A0A093HN95_STRCA Loading...

Kelch-like 6

AlphaFold DB , UniProt , Accession A0A093HN95, Species STRCA (Struthio camelus australis), Gene n/a, Length 610 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	29.8	Very low	250 Å²	250	156.6 Å²	156.6	100%	1.232	85%	0.846	S	S	*	*				0	119.7	0	-80.1	-177.2	-176.9	0	0	107
2	G	32.2	Very low	30	Very low	67 Å²	67	154.2 Å²	154.2	69%	0.691	84%	0.844	S	S	*	*			trans	66.1	106.1	170.1	0	0	0	0	0	115.5
3	D	31	Very low	29.6	Very low	164 Å²	164	157.5 Å²	157.5	88%	0.877	85%	0.85	S	S	*	*				82.8	138.6	75.4	-80.7	-1.8	0	0	0	111.9
4	T	31.2	Very low	29.9	Very low	104 Å²	104	158.1 Å²	158.1	64%	0.638	85%	0.852	S	S	*	*			cis	-173.5	157.4	-28.5	-25.5	0	0	0	0	105.4
5	L	32.8	Very low	29.6	Very low	142 Å²	142	155.9 Å²	155.9	74%	0.743	85%	0.853	S	S	*	*			trans	75.5	146.6	157.1	-53.9	157	0	0	0	117
6	E	29.4	Very low	29.8	Very low	166 Å²	166	153.8 Å²	153.8	78%	0.776	85%	0.846	S	S	*	*			cis	-172.9	148.5	-2.9	-118.9	172.5	-176.2	0	0	106.6
7	K	27.2	Very low	29.6	Very low	209 Å²	209	153.3 Å²	153.3	91%	0.909	84%	0.842	S	S	*	*			trans	178.8	125.2	151.4	-108.6	177.2	-175.8	-176.4	0	112.1
8	S	27.8	Very low	29.5	Very low	113 Å²	113	152.2 Å²	152.2	79%	0.79	84%	0.835	S	S	*	*			trans	173.6	107.1	146.2	53.7	0	0	0	0	107.9
9	S	28.4	Very low	29.5	Very low	118 Å²	118	153.4 Å²	153.4	83%	0.825	83%	0.834	S	S	*	*				101.2	109.8	76.5	64.4	0	0	0	0	110.6
10	E	27.8	Very low	29.4	Very low	196 Å²	196	151.9 Å²	151.9	92%	0.916	83%	0.834	S	S	*	*			trans	-99.4	133.4	169.1	-73	-179.4	150	0	0	109.8
11	E	25.1	Very low	29.4	Very low	194 Å²	194	149.5 Å²	149.5	91%	0.907	83%	0.828	S	S	*	*			trans	-142.5	142.3	143.6	-92.3	-171	175.8	0	0	107.6
12	P	32.5	Very low	29.2	Very low	127 Å²	127	149.8 Å²	149.8	83%	0.825	82%	0.815	S	S	*	*			trans	-103.3	139.2	-175.7	36.2	-27.9	0	0	0	112.9
13	E	25.3	Very low	29.2	Very low	197 Å²	197	156 Å²	156	92%	0.921	82%	0.823	S	S	*	*			trans	-108.8	147.2	166.1	-82.7	-170.2	159.6	0	0	111.9
14	L	33.2	Very low	29.7	Very low	167 Å²	167	157 Å²	157	87%	0.874	83%	0.825	S	S	*	*			trans	-67	150.8	-178.2	-68.5	104.8	0	0	0	114
15	S	25.4	Very low	30.3	Very low	125 Å²	125	155 Å²	155	87%	0.874	83%	0.825	S	S	*	*			trans	-150.9	139.7	141.4	61.1	0	0	0	0	112.7
16	V	32.7	Very low	30.5	Very low	122 Å²	122	156.2 Å²	156.2	74%	0.739	83%	0.832	S	S	*	*			trans	-102.8	130.1	174.9	176.5	0	0	0	0	106.8
17	D	26.9	Very low	31.2	Very low	145 Å²	145	155.2 Å²	155.2	78%	0.775	83%	0.832	S	S	*	*			trans	-179.3	125.7	131	-96.8	-22.8	0	0	0	113.8
18	N	27.6	Very low	32.2	Very low	133 Å²	133	148.1 Å²	148.1	71%	0.711	81%	0.806	S	S	*	*			trans	41.9	123.4	140.8	-88.2	-13.7	0	0	0	125
19	E	30.6	Very low	33.1	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.822	81%	0.81	S	S	*	*			trans	49.1	117.8	130.1	-67.4	-173	151.2	0	0	120.8
20	C	27.1	Very low	33.9	Very low	123 Å²	123	152.9 Å²	152.9	83%	0.831	81%	0.812	S	S	*	*				160.8	148.5	97.9	-164.1	0	0	0	0	112.4
21	S	28.2	Very low	34.9	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	79%	0.793	S	S	*	*			trans	86.9	77.6	163.7	79.8	0	0	0	0	119
22	R	31.6	Very low	36.1	Very low	256 Å²	256	143.1 Å²	143.1	97%	0.966	79%	0.787	S	S	*	*			trans	-87.2	111.9	147.4	-81	-175	179.1	170.6	1	108.4
23	K	32.2	Very low	37.3	Very low	196 Å²	196	141.2 Å²	141.2	85%	0.852	79%	0.79	S	S	*	*			trans	-61.1	139.5	-178.4	-77.5	178.1	175	176.2	0	111.2
24	M	40.2	Very low	39.3	Very low	185 Å²	185	140.8 Å²	140.8	91%	0.911	79%	0.788	S	S	*	*	S	Bend	trans	-54.2	130.6	167.3	-155.7	97.3	76.9	0	0	110.8
25	G	45.4	Very low	40.7	Very low	63 Å²	63	141.4 Å²	141.4	65%	0.649	78%	0.783	S	S	*	*			trans	82	93.7	161.2	0	0	0	0	0	115.9
26	D	36.7	Very low	43.3	Very low	167 Å²	167	141.3 Å²	141.3	89%	0.893	78%	0.777	S	S	*	*			trans	-114.3	134	156.7	-91.2	-30.2	0	0	0	110.6
27	L	43.8	Very low	45.4	Very low	146 Å²	146	143.4 Å²	143.4	76%	0.764	78%	0.777	S	S	*	*			trans	-90.7	132.4	-159.5	-72.7	147.9	0	0	0	112.7
28	V	47.6	Very low	48.2	Very low	59 Å²	59	144.2 Å²	144.2	36%	0.358	77%	0.774	S	S	.	*			trans	54.5	109.9	134.2	-172.5	0	0	0	0	118.3	V30 V36	V28-V30 PolarHBondContact O-N 3.07Å; V28-V36 HydrophobicContact CG1-CG1 4.09Å; V28-V36 HydrophobicContact CG2-CG1 4.01Å
29	E	45.9	Very low	50.7	Low	190 Å²	190	143.3 Å²	143.3	89%	0.888	77%	0.768	S	S	*	*			trans	-64.1	124	152.3	-82.5	-173.3	154.3	0	0	110.2	S31	E29-S31 PolarHBondContact O-N 2.78Å
30	V	45.9	Very low	53.3	Low	142 Å²	142	138.6 Å²	138.6	86%	0.861	75%	0.749	S	S	*	*			trans	-72.9	112.1	178.9	179.7	0	0	0	0	109.9	V28	V28-V30 PolarHBondContact O-N 3.07Å
31	S	48.1	Very low	55.8	Low	75 Å²	75	138 Å²	138	52%	0.524	74%	0.742	S	S	.	*			trans	-117.6	115.3	162.3	73.2	0	0	0	0	110.6	E29 G33	E29-S31 PolarHBondContact O-N 2.78Å; S31-G33 PolarHBondContact O-N 3.46Å
32	S	50.8	Low	58.5	Low	110 Å²	110	134.6 Å²	134.6	77%	0.769	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	21.4	95	161.2	61	0	0	0	0	118.1	E34	S32-E34 PolarHBondContact O-N 3.13Å
33	G	59	Low	61.3	Low	86 Å²	86	126.5 Å²	126.5	89%	0.887	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.3	-35.8	136.9	0	0	0	0	0	121.5	S31	S31-G33 PolarHBondContact O-N 3.46Å
34	E	67	Low	63.9	Low	189 Å²	189	121 Å²	121	88%	0.883	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.8	2.2	-172.2	-79.7	-171.1	160.8	0	0	116	S32	S32-E34 PolarHBondContact O-N 3.13Å
35	K	61.1	Low	66.1	Low	179 Å²	179	117 Å²	117	78%	0.778	67%	0.666	S	S	*	*			trans	-140.2	125.6	174.6	-65.4	-177.5	-177.5	176.2	0	111
36	V	80.1	Confident	68.1	Low	123 Å²	123	118.7 Å²	118.7	75%	0.745	66%	0.664	S	S	*	*			trans	-103.2	123.9	171.1	178.6	0	0	0	0	108.1	V28	V28-V36 HydrophobicContact CG1-CG1 4.09Å; V28-V36 HydrophobicContact CG2-CG1 4.01Å
37	K	77.4	Confident	70.6	Confident	167 Å²	167	115.6 Å²	115.6	73%	0.726	65%	0.647	S	S	*	*			trans	-93.5	111.9	172.3	-169.7	-178.1	177.5	-167.5	0	108.5
38	F	85.2	Confident	72.8	Confident	162 Å²	162	110.7 Å²	110.7	71%	0.711	62%	0.62	S	S	*	*			trans	-84.7	127.9	170.8	175.1	-108.4	0	0	0	109	D40	F38-D40 HydrophobicContact CD1-CB 4.48Å; F38-D40 HydrophobicContact CE1-CB 3.63Å; F38-D40 HydrophobicContact CZ-CB 3.87Å
39	D	81.7	Confident	74.7	Confident	113 Å²	113	112 Å²	112	60%	0.604	63%	0.625	S	S	*	*			trans	-119.9	105.8	177.7	-167	-0.4	0	0	0	109.2	T41	D39-T41 PolarHBondContact O-N 2.79Å
40	D	83.3	Confident	76.8	Confident	78 Å²	78	104.4 Å²	104.4	42%	0.417	60%	0.598	S	S	.	*			trans	-95.4	82.3	173.9	-173.5	-3.3	0	0	0	109.6	F38 G42 L43	F38-D40 HydrophobicContact CD1-CB 4.48Å; F38-D40 HydrophobicContact CE1-CB 3.63Å; F38-D40 HydrophobicContact CZ-CB 3.87Å; D40-G42 PolarHBondContact O-N 2.63Å; D40-G42 WeakPolarHBondContact OD1-CA 3.47Å; D40-G42 PolarHBondContact OD1-N 3.32Å; D40-L43 HydrophobicContact CB-CB 4.25Å; D40-L43 PolarHBondContact O-N 2.9Å; D40-L43 PolarHBondContact OD1-N 3.4Å; D40-L43 VanDerWaalsContact OD1-N 3.08Å
41	T	81.1	Confident	78.9	Confident	110 Å²	110	100.7 Å²	100.7	68%	0.675	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-23.1	176.2	52.4	0	0	0	0	112.5	D39 S44	D39-T41 PolarHBondContact O-N 2.79Å; T41-S44 PolarHBondContact O-OG 3.16Å
42	G	85.3	Confident	81	Confident	31 Å²	31	98.2 Å²	98.2	32%	0.32	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-23.9	-179.1	0	0	0	0	0	114.6	D40 S44 L45 V46	D40-G42 PolarHBondContact O-N 2.63Å; D40-G42 WeakPolarHBondContact OD1-CA 3.47Å; D40-G42 PolarHBondContact OD1-N 3.32Å; G42-S44 PolarHBondContact O-N 2.81Å; G42-L45 PolarHBondContact O-N 3.3Å; G42-L45 VanDerWaalsContact O-N 3.15Å; G42-V46 PolarHBondContact O-N 3.11Å
43	L	89.4	Confident	82.9	Confident	85 Å²	85	97.2 Å²	97.2	45%	0.445	54%	0.539	S	S	.	.	H	α-helix	trans	-55.6	-36.1	179.1	-179	61.4	0	0	0	112.7	D40 L45 V46 L47	D40-L43 HydrophobicContact CB-CB 4.25Å; D40-L43 PolarHBondContact O-N 2.9Å; D40-L43 PolarHBondContact OD1-N 3.4Å; D40-L43 VanDerWaalsContact OD1-N 3.08Å; L43-L45 VanDerWaalsContact C-N 3.35Å; L43-L45 PolarHBondContact O-N 3Å; L43-V46 PolarHBondContact O-N 3.05Å; L43-L47 HydrophobicContact CD1-CD1 4.33Å; L43-L47 HydrophobicContact CD1-CG 4.14Å; L43-L47 HydrophobicContact CD2-CD1 4.49Å; L43-L47 HydrophobicContact CG-CD1 3.95Å; L43-L47 HydrophobicContact CG-CG 4.24Å; L43-L47 WeakPolarHBondContact O-CB 3.01Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 2.8Å
44	S	86.1	Confident	84.4	Confident	81 Å²	81	95.5 Å²	95.5	57%	0.566	51%	0.509	S	S	*	.	H	α-helix	trans	-57.9	-44	178.7	61.9	0	0	0	0	112.8	T41 G42 Q48	T41-S44 PolarHBondContact O-OG 3.16Å; G42-S44 PolarHBondContact O-N 2.81Å; S44-Q48 WeakPolarHBondContact O-CB 3.32Å; S44-Q48 PolarHBondContact O-N 2.81Å
45	L	86.2	Confident	85.6	Confident	100 Å²	100	87.6 Å²	87.6	52%	0.524	47%	0.471	S	S	.	.	H	α-helix	trans	-72.1	-37.1	179.1	-172.6	67.3	0	0	0	111.8	G42 L43 Q48 N49	G42-L45 PolarHBondContact O-N 3.3Å; G42-L45 VanDerWaalsContact O-N 3.15Å; L43-L45 VanDerWaalsContact C-N 3.35Å; L43-L45 PolarHBondContact O-N 3Å; L45-Q48 PolarHBondContact O-N 2.86Å; L45-N49 VanDerWaalsContact O-CG 3.31Å; L45-N49 PolarHBondContact O-N 3.49Å; L45-N49 PolarHBondContact O-ND2 2.68Å
46	V	89.3	Confident	86.9	Confident	100 Å²	100	84.1 Å²	84.1	61%	0.606	46%	0.461	S	S	*	.	H	α-helix	trans	-64.7	-44.8	175.7	177.1	0	0	0	0	110.7	G42 L43 Q48 N49 G50	G42-V46 PolarHBondContact O-N 3.11Å; L43-V46 PolarHBondContact O-N 3.05Å; V46-Q48 VanDerWaalsContact C-N 3.34Å; V46-N49 PolarHBondContact O-N 2.92Å; V46-G50 PolarHBondContact O-N 2.95Å
47	L	89.1	Confident	87.4	Confident	101 Å²	101	85 Å²	85	53%	0.529	46%	0.457	S	S	.	.	H	α-helix	trans	-61.7	-43.6	175.1	-75	172.7	0	0	0	111.4	L43 G50 L51	L43-L47 HydrophobicContact CD1-CD1 4.33Å; L43-L47 HydrophobicContact CD1-CG 4.14Å; L43-L47 HydrophobicContact CD2-CD1 4.49Å; L43-L47 HydrophobicContact CG-CD1 3.95Å; L43-L47 HydrophobicContact CG-CG 4.24Å; L43-L47 WeakPolarHBondContact O-CB 3.01Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 2.8Å; L47-G50 PolarHBondContact O-N 3.06Å; L47-L51 WeakPolarHBondContact O-CB 3.41Å; L47-L51 WeakPolarHBondContact O-CG 3.19Å; L47-L51 PolarHBondContact O-N 3.26Å
48	Q	89	Confident	87.9	Confident	44 Å²	44	81.6 Å²	81.6	21%	0.206	45%	0.446	C	S	.	.	H	α-helix	trans	-59.6	-50.4	178.1	-177.2	167.7	22.2	0	0	112	S44 L45 V46 G50 L51 E52 Y120 S122	S44-Q48 WeakPolarHBondContact O-CB 3.32Å; S44-Q48 PolarHBondContact O-N 2.81Å; L45-Q48 PolarHBondContact O-N 2.86Å; V46-Q48 VanDerWaalsContact C-N 3.34Å; Q48-G50 VanDerWaalsContact C-N 3.3Å; Q48-G50 PolarHBondContact O-N 2.86Å; Q48-L51 PolarHBondContact O-N 2.87Å; Q48-E52 PolarHBondContact O-N 2.92Å; Q48-Y120 WeakPolarHBondContact CG-O 3.44Å; Q48-Y120 PolarHBondContact NE2-O 3.3Å; Q48-S122 PolarHBondContact NE2-OG 3.21Å; Q48-S122 PolarHBondContact OE1-OG 2.92Å
49	N	88.4	Confident	88	Confident	87 Å²	87	76.1 Å²	76.1	47%	0.465	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-37.4	176.8	-69.7	-24.3	0	0	0	112.1	L45 V46 E52 N53	L45-N49 VanDerWaalsContact O-CG 3.31Å; L45-N49 PolarHBondContact O-N 3.49Å; L45-N49 PolarHBondContact O-ND2 2.68Å; V46-N49 PolarHBondContact O-N 2.92Å; N49-E52 PolarHBondContact O-N 3.32Å; N49-N53 PolarHBondContact O-N 2.85Å; N49-N53 PolarHBondContact O-ND2 3.4Å
50	G	89.6	Confident	88.3	Confident	30 Å²	30	77.3 Å²	77.3	31%	0.309	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175	0	0	0	0	0	112.6	V46 L47 Q48 E52 N53 L54	V46-G50 PolarHBondContact O-N 2.95Å; L47-G50 PolarHBondContact O-N 3.06Å; Q48-G50 VanDerWaalsContact C-N 3.3Å; Q48-G50 PolarHBondContact O-N 2.86Å; G50-E52 VanDerWaalsContact C-N 3.34Å; G50-E52 PolarHBondContact O-N 3.13Å; G50-N53 PolarHBondContact O-N 3.48Å; G50-L54 VanDerWaalsContact O-CG 3.32Å; G50-L54 WeakPolarHBondContact O-CG 3.15Å; G50-L54 PolarHBondContact O-N 2.9Å
51	L	90.9	Very high	88.6	Confident	63 Å²	63	75.6 Å²	75.6	33%	0.33	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-35.6	177.9	-72.7	169.2	0	0	0	112.6	L47 Q48 R55 V78 Y120	L47-L51 WeakPolarHBondContact O-CB 3.41Å; L47-L51 WeakPolarHBondContact O-CG 3.19Å; L47-L51 PolarHBondContact O-N 3.26Å; Q48-L51 PolarHBondContact O-N 2.87Å; L51-R55 PolarHBondContact O-N 3.17Å; L51-R55 VanDerWaalsContact O-N 3.09Å; L51-V78 HydrophobicContact CD1-CG2 4.12Å; L51-V78 HydrophobicContact CD2-CG2 4.3Å; L51-Y120 HydrophobicContact CB-CD1 4.24Å; L51-Y120 HydrophobicContact CB-CE1 4.34Å
52	E	90.7	Very high	89	Confident	23 Å²	23	74 Å²	74	11%	0.107	41%	0.413	C	S	.	.	H	α-helix	trans	-67.3	-45.2	174.7	176.6	57.7	-180	0	0	112	Q48 N49 G50 L54 R55 L56 Y120 T121	Q48-E52 PolarHBondContact O-N 2.92Å; N49-E52 PolarHBondContact O-N 3.32Å; G50-E52 VanDerWaalsContact C-N 3.34Å; G50-E52 PolarHBondContact O-N 3.13Å; E52-L54 VanDerWaalsContact C-N 3.31Å; E52-L54 PolarHBondContact O-N 2.71Å; E52-R55 WeakPolarHBondContact O-CB 3.46Å; E52-R55 PolarHBondContact O-N 3.17Å; E52-R55 VanDerWaalsContact O-N 3.12Å; E52-R55 IonicContact OE1-CZ 3.43Å; E52-R55 IonicContact OE1-NE 2.77Å; E52-R55 IonicContact OE1-NH2 3.25Å; E52-R55 PolarHBondContact OE1-NH2 2.94Å; E52-R55 IonicContact OE2-CZ 2.63Å; E52-R55 IonicContact OE2-NE 2.74Å; E52-R55 PolarHBondContact OE2-NE 2.96Å; E52-R55 IonicContact OE2-NH2 3.61Å; E52-R55 PolarHBondContact OE2-NH2 3.21Å; E52-L56 HydrophobicContact CG-CD1 4.32Å; E52-L56 WeakPolarHBondContact O-CG 3.28Å; E52-L56 PolarHBondContact O-N 3.43Å; E52-Y120 WeakPolarHBondContact OE2-CB 3.36Å; E52-T121 HydrophobicContact CG-CG2 4.19Å
53	N	90.9	Very high	89.3	Confident	90 Å²	90	72.6 Å²	72.6	48%	0.481	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-42.5	175.9	-70.5	-25.3	0	0	0	111.6	N49 G50 R55 L56 E57	N49-N53 PolarHBondContact O-N 2.85Å; N49-N53 PolarHBondContact O-ND2 3.4Å; G50-N53 PolarHBondContact O-N 3.48Å; N53-R55 VanDerWaalsContact C-N 3.29Å; N53-R55 PolarHBondContact O-N 3.39Å; N53-L56 PolarHBondContact O-N 2.98Å; N53-E57 WeakPolarHBondContact O-CB 3.43Å; N53-E57 WeakPolarHBondContact O-CG 3.22Å; N53-E57 PolarHBondContact O-N 3.44Å
