	68 Å²	68	47.6 Å²	47.6	36%	0.356	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-15.8	-177.2	-60.4	179.4	0	0	0	113.7	F92 A93 K94 L152 P155	F92-L96 HydrophobicContact CD1-CD1 4.19Å; F92-L96 HydrophobicContact CE1-CD1 3.4Å; F92-L96 VanDerWaalsContact CE1-CD1 3.4Å; F92-L96 HydrophobicContact CE1-CG 4.41Å; F92-L96 HydrophobicContact CZ-CD1 3.91Å; A93-L96 CarbonylContact O-C 3.6Å; A93-L96 PolarHBondContact O-N 3.21Å; K94-L96 PolarHBondContact O-N 3.25Å; L96-L152 HydrophobicContact CB-CD1 3.95Å; L96-L152 HydrophobicContact CD1-CD1 4.02Å; L96-L152 HydrophobicContact CD1-CD2 4.13Å; L96-P155 HydrophobicContact CD1-CG 4.18Å; L96-P155 HydrophobicContact CD2-CG 4.48Å
97	I	78.8	Confident	78.1	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.138	27%	0.268	C	S	.	.			trans	-119.5	103.4	-179.7	-58.8	171.2	0	0	0	108.3	A93 C99 K100 L152	A93-I97 HydrophobicContact CB-CD1 4.37Å; A93-I97 WeakPolarHBondContact O-CB 3.3Å; A93-I97 PolarHBondContact O-N 3.37Å; I97-C99 PolarHBondContact O-N 2.99Å; I97-C99 VanDerWaalsContact O-N 3.13Å; I97-K100 HydrophobicContact CB-CB 4.07Å; I97-K100 HydrophobicContact CG2-CB 3.99Å; I97-K100 PolarHBondContact O-N 2.89Å; I97-K100 VanDerWaalsContact O-N 3.16Å; I97-L152 HydrophobicContact CD1-CB 4.09Å; I97-L152 HydrophobicContact CD1-CD1 4.33Å; I97-L152 HydrophobicContact CG1-CD1 4.23Å
98	E	69.4	Low	77.8	Confident	151 Å²	151	47.9 Å²	47.9	71%	0.706	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.1	-177	-61.9	-176.4	161.3	0	0	113.5
99	C	67.9	Low	77.7	Confident	45 Å²	45	48.6 Å²	48.6	30%	0.304	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	2.1	-175	18.8	0	0	0	0	114.3	I97 T101	I97-C99 PolarHBondContact O-N 2.99Å; I97-C99 VanDerWaalsContact O-N 3.13Å; C99-T101 PolarHBondContact O-N 3.43Å
100	K	76.6	Confident	77.6	Confident	16 Å²	16	50.1 Å²	50.1	7%	0.07	27%	0.265	C	S	.	.			trans	-75.3	117.1	-177.6	-178.3	168.3	169.1	49.6	0	111.1	C90 A93 K94 I97 A102	C90-K100 VanDerWaalsContact O-CE 3.25Å; C90-K100 WeakPolarHBondContact O-CE 3.29Å; C90-K100 PolarHBondContact SG-NZ 3.21Å; A93-K100 HydrophobicContact CB-CD 3.86Å; K94-K100 HydrophobicContact CB-CD 4.32Å; I97-K100 HydrophobicContact CB-CB 4.07Å; I97-K100 HydrophobicContact CG2-CB 3.99Å; I97-K100 PolarHBondContact O-N 2.89Å; I97-K100 VanDerWaalsContact O-N 3.16Å; K100-A102 PolarHBondContact NZ-O 3.28Å
101	T	65.4	Low	77.8	Confident	127 Å²	127	50 Å²	50	78%	0.779	27%	0.265	S	S	*	.			trans	-104.6	-23.3	-177.2	52.8	0	0	0	0	114.3	C99 D103	C99-T101 PolarHBondContact O-N 3.43Å; T101-D103 PolarHBondContact O-N 3.11Å
102	A	60.1	Low	78.4	Confident	25 Å²	25	49.7 Å²	49.7	21%	0.207	26%	0.262	C	S	.	.			trans	-94.3	99.9	-171.7	0	0	0	0	0	112.8	K100 F109	K100-A102 PolarHBondContact NZ-O 3.28Å; A102-F109 HydrophobicContact CB-CE2 4.19Å
103	D	62.7	Low	78.9	Confident	24 Å²	24	48 Å²	48	13%	0.128	26%	0.255	C	S	.	.	S	Bend	trans	-107.8	-20.2	162.5	-63.8	-25.7	0	0	0	112.3	K94 T101	K94-D103 WeakPolarHBondContact CD-OD2 3.24Å; K94-D103 WeakPolarHBondContact CE-OD2 3.45Å; K94-D103 IonicContact NZ-OD2 2.78Å; K94-D103 PolarHBondContact NZ-OD2 3.05Å; T101-D103 PolarHBondContact O-N 3.11Å
104	E	58.4	Low	79.3	Confident	185 Å²	185	48 Å²	48	86%	0.864	26%	0.255	S	S	*	.	S	Bend	trans	-102.6	-20.9	-169.7	-62.9	-178.3	172.8	0	0	114
105	C	70.6	Confident	79.9	Confident	72 Å²	72	44.6 Å²	44.6	49%	0.486	24%	0.24	S	C	.	.			trans	-104.2	39.5	-178.1	-68.1	0	0	0	0	113.3	N107 S108 F109	C105-N107 PolarHBondContact O-N 3.38Å; C105-S108 WeakPolarHBondContact O-CB 3.41Å; C105-S108 PolarHBondContact O-N 3.08Å; C105-S108 PolarHBondContact O-OG 3.02Å; C105-F109 VanDerWaalsContact O-CD2 3.3Å; C105-F109 WeakPolarHBondContact O-CD2 3.46Å; C105-F109 WeakPolarHBondContact O-CE2 3.44Å
106	L	79.4	Confident	80.6	Confident	14 Å²	14	45.8 Å²	45.8	7%	0.073	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.1	-30.6	-175.5	-56.5	177.4	0	0	0	113.4	N79 C86 R87 C90 S108 F109 F111	N79-L106 HydrophobicContact CB-CB 4.18Å; N79-L106 VanDerWaalsContact CG-CB 3.41Å; N79-L106 WeakPolarHBondContact OD1-CB 3.38Å; C86-L106 HydrophobicContact CB-CD1 4.42Å; R87-L106 HydrophobicContact CB-CD1 3.79Å; R87-L106 HydrophobicContact CG-CD1 4.41Å; C90-L106 HydrophobicContact CB-CD2 3.99Å; C90-L106 WeakPolarHBondContact SG-CD2 3.48Å; L106-S108 PolarHBondContact O-N 3.45Å; L106-S108 VanDerWaalsContact O-N 3.15Å; L106-F109 PolarHBondContact O-N 3.15Å; L106-F109 VanDerWaalsContact O-N 3.16Å; L106-F111 HydrophobicContact CD2-CZ 4.01Å
107	N	80.5	Confident	81.2	Confident	86 Å²	86	45.4 Å²	45.4	46%	0.46	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-63.6	-14.8	175.9	-74.5	-26.5	0	0	0	113.4	N79 C105 F109 R135 R138	N79-N107 PolarHBondContact ND2-OD1 2.81Å; C105-N107 PolarHBondContact O-N 3.38Å; N107-F109 VanDerWaalsContact C-N 3.27Å; N107-R135 VanDerWaalsContact O-CD 3.28Å; N107-R135 WeakPolarHBondContact O-CD 3.31Å; N107-R135 PolarHBondContact O-NE 3.3Å; N107-R138 VanDerWaalsContact C-NH2 3.25Å; N107-R138 VanDerWaalsContact CB-NH2 3.33Å; N107-R138 PolarHBondContact O-NH2 3Å
108	S	82	Confident	81.9	Confident	9 Å²	9	45.5 Å²	45.5	6%	0.063	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-82.3	-2.9	177.1	-53	0	0	0	0	113.1	C105 L106 P134 R135 R138	C105-S108 WeakPolarHBondContact O-CB 3.41Å; C105-S108 PolarHBondContact O-N 3.08Å; C105-S108 PolarHBondContact O-OG 3.02Å; L106-S108 PolarHBondContact O-N 3.45Å; L106-S108 VanDerWaalsContact O-N 3.15Å; S108-P134 CarbonylContact O-C 3.57Å; S108-P134 WeakPolarHBondContact O-CA 3.42Å; S108-R135 PolarHBondContact O-N 3.48Å; S108-R138 WeakPolarHBondContact OG-CD 3.41Å; S108-R138 PolarHBondContact OG-NE 3.17Å; S108-R138 VanDerWaalsContact OG-NE 3.09Å; S108-R138 PolarHBondContact OG-NH1 3.4Å; S108-R138 PolarHBondContact OG-NH2 3.41Å
109	F	87.2	Confident	82.8	Confident	16 Å²	16	45 Å²	45	7%	0.07	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.6	-170.7	-56.6	-81.1	0	0	0	112.9	A102 C105 L106 N107 F111 K133 P134 R135 S149	A102-F109 HydrophobicContact CB-CE2 4.19Å; C105-F109 VanDerWaalsContact O-CD2 3.3Å; C105-F109 WeakPolarHBondContact O-CD2 3.46Å; C105-F109 WeakPolarHBondContact O-CE2 3.44Å; L106-F109 PolarHBondContact O-N 3.15Å; L106-F109 VanDerWaalsContact O-N 3.16Å; N107-F109 VanDerWaalsContact C-N 3.27Å; F109-F111 HydrophobicContact CB-CE2 4.03Å; F109-F111 HydrophobicContact CB-CZ 4.12Å; F109-K133 CarbonylContact C-O 3.52Å; F109-K133 VanDerWaalsContact CA-O 3.31Å; F109-K133 WeakPolarHBondContact CA-O 3.38Å; F109-P134 HydrophobicContact CD1-CG 4.39Å; F109-P134 HydrophobicContact CE1-CB 4.49Å; F109-P134 HydrophobicContact CE1-CG 4.18Å; F109-R135 PolarHBondContact O-NE 2.86Å; F109-R135 PolarHBondContact O-NH2 3.49Å; F109-S149 WeakPolarHBondContact CE1-OG 3.46Å
110	F	89.8	Confident	83.5	Confident	33 Å²	33	51.1 Å²	51.1	15%	0.145	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	142	153	-71.8	-69.6	0	0	0	108.8	Q76 Y112 S132 K133 R135 A284	Q76-F110 HydrophobicContact CG-CD1 4.27Å; F110-Y112 HydrophobicContact CB-CE2 3.89Å; F110-S132 CarbonylContact O-C 3.53Å; F110-S132 WeakPolarHBondContact O-CA 3.5Å; F110-K133 PolarHBondContact N-O 3.45Å; F110-K133 PolarHBondContact O-N 2.81Å; F110-R135 HydrophobicContact CD2-CG 3.88Å; F110-R135 HydrophobicContact CE2-CG 3.77Å; F110-R135 HydrophobicContact CZ-CG 4.34Å; F110-A284 HydrophobicContact CZ-CB 4.18Å
111	F	94.7	Very high	83.6	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	174.5	-63.4	-93.2	0	0	0	109.5	Q76 V77 C86 L89 C90 L106 F109 Y130	Q76-F111 CarbonylContact C-O 3.57Å; Q76-F111 WeakPolarHBondContact CA-O 3.26Å; V77-F111 HydrophobicContact CB-CB 4.25Å; V77-F111 PolarHBondContact N-O 3.45Å; V77-F111 PolarHBondContact O-N 3.45Å; V77-F111 VanDerWaalsContact O-N 3.13Å; C86-F111 HydrophobicContact CB-CD2 4.15Å; C86-F111 HydrophobicContact CB-CE2 3.88Å; C86-F111 HydrophobicContact CB-CZ 4.31Å; L89-F111 HydrophobicContact CD2-CD1 4.05Å; C90-F111 VanDerWaalsContact SG-CE1 3.55Å; L106-F111 HydrophobicContact CD2-CZ 4.01Å; F109-F111 HydrophobicContact CB-CE2 4.03Å; F109-F111 HydrophobicContact CB-CZ 4.12Å; F111-Y130 HydrophobicContact CD1-CD2 4.02Å; F111-Y130 AromaticContact CD1-CE2 3.92Å; F111-Y130 HydrophobicContact CD1-CE2 3.92Å; F111-Y130 HydrophobicContact CE1-CE2 4.26Å
112	Y	97.2	Very high	84.2	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.008	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	104.7	175.2	-67	-88.7	0	0	0	108.5	V66 I74 Y75 Q76 F110 Y130 F131 K133 F169 I173	V66-Y112 HydrophobicContact CG2-CD1 4.09Å; V66-Y112 HydrophobicContact CG2-CE1 4.33Å; I74-Y112 HydrophobicContact CG2-CD1 4.32Å; Y75-Y112 CarbonylContact O-C 3.47Å; Y75-Y112 WeakPolarHBondContact O-CA 3.47Å; Q76-Y112 HydrophobicContact CB-CD1 4.22Å; Q76-Y112 HydrophobicContact CB-CE1 4.03Å; Q76-Y112 HydrophobicContact CG-CD1 4.37Å; Q76-Y112 HydrophobicContact CG-CE1 3.88Å; Q76-Y112 PolarHBondContact NE2-OH 2.64Å; F110-Y112 HydrophobicContact CB-CE2 3.89Å; Y112-Y130 CarbonylContact O-C 3.56Å; Y112-Y130 WeakPolarHBondContact O-CA 3.44Å; Y112-Y130 VanDerWaalsContact O-CB 3.31Å; Y112-Y130 WeakPolarHBondContact O-CB 3.43Å; Y112-F131 HydrophobicContact CD1-CZ 4.22Å; Y112-F131 AromaticContact CD2-CD2 3.95Å; Y112-F131 HydrophobicContact CD2-CD2 3.95Å; Y112-F131 HydrophobicContact CD2-CE1 4.06Å; Y112-F131 AromaticContact CD2-CE2 3.25Å; Y112-F131 HydrophobicContact CD2-CE2 3.25Å; Y112-F131 AromaticContact CD2-CZ 3.31Å; Y112-F131 HydrophobicContact CD2-CZ 3.31Å; Y112-F131 AromaticContact CE2-CE2 3.84Å; Y112-F131 HydrophobicContact CE2-CE2 3.84Å; Y112-F131 HydrophobicContact CE2-CZ 4Å; Y112-F131 HydrophobicContact CG-CD1 4.5Å; Y112-F131 AromaticContact CG-CE1 3.8Å; Y112-F131 HydrophobicContact CG-CE1 3.8Å; Y112-F131 AromaticContact CG-CE2 3.88Å; Y112-F131 HydrophobicContact CG-CE2 3.88Å; Y112-F131 AromaticContact CG-CZ 3.43Å; Y112-F131 HydrophobicContact CG-CZ 3.43Å; Y112-F131 VanDerWaalsContact CG-CZ 3.43Å; Y112-F131 PolarHBondContact N-O 3.12Å; Y112-F131 PolarHBondContact O-N 2.85Å; Y112-K133 HydrophobicContact CD2-CB 4.42Å; Y112-K133 HydrophobicContact CE2-CB 3.98Å; Y112-K133 HydrophobicContact CE2-CD 4.36Å; Y112-F169 HydrophobicContact CD1-CD1 4.22Å; Y112-F169 AromaticContact CD1-CE1 3.55Å; Y112-F169 HydrophobicContact CD1-CE1 3.55Å; Y112-F169 AromaticContact CE1-CE1 3.8Å; Y112-F169 HydrophobicContact CE1-CE1 3.8Å; Y112-F169 HydrophobicContact CG-CE1 4.36Å; Y112-I173 HydrophobicContact CD1-CD1 4.46Å; Y112-I173 HydrophobicContact CE1-CD1 3.82Å; Y112-I173 HydrophobicContact CE2-CD1 4.07Å
113	V	97.7	Very high	85.4	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.1	-171.3	-176.7	0	0	0	0	109.7	I74 Y75 V77 F85 L89 I115	I74-V113 WeakPolarHBondContact CA-O 3.49Å; Y75-V113 PolarHBondContact N-O 2.6Å; Y75-V113 PolarHBondContact O-N 3.27Å; V77-V113 HydrophobicContact CG2-CB 4.46Å; V77-V113 HydrophobicContact CG2-CG2 3.81Å; F85-V113 HydrophobicContact CE1-CG2 4.04Å; F85-V113 HydrophobicContact CZ-CG2 4.42Å; L89-V113 HydrophobicContact CD2-CG2 3.85Å; V113-I115 HydrophobicContact CG1-CG2 4.09Å
114	L	98.2	Very high	86.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.4	173.6	-176.9	71	0	0	0	109.8	I72 E73 I74 V128 G129 Y162 L165 L166	I72-L114 HydrophobicContact CG2-CD1 3.32Å; I72-L114 HydrophobicContact CG2-CG 4.35Å; E73-L114 WeakPolarHBondContact O-CA 2.86Å; I74-L114 HydrophobicContact CD1-CD1 4.28Å; I74-L114 HydrophobicContact CG1-CD1 3.62Å; L114-V128 HydrophobicContact CB-CB 4.38Å; L114-V128 HydrophobicContact CD2-CB 3.96Å; L114-V128 HydrophobicContact CD2-CG1 3.59Å; L114-V128 HydrophobicContact CG-CB 3.94Å; L114-V128 HydrophobicContact CG-CG1 4.13Å; L114-V128 WeakPolarHBondContact O-CB 3.42Å; L114-V128 PolarHBondContact O-N 2.93Å; L114-G129 PolarHBondContact N-O 3.39Å; L114-G129 PolarHBondContact O-N 3.12Å; L114-Y162 HydrophobicContact CD2-CD1 3.8Å; L114-Y162 HydrophobicContact CD2-CG 4.11Å; L114-L165 HydrophobicContact CD1-CD2 4Å; L114-L165 HydrophobicContact CD2-CD2 4.38Å; L114-L166 HydrophobicContact CB-CD1 4.36Å; L114-L166 HydrophobicContact CB-CD2 3.72Å; L114-L166 HydrophobicContact CB-CG 4.3Å; L114-L166 HydrophobicContact CD2-CD1 4.31Å; L114-L166 HydrophobicContact CD2-CD2 4.27Å; L114-L166 HydrophobicContact CD2-CG 4.07Å; L114-L166 HydrophobicContact CG-CD2 4.46Å
115	I	97.5	Very high	88.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	159.7	173.9	67.5	152	0	0	0	111.8	P61 I72 E73 Y75 V113 W125 L126	P61-I115 HydrophobicContact CG-CD1 4.14Å; P61-I115 HydrophobicContact CG-CG2 3.57Å; I72-I115 WeakPolarHBondContact CA-O 3.29Å; E73-I115 HydrophobicContact CB-CD1 4.23Å; E73-I115 HydrophobicContact CB-CG1 3.79Å; E73-I115 PolarHBondContact N-O 2.88Å; E73-I115 VanDerWaalsContact N-O 3.1Å; E73-I115 PolarHBondContact O-N 3.29Å; Y75-I115 HydrophobicContact CD2-CD1 4.28Å; Y75-I115 HydrophobicContact CD2-CG1 4.14Å; Y75-I115 HydrophobicContact CE2-CD1 3.68Å; Y75-I115 HydrophobicContact CE2-CG1 3.97Å; V113-I115 HydrophobicContact CG1-CG2 4.09Å; I115-W125 HydrophobicContact CB-CE3 4.18Å; I115-W125 HydrophobicContact CD1-CB 3.68Å; I115-W125 HydrophobicContact CD1-CG 4.26Å; I115-W125 HydrophobicContact CG2-CD2 4.48Å; I115-W125 HydrophobicContact CG2-CE3 3.6Å; I115-W125 HydrophobicContact CG2-CZ3 3.89Å; I115-L126 CarbonylContact C-O 3.53Å; I115-L126 VanDerWaalsContact CA-O 3.25Å; I115-L126 WeakPolarHBondContact CA-O 3.48Å; I115-L126 WeakPolarHBondContact CB-O 3.3Å
116	K	96.2	Very high	89.6	Confident	59 Å²	59	54.4 Å²	54.4	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.1	167.4	177.5	166.6	177	154.2	0	109.8	E71 I72 W125 L126 V128	E71-K116 HydrophobicContact CB-CG 4.43Å; E71-K116 CarbonylContact O-C 3.57Å; E71-K116 WeakPolarHBondContact O-CA 3.3Å; E71-K116 WeakPolarHBondContact OE2-CE 3.38Å; E71-K116 IonicContact OE2-NZ 2.75Å; E71-K116 PolarHBondContact OE2-NZ 3.21Å; I72-K116 HydrophobicContact CD1-CB 3.77Å; I72-K116 HydrophobicContact CD1-CD 4.23Å; I72-K116 HydrophobicContact CD1-CG 3.97Å; K116-W125 CarbonylContact O-C 3.51Å; K116-W125 VanDerWaalsContact O-CA 3.31Å; K116-W125 WeakPolarHBondContact O-CA 3.37Å; K116-L126 PolarHBondContact N-O 3.13Å; K116-L126 PolarHBondContact O-N 3.14Å; K116-V128 HydrophobicContact CB-CG2 3.6Å
117	R	96	Very high	90.2	Very high	61 Å²	61	55.4 Å²	55.4	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	142.2	168.5	-69.5	-72.9	179.3	-166.7	-8.6	109.7	D59 S60 E71 E73 Y75	D59-R117 PolarHBondContact O-NH1 2.92Å; S60-R117 PolarHBondContact OG-NH1 3.45Å; S60-R117 PolarHBondContact OG-NH2 2.51Å; E71-R117 HydrophobicContact CB-CB 4.42Å; E71-R117 PolarHBondContact O-N 2.86Å; E73-R117 VanDerWaalsContact CD-NE 3.26Å; E73-R117 IonicContact OE1-CZ 2.73Å; E73-R117 IonicContact OE1-NE 3.31Å; E73-R117 PolarHBondContact OE1-NE 2.69Å; E73-R117 IonicContact OE1-NH2 2.8Å; E73-R117 IonicContact OE2-CZ 2.96Å; E73-R117 IonicContact OE2-NE 3.29Å; E73-R117 PolarHBondContact OE2-NE 3.38Å; E73-R117 IonicContact OE2-NH2 3.51Å; E73-R117 PolarHBondContact OE2-NH2 3.25Å; Y75-R117 PolarHBondContact OH-NH2 2.81Å
118	T	93.1	Very high	91	Very high	28 Å²	28	51.3 Å²	51.3	17%	0.172	26%	0.257	C	S	.	.			trans	-148.9	135.1	177.6	168.6	0	0	0	0	109.5	K120 K123 K124 L126	T118-K120 PolarHBondContact OG1-N 2.78Å; T118-K120 PolarHBondContact OG1-O 2.91Å; T118-K123 VanDerWaalsContact CG2-O 3.24Å; T118-K123 WeakPolarHBondContact CG2-O 3.37Å; T118-K124 PolarHBondContact N-O 2.95Å; T118-K124 CarbonylContact O-C 3.47Å; T118-L126 HydrophobicContact CG2-CD1 4.19Å; T118-L126 HydrophobicContact CG2-CD2 4.44Å; T118-L126 HydrophobicContact CG2-CG 3.8Å
119	T	88.6	Confident	91.7	Very high	140 Å²	140	51 Å²	51	86%	0.859	26%	0.255	S	S	*	.			trans	-91.3	-10.2	169.5	53.8	0	0	0	0	111.7	G121	T119-G121 PolarHBondContact O-N 2.91Å
120	K	82.5	Confident	92.1	Very high	175 Å²	175	50.2 Å²	50.2	76%	0.761	25%	0.251	S	S	*	.	S	Bend	trans	-80.8	119.7	-177.8	-60.9	-170.6	-179.9	-174.2	0	111.4	T118	T118-K120 PolarHBondContact OG1-N 2.78Å; T118-K120 PolarHBondContact OG1-O 2.91Å
121	G	77.7	Confident	92.4	Very high	68 Å²	68	48.6 Å²	48.6	70%	0.701	24%	0.244	S	C	*	.	S	Bend	trans	76.2	-173.8	176.8	0	0	0	0	0	113.8	T119 K123	T119-G121 PolarHBondContact O-N 2.91Å; G121-K123 PolarHBondContact O-N 3.27Å
122	R	78.3	Confident	92.3	Very high	193 Å²	193	48.7 Å²	48.7	73%	0.728	25%	0.245	S	C	*	.	S	Bend	trans	-66.8	4	-177.9	-61.6	-173.3	-73.7	-175.4	-3.2	114.6
123	K	85.6	Confident	92	Very high	119 Å²	119	49.1 Å²	49.1	52%	0.517	25%	0.247	S	C	.	.			trans	-110.6	117.8	-167.5	-77.8	-163.9	-179.3	171.6	0	108.4	R3 T118 G121 L126	R3-K123 VanDerWaalsContact NH1-CA 3.3Å; T118-K123 VanDerWaalsContact CG2-O 3.24Å; T118-K123 WeakPolarHBondContact CG2-O 3.37Å; G121-K123 PolarHBondContact O-N 3.27Å; K123-L126 HydrophobicContact CD-CD2 3.96Å
124	K	90.8	Very high	91.4	Very high	88 Å²	88	49.4 Å²	49.4	38%	0.383	25%	0.249	S	C	.	.	S	Bend	trans	-81.4	-24.7	178.6	-60.4	-159.2	-173	174.5	0	114.5	D59 T118	D59-K124 HydrophobicContact CB-CD 4.05Å; D59-K124 VanDerWaalsContact OD1-CD 3.25Å; D59-K124 WeakPolarHBondContact OD1-CD 3.32Å; D59-K124 WeakPolarHBondContact OD1-CE 3.23Å; D59-K124 IonicContact OD1-NZ 2.69Å; D59-K124 PolarHBondContact OD1-NZ 3.45Å; D59-K124 VanDerWaalsContact OD1-NZ 3.09Å; D59-K124 IonicContact OD2-NZ 3.59Å; D59-K124 PolarHBondContact OD2-NZ 3.23Å; T118-K124 PolarHBondContact N-O 2.95Å; T118-K124 CarbonylContact O-C 3.47Å
125	W	95	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	141.1	-178.2	63	-91.3	0	0	0	113.2	L2 R3 F57 R58 P61 F85 I115 K116 P127	L2-W125 HydrophobicContact CB-CH2 4.24Å; R3-W125 HydrophobicContact CG-CH2 4.06Å; R3-W125 HydrophobicContact CG-CZ2 3.48Å; R3-W125 VanDerWaalsContact CG-CZ2 3.48Å; R3-W125 PolarHBondContact NE-O 3.09Å; R3-W125 PolarHBondContact NH2-O 2.95Å; F57-W125 PolarHBondContact O-NE1 2.95Å; R58-W125 PolarHBondContact O-NE1 3.21Å; P61-W125 HydrophobicContact CB-CH2 4.35Å; P61-W125 HydrophobicContact CB-CZ2 4.34Å; P61-W125 HydrophobicContact CG-CD2 4.07Å; P61-W125 HydrophobicContact CG-CE3 4.03Å; P61-W125 HydrophobicContact CG-CH2 3.95Å; P61-W125 HydrophobicContact CG-CZ2 3.96Å; P61-W125 HydrophobicContact CG-CZ3 3.99Å; F85-W125 HydrophobicContact CE2-CH2 4.28Å; I115-W125 HydrophobicContact CB-CE3 4.18Å; I115-W125 HydrophobicContact CD1-CB 3.68Å; I115-W125 HydrophobicContact CD1-CG 4.26Å; I115-W125 HydrophobicContact CG2-CD2 4.48Å; I115-W125 HydrophobicContact CG2-CE3 3.6Å; I115-W125 HydrophobicContact CG2-CZ3 3.89Å; K116-W125 CarbonylContact O-C 3.51Å; K116-W125 VanDerWaalsContact O-CA 3.31Å; K116-W125 WeakPolarHBondContact O-CA 3.37Å; W125-P127 HydrophobicContact CZ3-CB 4.01Å; W125-P127 HydrophobicContact CZ3-CG 4.31Å
126	L	93.5	Very high	89	Confident	49 Å²	49	52.4 Å²	52.4	26%	0.257	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.5	176.5	-60.6	173.8	0	0	0	109.9	I115 K116 T118 K123 V128 F157	I115-L126 CarbonylContact C-O 3.53Å; I115-L126 VanDerWaalsContact CA-O 3.25Å; I115-L126 WeakPolarHBondContact CA-O 3.48Å; I115-L126 WeakPolarHBondContact CB-O 3.3Å; K116-L126 PolarHBondContact N-O 3.13Å; K116-L126 PolarHBondContact O-N 3.14Å; T118-L126 HydrophobicContact CG2-CD1 4.19Å; T118-L126 HydrophobicContact CG2-CD2 4.44Å; T118-L126 HydrophobicContact CG2-CG 3.8Å; K123-L126 HydrophobicContact CD-CD2 3.96Å; L126-V128 PolarHBondContact O-N 3.46Å; L126-F157 HydrophobicContact CB-CE2 4.45Å; L126-F157 HydrophobicContact CB-CZ 3.95Å; L126-F157 HydrophobicContact CD1-CZ 3.98Å
127	P	93.4	Very high	86.8	Confident	35 Å²	35	53.6 Å²	53.6	23%	0.227	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	124.6	168.2	27.7	-31.6	0	0	0	108.8	L2 W125 M154 F157	L2-P127 HydrophobicContact CD1-CB 3.92Å; L2-P127 HydrophobicContact CD1-CG 4.19Å; W125-P127 HydrophobicContact CZ3-CB 4.01Å; W125-P127 HydrophobicContact CZ3-CG 4.31Å; P127-M154 HydrophobicContact CB-CE 4.34Å; P127-F157 WeakPolarHBondContact O-CE2 3.44Å
128	V	95.7	Very high	84.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-41.1	-179.5	177.2	0	0	0	0	110.4	L114 K116 L126 M154 F157 Y162	L114-V128 HydrophobicContact CB-CB 4.38Å; L114-V128 HydrophobicContact CD2-CB 3.96Å; L114-V128 HydrophobicContact CD2-CG1 3.59Å; L114-V128 HydrophobicContact CG-CB 3.94Å; L114-V128 HydrophobicContact CG-CG1 4.13Å; L114-V128 WeakPolarHBondContact O-CB 3.42Å; L114-V128 PolarHBondContact O-N 2.93Å; K116-V128 HydrophobicContact CB-CG2 3.6Å; L126-V128 PolarHBondContact O-N 3.46Å; V128-M154 VanDerWaalsContact O-CB 3.3Å; V128-M154 WeakPolarHBondContact O-CB 3.46Å; V128-M154 VanDerWaalsContact O-CG 3.28Å; V128-M154 WeakPolarHBondContact O-CG 3.35Å; V128-M154 PolarHBondContact O-N 3.48Å; V128-F157 HydrophobicContact CB-CD2 4.47Å; V128-F157 HydrophobicContact CB-CG 4.42Å; V128-F157 HydrophobicContact CG1-CB 3.82Å; V128-F157 HydrophobicContact CG1-CD1 4.31Å; V128-F157 HydrophobicContact CG1-CD2 4.43Å; V128-F157 HydrophobicContact CG1-CG 3.95Å; V128-F157 HydrophobicContact CG2-CD1 4.31Å; V128-F157 HydrophobicContact CG2-CD2 4.49Å; V128-F157 HydrophobicContact CG2-CE1 4.3Å; V128-F157 HydrophobicContact CG2-CE2 4.45Å; V128-F157 HydrophobicContact CG2-CG 4.4Å; V128-F157 HydrophobicContact CG2-CZ 4.36Å; V128-Y162 HydrophobicContact CG1-CD1 3.83Å; V128-Y162 HydrophobicContact CG1-CD2 3.57Å; V128-Y162 HydrophobicContact CG1-CE1 4.24Å; V128-Y162 HydrophobicContact CG1-CE2 4.01Å; V128-Y162 HydrophobicContact CG1-CG 3.45Å; V128-Y162 VanDerWaalsContact CG1-CG 3.45Å
129	G	96.4	Very high	82.7	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	179.9	-179.6	0	0	0	0	0	111.1	L114 L152	L114-G129 PolarHBondContact N-O 3.39Å; L114-G129 PolarHBondContact O-N 3.12Å; G129-L152 CarbonylContact C-O 3.55Å; G129-L152 WeakPolarHBondContact CA-O 3.41Å
130	Y	97	Very high	80.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	164.3	171.5	83.3	-75.7	0	0	0	110.6	L89 A93 F111 Y112 L152	L89-Y130 HydrophobicContact CD1-CD1 3.71Å; L89-Y130 HydrophobicContact CD1-CE1 4.05Å; L89-Y130 HydrophobicContact CD1-CG 4.1Å; L89-Y130 HydrophobicContact CD2-CD1 4.2Å; L89-Y130 HydrophobicContact CD2-CD2 3.77Å; L89-Y130 HydrophobicContact CD2-CE2 4.23Å; L89-Y130 HydrophobicContact CD2-CG 3.77Å; L89-Y130 HydrophobicContact CG-CD1 4.02Å; L89-Y130 HydrophobicContact CG-CD2 4.28Å; L89-Y130 HydrophobicContact CG-CE1 4.11Å; L89-Y130 HydrophobicContact CG-CE2 4.37Å; L89-Y130 HydrophobicContact CG-CG 4.11Å; A93-Y130 HydrophobicContact CB-CE1 3.63Å; A93-Y130 WeakPolarHBondContact CB-OH 3.48Å; F111-Y130 HydrophobicContact CD1-CD2 4.02Å; F111-Y130 AromaticContact CD1-CE2 3.92Å; F111-Y130 HydrophobicContact CD1-CE2 3.92Å; F111-Y130 HydrophobicContact CE1-CE2 4.26Å; Y112-Y130 CarbonylContact O-C 3.56Å; Y112-Y130 WeakPolarHBondContact O-CA 3.44Å; Y112-Y130 VanDerWaalsContact O-CB 3.31Å; Y112-Y130 WeakPolarHBondContact O-CB 3.43Å; Y130-L152 HydrophobicContact CD1-CB 3.8Å; Y130-L152 HydrophobicContact CD1-CD2 4.3Å; Y130-L152 HydrophobicContact CE1-CB 3.55Å; Y130-L152 HydrophobicContact CE1-CD2 3.89Å; Y130-L152 HydrophobicContact CE1-CG 4.38Å; Y130-L152 PolarHBondContact N-O 3.01Å; Y130-L152 PolarHBondContact O-N 3.18Å
131	F	95.9	Very high	78.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153	154.8	72.2	-88.8	0	0	0	112.1	Y112 K133 L148 C150 L151 L166 F169 I173	Y112-F131 HydrophobicContact CD1-CZ 4.22Å; Y112-F131 AromaticContact CD2-CD2 3.95Å; Y112-F131 HydrophobicContact CD2-CD2 3.95Å; Y112-F131 HydrophobicContact CD2-CE1 4.06Å; Y112-F131 AromaticContact CD2-CE2 3.25Å; Y112-F131 HydrophobicContact CD2-CE2 3.25Å; Y112-F131 AromaticContact CD2-CZ 3.31Å; Y112-F131 HydrophobicContact CD2-CZ 3.31Å; Y112-F131 AromaticContact CE2-CE2 3.84Å; Y112-F131 HydrophobicContact CE2-CE2 3.84Å; Y112-F131 HydrophobicContact CE2-CZ 4Å; Y112-F131 HydrophobicContact CG-CD1 4.5Å; Y112-F131 AromaticContact CG-CE1 3.8Å; Y112-F131 HydrophobicContact CG-CE1 3.8Å; Y112-F131 AromaticContact CG-CE2 3.88Å; Y112-F131 HydrophobicContact CG-CE2 3.88Å; Y112-F131 AromaticContact CG-CZ 3.43Å; Y112-F131 HydrophobicContact CG-CZ 3.43Å; Y112-F131 VanDerWaalsContact CG-CZ 3.43Å; Y112-F131 PolarHBondContact N-O 3.12Å; Y112-F131 PolarHBondContact O-N 2.85Å; F131-K133 HydrophobicContact CD2-CB 4.4Å; F131-K133 HydrophobicContact CE2-CB 4.1Å; F131-L148 HydrophobicContact CB-CD1 3.45Å; F131-L148 VanDerWaalsContact CB-CD1 3.45Å; F131-L148 HydrophobicContact CB-CG 3.88Å; F131-L148 HydrophobicContact CD1-CD1 4.34Å; F131-L148 HydrophobicContact CD2-CB 4.49Å; F131-L148 HydrophobicContact CD2-CD1 3.76Å; F131-L148 HydrophobicContact CD2-CG 3.98Å; F131-L148 HydrophobicContact CG-CD1 3.61Å; F131-L148 HydrophobicContact CG-CG 4.19Å; F131-C150 CarbonylContact C-O 3.59Å; F131-C150 WeakPolarHBondContact CA-O 3.34Å; F131-C150 VanDerWaalsContact CB-O 3.23Å; F131-C150 WeakPolarHBondContact CB-O 3.29Å; F131-L151 HydrophobicContact CB-CD1 4.11Å; F131-L166 HydrophobicContact CD1-CB 4.29Å; F131-L166 HydrophobicContact CD1-CD2 4.01Å; F131-L166 HydrophobicContact CE1-CD2 4.39Å; F131-F169 AromaticContact CE1-CD1 3.89Å; F131-F169 HydrophobicContact CE1-CD1 3.89Å; F131-F169 AromaticContact CZ-CD1 3.95Å; F131-F169 HydrophobicContact CZ-CD1 3.95Å; F131-I173 HydrophobicContact CZ-CD1 4.1Å