54	L	91.6	Very high	89.4	Confident	50 Å²	50	71 Å²	71	26%	0.262	39%	0.39	S	S	.	.	H	α-helix	trans	-60.6	-38.4	175.6	-72	172.2	0	0	0	112.2	G50 E52 E57 N58 S59 L60	G50-L54 VanDerWaalsContact O-CG 3.32Å; G50-L54 WeakPolarHBondContact O-CG 3.15Å; G50-L54 PolarHBondContact O-N 2.9Å; E52-L54 VanDerWaalsContact C-N 3.31Å; E52-L54 PolarHBondContact O-N 2.71Å; L54-E57 PolarHBondContact O-N 3.48Å; L54-N58 PolarHBondContact O-N 3.3Å; L54-S59 PolarHBondContact O-N 2.98Å; L54-L60 HydrophobicContact CD1-CD1 4.5Å
55	R	90.4	Very high	89.6	Confident	22 Å²	22	67.1 Å²	67.1	8%	0.083	36%	0.363	C	S	.	.	H	α-helix	trans	-63.2	-48.3	174.8	-174.3	-172.7	72.1	105.3	-10.7	111.3	L51 E52 N53 E57 N58 D117 Y120	L51-R55 PolarHBondContact O-N 3.17Å; L51-R55 VanDerWaalsContact O-N 3.09Å; E52-R55 WeakPolarHBondContact O-CB 3.46Å; E52-R55 PolarHBondContact O-N 3.17Å; E52-R55 VanDerWaalsContact O-N 3.12Å; E52-R55 IonicContact OE1-CZ 3.43Å; E52-R55 IonicContact OE1-NE 2.77Å; E52-R55 IonicContact OE1-NH2 3.25Å; E52-R55 PolarHBondContact OE1-NH2 2.94Å; E52-R55 IonicContact OE2-CZ 2.63Å; E52-R55 IonicContact OE2-NE 2.74Å; E52-R55 PolarHBondContact OE2-NE 2.96Å; E52-R55 IonicContact OE2-NH2 3.61Å; E52-R55 PolarHBondContact OE2-NH2 3.21Å; N53-R55 VanDerWaalsContact C-N 3.29Å; N53-R55 PolarHBondContact O-N 3.39Å; R55-E57 VanDerWaalsContact C-N 3.3Å; R55-E57 PolarHBondContact O-N 3.37Å; R55-N58 PolarHBondContact O-N 3.47Å; R55-D117 IonicContact CZ-OD1 3.86Å; R55-D117 IonicContact NH2-OD1 2.74Å; R55-D117 PolarHBondContact NH2-OD1 2.95Å; R55-Y120 HydrophobicContact CB-CD1 4.34Å; R55-Y120 HydrophobicContact CB-CE1 4.08Å; R55-Y120 VanDerWaalsContact CD-CE2 3.43Å; R55-Y120 HydrophobicContact CG-CE1 4.48Å; R55-Y120 HydrophobicContact CG-CE2 4.45Å
56	L	88.7	Confident	89.8	Confident	107 Å²	107	63 Å²	63	56%	0.56	34%	0.342	S	S	*	.	H	α-helix	trans	-64.3	-34.2	-179.8	-67.2	173.4	0	0	0	112.5	E52 N53 N58	E52-L56 HydrophobicContact CG-CD1 4.32Å; E52-L56 WeakPolarHBondContact O-CG 3.28Å; E52-L56 PolarHBondContact O-N 3.43Å; N53-L56 PolarHBondContact O-N 2.98Å; L56-N58 PolarHBondContact O-N 3Å
57	E	90.4	Very high	89.7	Confident	142 Å²	142	58.2 Å²	58.2	66%	0.664	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.6	174.7	-69.3	177.5	-178.4	0	0	113.4	N53 L54 R55 S59	N53-E57 WeakPolarHBondContact O-CB 3.43Å; N53-E57 WeakPolarHBondContact O-CG 3.22Å; N53-E57 PolarHBondContact O-N 3.44Å; L54-E57 PolarHBondContact O-N 3.48Å; R55-E57 VanDerWaalsContact C-N 3.3Å; R55-E57 PolarHBondContact O-N 3.37Å; E57-S59 PolarHBondContact O-N 3.06Å
58	N	87.8	Confident	89.5	Confident	95 Å²	95	60.5 Å²	60.5	51%	0.508	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	27.5	-169.9	-60.4	-76.3	0	0	0	113.6	L54 R55 L56 T61 S73	L54-N58 PolarHBondContact O-N 3.3Å; R55-N58 PolarHBondContact O-N 3.47Å; L56-N58 PolarHBondContact O-N 3Å; N58-T61 PolarHBondContact O-OG1 3.18Å; N58-S73 WeakPolarHBondContact OD1-CB 3.13Å; N58-S73 PolarHBondContact OD1-OG 3.48Å
59	S	88.7	Confident	89.2	Confident	47 Å²	47	64 Å²	64	33%	0.329	35%	0.35	S	S	.	.			trans	-91.1	133.6	-178.5	-171.4	0	0	0	0	110.2	L54 E57 T61 H75	L54-S59 PolarHBondContact O-N 2.98Å; E57-S59 PolarHBondContact O-N 3.06Å; S59-T61 PolarHBondContact O-N 3.04Å; S59-T61 VanDerWaalsContact O-N 3.17Å; S59-H75 PolarHBondContact O-NE2 3.1Å
60	L	87.8	Confident	89.3	Confident	137 Å²	137	66.8 Å²	66.8	72%	0.717	35%	0.354	S	S	*	.	S	Bend	trans	59.8	19.4	-179.9	-55.7	174.2	0	0	0	115.5	L54 H75	L54-L60 HydrophobicContact CD1-CD1 4.5Å; L60-H75 PolarHBondContact O-CD2 2.95Å
61	T	89.3	Confident	89.4	Confident	42 Å²	42	71 Å²	71	26%	0.258	37%	0.366	S	S	.	.			trans	-74.7	137.8	173.5	58.3	0	0	0	0	111.1	N58 S59 C74	N58-T61 PolarHBondContact O-OG1 3.18Å; S59-T61 PolarHBondContact O-N 3.04Å; S59-T61 VanDerWaalsContact O-N 3.17Å; T61-C74 WeakPolarHBondContact CB-O 3.46Å
62	D	90.3	Very high	89.5	Confident	76 Å²	76	69.1 Å²	69.1	41%	0.406	36%	0.355	S	S	.	.			trans	-126.9	6.3	-171.1	64.2	-9.9	0	0	0	113.2	C74 H75 R76	D62-C74 PolarHBondContact N-O 3.45Å; D62-C74 VanDerWaalsContact N-O 3.13Å; D62-H75 VanDerWaalsContact OD1-CA 3.23Å; D62-H75 WeakPolarHBondContact OD1-CA 3.36Å; D62-R76 PolarHBondContact O-NE 3.23Å; D62-R76 VanDerWaalsContact O-NE 3.11Å; D62-R76 WeakPolarHBondContact OD1-CG 3.23Å; D62-R76 PolarHBondContact OD1-N 3.47Å; D62-R76 WeakPolarHBondContact OD2-CB 3.44Å
63	V	90.3	Very high	89.6	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.012	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	143.4	173.2	64.1	0	0	0	0	111.5	L65 C74 R76 L79 F90 I102	V63-L65 HydrophobicContact CG2-CD2 4.25Å; V63-C74 HydrophobicContact CG1-CB 3.96Å; V63-C74 PolarHBondContact N-O 3.44Å; V63-C74 PolarHBondContact O-N 3.41Å; V63-R76 HydrophobicContact CB-CG 3.74Å; V63-R76 HydrophobicContact CG1-CG 3.69Å; V63-L79 HydrophobicContact CG1-CD1 4.19Å; V63-F90 HydrophobicContact CG2-CZ 4.44Å; V63-I102 HydrophobicContact CG2-CD1 3.68Å; V63-I102 HydrophobicContact CG2-CG1 4.17Å
64	I	91.4	Very high	89.6	Confident	52 Å²	52	65.1 Å²	65.1	27%	0.267	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	116.9	172.9	-58.2	173.3	0	0	0	108.5	E71 F72 E100 K101 I102	I64-E71 HydrophobicContact CG2-CB 3.94Å; I64-F72 WeakPolarHBondContact CA-O 3.44Å; I64-E100 PolarHBondContact N-O 3.05Å; I64-K101 WeakPolarHBondContact O-CA 3.46Å; I64-I102 PolarHBondContact O-N 3.39Å
65	L	90.4	Very high	89.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124	173.3	-58.9	-179.2	0	0	0	109.6	V63 F72 L79 F86 I102 L104 L116	V63-L65 HydrophobicContact CG2-CD2 4.25Å; L65-F72 HydrophobicContact CB-CB 4.38Å; L65-F72 PolarHBondContact N-O 2.95Å; L65-F72 PolarHBondContact O-N 3.5Å; L65-L79 HydrophobicContact CD1-CD1 3.94Å; L65-F86 HydrophobicContact CD1-CE1 4.46Å; L65-F86 HydrophobicContact CD1-CZ 4.47Å; L65-I102 HydrophobicContact CD2-CB 4.14Å; L65-L104 HydrophobicContact CB-CD1 4.34Å; L65-L104 HydrophobicContact CD1-CD1 4.08Å; L65-L104 HydrophobicContact CD2-CD1 4.02Å; L65-L104 HydrophobicContact CG-CD1 4.38Å; L65-L116 HydrophobicContact CD1-CD2 4.39Å
66	C	89.8	Confident	89.7	Confident	12 Å²	12	63.9 Å²	63.9	8%	0.081	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	115.3	176.2	-64.5	0	0	0	0	109.9	K101 I102 I103 L104	C66-K101 WeakPolarHBondContact SG-CE 3.46Å; C66-K101 WeakPolarHBondContact SG-CG 3.23Å; C66-I102 PolarHBondContact N-O 3.03Å; C66-I103 HydrophobicContact CB-CG1 4.27Å; C66-L104 PolarHBondContact O-N 3.06Å
67	V	88.8	Confident	89.7	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	119.5	176.5	-174.4	0	0	0	0	107.6	S69 R70 F72 L104 V107 M112	V67-S69 PolarHBondContact O-N 2.86Å; V67-R70 PolarHBondContact N-O 3.24Å; V67-R70 PolarHBondContact O-N 2.99Å; V67-F72 HydrophobicContact CB-CE2 4.26Å; V67-F72 HydrophobicContact CG2-CE2 4.43Å; V67-L104 HydrophobicContact CG2-CB 4.18Å; V67-L104 HydrophobicContact CG2-CD1 4.49Å; V67-V107 WeakPolarHBondContact CG1-O 3.42Å; V67-M112 HydrophobicContact CG1-CB 4.48Å; V67-M112 HydrophobicContact CG2-CB 4.05Å; V67-M112 HydrophobicContact CG2-CE 3.77Å; V67-M112 HydrophobicContact CG2-CG 3.77Å
68	E	85.3	Confident	89.8	Confident	149 Å²	149	57.9 Å²	57.9	70%	0.696	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	-109.5	-173.2	-58.4	178	143.1	0	0	111.9	A109	E68-A109 PolarHBondContact OE2-N 3.23Å
69	S	82.7	Confident	90	Very high	116 Å²	116	53.4 Å²	53.4	81%	0.811	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	10.6	178.8	70.5	0	0	0	0	113.7	V67	V67-S69 PolarHBondContact O-N 2.86Å
70	R	90.1	Very high	90	Very high	147 Å²	147	51.9 Å²	51.9	56%	0.555	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.8	179.5	-62.8	-162.9	-173.2	169.3	-0.4	111.3	V67 F72 A109	V67-R70 PolarHBondContact N-O 3.24Å; V67-R70 PolarHBondContact O-N 2.99Å; R70-F72 HydrophobicContact CB-CE2 3.86Å; R70-F72 HydrophobicContact CB-CZ 4.09Å; R70-A109 HydrophobicContact CB-CB 4.04Å; R70-A109 HydrophobicContact CG-CB 3.93Å
71	E	91.8	Very high	90.2	Very high	118 Å²	118	49.7 Å²	49.7	55%	0.551	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.8	178.7	-58.5	-171	170.8	0	0	109.6	I64 K101	I64-E71 HydrophobicContact CG2-CB 3.94Å; E71-K101 WeakPolarHBondContact OE1-CE 3.5Å; E71-K101 IonicContact OE1-NZ 2.79Å; E71-K101 PolarHBondContact OE1-NZ 3.49Å
72	F	92.1	Very high	90.1	Very high	23 Å²	23	49.6 Å²	49.6	10%	0.101	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	110.6	-179.3	-60.2	-88.2	0	0	0	110	I64 L65 V67 R70 A109 M112 N113 L116	I64-F72 WeakPolarHBondContact CA-O 3.44Å; L65-F72 HydrophobicContact CB-CB 4.38Å; L65-F72 PolarHBondContact N-O 2.95Å; L65-F72 PolarHBondContact O-N 3.5Å; V67-F72 HydrophobicContact CB-CE2 4.26Å; V67-F72 HydrophobicContact CG2-CE2 4.43Å; R70-F72 HydrophobicContact CB-CE2 3.86Å; R70-F72 HydrophobicContact CB-CZ 4.09Å; F72-A109 HydrophobicContact CE2-CB 4.42Å; F72-A109 HydrophobicContact CZ-CB 4.34Å; F72-A109 WeakPolarHBondContact CZ-O 3.14Å; F72-M112 HydrophobicContact CD2-CG 4.28Å; F72-M112 HydrophobicContact CE2-CB 4.37Å; F72-M112 HydrophobicContact CE2-CG 4.23Å; F72-N113 HydrophobicContact CE1-CB 4.05Å; F72-N113 HydrophobicContact CZ-CB 4.42Å; F72-L116 HydrophobicContact CB-CD1 3.65Å; F72-L116 HydrophobicContact CD1-CD1 3.72Å; F72-L116 HydrophobicContact CG-CD1 3.75Å
73	S	91.9	Very high	90.2	Very high	30 Å²	30	46.1 Å²	46.1	21%	0.21	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.8	173.5	-46.8	0	0	0	0	110	N58	N58-S73 WeakPolarHBondContact OD1-CB 3.13Å; N58-S73 PolarHBondContact OD1-OG 3.48Å
74	C	92.9	Very high	90.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	173.2	-172.7	-69.4	0	0	0	0	111.6	T61 D62 V63 L79 L116	T61-C74 WeakPolarHBondContact CB-O 3.46Å; D62-C74 PolarHBondContact N-O 3.45Å; D62-C74 VanDerWaalsContact N-O 3.13Å; V63-C74 HydrophobicContact CG1-CB 3.96Å; V63-C74 PolarHBondContact N-O 3.44Å; V63-C74 PolarHBondContact O-N 3.41Å; C74-L79 HydrophobicContact CB-CD1 3.77Å; C74-L79 HydrophobicContact CB-CG 4.38Å; C74-L116 VanDerWaalsContact SG-CD2 3.59Å
75	H	92.9	Very high	90.1	Very high	11 Å²	11	52 Å²	52	5%	0.051	29%	0.286	C	S	.	.			trans	-108.8	119.3	175.4	-54	86.5	0	0	0	109.7	S59 L60 D62 V77 V78 L79 Y120	S59-H75 PolarHBondContact O-NE2 3.1Å; L60-H75 PolarHBondContact O-CD2 2.95Å; D62-H75 VanDerWaalsContact OD1-CA 3.23Å; D62-H75 WeakPolarHBondContact OD1-CA 3.36Å; H75-V77 HydrophobicContact CB-CG1 4.37Å; H75-V77 PolarHBondContact O-N 2.91Å; H75-V78 HydrophobicContact CB-CB 4.17Å; H75-V78 HydrophobicContact CB-CG2 3.81Å; H75-V78 PolarHBondContact O-N 3.39Å; H75-V78 VanDerWaalsContact O-N 3.09Å; H75-L79 PolarHBondContact O-N 3.12Å; H75-L79 VanDerWaalsContact O-N 3.1Å; H75-Y120 WeakPolarHBondContact CB-OH 3.12Å; H75-Y120 PolarHBondContact N-OH 2.8Å; H75-Y120 AromaticContact ND1-CE1 3.64Å; H75-Y120 AromaticContact ND1-CZ 3.68Å; H75-Y120 PolarHBondContact ND1-OH 2.8Å
76	R	89.6	Confident	90	Very high	35 Å²	35	52.1 Å²	52.1	13%	0.132	29%	0.286	C	S	.	.	H	α-helix	trans	-54.4	-41	179.7	-70.2	174.4	179.2	-97.5	0.5	111.7	D62 V63 V78 L79 A80 F90 E96 K97 E99	D62-R76 PolarHBondContact O-NE 3.23Å; D62-R76 VanDerWaalsContact O-NE 3.11Å; D62-R76 WeakPolarHBondContact OD1-CG 3.23Å; D62-R76 PolarHBondContact OD1-N 3.47Å; D62-R76 WeakPolarHBondContact OD2-CB 3.44Å; V63-R76 HydrophobicContact CB-CG 3.74Å; V63-R76 HydrophobicContact CG1-CG 3.69Å; R76-V78 VanDerWaalsContact C-N 3.34Å; R76-V78 PolarHBondContact O-N 3.09Å; R76-L79 PolarHBondContact O-N 3.09Å; R76-A80 WeakPolarHBondContact O-CB 3.4Å; R76-A80 PolarHBondContact O-N 3.35Å; R76-F90 HydrophobicContact CB-CD2 3.92Å; R76-F90 HydrophobicContact CB-CE2 4.12Å; R76-F90 HydrophobicContact CB-CG 4.35Å; R76-F90 HydrophobicContact CG-CD1 4.45Å; R76-F90 HydrophobicContact CG-CD2 4.2Å; R76-F90 HydrophobicContact CG-CE1 4.38Å; R76-F90 HydrophobicContact CG-CE2 4.14Å; R76-F90 HydrophobicContact CG-CG 4.37Å; R76-F90 HydrophobicContact CG-CZ 4.23Å; R76-F90 VanDerWaalsContact NH1-CD1 3.26Å; R76-E96 PolarHBondContact NH1-O 2.74Å; R76-K97 PolarHBondContact NH1-O 3.24Å; R76-E99 PolarHBondContact NH2-O 3.37Å
77	V	90.3	Very high	90	Very high	104 Å²	104	58.4 Å²	58.4	63%	0.63	31%	0.309	S	S	*	.	H	α-helix	trans	-63.1	-39.8	-179.7	68.5	0	0	0	0	112.1	H75 A81	H75-V77 HydrophobicContact CB-CG1 4.37Å; H75-V77 PolarHBondContact O-N 2.91Å; V77-A81 VanDerWaalsContact O-CB 3.26Å; V77-A81 WeakPolarHBondContact O-CB 3.02Å; V77-A81 PolarHBondContact O-N 3.36Å
78	V	91.8	Very high	89.9	Confident	18 Å²	18	60.3 Å²	60.3	11%	0.109	32%	0.324	C	S	.	.	H	α-helix	trans	-70.9	-46.1	179.7	179.5	0	0	0	0	109.9	L51 H75 R76 A80 A81 A82 Y120	L51-V78 HydrophobicContact CD1-CG2 4.12Å; L51-V78 HydrophobicContact CD2-CG2 4.3Å; H75-V78 HydrophobicContact CB-CB 4.17Å; H75-V78 HydrophobicContact CB-CG2 3.81Å; H75-V78 PolarHBondContact O-N 3.39Å; H75-V78 VanDerWaalsContact O-N 3.09Å; R76-V78 VanDerWaalsContact C-N 3.34Å; R76-V78 PolarHBondContact O-N 3.09Å; V78-A80 PolarHBondContact O-N 3.06Å; V78-A81 PolarHBondContact O-N 2.95Å; V78-A82 WeakPolarHBondContact O-CB 3.47Å; V78-A82 PolarHBondContact O-N 3.5Å; V78-Y120 HydrophobicContact CB-CE1 4.17Å; V78-Y120 HydrophobicContact CG1-CD1 4.25Å; V78-Y120 HydrophobicContact CG1-CD2 4.48Å; V78-Y120 HydrophobicContact CG1-CE1 3.83Å; V78-Y120 HydrophobicContact CG1-CE2 4.08Å; V78-Y120 HydrophobicContact CG2-CE1 4.05Å
79	L	91.1	Very high	89.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-44.3	177.4	-68.8	176.4	0	0	0	112.3	V63 L65 C74 H75 R76 A81 A82 S83 F86 F90 L116	V63-L79 HydrophobicContact CG1-CD1 4.19Å; L65-L79 HydrophobicContact CD1-CD1 3.94Å; C74-L79 HydrophobicContact CB-CD1 3.77Å; C74-L79 HydrophobicContact CB-CG 4.38Å; H75-L79 PolarHBondContact O-N 3.12Å; H75-L79 VanDerWaalsContact O-N 3.1Å; R76-L79 PolarHBondContact O-N 3.09Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.21Å; L79-A82 PolarHBondContact O-N 2.97Å; L79-S83 PolarHBondContact O-N 2.54Å; L79-F86 HydrophobicContact CB-CB 3.96Å; L79-F86 HydrophobicContact CB-CD2 4.14Å; L79-F86 HydrophobicContact CB-CG 4Å; L79-F86 HydrophobicContact CD2-CD2 4.34Å; L79-F86 HydrophobicContact CD2-CE2 4.35Å; L79-F90 HydrophobicContact CB-CE2 3.96Å; L79-F90 HydrophobicContact CD1-CE2 4.21Å; L79-F90 HydrophobicContact CD1-CZ 4.42Å; L79-L116 HydrophobicContact CD2-CD2 3.71Å
80	A	90.5	Very high	90	Very high	16 Å²	16	49.1 Å²	49.1	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-31.3	176.5	0	0	0	0	0	113.1	R76 V78 R87 F90	R76-A80 WeakPolarHBondContact O-CB 3.4Å; R76-A80 PolarHBondContact O-N 3.35Å; V78-A80 PolarHBondContact O-N 3.06Å; A80-R87 HydrophobicContact CB-CB 4.3Å; A80-R87 WeakPolarHBondContact O-CB 3.36Å; A80-F90 HydrophobicContact CB-CD2 4.23Å
81	A	90.1	Very high	89.5	Confident	90 Å²	90	46 Å²	46	74%	0.744	26%	0.259	S	S	*	.	H	α-helix	trans	-73.1	-36.7	174.2	0	0	0	0	0	111.8	V77 V78 L79	V77-A81 VanDerWaalsContact O-CB 3.26Å; V77-A81 WeakPolarHBondContact O-CB 3.02Å; V77-A81 PolarHBondContact O-N 3.36Å; V78-A81 PolarHBondContact O-N 2.95Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.21Å
82	A	89.1	Confident	88.9	Confident	41 Å²	41	44.7 Å²	44.7	34%	0.339	26%	0.255	S	S	.	.	H	α-helix	trans	-81.9	-28.2	-174.9	0	0	0	0	0	113.9	V78 L79 T119 F143	V78-A82 WeakPolarHBondContact O-CB 3.47Å; V78-A82 PolarHBondContact O-N 3.5Å; L79-A82 PolarHBondContact O-N 2.97Å; A82-T119 HydrophobicContact CB-CG2 3.79Å; A82-F143 HydrophobicContact CB-CE1 3.93Å
83	S	91.9	Very high	87.7	Confident	3 Å²	3	50 Å²	50	2%	0.021	29%	0.285	C	S	.	.			trans	-141	138.2	-177.6	150	0	0	0	0	113.5	L79 Y85 F86 R87 F141 F143	L79-S83 PolarHBondContact O-N 2.54Å; S83-Y85 VanDerWaalsContact C-N 3.25Å; S83-Y85 PolarHBondContact O-N 3.16Å; S83-Y85 WeakPolarHBondContact OG-CB 3.41Å; S83-Y85 PolarHBondContact OG-N 3.4Å; S83-F86 PolarHBondContact O-N 3.14Å; S83-F86 PolarHBondContact OG-N 3.43Å; S83-R87 WeakPolarHBondContact O-CB 3.46Å; S83-R87 PolarHBondContact O-N 2.89Å; S83-F141 WeakPolarHBondContact CB-O 3.44Å; S83-F141 PolarHBondContact OG-O 2.98Å; S83-F143 VanDerWaalsContact CB-CE1 3.49Å
84	N	88.4	Confident	86.8	Confident	94 Å²	94	52.4 Å²	52.4	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-66.1	-27.1	175.7	-70.7	-35.8	0	0	0	113	A88 Q142	N84-A88 WeakPolarHBondContact O-CB 3.42Å; N84-A88 PolarHBondContact O-N 2.88Å; N84-Q142 HydrophobicContact CB-CB 4.41Å
85	Y	90.4	Very high	85.7	Confident	83 Å²	83	61.4 Å²	61.4	33%	0.325	33%	0.329	S	S	.	.	H	α-helix	trans	-65.8	-52.5	176.3	173.6	-93.9	0	0	0	110.8	S83 R87 A88 M89 L104 F141	S83-Y85 VanDerWaalsContact C-N 3.25Å; S83-Y85 PolarHBondContact O-N 3.16Å; S83-Y85 WeakPolarHBondContact OG-CB 3.41Å; S83-Y85 PolarHBondContact OG-N 3.4Å; Y85-R87 VanDerWaalsContact C-N 3.29Å; Y85-R87 PolarHBondContact O-N 3.47Å; Y85-A88 PolarHBondContact O-N 3.16Å; Y85-M89 HydrophobicContact CD1-CE 4.38Å; Y85-M89 HydrophobicContact CE1-CE 3.38Å; Y85-M89 PolarHBondContact O-N 3.33Å; Y85-M89 VanDerWaalsContact OH-CE 3.28Å; Y85-M89 WeakPolarHBondContact OH-CE 3.21Å; Y85-L104 HydrophobicContact CE1-CD2 4.5Å; Y85-F141 WeakPolarHBondContact CB-O 3.49Å; Y85-F141 AromaticContact CD1-CD1 3.59Å; Y85-F141 HydrophobicContact CD1-CD1 3.59Å; Y85-F141 HydrophobicContact CD1-CE1 4.29Å; Y85-F141 AromaticContact CE1-CD1 3.59Å; Y85-F141 HydrophobicContact CE1-CD1 3.59Å; Y85-F141 AromaticContact CE1-CE1 3.82Å; Y85-F141 HydrophobicContact CE1-CE1 3.82Å; Y85-F141 HydrophobicContact CG-CD1 4.14Å
86	F	89.6	Confident	84.7	Confident	3 Å²	3	64 Å²	64	1%	0.013	34%	0.341	C	S	.	.	H	α-helix	trans	-67.6	-33	177.6	-67.7	-62.6	0	0	0	112	L65 L79 S83 M89 F90 L104 F141 F143	L65-F86 HydrophobicContact CD1-CE1 4.46Å; L65-F86 HydrophobicContact CD1-CZ 4.47Å; L79-F86 HydrophobicContact CB-CB 3.96Å; L79-F86 HydrophobicContact CB-CD2 4.14Å; L79-F86 HydrophobicContact CB-CG 4Å; L79-F86 HydrophobicContact CD2-CD2 4.34Å; L79-F86 HydrophobicContact CD2-CE2 4.35Å; S83-F86 PolarHBondContact O-N 3.14Å; S83-F86 PolarHBondContact OG-N 3.43Å; F86-M89 HydrophobicContact CD1-SD 4.29Å; F86-M89 PolarHBondContact O-N 2.57Å; F86-F90 HydrophobicContact CB-CD2 4.22Å; F86-F90 HydrophobicContact CB-CE2 3.88Å; F86-F90 HydrophobicContact CD1-CE2 4.16Å; F86-F90 HydrophobicContact CD1-CZ 4.12Å; F86-F90 HydrophobicContact CG-CE2 4.37Å; F86-F90 WeakPolarHBondContact O-CB 3.4Å; F86-F90 WeakPolarHBondContact O-CD2 3.39Å; F86-F90 WeakPolarHBondContact O-CG 3.26Å; F86-F90 PolarHBondContact O-N 2.94Å; F86-L104 HydrophobicContact CE1-CD1 4.25Å; F86-L104 HydrophobicContact CZ-CD1 4.32Å; F86-F141 HydrophobicContact CE2-CB 4.49Å; F86-F141 HydrophobicContact CZ-CD1 4.29Å; F86-F143 HydrophobicContact CD2-CZ 4.32Å; F86-F143 HydrophobicContact CE2-CE2 4.09Å; F86-F143 HydrophobicContact CE2-CZ 4.07Å
87	R	87.9	Confident	83.9	Confident	144 Å²	144	65.5 Å²	65.5	54%	0.543	35%	0.348	S	S	.	.	H	α-helix	trans	-58.8	-47.7	171.2	-167.8	175.4	173.1	-177.2	-1.1	111.6	A80 S83 Y85 M89 C91	A80-R87 HydrophobicContact CB-CB 4.3Å; A80-R87 WeakPolarHBondContact O-CB 3.36Å; S83-R87 WeakPolarHBondContact O-CB 3.46Å; S83-R87 PolarHBondContact O-N 2.89Å; Y85-R87 VanDerWaalsContact C-N 3.29Å; Y85-R87 PolarHBondContact O-N 3.47Å; R87-M89 VanDerWaalsContact C-N 3.34Å; R87-C91 WeakPolarHBondContact O-CB 3.48Å; R87-C91 PolarHBondContact O-N 3.25Å; R87-C91 PolarHBondContact O-SG 3.28Å; R87-C91 VanDerWaalsContact O-SG 3.4Å
88	A	86.6	Confident	83.1	Confident	40 Å²	40	68.9 Å²	68.9	33%	0.331	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-41.1	176.2	0	0	0	0	0	111.5	N84 Y85 F90 N92	N84-A88 WeakPolarHBondContact O-CB 3.42Å; N84-A88 PolarHBondContact O-N 2.88Å; Y85-A88 PolarHBondContact O-N 3.16Å; A88-F90 PolarHBondContact O-N 3.44Å; A88-N92 WeakPolarHBondContact O-CB 3.32Å; A88-N92 PolarHBondContact O-N 3Å; A88-N92 PolarHBondContact O-ND2 3.29Å
89	M	85.7	Confident	82.6	Confident	13 Å²	13	71.2 Å²	71.2	6%	0.064	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-43	178.5	-175.1	-179.7	-76.1	0	0	113.1	Y85 F86 R87 E96 I102 L104	Y85-M89 HydrophobicContact CD1-CE 4.38Å; Y85-M89 HydrophobicContact CE1-CE 3.38Å; Y85-M89 PolarHBondContact O-N 3.33Å; Y85-M89 VanDerWaalsContact OH-CE 3.28Å; Y85-M89 WeakPolarHBondContact OH-CE 3.21Å; F86-M89 HydrophobicContact CD1-SD 4.29Å; F86-M89 PolarHBondContact O-N 2.57Å; R87-M89 VanDerWaalsContact C-N 3.34Å; M89-E96 HydrophobicContact CG-CB 3.77Å; M89-E96 HydrophobicContact CG-CG 4.36Å; M89-E96 HydrophobicContact SD-CB 4.24Å; M89-I102 HydrophobicContact SD-CD1 3.99Å; M89-I102 HydrophobicContact SD-CG2 4.21Å; M89-L104 HydrophobicContact CE-CD2 4.24Å
90	F	85.6	Confident	82.1	Confident	18 Å²	18	78.7 Å²	78.7	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-94.1	-29.1	-173.6	-57.7	-35.7	0	0	0	114.2	V63 R76 L79 A80 F86 A88 I102	V63-F90 HydrophobicContact CG2-CZ 4.44Å; R76-F90 HydrophobicContact CB-CD2 3.92Å; R76-F90 HydrophobicContact CB-CE2 4.12Å; R76-F90 HydrophobicContact CB-CG 4.35Å; R76-F90 HydrophobicContact CG-CD1 4.45Å; R76-F90 HydrophobicContact CG-CD2 4.2Å; R76-F90 HydrophobicContact CG-CE1 4.38Å; R76-F90 HydrophobicContact CG-CE2 4.14Å; R76-F90 HydrophobicContact CG-CG 4.37Å; R76-F90 HydrophobicContact CG-CZ 4.23Å; R76-F90 VanDerWaalsContact NH1-CD1 3.26Å; L79-F90 HydrophobicContact CB-CE2 3.96Å; L79-F90 HydrophobicContact CD1-CE2 4.21Å; L79-F90 HydrophobicContact CD1-CZ 4.42Å; A80-F90 HydrophobicContact CB-CD2 4.23Å; F86-F90 HydrophobicContact CB-CD2 4.22Å; F86-F90 HydrophobicContact CB-CE2 3.88Å; F86-F90 HydrophobicContact CD1-CE2 4.16Å; F86-F90 HydrophobicContact CD1-CZ 4.12Å; F86-F90 HydrophobicContact CG-CE2 4.37Å; F86-F90 WeakPolarHBondContact O-CB 3.4Å; F86-F90 WeakPolarHBondContact O-CD2 3.39Å; F86-F90 WeakPolarHBondContact O-CG 3.26Å; F86-F90 PolarHBondContact O-N 2.94Å; A88-F90 PolarHBondContact O-N 3.44Å; F90-I102 HydrophobicContact CE1-CD1 3.54Å; F90-I102 HydrophobicContact CZ-CD1 4.19Å
91	C	80.3	Confident	81.9	Confident	81 Å²	81	83 Å²	83	55%	0.547	41%	0.411	S	S	.	.	H	α-helix	trans	-90	-25.3	-178	-60.8	0	0	0	0	113.4	R87	R87-C91 WeakPolarHBondContact O-CB 3.48Å; R87-C91 PolarHBondContact O-N 3.25Å; R87-C91 PolarHBondContact O-SG 3.28Å; R87-C91 VanDerWaalsContact O-SG 3.4Å
92	N	78.3	Confident	81.8	Confident	90 Å²	90	79 Å²	79	48%	0.481	38%	0.377	S	S	.	.	S	Bend	trans	-84.2	160.9	174.7	-62.2	-22	0	0	0	110.9	A88 L94 K97	A88-N92 WeakPolarHBondContact O-CB 3.32Å; A88-N92 PolarHBondContact O-N 3Å; A88-N92 PolarHBondContact O-ND2 3.29Å; N92-L94 HydrophobicContact CB-CD1 4.36Å; N92-L94 HydrophobicContact CB-CG 4.29Å; N92-L94 PolarHBondContact O-N 3.04Å; N92-K97 WeakPolarHBondContact O-CD 3.33Å
93	D	67.7	Low	81.7	Confident	135 Å²	135	83 Å²	83	72%	0.722	39%	0.392	S	S	*	.	S	Bend	trans	-76.5	56.2	177.9	-68.3	-34.6	0	0	0	112.2	K97	D93-K97 IonicContact OD1-NZ 2.8Å; D93-K97 PolarHBondContact OD1-NZ 2.67Å
94	L	72.8	Confident	81.4	Confident	81 Å²	81	83.4 Å²	83.4	42%	0.424	39%	0.394	S	S	.	.			trans	-90	157	171.6	-68.9	170.3	0	0	0	110	N92 E96 K97	N92-L94 HydrophobicContact CB-CD1 4.36Å; N92-L94 HydrophobicContact CB-CG 4.29Å; N92-L94 PolarHBondContact O-N 3.04Å; L94-E96 WeakPolarHBondContact CB-OE2 3.49Å; L94-E96 PolarHBondContact O-N 3.25Å; L94-K97 WeakPolarHBondContact O-CB 2.9Å; L94-K97 PolarHBondContact O-N 2.77Å; L94-K97 VanDerWaalsContact O-N 3.16Å
95	R	68.9	Low	81.1	Confident	188 Å²	188	87.5 Å²	87.5	71%	0.709	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-63.9	-34.3	-175.1	-176.6	177.4	170.1	158.6	3	111.7	K97 Y98 E99	R95-K97 PolarHBondContact O-N 2.96Å; R95-K97 VanDerWaalsContact O-N 3.13Å; R95-Y98 PolarHBondContact O-N 3Å; R95-E99 HydrophobicContact CG-CG 4.5Å; R95-E99 IonicContact CZ-OE1 3.58Å; R95-E99 IonicContact NE-OE1 2.78Å; R95-E99 PolarHBondContact NE-OE1 3.26Å; R95-E99 IonicContact NH2-OE1 3.59Å
96	E	73.3	Confident	80.7	Confident	66 Å²	66	87.2 Å²	87.2	31%	0.308	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-62.1	-16.2	178.2	-63.2	84.6	168.8	0	0	113.2	R76 M89 L94 Y98 I102	R76-E96 PolarHBondContact NH1-O 2.74Å; M89-E96 HydrophobicContact CG-CB 3.77Å; M89-E96 HydrophobicContact CG-CG 4.36Å; M89-E96 HydrophobicContact SD-CB 4.24Å; L94-E96 WeakPolarHBondContact CB-OE2 3.49Å; L94-E96 PolarHBondContact O-N 3.25Å; E96-Y98 VanDerWaalsContact C-N 3.28Å; E96-Y98 PolarHBondContact O-N 2.92Å; E96-I102 HydrophobicContact CB-CD1 4.15Å; E96-I102 HydrophobicContact CB-CG1 4.5Å; E96-I102 HydrophobicContact CG-CG2 4.47Å
97	K	72.8	Confident	80.6	Confident	66 Å²	66	87.8 Å²	87.8	29%	0.287	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-64.1	-33	171.6	-177.3	172.7	172	178.3	0	112.5	R76 N92 D93 L94 R95	R76-K97 PolarHBondContact NH1-O 3.24Å; N92-K97 WeakPolarHBondContact O-CD 3.33Å; D93-K97 IonicContact OD1-NZ 2.8Å; D93-K97 PolarHBondContact OD1-NZ 2.67Å; L94-K97 WeakPolarHBondContact O-CB 2.9Å; L94-K97 PolarHBondContact O-N 2.77Å; L94-K97 VanDerWaalsContact O-N 3.16Å; R95-K97 PolarHBondContact O-N 2.96Å; R95-K97 VanDerWaalsContact O-N 3.13Å
98	Y	72.1	Confident	80.7	Confident	176 Å²	176	82.4 Å²	82.4	69%	0.69	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.1	-175.8	-57	-76.8	0	0	0	113.5	R95 E96	R95-Y98 PolarHBondContact O-N 3Å; E96-Y98 VanDerWaalsContact C-N 3.28Å; E96-Y98 PolarHBondContact O-N 2.92Å
99	E	81.7	Confident	80.9	Confident	67 Å²	67	80.7 Å²	80.7	31%	0.313	40%	0.401	S	S	.	.			trans	-92.3	123.7	-179.3	-69.5	-174.9	171.4	0	0	111	R76 R95 K101	R76-E99 PolarHBondContact NH2-O 3.37Å; R95-E99 HydrophobicContact CG-CG 4.5Å; R95-E99 IonicContact CZ-OE1 3.58Å; R95-E99 IonicContact NE-OE1 2.78Å; R95-E99 PolarHBondContact NE-OE1 3.26Å; R95-E99 IonicContact NH2-OE1 3.59Å; E99-K101 PolarHBondContact O-N 3.45Å
100	E	80.4	Confident	81.1	Confident	157 Å²	157	86.5 Å²	86.5	73%	0.734	43%	0.428	S	S	*	.	S	Bend	trans	-67.7	-25.1	176	-70.2	-179.9	172.3	0	0	112.7	I64	I64-E100 PolarHBondContact N-O 3.05Å
101	K	86.4	Confident	81.4	Confident	106 Å²	106	85.9 Å²	85.9	46%	0.461	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	116.7	-174.9	-167.6	173.6	-170.2	167.8	0	110.8	I64 C66 E71 E99	I64-K101 WeakPolarHBondContact O-CA 3.46Å; C66-K101 WeakPolarHBondContact SG-CE 3.46Å; C66-K101 WeakPolarHBondContact SG-CG 3.23Å; E71-K101 WeakPolarHBondContact OE1-CE 3.5Å; E71-K101 IonicContact OE1-NZ 2.79Å; E71-K101 PolarHBondContact OE1-NZ 3.49Å; E99-K101 PolarHBondContact O-N 3.45Å
102	I	87.9	Confident	82	Confident	6 Å²	6	82.1 Å²	82.1	3%	0.031	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.1	-174.4	-58.7	174.5	0	0	0	109.7	V63 I64 L65 C66 M89 F90 E96 L104	V63-I102 HydrophobicContact CG2-CD1 3.68Å; V63-I102 HydrophobicContact CG2-CG1 4.17Å; I64-I102 PolarHBondContact O-N 3.39Å; L65-I102 HydrophobicContact CD2-CB 4.14Å; C66-I102 PolarHBondContact N-O 3.03Å; M89-I102 HydrophobicContact SD-CD1 3.99Å; M89-I102 HydrophobicContact SD-CG2 4.21Å; F90-I102 HydrophobicContact CE1-CD1 3.54Å; F90-I102 HydrophobicContact CZ-CD1 4.19Å; E96-I102 HydrophobicContact CB-CD1 4.15Å; E96-I102 HydrophobicContact CB-CG1 4.5Å; E96-I102 HydrophobicContact CG-CG2 4.47Å; I102-L104 HydrophobicContact CG2-CD2 4.23Å; I102-L104 HydrophobicContact CG2-CG 4.48Å
103	I	86.3	Confident	82.6	Confident	126 Å²	126	80.5 Å²	80.5	65%	0.646	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	112	178.7	-57.6	171.6	0	0	0	109.1	C66	C66-I103 HydrophobicContact CB-CG1 4.27Å