132	S	93.2	Very high	77.3	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	142.4	167.4	55.8	0	0	0	0	110.1	F110 S149 C150	F110-S132 CarbonylContact O-C 3.53Å; F110-S132 WeakPolarHBondContact O-CA 3.5Å; S132-S149 PolarHBondContact O-N 3.31Å; S132-S149 WeakPolarHBondContact OG-CB 3.38Å; S132-C150 PolarHBondContact N-O 3.24Å; S132-C150 WeakPolarHBondContact OG-CB 3.45Å; S132-C150 PolarHBondContact OG-N 2.64Å; S132-C150 VanDerWaalsContact OG-N 3.11Å
133	K	89.8	Confident	76.2	Confident	11 Å²	11	52.3 Å²	52.3	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.3	173.7	175.6	173.5	179.2	168.4	0	108.9	F109 F110 Y112 F131 R135 N147	F109-K133 CarbonylContact C-O 3.52Å; F109-K133 VanDerWaalsContact CA-O 3.31Å; F109-K133 WeakPolarHBondContact CA-O 3.38Å; F110-K133 PolarHBondContact N-O 3.45Å; F110-K133 PolarHBondContact O-N 2.81Å; Y112-K133 HydrophobicContact CD2-CB 4.42Å; Y112-K133 HydrophobicContact CE2-CB 3.98Å; Y112-K133 HydrophobicContact CE2-CD 4.36Å; F131-K133 HydrophobicContact CD2-CB 4.4Å; F131-K133 HydrophobicContact CE2-CB 4.1Å; K133-R135 PolarHBondContact O-N 2.88Å; K133-N147 WeakPolarHBondContact CG-O 3.31Å
134	P	84.5	Confident	75.2	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.039	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	140.3	173.8	-23.2	32.7	0	0	0	111.9	S108 F109 Y139 I146 S149	S108-P134 CarbonylContact O-C 3.57Å; S108-P134 WeakPolarHBondContact O-CA 3.42Å; F109-P134 HydrophobicContact CD1-CG 4.39Å; F109-P134 HydrophobicContact CE1-CB 4.49Å; F109-P134 HydrophobicContact CE1-CG 4.18Å; P134-Y139 HydrophobicContact CB-CD1 4.47Å; P134-Y139 HydrophobicContact CB-CD2 3.39Å; P134-Y139 HydrophobicContact CB-CE2 3.73Å; P134-Y139 HydrophobicContact CB-CG 3.78Å; P134-Y139 HydrophobicContact CG-CD1 4.49Å; P134-Y139 HydrophobicContact CG-CD2 4.11Å; P134-Y139 HydrophobicContact CG-CE2 4.13Å; P134-Y139 HydrophobicContact CG-CG 4.27Å; P134-I146 HydrophobicContact CG-CB 4.28Å; P134-I146 HydrophobicContact CG-CG2 3.94Å; P134-S149 WeakPolarHBondContact CD-OG 3.48Å; P134-S149 VanDerWaalsContact CG-OG 3.26Å; P134-S149 WeakPolarHBondContact CG-OG 3.36Å
135	R	80.6	Confident	74.6	Confident	37 Å²	37	46.7 Å²	46.7	14%	0.14	25%	0.249	C	C	.	.			trans	-66.7	134.8	163.3	-68.2	-174.4	-172.2	-107	-19.8	107.2	D78 N107 S108 F109 F110 K133 D137 R138	D78-R135 IonicContact OD1-CZ 3.68Å; D78-R135 IonicContact OD1-NH1 3.93Å; D78-R135 IonicContact OD1-NH2 2.8Å; D78-R135 PolarHBondContact OD1-NH2 3.17Å; D78-R135 IonicContact OD2-CZ 3.35Å; D78-R135 IonicContact OD2-NH1 3.07Å; D78-R135 PolarHBondContact OD2-NH1 2.94Å; D78-R135 VanDerWaalsContact OD2-NH1 3.07Å; D78-R135 IonicContact OD2-NH2 2.73Å; D78-R135 PolarHBondContact OD2-NH2 3.12Å; N107-R135 VanDerWaalsContact O-CD 3.28Å; N107-R135 WeakPolarHBondContact O-CD 3.31Å; N107-R135 PolarHBondContact O-NE 3.3Å; S108-R135 PolarHBondContact O-N 3.48Å; F109-R135 PolarHBondContact O-NE 2.86Å; F109-R135 PolarHBondContact O-NH2 3.49Å; F110-R135 HydrophobicContact CD2-CG 3.88Å; F110-R135 HydrophobicContact CE2-CG 3.77Å; F110-R135 HydrophobicContact CZ-CG 4.34Å; K133-R135 PolarHBondContact O-N 2.88Å; R135-D137 WeakPolarHBondContact CB-OD1 3.31Å; R135-D137 PolarHBondContact O-N 3.42Å; R135-R138 PolarHBondContact O-N 3.29Å
136	G	65.1	Low	74.3	Confident	27 Å²	27	48 Å²	48	28%	0.278	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.2	179.5	0	0	0	0	0	112.2	R138 Y139 F140	G136-R138 PolarHBondContact O-N 3.13Å; G136-R138 VanDerWaalsContact O-N 3.15Å; G136-Y139 PolarHBondContact O-N 3.11Å; G136-F140 WeakPolarHBondContact O-CD1 3.34Å; G136-F140 VanDerWaalsContact O-CD2 3.26Å; G136-F140 WeakPolarHBondContact O-CD2 3.38Å; G136-F140 WeakPolarHBondContact O-CE1 3.23Å; G136-F140 WeakPolarHBondContact O-CE2 3.29Å; G136-F140 WeakPolarHBondContact O-CG 3.37Å; G136-F140 VanDerWaalsContact O-CZ 3.24Å; G136-F140 WeakPolarHBondContact O-CZ 3.49Å; G136-F140 PolarHBondContact O-N 3.33Å
137	D	51.2	Low	74.2	Confident	84 Å²	84	45.7 Å²	45.7	45%	0.449	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.8	-178	59.4	6.2	0	0	0	115.9	R135 F140	R135-D137 WeakPolarHBondContact CB-OD1 3.31Å; R135-D137 PolarHBondContact O-N 3.42Å; D137-F140 HydrophobicContact CB-CE2 4.19Å; D137-F140 HydrophobicContact CB-CZ 4.35Å; D137-F140 WeakPolarHBondContact O-CD2 3.32Å; D137-F140 WeakPolarHBondContact O-CE2 3.22Å
138	R	49	Very low	74.1	Confident	134 Å²	134	44.3 Å²	44.3	51%	0.506	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-12.4	-177.7	-64.1	-165.8	-131.7	-160.6	5	115.4	N107 S108 R135 G136	N107-R138 VanDerWaalsContact C-NH2 3.25Å; N107-R138 VanDerWaalsContact CB-NH2 3.33Å; N107-R138 PolarHBondContact O-NH2 3Å; S108-R138 WeakPolarHBondContact OG-CD 3.41Å; S108-R138 PolarHBondContact OG-NE 3.17Å; S108-R138 VanDerWaalsContact OG-NE 3.09Å; S108-R138 PolarHBondContact OG-NH1 3.4Å; S108-R138 PolarHBondContact OG-NH2 3.41Å; R135-R138 PolarHBondContact O-N 3.29Å; G136-R138 PolarHBondContact O-N 3.13Å; G136-R138 VanDerWaalsContact O-N 3.15Å
139	Y	52.7	Low	73.8	Confident	76 Å²	76	45 Å²	45	30%	0.298	24%	0.239	S	C	.	.			trans	-113	26.9	-179	-78.4	-100.4	0	0	0	111.7	P134 G136 D141 T142	P134-Y139 HydrophobicContact CB-CD1 4.47Å; P134-Y139 HydrophobicContact CB-CD2 3.39Å; P134-Y139 HydrophobicContact CB-CE2 3.73Å; P134-Y139 HydrophobicContact CB-CG 3.78Å; P134-Y139 HydrophobicContact CG-CD1 4.49Å; P134-Y139 HydrophobicContact CG-CD2 4.11Å; P134-Y139 HydrophobicContact CG-CE2 4.13Å; P134-Y139 HydrophobicContact CG-CG 4.27Å; G136-Y139 PolarHBondContact O-N 3.11Å; Y139-D141 PolarHBondContact O-N 2.91Å; Y139-D141 VanDerWaalsContact O-N 3.15Å; Y139-T142 HydrophobicContact CD1-CG2 3.86Å; Y139-T142 PolarHBondContact O-N 2.71Å; Y139-T142 PolarHBondContact O-OG1 2.96Å
140	F	45.9	Very low	73.6	Confident	78 Å²	78	46 Å²	46	34%	0.342	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.6	177.7	-69.3	-60.2	0	0	0	113.6	G136 D137 K289	G136-F140 WeakPolarHBondContact O-CD1 3.34Å; G136-F140 VanDerWaalsContact O-CD2 3.26Å; G136-F140 WeakPolarHBondContact O-CD2 3.38Å; G136-F140 WeakPolarHBondContact O-CE1 3.23Å; G136-F140 WeakPolarHBondContact O-CE2 3.29Å; G136-F140 WeakPolarHBondContact O-CG 3.37Å; G136-F140 VanDerWaalsContact O-CZ 3.24Å; G136-F140 WeakPolarHBondContact O-CZ 3.49Å; G136-F140 PolarHBondContact O-N 3.33Å; D137-F140 HydrophobicContact CB-CE2 4.19Å; D137-F140 HydrophobicContact CB-CZ 4.35Å; D137-F140 WeakPolarHBondContact O-CD2 3.32Å; D137-F140 WeakPolarHBondContact O-CE2 3.22Å; F140-K289 HydrophobicContact CE1-CB 4.05Å; F140-K289 WeakPolarHBondContact CE1-O 3.37Å; F140-K289 HydrophobicContact CZ-CB 4.19Å
141	D	39.9	Very low	73.5	Confident	154 Å²	154	47.9 Å²	47.9	82%	0.824	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-4.7	-175	-56.3	-32	0	0	0	113.5	Y139 V143	Y139-D141 PolarHBondContact O-N 2.91Å; Y139-D141 VanDerWaalsContact O-N 3.15Å; D141-V143 PolarHBondContact O-N 3.31Å; D141-V143 VanDerWaalsContact O-N 3.16Å
142	T	49.4	Very low	73.4	Confident	53 Å²	53	48.5 Å²	48.5	33%	0.325	26%	0.259	S	S	.	.			trans	-87.6	90.2	175	62.3	0	0	0	0	108.9	Y139 P144 S145	Y139-T142 HydrophobicContact CD1-CG2 3.86Å; Y139-T142 PolarHBondContact O-N 2.71Å; Y139-T142 PolarHBondContact O-OG1 2.96Å; T142-P144 CarbonylContact C-O 3.5Å; T142-P144 CarbonylContact O-C 3.55Å; T142-S145 PolarHBondContact O-N 2.96Å
143	V	55.2	Low	73.4	Confident	143 Å²	143	49.4 Å²	49.4	87%	0.867	26%	0.264	S	S	*	.	S	Bend	trans	-86.8	115.1	153.1	-179.3	0	0	0	0	105.6	D141	D141-V143 PolarHBondContact O-N 3.31Å; D141-V143 VanDerWaalsContact O-N 3.16Å
144	P	64.6	Low	73.5	Confident	58 Å²	58	49.6 Å²	49.6	38%	0.377	27%	0.265	S	S	.	.	S	Bend	cis	-86.5	157.3	9.4	34.7	-36.2	0	0	0	115.3	T142 I146 T182 L226	T142-P144 CarbonylContact C-O 3.5Å; T142-P144 CarbonylContact O-C 3.55Å; P144-I146 PolarHBondContact O-N 2.7Å; P144-T182 HydrophobicContact CB-CG2 4.3Å; P144-T182 HydrophobicContact CG-CG2 3.82Å; P144-L226 HydrophobicContact CB-CD1 3.25Å; P144-L226 HydrophobicContact CB-CD2 3.97Å; P144-L226 HydrophobicContact CB-CG 4.26Å; P144-L226 HydrophobicContact CG-CD1 3.72Å
145	S	79.7	Confident	73.6	Confident	31 Å²	31	51.5 Å²	51.5	22%	0.217	28%	0.278	C	S	.	.			trans	-62.9	126.1	-177	-170.1	0	0	0	0	112.5	T142 N147 L179 P180 G181 T182	T142-S145 PolarHBondContact O-N 2.96Å; S145-N147 PolarHBondContact O-N 3.16Å; S145-L179 WeakPolarHBondContact OG-CD2 3.44Å; S145-P180 WeakPolarHBondContact CB-O 3.25Å; S145-G181 CarbonylContact O-C 2.98Å; S145-G181 WeakPolarHBondContact O-CA 3.46Å; S145-T182 PolarHBondContact O-N 2.66Å
146	I	87.5	Confident	73.9	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.138	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	112	174.6	-57.5	-56.8	0	0	0	110.3	P134 P144 L148 T182 E184	P134-I146 HydrophobicContact CG-CB 4.28Å; P134-I146 HydrophobicContact CG-CG2 3.94Å; P144-I146 PolarHBondContact O-N 2.7Å; I146-L148 WeakPolarHBondContact CG2-O 2.98Å; I146-T182 VanDerWaalsContact CA-O 3.26Å; I146-T182 WeakPolarHBondContact CA-O 3.17Å; I146-T182 HydrophobicContact CD1-CG2 3.91Å; I146-E184 HydrophobicContact CG2-CB 4Å
147	N	90.9	Very high	75.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-15.4	179	70.4	-6.2	0	0	0	113.7	K133 S145 Y171 S174 T182	K133-N147 WeakPolarHBondContact CG-O 3.31Å; S145-N147 PolarHBondContact O-N 3.16Å; N147-Y171 WeakPolarHBondContact ND2-CD1 3.01Å; N147-Y171 VanDerWaalsContact ND2-CE1 3.28Å; N147-Y171 WeakPolarHBondContact ND2-CE1 2.87Å; N147-S174 WeakPolarHBondContact CB-OG 3.4Å; N147-S174 PolarHBondContact ND2-OG 3.38Å; N147-T182 PolarHBondContact N-O 3.2Å; N147-T182 PolarHBondContact OD1-O 3.3Å
148	L	92.6	Very high	76.9	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	129.4	-179.6	-173.4	146.2	0	0	0	110.5	F131 I146 L151 P183 E184 Y195	F131-L148 HydrophobicContact CB-CD1 3.45Å; F131-L148 VanDerWaalsContact CB-CD1 3.45Å; F131-L148 HydrophobicContact CB-CG 3.88Å; F131-L148 HydrophobicContact CD1-CD1 4.34Å; F131-L148 HydrophobicContact CD2-CB 4.49Å; F131-L148 HydrophobicContact CD2-CD1 3.76Å; F131-L148 HydrophobicContact CD2-CG 3.98Å; F131-L148 HydrophobicContact CG-CD1 3.61Å; F131-L148 HydrophobicContact CG-CG 4.19Å; I146-L148 WeakPolarHBondContact CG2-O 2.98Å; L148-L151 HydrophobicContact CD1-CB 4.28Å; L148-L151 HydrophobicContact CD2-CB 3.88Å; L148-P183 HydrophobicContact CB-CB 4.41Å; L148-P183 HydrophobicContact CD2-CB 4.41Å; L148-P183 CarbonylContact O-C 3.52Å; L148-P183 VanDerWaalsContact O-CA 3.31Å; L148-P183 WeakPolarHBondContact O-CA 3.27Å; L148-E184 PolarHBondContact O-N 3.47Å; L148-Y195 VanDerWaalsContact CD1-OH 3.3Å; L148-Y195 WeakPolarHBondContact CD1-OH 2.79Å; L148-Y195 WeakPolarHBondContact CD2-OH 3.48Å
149	S	89.8	Confident	78.7	Confident	14 Å²	14	59 Å²	59	10%	0.098	31%	0.306	C	S	.	.	S	Bend	trans	-97.7	-56.4	177.3	-80.7	0	0	0	0	113.3	F109 S132 P134 E184	F109-S149 WeakPolarHBondContact CE1-OG 3.46Å; S132-S149 PolarHBondContact O-N 3.31Å; S132-S149 WeakPolarHBondContact OG-CB 3.38Å; P134-S149 WeakPolarHBondContact CD-OG 3.48Å; P134-S149 VanDerWaalsContact CG-OG 3.26Å; P134-S149 WeakPolarHBondContact CG-OG 3.36Å; S149-E184 VanDerWaalsContact CA-OE2 3.3Å; S149-E184 WeakPolarHBondContact CA-OE2 3.4Å; S149-E184 WeakPolarHBondContact CB-OE2 3.33Å; S149-E184 PolarHBondContact OG-OE2 3.25Å
150	C	91.9	Very high	80.5	Confident	24 Å²	24	60.7 Å²	60.7	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140.1	176.5	-63.7	0	0	0	0	109.1	F131 S132	F131-C150 CarbonylContact C-O 3.59Å; F131-C150 WeakPolarHBondContact CA-O 3.34Å; F131-C150 VanDerWaalsContact CB-O 3.23Å; F131-C150 WeakPolarHBondContact CB-O 3.29Å; S132-C150 PolarHBondContact N-O 3.24Å; S132-C150 WeakPolarHBondContact OG-CB 3.45Å; S132-C150 PolarHBondContact OG-N 2.64Å; S132-C150 VanDerWaalsContact OG-N 3.11Å
151	L	94	Very high	82.7	Confident	39 Å²	39	57.8 Å²	57.8	20%	0.204	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130	172.9	174.1	65.9	0	0	0	108.4	F131 L148 L166 I167	F131-L151 HydrophobicContact CB-CD1 4.11Å; L148-L151 HydrophobicContact CD1-CB 4.28Å; L148-L151 HydrophobicContact CD2-CB 3.88Å; L151-L166 HydrophobicContact CD1-CB 3.65Å; L151-L166 HydrophobicContact CD1-CD1 3.69Å; L151-L166 HydrophobicContact CD1-CG 4.32Å; L151-I167 HydrophobicContact CD2-CD1 3.89Å; L151-I167 HydrophobicContact CD2-CG1 3.67Å
152	L	93.9	Very high	85.3	Confident	14 Å²	14	51.4 Å²	51.4	7%	0.073	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.8	172.1	-178.8	65.2	0	0	0	109.8	F92 A93 L96 I97 G129 Y130 M154	F92-L152 HydrophobicContact CD1-CD2 4.17Å; F92-L152 HydrophobicContact CE1-CD2 4.27Å; A93-L152 HydrophobicContact CB-CD2 3.89Å; L96-L152 HydrophobicContact CB-CD1 3.95Å; L96-L152 HydrophobicContact CD1-CD1 4.02Å; L96-L152 HydrophobicContact CD1-CD2 4.13Å; I97-L152 HydrophobicContact CD1-CB 4.09Å; I97-L152 HydrophobicContact CD1-CD1 4.33Å; I97-L152 HydrophobicContact CG1-CD1 4.23Å; G129-L152 CarbonylContact C-O 3.55Å; G129-L152 WeakPolarHBondContact CA-O 3.41Å; Y130-L152 HydrophobicContact CD1-CB 3.8Å; Y130-L152 HydrophobicContact CD1-CD2 4.3Å; Y130-L152 HydrophobicContact CE1-CB 3.55Å; Y130-L152 HydrophobicContact CE1-CD2 3.89Å; Y130-L152 HydrophobicContact CE1-CG 4.38Å; Y130-L152 PolarHBondContact N-O 3.01Å; Y130-L152 PolarHBondContact O-N 3.18Å; L152-M154 HydrophobicContact CD2-CE 4.16Å
153	V	93.8	Very high	87.5	Confident	21 Å²	21	49.7 Å²	49.7	13%	0.127	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.1	159.7	-179.2	0	0	0	0	107	F157 M158 G163 L166	V153-F157 HydrophobicContact CG1-CB 4.1Å; V153-M158 HydrophobicContact CB-CG 4.34Å; V153-M158 HydrophobicContact CG1-CG 4.18Å; V153-G163 VanDerWaalsContact CG2-CA 3.5Å; V153-L166 HydrophobicContact CG2-CD1 4.45Å
154	M	91.3	Very high	89.5	Confident	15 Å²	15	44.3 Å²	44.3	7%	0.074	23%	0.228	C	C	.	.			trans	-58.3	138.5	179	-64.5	-74	164.4	0	0	109.5	F92 P127 V128 L152 L156 F157 M158	F92-M154 HydrophobicContact CD1-CE 3.75Å; F92-M154 HydrophobicContact CD1-SD 3.97Å; F92-M154 HydrophobicContact CE1-CE 3.59Å; F92-M154 HydrophobicContact CE1-SD 3.16Å; F92-M154 WeakPolarHBondContact CE1-SD 3.42Å; F92-M154 HydrophobicContact CZ-CE 4.49Å; F92-M154 HydrophobicContact CZ-SD 3.71Å; P127-M154 HydrophobicContact CB-CE 4.34Å; V128-M154 VanDerWaalsContact O-CB 3.3Å; V128-M154 WeakPolarHBondContact O-CB 3.46Å; V128-M154 VanDerWaalsContact O-CG 3.28Å; V128-M154 WeakPolarHBondContact O-CG 3.35Å; V128-M154 PolarHBondContact O-N 3.48Å; L152-M154 HydrophobicContact CD2-CE 4.16Å; M154-L156 VanDerWaalsContact C-N 3.26Å; M154-L156 PolarHBondContact O-N 3.43Å; M154-L156 VanDerWaalsContact O-N 3.07Å; M154-F157 HydrophobicContact CB-CD2 3.91Å; M154-F157 WeakPolarHBondContact O-CA 3.22Å; M154-F157 PolarHBondContact O-N 3.39Å; M154-M158 PolarHBondContact O-N 2.83Å
155	P	87.2	Confident	91	Very high	47 Å²	47	41.7 Å²	41.7	31%	0.305	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-49.9	-40.9	-173.1	-32.7	36.4	0	0	0	115	F23 L96 F157 M158	F23-P155 HydrophobicContact CE1-CB 3.87Å; F23-P155 HydrophobicContact CE1-CG 4.5Å; L96-P155 HydrophobicContact CD1-CG 4.18Å; L96-P155 HydrophobicContact CD2-CG 4.48Å; P155-F157 PolarHBondContact O-N 3.27Å; P155-F157 VanDerWaalsContact O-N 3.08Å; P155-M158 PolarHBondContact O-N 2.87Å
156	L	87	Confident	91.9	Very high	135 Å²	135	40.2 Å²	40.2	71%	0.707	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-63	-16	178.6	-61.3	175.9	0	0	0	114.5	M154 K160	M154-L156 VanDerWaalsContact C-N 3.26Å; M154-L156 PolarHBondContact O-N 3.43Å; M154-L156 VanDerWaalsContact O-N 3.07Å; L156-K160 PolarHBondContact O-NZ 3.38Å
157	F	90.9	Very high	92.4	Very high	28 Å²	28	38.9 Å²	38.9	12%	0.123	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-117.5	2.3	-176.4	-60.2	-78.3	0	0	0	113.2	L126 P127 V128 V153 M154 P155 Y162	L126-F157 HydrophobicContact CB-CE2 4.45Å; L126-F157 HydrophobicContact CB-CZ 3.95Å; L126-F157 HydrophobicContact CD1-CZ 3.98Å; P127-F157 WeakPolarHBondContact O-CE2 3.44Å; V128-F157 HydrophobicContact CB-CD2 4.47Å; V128-F157 HydrophobicContact CB-CG 4.42Å; V128-F157 HydrophobicContact CG1-CB 3.82Å; V128-F157 HydrophobicContact CG1-CD1 4.31Å; V128-F157 HydrophobicContact CG1-CD2 4.43Å; V128-F157 HydrophobicContact CG1-CG 3.95Å; V128-F157 HydrophobicContact CG2-CD1 4.31Å; V128-F157 HydrophobicContact CG2-CD2 4.49Å; V128-F157 HydrophobicContact CG2-CE1 4.3Å; V128-F157 HydrophobicContact CG2-CE2 4.45Å; V128-F157 HydrophobicContact CG2-CG 4.4Å; V128-F157 HydrophobicContact CG2-CZ 4.36Å; V153-F157 HydrophobicContact CG1-CB 4.1Å; M154-F157 HydrophobicContact CB-CD2 3.91Å; M154-F157 WeakPolarHBondContact O-CA 3.22Å; M154-F157 PolarHBondContact O-N 3.39Å; P155-F157 PolarHBondContact O-N 3.27Å; P155-F157 VanDerWaalsContact O-N 3.08Å; F157-Y162 HydrophobicContact CB-CD2 3.87Å; F157-Y162 HydrophobicContact CB-CE2 4.13Å; F157-Y162 AromaticContact CD1-CE2 4Å; F157-Y162 HydrophobicContact CD1-CE2 4Å; F157-Y162 WeakPolarHBondContact O-CD2 3.39Å
158	M	88.6	Confident	92.7	Very high	82 Å²	82	39 Å²	39	40%	0.404	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	155.4	175.2	-67.5	-178.6	77.9	0	0	111.5	V153 M154 P155 K160	V153-M158 HydrophobicContact CB-CG 4.34Å; V153-M158 HydrophobicContact CG1-CG 4.18Å; M154-M158 PolarHBondContact O-N 2.83Å; P155-M158 PolarHBondContact O-N 2.87Å; M158-K160 PolarHBondContact O-N 2.98Å; M158-K160 VanDerWaalsContact O-N 3.09Å
159	R	85.7	Confident	92.9	Very high	195 Å²	195	38.8 Å²	38.8	74%	0.736	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	14.2	178.1	-50.6	-63.4	-178.1	164.1	0	115.9
160	K	90.4	Very high	93.2	Very high	111 Å²	111	38.1 Å²	38.1	48%	0.483	19%	0.189	S	C	.	.	S	Bend	trans	-105.2	16.1	176.5	-63.1	174.3	-175.1	167.9	0	114.3	L156 M158 Y162 K272	L156-K160 PolarHBondContact O-NZ 3.38Å; M158-K160 PolarHBondContact O-N 2.98Å; M158-K160 VanDerWaalsContact O-N 3.09Å; K160-Y162 HydrophobicContact CB-CD2 3.81Å; K160-Y162 HydrophobicContact CB-CE2 3.69Å; K160-Y162 HydrophobicContact CD-CE2 4.24Å; K160-Y162 PolarHBondContact O-N 2.86Å; K160-K272 VanDerWaalsContact O-CE 3.29Å; K160-K272 WeakPolarHBondContact O-CE 3.47Å
161	G	92.5	Very high	93.4	Very high	17 Å²	17	37 Å²	37	18%	0.175	18%	0.181	C	C	.	.	S	Bend	trans	86.1	-9.7	179.7	0	0	0	0	0	115.9	G163 R164 L165	G161-G163 VanDerWaalsContact C-N 3.34Å; G161-G163 PolarHBondContact O-N 3.44Å; G161-R164 WeakPolarHBondContact O-CB 3.08Å; G161-R164 PolarHBondContact O-N 3.5Å; G161-R164 VanDerWaalsContact O-N 3.15Å; G161-L165 PolarHBondContact O-N 2.9Å; G161-L165 VanDerWaalsContact O-N 3.08Å
162	Y	95.2	Very high	93.5	Very high	19 Å²	19	35.9 Å²	35.9	8%	0.075	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-31.6	-176.9	-61.7	-62	0	0	0	114.7	I72 L114 V128 F157 K160 R164 L165 L166 K272	I72-Y162 HydrophobicContact CD1-CE1 3.67Å; I72-Y162 HydrophobicContact CG1-CE1 4.28Å; L114-Y162 HydrophobicContact CD2-CD1 3.8Å; L114-Y162 HydrophobicContact CD2-CG 4.11Å; V128-Y162 HydrophobicContact CG1-CD1 3.83Å; V128-Y162 HydrophobicContact CG1-CD2 3.57Å; V128-Y162 HydrophobicContact CG1-CE1 4.24Å; V128-Y162 HydrophobicContact CG1-CE2 4.01Å; V128-Y162 HydrophobicContact CG1-CG 3.45Å; V128-Y162 VanDerWaalsContact CG1-CG 3.45Å; F157-Y162 HydrophobicContact CB-CD2 3.87Å; F157-Y162 HydrophobicContact CB-CE2 4.13Å; F157-Y162 AromaticContact CD1-CE2 4Å; F157-Y162 HydrophobicContact CD1-CE2 4Å; F157-Y162 WeakPolarHBondContact O-CD2 3.39Å; K160-Y162 HydrophobicContact CB-CD2 3.81Å; K160-Y162 HydrophobicContact CB-CE2 3.69Å; K160-Y162 HydrophobicContact CD-CE2 4.24Å; K160-Y162 PolarHBondContact O-N 2.86Å; Y162-R164 VanDerWaalsContact C-N 3.35Å; Y162-L165 PolarHBondContact O-N 3.49Å; Y162-L166 WeakPolarHBondContact O-CG 3.5Å; Y162-L166 PolarHBondContact O-N 2.97Å; Y162-K272 HydrophobicContact CD1-CD 4.01Å; Y162-K272 HydrophobicContact CE1-CD 4.1Å
163	G	95.5	Very high	93.5	Very high	17 Å²	17	35.2 Å²	35.2	18%	0.175	17%	0.172	C	C	.	.	H	α-helix	trans	-64.4	-41.6	174	0	0	0	0	0	111.8	V153 G161 L166 I167	V153-G163 VanDerWaalsContact CG2-CA 3.5Å; G161-G163 VanDerWaalsContact C-N 3.34Å; G161-G163 PolarHBondContact O-N 3.44Å; G163-L166 PolarHBondContact O-N 3.46Å; G163-I167 VanDerWaalsContact O-CG1 3.3Å; G163-I167 WeakPolarHBondContact O-CG1 3.41Å; G163-I167 PolarHBondContact O-N 3.19Å; G163-I167 VanDerWaalsContact O-N 3.07Å
164	R	96	Very high	93.4	Very high	30 Å²	30	34.4 Å²	34.4	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-46	174.2	-171.1	-175.6	-176.5	-67.7	-16.8	111	G161 Y162 L166 I167 D168 Y198 D201 Y271 K272	G161-R164 WeakPolarHBondContact O-CB 3.08Å; G161-R164 PolarHBondContact O-N 3.5Å; G161-R164 VanDerWaalsContact O-N 3.15Å; Y162-R164 VanDerWaalsContact C-N 3.35Å; R164-L166 VanDerWaalsContact C-N 3.34Å; R164-L166 PolarHBondContact O-N 2.9Å; R164-I167 PolarHBondContact O-N 3.48Å; R164-D168 VanDerWaalsContact O-CB 3.3Å; R164-D168 WeakPolarHBondContact O-CB 3.32Å; R164-D168 PolarHBondContact O-N 3.26Å; R164-Y198 HydrophobicContact CG-CD2 4.08Å; R164-D201 IonicContact CZ-OD2 2.8Å; R164-D201 IonicContact NE-OD2 3Å; R164-D201 PolarHBondContact NE-OD2 2.98Å; R164-D201 IonicContact NH2-OD2 2.92Å; R164-Y271 VanDerWaalsContact CZ-OH 3.31Å; R164-Y271 PolarHBondContact NH2-OH 3.05Å; R164-K272 PolarHBondContact NH1-O 3.31Å
165	L	96.9	Very high	93.4	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-58.1	-43.7	178.1	-172.8	71.5	0	0	0	112.4	I72 L114 G161 Y162 D168 F169 K272 I274	I72-L165 HydrophobicContact CG2-CD2 4.13Å; L114-L165 HydrophobicContact CD1-CD2 4Å; L114-L165 HydrophobicContact CD2-CD2 4.38Å; G161-L165 PolarHBondContact O-N 2.9Å; G161-L165 VanDerWaalsContact O-N 3.08Å; Y162-L165 PolarHBondContact O-N 3.49Å; L165-D168 PolarHBondContact O-N 2.75Å; L165-F169 PolarHBondContact O-N 2.72Å; L165-K272 HydrophobicContact CB-CB 4.17Å; L165-K272 HydrophobicContact CD1-CB 4.28Å; L165-I274 HydrophobicContact CD1-CD1 3.5Å; L165-I274 HydrophobicContact CD1-CG1 3.98Å; L165-I274 HydrophobicContact CG-CD1 3.96Å
166	L	97.9	Very high	93.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-40.6	178.1	-75.4	176	0	0	0	112.7	L114 F131 L151 V153 Y162 G163 R164 D168 F169 S170	L114-L166 HydrophobicContact CB-CD1 4.36Å; L114-L166 HydrophobicContact CB-CD2 3.72Å; L114-L166 HydrophobicContact CB-CG 4.3Å; L114-L166 HydrophobicContact CD2-CD1 4.31Å; L114-L166 HydrophobicContact CD2-CD2 4.27Å; L114-L166 HydrophobicContact CD2-CG 4.07Å; L114-L166 HydrophobicContact CG-CD2 4.46Å; F131-L166 HydrophobicContact CD1-CB 4.29Å; F131-L166 HydrophobicContact CD1-CD2 4.01Å; F131-L166 HydrophobicContact CE1-CD2 4.39Å; L151-L166 HydrophobicContact CD1-CB 3.65Å; L151-L166 HydrophobicContact CD1-CD1 3.69Å; L151-L166 HydrophobicContact CD1-CG 4.32Å; V153-L166 HydrophobicContact CG2-CD1 4.45Å; Y162-L166 WeakPolarHBondContact O-CG 3.5Å; Y162-L166 PolarHBondContact O-N 2.97Å; G163-L166 PolarHBondContact O-N 3.46Å; R164-L166 VanDerWaalsContact C-N 3.34Å; R164-L166 PolarHBondContact O-N 2.9Å; L166-D168 VanDerWaalsContact C-N 3.33Å; L166-F169 PolarHBondContact O-N 3.43Å; L166-S170 PolarHBondContact O-N 2.89Å; L166-S170 VanDerWaalsContact O-N 3.14Å
167	I	97.8	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-43.7	173.5	-66.7	168.1	0	0	0	109.8	L151 G163 R164 F169 S170 Y171 A194 Y195 Y198	L151-I167 HydrophobicContact CD2-CD1 3.89Å; L151-I167 HydrophobicContact CD2-CG1 3.67Å; G163-I167 VanDerWaalsContact O-CG1 3.3Å; G163-I167 WeakPolarHBondContact O-CG1 3.41Å; G163-I167 PolarHBondContact O-N 3.19Å; G163-I167 VanDerWaalsContact O-N 3.07Å; R164-I167 PolarHBondContact O-N 3.48Å; I167-F169 VanDerWaalsContact C-N 3.32Å; I167-F169 PolarHBondContact O-N 2.98Å; I167-S170 PolarHBondContact O-N 3.45Å; I167-S170 VanDerWaalsContact O-N 3.12Å; I167-S170 PolarHBondContact O-OG 2.58Å; I167-Y171 HydrophobicContact CG2-CD2 3.87Å; I167-Y171 HydrophobicContact CG2-CE2 3.88Å; I167-Y171 WeakPolarHBondContact O-CD2 3.4Å; I167-Y171 PolarHBondContact O-N 2.96Å; I167-Y171 VanDerWaalsContact O-N 3.15Å; I167-A194 HydrophobicContact CD1-CB 3.87Å; I167-Y195 HydrophobicContact CD1-CD1 4.49Å; I167-Y195 HydrophobicContact CD1-CD2 4.21Å; I167-Y195 HydrophobicContact CD1-CE1 4.38Å; I167-Y195 HydrophobicContact CD1-CE2 4.09Å; I167-Y195 HydrophobicContact CD1-CG 4.4Å; I167-Y195 HydrophobicContact CG1-CE1 4.21Å; I167-Y195 HydrophobicContact CG1-CE2 4.24Å; I167-Y195 HydrophobicContact CG2-CD1 4.11Å; I167-Y195 HydrophobicContact CG2-CE1 3.67Å; I167-Y198 HydrophobicContact CB-CD2 4.36Å; I167-Y198 HydrophobicContact CB-CG 4.38Å; I167-Y198 HydrophobicContact CG2-CD1 3.51Å; I167-Y198 HydrophobicContact CG2-CD2 3.82Å; I167-Y198 HydrophobicContact CG2-CE1 3.9Å; I167-Y198 HydrophobicContact CG2-CE2 4.18Å; I167-Y198 HydrophobicContact CG2-CG 3.47Å; I167-Y198 VanDerWaalsContact CG2-CG 3.47Å
168	D	97.5	Very high	93.2	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-39.4	-179.5	-163.8	37.9	0	0	0	112.5	R164 L165 L166 S170 Y171 F172 Y198 E273 I274	R164-D168 VanDerWaalsContact O-CB 3.3Å; R164-D168 WeakPolarHBondContact O-CB 3.32Å; R164-D168 PolarHBondContact O-N 3.26Å; L165-D168 PolarHBondContact O-N 2.75Å; L166-D168 VanDerWaalsContact C-N 3.33Å; D168-S170 VanDerWaalsContact C-N 3.34Å; D168-S170 PolarHBondContact O-N 2.93Å; D168-Y171 PolarHBondContact O-N 3Å; D168-F172 PolarHBondContact O-N 3.22Å; D168-Y198 HydrophobicContact CB-CE2 3.61Å; D168-Y198 WeakPolarHBondContact OD1-CE2 3.48Å; D168-Y198 PolarHBondContact OD1-OH 3.47Å; D168-E273 WeakPolarHBondContact OD2-CA 3.07Å; D168-E273 WeakPolarHBondContact OD2-CG 3.41Å; D168-I274 HydrophobicContact CB-CG1 4.24Å; D168-I274 PolarHBondContact OD2-N 3.42Å