104	L	86	Confident	83.8	Confident	11 Å²	11	75.3 Å²	75.3	6%	0.058	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.8	175.1	-63.7	173.5	0	0	0	109.5	L65 C66 V67 Y85 F86 M89 I102 M112 F141	L65-L104 HydrophobicContact CB-CD1 4.34Å; L65-L104 HydrophobicContact CD1-CD1 4.08Å; L65-L104 HydrophobicContact CD2-CD1 4.02Å; L65-L104 HydrophobicContact CG-CD1 4.38Å; C66-L104 PolarHBondContact O-N 3.06Å; V67-L104 HydrophobicContact CG2-CB 4.18Å; V67-L104 HydrophobicContact CG2-CD1 4.49Å; Y85-L104 HydrophobicContact CE1-CD2 4.5Å; F86-L104 HydrophobicContact CE1-CD1 4.25Å; F86-L104 HydrophobicContact CZ-CD1 4.32Å; M89-L104 HydrophobicContact CE-CD2 4.24Å; I102-L104 HydrophobicContact CG2-CD2 4.23Å; I102-L104 HydrophobicContact CG2-CG 4.48Å; L104-M112 HydrophobicContact CD1-CE 3.48Å; L104-M112 VanDerWaalsContact CD1-CE 3.48Å; L104-M112 HydrophobicContact CD1-SD 4.45Å; L104-F141 HydrophobicContact CD1-CE1 4.48Å; L104-F141 HydrophobicContact CD1-CZ 4.25Å; L104-F141 HydrophobicContact CD2-CE1 4.28Å
105	K	83.4	Confident	84.7	Confident	181 Å²	181	71.6 Å²	71.6	79%	0.787	34%	0.344	S	S	*	.			trans	-111.4	148.9	178.2	-63.5	-177.4	-178.8	178.1	0	109.8
106	G	80.3	Confident	85.8	Confident	76 Å²	76	62.7 Å²	62.7	78%	0.784	31%	0.311	S	S	*	.	S	Bend	trans	92.7	10.1	172.1	0	0	0	0	0	115.8
107	V	89.3	Confident	86.7	Confident	16 Å²	16	62 Å²	62	10%	0.097	31%	0.309	C	S	.	.	S	Bend	trans	-137.6	145.5	174.7	179.2	0	0	0	0	109	V67 T111 M112 A137 L140 F141	V67-V107 WeakPolarHBondContact CG1-O 3.42Å; V107-T111 HydrophobicContact CG1-CG2 4.07Å; V107-M112 HydrophobicContact CG1-CB 4.47Å; V107-M112 HydrophobicContact CG1-CE 4.4Å; V107-A137 HydrophobicContact CG1-CB 3.89Å; V107-A137 HydrophobicContact CG2-CB 3.76Å; V107-L140 HydrophobicContact CG2-CD2 4.12Å; V107-F141 HydrophobicContact CB-CE2 4.16Å; V107-F141 HydrophobicContact CB-CZ 4.48Å; V107-F141 HydrophobicContact CG1-CE2 4.38Å; V107-F141 HydrophobicContact CG2-CD2 4.46Å; V107-F141 HydrophobicContact CG2-CE2 3.49Å; V107-F141 VanDerWaalsContact CG2-CE2 3.49Å; V107-F141 HydrophobicContact CG2-CZ 3.84Å
108	D	90	Very high	87.7	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.16	31%	0.305	C	S	.	.			trans	-83	156.9	176.4	63.3	2.1	0	0	0	111.6	E110 T111 M112 K133	D108-E110 PolarHBondContact O-N 2.79Å; D108-T111 PolarHBondContact O-N 3.38Å; D108-T111 WeakPolarHBondContact OD1-CA 3.32Å; D108-T111 WeakPolarHBondContact OD1-CB 3.43Å; D108-T111 PolarHBondContact OD1-N 3.28Å; D108-T111 PolarHBondContact OD1-OG1 2.93Å; D108-M112 PolarHBondContact O-N 2.89Å; D108-K133 WeakPolarHBondContact OD2-CD 3.42Å; D108-K133 IonicContact OD2-NZ 3.68Å; D108-K133 PolarHBondContact OD2-NZ 3.26Å
109	A	89.9	Confident	88.6	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-26	-174.9	0	0	0	0	0	113.3	E68 R70 F72 N113	E68-A109 PolarHBondContact OE2-N 3.23Å; R70-A109 HydrophobicContact CB-CB 4.04Å; R70-A109 HydrophobicContact CG-CB 3.93Å; F72-A109 HydrophobicContact CE2-CB 4.42Å; F72-A109 HydrophobicContact CZ-CB 4.34Å; F72-A109 WeakPolarHBondContact CZ-O 3.14Å; A109-N113 PolarHBondContact O-N 3.27Å; A109-N113 VanDerWaalsContact O-N 3.16Å
110	E	90.6	Very high	89.1	Confident	135 Å²	135	50.8 Å²	50.8	63%	0.631	26%	0.263	S	S	*	.	H	α-helix	trans	-73.2	-46.3	177.2	-170.7	171.3	-172.3	0	0	112.1	D108 M112 N113 I114	D108-E110 PolarHBondContact O-N 2.79Å; E110-M112 VanDerWaalsContact C-N 3.3Å; E110-M112 PolarHBondContact O-N 3.1Å; E110-N113 WeakPolarHBondContact O-CB 2.96Å; E110-N113 PolarHBondContact O-N 3.3Å; E110-N113 VanDerWaalsContact O-N 3.14Å; E110-I114 WeakPolarHBondContact O-CG1 3.33Å; E110-I114 PolarHBondContact O-N 2.88Å; E110-I114 VanDerWaalsContact O-N 3.07Å
111	T	91.8	Very high	89.6	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-37.9	175.8	-57.1	0	0	0	0	111	V107 D108 N113 I114 L115 V134 A137	V107-T111 HydrophobicContact CG1-CG2 4.07Å; D108-T111 PolarHBondContact O-N 3.38Å; D108-T111 WeakPolarHBondContact OD1-CA 3.32Å; D108-T111 WeakPolarHBondContact OD1-CB 3.43Å; D108-T111 PolarHBondContact OD1-N 3.28Å; D108-T111 PolarHBondContact OD1-OG1 2.93Å; T111-N113 VanDerWaalsContact C-N 3.28Å; T111-N113 PolarHBondContact O-N 2.93Å; T111-I114 PolarHBondContact O-N 2.96Å; T111-L115 HydrophobicContact CG2-CD1 4.49Å; T111-L115 HydrophobicContact CG2-CG 4.48Å; T111-L115 WeakPolarHBondContact O-CG 3.38Å; T111-L115 PolarHBondContact O-N 3.24Å; T111-V134 HydrophobicContact CG2-CB 4.49Å; T111-V134 HydrophobicContact CG2-CG2 4.1Å; T111-A137 HydrophobicContact CG2-CB 3.51Å
112	M	91.9	Very high	89.7	Confident	2 Å²	2	44 Å²	44	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-41.3	174.1	-174	60.9	66.2	0	0	111.5	V67 F72 L104 V107 D108 E110 I114 L115 L116 F141	V67-M112 HydrophobicContact CG1-CB 4.48Å; V67-M112 HydrophobicContact CG2-CB 4.05Å; V67-M112 HydrophobicContact CG2-CE 3.77Å; V67-M112 HydrophobicContact CG2-CG 3.77Å; F72-M112 HydrophobicContact CD2-CG 4.28Å; F72-M112 HydrophobicContact CE2-CB 4.37Å; F72-M112 HydrophobicContact CE2-CG 4.23Å; L104-M112 HydrophobicContact CD1-CE 3.48Å; L104-M112 VanDerWaalsContact CD1-CE 3.48Å; L104-M112 HydrophobicContact CD1-SD 4.45Å; V107-M112 HydrophobicContact CG1-CB 4.47Å; V107-M112 HydrophobicContact CG1-CE 4.4Å; D108-M112 PolarHBondContact O-N 2.89Å; E110-M112 VanDerWaalsContact C-N 3.3Å; E110-M112 PolarHBondContact O-N 3.1Å; M112-I114 VanDerWaalsContact C-N 3.33Å; M112-I114 PolarHBondContact O-N 3.44Å; M112-L115 PolarHBondContact O-N 3.12Å; M112-L115 HydrophobicContact SD-CD1 4.44Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 HydrophobicContact CG-CG 4.38Å; M112-L116 WeakPolarHBondContact O-CG 3.34Å; M112-L116 PolarHBondContact O-N 2.89Å; M112-L116 HydrophobicContact SD-CG 4.41Å; M112-F141 HydrophobicContact CE-CD2 4.44Å; M112-F141 HydrophobicContact CE-CE2 3.46Å; M112-F141 VanDerWaalsContact CE-CE2 3.46Å; M112-F141 HydrophobicContact CE-CZ 3.67Å
113	N	91.4	Very high	89.8	Confident	56 Å²	56	51.4 Å²	51.4	30%	0.299	28%	0.276	S	S	.	.	H	α-helix	trans	-62.3	-42.3	176.5	-167.2	57.9	0	0	0	111.7	F72 A109 E110 T111 L115 L116 D117	F72-N113 HydrophobicContact CE1-CB 4.05Å; F72-N113 HydrophobicContact CZ-CB 4.42Å; A109-N113 PolarHBondContact O-N 3.27Å; A109-N113 VanDerWaalsContact O-N 3.16Å; E110-N113 WeakPolarHBondContact O-CB 2.96Å; E110-N113 PolarHBondContact O-N 3.3Å; E110-N113 VanDerWaalsContact O-N 3.14Å; T111-N113 VanDerWaalsContact C-N 3.28Å; T111-N113 PolarHBondContact O-N 2.93Å; N113-L115 VanDerWaalsContact C-N 3.34Å; N113-L115 PolarHBondContact O-N 3.06Å; N113-L116 PolarHBondContact O-N 3.42Å; N113-D117 PolarHBondContact ND2-OD2 3.46Å; N113-D117 VanDerWaalsContact ND2-OD2 3.09Å; N113-D117 WeakPolarHBondContact O-CB 3.37Å; N113-D117 PolarHBondContact O-N 3.19Å
114	I	92.6	Very high	90	Very high	27 Å²	27	47.7 Å²	47.7	14%	0.138	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-43	176	-65	169.8	0	0	0	111.4	E110 T111 M112 Y118 M124 V134	E110-I114 WeakPolarHBondContact O-CG1 3.33Å; E110-I114 PolarHBondContact O-N 2.88Å; E110-I114 VanDerWaalsContact O-N 3.07Å; T111-I114 PolarHBondContact O-N 2.96Å; M112-I114 VanDerWaalsContact C-N 3.33Å; M112-I114 PolarHBondContact O-N 3.44Å; I114-Y118 WeakPolarHBondContact O-CB 3.48Å; I114-Y118 PolarHBondContact O-N 3.12Å; I114-M124 HydrophobicContact CG2-CG 3.59Å; I114-M124 HydrophobicContact CG2-SD 4.01Å; I114-V134 HydrophobicContact CD1-CG2 4.18Å; I114-V134 HydrophobicContact CG2-CG2 4.44Å
115	L	92.3	Very high	90.3	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-44.3	176.8	-68.2	173.5	0	0	0	111.3	T111 M112 N113 Y118 T119 A137 A138 F141 F143 M146	T111-L115 HydrophobicContact CG2-CD1 4.49Å; T111-L115 HydrophobicContact CG2-CG 4.48Å; T111-L115 WeakPolarHBondContact O-CG 3.38Å; T111-L115 PolarHBondContact O-N 3.24Å; M112-L115 PolarHBondContact O-N 3.12Å; M112-L115 HydrophobicContact SD-CD1 4.44Å; N113-L115 VanDerWaalsContact C-N 3.34Å; N113-L115 PolarHBondContact O-N 3.06Å; L115-Y118 WeakPolarHBondContact O-CB 3.5Å; L115-Y118 PolarHBondContact O-N 3.27Å; L115-T119 VanDerWaalsContact O-CG2 3.24Å; L115-T119 WeakPolarHBondContact O-CG2 3.33Å; L115-T119 PolarHBondContact O-N 3.26Å; L115-A137 HydrophobicContact CD1-CB 3.87Å; L115-A138 HydrophobicContact CD2-CB 4.35Å; L115-F141 HydrophobicContact CD1-CD2 3.61Å; L115-F141 HydrophobicContact CD1-CE2 4.01Å; L115-F143 HydrophobicContact CD2-CD2 4.02Å; L115-F143 HydrophobicContact CD2-CE2 4.32Å; L115-M146 HydrophobicContact CD2-CE 3.27Å; L115-M146 HydrophobicContact CD2-SD 3.76Å; L115-M146 HydrophobicContact CG-CE 4.48Å
116	L	92.1	Very high	90.7	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-48.1	178.2	-69.6	176.7	0	0	0	111.3	L65 F72 C74 L79 M112 N113 Y118 T119 Y120	L65-L116 HydrophobicContact CD1-CD2 4.39Å; F72-L116 HydrophobicContact CB-CD1 3.65Å; F72-L116 HydrophobicContact CD1-CD1 3.72Å; F72-L116 HydrophobicContact CG-CD1 3.75Å; C74-L116 VanDerWaalsContact SG-CD2 3.59Å; L79-L116 HydrophobicContact CD2-CD2 3.71Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 HydrophobicContact CG-CG 4.38Å; M112-L116 WeakPolarHBondContact O-CG 3.34Å; M112-L116 PolarHBondContact O-N 2.89Å; M112-L116 HydrophobicContact SD-CG 4.41Å; N113-L116 PolarHBondContact O-N 3.42Å; L116-Y118 PolarHBondContact O-N 2.8Å; L116-T119 WeakPolarHBondContact CA-OG1 3.35Å; L116-T119 PolarHBondContact O-N 3.48Å; L116-T119 PolarHBondContact O-OG1 3.12Å; L116-Y120 WeakPolarHBondContact O-CD2 3.24Å; L116-Y120 PolarHBondContact O-N 3.46Å
117	D	91.6	Very high	91.2	Very high	50 Å²	50	45.4 Å²	45.4	27%	0.267	24%	0.236	S	C	.	.	H	α-helix	trans	-57.5	-39.1	176.2	-69.2	-16.5	0	0	0	110.4	R55 N113 Y120 T121	R55-D117 IonicContact CZ-OD1 3.86Å; R55-D117 IonicContact NH2-OD1 2.74Å; R55-D117 PolarHBondContact NH2-OD1 2.95Å; N113-D117 PolarHBondContact ND2-OD2 3.46Å; N113-D117 VanDerWaalsContact ND2-OD2 3.09Å; N113-D117 WeakPolarHBondContact O-CB 3.37Å; N113-D117 PolarHBondContact O-N 3.19Å; D117-Y120 PolarHBondContact O-N 3Å; D117-T121 WeakPolarHBondContact O-CA 3.29Å; D117-T121 VanDerWaalsContact O-CB 3.27Å; D117-T121 WeakPolarHBondContact O-CB 3.23Å; D117-T121 WeakPolarHBondContact O-CG2 3.34Å; D117-T121 PolarHBondContact O-N 3.07Å; D117-T121 PolarHBondContact O-OG1 3.46Å
118	Y	93.6	Very high	91.1	Very high	55 Å²	55	51.4 Å²	51.4	22%	0.216	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-45.7	171.2	173.9	-95.1	0	0	0	112.8	I114 L115 L116 Y120 S122 K123 M124 R145 M146	I114-Y118 WeakPolarHBondContact O-CB 3.48Å; I114-Y118 PolarHBondContact O-N 3.12Å; L115-Y118 WeakPolarHBondContact O-CB 3.5Å; L115-Y118 PolarHBondContact O-N 3.27Å; L116-Y118 PolarHBondContact O-N 2.8Å; Y118-Y120 PolarHBondContact O-N 3.17Å; Y118-S122 VanDerWaalsContact O-CA 3.27Å; Y118-S122 WeakPolarHBondContact O-CA 3.35Å; Y118-S122 PolarHBondContact O-N 3.09Å; Y118-K123 WeakPolarHBondContact CA-O 3.48Å; Y118-M124 HydrophobicContact CD2-CB 4.02Å; Y118-R145 WeakPolarHBondContact OH-CB 3.12Å; Y118-M146 HydrophobicContact CD1-CE 3.25Å; Y118-M146 HydrophobicContact CD1-CG 3.68Å; Y118-M146 HydrophobicContact CD1-SD 3.29Å; Y118-M146 WeakPolarHBondContact CD1-SD 3.3Å; Y118-M146 HydrophobicContact CD2-CG 3.95Å; Y118-M146 HydrophobicContact CD2-SD 3.94Å; Y118-M146 HydrophobicContact CE1-CE 3.72Å; Y118-M146 HydrophobicContact CE1-CG 3.56Å; Y118-M146 HydrophobicContact CE1-SD 3.84Å; Y118-M146 HydrophobicContact CE2-CG 3.84Å; Y118-M146 HydrophobicContact CE2-SD 4.42Å; Y118-M146 HydrophobicContact CG-CE 3.92Å; Y118-M146 HydrophobicContact CG-CG 3.85Å; Y118-M146 HydrophobicContact CG-SD 3.32Å
119	T	92.2	Very high	91	Very high	17 Å²	17	58.7 Å²	58.7	10%	0.104	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-32.6	-179.3	60.5	0	0	0	0	113.2	A82 L115 L116 F143	A82-T119 HydrophobicContact CB-CG2 3.79Å; L115-T119 VanDerWaalsContact O-CG2 3.24Å; L115-T119 WeakPolarHBondContact O-CG2 3.33Å; L115-T119 PolarHBondContact O-N 3.26Å; L116-T119 WeakPolarHBondContact CA-OG1 3.35Å; L116-T119 PolarHBondContact O-N 3.48Å; L116-T119 PolarHBondContact O-OG1 3.12Å; T119-F143 HydrophobicContact CG2-CE1 3.43Å; T119-F143 VanDerWaalsContact CG2-CE1 3.43Å; T119-F143 HydrophobicContact CG2-CZ 3.52Å
120	Y	91.4	Very high	91	Very high	3 Å²	3	59.6 Å²	59.6	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-97.3	-27.8	-178.1	-76	-92.1	0	0	0	113.8	Q48 L51 E52 R55 H75 V78 L116 D117 Y118	Q48-Y120 WeakPolarHBondContact CG-O 3.44Å; Q48-Y120 PolarHBondContact NE2-O 3.3Å; L51-Y120 HydrophobicContact CB-CD1 4.24Å; L51-Y120 HydrophobicContact CB-CE1 4.34Å; E52-Y120 WeakPolarHBondContact OE2-CB 3.36Å; R55-Y120 HydrophobicContact CB-CD1 4.34Å; R55-Y120 HydrophobicContact CB-CE1 4.08Å; R55-Y120 VanDerWaalsContact CD-CE2 3.43Å; R55-Y120 HydrophobicContact CG-CE1 4.48Å; R55-Y120 HydrophobicContact CG-CE2 4.45Å; H75-Y120 WeakPolarHBondContact CB-OH 3.12Å; H75-Y120 PolarHBondContact N-OH 2.8Å; H75-Y120 AromaticContact ND1-CE1 3.64Å; H75-Y120 AromaticContact ND1-CZ 3.68Å; H75-Y120 PolarHBondContact ND1-OH 2.8Å; V78-Y120 HydrophobicContact CB-CE1 4.17Å; V78-Y120 HydrophobicContact CG1-CD1 4.25Å; V78-Y120 HydrophobicContact CG1-CD2 4.48Å; V78-Y120 HydrophobicContact CG1-CE1 3.83Å; V78-Y120 HydrophobicContact CG1-CE2 4.08Å; V78-Y120 HydrophobicContact CG2-CE1 4.05Å; L116-Y120 WeakPolarHBondContact O-CD2 3.24Å; L116-Y120 PolarHBondContact O-N 3.46Å; D117-Y120 PolarHBondContact O-N 3Å; Y118-Y120 PolarHBondContact O-N 3.17Å
121	T	90.2	Very high	91.1	Very high	44 Å²	44	53.6 Å²	53.6	27%	0.27	27%	0.271	S	S	.	.	H	α-helix	trans	-111.9	-8.9	-175.6	72.9	0	0	0	0	114.6	E52 D117 K123	E52-T121 HydrophobicContact CG-CG2 4.19Å; D117-T121 WeakPolarHBondContact O-CA 3.29Å; D117-T121 VanDerWaalsContact O-CB 3.27Å; D117-T121 WeakPolarHBondContact O-CB 3.23Å; D117-T121 WeakPolarHBondContact O-CG2 3.34Å; D117-T121 PolarHBondContact O-N 3.07Å; D117-T121 PolarHBondContact O-OG1 3.46Å; T121-K123 PolarHBondContact O-N 3.36Å; T121-K123 VanDerWaalsContact O-N 3.17Å; T121-K123 PolarHBondContact OG1-N 3.44Å
122	S	89.8	Confident	91	Very high	75 Å²	75	58.1 Å²	58.1	52%	0.524	29%	0.291	S	S	.	.	S	Bend	trans	59.1	15.5	-171.1	-60.6	0	0	0	0	114	Q48 Y118	Q48-S122 PolarHBondContact NE2-OG 3.21Å; Q48-S122 PolarHBondContact OE1-OG 2.92Å; Y118-S122 VanDerWaalsContact O-CA 3.27Å; Y118-S122 WeakPolarHBondContact O-CA 3.35Å; Y118-S122 PolarHBondContact O-N 3.09Å
123	K	89.4	Confident	91	Very high	163 Å²	163	62.8 Å²	62.8	71%	0.709	31%	0.312	S	S	*	.			trans	-121.2	142.1	-178.3	-65.6	176.1	-176.4	178.2	0	110.1	Y118 T121	Y118-K123 WeakPolarHBondContact CA-O 3.48Å; T121-K123 PolarHBondContact O-N 3.36Å; T121-K123 VanDerWaalsContact O-N 3.17Å; T121-K123 PolarHBondContact OG1-N 3.44Å
124	M	91	Very high	91	Very high	47 Å²	47	60.1 Å²	60.1	23%	0.232	30%	0.297	C	S	.	.			trans	-144.4	139.1	178.2	177.9	176.2	63.2	0	0	109.4	I114 Y118 I126 V134 M146 A149	I114-M124 HydrophobicContact CG2-CG 3.59Å; I114-M124 HydrophobicContact CG2-SD 4.01Å; Y118-M124 HydrophobicContact CD2-CB 4.02Å; M124-I126 HydrophobicContact CE-CD1 3.58Å; M124-I126 HydrophobicContact CE-CG1 3.59Å; M124-I126 HydrophobicContact CG-CG1 4.33Å; M124-I126 HydrophobicContact SD-CG1 4.43Å; M124-V134 HydrophobicContact CE-CG1 4.42Å; M124-V134 HydrophobicContact SD-CG1 3.55Å; M124-V134 VanDerWaalsContact SD-CG1 3.55Å; M124-M146 HydrophobicContact CE-CB 4.03Å; M124-M146 HydrophobicContact CE-CG 3.95Å; M124-M146 HydrophobicContact CE-SD 4.32Å; M124-M146 HydrophobicContact SD-CB 4.37Å; M124-M146 HydrophobicContact SD-CG 4.04Å; M124-M146 HydrophobicContact SD-SD 3.61Å; M124-M146 VanDerWaalsContact SD-SD 3.61Å; M124-A149 HydrophobicContact CE-CB 4.29Å
125	L	90.8	Very high	91	Very high	134 Å²	134	58.9 Å²	58.9	70%	0.702	29%	0.291	S	S	*	.			trans	-100	111.7	174.8	-177	67.3	0	0	0	110.2	T127 N130	L125-T127 HydrophobicContact CD2-CG2 4.5Å; L125-T127 HydrophobicContact CG-CG2 4.22Å; L125-N130 PolarHBondContact O-ND2 2.8Å
126	I	92.3	Very high	90.9	Very high	34 Å²	34	62.5 Å²	62.5	17%	0.174	31%	0.308	C	S	.	.			trans	-97.7	131.5	176.7	-50.2	175.7	0	0	0	109.2	M124 V131 A149 F153	M124-I126 HydrophobicContact CE-CD1 3.58Å; M124-I126 HydrophobicContact CE-CG1 3.59Å; M124-I126 HydrophobicContact CG-CG1 4.33Å; M124-I126 HydrophobicContact SD-CG1 4.43Å; I126-V131 HydrophobicContact CG2-CB 3.85Å; I126-V131 HydrophobicContact CG2-CG2 3.83Å; I126-A149 HydrophobicContact CD1-CB 3.96Å; I126-F153 HydrophobicContact CB-CD2 4.44Å; I126-F153 HydrophobicContact CB-CG 4.42Å; I126-F153 HydrophobicContact CD1-CB 4.45Å; I126-F153 HydrophobicContact CG2-CB 4.07Å; I126-F153 HydrophobicContact CG2-CD1 3.7Å; I126-F153 HydrophobicContact CG2-CD2 4.11Å; I126-F153 HydrophobicContact CG2-CE1 4.13Å; I126-F153 HydrophobicContact CG2-CG 3.68Å
127	T	91.8	Very high	90.9	Very high	52 Å²	52	62.5 Å²	62.5	32%	0.319	31%	0.308	S	S	.	.			trans	-134.7	162.2	178.2	69.8	0	0	0	0	109.9	L125 Q129 N130 V131	L125-T127 HydrophobicContact CD2-CG2 4.5Å; L125-T127 HydrophobicContact CG-CG2 4.22Å; T127-Q129 PolarHBondContact O-N 2.92Å; T127-Q129 VanDerWaalsContact O-N 3.13Å; T127-N130 PolarHBondContact N-OD1 2.82Å; T127-N130 PolarHBondContact O-N 2.86Å; T127-N130 PolarHBondContact O-OD1 2.88Å; T127-N130 PolarHBondContact OG1-N 2.61Å; T127-N130 PolarHBondContact OG1-ND2 3.25Å; T127-N130 PolarHBondContact OG1-OD1 3.47Å; T127-V131 WeakPolarHBondContact O-CB 3.29Å; T127-V131 PolarHBondContact O-N 2.89Å
128	K	86.4	Confident	91	Very high	143 Å²	143	60.1 Å²	60.1	62%	0.622	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.6	178.1	-66.5	-169.2	176.9	-166.8	0	113.6	F153	K128-F153 HydrophobicContact CG-CE1 4.4Å; K128-F153 HydrophobicContact CG-CZ 4.2Å
129	Q	87.8	Confident	90.9	Very high	182 Å²	182	58.8 Å²	58.8	85%	0.85	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-30.9	-177.4	-65.3	176	3.8	0	0	112.8	T127	T127-Q129 PolarHBondContact O-N 2.92Å; T127-Q129 VanDerWaalsContact O-N 3.13Å
130	N	90.6	Very high	90.8	Very high	25 Å²	25	62.2 Å²	62.2	13%	0.134	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-21.5	-176.6	74.7	8.1	0	0	0	113.5	L125 T127 Q132 K133 V134	L125-N130 PolarHBondContact O-ND2 2.8Å; T127-N130 PolarHBondContact N-OD1 2.82Å; T127-N130 PolarHBondContact O-N 2.86Å; T127-N130 PolarHBondContact O-OD1 2.88Å; T127-N130 PolarHBondContact OG1-N 2.61Å; T127-N130 PolarHBondContact OG1-ND2 3.25Å; T127-N130 PolarHBondContact OG1-OD1 3.47Å; N130-Q132 VanDerWaalsContact C-N 3.29Å; N130-Q132 PolarHBondContact O-N 3.41Å; N130-Q132 VanDerWaalsContact O-N 3.16Å; N130-K133 PolarHBondContact O-N 3.4Å; N130-K133 VanDerWaalsContact O-N 3.12Å; N130-V134 HydrophobicContact CB-CG2 4.1Å; N130-V134 WeakPolarHBondContact O-CB 3.47Å; N130-V134 VanDerWaalsContact O-CG2 3.27Å; N130-V134 WeakPolarHBondContact O-CG2 3.36Å; N130-V134 PolarHBondContact O-N 3.28Å
131	V	91.4	Very high	90.8	Very high	9 Å²	9	62.2 Å²	62.2	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-56.2	-40.1	-169.6	63.8	0	0	0	0	113.2	I126 T127 L135 C150 F153 L154	I126-V131 HydrophobicContact CG2-CB 3.85Å; I126-V131 HydrophobicContact CG2-CG2 3.83Å; T127-V131 WeakPolarHBondContact O-CB 3.29Å; T127-V131 PolarHBondContact O-N 2.89Å; V131-L135 WeakPolarHBondContact O-CB 3.46Å; V131-L135 PolarHBondContact O-N 3.28Å; V131-C150 HydrophobicContact CG2-CB 4.07Å; V131-F153 HydrophobicContact CB-CD1 4.22Å; V131-F153 HydrophobicContact CB-CE1 4.33Å; V131-F153 HydrophobicContact CG1-CE1 4.35Å; V131-F153 HydrophobicContact CG2-CD1 3.95Å; V131-L154 HydrophobicContact CG1-CD2 3.85Å; V131-L154 HydrophobicContact CG2-CD1 4.33Å; V131-L154 HydrophobicContact CG2-CD2 3.88Å; V131-L154 HydrophobicContact CG2-CG 3.89Å
132	Q	90.5	Very high	90.9	Very high	98 Å²	98	64.3 Å²	64.3	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-52.7	178.6	176.7	175.7	-7.6	0	0	111.2	N130 V134 L135 E136 L169	N130-Q132 VanDerWaalsContact C-N 3.29Å; N130-Q132 PolarHBondContact O-N 3.41Å; N130-Q132 VanDerWaalsContact O-N 3.16Å; Q132-V134 PolarHBondContact O-N 3.32Å; Q132-L135 PolarHBondContact O-N 2.98Å; Q132-E136 VanDerWaalsContact CG-OE1 3.23Å; Q132-E136 WeakPolarHBondContact CG-OE1 3.4Å; Q132-E136 PolarHBondContact NE2-OE1 2.97Å; Q132-E136 WeakPolarHBondContact O-CB 3.27Å; Q132-E136 WeakPolarHBondContact O-CG 3.35Å; Q132-E136 PolarHBondContact O-N 3.48Å; Q132-L169 HydrophobicContact CB-CD1 4.39Å; Q132-L169 HydrophobicContact CG-CD1 4.18Å; Q132-L169 HydrophobicContact CG-CD2 3.83Å
133	K	91.4	Very high	91	Very high	101 Å²	101	61.1 Å²	61.1	44%	0.439	30%	0.295	S	S	.	.	H	α-helix	trans	-63.7	-41.6	-179.2	-63	180	171.4	-170.6	0	112	D108 N130 E136 A137	D108-K133 WeakPolarHBondContact OD2-CD 3.42Å; D108-K133 IonicContact OD2-NZ 3.68Å; D108-K133 PolarHBondContact OD2-NZ 3.26Å; N130-K133 PolarHBondContact O-N 3.4Å; N130-K133 VanDerWaalsContact O-N 3.12Å; K133-E136 PolarHBondContact O-N 2.89Å; K133-A137 WeakPolarHBondContact O-CB 3.24Å; K133-A137 PolarHBondContact O-N 2.92Å
134	V	92.9	Very high	91	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-43	177.6	174.3	0	0	0	0	110.5	T111 I114 M124 N130 Q132 A137 A138	T111-V134 HydrophobicContact CG2-CB 4.49Å; T111-V134 HydrophobicContact CG2-CG2 4.1Å; I114-V134 HydrophobicContact CD1-CG2 4.18Å; I114-V134 HydrophobicContact CG2-CG2 4.44Å; M124-V134 HydrophobicContact CE-CG1 4.42Å; M124-V134 HydrophobicContact SD-CG1 3.55Å; M124-V134 VanDerWaalsContact SD-CG1 3.55Å; N130-V134 HydrophobicContact CB-CG2 4.1Å; N130-V134 WeakPolarHBondContact O-CB 3.47Å; N130-V134 VanDerWaalsContact O-CG2 3.27Å; N130-V134 WeakPolarHBondContact O-CG2 3.36Å; N130-V134 PolarHBondContact O-N 3.28Å; Q132-V134 PolarHBondContact O-N 3.32Å; V134-A137 PolarHBondContact O-N 3.34Å; V134-A138 WeakPolarHBondContact O-CB 3.37Å; V134-A138 PolarHBondContact O-N 3.2Å
135	L	91.9	Very high	91.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-46.3	176.6	178.8	65.2	0	0	0	111.6	V131 Q132 A137 A138 S139 V147 C150 L154 L175	V131-L135 WeakPolarHBondContact O-CB 3.46Å; V131-L135 PolarHBondContact O-N 3.28Å; Q132-L135 PolarHBondContact O-N 2.98Å; L135-A137 PolarHBondContact O-N 3.19Å; L135-A138 PolarHBondContact O-N 3.23Å; L135-S139 VanDerWaalsContact O-CB 3.24Å; L135-S139 WeakPolarHBondContact O-CB 2.92Å; L135-S139 PolarHBondContact O-N 3.47Å; L135-V147 HydrophobicContact CD1-CB 4.31Å; L135-V147 HydrophobicContact CD1-CG1 3.91Å; L135-V147 HydrophobicContact CD1-CG2 4.33Å; L135-C150 HydrophobicContact CB-CB 4.16Å; L135-C150 HydrophobicContact CD1-CB 3.88Å; L135-L154 HydrophobicContact CD2-CD1 3.97Å; L135-L175 HydrophobicContact CD1-CD1 4.01Å; L135-L175 HydrophobicContact CD2-CD1 3.98Å
136	E	90.6	Very high	91.2	Very high	78 Å²	78	58.5 Å²	58.5	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-57.1	-48.9	176.8	-76.3	170.5	-161.9	0	0	111	Q132 K133 L140 H173	Q132-E136 VanDerWaalsContact CG-OE1 3.23Å; Q132-E136 WeakPolarHBondContact CG-OE1 3.4Å; Q132-E136 PolarHBondContact NE2-OE1 2.97Å; Q132-E136 WeakPolarHBondContact O-CB 3.27Å; Q132-E136 WeakPolarHBondContact O-CG 3.35Å; Q132-E136 PolarHBondContact O-N 3.48Å; K133-E136 PolarHBondContact O-N 2.89Å; E136-L140 WeakPolarHBondContact O-CB 3.34Å; E136-L140 PolarHBondContact O-N 3.39Å; E136-H173 VanDerWaalsContact CG-NE2 3.29Å; E136-H173 WeakPolarHBondContact CG-NE2 3.49Å
137	A	91.7	Very high	91.2	Very high	3 Å²	3	57.3 Å²	57.3	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-70.7	-39.9	-179.7	0	0	0	0	0	112.9	V107 T111 L115 K133 V134 L135 S139 L140 F141	V107-A137 HydrophobicContact CG1-CB 3.89Å; V107-A137 HydrophobicContact CG2-CB 3.76Å; T111-A137 HydrophobicContact CG2-CB 3.51Å; L115-A137 HydrophobicContact CD1-CB 3.87Å; K133-A137 WeakPolarHBondContact O-CB 3.24Å; K133-A137 PolarHBondContact O-N 2.92Å; V134-A137 PolarHBondContact O-N 3.34Å; L135-A137 PolarHBondContact O-N 3.19Å; A137-S139 VanDerWaalsContact C-N 3.33Å; A137-S139 PolarHBondContact O-N 2.94Å; A137-L140 PolarHBondContact O-N 3.29Å; A137-F141 HydrophobicContact CB-CD2 4.46Å; A137-F141 WeakPolarHBondContact O-CB 3.27Å; A137-F141 VanDerWaalsContact O-CD2 3.23Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.38Å
138	A	92.6	Very high	91.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.3	-37.8	176.8	0	0	0	0	0	111.6	L115 V134 L135 Q142 F143 M146 V147	L115-A138 HydrophobicContact CD2-CB 4.35Å; V134-A138 WeakPolarHBondContact O-CB 3.37Å; V134-A138 PolarHBondContact O-N 3.2Å; L135-A138 PolarHBondContact O-N 3.23Å; A138-Q142 CarbonylContact O-C 3.59Å; A138-Q142 WeakPolarHBondContact O-CA 3.41Å; A138-Q142 PolarHBondContact O-N 3.24Å; A138-F143 HydrophobicContact CB-CB 4.22Å; A138-F143 PolarHBondContact O-N 2.92Å; A138-M146 HydrophobicContact CB-CB 3.9Å; A138-V147 HydrophobicContact CB-CG2 3.85Å
139	S	91.7	Very high	91.5	Very high	27 Å²	27	54.2 Å²	54.2	19%	0.189	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-48.1	173.2	-175.5	0	0	0	0	111	L135 A137 F141 Q142 H173	L135-S139 VanDerWaalsContact O-CB 3.24Å; L135-S139 WeakPolarHBondContact O-CB 2.92Å; L135-S139 PolarHBondContact O-N 3.47Å; A137-S139 VanDerWaalsContact C-N 3.33Å; A137-S139 PolarHBondContact O-N 2.94Å; S139-F141 PolarHBondContact O-N 3.16Å; S139-Q142 PolarHBondContact O-N 2.92Å; S139-Q142 VanDerWaalsContact O-N 3.16Å; S139-Q142 PolarHBondContact O-NE2 2.73Å; S139-H173 WeakPolarHBondContact CB-ND1 3.2Å; S139-H173 PolarHBondContact OG-ND1 3.09Å
140	L	90.9	Very high	91.7	Very high	88 Å²	88	45.5 Å²	45.5	46%	0.461	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-47.9	178.7	-178.7	65.6	0	0	0	112.2	V107 E136 A137 Q142	V107-L140 HydrophobicContact CG2-CD2 4.12Å; E136-L140 WeakPolarHBondContact O-CB 3.34Å; E136-L140 PolarHBondContact O-N 3.39Å; A137-L140 PolarHBondContact O-N 3.29Å; L140-Q142 VanDerWaalsContact C-N 3.3Å; L140-Q142 PolarHBondContact O-N 3.24Å
141	F	91.2	Very high	91.8	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.013	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	11.7	179.8	-59.6	-53.8	0	0	0	113.7	S83 Y85 F86 L104 V107 M112 L115 A137 S139 F143	S83-F141 WeakPolarHBondContact CB-O 3.44Å; S83-F141 PolarHBondContact OG-O 2.98Å; Y85-F141 WeakPolarHBondContact CB-O 3.49Å; Y85-F141 AromaticContact CD1-CD1 3.59Å; Y85-F141 HydrophobicContact CD1-CD1 3.59Å; Y85-F141 HydrophobicContact CD1-CE1 4.29Å; Y85-F141 AromaticContact CE1-CD1 3.59Å; Y85-F141 HydrophobicContact CE1-CD1 3.59Å; Y85-F141 AromaticContact CE1-CE1 3.82Å; Y85-F141 HydrophobicContact CE1-CE1 3.82Å; Y85-F141 HydrophobicContact CG-CD1 4.14Å; F86-F141 HydrophobicContact CE2-CB 4.49Å; F86-F141 HydrophobicContact CZ-CD1 4.29Å; L104-F141 HydrophobicContact CD1-CE1 4.48Å; L104-F141 HydrophobicContact CD1-CZ 4.25Å; L104-F141 HydrophobicContact CD2-CE1 4.28Å; V107-F141 HydrophobicContact CB-CE2 4.16Å; V107-F141 HydrophobicContact CB-CZ 4.48Å; V107-F141 HydrophobicContact CG1-CE2 4.38Å; V107-F141 HydrophobicContact CG2-CD2 4.46Å; V107-F141 HydrophobicContact CG2-CE2 3.49Å; V107-F141 VanDerWaalsContact CG2-CE2 3.49Å; V107-F141 HydrophobicContact CG2-CZ 3.84Å; M112-F141 HydrophobicContact CE-CD2 4.44Å; M112-F141 HydrophobicContact CE-CE2 3.46Å; M112-F141 VanDerWaalsContact CE-CE2 3.46Å; M112-F141 HydrophobicContact CE-CZ 3.67Å; L115-F141 HydrophobicContact CD1-CD2 3.61Å; L115-F141 HydrophobicContact CD1-CE2 4.01Å; A137-F141 HydrophobicContact CB-CD2 4.46Å; A137-F141 WeakPolarHBondContact O-CB 3.27Å; A137-F141 VanDerWaalsContact O-CD2 3.23Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.38Å; S139-F141 PolarHBondContact O-N 3.16Å; F141-F143 HydrophobicContact CB-CD2 3.74Å; F141-F143 HydrophobicContact CB-CE2 3.72Å; F141-F143 PolarHBondContact O-N 3.17Å