169	F	97.6	Very high	93.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-36.2	173.4	-166.2	-103	0	0	0	112.8	V66 I74 Y112 F131 L165 L166 I167 Y171 F172 I173 I274 V279 M285	V66-F169 HydrophobicContact CB-CZ 4.05Å; V66-F169 HydrophobicContact CG2-CE1 3.92Å; V66-F169 HydrophobicContact CG2-CZ 3.56Å; I74-F169 HydrophobicContact CD1-CB 4.1Å; I74-F169 HydrophobicContact CD1-CD1 4.1Å; I74-F169 HydrophobicContact CD1-CD2 3.89Å; I74-F169 HydrophobicContact CD1-CE2 4.33Å; I74-F169 HydrophobicContact CD1-CG 3.75Å; I74-F169 HydrophobicContact CG2-CD1 4.47Å; I74-F169 HydrophobicContact CG2-CE1 4.22Å; Y112-F169 HydrophobicContact CD1-CD1 4.22Å; Y112-F169 AromaticContact CD1-CE1 3.55Å; Y112-F169 HydrophobicContact CD1-CE1 3.55Å; Y112-F169 AromaticContact CE1-CE1 3.8Å; Y112-F169 HydrophobicContact CE1-CE1 3.8Å; Y112-F169 HydrophobicContact CG-CE1 4.36Å; F131-F169 AromaticContact CE1-CD1 3.89Å; F131-F169 HydrophobicContact CE1-CD1 3.89Å; F131-F169 AromaticContact CZ-CD1 3.95Å; F131-F169 HydrophobicContact CZ-CD1 3.95Å; L165-F169 PolarHBondContact O-N 2.72Å; L166-F169 PolarHBondContact O-N 3.43Å; I167-F169 VanDerWaalsContact C-N 3.32Å; I167-F169 PolarHBondContact O-N 2.98Å; F169-Y171 VanDerWaalsContact C-N 3.33Å; F169-Y171 PolarHBondContact O-N 3.45Å; F169-F172 WeakPolarHBondContact O-CB 3.18Å; F169-F172 PolarHBondContact O-N 2.81Å; F169-I173 HydrophobicContact CD1-CD1 3.94Å; F169-I173 HydrophobicContact CD1-CG1 4.48Å; F169-I173 HydrophobicContact CE1-CD1 3.76Å; F169-I173 HydrophobicContact CE1-CG1 4.26Å; F169-I173 WeakPolarHBondContact O-CG1 3.47Å; F169-I173 PolarHBondContact O-N 3.41Å; F169-I173 VanDerWaalsContact O-N 3.14Å; F169-I274 HydrophobicContact CB-CD1 3.9Å; F169-I274 HydrophobicContact CB-CG1 3.86Å; F169-I274 HydrophobicContact CD2-CD1 3.66Å; F169-I274 HydrophobicContact CD2-CG1 3.99Å; F169-I274 HydrophobicContact CD2-CG2 4.35Å; F169-I274 HydrophobicContact CG-CD1 4.21Å; F169-I274 HydrophobicContact CG-CG1 4.44Å; F169-V279 HydrophobicContact CE2-CG1 4.09Å; F169-V279 HydrophobicContact CE2-CG2 4.26Å; F169-M285 HydrophobicContact CE1-CE 4.2Å; F169-M285 HydrophobicContact CE2-CE 4.29Å; F169-M285 HydrophobicContact CZ-CE 3.62Å
170	S	96.5	Very high	93.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.2	-39.4	176.9	80.8	0	0	0	0	111.5	L166 I167 D168 I173 S174	L166-S170 PolarHBondContact O-N 2.89Å; L166-S170 VanDerWaalsContact O-N 3.14Å; I167-S170 PolarHBondContact O-N 3.45Å; I167-S170 VanDerWaalsContact O-N 3.12Å; I167-S170 PolarHBondContact O-OG 2.58Å; D168-S170 VanDerWaalsContact C-N 3.34Å; D168-S170 PolarHBondContact O-N 2.93Å; S170-I173 PolarHBondContact O-N 2.92Å; S170-S174 PolarHBondContact O-N 3.48Å
171	Y	96.1	Very high	93.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-72.7	-33.6	174.6	-80	-67.8	0	0	0	113.5	N147 I167 D168 F169 I173 S174 R175 G181 Y195 Y198 W199 G224 V225	N147-Y171 WeakPolarHBondContact ND2-CD1 3.01Å; N147-Y171 VanDerWaalsContact ND2-CE1 3.28Å; N147-Y171 WeakPolarHBondContact ND2-CE1 2.87Å; I167-Y171 HydrophobicContact CG2-CD2 3.87Å; I167-Y171 HydrophobicContact CG2-CE2 3.88Å; I167-Y171 WeakPolarHBondContact O-CD2 3.4Å; I167-Y171 PolarHBondContact O-N 2.96Å; I167-Y171 VanDerWaalsContact O-N 3.15Å; D168-Y171 PolarHBondContact O-N 3Å; F169-Y171 VanDerWaalsContact C-N 3.33Å; F169-Y171 PolarHBondContact O-N 3.45Å; Y171-I173 VanDerWaalsContact C-N 3.27Å; Y171-I173 PolarHBondContact O-N 2.68Å; Y171-S174 WeakPolarHBondContact O-CA 3.41Å; Y171-S174 WeakPolarHBondContact O-CB 3.49Å; Y171-S174 PolarHBondContact O-N 2.71Å; Y171-R175 WeakPolarHBondContact O-CG 3.47Å; Y171-R175 PolarHBondContact O-N 3.34Å; Y171-G181 VanDerWaalsContact CE1-O 3.27Å; Y171-G181 WeakPolarHBondContact CE1-O 3.46Å; Y171-G181 PolarHBondContact OH-O 2.62Å; Y171-Y195 HydrophobicContact CE2-CD1 4.46Å; Y171-Y195 HydrophobicContact CE2-CE1 4.01Å; Y171-Y198 WeakPolarHBondContact CB-OH 3.35Å; Y171-Y198 AromaticContact CD2-CD1 3.92Å; Y171-Y198 HydrophobicContact CD2-CD1 3.92Å; Y171-Y198 AromaticContact CD2-CE1 3.15Å; Y171-Y198 HydrophobicContact CD2-CE1 3.15Å; Y171-Y198 AromaticContact CD2-CZ 3.72Å; Y171-Y198 AromaticContact CE2-CD1 3.88Å; Y171-Y198 HydrophobicContact CE2-CD1 3.88Å; Y171-Y198 AromaticContact CE2-CE1 3.54Å; Y171-Y198 HydrophobicContact CE2-CE1 3.54Å; Y171-Y198 AromaticContact CG-CE1 3.91Å; Y171-Y198 HydrophobicContact CG-CE1 3.91Å; Y171-W199 AromaticContact CE2-NE1 3.66Å; Y171-W199 AromaticContact CZ-NE1 3.45Å; Y171-W199 PolarHBondContact OH-NE1 3.07Å; Y171-G224 WeakPolarHBondContact CD1-O 3.22Å; Y171-G224 WeakPolarHBondContact CE1-O 3.39Å; Y171-V225 HydrophobicContact CD1-CG2 3.81Å; Y171-V225 HydrophobicContact CE1-CB 4.07Å; Y171-V225 HydrophobicContact CE1-CG1 4.41Å; Y171-V225 HydrophobicContact CE1-CG2 3.64Å; Y171-V225 HydrophobicContact CE2-CG2 4.42Å; Y171-V225 HydrophobicContact CG-CG2 4.31Å
172	F	95.2	Very high	93.3	Very high	15 Å²	15	20.5 Å²	20.5	7%	0.066	10%	0.104	C	C	.	.	H	α-helix	trans	-55.1	-44.7	168.8	174.6	-86.4	0	0	0	111	D168 F169 S174 R175 L176 I274 E276 V279 V281 M285	D168-F172 PolarHBondContact O-N 3.22Å; F169-F172 WeakPolarHBondContact O-CB 3.18Å; F169-F172 PolarHBondContact O-N 2.81Å; F172-S174 VanDerWaalsContact C-N 3.32Å; F172-S174 PolarHBondContact O-N 3.4Å; F172-R175 PolarHBondContact O-N 3.05Å; F172-L176 HydrophobicContact CE1-CD2 4.43Å; F172-L176 WeakPolarHBondContact O-CB 3.36Å; F172-L176 PolarHBondContact O-N 3.3Å; F172-I274 HydrophobicContact CD2-CG2 4.48Å; F172-E276 HydrophobicContact CD2-CG 3.94Å; F172-E276 HydrophobicContact CE2-CB 4.02Å; F172-E276 HydrophobicContact CE2-CG 3.68Å; F172-V279 HydrophobicContact CD1-CG1 4.23Å; F172-V279 HydrophobicContact CD1-CG2 4.48Å; F172-V279 HydrophobicContact CE1-CB 4.21Å; F172-V279 HydrophobicContact CE1-CG1 3.51Å; F172-V279 HydrophobicContact CE1-CG2 4.19Å; F172-V279 HydrophobicContact CE2-CG2 4.26Å; F172-V279 HydrophobicContact CZ-CB 4.06Å; F172-V279 HydrophobicContact CZ-CG1 3.83Å; F172-V279 HydrophobicContact CZ-CG2 4.05Å; F172-V281 HydrophobicContact CE1-CG2 4.33Å; F172-V281 HydrophobicContact CZ-CG2 4.33Å; F172-M285 HydrophobicContact CD1-CE 4.35Å; F172-M285 HydrophobicContact CE1-CE 4.22Å
173	I	93.1	Very high	93.1	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-37.7	176.2	-58.3	161.4	0	0	0	111.3	Y112 F131 F169 S170 Y171 L176 R177 M285	Y112-I173 HydrophobicContact CD1-CD1 4.46Å; Y112-I173 HydrophobicContact CE1-CD1 3.82Å; Y112-I173 HydrophobicContact CE2-CD1 4.07Å; F131-I173 HydrophobicContact CZ-CD1 4.1Å; F169-I173 HydrophobicContact CD1-CD1 3.94Å; F169-I173 HydrophobicContact CD1-CG1 4.48Å; F169-I173 HydrophobicContact CE1-CD1 3.76Å; F169-I173 HydrophobicContact CE1-CG1 4.26Å; F169-I173 WeakPolarHBondContact O-CG1 3.47Å; F169-I173 PolarHBondContact O-N 3.41Å; F169-I173 VanDerWaalsContact O-N 3.14Å; S170-I173 PolarHBondContact O-N 2.92Å; Y171-I173 VanDerWaalsContact C-N 3.27Å; Y171-I173 PolarHBondContact O-N 2.68Å; I173-L176 PolarHBondContact O-N 3.29Å; I173-R177 WeakPolarHBondContact O-CB 3.33Å; I173-R177 WeakPolarHBondContact O-CG 2.97Å; I173-R177 PolarHBondContact O-N 3.37Å; I173-R177 VanDerWaalsContact O-N 3.13Å; I173-M285 HydrophobicContact CD1-CE 4.33Å; I173-M285 HydrophobicContact CG1-CE 3.67Å
174	S	91.8	Very high	92.7	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-45.2	174.2	-75.2	0	0	0	0	111.9	N147 S170 Y171 F172 R177 N178 L179	N147-S174 WeakPolarHBondContact CB-OG 3.4Å; N147-S174 PolarHBondContact ND2-OG 3.38Å; S170-S174 PolarHBondContact O-N 3.48Å; Y171-S174 WeakPolarHBondContact O-CA 3.41Å; Y171-S174 WeakPolarHBondContact O-CB 3.49Å; Y171-S174 PolarHBondContact O-N 2.71Å; F172-S174 VanDerWaalsContact C-N 3.32Å; F172-S174 PolarHBondContact O-N 3.4Å; S174-R177 PolarHBondContact O-N 3.08Å; S174-N178 PolarHBondContact O-N 2.83Å; S174-L179 WeakPolarHBondContact CA-O 3.3Å; S174-L179 VanDerWaalsContact CB-O 3.27Å; S174-L179 WeakPolarHBondContact CB-O 3.32Å; S174-L179 PolarHBondContact O-N 3.5Å; S174-L179 PolarHBondContact OG-O 2.92Å
175	R	91.9	Very high	92.1	Very high	58 Å²	58	24 Å²	24	22%	0.219	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-47.1	175.2	-66.4	-167.7	-58.6	-91.8	13.2	111.9	Y171 F172 R177 N178 R222 T223 E276	Y171-R175 WeakPolarHBondContact O-CG 3.47Å; Y171-R175 PolarHBondContact O-N 3.34Å; F172-R175 PolarHBondContact O-N 3.05Å; R175-R177 PolarHBondContact O-N 3.28Å; R175-R177 VanDerWaalsContact O-N 3.15Å; R175-N178 PolarHBondContact O-N 2.67Å; R175-R222 WeakPolarHBondContact CD-O 3.49Å; R175-T223 WeakPolarHBondContact CG-O 3.34Å; R175-T223 PolarHBondContact NH1-O 3.35Å; R175-E276 IonicContact CZ-OE1 3.09Å; R175-E276 IonicContact NE-OE1 2.77Å; R175-E276 IonicContact NH2-OE1 3.56Å; R175-E276 PolarHBondContact NH2-OE1 3.31Å
176	L	89.9	Confident	91.4	Very high	39 Å²	39	25.9 Å²	25.9	20%	0.204	13%	0.127	C	C	.	.	H	α-helix	trans	-56.9	-32.7	177.7	-177.1	68.3	0	0	0	112.6	F172 I173 V281 M285 R286	F172-L176 HydrophobicContact CE1-CD2 4.43Å; F172-L176 WeakPolarHBondContact O-CB 3.36Å; F172-L176 PolarHBondContact O-N 3.3Å; I173-L176 PolarHBondContact O-N 3.29Å; L176-V281 HydrophobicContact CD1-CG1 4.22Å; L176-V281 HydrophobicContact CD2-CG1 3.49Å; L176-V281 VanDerWaalsContact CD2-CG1 3.49Å; L176-V281 HydrophobicContact CD2-CG2 4.27Å; L176-V281 HydrophobicContact CG-CG1 4.45Å; L176-M285 HydrophobicContact CD2-CB 3.78Å; L176-R286 HydrophobicContact CD1-CG 4.34Å; L176-R286 HydrophobicContact CD2-CG 4Å; L176-R286 HydrophobicContact CG-CG 4.19Å
177	R	86	Confident	90.5	Very high	35 Å²	35	26.7 Å²	26.7	13%	0.132	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.6	178.6	-73.9	177.3	60.7	154.9	-6.4	113.8	I173 S174 R175 L179 M285 V288	I173-R177 WeakPolarHBondContact O-CB 3.33Å; I173-R177 WeakPolarHBondContact O-CG 2.97Å; I173-R177 PolarHBondContact O-N 3.37Å; I173-R177 VanDerWaalsContact O-N 3.13Å; S174-R177 PolarHBondContact O-N 3.08Å; R175-R177 PolarHBondContact O-N 3.28Å; R175-R177 VanDerWaalsContact O-N 3.15Å; R177-L179 HydrophobicContact CB-CB 4.03Å; R177-L179 PolarHBondContact O-N 3.42Å; R177-L179 VanDerWaalsContact O-N 3.1Å; R177-M285 WeakPolarHBondContact CD-O 3.41Å; R177-M285 WeakPolarHBondContact CG-O 3.33Å; R177-V288 HydrophobicContact CB-CG2 3.61Å; R177-V288 HydrophobicContact CG-CG2 3.82Å; R177-V288 VanDerWaalsContact O-CG2 3.26Å; R177-V288 WeakPolarHBondContact O-CG2 3.43Å
178	N	85.9	Confident	89.7	Confident	132 Å²	132	29 Å²	29	71%	0.706	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.9	35	-166.8	-62.4	-63.8	0	0	0	112.2	S174 R175	S174-N178 PolarHBondContact O-N 2.83Å; R175-N178 PolarHBondContact O-N 2.67Å
179	L	87.7	Confident	88.7	Confident	47 Å²	47	34.9 Å²	34.9	25%	0.246	17%	0.169	C	C	.	.			trans	-128	96.5	-177.5	-174.8	63.7	0	0	0	107.9	S145 S174 R177	S145-L179 WeakPolarHBondContact OG-CD2 3.44Å; S174-L179 WeakPolarHBondContact CA-O 3.3Å; S174-L179 VanDerWaalsContact CB-O 3.27Å; S174-L179 WeakPolarHBondContact CB-O 3.32Å; S174-L179 PolarHBondContact O-N 3.5Å; S174-L179 PolarHBondContact OG-O 2.92Å; R177-L179 HydrophobicContact CB-CB 4.03Å; R177-L179 PolarHBondContact O-N 3.42Å; R177-L179 VanDerWaalsContact O-N 3.1Å
180	P	90	Very high	88	Confident	26 Å²	26	37.8 Å²	37.8	17%	0.169	19%	0.19	C	C	.	.			trans	-53.8	142.9	174.6	-26.7	36.1	0	0	0	111.2	S145 E220 G224 L226	S145-P180 WeakPolarHBondContact CB-O 3.25Å; P180-E220 HydrophobicContact CB-CG 3.57Å; P180-E220 HydrophobicContact CG-CG 3.33Å; P180-G224 VanDerWaalsContact CA-O 3.28Å; P180-G224 WeakPolarHBondContact CA-O 3.46Å; P180-L226 HydrophobicContact CB-CD2 3.83Å; P180-L226 HydrophobicContact CB-CG 4.49Å
181	G	89.5	Confident	87.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-139.3	165.8	-175.9	0	0	0	0	0	114.2	S145 Y171 G224	S145-G181 CarbonylContact O-C 2.98Å; S145-G181 WeakPolarHBondContact O-CA 3.46Å; Y171-G181 VanDerWaalsContact CE1-O 3.27Å; Y171-G181 WeakPolarHBondContact CE1-O 3.46Å; Y171-G181 PolarHBondContact OH-O 2.62Å; G181-G224 PolarHBondContact N-O 3.46Å
182	T	91.1	Very high	87.2	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.6	174	-166.3	0	0	0	0	109.1	P144 S145 I146 N147 R185 L226 D229	P144-T182 HydrophobicContact CB-CG2 4.3Å; P144-T182 HydrophobicContact CG-CG2 3.82Å; S145-T182 PolarHBondContact O-N 2.66Å; I146-T182 VanDerWaalsContact CA-O 3.26Å; I146-T182 WeakPolarHBondContact CA-O 3.17Å; I146-T182 HydrophobicContact CD1-CG2 3.91Å; N147-T182 PolarHBondContact N-O 3.2Å; N147-T182 PolarHBondContact OD1-O 3.3Å; T182-R185 PolarHBondContact OG1-NH1 3.16Å; T182-L226 VanDerWaalsContact CB-CD1 3.41Å; T182-L226 HydrophobicContact CG2-CD1 3.58Å; T182-D229 WeakPolarHBondContact CB-OD2 3.31Å; T182-D229 PolarHBondContact OG1-OD1 2.84Å; T182-D229 PolarHBondContact OG1-OD2 3.37Å
183	P	92.1	Very high	87	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	156.5	169.1	29.5	-39.8	0	0	0	112.9	L148 F187 Y195 W199	L148-P183 HydrophobicContact CB-CB 4.41Å; L148-P183 HydrophobicContact CD2-CB 4.41Å; L148-P183 CarbonylContact O-C 3.52Å; L148-P183 VanDerWaalsContact O-CA 3.31Å; L148-P183 WeakPolarHBondContact O-CA 3.27Å; P183-F187 HydrophobicContact CB-CE1 3.66Å; P183-F187 HydrophobicContact CB-CZ 4.1Å; P183-F187 HydrophobicContact CG-CE1 3.29Å; P183-F187 HydrophobicContact CG-CZ 3.22Å; P183-Y195 HydrophobicContact CB-CE1 3.96Å; P183-Y195 HydrophobicContact CB-CE2 3.93Å; P183-Y195 WeakPolarHBondContact CB-OH 3.39Å; P183-Y195 HydrophobicContact CG-CD1 3.88Å; P183-Y195 HydrophobicContact CG-CD2 4.27Å; P183-Y195 HydrophobicContact CG-CE1 3.54Å; P183-Y195 HydrophobicContact CG-CE2 3.97Å; P183-Y195 HydrophobicContact CG-CG 4.23Å; P183-W199 HydrophobicContact CG-CZ2 4.27Å
184	E	86.1	Confident	87	Confident	69 Å²	69	42.1 Å²	42.1	32%	0.322	23%	0.225	S	C	.	.			trans	-64.8	140.2	170.4	-168.5	174.9	170.1	0	0	110.8	I146 L148 S149	I146-E184 HydrophobicContact CG2-CB 4Å; L148-E184 PolarHBondContact O-N 3.47Å; S149-E184 VanDerWaalsContact CA-OE2 3.3Å; S149-E184 WeakPolarHBondContact CA-OE2 3.4Å; S149-E184 WeakPolarHBondContact CB-OE2 3.33Å; S149-E184 PolarHBondContact OG-OE2 3.25Å
185	R	82.8	Confident	87.1	Confident	69 Å²	69	42.2 Å²	42.2	26%	0.26	23%	0.225	S	C	.	.	S	Bend	trans	-109.9	152.7	177.6	-68.4	176.3	174.6	80.2	-7.8	109.3	T182 F187 D229 D352	T182-R185 PolarHBondContact OG1-NH1 3.16Å; R185-F187 HydrophobicContact CG-CD2 4.48Å; R185-F187 HydrophobicContact CG-CE2 4.27Å; R185-D229 IonicContact CZ-OD1 3.65Å; R185-D229 IonicContact NH2-OD1 3.76Å; R185-D229 PolarHBondContact NH2-OD1 3.32Å; R185-D352 IonicContact NE-OD2 2.79Å
186	P	82	Confident	87.2	Confident	43 Å²	43	41.3 Å²	41.3	28%	0.279	22%	0.222	S	C	.	.	S	Bend	cis	-79.5	152.3	4.2	32.8	-35.6	0	0	0	113.1	C355	P186-C355 HydrophobicContact CB-CB 4.44Å
187	F	78.7	Confident	87.4	Confident	18 Å²	18	43.8 Å²	43.8	8%	0.079	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-78.2	155.4	172.1	-67.7	-64	0	0	0	112.3	P183 R185 V192 Y195 W199 I356	P183-F187 HydrophobicContact CB-CE1 3.66Å; P183-F187 HydrophobicContact CB-CZ 4.1Å; P183-F187 HydrophobicContact CG-CE1 3.29Å; P183-F187 HydrophobicContact CG-CZ 3.22Å; R185-F187 HydrophobicContact CG-CD2 4.48Å; R185-F187 HydrophobicContact CG-CE2 4.27Å; F187-V192 HydrophobicContact CB-CG2 3.47Å; F187-V192 VanDerWaalsContact CB-CG2 3.47Å; F187-V192 HydrophobicContact CD2-CG2 3.94Å; F187-V192 HydrophobicContact CG-CG2 4.04Å; F187-Y195 HydrophobicContact CD1-CD2 4.06Å; F187-Y195 HydrophobicContact CD1-CE2 4.38Å; F187-Y195 AromaticContact CE1-CD2 3.38Å; F187-Y195 HydrophobicContact CE1-CD2 3.38Å; F187-Y195 AromaticContact CE1-CE2 3.67Å; F187-Y195 HydrophobicContact CE1-CE2 3.67Å; F187-Y195 AromaticContact CE1-CG 3.98Å; F187-Y195 HydrophobicContact CE1-CG 3.98Å; F187-Y195 AromaticContact CZ-CD2 3.94Å; F187-Y195 HydrophobicContact CZ-CD2 3.94Å; F187-Y195 HydrophobicContact CZ-CE2 4.49Å; F187-Y195 HydrophobicContact CZ-CG 4.06Å; F187-W199 HydrophobicContact CZ-CH2 4.24Å; F187-I356 WeakPolarHBondContact O-CG1 3.49Å
188	S	82.8	Confident	88	Confident	49 Å²	49	42.2 Å²	42.2	34%	0.343	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-72.1	159.2	155.2	67.6	0	0	0	0	110	S190 G191 V192	S188-S190 VanDerWaalsContact C-N 3.27Å; S188-S190 PolarHBondContact O-N 2.91Å; S188-S190 PolarHBondContact OG-OG 3.1Å; S188-S190 VanDerWaalsContact OG-OG 3.05Å; S188-G191 CarbonylContact O-C 3.46Å; S188-G191 VanDerWaalsContact O-CA 3.29Å; S188-G191 WeakPolarHBondContact O-CA 3.42Å; S188-G191 PolarHBondContact O-N 2.94Å; S188-G191 PolarHBondContact OG-N 2.75Å; S188-G191 VanDerWaalsContact OG-N 3.11Å; S188-V192 PolarHBondContact O-N 3.33Å
189	Y	75.8	Confident	88.5	Confident	126 Å²	126	36.1 Å²	36.1	49%	0.494	19%	0.19	S	C	.	.	H	α-helix	trans	-53.2	-46.4	176	-176.8	-82.6	0	0	0	112.2	G191 V192 S193 Y382	Y189-G191 PolarHBondContact O-N 3.34Å; Y189-V192 PolarHBondContact O-N 2.83Å; Y189-S193 PolarHBondContact O-N 3.39Å; Y189-Y382 HydrophobicContact CD1-CE1 4.07Å; Y189-Y382 AromaticContact CD1-CZ 3.57Å; Y189-Y382 WeakPolarHBondContact CD1-OH 3.09Å; Y189-Y382 WeakPolarHBondContact CD2-OH 3.17Å; Y189-Y382 HydrophobicContact CE1-CD1 4.44Å; Y189-Y382 AromaticContact CE1-CE1 3.31Å; Y189-Y382 HydrophobicContact CE1-CE1 3.31Å; Y189-Y382 HydrophobicContact CE1-CE2 4.38Å; Y189-Y382 AromaticContact CE1-CZ 3.3Å; Y189-Y382 WeakPolarHBondContact CE1-OH 3.39Å; Y189-Y382 AromaticContact CE2-CE1 3.98Å; Y189-Y382 HydrophobicContact CE2-CE1 3.98Å; Y189-Y382 AromaticContact CZ-CE1 3.27Å; Y189-Y382 AromaticContact CZ-CZ 3.67Å; Y189-Y382 VanDerWaalsContact OH-CE1 3.3Å; Y189-Y382 WeakPolarHBondContact OH-CE1 3.28Å
190	S	83.3	Confident	89	Confident	61 Å²	61	33.9 Å²	33.9	43%	0.427	18%	0.178	S	C	.	.	H	α-helix	trans	-62.5	-30.9	175	54.6	0	0	0	0	113	S188 A194	S188-S190 VanDerWaalsContact C-N 3.27Å; S188-S190 PolarHBondContact O-N 2.91Å; S188-S190 PolarHBondContact OG-OG 3.1Å; S188-S190 VanDerWaalsContact OG-OG 3.05Å; S190-A194 VanDerWaalsContact O-CB 3.31Å; S190-A194 WeakPolarHBondContact O-CB 3.39Å; S190-A194 PolarHBondContact O-N 2.86Å
191	G	88.9	Confident	89.3	Confident	10 Å²	10	32.7 Å²	32.7	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-66.2	-48.1	175.6	0	0	0	0	0	112	S188 Y189 S193 A194 Y195	S188-G191 CarbonylContact O-C 3.46Å; S188-G191 VanDerWaalsContact O-CA 3.29Å; S188-G191 WeakPolarHBondContact O-CA 3.42Å; S188-G191 PolarHBondContact O-N 2.94Å; S188-G191 PolarHBondContact OG-N 2.75Å; S188-G191 VanDerWaalsContact OG-N 3.11Å; Y189-G191 PolarHBondContact O-N 3.34Å; G191-S193 VanDerWaalsContact C-N 3.33Å; G191-S193 PolarHBondContact O-N 2.86Å; G191-A194 PolarHBondContact O-N 3.33Å; G191-Y195 WeakPolarHBondContact O-CD2 3.41Å; G191-Y195 PolarHBondContact O-N 3.14Å
192	V	87.4	Confident	89.6	Confident	11 Å²	11	33.6 Å²	33.6	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-56	-49.7	176	179.2	0	0	0	0	110.5	F187 S188 Y189 A194 Y195 R196 I356	F187-V192 HydrophobicContact CB-CG2 3.47Å; F187-V192 VanDerWaalsContact CB-CG2 3.47Å; F187-V192 HydrophobicContact CD2-CG2 3.94Å; F187-V192 HydrophobicContact CG-CG2 4.04Å; S188-V192 PolarHBondContact O-N 3.33Å; Y189-V192 PolarHBondContact O-N 2.83Å; V192-A194 VanDerWaalsContact C-N 3.34Å; V192-A194 PolarHBondContact O-N 2.98Å; V192-Y195 PolarHBondContact O-N 3.15Å; V192-R196 HydrophobicContact CG1-CG 4.24Å; V192-R196 WeakPolarHBondContact O-CB 3.46Å; V192-R196 WeakPolarHBondContact O-CG 3.48Å; V192-R196 PolarHBondContact O-N 3.07Å; V192-I356 HydrophobicContact CG2-CD1 4.06Å
193	S	89.5	Confident	89.8	Confident	53 Å²	53	33.7 Å²	33.7	37%	0.371	18%	0.176	S	C	.	.	H	α-helix	trans	-59.7	-43	178.4	-179.7	0	0	0	0	112.1	Y189 G191 R197	Y189-S193 PolarHBondContact O-N 3.39Å; G191-S193 VanDerWaalsContact C-N 3.33Å; G191-S193 PolarHBondContact O-N 2.86Å; S193-R197 VanDerWaalsContact O-CB 3.31Å; S193-R197 WeakPolarHBondContact O-CB 3.3Å; S193-R197 PolarHBondContact O-N 2.96Å; S193-R197 VanDerWaalsContact O-N 3.11Å
194	A	93	Very high	89.9	Confident	33 Å²	33	33.6 Å²	33.6	27%	0.273	18%	0.176	S	C	.	.	H	α-helix	trans	-65.8	-45.3	179.2	0	0	0	0	0	112.7	I167 S190 G191 V192 Y198	I167-A194 HydrophobicContact CD1-CB 3.87Å; S190-A194 VanDerWaalsContact O-CB 3.31Å; S190-A194 WeakPolarHBondContact O-CB 3.39Å; S190-A194 PolarHBondContact O-N 2.86Å; G191-A194 PolarHBondContact O-N 3.33Å; V192-A194 VanDerWaalsContact C-N 3.34Å; V192-A194 PolarHBondContact O-N 2.98Å; A194-Y198 WeakPolarHBondContact O-CB 3.41Å; A194-Y198 PolarHBondContact O-N 3.3Å
195	Y	95.1	Very high	90.3	Very high	5 Å²	5	31.7 Å²	31.7	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-70.9	-44.1	179.7	-86.4	-80.3	0	0	0	112.7	L148 I167 Y171 P183 F187 G191 V192 R197 Y198 W199	L148-Y195 VanDerWaalsContact CD1-OH 3.3Å; L148-Y195 WeakPolarHBondContact CD1-OH 2.79Å; L148-Y195 WeakPolarHBondContact CD2-OH 3.48Å; I167-Y195 HydrophobicContact CD1-CD1 4.49Å; I167-Y195 HydrophobicContact CD1-CD2 4.21Å; I167-Y195 HydrophobicContact CD1-CE1 4.38Å; I167-Y195 HydrophobicContact CD1-CE2 4.09Å; I167-Y195 HydrophobicContact CD1-CG 4.4Å; I167-Y195 HydrophobicContact CG1-CE1 4.21Å; I167-Y195 HydrophobicContact CG1-CE2 4.24Å; I167-Y195 HydrophobicContact CG2-CD1 4.11Å; I167-Y195 HydrophobicContact CG2-CE1 3.67Å; Y171-Y195 HydrophobicContact CE2-CD1 4.46Å; Y171-Y195 HydrophobicContact CE2-CE1 4.01Å; P183-Y195 HydrophobicContact CB-CE1 3.96Å; P183-Y195 HydrophobicContact CB-CE2 3.93Å; P183-Y195 WeakPolarHBondContact CB-OH 3.39Å; P183-Y195 HydrophobicContact CG-CD1 3.88Å; P183-Y195 HydrophobicContact CG-CD2 4.27Å; P183-Y195 HydrophobicContact CG-CE1 3.54Å; P183-Y195 HydrophobicContact CG-CE2 3.97Å; P183-Y195 HydrophobicContact CG-CG 4.23Å; F187-Y195 HydrophobicContact CD1-CD2 4.06Å; F187-Y195 HydrophobicContact CD1-CE2 4.38Å; F187-Y195 AromaticContact CE1-CD2 3.38Å; F187-Y195 HydrophobicContact CE1-CD2 3.38Å; F187-Y195 AromaticContact CE1-CE2 3.67Å; F187-Y195 HydrophobicContact CE1-CE2 3.67Å; F187-Y195 AromaticContact CE1-CG 3.98Å; F187-Y195 HydrophobicContact CE1-CG 3.98Å; F187-Y195 AromaticContact CZ-CD2 3.94Å; F187-Y195 HydrophobicContact CZ-CD2 3.94Å; F187-Y195 HydrophobicContact CZ-CE2 4.49Å; F187-Y195 HydrophobicContact CZ-CG 4.06Å; G191-Y195 WeakPolarHBondContact O-CD2 3.41Å; G191-Y195 PolarHBondContact O-N 3.14Å; V192-Y195 PolarHBondContact O-N 3.15Å; Y195-R197 VanDerWaalsContact C-N 3.27Å; Y195-R197 PolarHBondContact O-N 3.2Å; Y195-Y198 PolarHBondContact O-N 3.08Å; Y195-Y198 VanDerWaalsContact O-N 3.14Å; Y195-W199 AromaticContact CD1-CE2 3.81Å; Y195-W199 HydrophobicContact CD1-CH2 4.43Å; Y195-W199 AromaticContact CD1-CZ2 3.71Å; Y195-W199 HydrophobicContact CD1-CZ2 3.71Å; Y195-W199 AromaticContact CD1-NE1 3.97Å; Y195-W199 HydrophobicContact CG-CZ2 4.3Å; Y195-W199 PolarHBondContact O-N 2.84Å
196	R	93.3	Very high	90.7	Very high	40 Å²	40	29.1 Å²	29.1	15%	0.151	16%	0.162	C	C	.	.	H	α-helix	trans	-55.4	-45.4	173.7	-77	-175.7	179.8	158.5	1.7	110.9	V192 S200 Y236 Y349 E353	V192-R196 HydrophobicContact CG1-CG 4.24Å; V192-R196 WeakPolarHBondContact O-CB 3.46Å; V192-R196 WeakPolarHBondContact O-CG 3.48Å; V192-R196 PolarHBondContact O-N 3.07Å; R196-S200 VanDerWaalsContact O-CB 3.24Å; R196-S200 WeakPolarHBondContact O-CB 3.4Å; R196-S200 PolarHBondContact O-N 2.91Å; R196-S200 PolarHBondContact O-OG 2.81Å; R196-Y236 HydrophobicContact CB-CE1 4.48Å; R196-Y349 HydrophobicContact CG-CE1 4.21Å; R196-E353 IonicContact CZ-OE1 2.78Å; R196-E353 IonicContact NH1-OE1 3.85Å; R196-E353 IonicContact NH2-OE1 3.48Å; R196-E353 PolarHBondContact NH2-OE1 2.73Å
197	R	94.9	Very high	91.1	Very high	90 Å²	90	28.2 Å²	28.2	34%	0.34	15%	0.154	S	C	.	.	H	α-helix	trans	-62.9	-46.3	176.6	-173.4	177.8	-175.4	99.7	8.1	111.9	S193 Y195 S200 D201	S193-R197 VanDerWaalsContact O-CB 3.31Å; S193-R197 WeakPolarHBondContact O-CB 3.3Å; S193-R197 PolarHBondContact O-N 2.96Å; S193-R197 VanDerWaalsContact O-N 3.11Å; Y195-R197 VanDerWaalsContact C-N 3.27Å; Y195-R197 PolarHBondContact O-N 3.2Å; R197-S200 PolarHBondContact O-N 3.45Å; R197-D201 PolarHBondContact O-N 3.24Å
198	Y	97.4	Very high	91.6	Very high	3 Å²	3	31.1 Å²	31.1	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-50.7	179.9	177.3	-94.7	0	0	0	112.1	R164 I167 D168 Y171 A194 Y195 S200 D201 V202	R164-Y198 HydrophobicContact CG-CD2 4.08Å; I167-Y198 HydrophobicContact CB-CD2 4.36Å; I167-Y198 HydrophobicContact CB-CG 4.38Å; I167-Y198 HydrophobicContact CG2-CD1 3.51Å; I167-Y198 HydrophobicContact CG2-CD2 3.82Å; I167-Y198 HydrophobicContact CG2-CE1 3.9Å; I167-Y198 HydrophobicContact CG2-CE2 4.18Å; I167-Y198 HydrophobicContact CG2-CG 3.47Å; I167-Y198 VanDerWaalsContact CG2-CG 3.47Å; D168-Y198 HydrophobicContact CB-CE2 3.61Å; D168-Y198 WeakPolarHBondContact OD1-CE2 3.48Å; D168-Y198 PolarHBondContact OD1-OH 3.47Å; Y171-Y198 WeakPolarHBondContact CB-OH 3.35Å; Y171-Y198 AromaticContact CD2-CD1 3.92Å; Y171-Y198 HydrophobicContact CD2-CD1 3.92Å; Y171-Y198 AromaticContact CD2-CE1 3.15Å; Y171-Y198 HydrophobicContact CD2-CE1 3.15Å; Y171-Y198 AromaticContact CD2-CZ 3.72Å; Y171-Y198 AromaticContact CE2-CD1 3.88Å; Y171-Y198 HydrophobicContact CE2-CD1 3.88Å; Y171-Y198 AromaticContact CE2-CE1 3.54Å; Y171-Y198 HydrophobicContact CE2-CE1 3.54Å; Y171-Y198 AromaticContact CG-CE1 3.91Å; Y171-Y198 HydrophobicContact CG-CE1 3.91Å; A194-Y198 WeakPolarHBondContact O-CB 3.41Å; A194-Y198 PolarHBondContact O-N 3.3Å; Y195-Y198 PolarHBondContact O-N 3.08Å; Y195-Y198 VanDerWaalsContact O-N 3.14Å; Y198-S200 VanDerWaalsContact C-N 3.31Å; Y198-S200 PolarHBondContact O-N 3.41Å; Y198-D201 WeakPolarHBondContact O-CB 3.48Å; Y198-D201 PolarHBondContact O-N 3.11Å; Y198-D201 VanDerWaalsContact O-N 3.12Å; Y198-V202 HydrophobicContact CD1-CG2 4.13Å; Y198-V202 HydrophobicContact CE1-CG2 3.59Å; Y198-V202 HydrophobicContact CE2-CG2 4.11Å; Y198-V202 WeakPolarHBondContact O-CG2 3.42Å; Y198-V202 PolarHBondContact O-N 2.89Å