142	Q	91.9	Very high	91.8	Very high	88 Å²	88	47.6 Å²	47.6	41%	0.411	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	37.4	171.8	-59.5	-70.7	-62.2	0	0	114.9	N84 A138 S139 L140 L144	N84-Q142 HydrophobicContact CB-CB 4.41Å; A138-Q142 CarbonylContact O-C 3.59Å; A138-Q142 WeakPolarHBondContact O-CA 3.41Å; A138-Q142 PolarHBondContact O-N 3.24Å; S139-Q142 PolarHBondContact O-N 2.92Å; S139-Q142 VanDerWaalsContact O-N 3.16Å; S139-Q142 PolarHBondContact O-NE2 2.73Å; L140-Q142 VanDerWaalsContact C-N 3.3Å; L140-Q142 PolarHBondContact O-N 3.24Å; Q142-L144 PolarHBondContact O-N 2.76Å
143	F	92.3	Very high	92	Very high	9 Å²	9	45.6 Å²	45.6	4%	0.039	23%	0.23	C	C	.	.			trans	-88.9	74.7	170.7	-70.6	-76.9	0	0	0	111.5	A82 S83 F86 L115 T119 A138 F141 R145 M146 V147	A82-F143 HydrophobicContact CB-CE1 3.93Å; S83-F143 VanDerWaalsContact CB-CE1 3.49Å; F86-F143 HydrophobicContact CD2-CZ 4.32Å; F86-F143 HydrophobicContact CE2-CE2 4.09Å; F86-F143 HydrophobicContact CE2-CZ 4.07Å; L115-F143 HydrophobicContact CD2-CD2 4.02Å; L115-F143 HydrophobicContact CD2-CE2 4.32Å; T119-F143 HydrophobicContact CG2-CE1 3.43Å; T119-F143 VanDerWaalsContact CG2-CE1 3.43Å; T119-F143 HydrophobicContact CG2-CZ 3.52Å; A138-F143 HydrophobicContact CB-CB 4.22Å; A138-F143 PolarHBondContact O-N 2.92Å; F141-F143 HydrophobicContact CB-CD2 3.74Å; F141-F143 HydrophobicContact CB-CE2 3.72Å; F141-F143 PolarHBondContact O-N 3.17Å; F143-R145 VanDerWaalsContact C-N 3.28Å; F143-R145 PolarHBondContact O-N 3.42Å; F143-M146 HydrophobicContact CB-CB 4.2Å; F143-M146 HydrophobicContact CB-CE 3.22Å; F143-M146 HydrophobicContact CB-CG 4.38Å; F143-M146 HydrophobicContact CD1-CE 3.39Å; F143-M146 HydrophobicContact CD2-CE 3.5Å; F143-M146 HydrophobicContact CE1-CE 4.02Å; F143-M146 HydrophobicContact CE2-CE 4.12Å; F143-M146 HydrophobicContact CG-CE 3.09Å; F143-M146 HydrophobicContact CZ-CE 4.34Å; F143-M146 PolarHBondContact O-N 3.37Å; F143-V147 PolarHBondContact O-N 2.94Å; F143-V147 VanDerWaalsContact O-N 3.12Å
144	L	90.1	Very high	92	Very high	99 Å²	99	41.2 Å²	41.2	52%	0.518	21%	0.212	S	C	.	.	H	α-helix	trans	-57.3	-36.3	-170.8	-55.9	-179.7	0	0	0	114	Q142 M146 V147 D148	Q142-L144 PolarHBondContact O-N 2.76Å; L144-M146 VanDerWaalsContact C-N 3.33Å; L144-M146 PolarHBondContact O-N 3.4Å; L144-V147 WeakPolarHBondContact O-CB 3.44Å; L144-V147 PolarHBondContact O-N 3.33Å; L144-D148 PolarHBondContact O-N 3Å
145	R	91.7	Very high	92	Very high	189 Å²	189	43.3 Å²	43.3	71%	0.713	23%	0.225	S	C	*	.	H	α-helix	trans	-65.3	-34.8	177.2	-67.5	-63	-143.7	-154.9	4.1	113.3	Y118 F143 A149	Y118-R145 WeakPolarHBondContact OH-CB 3.12Å; F143-R145 VanDerWaalsContact C-N 3.28Å; F143-R145 PolarHBondContact O-N 3.42Å; R145-A149 PolarHBondContact O-N 3.27Å; R145-A149 VanDerWaalsContact O-N 3.16Å
146	M	92.7	Very high	91.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-73.2	-36.5	175.1	-71.4	-165.9	-86.7	0	0	111	L115 Y118 M124 A138 F143 L144 A149 C150	L115-M146 HydrophobicContact CD2-CE 3.27Å; L115-M146 HydrophobicContact CD2-SD 3.76Å; L115-M146 HydrophobicContact CG-CE 4.48Å; Y118-M146 HydrophobicContact CD1-CE 3.25Å; Y118-M146 HydrophobicContact CD1-CG 3.68Å; Y118-M146 HydrophobicContact CD1-SD 3.29Å; Y118-M146 WeakPolarHBondContact CD1-SD 3.3Å; Y118-M146 HydrophobicContact CD2-CG 3.95Å; Y118-M146 HydrophobicContact CD2-SD 3.94Å; Y118-M146 HydrophobicContact CE1-CE 3.72Å; Y118-M146 HydrophobicContact CE1-CG 3.56Å; Y118-M146 HydrophobicContact CE1-SD 3.84Å; Y118-M146 HydrophobicContact CE2-CG 3.84Å; Y118-M146 HydrophobicContact CE2-SD 4.42Å; Y118-M146 HydrophobicContact CG-CE 3.92Å; Y118-M146 HydrophobicContact CG-CG 3.85Å; Y118-M146 HydrophobicContact CG-SD 3.32Å; M124-M146 HydrophobicContact CE-CB 4.03Å; M124-M146 HydrophobicContact CE-CG 3.95Å; M124-M146 HydrophobicContact CE-SD 4.32Å; M124-M146 HydrophobicContact SD-CB 4.37Å; M124-M146 HydrophobicContact SD-CG 4.04Å; M124-M146 HydrophobicContact SD-SD 3.61Å; M124-M146 VanDerWaalsContact SD-SD 3.61Å; A138-M146 HydrophobicContact CB-CB 3.9Å; F143-M146 HydrophobicContact CB-CB 4.2Å; F143-M146 HydrophobicContact CB-CE 3.22Å; F143-M146 HydrophobicContact CB-CG 4.38Å; F143-M146 HydrophobicContact CD1-CE 3.39Å; F143-M146 HydrophobicContact CD2-CE 3.5Å; F143-M146 HydrophobicContact CE1-CE 4.02Å; F143-M146 HydrophobicContact CE2-CE 4.12Å; F143-M146 HydrophobicContact CG-CE 3.09Å; F143-M146 HydrophobicContact CZ-CE 4.34Å; F143-M146 PolarHBondContact O-N 3.37Å; L144-M146 VanDerWaalsContact C-N 3.33Å; L144-M146 PolarHBondContact O-N 3.4Å; M146-A149 PolarHBondContact O-N 2.87Å; M146-C150 WeakPolarHBondContact O-CB 3.45Å; M146-C150 PolarHBondContact O-N 3.29Å; M146-C150 PolarHBondContact O-SG 2.77Å
147	V	92.6	Very high	91.9	Very high	9 Å²	9	48.6 Å²	48.6	6%	0.055	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-47.4	172.2	172.9	0	0	0	0	110.6	L135 A138 F143 L144 A149 C150 A151 L175	L135-V147 HydrophobicContact CD1-CB 4.31Å; L135-V147 HydrophobicContact CD1-CG1 3.91Å; L135-V147 HydrophobicContact CD1-CG2 4.33Å; A138-V147 HydrophobicContact CB-CG2 3.85Å; F143-V147 PolarHBondContact O-N 2.94Å; F143-V147 VanDerWaalsContact O-N 3.12Å; L144-V147 WeakPolarHBondContact O-CB 3.44Å; L144-V147 PolarHBondContact O-N 3.33Å; V147-A149 VanDerWaalsContact C-N 3.34Å; V147-A149 PolarHBondContact O-N 3.16Å; V147-C150 PolarHBondContact O-N 2.87Å; V147-A151 WeakPolarHBondContact O-CB 3.29Å; V147-A151 PolarHBondContact O-N 3.47Å; V147-L175 HydrophobicContact CG1-CD2 3.38Å
148	D	91.4	Very high	91.9	Very high	89 Å²	89	49.7 Å²	49.7	48%	0.476	26%	0.258	S	S	.	.	H	α-helix	trans	-61.3	-40	177.1	-66.9	-26.4	0	0	0	112.7	L144 A151 S152	L144-D148 PolarHBondContact O-N 3Å; D148-A151 PolarHBondContact O-N 3.19Å; D148-S152 PolarHBondContact O-N 3.3Å; D148-S152 PolarHBondContact O-OG 3.33Å
149	A	92.7	Very high	91.8	Very high	40 Å²	40	53 Å²	53	33%	0.331	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-42.4	177.1	0	0	0	0	0	112	M124 I126 R145 M146 V147 S152 F153	M124-A149 HydrophobicContact CE-CB 4.29Å; I126-A149 HydrophobicContact CD1-CB 3.96Å; R145-A149 PolarHBondContact O-N 3.27Å; R145-A149 VanDerWaalsContact O-N 3.16Å; M146-A149 PolarHBondContact O-N 2.87Å; V147-A149 VanDerWaalsContact C-N 3.34Å; V147-A149 PolarHBondContact O-N 3.16Å; A149-S152 PolarHBondContact O-N 3.42Å; A149-F153 PolarHBondContact O-N 3.23Å
150	C	93.3	Very high	91.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-41.7	174.7	-66.4	0	0	0	0	111.3	V131 L135 M146 V147 F153 L154	V131-C150 HydrophobicContact CG2-CB 4.07Å; L135-C150 HydrophobicContact CB-CB 4.16Å; L135-C150 HydrophobicContact CD1-CB 3.88Å; M146-C150 WeakPolarHBondContact O-CB 3.45Å; M146-C150 PolarHBondContact O-N 3.29Å; M146-C150 PolarHBondContact O-SG 2.77Å; V147-C150 PolarHBondContact O-N 2.87Å; C150-F153 PolarHBondContact O-N 3.16Å; C150-L154 VanDerWaalsContact O-CG 3.32Å; C150-L154 WeakPolarHBondContact O-CG 3.49Å; C150-L154 PolarHBondContact O-N 2.9Å
151	A	92.4	Very high	91.6	Very high	10 Å²	10	53.1 Å²	53.1	8%	0.083	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-45.4	176.4	0	0	0	0	0	111.5	V147 D148 F153 L154 T155 L178	V147-A151 WeakPolarHBondContact O-CB 3.29Å; V147-A151 PolarHBondContact O-N 3.47Å; D148-A151 PolarHBondContact O-N 3.19Å; A151-F153 VanDerWaalsContact C-N 3.35Å; A151-F153 PolarHBondContact O-N 2.75Å; A151-L154 PolarHBondContact O-N 3.3Å; A151-T155 PolarHBondContact O-N 2.91Å; A151-T155 PolarHBondContact O-OG1 2.95Å; A151-T155 VanDerWaalsContact O-OG1 3.1Å; A151-L178 HydrophobicContact CB-CD2 4.38Å
152	S	92.4	Very high	91.5	Very high	68 Å²	68	54.7 Å²	54.7	48%	0.476	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.6	-58.6	0	0	0	0	112.2	D148 A149 L154 T155 E156	D148-S152 PolarHBondContact O-N 3.3Å; D148-S152 PolarHBondContact O-OG 3.33Å; A149-S152 PolarHBondContact O-N 3.42Å; S152-L154 PolarHBondContact O-N 3.43Å; S152-T155 WeakPolarHBondContact O-CB 3.24Å; S152-T155 PolarHBondContact O-N 3.17Å; S152-E156 PolarHBondContact O-N 3.27Å; S152-E156 VanDerWaalsContact O-N 3.09Å
153	F	93.4	Very high	91.5	Very high	55 Å²	55	50.5 Å²	50.5	24%	0.241	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-41.6	176.1	179.1	-92.6	0	0	0	112.3	I126 K128 V131 A149 C150 A151 T155 E156 A157	I126-F153 HydrophobicContact CB-CD2 4.44Å; I126-F153 HydrophobicContact CB-CG 4.42Å; I126-F153 HydrophobicContact CD1-CB 4.45Å; I126-F153 HydrophobicContact CG2-CB 4.07Å; I126-F153 HydrophobicContact CG2-CD1 3.7Å; I126-F153 HydrophobicContact CG2-CD2 4.11Å; I126-F153 HydrophobicContact CG2-CE1 4.13Å; I126-F153 HydrophobicContact CG2-CG 3.68Å; K128-F153 HydrophobicContact CG-CE1 4.4Å; K128-F153 HydrophobicContact CG-CZ 4.2Å; V131-F153 HydrophobicContact CB-CD1 4.22Å; V131-F153 HydrophobicContact CB-CE1 4.33Å; V131-F153 HydrophobicContact CG1-CE1 4.35Å; V131-F153 HydrophobicContact CG2-CD1 3.95Å; A149-F153 PolarHBondContact O-N 3.23Å; C150-F153 PolarHBondContact O-N 3.16Å; A151-F153 VanDerWaalsContact C-N 3.35Å; A151-F153 PolarHBondContact O-N 2.75Å; F153-T155 VanDerWaalsContact C-N 3.34Å; F153-E156 PolarHBondContact O-N 3.49Å; F153-A157 VanDerWaalsContact O-CB 3.3Å; F153-A157 WeakPolarHBondContact O-CB 2.99Å; F153-A157 PolarHBondContact O-N 3.15Å
154	L	92.5	Very high	91.3	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-37.3	177	-70.7	174.4	0	0	0	111.9	V131 L135 C150 A151 S152 A157 L158 I166 L178	V131-L154 HydrophobicContact CG1-CD2 3.85Å; V131-L154 HydrophobicContact CG2-CD1 4.33Å; V131-L154 HydrophobicContact CG2-CD2 3.88Å; V131-L154 HydrophobicContact CG2-CG 3.89Å; L135-L154 HydrophobicContact CD2-CD1 3.97Å; C150-L154 VanDerWaalsContact O-CG 3.32Å; C150-L154 WeakPolarHBondContact O-CG 3.49Å; C150-L154 PolarHBondContact O-N 2.9Å; A151-L154 PolarHBondContact O-N 3.3Å; S152-L154 PolarHBondContact O-N 3.43Å; L154-A157 CarbonylContact O-C 3.45Å; L154-A157 PolarHBondContact O-N 3.42Å; L154-L158 PolarHBondContact O-N 3.08Å; L154-I166 HydrophobicContact CB-CG2 4.13Å; L154-I166 HydrophobicContact CD1-CG2 4.45Å; L154-I166 HydrophobicContact CD2-CD1 4.32Å; L154-I166 HydrophobicContact CD2-CG1 4.23Å; L154-L178 HydrophobicContact CB-CD1 4.3Å; L154-L178 HydrophobicContact CB-CD2 4.24Å; L154-L178 HydrophobicContact CD1-CD2 3.97Å
155	T	91.4	Very high	91.3	Very high	43 Å²	43	47 Å²	47	26%	0.264	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-44.8	174.4	-60.1	0	0	0	0	111.8	A151 S152 F153 A157 L158 L178 Q181	A151-T155 PolarHBondContact O-N 2.91Å; A151-T155 PolarHBondContact O-OG1 2.95Å; A151-T155 VanDerWaalsContact O-OG1 3.1Å; S152-T155 WeakPolarHBondContact O-CB 3.24Å; S152-T155 PolarHBondContact O-N 3.17Å; F153-T155 VanDerWaalsContact C-N 3.34Å; T155-A157 VanDerWaalsContact C-N 3.27Å; T155-A157 PolarHBondContact O-N 2.96Å; T155-L158 HydrophobicContact CG2-CD1 4.43Å; T155-L158 WeakPolarHBondContact O-CD1 3.13Å; T155-L158 WeakPolarHBondContact O-CG 3.42Å; T155-L158 PolarHBondContact O-N 3.34Å; T155-L178 VanDerWaalsContact OG1-CD1 3.28Å; T155-L178 WeakPolarHBondContact OG1-CD1 3.37Å; T155-Q181 PolarHBondContact OG1-OE1 2.95Å
156	E	90.4	Very high	91.2	Very high	169 Å²	169	38.3 Å²	38.3	79%	0.79	22%	0.217	S	C	*	.	H	α-helix	trans	-68.7	-27.7	177.6	-70.1	179.9	-174.7	0	0	112.6	S152 F153	S152-E156 PolarHBondContact O-N 3.27Å; S152-E156 VanDerWaalsContact O-N 3.09Å; F153-E156 PolarHBondContact O-N 3.49Å
157	A	90.3	Very high	91.2	Very high	20 Å²	20	38.4 Å²	38.4	17%	0.165	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	14.1	-180	0	0	0	0	0	114.3	F153 L154 T155 Q159 N162	F153-A157 VanDerWaalsContact O-CB 3.3Å; F153-A157 WeakPolarHBondContact O-CB 2.99Å; F153-A157 PolarHBondContact O-N 3.15Å; L154-A157 CarbonylContact O-C 3.45Å; L154-A157 PolarHBondContact O-N 3.42Å; T155-A157 VanDerWaalsContact C-N 3.27Å; T155-A157 PolarHBondContact O-N 2.96Å; A157-Q159 PolarHBondContact O-N 3.07Å; A157-N162 PolarHBondContact O-ND2 3.16Å
158	L	91.7	Very high	91	Very high	26 Å²	26	44.5 Å²	44.5	14%	0.136	24%	0.239	C	C	.	.			trans	-65	123.2	180	-76.2	169.8	0	0	0	112.1	L154 T155 I166 V182 Y185	L154-L158 PolarHBondContact O-N 3.08Å; T155-L158 HydrophobicContact CG2-CD1 4.43Å; T155-L158 WeakPolarHBondContact O-CD1 3.13Å; T155-L158 WeakPolarHBondContact O-CG 3.42Å; T155-L158 PolarHBondContact O-N 3.34Å; L158-I166 HydrophobicContact CD2-CB 4.43Å; L158-I166 HydrophobicContact CD2-CD1 3.73Å; L158-I166 HydrophobicContact CD2-CG2 4.26Å; L158-V182 HydrophobicContact CD1-CG2 4.49Å; L158-V182 HydrophobicContact CD2-CG2 3.79Å; L158-Y185 HydrophobicContact CB-CD2 4.26Å; L158-Y185 HydrophobicContact CB-CE2 4.26Å; L158-Y185 HydrophobicContact CB-CG 4.47Å; L158-Y185 HydrophobicContact CD1-CG 4.47Å
159	Q	90.8	Very high	90.8	Very high	69 Å²	69	41.5 Å²	41.5	32%	0.322	22%	0.223	S	C	.	.			trans	-134	157.4	177.3	-59	-177	-90.6	0	0	109.6	A157 E161 N162 C163	A157-Q159 PolarHBondContact O-N 3.07Å; Q159-E161 HydrophobicContact CB-CG 4.08Å; Q159-E161 PolarHBondContact O-N 3.3Å; Q159-N162 PolarHBondContact N-OD1 3.35Å; Q159-N162 PolarHBondContact O-N 3.23Å; Q159-N162 VanDerWaalsContact O-N 3.17Å; Q159-N162 PolarHBondContact O-OD1 3.45Å; Q159-C163 PolarHBondContact O-N 3.32Å; Q159-C163 VanDerWaalsContact O-N 3.16Å
160	P	88.6	Confident	90.8	Very high	22 Å²	22	39.6 Å²	39.6	14%	0.143	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.9	-179	-25	36.4	0	0	0	113.1	C163 Y185 Q192 V193 Y196	P160-C163 PolarHBondContact O-SG 2.86Å; P160-Y185 VanDerWaalsContact CD-OH 3.25Å; P160-Y185 WeakPolarHBondContact CD-OH 3.4Å; P160-Q192 HydrophobicContact CB-CB 4.33Å; P160-Q192 HydrophobicContact CG-CB 4.34Å; P160-V193 HydrophobicContact CB-CG2 4.24Å; P160-Y196 HydrophobicContact CB-CD2 4.27Å; P160-Y196 HydrophobicContact CB-CE2 3.73Å
161	E	89.8	Confident	90.6	Very high	96 Å²	96	43.3 Å²	43.3	45%	0.449	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-20.5	-179.5	63.8	-174	-161.7	0	0	114.9	Q159 Y196 E198	Q159-E161 HydrophobicContact CB-CG 4.08Å; Q159-E161 PolarHBondContact O-N 3.3Å; E161-Y196 HydrophobicContact CB-CD1 3.98Å; E161-Y196 HydrophobicContact CB-CE1 3.64Å; E161-E198 VanDerWaalsContact O-OE2 3.07Å
162	N	89.8	Confident	90.4	Very high	37 Å²	37	46.4 Å²	46.4	20%	0.198	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-6.3	-173.8	71.4	14.3	0	0	0	113.8	A157 Q159 V164 G165 I166	A157-N162 PolarHBondContact O-ND2 3.16Å; Q159-N162 PolarHBondContact N-OD1 3.35Å; Q159-N162 PolarHBondContact O-N 3.23Å; Q159-N162 VanDerWaalsContact O-N 3.17Å; Q159-N162 PolarHBondContact O-OD1 3.45Å; N162-V164 VanDerWaalsContact C-N 3.31Å; N162-V164 PolarHBondContact O-N 3.34Å; N162-G165 PolarHBondContact O-N 3.19Å; N162-I166 HydrophobicContact CB-CD1 4.36Å; N162-I166 WeakPolarHBondContact O-CG1 3.27Å; N162-I166 PolarHBondContact O-N 2.93Å; N162-I166 WeakPolarHBondContact OD1-CD1 3.44Å
163	C	90.3	Very high	90.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-37.7	-171.9	64.1	0	0	0	0	112.7	Q159 P160 I166 L167 V182 Y185 I186	Q159-C163 PolarHBondContact O-N 3.32Å; Q159-C163 VanDerWaalsContact O-N 3.16Å; P160-C163 PolarHBondContact O-SG 2.86Å; C163-I166 PolarHBondContact O-N 3.46Å; C163-L167 WeakPolarHBondContact O-CB 3.37Å; C163-L167 PolarHBondContact O-N 3.46Å; C163-V182 HydrophobicContact CB-CG1 4.32Å; C163-V182 VanDerWaalsContact O-CG1 3.24Å; C163-V182 WeakPolarHBondContact O-CG1 3.48Å; C163-Y185 HydrophobicContact CB-CD1 4.15Å; C163-Y185 HydrophobicContact CB-CE1 4.33Å; C163-I186 HydrophobicContact CB-CG1 4.28Å
164	V	89.2	Confident	89.9	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-71	-41.4	178.4	-176.4	0	0	0	0	111.1	N162 L167 R168 E198 L202	N162-V164 VanDerWaalsContact C-N 3.31Å; N162-V164 PolarHBondContact O-N 3.34Å; V164-L167 WeakPolarHBondContact O-CB 3.33Å; V164-L167 PolarHBondContact O-N 3.06Å; V164-R168 WeakPolarHBondContact O-CG 3.48Å; V164-R168 PolarHBondContact O-N 3.3Å; V164-E198 HydrophobicContact CB-CB 4.16Å; V164-E198 WeakPolarHBondContact CG1-O 3.47Å; V164-E198 HydrophobicContact CG2-CB 4.35Å; V164-L202 HydrophobicContact CG1-CD2 3.9Å; V164-L202 HydrophobicContact CG1-CG 4.16Å; V164-L202 HydrophobicContact CG2-CD2 4.13Å; V164-L202 HydrophobicContact CG2-CG 4.17Å
165	G	89	Confident	89.7	Confident	30 Å²	30	47 Å²	47	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-57.8	-47.8	172.4	0	0	0	0	0	112.4	N162 L167 R168 L169	N162-G165 PolarHBondContact O-N 3.19Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3.42Å; G165-R168 PolarHBondContact O-N 3.08Å; G165-L169 WeakPolarHBondContact O-CG 3.39Å; G165-L169 PolarHBondContact O-N 3.2Å
166	I	90.9	Very high	89.6	Confident	8 Å²	8	51.5 Å²	51.5	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-38.5	178	-64	171.4	0	0	0	111.2	L154 L158 N162 C163 R168 L169 A170 L178 V182	L154-I166 HydrophobicContact CB-CG2 4.13Å; L154-I166 HydrophobicContact CD1-CG2 4.45Å; L154-I166 HydrophobicContact CD2-CD1 4.32Å; L154-I166 HydrophobicContact CD2-CG1 4.23Å; L158-I166 HydrophobicContact CD2-CB 4.43Å; L158-I166 HydrophobicContact CD2-CD1 3.73Å; L158-I166 HydrophobicContact CD2-CG2 4.26Å; N162-I166 HydrophobicContact CB-CD1 4.36Å; N162-I166 WeakPolarHBondContact O-CG1 3.27Å; N162-I166 PolarHBondContact O-N 2.93Å; N162-I166 WeakPolarHBondContact OD1-CD1 3.44Å; C163-I166 PolarHBondContact O-N 3.46Å; I166-R168 PolarHBondContact O-N 3.45Å; I166-L169 PolarHBondContact O-N 2.9Å; I166-A170 WeakPolarHBondContact O-CB 3.26Å; I166-A170 PolarHBondContact O-N 3.38Å; I166-L178 HydrophobicContact CG2-CD1 4.14Å; I166-L178 HydrophobicContact CG2-CD2 3.99Å; I166-L178 HydrophobicContact CG2-CG 4.16Å; I166-V182 HydrophobicContact CB-CG2 4.44Å; I166-V182 HydrophobicContact CG2-CG2 3.74Å
167	L	91.4	Very high	89.6	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-44.5	174.6	-176.4	71.9	0	0	0	111.9	C163 V164 G165 L169 A170 D171 K179 V182 Q183 I186 L202 V206	C163-L167 WeakPolarHBondContact O-CB 3.37Å; C163-L167 PolarHBondContact O-N 3.46Å; V164-L167 WeakPolarHBondContact O-CB 3.33Å; V164-L167 PolarHBondContact O-N 3.06Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3.42Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-A170 WeakPolarHBondContact O-CB 3.4Å; L167-A170 PolarHBondContact O-N 3.34Å; L167-D171 PolarHBondContact O-N 3.03Å; L167-K179 HydrophobicContact CD1-CG 3.8Å; L167-V182 HydrophobicContact CB-CG1 3.85Å; L167-V182 HydrophobicContact CD1-CB 4.29Å; L167-V182 HydrophobicContact CD1-CG1 4.12Å; L167-Q183 HydrophobicContact CD1-CG 4.17Å; L167-I186 HydrophobicContact CD2-CD1 4.42Å; L167-L202 HydrophobicContact CD2-CD2 3.43Å; L167-L202 VanDerWaalsContact CD2-CD2 3.43Å; L167-V206 HydrophobicContact CD2-CB 4.24Å; L167-V206 HydrophobicContact CD2-CG1 3.65Å; L167-V206 HydrophobicContact CD2-CG2 4.19Å
168	R	89.1	Confident	89.7	Confident	136 Å²	136	46 Å²	46	51%	0.513	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-40	178.3	-71.4	176.8	64.6	177.2	-2	111.7	V164 G165 I166 D171 A172 E201	V164-R168 WeakPolarHBondContact O-CG 3.48Å; V164-R168 PolarHBondContact O-N 3.3Å; G165-R168 PolarHBondContact O-N 3.08Å; I166-R168 PolarHBondContact O-N 3.45Å; R168-D171 PolarHBondContact O-N 3.16Å; R168-A172 WeakPolarHBondContact O-CB 3.37Å; R168-A172 PolarHBondContact O-N 2.72Å; R168-E201 IonicContact NH1-OE2 2.92Å; R168-E201 PolarHBondContact NH1-OE2 3.3Å
169	L	88.4	Confident	89.6	Confident	27 Å²	27	46.3 Å²	46.3	14%	0.141	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-43.7	173.8	-70.3	173	0	0	0	111.5	Q132 G165 I166 L167 D171 A172 H173	Q132-L169 HydrophobicContact CB-CD1 4.39Å; Q132-L169 HydrophobicContact CG-CD1 4.18Å; Q132-L169 HydrophobicContact CG-CD2 3.83Å; G165-L169 WeakPolarHBondContact O-CG 3.39Å; G165-L169 PolarHBondContact O-N 3.2Å; I166-L169 PolarHBondContact O-N 2.9Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L169-D171 VanDerWaalsContact C-N 3.29Å; L169-D171 PolarHBondContact O-N 2.9Å; L169-A172 PolarHBondContact O-N 2.81Å; L169-H173 PolarHBondContact O-CD2 3.23Å; L169-H173 VanDerWaalsContact O-CD2 3.27Å; L169-H173 PolarHBondContact O-N 3.18Å; L169-H173 VanDerWaalsContact O-N 3.1Å
170	A	91.1	Very high	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-40.8	176.5	0	0	0	0	0	111.6	I166 L167 S174 L175 L178 K179	I166-A170 WeakPolarHBondContact O-CB 3.26Å; I166-A170 PolarHBondContact O-N 3.38Å; L167-A170 WeakPolarHBondContact O-CB 3.4Å; L167-A170 PolarHBondContact O-N 3.34Å; A170-S174 CarbonylContact O-C 3.5Å; A170-S174 PolarHBondContact O-N 3.12Å; A170-L175 HydrophobicContact CB-CB 4.17Å; A170-L175 PolarHBondContact O-N 3Å; A170-L178 HydrophobicContact CB-CB 4.17Å; A170-L178 HydrophobicContact CB-CD2 3.99Å; A170-L178 HydrophobicContact CB-CG 4.02Å; A170-K179 HydrophobicContact CB-CB 4.19Å
171	D	89.3	Confident	89.7	Confident	77 Å²	77	52.2 Å²	52.2	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-70.4	-45.3	178.6	-153	46.1	0	0	0	112.2	L167 R168 L169 H173 S174 K179	L167-D171 PolarHBondContact O-N 3.03Å; R168-D171 PolarHBondContact O-N 3.16Å; L169-D171 VanDerWaalsContact C-N 3.29Å; L169-D171 PolarHBondContact O-N 2.9Å; D171-H173 PolarHBondContact O-N 3Å; D171-S174 PolarHBondContact O-N 2.79Å; D171-S174 VanDerWaalsContact O-N 3.12Å; D171-K179 IonicContact OD1-NZ 2.79Å; D171-K179 PolarHBondContact OD1-NZ 3.49Å
172	A	88	Confident	89.9	Confident	75 Å²	75	47.7 Å²	47.7	62%	0.62	26%	0.26	S	S	*	.	H	α-helix	trans	-59.1	-34.6	178.6	0	0	0	0	0	112.9	R168 L169	R168-A172 WeakPolarHBondContact O-CB 3.37Å; R168-A172 PolarHBondContact O-N 2.72Å; L169-A172 PolarHBondContact O-N 2.81Å
173	H	87.4	Confident	89.9	Confident	39 Å²	39	47.7 Å²	47.7	18%	0.181	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	10.5	179.3	-63	-64.1	0	0	0	114.1	E136 S139 L169 D171 L175	E136-H173 VanDerWaalsContact CG-NE2 3.29Å; E136-H173 WeakPolarHBondContact CG-NE2 3.49Å; S139-H173 WeakPolarHBondContact CB-ND1 3.2Å; S139-H173 PolarHBondContact OG-ND1 3.09Å; L169-H173 PolarHBondContact O-CD2 3.23Å; L169-H173 VanDerWaalsContact O-CD2 3.27Å; L169-H173 PolarHBondContact O-N 3.18Å; L169-H173 VanDerWaalsContact O-N 3.1Å; D171-H173 PolarHBondContact O-N 3Å; H173-L175 VanDerWaalsContact C-N 3.26Å; H173-L175 HydrophobicContact CB-CD1 4.32Å; H173-L175 HydrophobicContact CB-CD2 4.47Å; H173-L175 HydrophobicContact CB-CG 4Å; H173-L175 PolarHBondContact O-N 2.93Å
174	S	88.3	Confident	90	Very high	83 Å²	83	50.6 Å²	50.6	58%	0.58	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	36.2	179.4	-56.8	0	0	0	0	114.3	A170 D171 H176	A170-S174 CarbonylContact O-C 3.5Å; A170-S174 PolarHBondContact O-N 3.12Å; D171-S174 PolarHBondContact O-N 2.79Å; D171-S174 VanDerWaalsContact O-N 3.12Å; S174-H176 PolarHBondContact O-CD2 2.89Å; S174-H176 PolarHBondContact O-N 3.41Å; S174-H176 VanDerWaalsContact O-N 3.16Å
175	L	89.1	Confident	90.1	Very high	23 Å²	23	52.7 Å²	52.7	12%	0.12	29%	0.287	C	S	.	.			trans	-83.6	83.8	177.4	-53.8	178.5	0	0	0	110.8	L135 V147 A170 H173 S177 L178 K179	L135-L175 HydrophobicContact CD1-CD1 4.01Å; L135-L175 HydrophobicContact CD2-CD1 3.98Å; V147-L175 HydrophobicContact CG1-CD2 3.38Å; A170-L175 HydrophobicContact CB-CB 4.17Å; A170-L175 PolarHBondContact O-N 3Å; H173-L175 VanDerWaalsContact C-N 3.26Å; H173-L175 HydrophobicContact CB-CD1 4.32Å; H173-L175 HydrophobicContact CB-CD2 4.47Å; H173-L175 HydrophobicContact CB-CG 4Å; H173-L175 PolarHBondContact O-N 2.93Å; L175-S177 PolarHBondContact O-N 3.34Å; L175-L178 HydrophobicContact CB-CB 4.1Å; L175-L178 HydrophobicContact CD1-CD2 4.02Å; L175-L178 PolarHBondContact O-N 3.49Å; L175-K179 WeakPolarHBondContact O-CB 3.13Å; L175-K179 PolarHBondContact O-N 3Å
176	H	89.2	Confident	90.3	Very high	138 Å²	138	51.3 Å²	51.3	64%	0.639	27%	0.272	S	S	*	.	H	α-helix	trans	-63	-38.6	-174.7	-63	-63.3	0	0	0	114.4	S174 K179 Q180	S174-H176 PolarHBondContact O-CD2 2.89Å; S174-H176 PolarHBondContact O-N 3.41Å; S174-H176 VanDerWaalsContact O-N 3.16Å; H176-K179 PolarHBondContact O-N 3.46Å; H176-Q180 WeakPolarHBondContact O-CG 3.34Å; H176-Q180 PolarHBondContact O-N 3.08Å; H176-Q180 VanDerWaalsContact O-N 3.12Å
177	S	89.8	Confident	90.3	Very high	73 Å²	73	52.1 Å²	52.1	51%	0.51	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-44.3	-179.3	69.7	0	0	0	0	111.8	L175 Q180 Q181	L175-S177 PolarHBondContact O-N 3.34Å; S177-Q180 PolarHBondContact O-N 2.94Å; S177-Q181 WeakPolarHBondContact O-CG 3.18Å; S177-Q181 PolarHBondContact O-N 3.01Å
178	L	91.8	Very high	90.2	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-43.6	176.6	-177.2	61.4	0	0	0	110.5	A151 L154 T155 I166 A170 L175 Q180 Q181 V182	A151-L178 HydrophobicContact CB-CD2 4.38Å; L154-L178 HydrophobicContact CB-CD1 4.3Å; L154-L178 HydrophobicContact CB-CD2 4.24Å; L154-L178 HydrophobicContact CD1-CD2 3.97Å; T155-L178 VanDerWaalsContact OG1-CD1 3.28Å; T155-L178 WeakPolarHBondContact OG1-CD1 3.37Å; I166-L178 HydrophobicContact CG2-CD1 4.14Å; I166-L178 HydrophobicContact CG2-CD2 3.99Å; I166-L178 HydrophobicContact CG2-CG 4.16Å; A170-L178 HydrophobicContact CB-CB 4.17Å; A170-L178 HydrophobicContact CB-CD2 3.99Å; A170-L178 HydrophobicContact CB-CG 4.02Å; L175-L178 HydrophobicContact CB-CB 4.1Å; L175-L178 HydrophobicContact CD1-CD2 4.02Å; L175-L178 PolarHBondContact O-N 3.49Å; L178-Q180 VanDerWaalsContact C-N 3.34Å; L178-Q180 PolarHBondContact O-N 3.48Å; L178-Q181 PolarHBondContact O-N 3.48Å; L178-V182 HydrophobicContact CD1-CG2 4.1Å; L178-V182 HydrophobicContact CG-CG2 4.23Å; L178-V182 WeakPolarHBondContact O-CG2 3.35Å; L178-V182 PolarHBondContact O-N 3.42Å
179	K	90.6	Very high	90.2	Very high	34 Å²	34	53.1 Å²	53.1	15%	0.148	29%	0.288	C	S	.	.	H	α-helix	trans	-55.3	-46.8	175.8	-174.6	171.8	-175.8	171.9	0	111.9	L167 A170 D171 L175 H176 V182 Q183 D205	L167-K179 HydrophobicContact CD1-CG 3.8Å; A170-K179 HydrophobicContact CB-CB 4.19Å; D171-K179 IonicContact OD1-NZ 2.79Å; D171-K179 PolarHBondContact OD1-NZ 3.49Å; L175-K179 WeakPolarHBondContact O-CB 3.13Å; L175-K179 PolarHBondContact O-N 3Å; H176-K179 PolarHBondContact O-N 3.46Å; K179-V182 PolarHBondContact O-N 3.05Å; K179-Q183 WeakPolarHBondContact O-CB 3.44Å; K179-Q183 VanDerWaalsContact O-CG 3.27Å; K179-Q183 WeakPolarHBondContact O-CG 3.35Å; K179-Q183 PolarHBondContact O-N 3.43Å; K179-D205 IonicContact NZ-OD2 3.85Å
180	Q	90.9	Very high	90.3	Very high	128 Å²	128	51.9 Å²	51.9	60%	0.598	28%	0.281	S	S	*	.	H	α-helix	trans	-65.3	-40.8	178.2	-73.7	179.4	-15.6	0	0	113	H176 S177 L178 Q183 S184	H176-Q180 WeakPolarHBondContact O-CG 3.34Å; H176-Q180 PolarHBondContact O-N 3.08Å; H176-Q180 VanDerWaalsContact O-N 3.12Å; S177-Q180 PolarHBondContact O-N 2.94Å; L178-Q180 VanDerWaalsContact C-N 3.34Å; L178-Q180 PolarHBondContact O-N 3.48Å; Q180-Q183 PolarHBondContact O-N 2.98Å; Q180-S184 WeakPolarHBondContact O-CB 3.44Å; Q180-S184 PolarHBondContact O-N 3.34Å; Q180-S184 PolarHBondContact O-OG 3.21Å
181	Q	90.8	Very high	90.2	Very high	87 Å²	87	53.9 Å²	53.9	41%	0.407	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-44.3	177.3	-71.9	174	-1	0	0	111.7	T155 S177 L178 S184 Y185	T155-Q181 PolarHBondContact OG1-OE1 2.95Å; S177-Q181 WeakPolarHBondContact O-CG 3.18Å; S177-Q181 PolarHBondContact O-N 3.01Å; L178-Q181 PolarHBondContact O-N 3.48Å; Q181-S184 PolarHBondContact O-N 3.47Å; Q181-Y185 PolarHBondContact O-N 3.48Å