199	W	97.5	Very high	91.7	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-39.1	178.6	-63.8	-33	0	0	0	112	Y171 P183 F187 Y195 D201 V202 I203 V225 D229 T233	Y171-W199 AromaticContact CE2-NE1 3.66Å; Y171-W199 AromaticContact CZ-NE1 3.45Å; Y171-W199 PolarHBondContact OH-NE1 3.07Å; P183-W199 HydrophobicContact CG-CZ2 4.27Å; F187-W199 HydrophobicContact CZ-CH2 4.24Å; Y195-W199 AromaticContact CD1-CE2 3.81Å; Y195-W199 HydrophobicContact CD1-CH2 4.43Å; Y195-W199 AromaticContact CD1-CZ2 3.71Å; Y195-W199 HydrophobicContact CD1-CZ2 3.71Å; Y195-W199 AromaticContact CD1-NE1 3.97Å; Y195-W199 HydrophobicContact CG-CZ2 4.3Å; Y195-W199 PolarHBondContact O-N 2.84Å; W199-D201 VanDerWaalsContact C-N 3.34Å; W199-D201 PolarHBondContact O-N 2.85Å; W199-V202 PolarHBondContact O-N 3.13Å; W199-I203 VanDerWaalsContact O-CG1 3.31Å; W199-I203 WeakPolarHBondContact O-CG1 3.31Å; W199-I203 PolarHBondContact O-N 3.21Å; W199-V225 HydrophobicContact CG-CG1 4.32Å; W199-D229 HydrophobicContact CD2-CB 4.19Å; W199-D229 HydrophobicContact CE3-CB 4.28Å; W199-D229 HydrophobicContact CH2-CB 3.89Å; W199-D229 HydrophobicContact CZ2-CB 3.8Å; W199-D229 HydrophobicContact CZ3-CB 4.14Å; W199-T233 HydrophobicContact CB-CG2 3.87Å; W199-T233 WeakPolarHBondContact CB-OG1 3.4Å
200	S	97.3	Very high	91.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-39.7	174.6	-57.9	0	0	0	0	111.7	R196 R197 Y198 I203 C204 T233 H258	R196-S200 VanDerWaalsContact O-CB 3.24Å; R196-S200 WeakPolarHBondContact O-CB 3.4Å; R196-S200 PolarHBondContact O-N 2.91Å; R196-S200 PolarHBondContact O-OG 2.81Å; R197-S200 PolarHBondContact O-N 3.45Å; Y198-S200 VanDerWaalsContact C-N 3.31Å; Y198-S200 PolarHBondContact O-N 3.41Å; S200-I203 PolarHBondContact O-N 3.49Å; S200-C204 PolarHBondContact O-N 3.44Å; S200-T233 VanDerWaalsContact OG-CG2 3.3Å; S200-T233 WeakPolarHBondContact OG-CG2 3.29Å; S200-H258 VanDerWaalsContact CB-CD2 3.48Å; S200-H258 WeakPolarHBondContact CB-CD2 3.38Å; S200-H258 VanDerWaalsContact CB-CE1 3.4Å; S200-H258 WeakPolarHBondContact CB-CE1 3.27Å; S200-H258 WeakPolarHBondContact CB-NE2 3.48Å
201	D	96.8	Very high	91.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-43.5	174.5	-71.9	-16.6	0	0	0	111.7	R164 R197 Y198 W199 C204 A205 H258 Y271	R164-D201 IonicContact CZ-OD2 2.8Å; R164-D201 IonicContact NE-OD2 3Å; R164-D201 PolarHBondContact NE-OD2 2.98Å; R164-D201 IonicContact NH2-OD2 2.92Å; R197-D201 PolarHBondContact O-N 3.24Å; Y198-D201 WeakPolarHBondContact O-CB 3.48Å; Y198-D201 PolarHBondContact O-N 3.11Å; Y198-D201 VanDerWaalsContact O-N 3.12Å; W199-D201 VanDerWaalsContact C-N 3.34Å; W199-D201 PolarHBondContact O-N 2.85Å; D201-C204 PolarHBondContact O-N 3.1Å; D201-A205 WeakPolarHBondContact O-CB 3.27Å; D201-A205 PolarHBondContact O-N 2.71Å; D201-H258 PolarHBondContact N-NE2 2.88Å; D201-H258 IonicContact OD1-CD2 3.85Å; D201-H258 IonicContact OD1-CE1 3.71Å; D201-H258 PolarHBondContact OD1-CE1 3.05Å; D201-H258 IonicContact OD1-NE2 2.81Å; D201-H258 PolarHBondContact OD1-NE2 3.27Å; D201-Y271 HydrophobicContact CB-CE2 4.4Å; D201-Y271 WeakPolarHBondContact OD2-CE2 3.32Å
202	V	95.6	Very high	90.1	Very high	20 Å²	20	35.3 Å²	35.3	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-64.7	-42.9	179.1	167.9	0	0	0	0	111.3	Y198 W199 A205 Y206 T223 V225	Y198-V202 HydrophobicContact CD1-CG2 4.13Å; Y198-V202 HydrophobicContact CE1-CG2 3.59Å; Y198-V202 HydrophobicContact CE2-CG2 4.11Å; Y198-V202 WeakPolarHBondContact O-CG2 3.42Å; Y198-V202 PolarHBondContact O-N 2.89Å; W199-V202 PolarHBondContact O-N 3.13Å; V202-A205 PolarHBondContact O-N 2.88Å; V202-Y206 WeakPolarHBondContact O-CB 3.41Å; V202-Y206 PolarHBondContact O-N 3.07Å; V202-T223 HydrophobicContact CG1-CG2 3.24Å; V202-V225 HydrophobicContact CG1-CG2 4.36Å
203	I	94.7	Very high	89.3	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-45.7	175.2	-68.8	162.9	0	0	0	110.7	W199 S200 A205 Y206 L207 M219 I230 T233 M234 M239 Y255	W199-I203 VanDerWaalsContact O-CG1 3.31Å; W199-I203 WeakPolarHBondContact O-CG1 3.31Å; W199-I203 PolarHBondContact O-N 3.21Å; S200-I203 PolarHBondContact O-N 3.49Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 2.95Å; I203-Y206 PolarHBondContact O-N 3.29Å; I203-L207 HydrophobicContact CG2-CD1 3.74Å; I203-L207 HydrophobicContact CG2-CG 4.37Å; I203-L207 WeakPolarHBondContact O-CB 3.09Å; I203-L207 VanDerWaalsContact O-CG 3.32Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 2.96Å; I203-M219 HydrophobicContact CG1-SD 3.83Å; I203-I230 HydrophobicContact CD1-CG2 4.43Å; I203-T233 HydrophobicContact CD1-CG2 3.62Å; I203-M234 HydrophobicContact CD1-CG 4.01Å; I203-M234 HydrophobicContact CG1-CE 4.41Å; I203-M234 HydrophobicContact CG2-CE 3.99Å; I203-M234 HydrophobicContact CG2-CG 4.49Å; I203-M239 HydrophobicContact CG2-SD 4.34Å; I203-Y255 HydrophobicContact CG2-CE2 4.45Å
204	C	94.7	Very high	88.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.4	-48	173.6	-78.7	0	0	0	0	110.8	S200 D201 Y206 L207 E208 Y255 C259	S200-C204 PolarHBondContact O-N 3.44Å; D201-C204 PolarHBondContact O-N 3.1Å; C204-Y206 PolarHBondContact O-N 2.92Å; C204-L207 PolarHBondContact O-N 2.8Å; C204-E208 WeakPolarHBondContact O-CB 3.43Å; C204-E208 WeakPolarHBondContact O-CG 3.46Å; C204-E208 PolarHBondContact O-N 3.25Å; C204-Y255 HydrophobicContact CB-CE2 4.42Å; C204-C259 HydrophobicContact CB-CB 4.22Å; C204-C259 WeakPolarHBondContact CB-SG 3.46Å; C204-C259 VanDerWaalsContact SG-CA 3.52Å; C204-C259 WeakPolarHBondContact SG-CB 3.37Å; C204-C259 CovalentContact SG-SG 2.07Å; C204-C259 PolarHBondContact SG-SG 2.84Å
205	A	93.7	Very high	88.3	Confident	28 Å²	28	37.2 Å²	37.2	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-44.6	-178.9	0	0	0	0	0	112.2	D201 V202 I203 E208 T209	D201-A205 WeakPolarHBondContact O-CB 3.27Å; D201-A205 PolarHBondContact O-N 2.71Å; V202-A205 PolarHBondContact O-N 2.88Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 2.95Å; A205-E208 PolarHBondContact O-N 3.25Å; A205-T209 PolarHBondContact O-N 3.39Å
206	Y	92.8	Very high	88	Confident	15 Å²	15	37.4 Å²	37.4	6%	0.059	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-47.1	177.8	-176	-78.4	0	0	0	111.8	V202 I203 C204 E208 T209 E210 L214 M219 R222 T223	V202-Y206 WeakPolarHBondContact O-CB 3.41Å; V202-Y206 PolarHBondContact O-N 3.07Å; I203-Y206 PolarHBondContact O-N 3.29Å; C204-Y206 PolarHBondContact O-N 2.92Å; Y206-E208 VanDerWaalsContact C-N 3.26Å; Y206-E208 PolarHBondContact O-N 3.15Å; Y206-T209 PolarHBondContact O-N 3.49Å; Y206-T209 PolarHBondContact O-OG1 3.38Å; Y206-T209 VanDerWaalsContact O-OG1 3.13Å; Y206-E210 HydrophobicContact CD1-CB 4.28Å; Y206-E210 HydrophobicContact CD1-CG 3.85Å; Y206-E210 HydrophobicContact CD2-CG 4.39Å; Y206-E210 HydrophobicContact CE1-CB 3.92Å; Y206-E210 HydrophobicContact CE1-CG 3.47Å; Y206-E210 VanDerWaalsContact CE1-CG 3.47Å; Y206-E210 HydrophobicContact CE2-CG 4.07Å; Y206-E210 HydrophobicContact CG-CG 4.3Å; Y206-E210 WeakPolarHBondContact O-CG 3.43Å; Y206-E210 PolarHBondContact O-N 2.79Å; Y206-L214 HydrophobicContact CD1-CD1 4.05Å; Y206-L214 HydrophobicContact CE1-CD1 3.52Å; Y206-M219 HydrophobicContact CD1-CE 3.53Å; Y206-M219 HydrophobicContact CD1-CG 4.33Å; Y206-M219 HydrophobicContact CD2-CB 4.16Å; Y206-M219 HydrophobicContact CD2-CG 3.79Å; Y206-M219 HydrophobicContact CE1-CB 4.37Å; Y206-M219 HydrophobicContact CE1-CE 3.92Å; Y206-M219 VanDerWaalsContact CE2-CA 3.46Å; Y206-M219 HydrophobicContact CE2-CB 3.87Å; Y206-M219 HydrophobicContact CE2-CG 4.04Å; Y206-M219 HydrophobicContact CG-CE 3.94Å; Y206-M219 HydrophobicContact CG-CG 3.94Å; Y206-M219 HydrophobicContact CG-SD 4.48Å; Y206-R222 HydrophobicContact CD2-CB 4.33Å; Y206-R222 HydrophobicContact CE2-CB 4.05Å; Y206-R222 HydrophobicContact CE2-CG 4.19Å; Y206-T223 HydrophobicContact CD2-CG2 4.31Å
207	L	90.6	Very high	87.7	Confident	24 Å²	24	40 Å²	40	13%	0.126	22%	0.215	C	C	.	.	H	α-helix	trans	-71.8	-20.8	-177.7	-66.7	174.9	0	0	0	113.2	I203 C204 L214 M239 Y255 I331	I203-L207 HydrophobicContact CG2-CD1 3.74Å; I203-L207 HydrophobicContact CG2-CG 4.37Å; I203-L207 WeakPolarHBondContact O-CB 3.09Å; I203-L207 VanDerWaalsContact O-CG 3.32Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 2.96Å; C204-L207 PolarHBondContact O-N 2.8Å; L207-L214 HydrophobicContact CD2-CD1 3.6Å; L207-L214 HydrophobicContact CD2-CD2 4.46Å; L207-M239 HydrophobicContact CD1-CE 3.69Å; L207-Y255 WeakPolarHBondContact CB-OH 3.18Å; L207-Y255 HydrophobicContact CD1-CE2 3.86Å; L207-I331 HydrophobicContact CD2-CD1 4.31Å
208	E	88.2	Confident	87.3	Confident	79 Å²	79	39.4 Å²	39.4	37%	0.369	22%	0.219	S	C	.	.	H	α-helix	trans	-73.9	-29.3	172.6	-78	174.9	159.6	0	0	112.7	C204 A205 Y206 R262 K263	C204-E208 WeakPolarHBondContact O-CB 3.43Å; C204-E208 WeakPolarHBondContact O-CG 3.46Å; C204-E208 PolarHBondContact O-N 3.25Å; A205-E208 PolarHBondContact O-N 3.25Å; Y206-E208 VanDerWaalsContact C-N 3.26Å; Y206-E208 PolarHBondContact O-N 3.15Å; E208-R262 IonicContact OE1-NH1 2.72Å; E208-R262 IonicContact OE2-CZ 2.73Å; E208-R262 IonicContact OE2-NH1 3.81Å; E208-R262 PolarHBondContact OE2-NH1 2.87Å; E208-K263 WeakPolarHBondContact OE1-CE 3.3Å; E208-K263 IonicContact OE1-NZ 2.69Å; E208-K263 PolarHBondContact OE1-NZ 3.01Å
209	T	84.8	Confident	87.1	Confident	99 Å²	99	39.3 Å²	39.3	61%	0.607	22%	0.218	S	C	*	.	H	α-helix	trans	-97.7	-32	-177.6	60.3	0	0	0	0	113.5	A205 Y206	A205-T209 PolarHBondContact O-N 3.39Å; Y206-T209 PolarHBondContact O-N 3.49Å; Y206-T209 PolarHBondContact O-OG1 3.38Å; Y206-T209 VanDerWaalsContact O-OG1 3.13Å
210	E	77.7	Confident	86.9	Confident	49 Å²	49	41.3 Å²	41.3	23%	0.229	23%	0.228	C	C	.	.			trans	-88.1	130.4	-176.1	-62.5	-50.7	119.4	0	0	112.8	Y206 R222 K329	Y206-E210 HydrophobicContact CD1-CB 4.28Å; Y206-E210 HydrophobicContact CD1-CG 3.85Å; Y206-E210 HydrophobicContact CD2-CG 4.39Å; Y206-E210 HydrophobicContact CE1-CB 3.92Å; Y206-E210 HydrophobicContact CE1-CG 3.47Å; Y206-E210 VanDerWaalsContact CE1-CG 3.47Å; Y206-E210 HydrophobicContact CE2-CG 4.07Å; Y206-E210 HydrophobicContact CG-CG 4.3Å; Y206-E210 WeakPolarHBondContact O-CG 3.43Å; Y206-E210 PolarHBondContact O-N 2.79Å; E210-R222 VanDerWaalsContact CD-NH2 3.34Å; E210-R222 IonicContact OE1-CZ 2.98Å; E210-R222 VanDerWaalsContact OE1-CZ 3.31Å; E210-R222 IonicContact OE1-NH1 2.83Å; E210-R222 PolarHBondContact OE1-NH1 3.15Å; E210-R222 IonicContact OE1-NH2 3.81Å; E210-R222 IonicContact OE2-CZ 2.82Å; E210-R222 IonicContact OE2-NH1 3.83Å; E210-R222 PolarHBondContact OE2-NH1 3.39Å; E210-R222 IonicContact OE2-NH2 2.76Å; E210-R222 PolarHBondContact OE2-NH2 3.5Å; E210-K329 PolarHBondContact O-NZ 2.82Å
211	D	68.1	Low	86.5	Confident	135 Å²	135	48.5 Å²	48.5	72%	0.722	26%	0.259	S	S	*	.			trans	-109.3	136.5	168.1	-72.2	-34.6	0	0	0	109.5	K329	D211-K329 WeakPolarHBondContact OD1-CE 3.49Å; D211-K329 IonicContact OD1-NZ 3.75Å; D211-K329 PolarHBondContact OD1-NZ 3.48Å
212	G	69	Low	86.3	Confident	52 Å²	52	54.8 Å²	54.8	54%	0.536	28%	0.283	S	S	.	.	S	Bend	trans	113.6	-149.9	175.7	0	0	0	0	0	114.2
213	E	69.9	Low	86.2	Confident	119 Å²	119	54.5 Å²	54.5	56%	0.556	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-72.5	140.7	-178.2	-57.6	-168.7	140.2	0	0	110.8	S332 Q334	E213-S332 VanDerWaalsContact CG-OG 3.29Å; E213-S332 WeakPolarHBondContact CG-OG 3.06Å; E213-S332 PolarHBondContact OE1-OG 3.01Å; E213-Q334 PolarHBondContact OE2-NE2 2.77Å
214	L	78.8	Confident	86.2	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-97.3	117.7	178.8	-170.7	74.5	0	0	0	109	Y206 L207 M219 M234 I249 I331 S332	Y206-L214 HydrophobicContact CD1-CD1 4.05Å; Y206-L214 HydrophobicContact CE1-CD1 3.52Å; L207-L214 HydrophobicContact CD2-CD1 3.6Å; L207-L214 HydrophobicContact CD2-CD2 4.46Å; L214-M219 HydrophobicContact CD1-CE 3.72Å; L214-M219 HydrophobicContact CD2-CE 4.43Å; L214-M219 HydrophobicContact CG-CE 4.44Å; L214-M234 HydrophobicContact CD2-CE 4.04Å; L214-I249 HydrophobicContact CD2-CD1 3.48Å; L214-I249 VanDerWaalsContact CD2-CD1 3.48Å; L214-I331 HydrophobicContact CB-CB 4.15Å; L214-I331 HydrophobicContact CB-CD1 4.41Å; L214-I331 HydrophobicContact CB-CG1 4.1Å; L214-I331 HydrophobicContact CB-CG2 3.11Å; L214-I331 HydrophobicContact CD2-CD1 4.29Å; L214-I331 HydrophobicContact CD2-CG2 3.77Å; L214-I331 HydrophobicContact CG-CG2 4.06Å; L214-S332 PolarHBondContact N-O 2.84Å
215	S	83.3	Confident	86.2	Confident	11 Å²	11	54.6 Å²	54.6	8%	0.077	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-100.2	129.2	159.8	174.1	0	0	0	0	109.9	K217 D218 M219 D335	S215-K217 PolarHBondContact O-N 3.38Å; S215-K217 WeakPolarHBondContact OG-CB 3.22Å; S215-K217 PolarHBondContact OG-N 3.27Å; S215-K217 VanDerWaalsContact OG-N 3.1Å; S215-D218 WeakPolarHBondContact CB-OD2 3.45Å; S215-D218 PolarHBondContact O-N 2.97Å; S215-D218 PolarHBondContact OG-N 3.02Å; S215-M219 PolarHBondContact O-N 2.95Å; S215-D335 PolarHBondContact OG-OD2 2.68Å
216	V	88	Confident	86	Confident	10 Å²	10	54.3 Å²	54.3	6%	0.061	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-32.5	170.6	178.3	0	0	0	0	110.2	M219 E220 A227 I230 V231	V216-M219 PolarHBondContact O-N 2.93Å; V216-E220 WeakPolarHBondContact O-CB 3.24Å; V216-E220 PolarHBondContact O-N 3.25Å; V216-A227 HydrophobicContact CG1-CB 3.61Å; V216-I230 HydrophobicContact CG1-CB 4.41Å; V216-I230 HydrophobicContact CG1-CG2 4.14Å; V216-V231 HydrophobicContact CG1-CG2 4.01Å; V216-V231 HydrophobicContact CG2-CG2 4.32Å
217	K	87.5	Confident	85.9	Confident	93 Å²	93	53.7 Å²	53.7	40%	0.404	27%	0.274	S	S	.	.	H	α-helix	trans	-67.5	-38.3	175	-69.6	-177.9	-178.9	153.9	0	112	S215 M219 E220 K221 D335	S215-K217 PolarHBondContact O-N 3.38Å; S215-K217 WeakPolarHBondContact OG-CB 3.22Å; S215-K217 PolarHBondContact OG-N 3.27Å; S215-K217 VanDerWaalsContact OG-N 3.1Å; K217-M219 VanDerWaalsContact C-N 3.35Å; K217-E220 PolarHBondContact O-N 3.18Å; K217-K221 WeakPolarHBondContact O-CB 3.36Å; K217-K221 PolarHBondContact O-N 2.79Å; K217-D335 WeakPolarHBondContact CD-OD2 3.49Å; K217-D335 WeakPolarHBondContact CE-OD1 3.46Å; K217-D335 IonicContact NZ-OD1 3.22Å; K217-D335 PolarHBondContact NZ-OD1 3.37Å
218	D	88	Confident	85.8	Confident	79 Å²	79	57.8 Å²	57.8	42%	0.422	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-41	173.8	-72.6	-27.1	0	0	0	111.2	S215 K221 R222	S215-D218 WeakPolarHBondContact CB-OD2 3.45Å; S215-D218 PolarHBondContact O-N 2.97Å; S215-D218 PolarHBondContact OG-N 3.02Å; D218-K221 PolarHBondContact O-N 3.34Å; D218-R222 WeakPolarHBondContact O-CB 3.39Å; D218-R222 WeakPolarHBondContact O-CG 3.31Å; D218-R222 PolarHBondContact O-N 2.98Å
219	M	92.2	Very high	85.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-43.3	173.2	-169.1	-178.7	-57.9	0	0	111.9	I203 Y206 L214 S215 V216 K217 K221 R222 T223 I230 M234	I203-M219 HydrophobicContact CG1-SD 3.83Å; Y206-M219 HydrophobicContact CD1-CE 3.53Å; Y206-M219 HydrophobicContact CD1-CG 4.33Å; Y206-M219 HydrophobicContact CD2-CB 4.16Å; Y206-M219 HydrophobicContact CD2-CG 3.79Å; Y206-M219 HydrophobicContact CE1-CB 4.37Å; Y206-M219 HydrophobicContact CE1-CE 3.92Å; Y206-M219 VanDerWaalsContact CE2-CA 3.46Å; Y206-M219 HydrophobicContact CE2-CB 3.87Å; Y206-M219 HydrophobicContact CE2-CG 4.04Å; Y206-M219 HydrophobicContact CG-CE 3.94Å; Y206-M219 HydrophobicContact CG-CG 3.94Å; Y206-M219 HydrophobicContact CG-SD 4.48Å; L214-M219 HydrophobicContact CD1-CE 3.72Å; L214-M219 HydrophobicContact CD2-CE 4.43Å; L214-M219 HydrophobicContact CG-CE 4.44Å; S215-M219 PolarHBondContact O-N 2.95Å; V216-M219 PolarHBondContact O-N 2.93Å; K217-M219 VanDerWaalsContact C-N 3.35Å; M219-K221 PolarHBondContact O-N 3.38Å; M219-R222 PolarHBondContact O-N 2.86Å; M219-T223 HydrophobicContact CG-CG2 3.93Å; M219-T223 VanDerWaalsContact O-CB 3.27Å; M219-T223 WeakPolarHBondContact O-CB 3.44Å; M219-T223 WeakPolarHBondContact O-CG2 3.49Å; M219-T223 PolarHBondContact O-N 3.41Å; M219-T223 PolarHBondContact O-OG1 3.04Å; M219-I230 HydrophobicContact CB-CD1 3.99Å; M219-I230 HydrophobicContact CG-CD1 3.73Å; M219-I230 HydrophobicContact CG-CG1 4.42Å; M219-I230 HydrophobicContact CG-CG2 4.49Å; M219-I230 HydrophobicContact SD-CB 4.41Å; M219-I230 HydrophobicContact SD-CD1 4Å; M219-I230 HydrophobicContact SD-CG1 4.09Å; M219-I230 HydrophobicContact SD-CG2 3.42Å; M219-I230 WeakPolarHBondContact SD-CG2 3.06Å; M219-M234 HydrophobicContact CE-CE 3.34Å; M219-M234 HydrophobicContact SD-CE 3.79Å
220	E	92.6	Very high	86.3	Confident	47 Å²	47	49.5 Å²	49.5	22%	0.22	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-48.5	175.3	170.9	177.8	96.5	0	0	111.2	P180 V216 K217 R222 G224 V225 L226 A227 I230	P180-E220 HydrophobicContact CB-CG 3.57Å; P180-E220 HydrophobicContact CG-CG 3.33Å; V216-E220 WeakPolarHBondContact O-CB 3.24Å; V216-E220 PolarHBondContact O-N 3.25Å; K217-E220 PolarHBondContact O-N 3.18Å; E220-R222 PolarHBondContact O-N 2.73Å; E220-G224 VanDerWaalsContact O-CA 3.31Å; E220-G224 WeakPolarHBondContact O-CA 3.49Å; E220-G224 PolarHBondContact O-N 3.37Å; E220-V225 VanDerWaalsContact CA-O 3.25Å; E220-V225 WeakPolarHBondContact CA-O 3.42Å; E220-V225 WeakPolarHBondContact CB-O 3.43Å; E220-V225 WeakPolarHBondContact CG-O 3.36Å; E220-L226 WeakPolarHBondContact OE2-CA 3.47Å; E220-A227 HydrophobicContact CB-CB 4.48Å; E220-A227 WeakPolarHBondContact OE2-CB 3.28Å; E220-A227 PolarHBondContact OE2-N 3.4Å; E220-I230 HydrophobicContact CB-CD1 4.17Å
221	K	90.3	Very high	86.9	Confident	151 Å²	151	49.1 Å²	49.1	66%	0.657	25%	0.246	S	C	*	.	H	α-helix	trans	-62.4	-43.6	179.3	-175.9	-179.9	177.1	-175.1	0	112.3	K217 D218 M219	K217-K221 WeakPolarHBondContact O-CB 3.36Å; K217-K221 PolarHBondContact O-N 2.79Å; D218-K221 PolarHBondContact O-N 3.34Å; M219-K221 PolarHBondContact O-N 3.38Å
222	R	91.9	Very high	87.9	Confident	132 Å²	132	42.8 Å²	42.8	50%	0.498	21%	0.213	S	C	.	.	H	α-helix	trans	-74.4	-33.7	-177.5	-70.1	-160.2	-163.2	-162.7	14.4	113.3	R175 Y206 E210 D218 M219 E220	R175-R222 WeakPolarHBondContact CD-O 3.49Å; Y206-R222 HydrophobicContact CD2-CB 4.33Å; Y206-R222 HydrophobicContact CE2-CB 4.05Å; Y206-R222 HydrophobicContact CE2-CG 4.19Å; E210-R222 VanDerWaalsContact CD-NH2 3.34Å; E210-R222 IonicContact OE1-CZ 2.98Å; E210-R222 VanDerWaalsContact OE1-CZ 3.31Å; E210-R222 IonicContact OE1-NH1 2.83Å; E210-R222 PolarHBondContact OE1-NH1 3.15Å; E210-R222 IonicContact OE1-NH2 3.81Å; E210-R222 IonicContact OE2-CZ 2.82Å; E210-R222 IonicContact OE2-NH1 3.83Å; E210-R222 PolarHBondContact OE2-NH1 3.39Å; E210-R222 IonicContact OE2-NH2 2.76Å; E210-R222 PolarHBondContact OE2-NH2 3.5Å; D218-R222 WeakPolarHBondContact O-CB 3.39Å; D218-R222 WeakPolarHBondContact O-CG 3.31Å; D218-R222 PolarHBondContact O-N 2.98Å; M219-R222 PolarHBondContact O-N 2.86Å; E220-R222 PolarHBondContact O-N 2.73Å
223	T	94	Very high	89	Confident	13 Å²	13	40.3 Å²	40.3	8%	0.08	19%	0.187	C	C	.	.	H	α-helix	trans	-96.5	-26.7	-173.1	65.8	0	0	0	0	112.4	R175 V202 Y206 M219 V225	R175-T223 WeakPolarHBondContact CG-O 3.34Å; R175-T223 PolarHBondContact NH1-O 3.35Å; V202-T223 HydrophobicContact CG1-CG2 3.24Å; Y206-T223 HydrophobicContact CD2-CG2 4.31Å; M219-T223 HydrophobicContact CG-CG2 3.93Å; M219-T223 VanDerWaalsContact O-CB 3.27Å; M219-T223 WeakPolarHBondContact O-CB 3.44Å; M219-T223 WeakPolarHBondContact O-CG2 3.49Å; M219-T223 PolarHBondContact O-N 3.41Å; M219-T223 PolarHBondContact O-OG1 3.04Å; T223-V225 WeakPolarHBondContact OG1-CB 3.32Å; T223-V225 PolarHBondContact OG1-N 2.95Å; T223-V225 VanDerWaalsContact OG1-N 3.16Å
224	G	93.2	Very high	90.1	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	16%	0.161	C	C	.	.			trans	76.6	3.4	-169.4	0	0	0	0	0	113.4	Y171 P180 G181 E220	Y171-G224 WeakPolarHBondContact CD1-O 3.22Å; Y171-G224 WeakPolarHBondContact CE1-O 3.39Å; P180-G224 VanDerWaalsContact CA-O 3.28Å; P180-G224 WeakPolarHBondContact CA-O 3.46Å; G181-G224 PolarHBondContact N-O 3.46Å; E220-G224 VanDerWaalsContact O-CA 3.31Å; E220-G224 WeakPolarHBondContact O-CA 3.49Å; E220-G224 PolarHBondContact O-N 3.37Å
225	V	94.6	Very high	90.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-85.7	132.3	175.7	-175.6	0	0	0	0	108.8	Y171 W199 V202 E220 T223 A227 D229 I230	Y171-V225 HydrophobicContact CD1-CG2 3.81Å; Y171-V225 HydrophobicContact CE1-CB 4.07Å; Y171-V225 HydrophobicContact CE1-CG1 4.41Å; Y171-V225 HydrophobicContact CE1-CG2 3.64Å; Y171-V225 HydrophobicContact CE2-CG2 4.42Å; Y171-V225 HydrophobicContact CG-CG2 4.31Å; W199-V225 HydrophobicContact CG-CG1 4.32Å; V202-V225 HydrophobicContact CG1-CG2 4.36Å; E220-V225 VanDerWaalsContact CA-O 3.25Å; E220-V225 WeakPolarHBondContact CA-O 3.42Å; E220-V225 WeakPolarHBondContact CB-O 3.43Å; E220-V225 WeakPolarHBondContact CG-O 3.36Å; T223-V225 WeakPolarHBondContact OG1-CB 3.32Å; T223-V225 PolarHBondContact OG1-N 2.95Å; T223-V225 VanDerWaalsContact OG1-N 3.16Å; V225-A227 PolarHBondContact O-N 3.12Å; V225-D229 HydrophobicContact CG1-CB 3.81Å; V225-I230 HydrophobicContact CB-CD1 4.26Å; V225-I230 HydrophobicContact CB-CG1 4.08Å; V225-I230 HydrophobicContact CG1-CG1 3.87Å; V225-I230 WeakPolarHBondContact O-CD1 3.34Å
226	L	91.2	Very high	91	Very high	22 Å²	22	42.6 Å²	42.6	12%	0.115	19%	0.193	C	C	.	.			trans	-56.6	142.1	175.7	-70.2	172	0	0	0	112	P144 P180 T182 E220 K228 D229 I230	P144-L226 HydrophobicContact CB-CD1 3.25Å; P144-L226 HydrophobicContact CB-CD2 3.97Å; P144-L226 HydrophobicContact CB-CG 4.26Å; P144-L226 HydrophobicContact CG-CD1 3.72Å; P180-L226 HydrophobicContact CB-CD2 3.83Å; P180-L226 HydrophobicContact CB-CG 4.49Å; T182-L226 VanDerWaalsContact CB-CD1 3.41Å; T182-L226 HydrophobicContact CG2-CD1 3.58Å; E220-L226 WeakPolarHBondContact OE2-CA 3.47Å; L226-K228 PolarHBondContact O-N 3.5Å; L226-K228 VanDerWaalsContact O-N 3.14Å; L226-D229 PolarHBondContact O-N 3.14Å; L226-I230 PolarHBondContact O-N 3.06Å
227	A	89.7	Confident	91.2	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.017	19%	0.191	C	C	.	.	H	α-helix	trans	-50.3	-39.3	173	0	0	0	0	0	111.8	V216 E220 V225 I230 V231	V216-A227 HydrophobicContact CG1-CB 3.61Å; E220-A227 HydrophobicContact CB-CB 4.48Å; E220-A227 WeakPolarHBondContact OE2-CB 3.28Å; E220-A227 PolarHBondContact OE2-N 3.4Å; V225-A227 PolarHBondContact O-N 3.12Å; A227-I230 WeakPolarHBondContact O-CB 3.33Å; A227-I230 PolarHBondContact O-N 3.37Å; A227-V231 WeakPolarHBondContact O-CB 3.44Å; A227-V231 VanDerWaalsContact O-CG2 3.29Å; A227-V231 WeakPolarHBondContact O-CG2 3.28Å; A227-V231 PolarHBondContact O-N 2.95Å
228	K	88.6	Confident	91.4	Very high	111 Å²	111	44.1 Å²	44.1	48%	0.483	20%	0.195	S	C	.	.	H	α-helix	trans	-58.6	-48.9	175.4	-177.3	177	178.8	175.3	0	112.3	L226 I230 V231 Q232	L226-K228 PolarHBondContact O-N 3.5Å; L226-K228 VanDerWaalsContact O-N 3.14Å; K228-I230 VanDerWaalsContact C-N 3.34Å; K228-V231 PolarHBondContact O-N 2.83Å; K228-Q232 WeakPolarHBondContact O-CB 3.3Å; K228-Q232 VanDerWaalsContact O-CG 3.23Å; K228-Q232 WeakPolarHBondContact O-CG 3.47Å; K228-Q232 PolarHBondContact O-N 2.85Å
229	D	91.2	Very high	91.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-69.7	-33.9	-179.3	-65.9	-32.2	0	0	0	110.8	T182 R185 W199 V225 L226 T233	T182-D229 WeakPolarHBondContact CB-OD2 3.31Å; T182-D229 PolarHBondContact OG1-OD1 2.84Å; T182-D229 PolarHBondContact OG1-OD2 3.37Å; R185-D229 IonicContact CZ-OD1 3.65Å; R185-D229 IonicContact NH2-OD1 3.76Å; R185-D229 PolarHBondContact NH2-OD1 3.32Å; W199-D229 HydrophobicContact CD2-CB 4.19Å; W199-D229 HydrophobicContact CE3-CB 4.28Å; W199-D229 HydrophobicContact CH2-CB 3.89Å; W199-D229 HydrophobicContact CZ2-CB 3.8Å; W199-D229 HydrophobicContact CZ3-CB 4.14Å; V225-D229 HydrophobicContact CG1-CB 3.81Å; L226-D229 PolarHBondContact O-N 3.14Å; D229-T233 WeakPolarHBondContact O-CB 3.5Å; D229-T233 PolarHBondContact O-N 3.05Å; D229-T233 PolarHBondContact O-OG1 3.48Å
230	I	92.2	Very high	91.2	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-54.8	172.8	-69.6	164.3	0	0	0	110.6	I203 V216 M219 E220 V225 L226 A227 K228 Q232 T233 M234	I203-I230 HydrophobicContact CD1-CG2 4.43Å; V216-I230 HydrophobicContact CG1-CB 4.41Å; V216-I230 HydrophobicContact CG1-CG2 4.14Å; M219-I230 HydrophobicContact CB-CD1 3.99Å; M219-I230 HydrophobicContact CG-CD1 3.73Å; M219-I230 HydrophobicContact CG-CG1 4.42Å; M219-I230 HydrophobicContact CG-CG2 4.49Å; M219-I230 HydrophobicContact SD-CB 4.41Å; M219-I230 HydrophobicContact SD-CD1 4Å; M219-I230 HydrophobicContact SD-CG1 4.09Å; M219-I230 HydrophobicContact SD-CG2 3.42Å; M219-I230 WeakPolarHBondContact SD-CG2 3.06Å; E220-I230 HydrophobicContact CB-CD1 4.17Å; V225-I230 HydrophobicContact CB-CD1 4.26Å; V225-I230 HydrophobicContact CB-CG1 4.08Å; V225-I230 HydrophobicContact CG1-CG1 3.87Å; V225-I230 WeakPolarHBondContact O-CD1 3.34Å; L226-I230 PolarHBondContact O-N 3.06Å; A227-I230 WeakPolarHBondContact O-CB 3.33Å; A227-I230 PolarHBondContact O-N 3.37Å; K228-I230 VanDerWaalsContact C-N 3.34Å; I230-Q232 VanDerWaalsContact C-N 3.35Å; I230-Q232 PolarHBondContact O-N 3.49Å; I230-T233 PolarHBondContact O-N 3.15Å; I230-T233 VanDerWaalsContact O-N 3.12Å; I230-M234 HydrophobicContact CG2-CE 3.69Å; I230-M234 HydrophobicContact CG2-SD 4.13Å; I230-M234 WeakPolarHBondContact O-CG 2.98Å; I230-M234 PolarHBondContact O-N 2.93Å
231	V	90.5	Very high	90.6	Very high	41 Å²	41	48.6 Å²	48.6	25%	0.248	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-45	-178.9	171.6	0	0	0	0	110.4	V216 A227 K228 T233 M234 E235 F240	V216-V231 HydrophobicContact CG1-CG2 4.01Å; V216-V231 HydrophobicContact CG2-CG2 4.32Å; A227-V231 WeakPolarHBondContact O-CB 3.44Å; A227-V231 VanDerWaalsContact O-CG2 3.29Å; A227-V231 WeakPolarHBondContact O-CG2 3.28Å; A227-V231 PolarHBondContact O-N 2.95Å; K228-V231 PolarHBondContact O-N 2.83Å; V231-T233 VanDerWaalsContact C-N 3.26Å; V231-T233 PolarHBondContact O-N 3.27Å; V231-M234 PolarHBondContact O-N 2.92Å; V231-E235 WeakPolarHBondContact O-CB 3.39Å; V231-E235 PolarHBondContact O-N 2.64Å; V231-F240 HydrophobicContact CG1-CE2 4.08Å; V231-F240 HydrophobicContact CG1-CZ 4.05Å; V231-F240 WeakPolarHBondContact O-CE2 3.18Å
232	Q	89.1	Confident	90.1	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-36.6	175.4	-78.1	-177.9	-10	0	0	112.8	K228 I230 Y236 T345 Y349	K228-Q232 WeakPolarHBondContact O-CB 3.3Å; K228-Q232 VanDerWaalsContact O-CG 3.23Å; K228-Q232 WeakPolarHBondContact O-CG 3.47Å; K228-Q232 PolarHBondContact O-N 2.85Å; I230-Q232 VanDerWaalsContact C-N 3.35Å; I230-Q232 PolarHBondContact O-N 3.49Å; Q232-Y236 WeakPolarHBondContact O-CB 3.3Å; Q232-Y236 PolarHBondContact O-N 3.04Å; Q232-T345 HydrophobicContact CG-CG2 3.73Å; Q232-Y349 HydrophobicContact CB-CE2 3.93Å; Q232-Y349 HydrophobicContact CG-CE2 4.49Å
233	T	92.8	Very high	89.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-74.3	-39.3	177.5	-55.5	0	0	0	0	111.5	W199 S200 I203 D229 I230 V231 E235 Y236 L237	W199-T233 HydrophobicContact CB-CG2 3.87Å; W199-T233 WeakPolarHBondContact CB-OG1 3.4Å; S200-T233 VanDerWaalsContact OG-CG2 3.3Å; S200-T233 WeakPolarHBondContact OG-CG2 3.29Å; I203-T233 HydrophobicContact CD1-CG2 3.62Å; D229-T233 WeakPolarHBondContact O-CB 3.5Å; D229-T233 PolarHBondContact O-N 3.05Å; D229-T233 PolarHBondContact O-OG1 3.48Å; I230-T233 PolarHBondContact O-N 3.15Å; I230-T233 VanDerWaalsContact O-N 3.12Å; V231-T233 VanDerWaalsContact C-N 3.26Å; V231-T233 PolarHBondContact O-N 3.27Å; T233-E235 VanDerWaalsContact C-N 3.28Å; T233-E235 PolarHBondContact O-N 2.83Å; T233-Y236 WeakPolarHBondContact O-CB 3.28Å; T233-Y236 PolarHBondContact O-N 2.89Å; T233-L237 HydrophobicContact CG2-CD1 4.19Å; T233-L237 HydrophobicContact CG2-CG 4.47Å; T233-L237 WeakPolarHBondContact O-CB 3.27Å; T233-L237 VanDerWaalsContact O-CG 3.29Å; T233-L237 WeakPolarHBondContact O-CG 3.42Å; T233-L237 PolarHBondContact O-N 3.33Å
234	M	92.3	Very high	88.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-37.8	173.1	-71.4	-178.7	176.4	0	0	111.9	I203 L214 M219 I230 V231 L237 R238 M239 F240 I249	I203-M234 HydrophobicContact CD1-CG 4.01Å; I203-M234 HydrophobicContact CG1-CE 4.41Å; I203-M234 HydrophobicContact CG2-CE 3.99Å; I203-M234 HydrophobicContact CG2-CG 4.49Å; L214-M234 HydrophobicContact CD2-CE 4.04Å; M219-M234 HydrophobicContact CE-CE 3.34Å; M219-M234 HydrophobicContact SD-CE 3.79Å; I230-M234 HydrophobicContact CG2-CE 3.69Å; I230-M234 HydrophobicContact CG2-SD 4.13Å; I230-M234 WeakPolarHBondContact O-CG 2.98Å; I230-M234 PolarHBondContact O-N 2.93Å; V231-M234 PolarHBondContact O-N 2.92Å; M234-L237 CarbonylContact O-C 3.39Å; M234-L237 PolarHBondContact O-N 3.01Å; M234-R238 PolarHBondContact O-N 2.82Å; M234-M239 HydrophobicContact CB-CB 4.27Å; M234-M239 HydrophobicContact CB-SD 4.27Å; M234-M239 HydrophobicContact CG-SD 4.03Å; M234-M239 WeakPolarHBondContact O-CB 3.49Å; M234-M239 PolarHBondContact O-N 3.19Å; M234-F240 HydrophobicContact CB-CD2 4.44Å; M234-F240 HydrophobicContact CB-CE2 3.6Å; M234-F240 HydrophobicContact CB-CZ 3.71Å; M234-F240 HydrophobicContact SD-CZ 4.2Å; M234-I249 HydrophobicContact SD-CD1 4.29Å
235	E	89.8	Confident	87.5	Confident	78 Å²	78	60.1 Å²	60.1	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-45.4	173.5	-173.3	176.9	-162.9	0	0	111.5	V231 T233 L237 R238 F240 T345	V231-E235 WeakPolarHBondContact O-CB 3.39Å; V231-E235 PolarHBondContact O-N 2.64Å; T233-E235 VanDerWaalsContact C-N 3.28Å; T233-E235 PolarHBondContact O-N 2.83Å; E235-L237 VanDerWaalsContact C-N 3.27Å; E235-L237 PolarHBondContact O-N 3.05Å; E235-R238 WeakPolarHBondContact O-CA 3.45Å; E235-R238 PolarHBondContact O-N 2.8Å; E235-F240 HydrophobicContact CB-CD2 4Å; E235-F240 HydrophobicContact CB-CE2 4.06Å; E235-T345 VanDerWaalsContact OE2-CB 3.22Å; E235-T345 WeakPolarHBondContact OE2-CB 3.38Å; E235-T345 PolarHBondContact OE2-OG1 2.92Å
236	Y	90.7	Very high	86.3	Confident	106 Å²	106	60 Å²	60	42%	0.416	27%	0.27	S	S	.	.	H	α-helix	trans	-57.7	-39.6	173.6	168.7	-105	0	0	0	112.3	R196 Q232 T233 R238	R196-Y236 HydrophobicContact CB-CE1 4.48Å; Q232-Y236 WeakPolarHBondContact O-CB 3.3Å; Q232-Y236 PolarHBondContact O-N 3.04Å; T233-Y236 WeakPolarHBondContact O-CB 3.28Å; T233-Y236 PolarHBondContact O-N 2.89Å; Y236-R238 PolarHBondContact O-N 3.37Å
237	L	92.4	Very high	85.6	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	7.9	174	-64.8	174.1	0	0	0	112.7	T233 M234 E235 M239 S252 Y255 H258	T233-L237 HydrophobicContact CG2-CD1 4.19Å; T233-L237 HydrophobicContact CG2-CG 4.47Å; T233-L237 WeakPolarHBondContact O-CB 3.27Å; T233-L237 VanDerWaalsContact O-CG 3.29Å; T233-L237 WeakPolarHBondContact O-CG 3.42Å; T233-L237 PolarHBondContact O-N 3.33Å; M234-L237 CarbonylContact O-C 3.39Å; M234-L237 PolarHBondContact O-N 3.01Å; E235-L237 VanDerWaalsContact C-N 3.27Å; E235-L237 PolarHBondContact O-N 3.05Å; L237-M239 HydrophobicContact CB-CG 3.77Å; L237-M239 HydrophobicContact CB-SD 4.03Å; L237-M239 HydrophobicContact CD1-SD 4.07Å; L237-M239 PolarHBondContact O-N 3.13Å; L237-M239 VanDerWaalsContact O-N 3.13Å; L237-S252 WeakPolarHBondContact O-CB 3.39Å; L237-S252 PolarHBondContact O-OG 3.37Å; L237-Y255 HydrophobicContact CD1-CD2 4.29Å; L237-H258 HydrophobicContact CD2-CB 4.23Å
238	R	91.3	Very high	85	Confident	129 Å²	129	62 Å²	62	49%	0.487	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	35.5	-179.7	-55.5	-168.7	-177.3	134.2	-12.4	113.9	M234 E235 Y236 F240 S252 D254	M234-R238 PolarHBondContact O-N 2.82Å; E235-R238 WeakPolarHBondContact O-CA 3.45Å; E235-R238 PolarHBondContact O-N 2.8Å; Y236-R238 PolarHBondContact O-N 3.37Å; R238-F240 VanDerWaalsContact C-N 3.33Å; R238-S252 VanDerWaalsContact O-CB 3.29Å; R238-S252 WeakPolarHBondContact O-CB 3.43Å; R238-D254 WeakPolarHBondContact CD-OD2 3.24Å; R238-D254 WeakPolarHBondContact CG-OD2 3.45Å; R238-D254 IonicContact CZ-OD2 2.71Å; R238-D254 IonicContact NE-OD2 2.75Å; R238-D254 IonicContact NH1-OD1 3.72Å; R238-D254 IonicContact NH1-OD2 3.92Å; R238-D254 PolarHBondContact NH1-OD2 2.9Å
239	M	90	Very high	84.7	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	26%	0.262	C	S	.	.			trans	-80.3	-15	-177.4	-61.8	-179	70	0	0	112.6	I203 L207 M234 L237 I249 I250 Y255	I203-M239 HydrophobicContact CG2-SD 4.34Å; L207-M239 HydrophobicContact CD1-CE 3.69Å; M234-M239 HydrophobicContact CB-CB 4.27Å; M234-M239 HydrophobicContact CB-SD 4.27Å; M234-M239 HydrophobicContact CG-SD 4.03Å; M234-M239 WeakPolarHBondContact O-CB 3.49Å; M234-M239 PolarHBondContact O-N 3.19Å; L237-M239 HydrophobicContact CB-CG 3.77Å; L237-M239 HydrophobicContact CB-SD 4.03Å; L237-M239 HydrophobicContact CD1-SD 4.07Å; L237-M239 PolarHBondContact O-N 3.13Å; L237-M239 VanDerWaalsContact O-N 3.13Å; M239-I249 HydrophobicContact CB-CG2 4.38Å; M239-I249 HydrophobicContact CE-CG2 4.03Å; M239-I249 CarbonylContact O-C 3.57Å; M239-I249 VanDerWaalsContact O-CA 3.27Å; M239-I249 WeakPolarHBondContact O-CA 3.31Å; M239-I250 VanDerWaalsContact O-CG1 3.32Å; M239-I250 WeakPolarHBondContact O-CG1 3.26Å; M239-I250 PolarHBondContact O-N 2.75Å; M239-Y255 HydrophobicContact CE-CD1 4.48Å; M239-Y255 HydrophobicContact CE-CD2 3.77Å; M239-Y255 HydrophobicContact CE-CE2 4.03Å; M239-Y255 HydrophobicContact CE-CG 4.01Å; M239-Y255 HydrophobicContact CG-CG 4.47Å; M239-Y255 HydrophobicContact SD-CD2 3.67Å; M239-Y255 HydrophobicContact SD-CE2 4.36Å; M239-Y255 HydrophobicContact SD-CG 4.08Å
240	F	86.7	Confident	84.4	Confident	64 Å²	64	59.7 Å²	59.7	28%	0.281	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.8	176.6	-61.5	-65.5	0	0	0	111.5	V231 M234 E235 R238 T247 M248 I249	V231-F240 HydrophobicContact CG1-CE2 4.08Å; V231-F240 HydrophobicContact CG1-CZ 4.05Å; V231-F240 WeakPolarHBondContact O-CE2 3.18Å; M234-F240 HydrophobicContact CB-CD2 4.44Å; M234-F240 HydrophobicContact CB-CE2 3.6Å; M234-F240 HydrophobicContact CB-CZ 3.71Å; M234-F240 HydrophobicContact SD-CZ 4.2Å; E235-F240 HydrophobicContact CB-CD2 4Å; E235-F240 HydrophobicContact CB-CE2 4.06Å; R238-F240 VanDerWaalsContact C-N 3.33Å; F240-T247 HydrophobicContact CB-CG2 3.99Å; F240-T247 HydrophobicContact CD1-CG2 3.78Å; F240-T247 HydrophobicContact CG-CG2 4.23Å; F240-M248 WeakPolarHBondContact CA-O 3.35Å; F240-I249 HydrophobicContact CD1-CG1 3.92Å; F240-I249 HydrophobicContact CE1-CD1 4.05Å; F240-I249 HydrophobicContact CE1-CG1 3.75Å
241	R	80.7	Confident	84.2	Confident	154 Å²	154	64.3 Å²	64.3	58%	0.581	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.8	172.5	-174.6	175.2	-179.5	171.5	3.1	110.2	M248 I250	R241-M248 PolarHBondContact N-O 3Å; R241-M248 PolarHBondContact O-N 2.92Å; R241-I250 HydrophobicContact CB-CD1 4.11Å; R241-I250 HydrophobicContact CB-CG1 4.31Å; R241-I250 HydrophobicContact CB-CG2 4.04Å
242	K	79.2	Confident	84.2	Confident	179 Å²	179	62.8 Å²	62.8	78%	0.778	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.9	171.6	-65.8	-175.7	179.1	-178.3	0	110.1	A246	K242-A246 CarbonylContact C-O 3.46Å; K242-A246 WeakPolarHBondContact CA-O 3.4Å
243	K	75.1	Confident	84.5	Confident	88 Å²	88	66.4 Å²	66.4	38%	0.383	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	126.7	173.3	-171.9	-175.3	174.9	-171	0	108.8	N245 A246 M248	K243-N245 VanDerWaalsContact C-N 3.35Å; K243-N245 PolarHBondContact O-N 2.88Å; K243-A246 PolarHBondContact N-O 2.74Å; K243-A246 WeakPolarHBondContact O-CA 3.39Å; K243-A246 WeakPolarHBondContact O-CB 3.17Å; K243-A246 PolarHBondContact O-N 3.04Å; K243-M248 HydrophobicContact CB-CE 3.83Å; K243-M248 HydrophobicContact CB-SD 4.29Å; K243-M248 HydrophobicContact CD-CE 3.7Å; K243-M248 HydrophobicContact CD-SD 4.27Å; K243-M248 HydrophobicContact CG-CE 4.38Å
244	D	76.6	Confident	84.5	Confident	112 Å²	112	69.2 Å²	69.2	60%	0.599	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	45.9	174.1	-48.7	-33.7	0	0	0	113.7	A246 V490	D244-A246 PolarHBondContact O-N 3.48Å; D244-V490 HydrophobicContact CB-CG1 4.33Å
245	N	72.9	Confident	84.6	Confident	161 Å²	161	69.9 Å²	69.9	86%	0.861	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	3.3	-172.7	-65.5	-20.8	0	0	0	116.1	K243	K243-N245 VanDerWaalsContact C-N 3.35Å; K243-N245 PolarHBondContact O-N 2.88Å
246	A	69.8	Low	84.8	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	145.3	169.4	0	0	0	0	0	111.7	K242 K243 D244 M248 V490 C491	K242-A246 CarbonylContact C-O 3.46Å; K242-A246 WeakPolarHBondContact CA-O 3.4Å; K243-A246 PolarHBondContact N-O 2.74Å; K243-A246 WeakPolarHBondContact O-CA 3.39Å; K243-A246 WeakPolarHBondContact O-CB 3.17Å; K243-A246 PolarHBondContact O-N 3.04Å; D244-A246 PolarHBondContact O-N 3.48Å; A246-M248 HydrophobicContact CB-CG 4.5Å; A246-V490 HydrophobicContact CB-CG1 3.75Å; A246-C491 VanDerWaalsContact CA-O 3.26Å; A246-C491 WeakPolarHBondContact CA-O 3.49Å; A246-C491 VanDerWaalsContact CB-C 3.43Å; A246-C491 WeakPolarHBondContact CB-O 3.49Å
247	T	75.8	Confident	85.1	Confident	51 Å²	51	67 Å²	67	31%	0.313	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.4	162.2	-58.8	0	0	0	0	108.5	F240	F240-T247 HydrophobicContact CB-CG2 3.99Å; F240-T247 HydrophobicContact CD1-CG2 3.78Å; F240-T247 HydrophobicContact CG-CG2 4.23Å
248	M	76.9	Confident	85.2	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.069	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	148.3	177.9	-54.4	-169	-49.5	0	0	110.3	F240 R241 K243 A246 A488	F240-M248 WeakPolarHBondContact CA-O 3.35Å; R241-M248 PolarHBondContact N-O 3Å; R241-M248 PolarHBondContact O-N 2.92Å; K243-M248 HydrophobicContact CB-CE 3.83Å; K243-M248 HydrophobicContact CB-SD 4.29Å; K243-M248 HydrophobicContact CD-CE 3.7Å; K243-M248 HydrophobicContact CD-SD 4.27Å; K243-M248 HydrophobicContact CG-CE 4.38Å; A246-M248 HydrophobicContact CB-CG 4.5Å; M248-A488 HydrophobicContact CE-CB 4.01Å
249	I	83.1	Confident	85.4	Confident	13 Å²	13	62 Å²	62	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.3	169.2	-66.9	171.7	0	0	0	109.1	L214 M234 M239 F240 I331 I333	L214-I249 HydrophobicContact CD2-CD1 3.48Å; L214-I249 VanDerWaalsContact CD2-CD1 3.48Å; M234-I249 HydrophobicContact SD-CD1 4.29Å; M239-I249 HydrophobicContact CB-CG2 4.38Å; M239-I249 HydrophobicContact CE-CG2 4.03Å; M239-I249 CarbonylContact O-C 3.57Å; M239-I249 VanDerWaalsContact O-CA 3.27Å; M239-I249 WeakPolarHBondContact O-CA 3.31Å; F240-I249 HydrophobicContact CD1-CG1 3.92Å; F240-I249 HydrophobicContact CE1-CD1 4.05Å; F240-I249 HydrophobicContact CE1-CG1 3.75Å; I249-I331 HydrophobicContact CB-CB 4.35Å; I249-I331 HydrophobicContact CB-CD1 4.34Å; I249-I331 HydrophobicContact CB-CG2 4.19Å; I249-I331 HydrophobicContact CD1-CG2 3.91Å; I249-I331 HydrophobicContact CG1-CG2 4.49Å; I249-I331 HydrophobicContact CG2-CD1 3.92Å; I249-I333 HydrophobicContact CD1-CD1 3.56Å; I249-I333 HydrophobicContact CD1-CG1 3.93Å; I249-I333 HydrophobicContact CG1-CD1 4.01Å
250	I	84.4	Confident	85.7	Confident	52 Å²	52	69.9 Å²	69.9	27%	0.267	34%	0.342	S	S	.	.			trans	-126	151.2	-179.5	62.9	162.1	0	0	0	111.2	M239 R241 S252	M239-I250 VanDerWaalsContact O-CG1 3.32Å; M239-I250 WeakPolarHBondContact O-CG1 3.26Å; M239-I250 PolarHBondContact O-N 2.75Å; R241-I250 HydrophobicContact CB-CD1 4.11Å; R241-I250 HydrophobicContact CB-CG1 4.31Å; R241-I250 HydrophobicContact CB-CG2 4.04Å; I250-S252 VanDerWaalsContact C-N 3.31Å; I250-S252 PolarHBondContact O-N 3.24Å
251	E	88.3	Confident	86.1	Confident	99 Å²	99	70.8 Å²	70.8	46%	0.463	35%	0.346	S	S	.	.			trans	-75.8	85.4	164.1	-64.7	178.7	179	0	0	108.6	Y255 L256	E251-Y255 HydrophobicContact CB-CD1 4.07Å; E251-Y255 HydrophobicContact CB-CE1 4.32Å; E251-Y255 HydrophobicContact CG-CD1 4.23Å; E251-Y255 HydrophobicContact CG-CE1 3.99Å; E251-L256 HydrophobicContact CB-CD1 4.5Å; E251-L256 HydrophobicContact CB-CD2 4.21Å; E251-L256 HydrophobicContact CB-CG 4.3Å
252	S	91	Very high	86.8	Confident	9 Å²	9	64.5 Å²	64.5	6%	0.063	32%	0.322	C	S	.	.			trans	-67.3	163.6	179	73.2	0	0	0	0	111.9	L237 R238 I250 D254 Y255 L256	L237-S252 WeakPolarHBondContact O-CB 3.39Å; L237-S252 PolarHBondContact O-OG 3.37Å; R238-S252 VanDerWaalsContact O-CB 3.29Å; R238-S252 WeakPolarHBondContact O-CB 3.43Å; I250-S252 VanDerWaalsContact C-N 3.31Å; I250-S252 PolarHBondContact O-N 3.24Å; S252-D254 VanDerWaalsContact C-N 3.25Å; S252-D254 PolarHBondContact O-N 3.47Å; S252-D254 PolarHBondContact OG-N 3.25Å; S252-Y255 PolarHBondContact O-N 3.1Å; S252-Y255 VanDerWaalsContact OG-CB 3.3Å; S252-Y255 WeakPolarHBondContact OG-CB 3.31Å; S252-Y255 PolarHBondContact OG-N 3.42Å; S252-L256 WeakPolarHBondContact O-CB 3.49Å; S252-L256 VanDerWaalsContact O-CG 3.31Å; S252-L256 WeakPolarHBondContact O-CG 3.25Å; S252-L256 PolarHBondContact O-N 2.91Å
253	A	93.9	Very high	87.6	Confident	79 Å²	79	61.5 Å²	61.5	65%	0.653	31%	0.309	S	S	*	.	H	α-helix	trans	-59.1	-38.9	173	0	0	0	0	0	112	L256 D257	A253-L256 PolarHBondContact O-N 2.92Å; A253-D257 VanDerWaalsContact O-CB 3.27Å; A253-D257 WeakPolarHBondContact O-CB 3.49Å; A253-D257 PolarHBondContact O-N 2.93Å
254	D	93.5	Very high	88.6	Confident	59 Å²	59	60 Å²	60	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-42	179.9	-60.8	-28.7	0	0	0	111.4	R238 S252 H258	R238-D254 WeakPolarHBondContact CD-OD2 3.24Å; R238-D254 WeakPolarHBondContact CG-OD2 3.45Å; R238-D254 IonicContact CZ-OD2 2.71Å; R238-D254 IonicContact NE-OD2 2.75Å; R238-D254 IonicContact NH1-OD1 3.72Å; R238-D254 IonicContact NH1-OD2 3.92Å; R238-D254 PolarHBondContact NH1-OD2 2.9Å; S252-D254 VanDerWaalsContact C-N 3.25Å; S252-D254 PolarHBondContact O-N 3.47Å; S252-D254 PolarHBondContact OG-N 3.25Å; D254-H258 WeakPolarHBondContact O-CB 3.37Å; D254-H258 PolarHBondContact O-N 3.24Å
255	Y	94.2	Very high	89.3	Confident	13 Å²	13	54.8 Å²	54.8	5%	0.051	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-49.9	173.1	167.8	-101.9	0	0	0	111.7	I203 C204 L207 L237 M239 E251 S252 D257 H258 C259	I203-Y255 HydrophobicContact CG2-CE2 4.45Å; C204-Y255 HydrophobicContact CB-CE2 4.42Å; L207-Y255 WeakPolarHBondContact CB-OH 3.18Å; L207-Y255 HydrophobicContact CD1-CE2 3.86Å; L237-Y255 HydrophobicContact CD1-CD2 4.29Å; M239-Y255 HydrophobicContact CE-CD1 4.48Å; M239-Y255 HydrophobicContact CE-CD2 3.77Å; M239-Y255 HydrophobicContact CE-CE2 4.03Å; M239-Y255 HydrophobicContact CE-CG 4.01Å; M239-Y255 HydrophobicContact CG-CG 4.47Å; M239-Y255 HydrophobicContact SD-CD2 3.67Å; M239-Y255 HydrophobicContact SD-CE2 4.36Å; M239-Y255 HydrophobicContact SD-CG 4.08Å; E251-Y255 HydrophobicContact CB-CD1 4.07Å; E251-Y255 HydrophobicContact CB-CE1 4.32Å; E251-Y255 HydrophobicContact CG-CD1 4.23Å; E251-Y255 HydrophobicContact CG-CE1 3.99Å; S252-Y255 PolarHBondContact O-N 3.1Å; S252-Y255 VanDerWaalsContact OG-CB 3.3Å; S252-Y255 WeakPolarHBondContact OG-CB 3.31Å; S252-Y255 PolarHBondContact OG-N 3.42Å; Y255-D257 VanDerWaalsContact C-N 3.32Å; Y255-D257 PolarHBondContact O-N 3.17Å; Y255-H258 PolarHBondContact O-N 3.13Å; Y255-C259 WeakPolarHBondContact CE2-SG 3.31Å; Y255-C259 PolarHBondContact O-N 2.76Å; Y255-C259 PolarHBondContact O-SG 2.87Å; Y255-C259 VanDerWaalsContact O-SG 3.36Å
256	L	94.8	Very high	90.3	Very high	80 Å²	80	50.8 Å²	50.8	42%	0.419	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-39.9	179.8	-69.4	174.4	0	0	0	111.5	E251 S252 A253 C259 R260	E251-L256 HydrophobicContact CB-CD1 4.5Å; E251-L256 HydrophobicContact CB-CD2 4.21Å; E251-L256 HydrophobicContact CB-CG 4.3Å; S252-L256 WeakPolarHBondContact O-CB 3.49Å; S252-L256 VanDerWaalsContact O-CG 3.31Å; S252-L256 WeakPolarHBondContact O-CG 3.25Å; S252-L256 PolarHBondContact O-N 2.91Å; A253-L256 PolarHBondContact O-N 2.92Å; L256-C259 PolarHBondContact O-N 3.04Å; L256-R260 WeakPolarHBondContact O-CG 3.23Å; L256-R260 PolarHBondContact O-N 3.14Å
257	D	96.2	Very high	91.4	Very high	44 Å²	44	60.2 Å²	60.2	24%	0.235	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-45.6	173.9	-172.5	60.7	0	0	0	112	A253 Y255 C259 R260 K261	A253-D257 VanDerWaalsContact O-CB 3.27Å; A253-D257 WeakPolarHBondContact O-CB 3.49Å; A253-D257 PolarHBondContact O-N 2.93Å; Y255-D257 VanDerWaalsContact C-N 3.32Å; Y255-D257 PolarHBondContact O-N 3.17Å; D257-C259 PolarHBondContact O-N 2.9Å; D257-R260 WeakPolarHBondContact O-CB 3.1Å; D257-R260 PolarHBondContact O-N 3.27Å; D257-R260 IonicContact OD1-CZ 3.66Å; D257-R260 IonicContact OD1-NE 3.81Å; D257-R260 IonicContact OD1-NH2 2.75Å; D257-R260 PolarHBondContact OD1-NH2 3.19Å; D257-K261 WeakPolarHBondContact O-CG 3.14Å; D257-K261 PolarHBondContact O-N 3.36Å; D257-K261 WeakPolarHBondContact OD2-CD 3.49Å; D257-K261 WeakPolarHBondContact OD2-CE 3.37Å; D257-K261 IonicContact OD2-NZ 2.68Å; D257-K261 PolarHBondContact OD2-NZ 3.15Å
258	H	95.6	Very high	92.2	Very high	21 Å²	21	60.5 Å²	60.5	10%	0.097	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-48.6	175.6	-172.6	80.6	0	0	0	111.8	S200 D201 L237 D254 Y255 R260 K261 R262	S200-H258 VanDerWaalsContact CB-CD2 3.48Å; S200-H258 WeakPolarHBondContact CB-CD2 3.38Å; S200-H258 VanDerWaalsContact CB-CE1 3.4Å; S200-H258 WeakPolarHBondContact CB-CE1 3.27Å; S200-H258 WeakPolarHBondContact CB-NE2 3.48Å; D201-H258 PolarHBondContact N-NE2 2.88Å; D201-H258 IonicContact OD1-CD2 3.85Å; D201-H258 IonicContact OD1-CE1 3.71Å; D201-H258 PolarHBondContact OD1-CE1 3.05Å; D201-H258 IonicContact OD1-NE2 2.81Å; D201-H258 PolarHBondContact OD1-NE2 3.27Å; L237-H258 HydrophobicContact CD2-CB 4.23Å; D254-H258 WeakPolarHBondContact O-CB 3.37Å; D254-H258 PolarHBondContact O-N 3.24Å; Y255-H258 PolarHBondContact O-N 3.13Å; H258-R260 VanDerWaalsContact C-N 3.3Å; H258-R260 PolarHBondContact O-N 3.44Å; H258-K261 PolarHBondContact O-N 3.05Å; H258-R262 WeakPolarHBondContact O-CB 3.16Å; H258-R262 PolarHBondContact O-N 2.58Å
259	C	95.5	Very high	92.7	Very high	9 Å²	9	62.6 Å²	62.6	6%	0.061	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-33.7	179	-56.7	0	0	0	0	112	C204 Y255 L256 D257 K263	C204-C259 HydrophobicContact CB-CB 4.22Å; C204-C259 WeakPolarHBondContact CB-SG 3.46Å; C204-C259 VanDerWaalsContact SG-CA 3.52Å; C204-C259 WeakPolarHBondContact SG-CB 3.37Å; C204-C259 CovalentContact SG-SG 2.07Å; C204-C259 PolarHBondContact SG-SG 2.84Å; Y255-C259 WeakPolarHBondContact CE2-SG 3.31Å; Y255-C259 PolarHBondContact O-N 2.76Å; Y255-C259 PolarHBondContact O-SG 2.87Å; Y255-C259 VanDerWaalsContact O-SG 3.36Å; L256-C259 PolarHBondContact O-N 3.04Å; D257-C259 PolarHBondContact O-N 2.9Å; C259-K263 WeakPolarHBondContact O-CG 3.03Å; C259-K263 PolarHBondContact O-N 2.85Å
260	R	96.2	Very high	92.9	Very high	166 Å²	166	68.9 Å²	68.9	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-63.1	-48.7	171	-73.1	-175.3	-54	175.8	5.2	111.8	L256 D257 H258 R262 K263 A264	L256-R260 WeakPolarHBondContact O-CG 3.23Å; L256-R260 PolarHBondContact O-N 3.14Å; D257-R260 WeakPolarHBondContact O-CB 3.1Å; D257-R260 PolarHBondContact O-N 3.27Å; D257-R260 IonicContact OD1-CZ 3.66Å; D257-R260 IonicContact OD1-NE 3.81Å; D257-R260 IonicContact OD1-NH2 2.75Å; D257-R260 PolarHBondContact OD1-NH2 3.19Å; H258-R260 VanDerWaalsContact C-N 3.3Å; H258-R260 PolarHBondContact O-N 3.44Å; R260-R262 VanDerWaalsContact C-N 3.32Å; R260-R262 PolarHBondContact O-N 3.42Å; R260-K263 PolarHBondContact O-N 2.82Å; R260-A264 PolarHBondContact O-N 3.42Å
261	K	95.1	Very high	93.2	Very high	84 Å²	84	68 Å²	68	37%	0.365	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-39.3	177.5	-75.5	171.6	172.9	163.7	0	111.9	D257 H258 A264 A265	D257-K261 WeakPolarHBondContact O-CG 3.14Å; D257-K261 PolarHBondContact O-N 3.36Å; D257-K261 WeakPolarHBondContact OD2-CD 3.49Å; D257-K261 WeakPolarHBondContact OD2-CE 3.37Å; D257-K261 IonicContact OD2-NZ 2.68Å; D257-K261 PolarHBondContact OD2-NZ 3.15Å; H258-K261 PolarHBondContact O-N 3.05Å; K261-A264 PolarHBondContact O-N 2.91Å; K261-A265 WeakPolarHBondContact O-CB 3.37Å; K261-A265 PolarHBondContact O-N 2.78Å
262	R	95.5	Very high	93.4	Very high	21 Å²	21	66.4 Å²	66.4	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-59.9	-52.8	173.2	176.1	176.5	166.7	-99.1	0.3	111.2	E208 H258 R260 A264 A265 I266 Y271	E208-R262 IonicContact OE1-NH1 2.72Å; E208-R262 IonicContact OE2-CZ 2.73Å; E208-R262 IonicContact OE2-NH1 3.81Å; E208-R262 PolarHBondContact OE2-NH1 2.87Å; H258-R262 WeakPolarHBondContact O-CB 3.16Å; H258-R262 PolarHBondContact O-N 2.58Å; R260-R262 VanDerWaalsContact C-N 3.32Å; R260-R262 PolarHBondContact O-N 3.42Å; R262-A264 VanDerWaalsContact C-N 3.3Å; R262-A264 PolarHBondContact O-N 3.11Å; R262-A265 WeakPolarHBondContact O-CB 3.26Å; R262-A265 PolarHBondContact O-N 2.79Å; R262-A265 VanDerWaalsContact O-N 3.07Å; R262-I266 HydrophobicContact CG-CD1 4Å; R262-I266 WeakPolarHBondContact O-CG1 3.43Å; R262-I266 PolarHBondContact O-N 3.34Å; R262-Y271 HydrophobicContact CG-CD2 4.41Å; R262-Y271 HydrophobicContact CG-CE2 3.93Å; R262-Y271 PolarHBondContact NE-OH 3.33Å
263	K	95.2	Very high	93.6	Very high	117 Å²	117	70.5 Å²	70.5	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-40.5	177.8	-74.7	173.7	-179.9	163.1	0	112.5	E208 C259 R260 I266 K267	E208-K263 WeakPolarHBondContact OE1-CE 3.3Å; E208-K263 IonicContact OE1-NZ 2.69Å; E208-K263 PolarHBondContact OE1-NZ 3.01Å; C259-K263 WeakPolarHBondContact O-CG 3.03Å; C259-K263 PolarHBondContact O-N 2.85Å; R260-K263 PolarHBondContact O-N 2.82Å; K263-I266 PolarHBondContact O-N 2.96Å; K263-K267 PolarHBondContact O-N 3.18Å
264	A	95.2	Very high	93.6	Very high	55 Å²	55	67.2 Å²	67.2	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-64.4	-39.9	175	0	0	0	0	0	112.6	R260 K261 R262 K267 A268	R260-A264 PolarHBondContact O-N 3.42Å; K261-A264 PolarHBondContact O-N 2.91Å; R262-A264 VanDerWaalsContact C-N 3.3Å; R262-A264 PolarHBondContact O-N 3.11Å; A264-K267 PolarHBondContact O-N 3.38Å; A264-A268 VanDerWaalsContact O-CB 3.31Å; A264-A268 WeakPolarHBondContact O-CB 3.48Å; A264-A268 PolarHBondContact O-N 2.82Å
265	A	92.6	Very high	93.7	Very high	4 Å²	4	68.9 Å²	68.9	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-37	176.6	0	0	0	0	0	112.8	K261 R262 A268 G269 R270 Y271	K261-A265 WeakPolarHBondContact O-CB 3.37Å; K261-A265 PolarHBondContact O-N 2.78Å; R262-A265 WeakPolarHBondContact O-CB 3.26Å; R262-A265 PolarHBondContact O-N 2.79Å; R262-A265 VanDerWaalsContact O-N 3.07Å; A265-A268 PolarHBondContact O-N 2.96Å; A265-G269 PolarHBondContact O-N 2.91Å; A265-R270 PolarHBondContact O-N 3.05Å; A265-Y271 PolarHBondContact O-N 3.36Å
266	I	93.7	Very high	93.7	Very high	77 Å²	77	73.6 Å²	73.6	40%	0.395	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-52.6	172.8	-66.4	166	0	0	0	109.9	R262 K263 A268 G269 Y271	R262-I266 HydrophobicContact CG-CD1 4Å; R262-I266 WeakPolarHBondContact O-CG1 3.43Å; R262-I266 PolarHBondContact O-N 3.34Å; K263-I266 PolarHBondContact O-N 2.96Å; I266-A268 PolarHBondContact O-N 3.29Å; I266-G269 PolarHBondContact O-N 3.44Å; I266-Y271 HydrophobicContact CD1-CD1 4.46Å; I266-Y271 HydrophobicContact CD1-CE1 4.43Å; I266-Y271 HydrophobicContact CD1-CE2 4.48Å; I266-Y271 HydrophobicContact CD1-CG 4.46Å; I266-Y271 HydrophobicContact CG1-CD1 3.77Å; I266-Y271 HydrophobicContact CG1-CD2 3.89Å; I266-Y271 HydrophobicContact CG1-CE1 4.22Å; I266-Y271 HydrophobicContact CG1-CE2 4.33Å; I266-Y271 HydrophobicContact CG1-CG 3.54Å
267	K	93.7	Very high	93.7	Very high	197 Å²	197	76.3 Å²	76.3	86%	0.857	38%	0.377	S	S	*	.	H	α-helix	trans	-58.6	-33.4	178.8	-172.1	179.1	178.7	-175.7	0	112.7	K263 A264 G269	K263-K267 PolarHBondContact O-N 3.18Å; A264-K267 PolarHBondContact O-N 3.38Å; K267-G269 VanDerWaalsContact C-N 3.3Å; K267-G269 PolarHBondContact O-N 3.34Å
268	A	91.4	Very high	93.7	Very high	57 Å²	57	75.5 Å²	75.5	47%	0.471	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	2.3	178	0	0	0	0	0	114.4	A264 A265 I266 R270	A264-A268 VanDerWaalsContact O-CB 3.31Å; A264-A268 WeakPolarHBondContact O-CB 3.48Å; A264-A268 PolarHBondContact O-N 2.82Å; A265-A268 PolarHBondContact O-N 2.96Å; I266-A268 PolarHBondContact O-N 3.29Å; A268-R270 HydrophobicContact CB-CG 4.43Å; A268-R270 PolarHBondContact O-N 3.14Å
269	G	87.5	Confident	93.8	Very high	59 Å²	59	75.3 Å²	75.3	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	14.7	-178.8	0	0	0	0	0	114.8	A265 I266 K267	A265-G269 PolarHBondContact O-N 2.91Å; I266-G269 PolarHBondContact O-N 3.44Å; K267-G269 VanDerWaalsContact C-N 3.3Å; K267-G269 PolarHBondContact O-N 3.34Å
270	R	86.6	Confident	93.8	Very high	145 Å²	145	79.2 Å²	79.2	55%	0.547	39%	0.394	S	S	.	.			trans	-92.7	-12.1	-179.5	-69.7	-175.8	-71.2	104.7	-2.5	113.1	A265 A268	A265-R270 PolarHBondContact O-N 3.05Å; A268-R270 HydrophobicContact CB-CG 4.43Å; A268-R270 PolarHBondContact O-N 3.14Å
271	Y	91.7	Very high	93.6	Very high	34 Å²	34	73.5 Å²	73.5	13%	0.133	38%	0.377	C	S	.	.			trans	-87	123.5	176.4	-173.8	-86.5	0	0	0	109.5	R164 D201 R262 A265 I266 E273	R164-Y271 VanDerWaalsContact CZ-OH 3.31Å; R164-Y271 PolarHBondContact NH2-OH 3.05Å; D201-Y271 HydrophobicContact CB-CE2 4.4Å; D201-Y271 WeakPolarHBondContact OD2-CE2 3.32Å; R262-Y271 HydrophobicContact CG-CD2 4.41Å; R262-Y271 HydrophobicContact CG-CE2 3.93Å; R262-Y271 PolarHBondContact NE-OH 3.33Å; A265-Y271 PolarHBondContact O-N 3.36Å; I266-Y271 HydrophobicContact CD1-CD1 4.46Å; I266-Y271 HydrophobicContact CD1-CE1 4.43Å; I266-Y271 HydrophobicContact CD1-CE2 4.48Å; I266-Y271 HydrophobicContact CD1-CG 4.46Å; I266-Y271 HydrophobicContact CG1-CD1 3.77Å; I266-Y271 HydrophobicContact CG1-CD2 3.89Å; I266-Y271 HydrophobicContact CG1-CE1 4.22Å; I266-Y271 HydrophobicContact CG1-CE2 4.33Å; I266-Y271 HydrophobicContact CG1-CG 3.54Å; Y271-E273 HydrophobicContact CD1-CB 4.41Å; Y271-E273 HydrophobicContact CE1-CB 3.89Å; Y271-E273 WeakPolarHBondContact CE1-OE2 3.48Å
272	K	92.7	Very high	93.3	Very high	64 Å²	64	71 Å²	71	28%	0.278	37%	0.368	S	S	.	.			trans	-118	130.6	177.7	-66	-172.1	172.7	-66.9	0	108.9	K160 Y162 R164 L165	K160-K272 VanDerWaalsContact O-CE 3.29Å; K160-K272 WeakPolarHBondContact O-CE 3.47Å; Y162-K272 HydrophobicContact CD1-CD 4.01Å; Y162-K272 HydrophobicContact CE1-CD 4.1Å; R164-K272 PolarHBondContact NH1-O 3.31Å; L165-K272 HydrophobicContact CB-CB 4.17Å; L165-K272 HydrophobicContact CD1-CB 4.28Å
273	E	93.9	Very high	92.8	Very high	96 Å²	96	76 Å²	76	45%	0.449	39%	0.392	S	S	.	.			trans	-135.8	149.9	-178.3	-170.3	170.3	-169	0	0	108	D168 Y271 K275	D168-E273 WeakPolarHBondContact OD2-CA 3.07Å; D168-E273 WeakPolarHBondContact OD2-CG 3.41Å; Y271-E273 HydrophobicContact CD1-CB 4.41Å; Y271-E273 HydrophobicContact CE1-CB 3.89Å; Y271-E273 WeakPolarHBondContact CE1-OE2 3.48Å; E273-K275 PolarHBondContact O-N 3.35Å
274	I	95.7	Very high	92.1	Very high	10 Å²	10	72 Å²	72	5%	0.051	38%	0.381	C	S	.	.			trans	-71.8	123.2	175.9	-69.7	-65.8	0	0	0	109.2	Y67 I74 L165 D168 F169 F172 V279	Y67-I274 HydrophobicContact CD1-CD1 4.35Å; Y67-I274 HydrophobicContact CD2-CD1 3.89Å; Y67-I274 HydrophobicContact CD2-CG2 4.25Å; Y67-I274 HydrophobicContact CE1-CD1 4.17Å; Y67-I274 HydrophobicContact CE2-CB 4.46Å; Y67-I274 HydrophobicContact CE2-CD1 3.66Å; Y67-I274 HydrophobicContact CE2-CG2 3.89Å; Y67-I274 HydrophobicContact CG-CD1 4.2Å; I74-I274 HydrophobicContact CD1-CD1 4.21Å; L165-I274 HydrophobicContact CD1-CD1 3.5Å; L165-I274 HydrophobicContact CD1-CG1 3.98Å; L165-I274 HydrophobicContact CG-CD1 3.96Å; D168-I274 HydrophobicContact CB-CG1 4.24Å; D168-I274 PolarHBondContact OD2-N 3.42Å; F169-I274 HydrophobicContact CB-CD1 3.9Å; F169-I274 HydrophobicContact CB-CG1 3.86Å; F169-I274 HydrophobicContact CD2-CD1 3.66Å; F169-I274 HydrophobicContact CD2-CG1 3.99Å; F169-I274 HydrophobicContact CD2-CG2 4.35Å; F169-I274 HydrophobicContact CG-CD1 4.21Å; F169-I274 HydrophobicContact CG-CG1 4.44Å; F172-I274 HydrophobicContact CD2-CG2 4.48Å; I274-V279 HydrophobicContact CG2-CG2 3.5Å; I274-V279 VanDerWaalsContact CG2-CG2 3.5Å
275	K	95.7	Very high	91.6	Very high	94 Å²	94	69.5 Å²	69.5	41%	0.409	36%	0.36	S	S	.	.			trans	-80.6	111.6	166.8	-75.1	-173.7	-175.1	158.4	0	109.2	Y67 E69 E273 D277 C278	Y67-K275 PolarHBondContact OH-N 3.41Å; E69-K275 HydrophobicContact CG-CD 4.41Å; E69-K275 VanDerWaalsContact OE1-CD 3.22Å; E69-K275 WeakPolarHBondContact OE1-CD 3.43Å; E69-K275 WeakPolarHBondContact OE1-CE 3.05Å; E69-K275 IonicContact OE1-NZ 3.45Å; E69-K275 PolarHBondContact OE1-NZ 3.16Å; E273-K275 PolarHBondContact O-N 3.35Å; K275-D277 VanDerWaalsContact CB-OD1 3.31Å; K275-D277 WeakPolarHBondContact CB-OD1 3.45Å; K275-D277 PolarHBondContact O-N 3.03Å; K275-C278 HydrophobicContact CB-CB 4.01Å; K275-C278 WeakPolarHBondContact O-CA 3.35Å; K275-C278 WeakPolarHBondContact O-CB 3.38Å; K275-C278 PolarHBondContact O-N 3.25Å
276	E	93.4	Very high	91	Very high	112 Å²	112	76.1 Å²	76.1	52%	0.523	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-62.9	-29.3	-172.6	-58.5	-160.5	161.9	0	0	112.7	F172 R175 C278 V279	F172-E276 HydrophobicContact CD2-CG 3.94Å; F172-E276 HydrophobicContact CE2-CB 4.02Å; F172-E276 HydrophobicContact CE2-CG 3.68Å; R175-E276 IonicContact CZ-OE1 3.09Å; R175-E276 IonicContact NE-OE1 2.77Å; R175-E276 IonicContact NH2-OE1 3.56Å; R175-E276 PolarHBondContact NH2-OE1 3.31Å; E276-C278 PolarHBondContact O-N 3.36Å; E276-V279 WeakPolarHBondContact O-CB 3.25Å; E276-V279 PolarHBondContact O-N 3.13Å
277	D	95.3	Very high	89.7	Confident	137 Å²	137	76.9 Å²	76.9	73%	0.733	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-65.2	-23.5	171.8	58	-53	0	0	0	113.6	K275	K275-D277 VanDerWaalsContact CB-OD1 3.31Å; K275-D277 WeakPolarHBondContact CB-OD1 3.45Å; K275-D277 PolarHBondContact O-N 3.03Å
278	C	96	Very high	87.8	Confident	26 Å²	26	70 Å²	70	18%	0.176	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-89.1	-1.6	176.1	-65.3	0	0	0	0	113.1	Y67 K68 E69 K275 E276	Y67-C278 WeakPolarHBondContact CA-O 3.38Å; Y67-C278 HydrophobicContact CD2-CB 4.01Å; Y67-C278 HydrophobicContact CE2-CB 3.54Å; K68-C278 PolarHBondContact N-O 2.79Å; K68-C278 WeakPolarHBondContact O-CB 3.3Å; E69-C278 HydrophobicContact CB-CB 4.26Å; K275-C278 HydrophobicContact CB-CB 4.01Å; K275-C278 WeakPolarHBondContact O-CA 3.35Å; K275-C278 WeakPolarHBondContact O-CB 3.38Å; K275-C278 PolarHBondContact O-N 3.25Å; E276-C278 PolarHBondContact O-N 3.36Å
279	V	96.5	Very high	85.6	Confident	17 Å²	17	74.5 Å²	74.5	10%	0.103	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-89.5	126.5	-179.1	-177	0	0	0	0	111	V66 Y67 F169 F172 I274 E276 V281 M285	V66-V279 WeakPolarHBondContact O-CG1 3.4Å; Y67-V279 HydrophobicContact CD2-CG2 3.8Å; Y67-V279 HydrophobicContact CE2-CG2 4.28Å; F169-V279 HydrophobicContact CE2-CG1 4.09Å; F169-V279 HydrophobicContact CE2-CG2 4.26Å; F172-V279 HydrophobicContact CD1-CG1 4.23Å; F172-V279 HydrophobicContact CD1-CG2 4.48Å; F172-V279 HydrophobicContact CE1-CB 4.21Å; F172-V279 HydrophobicContact CE1-CG1 3.51Å; F172-V279 HydrophobicContact CE1-CG2 4.19Å; F172-V279 HydrophobicContact CE2-CG2 4.26Å; F172-V279 HydrophobicContact CZ-CB 4.06Å; F172-V279 HydrophobicContact CZ-CG1 3.83Å; F172-V279 HydrophobicContact CZ-CG2 4.05Å; I274-V279 HydrophobicContact CG2-CG2 3.5Å; I274-V279 VanDerWaalsContact CG2-CG2 3.5Å; E276-V279 WeakPolarHBondContact O-CB 3.25Å; E276-V279 PolarHBondContact O-N 3.13Å; V279-V281 HydrophobicContact CG1-CG2 3.93Å; V279-M285 HydrophobicContact CG1-CE 4.23Å
280	I	96.2	Very high	83.4	Confident	92 Å²	92	78 Å²	78	47%	0.472	37%	0.372	S	S	.	.			trans	-98.5	95.6	174.7	-54.8	170.1	0	0	0	107.9	I65 V66	I65-I280 HydrophobicContact CG2-CD1 4.11Å; V66-I280 PolarHBondContact O-N 3.09Å
281	V	91.8	Very high	80.8	Confident	46 Å²	46	80.6 Å²	80.6	28%	0.279	38%	0.382	S	S	.	.			trans	-77	125.5	-176.1	-179.2	0	0	0	0	111	F172 L176 V279 R286	F172-V281 HydrophobicContact CE1-CG2 4.33Å; F172-V281 HydrophobicContact CZ-CG2 4.33Å; L176-V281 HydrophobicContact CD1-CG1 4.22Å; L176-V281 HydrophobicContact CD2-CG1 3.49Å; L176-V281 VanDerWaalsContact CD2-CG1 3.49Å; L176-V281 HydrophobicContact CD2-CG2 4.27Å; L176-V281 HydrophobicContact CG-CG1 4.45Å; V279-V281 HydrophobicContact CG1-CG2 3.93Å; V281-R286 HydrophobicContact CG1-CG 3.69Å; V281-R286 VanDerWaalsContact CG1-NE 3.34Å
282	N	89.1	Confident	77.7	Confident	30 Å²	30	84.5 Å²	84.5	16%	0.16	41%	0.411	C	S	.	.			trans	-108.6	172.1	172.3	69.7	37.2	0	0	0	112.8	I64 Q76 A284 M285 R286	I64-N282 HydrophobicContact CD1-CB 4.33Å; I64-N282 WeakPolarHBondContact CD1-ND2 3.16Å; Q76-N282 PolarHBondContact OE1-ND2 3.39Å; N282-A284 VanDerWaalsContact C-N 3.32Å; N282-A284 PolarHBondContact O-N 2.81Å; N282-A284 WeakPolarHBondContact OD1-CB 3.26Å; N282-A284 PolarHBondContact OD1-N 2.97Å; N282-M285 PolarHBondContact O-N 3.4Å; N282-M285 WeakPolarHBondContact OD1-CG 3.49Å; N282-M285 PolarHBondContact OD1-N 2.89Å; N282-R286 PolarHBondContact O-N 3.46Å
283	E	84.7	Confident	74.7	Confident	128 Å²	128	89.1 Å²	89.1	60%	0.598	44%	0.435	S	S	*	.	H	α-helix	trans	-63.3	-36.2	-177.9	-156.6	-164.2	173.9	0	0	112.6	M285 R286 K287	E283-M285 VanDerWaalsContact C-N 3.29Å; E283-M285 PolarHBondContact O-N 2.84Å; E283-R286 PolarHBondContact O-N 2.81Å; E283-K287 HydrophobicContact CG-CD 4.21Å; E283-K287 HydrophobicContact CG-CG 4.38Å; E283-K287 WeakPolarHBondContact O-CB 3.32Å; E283-K287 VanDerWaalsContact O-CG 3.3Å; E283-K287 WeakPolarHBondContact O-CG 3.31Å; E283-K287 PolarHBondContact O-N 3.33Å; E283-K287 WeakPolarHBondContact OE1-CE 3.4Å; E283-K287 IonicContact OE1-NZ 3.25Å; E283-K287 PolarHBondContact OE1-NZ 2.97Å; E283-K287 IonicContact OE2-NZ 3.99Å; E283-K287 PolarHBondContact OE2-NZ 3.1Å
284	A	81	Confident	71.6	Confident	33 Å²	33	87 Å²	87	27%	0.273	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-32.2	178.8	0	0	0	0	0	112.5	F110 N282	F110-A284 HydrophobicContact CZ-CB 4.18Å; N282-A284 VanDerWaalsContact C-N 3.32Å; N282-A284 PolarHBondContact O-N 2.81Å; N282-A284 WeakPolarHBondContact OD1-CB 3.26Å; N282-A284 PolarHBondContact OD1-N 2.97Å
285	M	85	Confident	68.4	Low	1 Å²	1	92.8 Å²	92.8	1%	0.005	48%	0.478	C	S	.	.	H	α-helix	trans	-71.4	-36.6	174.1	-68.5	172.5	74.4	0	0	112	V66 F169 F172 I173 L176 R177 V279 N282 E283	V66-M285 HydrophobicContact CB-SD 4.02Å; V66-M285 HydrophobicContact CG1-SD 3.94Å; F169-M285 HydrophobicContact CE1-CE 4.2Å; F169-M285 HydrophobicContact CE2-CE 4.29Å; F169-M285 HydrophobicContact CZ-CE 3.62Å; F172-M285 HydrophobicContact CD1-CE 4.35Å; F172-M285 HydrophobicContact CE1-CE 4.22Å; I173-M285 HydrophobicContact CD1-CE 4.33Å; I173-M285 HydrophobicContact CG1-CE 3.67Å; L176-M285 HydrophobicContact CD2-CB 3.78Å; R177-M285 WeakPolarHBondContact CD-O 3.41Å; R177-M285 WeakPolarHBondContact CG-O 3.33Å; V279-M285 HydrophobicContact CG1-CE 4.23Å; N282-M285 PolarHBondContact O-N 3.4Å; N282-M285 WeakPolarHBondContact OD1-CG 3.49Å; N282-M285 PolarHBondContact OD1-N 2.89Å; E283-M285 VanDerWaalsContact C-N 3.29Å; E283-M285 PolarHBondContact O-N 2.84Å
286	R	79.9	Confident	65.3	Low	144 Å²	144	94.2 Å²	94.2	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-78.5	-31.3	179.1	-66.9	-175.2	-175.3	-83.7	-1.4	113.6	L176 V281 N282 E283 V288	L176-R286 HydrophobicContact CD1-CG 4.34Å; L176-R286 HydrophobicContact CD2-CG 4Å; L176-R286 HydrophobicContact CG-CG 4.19Å; V281-R286 HydrophobicContact CG1-CG 3.69Å; V281-R286 VanDerWaalsContact CG1-NE 3.34Å; N282-R286 PolarHBondContact O-N 3.46Å; E283-R286 PolarHBondContact O-N 2.81Å; R286-V288 PolarHBondContact O-N 3.2Å
287	K	65	Low	62.2	Low	92 Å²	92	98.5 Å²	98.5	40%	0.4	51%	0.511	S	S	.	.			trans	-58	108.4	-173.3	-88.7	170.1	172	160.3	0	111.7	E283	E283-K287 HydrophobicContact CG-CD 4.21Å; E283-K287 HydrophobicContact CG-CG 4.38Å; E283-K287 WeakPolarHBondContact O-CB 3.32Å; E283-K287 VanDerWaalsContact O-CG 3.3Å; E283-K287 WeakPolarHBondContact O-CG 3.31Å; E283-K287 PolarHBondContact O-N 3.33Å; E283-K287 WeakPolarHBondContact OE1-CE 3.4Å; E283-K287 IonicContact OE1-NZ 3.25Å; E283-K287 PolarHBondContact OE1-NZ 2.97Å; E283-K287 IonicContact OE2-NZ 3.99Å; E283-K287 PolarHBondContact OE2-NZ 3.1Å
288	V	55.1	Low	59.1	Low	54 Å²	54	96.7 Å²	96.7	33%	0.327	52%	0.515	S	S	.	.			trans	-100.8	88.1	163.3	178	0	0	0	0	106.1	R177 R286 L290	R177-V288 HydrophobicContact CB-CG2 3.61Å; R177-V288 HydrophobicContact CG-CG2 3.82Å; R177-V288 VanDerWaalsContact O-CG2 3.26Å; R177-V288 WeakPolarHBondContact O-CG2 3.43Å; R286-V288 PolarHBondContact O-N 3.2Å; V288-L290 HydrophobicContact CG1-CD1 3.61Å; V288-L290 HydrophobicContact CG1-CD2 4.39Å; V288-L290 HydrophobicContact CG1-CG 3.52Å; V288-L290 PolarHBondContact O-N 3.33Å; V288-L290 VanDerWaalsContact O-N 3.17Å
289	K	44	Very low	56.1	Low	151 Å²	151	104.8 Å²	104.8	66%	0.657	55%	0.547	S	S	*	.			trans	-75.3	100.6	163.6	-72.1	-172.7	177.9	-176.1	0	105.6	F140	F140-K289 HydrophobicContact CE1-CB 4.05Å; F140-K289 WeakPolarHBondContact CE1-O 3.37Å; F140-K289 HydrophobicContact CZ-CB 4.19Å
290	L	42.2	Very low	53	Low	132 Å²	132	107.4 Å²	107.4	69%	0.691	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-94.6	131.6	163.1	-73.8	161.7	0	0	0	106.3	V288	V288-L290 HydrophobicContact CG1-CD1 3.61Å; V288-L290 HydrophobicContact CG1-CD2 4.39Å; V288-L290 HydrophobicContact CG1-CG 3.52Å; V288-L290 PolarHBondContact O-N 3.33Å; V288-L290 VanDerWaalsContact O-N 3.17Å
291	R	30.9	Very low	49.8	Very low	200 Å²	200	108.1 Å²	108.1	76%	0.755	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-68.6	133.8	169.1	-164.4	-175.6	-86.7	-164.7	-2.3	106.9	M293	R291-M293 PolarHBondContact O-N 2.81Å
292	P	27.3	Very low	47	Very low	116 Å²	116	111 Å²	111	75%	0.753	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-58.1	126.1	172.1	-18.2	29	0	0	0	108.9	G294	P292-G294 PolarHBondContact O-N 2.96Å
293	M	30.5	Very low	44.1	Very low	160 Å²	160	119.4 Å²	119.4	79%	0.788	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-58.8	122.7	164.5	-77.6	-73.9	-60.8	0	0	107.7	R291	R291-M293 PolarHBondContact O-N 2.81Å
294	G	29.1	Very low	41.7	Very low	51 Å²	51	119.3 Å²	119.3	53%	0.526	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-59.5	160.1	176.7	0	0	0	0	0	112.1	P292 V296	P292-G294 PolarHBondContact O-N 2.96Å; G294-V296 PolarHBondContact O-N 3Å; G294-V296 VanDerWaalsContact O-N 3.09Å
295	P	27.4	Very low	39.2	Very low	132 Å²	132	128 Å²	128	86%	0.857	71%	0.706	S	S	*	*			trans	-66.4	113.9	-174.3	27	-32.3	0	0	0	110.7	K297	P295-K297 PolarHBondContact O-N 2.84Å
296	V	31.4	Very low	36.7	Very low	125 Å²	125	132 Å²	132	76%	0.758	75%	0.746	S	S	*	*			trans	-72.4	113.2	171	-178	0	0	0	0	108.3	G294 A298	G294-V296 PolarHBondContact O-N 3Å; G294-V296 VanDerWaalsContact O-N 3.09Å; V296-A298 PolarHBondContact O-N 3.13Å; V296-A298 VanDerWaalsContact O-N 3.17Å
297	K	28.5	Very low	34.3	Very low	202 Å²	202	135.4 Å²	135.4	88%	0.878	77%	0.765	S	S	*	*			trans	-62.5	110.8	176.7	-70.8	-178.9	178.3	176.7	0	110.4	P295	P295-K297 PolarHBondContact O-N 2.84Å
298	A	29.2	Very low	32.8	Very low	98 Å²	98	136.1 Å²	136.1	81%	0.81	79%	0.788	S	S	*	*			trans	-83.4	117	172.7	0	0	0	0	0	110.9	V296	V296-A298 PolarHBondContact O-N 3.13Å; V296-A298 VanDerWaalsContact O-N 3.17Å
299	K	33.3	Very low	31.8	Very low	197 Å²	197	143.7 Å²	143.7	86%	0.857	82%	0.817	S	S	*	*			trans	-99.5	132.4	167.5	-79.6	-174.7	172.9	-178.2	0	111.1
300	G	30.3	Very low	31.1	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	83%	0.825	S	S	*	*			trans	63.2	111.8	150.8	0	0	0	0	0	118.8
301	A	30.1	Very low	30.8	Very low	108 Å²	108	145.3 Å²	145.3	89%	0.893	84%	0.837	S	S	*	*				77.4	138.7	94.5	0	0	0	0	0	112.9
302	A	32.9	Very low	30.7	Very low	106 Å²	106	139.2 Å²	139.2	88%	0.876	84%	0.837	S	S	*	*			cis	-156.8	169.6	16.7	0	0	0	0	0	111.1
303	K	28.2	Very low	31.1	Very low	207 Å²	207	144 Å²	144	90%	0.9	85%	0.846	S	S	*	*			trans	-72.7	143.9	-175	-69.3	162.6	172.9	166.5	0	113.8
304	S	34.7	Very low	31	Very low	126 Å²	126	141 Å²	141	88%	0.881	85%	0.847	S	S	*	*			trans	-152.8	142	136.8	68.7	0	0	0	0	111.6
305	K	29.2	Very low	31.3	Very low	216 Å²	216	149.1 Å²	149.1	94%	0.939	87%	0.867	S	S	*	*			trans	-102.1	139.4	-174.1	-72	173.6	174.1	173.2	0	109.1
306	G	32.3	Very low	31.5	Very low	83 Å²	83	147.1 Å²	147.1	86%	0.856	86%	0.862	S	S	*	*			trans	-159.6	114	166.5	0	0	0	0	0	111.4
307	K	29.2	Very low	31.5	Very low	216 Å²	216	150.4 Å²	150.4	94%	0.939	87%	0.872	S	S	*	*			trans	-92	137.4	177.1	-77.1	174.3	172.2	174.6	0	109.5
308	A	33.1	Very low	31.6	Very low	107 Å²	107	144.5 Å²	144.5	88%	0.884	87%	0.868	S	S	*	*			trans	-156.7	142	149	0	0	0	0	0	111.8
309	K	33.2	Very low	31.6	Very low	214 Å²	214	150.3 Å²	150.3	93%	0.93	88%	0.875	S	S	*	*			trans	-92.3	146.9	-165.2	-70.6	169.6	168.6	173	0	112.3
310	A	30.3	Very low	31.5	Very low	100 Å²	100	145.9 Å²	145.9	83%	0.826	88%	0.876	S	S	*	*			trans	-92.2	145	164.7	0	0	0	0	0	111.6
311	K	35.9	Very low	31.4	Very low	216 Å²	216	152.5 Å²	152.5	94%	0.939	88%	0.884	S	S	*	*			trans	-131.2	128.1	158.8	-85.6	-172.6	175.5	-179.4	0	107.9
312	G	29.3	Very low	31.3	Very low	73 Å²	73	151.9 Å²	151.9	75%	0.753	88%	0.879	S	S	*	*			trans	-93	-169.3	-174.5	0	0	0	0	0	114.9
313	K	35.5	Very low	31.1	Very low	216 Å²	216	156.8 Å²	156.8	94%	0.939	88%	0.881	S	S	*	*			trans	-175.5	126.4	143.8	-102.8	169.4	-175.8	-176.5	0	109.9
314	A	28.4	Very low	30.9	Very low	98 Å²	98	150.5 Å²	150.5	81%	0.81	88%	0.875	S	S	*	*			trans	-86.9	149.1	167.5	0	0	0	0	0	110.5
315	K	35.6	Very low	30.5	Very low	220 Å²	220	153.6 Å²	153.6	96%	0.957	87%	0.872	S	S	*	*			trans	-148	143.6	153.8	-88.5	-163.5	176.5	-178.4	0	110.7
316	A	30	Very low	30.4	Very low	91 Å²	91	145.5 Å²	145.5	75%	0.752	85%	0.845	S	S	*	*			trans	-105	174.5	-164.9	0	0	0	0	0	114
317	M	31.5	Very low	30.2	Very low	193 Å²	193	149.1 Å²	149.1	95%	0.951	84%	0.838	S	S	*	*			trans	101.4	132.3	148.4	-57.6	-154.1	-72.3	0	0	119.9
318	G	31.5	Very low	30.1	Very low	79 Å²	79	140.4 Å²	140.4	81%	0.814	81%	0.806	S	S	*	*			trans	159.3	91.7	159.8	0	0	0	0	0	114.5
319	K	28.5	Very low	30.2	Very low	219 Å²	219	139.5 Å²	139.5	95%	0.952	78%	0.782	S	S	*	*			trans	-75.1	138.8	171.8	-73	175	174.7	174.2	0	111.1
320	A	32.7	Very low	30.2	Very low	105 Å²	105	133 Å²	133	87%	0.868	76%	0.757	S	S	*	*			trans	-152.6	138.4	157.6	0	0	0	0	0	112.4
321	K	28.1	Very low	30.5	Very low	210 Å²	210	129.7 Å²	129.7	91%	0.913	72%	0.724	S	S	*	*			trans	-84	149.1	-169.7	-74.9	175	171.5	175.6	0	114.2
322	A	26.5	Very low	30.4	Very low	95 Å²	95	120.8 Å²	120.8	79%	0.785	69%	0.689	S	S	*	*			trans	51.9	119.6	141.9	0	0	0	0	0	121.7
323	K	29.1	Very low	30.8	Very low	209 Å²	209	118.7 Å²	118.7	91%	0.909	66%	0.661	S	S	*	*				-175.8	129.4	120.7	-98.6	170.1	-176.3	-177.5	0	109.6
324	G	23.8	Very low	31	Very low	75 Å²	75	115 Å²	115	77%	0.773	65%	0.647	S	S	*	*			trans	-65.3	141.6	-170.5	0	0	0	0	0	114.1
325	K	27.3	Very low	31.3	Very low	191 Å²	191	111.9 Å²	111.9	83%	0.83	62%	0.617	S	S	*	*			trans	-169.1	134.7	161.8	-100.6	165.3	-170.9	-171	0	107.1
326	A	26.5	Very low	31.1	Very low	45 Å²	45	102.6 Å²	102.6	37%	0.372	58%	0.581	S	S	.	*			trans	-50.8	139.2	-172.3	0	0	0	0	0	113.1	L484 E485	A326-L484 HydrophobicContact CB-CB 4.45Å; A326-E485 CarbonylContact C-O 2.85Å; A326-E485 WeakPolarHBondContact CA-O 3.26Å; A326-E485 HydrophobicContact CB-CB 3.83Å; A326-E485 WeakPolarHBondContact CB-O 3.41Å
327	K	27.3	Very low	31.1	Very low	160 Å²	160	105.5 Å²	105.5	70%	0.696	58%	0.579	S	S	*	*			trans	-127.8	140.6	175.4	-60.7	-179.8	-179.9	-179.3	0	113.1	E485 G486	K327-E485 CarbonylContact C-O 2.99Å; K327-E485 WeakPolarHBondContact CA-O 3.32Å; K327-E485 PolarHBondContact N-O 2.85Å; K327-E485 CarbonylContact O-C 3.56Å; K327-E485 PolarHBondContact O-N 3.25Å; K327-E485 VanDerWaalsContact O-O 3.08Å; K327-G486 VanDerWaalsContact C-C 3.41Å; K327-G486 VanDerWaalsContact C-N 3.26Å; K327-G486 CarbonylContact C-O 3.51Å; K327-G486 VanDerWaalsContact CA-O 3.28Å; K327-G486 WeakPolarHBondContact CA-O 3.47Å; K327-G486 PolarHBondContact O-N 3.32Å
328	A	28.7	Very low	31.1	Very low	32 Å²	32	100 Å²	100	26%	0.264	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-97.6	157.2	174.5	0	0	0	0	0	109.5	G486 K487	A328-G486 VanDerWaalsContact CB-N 3.34Å; A328-G486 VanDerWaalsContact N-CA 3.28Å; A328-G486 VanDerWaalsContact N-N 3.12Å; A328-G486 PolarHBondContact N-O 3.29Å; A328-K487 VanDerWaalsContact CA-N 3.28Å; A328-K487 VanDerWaalsContact O-O 3.11Å
329	K	34.4	Very low	31.2	Very low	88 Å²	88	101.4 Å²	101.4	38%	0.383	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-66.9	134	167.4	-77.1	-178.8	170.8	-175.6	0	110.7	E210 D211	E210-K329 PolarHBondContact O-NZ 2.82Å; D211-K329 WeakPolarHBondContact OD1-CE 3.49Å; D211-K329 IonicContact OD1-NZ 3.75Å; D211-K329 PolarHBondContact OD1-NZ 3.48Å
330	I	34.1	Very low	31.2	Very low	79 Å²	79	99 Å²	99	41%	0.405	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-99.6	129.1	166.2	-57.8	152.5	0	0	0	105.2	Y489	I330-Y489 HydrophobicContact CD1-CD2 2.95Å; I330-Y489 HydrophobicContact CD1-CE2 3.58Å; I330-Y489 HydrophobicContact CD1-CG 3.51Å; I330-Y489 HydrophobicContact CG1-CD2 3.36Å; I330-Y489 HydrophobicContact CG1-CE2 4.25Å; I330-Y489 HydrophobicContact CG1-CG 3.97Å
331	I	36.6	Very low	31	Very low	29 Å²	29	98.1 Å²	98.1	15%	0.149	53%	0.525	C	S	.	.			trans	-112	110.1	177.4	-77.7	166.6	0	0	0	106.7	L207 L214 I249 I333	L207-I331 HydrophobicContact CD2-CD1 4.31Å; L214-I331 HydrophobicContact CB-CB 4.15Å; L214-I331 HydrophobicContact CB-CD1 4.41Å; L214-I331 HydrophobicContact CB-CG1 4.1Å; L214-I331 HydrophobicContact CB-CG2 3.11Å; L214-I331 HydrophobicContact CD2-CD1 4.29Å; L214-I331 HydrophobicContact CD2-CG2 3.77Å; L214-I331 HydrophobicContact CG-CG2 4.06Å; I249-I331 HydrophobicContact CB-CB 4.35Å; I249-I331 HydrophobicContact CB-CD1 4.34Å; I249-I331 HydrophobicContact CB-CG2 4.19Å; I249-I331 HydrophobicContact CD1-CG2 3.91Å; I249-I331 HydrophobicContact CG1-CG2 4.49Å; I249-I331 HydrophobicContact CG2-CD1 3.92Å; I331-I333 HydrophobicContact CG2-CG1 4.29Å
332	S	33.4	Very low	31.3	Very low	29 Å²	29	94 Å²	94	20%	0.203	51%	0.508	C	S	.	.			trans	-82.7	134.8	164.6	80.7	0	0	0	0	107.9	E213 L214	E213-S332 VanDerWaalsContact CG-OG 3.29Å; E213-S332 WeakPolarHBondContact CG-OG 3.06Å; E213-S332 PolarHBondContact OE1-OG 3.01Å; L214-S332 PolarHBondContact N-O 2.84Å
333	I	38.1	Very low	31.5	Very low	29 Å²	29	97.2 Å²	97.2	15%	0.149	51%	0.511	C	S	.	.			trans	-103.2	103.1	176.1	-55	173.2	0	0	0	106.6	I249 I331 D335 A336	I249-I333 HydrophobicContact CD1-CD1 3.56Å; I249-I333 HydrophobicContact CD1-CG1 3.93Å; I249-I333 HydrophobicContact CG1-CD1 4.01Å; I331-I333 HydrophobicContact CG2-CG1 4.29Å; I333-D335 PolarHBondContact O-N 2.92Å; I333-A336 HydrophobicContact CB-CB 4.12Å; I333-A336 HydrophobicContact CG2-CB 3.87Å
334	Q	38.8	Very low	31.8	Very low	140 Å²	140	91.2 Å²	91.2	65%	0.654	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.3	-179.8	-67.2	-169.9	-7.5	0	0	113.8	E213	E213-Q334 PolarHBondContact OE2-NE2 2.77Å
335	D	35.4	Very low	32.3	Very low	32 Å²	32	88.5 Å²	88.5	17%	0.171	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	7.4	-175.4	-69.2	-64.2	0	0	0	114.4	S215 K217 I333 E337 S338 Y339	S215-D335 PolarHBondContact OG-OD2 2.68Å; K217-D335 WeakPolarHBondContact CD-OD2 3.49Å; K217-D335 WeakPolarHBondContact CE-OD1 3.46Å; K217-D335 IonicContact NZ-OD1 3.22Å; K217-D335 PolarHBondContact NZ-OD1 3.37Å; I333-D335 PolarHBondContact O-N 2.92Å; D335-E337 VanDerWaalsContact C-N 3.26Å; D335-E337 PolarHBondContact O-N 3.25Å; D335-S338 PolarHBondContact O-N 3.15Å; D335-S338 PolarHBondContact O-OG 3.33Å; D335-Y339 WeakPolarHBondContact O-CD2 3.46Å
336	A	31.8	Very low	32.6	Very low	24 Å²	24	81.4 Å²	81.4	20%	0.198	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-66.4	-27.6	-175.3	0	0	0	0	0	113.2	I333 S338 Y339 I493	I333-A336 HydrophobicContact CB-CB 4.12Å; I333-A336 HydrophobicContact CG2-CB 3.87Å; A336-S338 VanDerWaalsContact C-N 3.27Å; A336-S338 PolarHBondContact O-N 3.34Å; A336-Y339 PolarHBondContact O-N 2.68Å; A336-Y339 VanDerWaalsContact O-N 3.13Å; A336-I493 HydrophobicContact CB-CD1 3.76Å
337	E	29.1	Very low	33.2	Very low	153 Å²	153	81.6 Å²	81.6	72%	0.715	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-71.3	-16.3	-176.1	-63.3	-173	160	0	0	114	D335 I493	D335-E337 VanDerWaalsContact C-N 3.26Å; D335-E337 PolarHBondContact O-N 3.25Å; E337-I493 HydrophobicContact CG-CG2 4.39Å
338	S	31.6	Very low	33.9	Very low	78 Å²	78	76.2 Å²	76.2	55%	0.545	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-95.2	-9.1	171.5	57.6	0	0	0	0	114	D335 A336	D335-S338 PolarHBondContact O-N 3.15Å; D335-S338 PolarHBondContact O-OG 3.33Å; A336-S338 VanDerWaalsContact C-N 3.27Å; A336-S338 PolarHBondContact O-N 3.34Å
339	Y	33	Very low	34.4	Very low	108 Å²	108	76 Å²	76	42%	0.424	40%	0.399	S	S	.	.	S	Bend	trans	-104.9	89.9	177.5	-74.7	-81.6	0	0	0	108.7	D335 A336 A341	D335-Y339 WeakPolarHBondContact O-CD2 3.46Å; A336-Y339 PolarHBondContact O-N 2.68Å; A336-Y339 VanDerWaalsContact O-N 3.13Å; Y339-A341 PolarHBondContact O-N 3.16Å; Y339-A341 VanDerWaalsContact O-N 3.16Å
340	Q	28.6	Very low	34.7	Very low	169 Å²	169	78 Å²	78	79%	0.79	40%	0.404	S	S	*	.			trans	-46.5	126.6	162.6	-133.4	153.6	0.3	0	0	107.1	F342	Q340-F342 VanDerWaalsContact C-N 3.28Å; Q340-F342 PolarHBondContact O-N 3.22Å
341	A	30	Very low	35.1	Very low	85 Å²	85	79.5 Å²	79.5	70%	0.702	41%	0.407	S	S	*	.			trans	-51.6	100.3	175.2	0	0	0	0	0	107.3	Y339 L343	Y339-A341 PolarHBondContact O-N 3.16Å; Y339-A341 VanDerWaalsContact O-N 3.16Å; A341-L343 VanDerWaalsContact C-N 3.28Å; A341-L343 PolarHBondContact O-N 3.46Å
342	F	33.3	Very low	35.3	Very low	125 Å²	125	78.7 Å²	78.7	55%	0.548	40%	0.403	S	S	.	.			trans	-69.7	96.6	-176.6	-109.5	-88.2	0	0	0	105.1	Q340 D344 T345	Q340-F342 VanDerWaalsContact C-N 3.28Å; Q340-F342 PolarHBondContact O-N 3.22Å; F342-D344 HydrophobicContact CD1-CB 4.32Å; F342-D344 PolarHBondContact O-N 2.95Å; F342-T345 HydrophobicContact CB-CG2 4.12Å; F342-T345 PolarHBondContact O-N 3.43Å; F342-T345 PolarHBondContact O-OG1 3.29Å
343	L	31.9	Very low	35.6	Very low	162 Å²	162	81.1 Å²	81.1	85%	0.848	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-2.8	174.7	-72.8	165.5	0	0	0	112.2	A341	A341-L343 VanDerWaalsContact C-N 3.28Å; A341-L343 PolarHBondContact O-N 3.46Å
344	D	34.5	Very low	35.5	Very low	82 Å²	82	87.2 Å²	87.2	44%	0.439	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	1.4	-177.5	-62.7	-8.3	0	0	0	115.4	F342 D347 Q348	F342-D344 HydrophobicContact CD1-CB 4.32Å; F342-D344 PolarHBondContact O-N 2.95Å; D344-D347 HydrophobicContact CB-CB 4.45Å; D344-D347 CarbonylContact O-C 3.45Å; D344-D347 WeakPolarHBondContact O-CA 3.44Å; D344-D347 WeakPolarHBondContact O-CB 3.25Å; D344-D347 PolarHBondContact O-N 2.93Å; D344-Q348 PolarHBondContact O-N 3.47Å
345	T	35	Very low	35.4	Very low	19 Å²	19	82.4 Å²	82.4	12%	0.117	42%	0.415	C	S	.	.	H	α-helix	trans	-69.3	-41.7	-177.9	40.3	0	0	0	0	113.1	Q232 E235 F342 D347 Q348 Y349	Q232-T345 HydrophobicContact CG-CG2 3.73Å; E235-T345 VanDerWaalsContact OE2-CB 3.22Å; E235-T345 WeakPolarHBondContact OE2-CB 3.38Å; E235-T345 PolarHBondContact OE2-OG1 2.92Å; F342-T345 HydrophobicContact CB-CG2 4.12Å; F342-T345 PolarHBondContact O-N 3.43Å; F342-T345 PolarHBondContact O-OG1 3.29Å; T345-D347 PolarHBondContact O-N 2.86Å; T345-Q348 PolarHBondContact O-N 2.84Å; T345-Y349 PolarHBondContact O-N 3.16Å
346	A	33.5	Very low	35.6	Very low	41 Å²	41	82.4 Å²	82.4	34%	0.339	42%	0.415	S	S	.	.	H	α-helix	trans	-62.1	-34.7	169.2	0	0	0	0	0	111.4	Q348 Y349 R350	A346-Q348 VanDerWaalsContact C-N 3.34Å; A346-Y349 PolarHBondContact O-N 3.5Å; A346-R350 WeakPolarHBondContact O-CB 3.29Å; A346-R350 PolarHBondContact O-N 3.44Å
347	D	39.2	Very low	35.8	Very low	50 Å²	50	87.3 Å²	87.3	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-68.1	-30.3	174.8	-82	-1.7	0	0	0	112.3	D344 T345 R350 K351	D344-D347 HydrophobicContact CB-CB 4.45Å; D344-D347 CarbonylContact O-C 3.45Å; D344-D347 WeakPolarHBondContact O-CA 3.44Å; D344-D347 WeakPolarHBondContact O-CB 3.25Å; D344-D347 PolarHBondContact O-N 2.93Å; T345-D347 PolarHBondContact O-N 2.86Å; D347-R350 CarbonylContact O-C 3.02Å; D347-R350 PolarHBondContact O-N 3.28Å; D347-R350 IonicContact OD1-CZ 2.68Å; D347-R350 VanDerWaalsContact OD1-CZ 3.22Å; D347-R350 IonicContact OD1-NH1 3.22Å; D347-R350 PolarHBondContact OD1-NH1 2.77Å; D347-R350 IonicContact OD1-NH2 3.47Å; D347-R350 PolarHBondContact OD1-NH2 2.96Å; D347-K351 WeakPolarHBondContact O-CB 3.36Å; D347-K351 WeakPolarHBondContact O-CD 3.13Å; D347-K351 WeakPolarHBondContact O-CG 3.01Å; D347-K351 PolarHBondContact O-N 3.22Å
348	Q	40.7	Very low	36.2	Very low	47 Å²	47	82.7 Å²	82.7	22%	0.22	41%	0.414	C	S	.	.	H	α-helix	trans	-68.6	-43.3	175	-171.2	63.2	43.8	0	0	111.7	D344 T345 A346 R350 K351 D352	D344-Q348 PolarHBondContact O-N 3.47Å; T345-Q348 PolarHBondContact O-N 2.84Å; A346-Q348 VanDerWaalsContact C-N 3.34Å; Q348-R350 VanDerWaalsContact C-N 3.34Å; Q348-K351 PolarHBondContact O-N 3.09Å; Q348-D352 PolarHBondContact NE2-OD1 2.77Å; Q348-D352 WeakPolarHBondContact O-CB 3.32Å; Q348-D352 PolarHBondContact O-N 3.24Å
349	Y	40.2	Very low	36.4	Very low	27 Å²	27	86.2 Å²	86.2	11%	0.106	42%	0.415	C	S	.	.	H	α-helix	trans	-65	-40	173.5	-80.3	-63.2	0	0	0	111.6	R196 Q232 T345 A346 K351 D352 E353	R196-Y349 HydrophobicContact CG-CE1 4.21Å; Q232-Y349 HydrophobicContact CB-CE2 3.93Å; Q232-Y349 HydrophobicContact CG-CE2 4.49Å; T345-Y349 PolarHBondContact O-N 3.16Å; A346-Y349 PolarHBondContact O-N 3.5Å; Y349-K351 VanDerWaalsContact C-N 3.34Å; Y349-K351 PolarHBondContact O-N 3.06Å; Y349-D352 PolarHBondContact O-N 3.1Å; Y349-E353 WeakPolarHBondContact O-CB 3.36Å; Y349-E353 WeakPolarHBondContact O-CG 3.41Å; Y349-E353 PolarHBondContact O-N 3.36Å
350	R	39.3	Very low	36.6	Very low	130 Å²	130	83.6 Å²	83.6	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-39.5	172.1	-103.1	-173.6	-91.1	136.3	0.6	112	A346 D347 Q348 Y354	A346-R350 WeakPolarHBondContact O-CB 3.29Å; A346-R350 PolarHBondContact O-N 3.44Å; D347-R350 CarbonylContact O-C 3.02Å; D347-R350 PolarHBondContact O-N 3.28Å; D347-R350 IonicContact OD1-CZ 2.68Å; D347-R350 VanDerWaalsContact OD1-CZ 3.22Å; D347-R350 IonicContact OD1-NH1 3.22Å; D347-R350 PolarHBondContact OD1-NH1 2.77Å; D347-R350 IonicContact OD1-NH2 3.47Å; D347-R350 PolarHBondContact OD1-NH2 2.96Å; Q348-R350 VanDerWaalsContact C-N 3.34Å; R350-Y354 WeakPolarHBondContact O-CA 3.44Å; R350-Y354 WeakPolarHBondContact O-CB 3.3Å; R350-Y354 PolarHBondContact O-N 3.38Å
351	K	43.3	Very low	37	Very low	110 Å²	110	81.6 Å²	81.6	48%	0.478	40%	0.399	S	S	.	.	H	α-helix	trans	-67.8	-42.3	176	-78.2	166.9	-173.9	173.3	0	111.3	D347 Q348 Y349 Y354 C355	D347-K351 WeakPolarHBondContact O-CB 3.36Å; D347-K351 WeakPolarHBondContact O-CD 3.13Å; D347-K351 WeakPolarHBondContact O-CG 3.01Å; D347-K351 PolarHBondContact O-N 3.22Å; Q348-K351 PolarHBondContact O-N 3.09Å; Y349-K351 VanDerWaalsContact C-N 3.34Å; Y349-K351 PolarHBondContact O-N 3.06Å; K351-Y354 PolarHBondContact O-N 2.89Å; K351-C355 VanDerWaalsContact O-CB 3.22Å; K351-C355 WeakPolarHBondContact O-CB 3.43Å; K351-C355 PolarHBondContact O-N 3.06Å
352	D	39.8	Very low	37	Very low	12 Å²	12	80.2 Å²	80.2	6%	0.064	39%	0.393	C	S	.	.	H	α-helix	trans	-64.9	-44.4	176.5	-69.7	-11.1	0	0	0	110.1	R185 Q348 Y349 C355 I356	R185-D352 IonicContact NE-OD2 2.79Å; Q348-D352 PolarHBondContact NE2-OD1 2.77Å; Q348-D352 WeakPolarHBondContact O-CB 3.32Å; Q348-D352 PolarHBondContact O-N 3.24Å; Y349-D352 PolarHBondContact O-N 3.1Å; D352-C355 PolarHBondContact O-N 3.4Å; D352-I356 WeakPolarHBondContact O-CD1 3.41Å; D352-I356 VanDerWaalsContact O-CG1 3.27Å; D352-I356 WeakPolarHBondContact O-CG1 3.46Å; D352-I356 PolarHBondContact O-N 2.8Å; D352-I356 VanDerWaalsContact O-N 3.1Å
353	E	41.1	Very low	37.1	Very low	80 Å²	80	84 Å²	84	37%	0.374	41%	0.409	S	S	.	.	H	α-helix	trans	-65.5	-39.1	173.5	-76.1	176.4	-171.4	0	0	112.9	R196 Y349 I356 K357	R196-E353 IonicContact CZ-OE1 2.78Å; R196-E353 IonicContact NH1-OE1 3.85Å; R196-E353 IonicContact NH2-OE1 3.48Å; R196-E353 PolarHBondContact NH2-OE1 2.73Å; Y349-E353 WeakPolarHBondContact O-CB 3.36Å; Y349-E353 WeakPolarHBondContact O-CG 3.41Å; Y349-E353 PolarHBondContact O-N 3.36Å; E353-I356 WeakPolarHBondContact O-CB 3.15Å; E353-I356 PolarHBondContact O-N 2.89Å; E353-K357 WeakPolarHBondContact O-CG 3.44Å; E353-K357 PolarHBondContact O-N 2.78Å
354	Y	35.5	Very low	37.2	Very low	157 Å²	157	79.1 Å²	79.1	62%	0.616	39%	0.392	S	S	*	.	H	α-helix	trans	-68.9	-37.1	176	-175.4	-98.2	0	0	0	112	R350 K351 I356 K357 T358	R350-Y354 WeakPolarHBondContact O-CA 3.44Å; R350-Y354 WeakPolarHBondContact O-CB 3.3Å; R350-Y354 PolarHBondContact O-N 3.38Å; K351-Y354 PolarHBondContact O-N 2.89Å; Y354-I356 VanDerWaalsContact C-N 3.3Å; Y354-I356 PolarHBondContact O-N 3.44Å; Y354-K357 PolarHBondContact O-N 3.17Å; Y354-T358 HydrophobicContact CD1-CG2 3.92Å; Y354-T358 HydrophobicContact CD2-CG2 4.3Å; Y354-T358 HydrophobicContact CE1-CG2 3.47Å; Y354-T358 VanDerWaalsContact CE1-CG2 3.47Å; Y354-T358 HydrophobicContact CE2-CG2 3.88Å; Y354-T358 HydrophobicContact CG-CG2 4.31Å; Y354-T358 VanDerWaalsContact CZ-CG2 3.44Å; Y354-T358 WeakPolarHBondContact O-CB 3.27Å; Y354-T358 WeakPolarHBondContact O-CG2 3.29Å; Y354-T358 PolarHBondContact O-N 3.26Å; Y354-T358 PolarHBondContact O-OG1 3.38Å
355	C	37.7	Very low	37.3	Very low	39 Å²	39	86.3 Å²	86.3	26%	0.264	42%	0.42	S	S	.	.	H	α-helix	trans	-66.1	-35.8	175.4	-154.2	0	0	0	0	111	P186 K351 D352 R359	P186-C355 HydrophobicContact CB-CB 4.44Å; K351-C355 VanDerWaalsContact O-CB 3.22Å; K351-C355 WeakPolarHBondContact O-CB 3.43Å; K351-C355 PolarHBondContact O-N 3.06Å; D352-C355 PolarHBondContact O-N 3.4Å; C355-R359 WeakPolarHBondContact O-CB 3.1Å; C355-R359 PolarHBondContact O-N 3.39Å; C355-R359 VanDerWaalsContact O-N 3.13Å
356	I	39.6	Very low	37.7	Very low	33 Å²	33	88.7 Å²	88.7	17%	0.169	43%	0.429	C	S	.	.	H	α-helix	trans	-62.8	-53.4	170.1	-67	163.5	0	0	0	109.9	F187 V192 D352 E353 Y354 T358 S360	F187-I356 WeakPolarHBondContact O-CG1 3.49Å; V192-I356 HydrophobicContact CG2-CD1 4.06Å; D352-I356 WeakPolarHBondContact O-CD1 3.41Å; D352-I356 VanDerWaalsContact O-CG1 3.27Å; D352-I356 WeakPolarHBondContact O-CG1 3.46Å; D352-I356 PolarHBondContact O-N 2.8Å; D352-I356 VanDerWaalsContact O-N 3.1Å; E353-I356 WeakPolarHBondContact O-CB 3.15Å; E353-I356 PolarHBondContact O-N 2.89Å; Y354-I356 VanDerWaalsContact C-N 3.3Å; Y354-I356 PolarHBondContact O-N 3.44Å; I356-T358 PolarHBondContact O-N 3.07Å; I356-S360 WeakPolarHBondContact O-CB 2.92Å; I356-S360 PolarHBondContact O-N 3.04Å; I356-S360 VanDerWaalsContact O-N 3.15Å; I356-S360 PolarHBondContact O-OG 3.09Å; I356-S360 VanDerWaalsContact O-OG 3.07Å
357	K	34.6	Very low	38.3	Very low	126 Å²	126	91.3 Å²	91.3	55%	0.548	44%	0.438	S	S	.	.	H	α-helix	trans	-59.2	-44.3	-179.1	-73.2	-180	179.6	179.3	0	112.4	E353 Y354 Y361	E353-K357 WeakPolarHBondContact O-CG 3.44Å; E353-K357 PolarHBondContact O-N 2.78Å; Y354-K357 PolarHBondContact O-N 3.17Å; K357-Y361 WeakPolarHBondContact O-CD2 3.03Å
358	T	37	Very low	39	Very low	56 Å²	56	92.9 Å²	92.9	34%	0.344	46%	0.458	S	S	.	.	H	α-helix	trans	-77.4	-32.9	-175.3	50.9	0	0	0	0	114.4	Y354 I356 G362	Y354-T358 HydrophobicContact CD1-CG2 3.92Å; Y354-T358 HydrophobicContact CD2-CG2 4.3Å; Y354-T358 HydrophobicContact CE1-CG2 3.47Å; Y354-T358 VanDerWaalsContact CE1-CG2 3.47Å; Y354-T358 HydrophobicContact CE2-CG2 3.88Å; Y354-T358 HydrophobicContact CG-CG2 4.31Å; Y354-T358 VanDerWaalsContact CZ-CG2 3.44Å; Y354-T358 WeakPolarHBondContact O-CB 3.27Å; Y354-T358 WeakPolarHBondContact O-CG2 3.29Å; Y354-T358 PolarHBondContact O-N 3.26Å; Y354-T358 PolarHBondContact O-OG1 3.38Å; I356-T358 PolarHBondContact O-N 3.07Å; T358-G362 PolarHBondContact O-N 3.41Å
359	R	37.7	Very low	39.5	Very low	152 Å²	152	97.5 Å²	97.5	57%	0.574	48%	0.479	S	S	*	.	H	α-helix	trans	-79.6	-31.5	177.4	-81.6	-176.1	170.1	-179.2	-0.3	113.6	C355 Y361 G362	C355-R359 WeakPolarHBondContact O-CB 3.1Å; C355-R359 PolarHBondContact O-N 3.39Å; C355-R359 VanDerWaalsContact O-N 3.13Å; R359-Y361 PolarHBondContact O-N 3.47Å; R359-G362 PolarHBondContact O-N 3Å
360	S	37.2	Very low	39.9	Very low	54 Å²	54	98 Å²	98	38%	0.378	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-21.3	174.8	-64	0	0	0	0	112.9	I356	I356-S360 WeakPolarHBondContact O-CB 2.92Å; I356-S360 PolarHBondContact O-N 3.04Å; I356-S360 VanDerWaalsContact O-N 3.15Å; I356-S360 PolarHBondContact O-OG 3.09Å; I356-S360 VanDerWaalsContact O-OG 3.07Å
361	Y	35.3	Very low	40.4	Very low	127 Å²	127	96.4 Å²	96.4	50%	0.498	48%	0.483	S	S	.	.	H	α-helix	trans	-106	-11.4	176.6	-65.5	-60.3	0	0	0	114.8	K357 R359 K371 E375	K357-Y361 WeakPolarHBondContact O-CD2 3.03Å; R359-Y361 PolarHBondContact O-N 3.47Å; Y361-K371 HydrophobicContact CD1-CD 4.15Å; Y361-K371 HydrophobicContact CD1-CG 4.15Å; Y361-K371 HydrophobicContact CE1-CD 3.95Å; Y361-K371 HydrophobicContact CE1-CG 3.75Å; Y361-E375 WeakPolarHBondContact CE1-OE1 3.22Å; Y361-E375 PolarHBondContact OH-OE1 2.73Å
362	G	29.7	Very low	40.8	Very low	55 Å²	55	95.4 Å²	95.4	57%	0.567	48%	0.48	S	S	*	.	S	Bend	trans	-97.6	7.2	-159.5	0	0	0	0	0	118.7	T358 R359	T358-G362 PolarHBondContact O-N 3.41Å; R359-G362 PolarHBondContact O-N 3Å
363	K	35.5	Very low	41.5	Very low	204 Å²	204	102.7 Å²	102.7	89%	0.887	51%	0.507	S	S	*	.	S	Bend	trans	-138.2	10.8	-173.4	-80.8	-164.6	176.5	-175.3	0	118.4
364	A	33.9	Very low	41.8	Very low	61 Å²	61	103.2 Å²	103.2	50%	0.504	51%	0.508	S	S	.	.			trans	-136.6	137.6	172.4	0	0	0	0	0	110.9	E366	A364-E366 HydrophobicContact CB-CB 4.15Å; A364-E366 HydrophobicContact CB-CG 3.84Å; A364-E366 PolarHBondContact O-N 3.15Å
365	K	37.1	Very low	42.4	Very low	232 Å²	232	99.4 Å²	99.4	100%	1.009	50%	0.496	S	S	*	.			trans	-61.3	66.5	148.6	-83.8	-177.6	171.6	179.6	0	107.5
366	E	44.1	Very low	43	Very low	69 Å²	69	102.7 Å²	102.7	32%	0.322	51%	0.506	S	S	.	.			trans	-82.3	128.4	171.3	-102.6	-175.6	135.8	0	0	107.4	A364 S370 K374	A364-E366 HydrophobicContact CB-CB 4.15Å; A364-E366 HydrophobicContact CB-CG 3.84Å; A364-E366 PolarHBondContact O-N 3.15Å; E366-S370 WeakPolarHBondContact OE1-CB 3.02Å; E366-S370 PolarHBondContact OE1-OG 3.48Å; E366-K374 WeakPolarHBondContact OE1-CE 3.42Å; E366-K374 IonicContact OE1-NZ 2.6Å; E366-K374 PolarHBondContact OE1-NZ 3.32Å; E366-K374 IonicContact OE2-NZ 2.64Å; E366-K374 PolarHBondContact OE2-NZ 3.12Å
367	N	46.6	Very low	43.4	Very low	97 Å²	97	104.9 Å²	104.9	52%	0.519	52%	0.516	S	S	.	.			trans	-59.2	151	171.3	70	8.6	0	0	0	109.3	Q369 S370 K371	N367-Q369 PolarHBondContact O-N 2.94Å; N367-S370 PolarHBondContact O-N 3.47Å; N367-S370 VanDerWaalsContact OD1-CB 3.24Å; N367-S370 WeakPolarHBondContact OD1-CB 3.24Å; N367-S370 PolarHBondContact OD1-N 3.37Å; N367-K371 PolarHBondContact O-N 3.05Å
368	A	53.5	Low	43.6	Very low	83 Å²	83	102.5 Å²	102.5	69%	0.686	51%	0.512	S	S	*	.	H	α-helix	trans	-52.5	-31.6	-179	0	0	0	0	0	112.4	K371 E372	A368-K371 WeakPolarHBondContact O-CB 3.13Å; A368-K371 PolarHBondContact O-N 3.11Å; A368-E372 WeakPolarHBondContact O-CB 3.26Å; A368-E372 PolarHBondContact O-N 2.76Å
369	Q	49.9	Very low	43.7	Very low	144 Å²	144	105.1 Å²	105.1	67%	0.673	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-38.1	176.7	-117.4	176.7	5.4	0	0	114.4	N367 R373	N367-Q369 PolarHBondContact O-N 2.94Å; Q369-R373 WeakPolarHBondContact O-CB 3.49Å; Q369-R373 PolarHBondContact O-N 3.15Å
370	S	50.2	Low	43.6	Very low	37 Å²	37	103.9 Å²	103.9	26%	0.259	52%	0.521	S	S	.	.	H	α-helix	trans	-73.3	-37.9	178.4	-164.1	0	0	0	0	110.9	E366 N367 R373 K374	E366-S370 WeakPolarHBondContact OE1-CB 3.02Å; E366-S370 PolarHBondContact OE1-OG 3.48Å; N367-S370 PolarHBondContact O-N 3.47Å; N367-S370 VanDerWaalsContact OD1-CB 3.24Å; N367-S370 WeakPolarHBondContact OD1-CB 3.24Å; N367-S370 PolarHBondContact OD1-N 3.37Å; S370-R373 PolarHBondContact O-N 3.23Å; S370-K374 WeakPolarHBondContact O-CG 3.38Å; S370-K374 PolarHBondContact O-N 3.06Å
371	K	49.2	Very low	43.6	Very low	97 Å²	97	104.3 Å²	104.3	42%	0.422	53%	0.528	S	S	.	.	H	α-helix	trans	-59.9	-51.9	172.4	-170.9	-171.9	178.9	-170.9	0	110.9	Y361 N367 A368 R373 K374 E375	Y361-K371 HydrophobicContact CD1-CD 4.15Å; Y361-K371 HydrophobicContact CD1-CG 4.15Å; Y361-K371 HydrophobicContact CE1-CD 3.95Å; Y361-K371 HydrophobicContact CE1-CG 3.75Å; N367-K371 PolarHBondContact O-N 3.05Å; A368-K371 WeakPolarHBondContact O-CB 3.13Å; A368-K371 PolarHBondContact O-N 3.11Å; K371-R373 VanDerWaalsContact C-N 3.34Å; K371-R373 PolarHBondContact O-N 3.17Å; K371-K374 PolarHBondContact O-N 3.18Å; K371-E375 WeakPolarHBondContact CE-OE1 3.44Å; K371-E375 WeakPolarHBondContact O-CG 3.16Å; K371-E375 PolarHBondContact O-N 3.08Å
372	E	51.3	Low	43.5	Very low	89 Å²	89	101.9 Å²	101.9	42%	0.416	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-37.3	178.6	-167.6	-173.2	168.4	0	0	112.2	A368 E375 K376	A368-E372 WeakPolarHBondContact O-CB 3.26Å; A368-E372 PolarHBondContact O-N 2.76Å; E372-E375 PolarHBondContact O-N 3.47Å; E372-K376 HydrophobicContact CG-CD 4.41Å; E372-K376 WeakPolarHBondContact O-CB 3.34Å; E372-K376 WeakPolarHBondContact O-CG 3.23Å; E372-K376 PolarHBondContact O-N 3.48Å; E372-K376 VanDerWaalsContact OE1-CE 3.23Å; E372-K376 WeakPolarHBondContact OE1-CE 3.3Å; E372-K376 IonicContact OE1-NZ 3.51Å; E372-K376 PolarHBondContact OE1-NZ 3.46Å
373	R	54	Low	43.8	Very low	165 Å²	165	104.5 Å²	104.5	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-63.3	-43.6	174	-102.7	-175.5	174.6	-176.6	1.3	112.7	Q369 S370 K371 K376 M377	Q369-R373 WeakPolarHBondContact O-CB 3.49Å; Q369-R373 PolarHBondContact O-N 3.15Å; S370-R373 PolarHBondContact O-N 3.23Å; K371-R373 VanDerWaalsContact C-N 3.34Å; K371-R373 PolarHBondContact O-N 3.17Å; R373-K376 PolarHBondContact O-N 3.12Å; R373-M377 WeakPolarHBondContact O-CB 3.32Å; R373-M377 WeakPolarHBondContact O-CG 3.37Å; R373-M377 PolarHBondContact O-N 3.37Å
374	K	48.4	Very low	43.9	Very low	91 Å²	91	98.7 Å²	98.7	40%	0.396	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-43.7	176.7	-77.3	179.1	-179.9	171.5	0	110.8	E366 S370 K371 K376 M377 V378	E366-K374 WeakPolarHBondContact OE1-CE 3.42Å; E366-K374 IonicContact OE1-NZ 2.6Å; E366-K374 PolarHBondContact OE1-NZ 3.32Å; E366-K374 IonicContact OE2-NZ 2.64Å; E366-K374 PolarHBondContact OE2-NZ 3.12Å; S370-K374 WeakPolarHBondContact O-CG 3.38Å; S370-K374 PolarHBondContact O-N 3.06Å; K371-K374 PolarHBondContact O-N 3.18Å; K374-K376 PolarHBondContact O-N 2.99Å; K374-M377 PolarHBondContact O-N 3.06Å; K374-V378 WeakPolarHBondContact O-CB 3.37Å; K374-V378 VanDerWaalsContact O-CG2 3.22Å; K374-V378 WeakPolarHBondContact O-CG2 3.35Å; K374-V378 PolarHBondContact O-N 2.96Å
375	E	48.4	Very low	44.1	Very low	76 Å²	76	101 Å²	101	36%	0.355	51%	0.508	S	S	.	.	H	α-helix	trans	-57.6	-47.6	174.4	-74.4	169.6	180	0	0	111.2	Y361 K371 E372 M377 V378 E379	Y361-E375 WeakPolarHBondContact CE1-OE1 3.22Å; Y361-E375 PolarHBondContact OH-OE1 2.73Å; K371-E375 WeakPolarHBondContact CE-OE1 3.44Å; K371-E375 WeakPolarHBondContact O-CG 3.16Å; K371-E375 PolarHBondContact O-N 3.08Å; E372-E375 PolarHBondContact O-N 3.47Å; E375-M377 PolarHBondContact O-N 3.46Å; E375-V378 PolarHBondContact O-N 2.86Å; E375-E379 WeakPolarHBondContact O-CB 3.19Å; E375-E379 PolarHBondContact O-N 3.32Å
376	K	50	Low	43.9	Very low	108 Å²	108	93.9 Å²	93.9	47%	0.47	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-34.9	176.1	-73.6	178.8	-176.1	170.6	0	114	E372 R373 K374 E379 Q380	E372-K376 HydrophobicContact CG-CD 4.41Å; E372-K376 WeakPolarHBondContact O-CB 3.34Å; E372-K376 WeakPolarHBondContact O-CG 3.23Å; E372-K376 PolarHBondContact O-N 3.48Å; E372-K376 VanDerWaalsContact OE1-CE 3.23Å; E372-K376 WeakPolarHBondContact OE1-CE 3.3Å; E372-K376 IonicContact OE1-NZ 3.51Å; E372-K376 PolarHBondContact OE1-NZ 3.46Å; R373-K376 PolarHBondContact O-N 3.12Å; K374-K376 PolarHBondContact O-N 2.99Å; K376-E379 PolarHBondContact O-N 3.31Å; K376-Q380 WeakPolarHBondContact O-CB 3.4Å; K376-Q380 PolarHBondContact O-N 3.11Å
377	M	47.2	Very low	43.6	Very low	80 Å²	80	94.3 Å²	94.3	39%	0.394	51%	0.507	S	S	.	.	H	α-helix	trans	-67.6	-39.9	174.5	-80.4	-177.4	66.8	0	0	111.7	R373 K374 E375 A381	R373-M377 WeakPolarHBondContact O-CB 3.32Å; R373-M377 WeakPolarHBondContact O-CG 3.37Å; R373-M377 PolarHBondContact O-N 3.37Å; K374-M377 PolarHBondContact O-N 3.06Å; E375-M377 PolarHBondContact O-N 3.46Å; M377-A381 VanDerWaalsContact O-CB 3.31Å; M377-A381 WeakPolarHBondContact O-CB 2.91Å; M377-A381 PolarHBondContact O-N 3.16Å
378	V	39.6	Very low	43.1	Very low	75 Å²	75	94.5 Å²	94.5	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-50.3	172.7	171.8	0	0	0	0	108.7	K374 E375 Q380 A381 Y382	K374-V378 WeakPolarHBondContact O-CB 3.37Å; K374-V378 VanDerWaalsContact O-CG2 3.22Å; K374-V378 WeakPolarHBondContact O-CG2 3.35Å; K374-V378 PolarHBondContact O-N 2.96Å; E375-V378 PolarHBondContact O-N 2.86Å; V378-Q380 PolarHBondContact O-N 2.95Å; V378-A381 PolarHBondContact O-N 3.35Å; V378-A381 VanDerWaalsContact O-N 3.15Å; V378-Y382 HydrophobicContact CB-CE2 4.49Å; V378-Y382 HydrophobicContact CG1-CD2 3.94Å; V378-Y382 HydrophobicContact CG1-CE2 3.47Å; V378-Y382 VanDerWaalsContact CG1-CE2 3.47Å; V378-Y382 WeakPolarHBondContact O-CB 3.36Å; V378-Y382 WeakPolarHBondContact O-CD2 3.39Å; V378-Y382 PolarHBondContact O-N 3.33Å
379	E	38.2	Very low	42	Very low	111 Å²	111	94.8 Å²	94.8	52%	0.519	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-45.1	179.2	-164.2	178.6	-168.3	0	0	112.9	E375 K376 A381 Y382 L383	E375-E379 WeakPolarHBondContact O-CB 3.19Å; E375-E379 PolarHBondContact O-N 3.32Å; K376-E379 PolarHBondContact O-N 3.31Å; E379-A381 PolarHBondContact O-N 3.05Å; E379-Y382 CarbonylContact O-C 3.51Å; E379-Y382 PolarHBondContact O-N 3.32Å; E379-Y382 VanDerWaalsContact O-N 3.08Å; E379-L383 HydrophobicContact CG-CD1 3.69Å; E379-L383 HydrophobicContact CG-CG 4.15Å; E379-L383 WeakPolarHBondContact O-CB 3.27Å; E379-L383 VanDerWaalsContact O-CG 3.32Å; E379-L383 WeakPolarHBondContact O-CG 3.24Å; E379-L383 PolarHBondContact O-N 3.2Å
380	Q	37.2	Very low	41	Very low	126 Å²	126	92.8 Å²	92.8	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-36.8	174.8	-84.2	-174.7	-21.1	0	0	113.4	K376 V378 Y382	K376-Q380 WeakPolarHBondContact O-CB 3.4Å; K376-Q380 PolarHBondContact O-N 3.11Å; V378-Q380 PolarHBondContact O-N 2.95Å; Q380-Y382 PolarHBondContact O-N 3.15Å
381	A	36.6	Very low	40	Very low	63 Å²	63	100 Å²	100	52%	0.521	53%	0.528	S	S	.	.	H	α-helix	trans	-65.8	-27.2	174	0	0	0	0	0	111.7	M377 V378 E379 S384	M377-A381 VanDerWaalsContact O-CB 3.31Å; M377-A381 WeakPolarHBondContact O-CB 2.91Å; M377-A381 PolarHBondContact O-N 3.16Å; V378-A381 PolarHBondContact O-N 3.35Å; V378-A381 VanDerWaalsContact O-N 3.15Å; E379-A381 PolarHBondContact O-N 3.05Å; A381-S384 PolarHBondContact O-OG 3.28Å
382	Y	33.6	Very low	38.8	Very low	76 Å²	76	103.4 Å²	103.4	30%	0.298	55%	0.546	S	S	.	.	H	α-helix	trans	-91.8	-36.2	-176.2	-79.6	-129.1	0	0	0	113.2	Y189 V378 E379 Q380 S384	Y189-Y382 HydrophobicContact CD1-CE1 4.07Å; Y189-Y382 AromaticContact CD1-CZ 3.57Å; Y189-Y382 WeakPolarHBondContact CD1-OH 3.09Å; Y189-Y382 WeakPolarHBondContact CD2-OH 3.17Å; Y189-Y382 HydrophobicContact CE1-CD1 4.44Å; Y189-Y382 AromaticContact CE1-CE1 3.31Å; Y189-Y382 HydrophobicContact CE1-CE1 3.31Å; Y189-Y382 HydrophobicContact CE1-CE2 4.38Å; Y189-Y382 AromaticContact CE1-CZ 3.3Å; Y189-Y382 WeakPolarHBondContact CE1-OH 3.39Å; Y189-Y382 AromaticContact CE2-CE1 3.98Å; Y189-Y382 HydrophobicContact CE2-CE1 3.98Å; Y189-Y382 AromaticContact CZ-CE1 3.27Å; Y189-Y382 AromaticContact CZ-CZ 3.67Å; Y189-Y382 VanDerWaalsContact OH-CE1 3.3Å; Y189-Y382 WeakPolarHBondContact OH-CE1 3.28Å; V378-Y382 HydrophobicContact CB-CE2 4.49Å; V378-Y382 HydrophobicContact CG1-CD2 3.94Å; V378-Y382 HydrophobicContact CG1-CE2 3.47Å; V378-Y382 VanDerWaalsContact CG1-CE2 3.47Å; V378-Y382 WeakPolarHBondContact O-CB 3.36Å; V378-Y382 WeakPolarHBondContact O-CD2 3.39Å; V378-Y382 PolarHBondContact O-N 3.33Å; E379-Y382 CarbonylContact O-C 3.51Å; E379-Y382 PolarHBondContact O-N 3.32Å; E379-Y382 VanDerWaalsContact O-N 3.08Å; Q380-Y382 PolarHBondContact O-N 3.15Å; Y382-S384 VanDerWaalsContact C-N 3.26Å; Y382-S384 PolarHBondContact O-N 2.92Å
383	L	35.9	Very low	37.6	Very low	110 Å²	110	102.6 Å²	102.6	58%	0.576	55%	0.548	S	S	*	.	H	α-helix	trans	-77.2	-9.5	179.6	-67.8	176.1	0	0	0	113.5	E379 N385 L389	E379-L383 HydrophobicContact CG-CD1 3.69Å; E379-L383 HydrophobicContact CG-CG 4.15Å; E379-L383 WeakPolarHBondContact O-CB 3.27Å; E379-L383 VanDerWaalsContact O-CG 3.32Å; E379-L383 WeakPolarHBondContact O-CG 3.24Å; E379-L383 PolarHBondContact O-N 3.2Å; L383-N385 PolarHBondContact O-N 2.8Å; L383-L389 HydrophobicContact CD2-CD1 4.19Å
384	S	36.8	Very low	36.2	Very low	83 Å²	83	104 Å²	104	58%	0.58	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-5.7	178.3	66.7	0	0	0	0	114.7	A381 Y382	A381-S384 PolarHBondContact O-OG 3.28Å; Y382-S384 VanDerWaalsContact C-N 3.26Å; Y382-S384 PolarHBondContact O-N 2.92Å
385	N	37.9	Very low	35.1	Very low	109 Å²	109	108 Å²	108	58%	0.583	58%	0.576	S	S	*	*			trans	-148	88.5	169.6	-90.9	-42.9	0	0	0	110.7	L383 A387 D388	L383-N385 PolarHBondContact O-N 2.8Å; N385-A387 PolarHBondContact O-N 3.24Å; N385-D388 PolarHBondContact O-N 3.3Å
386	A	32.7	Very low	33.9	Very low	82 Å²	82	109.5 Å²	109.5	68%	0.678	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-56.9	-12.5	176.7	0	0	0	0	0	114.7	D388	A386-D388 VanDerWaalsContact C-N 3.34Å; A386-D388 PolarHBondContact O-N 2.73Å
387	A	39	Very low	32.7	Very low	78 Å²	78	109.4 Å²	109.4	65%	0.645	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-77.7	-11.1	179.9	0	0	0	0	0	115.1	N385	N385-A387 PolarHBondContact O-N 3.24Å
388	D	36.2	Very low	31.5	Very low	102 Å²	102	114 Å²	114	55%	0.545	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-107.2	-0.6	178.6	-77	-21.8	0	0	0	113.2	N385 A386 C390	N385-D388 PolarHBondContact O-N 3.3Å; A386-D388 VanDerWaalsContact C-N 3.34Å; A386-D388 PolarHBondContact O-N 2.73Å; D388-C390 PolarHBondContact O-N 2.78Å
389	L	28.7	Very low	30.7	Very low	88 Å²	88	116 Å²	116	46%	0.461	64%	0.636	S	S	.	*			trans	-86.1	85.8	172.7	-69.6	168.1	0	0	0	109	L383 E391	L383-L389 HydrophobicContact CD2-CD1 4.19Å; L389-E391 PolarHBondContact O-N 3.33Å
390	C	30.6	Very low	30	Very low	103 Å²	103	121.3 Å²	121.3	70%	0.696	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-71.3	123.3	160.9	-73.3	0	0	0	0	108.3	D388	D388-C390 PolarHBondContact O-N 2.78Å
391	E	28	Very low	29.4	Very low	188 Å²	188	122.6 Å²	122.6	88%	0.879	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-47.6	136	171.3	-67.3	174.5	154.2	0	0	111.2	L389 P393	L389-E391 PolarHBondContact O-N 3.33Å; E391-P393 WeakPolarHBondContact O-CD 3.33Å
392	E	25.2	Very low	28.8	Very low	169 Å²	169	130.7 Å²	130.7	79%	0.79	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.7	125.2	171.8	-79.2	-172.6	152.7	0	0	109.8	Q394	E392-Q394 PolarHBondContact O-N 3.16Å; E392-Q394 VanDerWaalsContact O-N 3.17Å
393	P	26.4	Very low	28.4	Very low	71 Å²	71	134.5 Å²	134.5	46%	0.461	71%	0.705	S	S	.	*			trans	-71.5	112.6	165.2	16.2	-8.1	0	0	0	108.1	E391 Y395	E391-P393 WeakPolarHBondContact O-CD 3.33Å; P393-Y395 HydrophobicContact CB-CD2 4.09Å; P393-Y395 HydrophobicContact CB-CE2 3.74Å; P393-Y395 HydrophobicContact CG-CD2 4.37Å; P393-Y395 HydrophobicContact CG-CE2 3.88Å; P393-Y395 WeakPolarHBondContact O-CD2 3.29Å; P393-Y395 PolarHBondContact O-N 3.19Å
394	Q	23.4	Very low	27.9	Very low	196 Å²	196	138.1 Å²	138.1	92%	0.916	72%	0.717	S	S	*	*			trans	-58.9	101.1	165.2	-72.4	-165.5	-29.7	0	0	109.2	E392	E392-Q394 PolarHBondContact O-N 3.16Å; E392-Q394 VanDerWaalsContact O-N 3.17Å
395	Y	26.2	Very low	27.3	Very low	175 Å²	175	138.9 Å²	138.9	69%	0.686	73%	0.728	S	S	*	*			trans	-92.3	101	162.8	-76.1	-81.5	0	0	0	108.2	P393 V397	P393-Y395 HydrophobicContact CB-CD2 4.09Å; P393-Y395 HydrophobicContact CB-CE2 3.74Å; P393-Y395 HydrophobicContact CG-CD2 4.37Å; P393-Y395 HydrophobicContact CG-CE2 3.88Å; P393-Y395 WeakPolarHBondContact O-CD2 3.29Å; P393-Y395 PolarHBondContact O-N 3.19Å; Y395-V397 PolarHBondContact O-N 3.27Å; Y395-V397 VanDerWaalsContact O-N 3.12Å
396	S	22.4	Very low	26.8	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	73%	0.733	S	S	*	*			trans	-67.4	103.5	163.5	59.4	0	0	0	0	108.6	Q398	S396-Q398 PolarHBondContact O-N 3.34Å; S396-Q398 VanDerWaalsContact O-N 3.14Å
397	V	24.8	Very low	26.6	Very low	106 Å²	106	139.8 Å²	139.8	64%	0.642	73%	0.733	S	S	*	*			trans	-74.3	99.5	168.5	179.2	0	0	0	0	107.3	Y395 T399	Y395-V397 PolarHBondContact O-N 3.27Å; Y395-V397 VanDerWaalsContact O-N 3.12Å; V397-T399 HydrophobicContact CG1-CG2 4.37Å; V397-T399 PolarHBondContact O-N 3.33Å; V397-T399 VanDerWaalsContact O-N 3.14Å
398	Q	22	Very low	26.2	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.822	74%	0.744	S	S	*	*			trans	-73.9	97.8	162.1	-77.2	-171.3	-12	0	0	108.1	S396 R400	S396-Q398 PolarHBondContact O-N 3.34Å; S396-Q398 VanDerWaalsContact O-N 3.14Å; Q398-R400 PolarHBondContact O-N 3.37Å
399	T	22.5	Very low	25.8	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	76%	0.756	S	S	*	*			trans	-60.4	110.3	164.4	39.7	0	0	0	0	109.5	V397	V397-T399 HydrophobicContact CG1-CG2 4.37Å; V397-T399 PolarHBondContact O-N 3.33Å; V397-T399 VanDerWaalsContact O-N 3.14Å
400	R	24	Very low	25.9	Very low	222 Å²	222	144.6 Å²	144.6	84%	0.838	77%	0.774	S	S	*	*			trans	-133.3	104.4	157	-91.2	-171.1	178.3	157.9	0.2	111.5	Q398	Q398-R400 PolarHBondContact O-N 3.37Å
401	N	23.7	Very low	25.7	Very low	153 Å²	153	144.2 Å²	144.2	82%	0.818	78%	0.778	S	S	*	*			trans	-19.5	128.5	155	-57.8	-25.5	0	0	0	115
402	Y	24.4	Very low	25.8	Very low	232 Å²	232	147.2 Å²	147.2	91%	0.91	78%	0.781	S	S	*	*			trans	-129	91.2	149.9	-84.3	-82.2	0	0	0	108.8
403	L	25.6	Very low	25.9	Very low	156 Å²	156	144.4 Å²	144.4	82%	0.817	78%	0.776	S	S	*	*			trans	-107.1	114.2	155	-94.7	161.4	0	0	0	107.4
404	K	25.3	Very low	25.9	Very low	187 Å²	187	151.9 Å²	151.9	81%	0.813	80%	0.796	S	S	*	*			trans	52.4	112.7	146.4	-71	179.2	176.2	179.3	0	119.9
405	A	25	Very low	26.2	Very low	98 Å²	98	146 Å²	146	81%	0.81	79%	0.789	S	S	*	*				63.2	133.6	117.7	0	0	0	0	0	120.7
406	S	27.5	Very low	26.3	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	80%	0.802	S	S	*	*			trans	100.9	106.7	146.4	-147.9	0	0	0	0	118.1
407	T	28	Very low	26.6	Very low	111 Å²	111	147.1 Å²	147.1	68%	0.681	81%	0.807	S	S	*	*			trans	60.5	115.8	132	59.2	0	0	0	0	121
408	N	29.8	Very low	26.6	Very low	164 Å²	164	152 Å²	152	88%	0.877	82%	0.819	S	S	*	*			trans	62.1	122	134.4	-60.3	-16.3	0	0	0	120.7
409	G	27.9	Very low	26.8	Very low	77 Å²	77	149.5 Å²	149.5	79%	0.794	82%	0.82	S	S	*	*			trans	130.4	125.3	148.9	0	0	0	0	0	115.6
410	P	30.5	Very low	27	Very low	128 Å²	128	148.9 Å²	148.9	83%	0.831	82%	0.821	S	S	*	*			trans	-97.3	153.3	-168.7	37.2	-32.7	0	0	0	115.5
411	A	26.8	Very low	26.9	Very low	94 Å²	94	150 Å²	150	78%	0.777	83%	0.825	S	S	*	*			trans	57.2	123.1	148.2	0	0	0	0	0	120.8
412	R	30.8	Very low	27.2	Very low	251 Å²	251	148.8 Å²	148.8	95%	0.947	82%	0.823	S	S	*	*				-169.7	154.3	123.6	-102.8	167.5	-172.9	-151.6	2.6	113.3
413	T	26.6	Very low	27.1	Very low	111 Å²	111	144 Å²	144	68%	0.681	82%	0.818	S	S	*	*			trans	-96.4	176.5	-163.7	39.6	0	0	0	0	114.4
414	Y	26.7	Very low	27.3	Very low	228 Å²	228	141.4 Å²	141.4	89%	0.894	81%	0.813	S	S	*	*			trans	88.6	140.9	167.8	-61.3	-84.6	0	0	0	116
415	G	30.4	Very low	27.4	Very low	73 Å²	73	141.5 Å²	141.5	75%	0.753	82%	0.816	S	S	*	*			cis	-175.6	169.8	8.8	0	0	0	0	0	110.2
416	K	26.6	Very low	27.6	Very low	222 Å²	222	142.4 Å²	142.4	97%	0.965	81%	0.814	S	S	*	*			trans	-69.4	151.2	-172.2	-67	168.6	174.4	172.1	0	114.1
417	G	29.2	Very low	27.4	Very low	83 Å²	83	143 Å²	143	86%	0.856	81%	0.814	S	S	*	*			trans	-163.6	122.8	160	0	0	0	0	0	112.4
418	K	25.3	Very low	27.2	Very low	207 Å²	207	145.8 Å²	145.8	90%	0.9	82%	0.819	S	S	*	*			trans	-93.5	167.1	176.5	-76.7	178.2	174	178.1	0	111.1
419	C	25.8	Very low	26.9	Very low	124 Å²	124	144.5 Å²	144.5	84%	0.838	82%	0.817	S	S	*	*			trans	117.3	143.8	162.9	-73.4	0	0	0	0	111.6
420	S	26.1	Very low	26.7	Very low	106 Å²	106	151.1 Å²	151.1	74%	0.741	82%	0.82	S	S	*	*			cis	-169.2	159	-13.1	39.3	0	0	0	0	106.5
421	R	23.9	Very low	26.3	Very low	244 Å²	244	151.5 Å²	151.5	92%	0.921	82%	0.824	S	S	*	*			trans	-43	126.3	179.9	-154.6	179.3	-138.4	171.2	1.4	114.4
422	V	28.3	Very low	26.2	Very low	128 Å²	128	152.5 Å²	152.5	78%	0.776	82%	0.82	S	S	*	*			trans	-139.1	125.7	157.3	178.4	0	0	0	0	108.4
423	T	23.9	Very low	26	Very low	131 Å²	131	152.1 Å²	152.1	80%	0.804	82%	0.819	S	S	*	*			trans	-84.5	124.9	169.4	44.2	0	0	0	0	109.3
424	S	29.9	Very low	25.8	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	83%	0.826	S	S	*	*			trans	-164.6	121.6	161.5	54	0	0	0	0	109.2
425	E	25.8	Very low	25.7	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.883	82%	0.816	S	S	*	*			trans	-58.9	154.9	164.8	-67.8	-176.6	149.6	0	0	111.2
426	P	29.1	Very low	25.5	Very low	117 Å²	117	150.6 Å²	150.6	76%	0.76	83%	0.825	S	S	*	*			trans	-131	122.5	140.6	20.6	-0.8	0	0	0	113
427	T	23.4	Very low	25.3	Very low	113 Å²	113	143.1 Å²	143.1	69%	0.693	81%	0.811	S	S	*	*			trans	-16.4	146.1	141.7	36.3	0	0	0	0	119.8
428	E	24.1	Very low	25	Very low	169 Å²	169	148.5 Å²	148.5	79%	0.79	81%	0.813	S	S	*	*			trans	67	125.8	140.3	-64.7	177.3	177.7	0	0	119.4
429	T	25	Very low	24.8	Very low	137 Å²	137	143.3 Å²	143.3	84%	0.84	81%	0.809	S	S	*	*				-163.4	125.2	76.9	21.5	0	0	0	0	112.3
430	Y	21.9	Very low	24.7	Very low	217 Å²	217	147.4 Å²	147.4	85%	0.851	81%	0.813	S	S	*	*			trans	-70.7	139.9	160.3	-88.4	-104.3	0	0	0	109.6	T432	Y430-T432 HydrophobicContact CD1-CG2 4.48Å
431	C	23	Very low	24.5	Very low	135 Å²	135	147.1 Å²	147.1	91%	0.912	81%	0.81	S	S	*	*			trans	-117	85.8	161.4	-156.5	0	0	0	0	109
432	T	23.7	Very low	24.4	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	80%	0.801	S	S	*	*			trans	-92.7	122.6	160.3	47.3	0	0	0	0	108.3	Y430	Y430-T432 HydrophobicContact CD1-CG2 4.48Å
433	R	27.3	Very low	24.1	Very low	243 Å²	243	140.3 Å²	140.3	92%	0.917	81%	0.805	S	S	*	*			trans	-146.2	106.5	154.6	-116.1	179.6	-176.8	176.8	1.2	111.1
434	S	23.6	Very low	24	Very low	119 Å²	119	142.8 Å²	142.8	83%	0.832	80%	0.804	S	S	*	*			trans	-55.5	139.5	155.4	-53.4	0	0	0	0	110.7
435	A	24.2	Very low	23.7	Very low	84 Å²	84	145.3 Å²	145.3	69%	0.694	81%	0.809	S	S	*	*			trans	177.8	128.4	140.9	0	0	0	0	0	111
436	L	25.6	Very low	23.4	Very low	178 Å²	178	143.1 Å²	143.1	93%	0.932	80%	0.803	S	S	*	*			trans	73.2	114.7	157.8	-52.7	160.2	0	0	0	114.7
437	G	22.2	Very low	23.2	Very low	65 Å²	65	144 Å²	144	67%	0.67	80%	0.8	S	S	*	*			cis	114.1	110.8	45.2	0	0	0	0	0	107.3
438	H	22.2	Very low	23.1	Very low	196 Å²	196	142.3 Å²	142.3	91%	0.907	79%	0.793	S	S	*	*			trans	31	114.3	162.2	-71.3	-85.6	0	0	0	119.9
439	A	22	Very low	23.2	Very low	98 Å²	98	141.2 Å²	141.2	81%	0.81	79%	0.792	S	S	*	*				179.6	131.8	120.5	0	0	0	0	0	112	S441	A439-S441 PolarHBondContact O-N 2.62Å
440	K	23.6	Very low	23.1	Very low	210 Å²	210	141.4 Å²	141.4	91%	0.913	79%	0.788	S	S	*	*			trans	-56.9	128.3	164.1	-64.6	167.5	176.2	173.6	0	109.3
441	S	22.1	Very low	23.3	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	78%	0.781	S	S	*	*			trans	178.6	133.3	142.2	48.7	0	0	0	0	111.7	A439	A439-S441 PolarHBondContact O-N 2.62Å
442	S	21.9	Very low	23.5	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	78%	0.777	S	S	*	*			trans	14.7	107.2	149	56.5	0	0	0	0	118.9
443	C	22.3	Very low	23.6	Very low	125 Å²	125	138.5 Å²	138.5	85%	0.845	79%	0.788	S	S	*	*			trans	-106.4	87.5	154.3	-72.8	0	0	0	0	109.7	L445	C443-L445 PolarHBondContact O-N 2.73Å
444	K	21.6	Very low	23.6	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.796	78%	0.775	S	S	*	*			trans	-57.5	110.5	148	-76.3	172.7	174.4	173	0	107.1	N446	K444-N446 VanDerWaalsContact C-N 3.33Å; K444-N446 PolarHBondContact O-N 2.88Å
445	L	22.5	Very low	23.8	Very low	155 Å²	155	135.8 Å²	135.8	81%	0.812	78%	0.778	S	S	*	*			trans	-84.3	88.2	162.4	-103	151.6	0	0	0	107.2	C443 I447	C443-L445 PolarHBondContact O-N 2.73Å; L445-I447 PolarHBondContact O-N 2.8Å
446	N	21	Very low	23.9	Very low	143 Å²	143	140.4 Å²	140.4	77%	0.765	79%	0.785	S	S	*	*			trans	-65.2	105.6	157.4	-82.8	-23.7	0	0	0	107	K444 S448	K444-N446 VanDerWaalsContact C-N 3.33Å; K444-N446 PolarHBondContact O-N 2.88Å; N446-S448 PolarHBondContact O-N 3.07Å
447	I	24.2	Very low	23.9	Very low	134 Å²	134	140.8 Å²	140.8	69%	0.687	78%	0.779	S	S	*	*			trans	-85.7	96.4	158.2	-63.6	172.9	0	0	0	104.7	L445 L449	L445-I447 PolarHBondContact O-N 2.8Å; I447-L449 HydrophobicContact CG2-CD1 4.28Å; I447-L449 HydrophobicContact CG2-CG 3.96Å; I447-L449 PolarHBondContact O-N 3.18Å
448	S	21.5	Very low	24.3	Very low	79 Å²	79	148 Å²	148	55%	0.552	79%	0.792	S	S	*	*			trans	-60.2	117.4	155.7	148.5	0	0	0	0	106	N446 D450	N446-S448 PolarHBondContact O-N 3.07Å; S448-D450 PolarHBondContact OG-N 3.09Å; S448-D450 PolarHBondContact OG-OD2 3.27Å
449	L	26.4	Very low	24.8	Very low	145 Å²	145	143.4 Å²	143.4	76%	0.759	79%	0.787	S	S	*	*			trans	-110.9	79.3	153.9	-80.5	166.2	0	0	0	105.7	I447 T451	I447-L449 HydrophobicContact CG2-CD1 4.28Å; I447-L449 HydrophobicContact CG2-CG 3.96Å; I447-L449 PolarHBondContact O-N 3.18Å; L449-T451 VanDerWaalsContact C-N 3.25Å; L449-T451 PolarHBondContact O-N 3.29Å
450	D	22.6	Very low	25	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	80%	0.796	S	S	*	*			trans	-64.2	92.3	155.5	-72.2	-53.2	0	0	0	107.4	S448	S448-D450 PolarHBondContact OG-N 3.09Å; S448-D450 PolarHBondContact OG-OD2 3.27Å
451	T	26	Very low	25.1	Very low	115 Å²	115	140.8 Å²	140.8	71%	0.706	78%	0.784	S	S	*	*			trans	-175.5	99.5	156.6	19.2	0	0	0	0	108.5	L449	L449-T451 VanDerWaalsContact C-N 3.25Å; L449-T451 PolarHBondContact O-N 3.29Å
452	E	27.5	Very low	25.5	Very low	178 Å²	178	146.2 Å²	146.2	83%	0.832	80%	0.796	S	S	*	*			trans	156.4	65.2	141.5	-84.9	-176.4	167.7	0	0	111	A454	E452-A454 PolarHBondContact O-N 3.28Å
453	A	24.9	Very low	25.7	Very low	113 Å²	113	153 Å²	153	93%	0.934	81%	0.805	S	S	*	*			trans	-86.4	31.8	167.9	0	0	0	0	0	112.6
454	A	27.3	Very low	26.2	Very low	77 Å²	77	157 Å²	157	64%	0.636	81%	0.808	S	S	*	*			trans	-148.1	59.1	-168.1	0	0	0	0	0	115.2	E452	E452-A454 PolarHBondContact O-N 3.28Å
455	Y	28	Very low	26.5	Very low	228 Å²	228	160 Å²	160	89%	0.894	81%	0.814	S	S	*	*			trans	-161.7	52.6	159.2	-100.9	-69.3	0	0	0	113.9
456	E	25.7	Very low	26.7	Very low	180 Å²	180	156.5 Å²	156.5	84%	0.841	81%	0.808	S	S	*	*			trans	-140.3	93.9	165.3	-79.7	-164.9	155	0	0	112
457	K	25.6	Very low	27.2	Very low	186 Å²	186	159 Å²	159	81%	0.809	82%	0.815	S	S	*	*			trans	-170.4	93	155.8	-111.4	176.8	-175.2	179.4	0	110.9
458	K	31.8	Very low	27.4	Very low	217 Å²	217	158.8 Å²	158.8	94%	0.943	82%	0.815	S	S	*	*			trans	165.8	128.4	150.6	-96.2	165.8	-175.9	179.4	0	108.4
459	A	31.6	Very low	27.9	Very low	99 Å²	99	161.9 Å²	161.9	82%	0.818	83%	0.831	S	S	*	*			cis	-162.6	128.3	-11	0	0	0	0	0	106.7
460	L	26.4	Very low	28	Very low	187 Å²	187	162.2 Å²	162.2	98%	0.979	83%	0.834	S	S	*	*			trans	-79.1	139.7	168.8	-94.7	151.3	0	0	0	110.4
461	G	25.8	Very low	28.5	Very low	66 Å²	66	159.8 Å²	159.8	68%	0.68	83%	0.833	S	S	*	*			trans	120.4	101.2	146.9	0	0	0	0	0	116.3
462	K	30.9	Very low	28.6	Very low	213 Å²	213	161.9 Å²	161.9	93%	0.926	84%	0.84	S	S	*	*				-173.1	105.8	116	-96.9	164.1	-169.6	-177.3	0	110.8
463	R	26.4	Very low	28.6	Very low	248 Å²	248	162.5 Å²	162.5	94%	0.936	84%	0.843	S	S	*	*			trans	-72.1	134.6	155.5	-81	177	165.6	173.7	-4.8	108.7
464	K	32	Very low	28.9	Very low	209 Å²	209	162.6 Å²	162.6	91%	0.909	83%	0.834	S	S	*	*			trans	-143.7	129.5	140.7	-84.4	-162.9	176	-176.9	0	110.4
465	R	27.3	Very low	28.8	Very low	245 Å²	245	164.3 Å²	164.3	93%	0.925	84%	0.836	S	S	*	*			trans	-30.7	135.4	165.4	-71.3	173.1	175.9	179.9	-3.1	112.9
466	A	27.2	Very low	28.6	Very low	82 Å²	82	161.4 Å²	161.4	68%	0.678	83%	0.831	S	S	*	*				113	124	64.6	0	0	0	0	0	107.5
467	H	32.6	Very low	28.5	Very low	195 Å²	195	158 Å²	158	90%	0.903	83%	0.827	S	S	*	*				-171.8	136	123.1	-110.6	-79.9	0	0	0	110.5
468	N	27.7	Very low	28.3	Very low	130 Å²	130	154.1 Å²	154.1	70%	0.695	82%	0.822	S	S	*	*			trans	-72.2	147.3	175.8	-153.9	6.7	0	0	0	109.7
469	T	33.1	Very low	27.8	Very low	144 Å²	144	149.9 Å²	149.9	88%	0.883	82%	0.815	S	S	*	*			trans	-172.7	136.7	137.1	23.5	0	0	0	0	111.3
470	N	28.5	Very low	27.4	Very low	153 Å²	153	154.6 Å²	154.6	82%	0.818	82%	0.817	S	S	*	*			trans	-71.3	156	-177.1	-71.8	-33.6	0	0	0	114.1
471	A	32.3	Very low	27.2	Very low	91 Å²	91	157.6 Å²	157.6	75%	0.752	82%	0.815	S	S	*	*				171.9	106.8	127.3	0	0	0	0	0	107.5
472	N	28.7	Very low	27	Very low	159 Å²	159	166.5 Å²	166.5	85%	0.85	83%	0.828	S	S	*	*				47.2	104.9	94.6	-83.1	-4.9	0	0	0	114.1
473	E	27.9	Very low	26.7	Very low	190 Å²	190	167.5 Å²	167.5	89%	0.888	83%	0.826	S	S	*	*				-171.8	143.5	118.9	-102	175.7	-173.6	0	0	111.2
474	P	29.9	Very low	26.6	Very low	115 Å²	115	161.8 Å²	161.8	75%	0.747	81%	0.813	S	S	*	*			trans	-96.9	-172.1	-176.6	36.6	-25.7	0	0	0	111.5
475	V	25.5	Very low	26.2	Very low	114 Å²	114	157.7 Å²	157.7	69%	0.691	80%	0.798	S	S	*	*			trans	135.6	109.4	150.1	174.2	0	0	0	0	113.6
476	E	24.3	Very low	26.1	Very low	166 Å²	166	148.2 Å²	148.2	78%	0.776	78%	0.776	S	S	*	*			trans	60.3	125.8	134.2	-62	175.2	167.9	0	0	123.2
477	S	23.2	Very low	26	Very low	109 Å²	109	150.4 Å²	150.4	76%	0.762	77%	0.77	S	S	*	*				60.8	126.2	127.4	88.2	0	0	0	0	118.8
478	C	21.4	Very low	25.6	Very low	104 Å²	104	143.9 Å²	143.9	70%	0.703	75%	0.75	S	S	*	*				171.2	121.3	108.9	-161.5	0	0	0	0	108.9
479	T	21.5	Very low	25.4	Very low	129 Å²	129	144.7 Å²	144.7	79%	0.791	74%	0.744	S	S	*	*			trans	-51.5	129.7	162.4	40.6	0	0	0	0	111.2
480	K	23.4	Very low	24.9	Very low	198 Å²	198	141 Å²	141	86%	0.861	72%	0.721	S	S	*	*			trans	-162.7	108.7	150	-109.3	153.5	-167.6	173.5	0	113.2
481	R	21.5	Very low	24.7	Very low	249 Å²	249	135.9 Å²	135.9	94%	0.94	70%	0.697	S	S	*	*			trans	-42.7	131.4	156.6	-69.3	171.9	177	170.8	-0.4	110.7
482	R	22.9	Very low	24.2	Very low	254 Å²	254	139.4 Å²	139.4	96%	0.958	70%	0.698	S	S	*	*			trans	-152.9	130.2	147.3	-108.1	171.3	-166.8	-167.6	3.3	111.3
483	R	22.7	Very low	24	Very low	233 Å²	233	135.2 Å²	135.2	88%	0.879	68%	0.675	S	S	*	*			trans	-95.1	161.6	-176.9	-147.1	175.6	-174.5	168	-1	108.4
484	L	24.4	Very low	23.9	Very low	128 Å²	128	128.9 Å²	128.9	67%	0.67	66%	0.66	S	S	*	*			trans	96.8	138.5	165.6	-54	157	0	0	0	115.7	A326	A326-L484 HydrophobicContact CB-CB 4.45Å
485	E	25.2	Very low	23.6	Very low	124 Å²	124	131.1 Å²	131.1	58%	0.579	67%	0.666	S	S	*	*			cis	158.3	131.4	-13.6	-114.5	177.1	-160	0	0	108.4	A326 K327	A326-E485 CarbonylContact C-O 2.85Å; A326-E485 WeakPolarHBondContact CA-O 3.26Å; A326-E485 HydrophobicContact CB-CB 3.83Å; A326-E485 WeakPolarHBondContact CB-O 3.41Å; K327-E485 CarbonylContact C-O 2.99Å; K327-E485 WeakPolarHBondContact CA-O 3.32Å; K327-E485 PolarHBondContact N-O 2.85Å; K327-E485 CarbonylContact O-C 3.56Å; K327-E485 PolarHBondContact O-N 3.25Å; K327-E485 VanDerWaalsContact O-O 3.08Å
486	G	24	Very low	23.5	Very low	46 Å²	46	129.7 Å²	129.7	47%	0.474	67%	0.666	S	S	.	*			trans	74.6	100.6	148.7	0	0	0	0	0	125.1	K327 A328	K327-G486 VanDerWaalsContact C-C 3.41Å; K327-G486 VanDerWaalsContact C-N 3.26Å; K327-G486 CarbonylContact C-O 3.51Å; K327-G486 VanDerWaalsContact CA-O 3.28Å; K327-G486 WeakPolarHBondContact CA-O 3.47Å; K327-G486 PolarHBondContact O-N 3.32Å; A328-G486 VanDerWaalsContact CB-N 3.34Å; A328-G486 VanDerWaalsContact N-CA 3.28Å; A328-G486 VanDerWaalsContact N-N 3.12Å; A328-G486 PolarHBondContact N-O 3.29Å
487	K	25.9	Very low	23.4	Very low	128 Å²	128	129.7 Å²	129.7	56%	0.557	67%	0.672	S	S	*	*			trans	174.4	120.3	159.8	-73.2	-141.8	-177.9	-180	0	112.9	A328	A328-K487 VanDerWaalsContact CA-N 3.28Å; A328-K487 VanDerWaalsContact O-O 3.11Å
488	A	23	Very low	23.5	Very low	57 Å²	57	130.6 Å²	130.6	47%	0.471	67%	0.672	S	S	.	*			trans	-101.6	150.3	-170.9	0	0	0	0	0	114.9	M248	M248-A488 HydrophobicContact CE-CB 4.01Å
489	Y	23.9	Very low	23.5	Very low	147 Å²	147	131.1 Å²	131.1	58%	0.576	68%	0.677	S	S	*	*			trans	-145.1	150.6	173.2	-66.1	-105.2	0	0	0	112.8	I330	I330-Y489 HydrophobicContact CD1-CD2 2.95Å; I330-Y489 HydrophobicContact CD1-CE2 3.58Å; I330-Y489 HydrophobicContact CD1-CG 3.51Å; I330-Y489 HydrophobicContact CG1-CD2 3.36Å; I330-Y489 HydrophobicContact CG1-CE2 4.25Å; I330-Y489 HydrophobicContact CG1-CG 3.97Å
490	V	22.7	Very low	23.6	Very low	67 Å²	67	131.2 Å²	131.2	41%	0.406	68%	0.677	S	S	.	*			trans	-80.4	145.6	-162.8	-179.4	0	0	0	0	112.2	D244 A246	D244-V490 HydrophobicContact CB-CG1 4.33Å; A246-V490 HydrophobicContact CB-CG1 3.75Å
491	C	24.4	Very low	23.6	Very low	45 Å²	45	130.5 Å²	130.5	30%	0.304	68%	0.677	S	S	.	*			trans	-126.3	103.8	167.3	-165.3	0	0	0	0	110.5	A246 I493	A246-C491 VanDerWaalsContact CA-O 3.26Å; A246-C491 WeakPolarHBondContact CA-O 3.49Å; A246-C491 VanDerWaalsContact CB-C 3.43Å; A246-C491 WeakPolarHBondContact CB-O 3.49Å; C491-I493 PolarHBondContact O-N 2.98Å
492	E	21.8	Very low	23.7	Very low	166 Å²	166	127.1 Å²	127.1	78%	0.776	67%	0.672	S	S	*	*			trans	-58.4	122.5	175.1	-69.6	177.1	159.6	0	0	110.4
493	I	25	Very low	23.8	Very low	70 Å²	70	120.8 Å²	120.8	36%	0.359	67%	0.665	S	S	.	*			trans	-109.6	87.1	164.4	-58.5	175	0	0	0	105	A336 E337 C491	A336-I493 HydrophobicContact CB-CD1 3.76Å; E337-I493 HydrophobicContact CG-CG2 4.39Å; C491-I493 PolarHBondContact O-N 2.98Å
494	G	24.4	Very low	24.1	Very low	57 Å²	57	120.3 Å²	120.3	59%	0.588	66%	0.663	S	S	*	*			trans	-111.8	113.7	-176.6	0	0	0	0	0	110.9	A496	G494-A496 PolarHBondContact O-N 2.71Å
495	N	24.3	Very low	24.4	Very low	163 Å²	163	121.8 Å²	121.8	87%	0.872	67%	0.672	S	S	*	*			trans	-47	129.5	166.7	-74.1	-32.9	0	0	0	111.1
496	A	24.4	Very low	24.8	Very low	83 Å²	83	125.3 Å²	125.3	69%	0.686	69%	0.685	S	S	*	*	S	Bend	trans	51.2	108.6	156	0	0	0	0	0	117.7	G494	G494-A496 PolarHBondContact O-N 2.71Å
497	N	22.4	Very low	25.2	Very low	167 Å²	167	133.1 Å²	133.1	89%	0.893	71%	0.706	S	S	*	*			trans	46.8	83.6	150.6	-66.7	-21.9	0	0	0	117.1
498	V	24.2	Very low	25.6	Very low	127 Å²	127	136.7 Å²	136.7	77%	0.77	72%	0.722	S	S	*	*			trans	-140.9	119.6	153.9	-170.6	0	0	0	0	110.7	V500	V498-V500 HydrophobicContact CG1-CG2 3.92Å
499	S	21.3	Very low	26	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	74%	0.742	S	S	*	*			trans	-72	130	166.4	56	0	0	0	0	110.1
500	V	24.2	Very low	26.5	Very low	131 Å²	131	146.8 Å²	146.8	79%	0.794	76%	0.758	S	S	*	*			trans	-137.7	123.1	165.5	-169.4	0	0	0	0	111.6	V498	V498-V500 HydrophobicContact CG1-CG2 3.92Å
501	Q	23.1	Very low	26.9	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	78%	0.775	S	S	*	*			trans	-69.8	159.2	176.7	-74	173.5	-55.5	0	0	112.6	C503	Q501-C503 PolarHBondContact O-N 3.19Å; Q501-C503 VanDerWaalsContact O-N 3.17Å
502	Q	22.9	Very low	27.2	Very low	179 Å²	179	156.2 Å²	156.2	84%	0.836	80%	0.803	S	S	*	*			trans	-64.5	107.8	177.3	-158.8	178	40.1	0	0	111.6	R504	Q502-R504 PolarHBondContact O-N 3.32Å
503	C	25.4	Very low	27.7	Very low	121 Å²	121	156.3 Å²	156.3	82%	0.818	80%	0.803	S	S	*	*			trans	-73.3	107.7	169	-100.8	0	0	0	0	110.2	Q501 D505	Q501-C503 PolarHBondContact O-N 3.19Å; Q501-C503 VanDerWaalsContact O-N 3.17Å; C503-D505 PolarHBondContact O-N 3.43Å
504	R	28.1	Very low	27.9	Very low	223 Å²	223	157 Å²	157	84%	0.842	82%	0.815	S	S	*	*			trans	-75.1	108.8	163.6	-79.5	-179.8	172.9	176.8	-2.4	108.8	Q502 K506	Q502-R504 PolarHBondContact O-N 3.32Å; R504-K506 PolarHBondContact O-N 2.99Å
505	D	32.3	Very low	28.3	Very low	159 Å²	159	162.9 Å²	162.9	85%	0.85	82%	0.824	S	S	*	*			trans	-66.4	105.2	166.3	-81.9	-30.6	0	0	0	110.3	C503 K507	C503-D505 PolarHBondContact O-N 3.43Å; D505-K507 PolarHBondContact O-N 3.09Å; D505-K507 VanDerWaalsContact O-N 3.12Å
506	K	33.2	Very low	28.7	Very low	197 Å²	197	163 Å²	163	86%	0.857	82%	0.816	S	S	*	*			trans	-66.4	102.5	166.3	-75.1	178.9	177.1	174.5	0	108.4	R504 K508	R504-K506 PolarHBondContact O-N 2.99Å; K506-K508 PolarHBondContact O-N 2.88Å
507	K	32.9	Very low	29	Very low	210 Å²	210	165.6 Å²	165.6	91%	0.913	82%	0.819	S	S	*	*			trans	-56.5	100.8	158.7	-86.4	-177.2	174.1	177.3	0	109.4	D505	D505-K507 PolarHBondContact O-N 3.09Å; D505-K507 VanDerWaalsContact O-N 3.12Å
508	K	34.6	Very low	29.5	Very low	204 Å²	204	164.2 Å²	164.2	89%	0.887	82%	0.816	S	S	*	*			trans	-83.8	112	159.1	-97.7	-176.6	174.6	178.3	0	108.6	K506 K510	K506-K508 PolarHBondContact O-N 2.88Å; K508-K510 PolarHBondContact O-N 3.5Å
509	K	30.1	Very low	29.7	Very low	204 Å²	204	166.1 Å²	166.1	89%	0.887	82%	0.821	S	S	*	*			trans	-62	120	163.1	-79.7	175.4	169.5	178	0	109.9
510	K	34.8	Very low	30.1	Very low	212 Å²	212	175.5 Å²	175.5	92%	0.922	84%	0.839	S	S	*	*			trans	-162.7	115.9	143.2	-69.7	-161.6	178.1	-179.4	0	103.5	K508	K508-K510 PolarHBondContact O-N 3.5Å
511	G	31	Very low	30.4	Very low	74 Å²	74	177.8 Å²	177.8	76%	0.763	84%	0.841	S	S	*	*				119.8	116.8	54.6	0	0	0	0	0	105.8
512	R	29.8	Very low	30.7	Very low	235 Å²	235	177.5 Å²	177.5	89%	0.887	84%	0.841	S	S	*	*			trans	17.9	126.4	156.4	-78.6	175	175.6	176	-2.8	117.2
513	E	32.3	Very low	31.2	Very low	169 Å²	169	177.4 Å²	177.4	79%	0.79	84%	0.841	S	S	*	*				-177	128.7	64.2	-111.6	157.2	-177.4	0	0	107.4
514	S	30.4	Very low	31.5	Very low	85 Å²	85	180.8 Å²	180.8	59%	0.594	84%	0.842	S	S	*	*				84	125.6	96.2	108.8	0	0	0	0	115.9
515	K	32.7	Very low	31.7	Very low	180 Å²	180	178.1 Å²	178.1	78%	0.783	84%	0.842	S	S	*	*			trans	72.7	140.5	155.4	-59.7	172	-176.7	172	0	114.8
516	K	32.3	Very low	31.7	Very low	164 Å²	164	179.4 Å²	179.4	71%	0.713	84%	0.842	S	S	*	*			cis	-170.2	145.2	2	-116.7	174.1	177.8	-177.5	0	104.4
517	N	30.3	Very low	31.6	Very low	138 Å²	138	178.1 Å²	178.1	74%	0.738	84%	0.841	S	S	*	*			trans	55	140	145.2	-53.4	-13	0	0	0	118.1
518	V	34.3	Very low	31.5	Very low	139 Å²	139	175.7 Å²	175.7	84%	0.842	84%	0.835	S	S	*	*			cis	-159.7	136	45.9	169.8	0	0	0	0	107.5
519	L	27.1	Very low	31.2	Very low	166 Å²	166	173.3 Å²	173.3	87%	0.869	83%	0.831	S	S	*	*			trans	-76.8	135.9	167.3	-96.9	114.6	0	0	0	110.8
520	R	29.3	Very low	31.3	Very low	314 Å²	314	170.5 Å²	170.5	100%	1.185	83%	0.826	S	S	*	*				-143	0	123.6	-137.4	-178.7	-168.7	-172.9	3.7	109.5

Retrieved 520 of 520 residues in 410.6 ms (Link to these results)

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