182	V	92.8	Very high	90.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-43.6	176.5	178.4	0	0	0	0	111	L158 C163 I166 L167 L178 K179 S184 Y185 I186	L158-V182 HydrophobicContact CD1-CG2 4.49Å; L158-V182 HydrophobicContact CD2-CG2 3.79Å; C163-V182 HydrophobicContact CB-CG1 4.32Å; C163-V182 VanDerWaalsContact O-CG1 3.24Å; C163-V182 WeakPolarHBondContact O-CG1 3.48Å; I166-V182 HydrophobicContact CB-CG2 4.44Å; I166-V182 HydrophobicContact CG2-CG2 3.74Å; L167-V182 HydrophobicContact CB-CG1 3.85Å; L167-V182 HydrophobicContact CD1-CB 4.29Å; L167-V182 HydrophobicContact CD1-CG1 4.12Å; L178-V182 HydrophobicContact CD1-CG2 4.1Å; L178-V182 HydrophobicContact CG-CG2 4.23Å; L178-V182 WeakPolarHBondContact O-CG2 3.35Å; L178-V182 PolarHBondContact O-N 3.42Å; K179-V182 PolarHBondContact O-N 3.05Å; V182-S184 VanDerWaalsContact C-N 3.31Å; V182-S184 PolarHBondContact O-N 3.21Å; V182-Y185 WeakPolarHBondContact O-CB 3.39Å; V182-Y185 PolarHBondContact O-N 3.29Å; V182-I186 HydrophobicContact CG1-CD1 4.03Å; V182-I186 HydrophobicContact CG1-CG1 4.46Å; V182-I186 WeakPolarHBondContact O-CG1 3.47Å; V182-I186 PolarHBondContact O-N 2.94Å
183	Q	91.4	Very high	90.2	Very high	37 Å²	37	51.3 Å²	51.3	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-42.8	175.3	-77.4	177.3	-29.4	0	0	111.9	L167 K179 Q180 Y185 I186 I187 V206 S209	L167-Q183 HydrophobicContact CD1-CG 4.17Å; K179-Q183 WeakPolarHBondContact O-CB 3.44Å; K179-Q183 VanDerWaalsContact O-CG 3.27Å; K179-Q183 WeakPolarHBondContact O-CG 3.35Å; K179-Q183 PolarHBondContact O-N 3.43Å; Q180-Q183 PolarHBondContact O-N 2.98Å; Q183-Y185 VanDerWaalsContact C-N 3.32Å; Q183-Y185 PolarHBondContact O-N 3.13Å; Q183-I186 PolarHBondContact O-N 3.48Å; Q183-I187 VanDerWaalsContact O-CG1 3.29Å; Q183-I187 WeakPolarHBondContact O-CG1 3.45Å; Q183-I187 PolarHBondContact O-N 3.1Å; Q183-V206 HydrophobicContact CG-CG1 4.01Å; Q183-S209 PolarHBondContact NE2-OG 3.21Å
184	S	91.4	Very high	90.3	Very high	62 Å²	62	52 Å²	52	43%	0.434	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-38.4	177.2	-56.5	0	0	0	0	111.5	Q180 Q181 V182 I187 Q188	Q180-S184 WeakPolarHBondContact O-CB 3.44Å; Q180-S184 PolarHBondContact O-N 3.34Å; Q180-S184 PolarHBondContact O-OG 3.21Å; Q181-S184 PolarHBondContact O-N 3.47Å; V182-S184 VanDerWaalsContact C-N 3.31Å; V182-S184 PolarHBondContact O-N 3.21Å; S184-I187 PolarHBondContact O-N 3.47Å; S184-Q188 WeakPolarHBondContact O-CG 3.31Å; S184-Q188 PolarHBondContact O-N 3.02Å; S184-Q188 VanDerWaalsContact O-N 3.15Å
185	Y	92.3	Very high	90.3	Very high	47 Å²	47	54.4 Å²	54.4	18%	0.184	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-43.5	174.3	-177.8	-90.2	0	0	0	112.6	L158 P160 C163 Q181 V182 Q183 I187 Q188 N189	L158-Y185 HydrophobicContact CB-CD2 4.26Å; L158-Y185 HydrophobicContact CB-CE2 4.26Å; L158-Y185 HydrophobicContact CB-CG 4.47Å; L158-Y185 HydrophobicContact CD1-CG 4.47Å; P160-Y185 VanDerWaalsContact CD-OH 3.25Å; P160-Y185 WeakPolarHBondContact CD-OH 3.4Å; C163-Y185 HydrophobicContact CB-CD1 4.15Å; C163-Y185 HydrophobicContact CB-CE1 4.33Å; Q181-Y185 PolarHBondContact O-N 3.48Å; V182-Y185 WeakPolarHBondContact O-CB 3.39Å; V182-Y185 PolarHBondContact O-N 3.29Å; Q183-Y185 VanDerWaalsContact C-N 3.32Å; Q183-Y185 PolarHBondContact O-N 3.13Å; Y185-I187 VanDerWaalsContact C-N 3.32Å; Y185-I187 PolarHBondContact O-N 2.85Å; Y185-Q188 PolarHBondContact O-N 3.12Å; Y185-N189 HydrophobicContact CE1-CB 4.36Å; Y185-N189 WeakPolarHBondContact CE2-ND2 3.47Å; Y185-N189 PolarHBondContact O-N 3.41Å; Y185-N189 PolarHBondContact O-ND2 3.21Å
186	I	91.8	Very high	90.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-41.5	176.2	-67.3	167.3	0	0	0	110.4	C163 L167 V182 Q183 Q188 F190 T210	C163-I186 HydrophobicContact CB-CG1 4.28Å; L167-I186 HydrophobicContact CD2-CD1 4.42Å; V182-I186 HydrophobicContact CG1-CD1 4.03Å; V182-I186 HydrophobicContact CG1-CG1 4.46Å; V182-I186 WeakPolarHBondContact O-CG1 3.47Å; V182-I186 PolarHBondContact O-N 2.94Å; Q183-I186 PolarHBondContact O-N 3.48Å; I186-Q188 VanDerWaalsContact C-N 3.33Å; I186-Q188 PolarHBondContact O-N 2.94Å; I186-F190 HydrophobicContact CG2-CD2 4.33Å; I186-F190 WeakPolarHBondContact O-CA 3.37Å; I186-F190 WeakPolarHBondContact O-CB 3.4Å; I186-F190 PolarHBondContact O-N 3.44Å; I186-T210 HydrophobicContact CG2-CG2 3.97Å
187	I	91.3	Very high	90.1	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.128	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-44	177.4	-71.4	167.1	0	0	0	110.9	Q183 S184 Y185 T210 D215 Y217	Q183-I187 VanDerWaalsContact O-CG1 3.29Å; Q183-I187 WeakPolarHBondContact O-CG1 3.45Å; Q183-I187 PolarHBondContact O-N 3.1Å; S184-I187 PolarHBondContact O-N 3.47Å; Y185-I187 VanDerWaalsContact C-N 3.32Å; Y185-I187 PolarHBondContact O-N 2.85Å; I187-T210 HydrophobicContact CG1-CG2 3.94Å; I187-D215 VanDerWaalsContact CG2-C 3.46Å; I187-D215 HydrophobicContact CG2-CB 3.77Å; I187-D215 VanDerWaalsContact CG2-O 3.26Å; I187-D215 WeakPolarHBondContact CG2-O 3.35Å; I187-Y217 WeakPolarHBondContact O-CB 3.24Å; I187-Y217 PolarHBondContact O-N 3.1Å
188	Q	89.6	Confident	89.9	Confident	126 Å²	126	59.5 Å²	59.5	59%	0.589	29%	0.29	S	S	*	.	H	α-helix	trans	-75.3	-32.6	-177.1	-70.2	177.3	4.2	0	0	113.9	S184 Y185 I186 Y217	S184-Q188 WeakPolarHBondContact O-CG 3.31Å; S184-Q188 PolarHBondContact O-N 3.02Å; S184-Q188 VanDerWaalsContact O-N 3.15Å; Y185-Q188 PolarHBondContact O-N 3.12Å; I186-Q188 VanDerWaalsContact C-N 3.33Å; I186-Q188 PolarHBondContact O-N 2.94Å; Q188-Y217 VanDerWaalsContact O-CB 3.29Å; Q188-Y217 WeakPolarHBondContact O-CB 3.35Å
189	N	89.4	Confident	89.8	Confident	35 Å²	35	59.8 Å²	59.8	19%	0.187	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	23.1	-176.9	-64.1	-74.1	0	0	0	112.9	Y185 T191 Q192 V193	Y185-N189 HydrophobicContact CE1-CB 4.36Å; Y185-N189 WeakPolarHBondContact CE2-ND2 3.47Å; Y185-N189 PolarHBondContact O-N 3.41Å; Y185-N189 PolarHBondContact O-ND2 3.21Å; N189-T191 VanDerWaalsContact C-N 3.34Å; N189-T191 PolarHBondContact O-N 3.43Å; N189-Q192 WeakPolarHBondContact O-CB 3.49Å; N189-Q192 PolarHBondContact O-N 2.96Å; N189-V193 HydrophobicContact CB-CG2 4.47Å; N189-V193 WeakPolarHBondContact O-CG2 3.5Å; N189-V193 PolarHBondContact O-N 3.16Å; N189-V193 VanDerWaalsContact O-N 3.1Å
190	F	91	Very high	89.7	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-50.5	-50.2	-169.2	-171.6	-105.7	0	0	0	113.1	I186 Q192 V193 L194 F199 T210 L211 L216 V218 T227	I186-F190 HydrophobicContact CG2-CD2 4.33Å; I186-F190 WeakPolarHBondContact O-CA 3.37Å; I186-F190 WeakPolarHBondContact O-CB 3.4Å; I186-F190 PolarHBondContact O-N 3.44Å; F190-Q192 VanDerWaalsContact C-N 3.25Å; F190-Q192 PolarHBondContact O-N 3.31Å; F190-V193 PolarHBondContact O-N 2.9Å; F190-V193 VanDerWaalsContact O-N 3.1Å; F190-L194 HydrophobicContact CD1-CD1 3.98Å; F190-L194 HydrophobicContact CD1-CG 4.25Å; F190-L194 HydrophobicContact CE1-CD1 3.76Å; F190-L194 HydrophobicContact CE1-CD2 4.07Å; F190-L194 HydrophobicContact CE1-CG 4.12Å; F190-L194 HydrophobicContact CE2-CD2 4.41Å; F190-L194 HydrophobicContact CZ-CD1 4.5Å; F190-L194 HydrophobicContact CZ-CD2 3.98Å; F190-L194 HydrophobicContact CZ-CG 4.49Å; F190-L194 WeakPolarHBondContact O-CG 3.5Å; F190-L194 PolarHBondContact O-N 3.3Å; F190-F199 HydrophobicContact CD2-CE2 4.32Å; F190-F199 AromaticContact CE2-CE2 3.74Å; F190-F199 HydrophobicContact CE2-CE2 3.74Å; F190-F199 AromaticContact CE2-CZ 3.73Å; F190-F199 HydrophobicContact CE2-CZ 3.73Å; F190-F199 HydrophobicContact CZ-CZ 4.12Å; F190-T210 HydrophobicContact CD2-CG2 4.25Å; F190-T210 HydrophobicContact CE2-CG2 4.22Å; F190-L211 HydrophobicContact CE2-CD2 4.35Å; F190-L211 HydrophobicContact CZ-CD2 3.96Å; F190-L216 HydrophobicContact CB-CD1 3.94Å; F190-L216 HydrophobicContact CD1-CD1 4.16Å; F190-L216 HydrophobicContact CD1-CD2 4.37Å; F190-L216 HydrophobicContact CD1-CG 4.27Å; F190-L216 HydrophobicContact CD2-CD1 3.54Å; F190-L216 HydrophobicContact CD2-CG 4.49Å; F190-L216 HydrophobicContact CE1-CD2 4.21Å; F190-L216 HydrophobicContact CE2-CD1 3.97Å; F190-L216 HydrophobicContact CG-CD1 3.62Å; F190-L216 HydrophobicContact CG-CG 4.19Å; F190-L216 HydrophobicContact CZ-CD1 4.43Å; F190-L216 HydrophobicContact CZ-CD2 4.34Å; F190-V218 HydrophobicContact CD1-CG1 3.41Å; F190-V218 VanDerWaalsContact CD1-CG1 3.41Å; F190-V218 HydrophobicContact CE1-CG1 3.77Å; F190-V218 HydrophobicContact CG-CG1 4.45Å; F190-T227 HydrophobicContact CZ-CG2 3.97Å
191	T	88.4	Confident	89.6	Confident	43 Å²	43	57.9 Å²	57.9	26%	0.264	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-31.8	178.7	49.3	0	0	0	0	114.3	N189 Y217	N189-T191 VanDerWaalsContact C-N 3.34Å; N189-T191 PolarHBondContact O-N 3.43Å; T191-Y217 WeakPolarHBondContact CG2-O 3.42Å
192	Q	88.2	Confident	89.5	Confident	97 Å²	97	53.8 Å²	53.8	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-77.4	-39.7	176.9	-61.4	178.9	28.8	0	0	111.1	P160 N189 F190 L194 N195 Y196	P160-Q192 HydrophobicContact CB-CB 4.33Å; P160-Q192 HydrophobicContact CG-CB 4.34Å; N189-Q192 WeakPolarHBondContact O-CB 3.49Å; N189-Q192 PolarHBondContact O-N 2.96Å; F190-Q192 VanDerWaalsContact C-N 3.25Å; F190-Q192 PolarHBondContact O-N 3.31Å; Q192-L194 VanDerWaalsContact C-N 3.29Å; Q192-L194 PolarHBondContact O-N 3.5Å; Q192-N195 WeakPolarHBondContact O-CB 3.41Å; Q192-N195 PolarHBondContact O-N 3.14Å; Q192-N195 PolarHBondContact O-ND2 2.81Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.37Å; Q192-Y196 WeakPolarHBondContact O-CE2 3.44Å
193	V	89.5	Confident	89.4	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-32.9	-179.9	-178.2	0	0	0	0	111.4	P160 N189 F190 N195 Y196 F199	P160-V193 HydrophobicContact CB-CG2 4.24Å; N189-V193 HydrophobicContact CB-CG2 4.47Å; N189-V193 WeakPolarHBondContact O-CG2 3.5Å; N189-V193 PolarHBondContact O-N 3.16Å; N189-V193 VanDerWaalsContact O-N 3.1Å; F190-V193 PolarHBondContact O-N 2.9Å; F190-V193 VanDerWaalsContact O-N 3.1Å; V193-N195 PolarHBondContact O-N 3.47Å; V193-N195 VanDerWaalsContact O-N 3.09Å; V193-Y196 PolarHBondContact O-N 2.68Å; V193-F199 HydrophobicContact CG1-CB 4.31Å; V193-F199 HydrophobicContact CG1-CD2 3.72Å; V193-F199 HydrophobicContact CG1-CG 4.45Å
194	L	88.5	Confident	89.3	Confident	52 Å²	52	55.2 Å²	55.2	27%	0.272	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.9	176.5	-68.3	-179.2	0	0	0	114.3	F190 Q192 Y196 F199 T227	F190-L194 HydrophobicContact CD1-CD1 3.98Å; F190-L194 HydrophobicContact CD1-CG 4.25Å; F190-L194 HydrophobicContact CE1-CD1 3.76Å; F190-L194 HydrophobicContact CE1-CD2 4.07Å; F190-L194 HydrophobicContact CE1-CG 4.12Å; F190-L194 HydrophobicContact CE2-CD2 4.41Å; F190-L194 HydrophobicContact CZ-CD1 4.5Å; F190-L194 HydrophobicContact CZ-CD2 3.98Å; F190-L194 HydrophobicContact CZ-CG 4.49Å; F190-L194 WeakPolarHBondContact O-CG 3.5Å; F190-L194 PolarHBondContact O-N 3.3Å; Q192-L194 VanDerWaalsContact C-N 3.29Å; Q192-L194 PolarHBondContact O-N 3.5Å; L194-Y196 PolarHBondContact O-N 2.77Å; L194-F199 HydrophobicContact CD2-CD1 4.03Å; L194-F199 HydrophobicContact CD2-CD2 4.42Å; L194-F199 HydrophobicContact CD2-CE1 3.89Å; L194-F199 HydrophobicContact CD2-CE2 4.22Å; L194-F199 HydrophobicContact CD2-CG 4.31Å; L194-F199 HydrophobicContact CD2-CZ 3.96Å; L194-T227 WeakPolarHBondContact CD1-OG1 3.38Å; L194-T227 HydrophobicContact CD2-CG2 3.44Å; L194-T227 VanDerWaalsContact CD2-CG2 3.44Å; L194-T227 WeakPolarHBondContact CD2-OG1 3.3Å
195	N	87.9	Confident	89.2	Confident	135 Å²	135	56.4 Å²	56.4	72%	0.722	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.8	178.4	-63	-39.8	0	0	0	113.2	Q192 V193	Q192-N195 WeakPolarHBondContact O-CB 3.41Å; Q192-N195 PolarHBondContact O-N 3.14Å; Q192-N195 PolarHBondContact O-ND2 2.81Å; V193-N195 PolarHBondContact O-N 3.47Å; V193-N195 VanDerWaalsContact O-N 3.09Å
196	Y	89.1	Confident	89.1	Confident	92 Å²	92	54.2 Å²	54.2	36%	0.361	27%	0.272	S	S	.	.	S	Bend	trans	-109	133.8	-175.9	-61	-87.8	0	0	0	111.1	P160 E161 Q192 V193 L194 E198 F199	P160-Y196 HydrophobicContact CB-CD2 4.27Å; P160-Y196 HydrophobicContact CB-CE2 3.73Å; E161-Y196 HydrophobicContact CB-CD1 3.98Å; E161-Y196 HydrophobicContact CB-CE1 3.64Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.37Å; Q192-Y196 WeakPolarHBondContact O-CE2 3.44Å; V193-Y196 PolarHBondContact O-N 2.68Å; L194-Y196 PolarHBondContact O-N 2.77Å; Y196-E198 PolarHBondContact O-N 2.85Å; Y196-F199 WeakPolarHBondContact O-CB 3.32Å; Y196-F199 PolarHBondContact O-N 3.48Å
197	E	85.5	Confident	89.1	Confident	160 Å²	160	54.2 Å²	54.2	75%	0.748	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-63.7	-25.5	-178.1	-66.6	-170.7	168.3	0	0	113.2	F199 L200	E197-F199 PolarHBondContact O-N 3.36Å; E197-F199 VanDerWaalsContact O-N 3.09Å; E197-L200 WeakPolarHBondContact O-CB 3.28Å; E197-L200 PolarHBondContact O-N 3.41Å
198	E	86.4	Confident	89.1	Confident	89 Å²	89	53.3 Å²	53.3	42%	0.416	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-55.8	-28.9	177.6	-65.5	-167.5	-177.9	0	0	112.6	E161 V164 Y196 L200 E201	E161-E198 VanDerWaalsContact O-OE2 3.07Å; V164-E198 HydrophobicContact CB-CB 4.16Å; V164-E198 WeakPolarHBondContact CG1-O 3.47Å; V164-E198 HydrophobicContact CG2-CB 4.35Å; Y196-E198 PolarHBondContact O-N 2.85Å; E198-L200 PolarHBondContact O-N 3.28Å; E198-E201 WeakPolarHBondContact O-CB 3.38Å; E198-E201 PolarHBondContact O-N 2.99Å
199	F	88.4	Confident	89.2	Confident	5 Å²	5	49.9 Å²	49.9	2%	0.022	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-57	-34.9	175.1	-177.3	-87.7	0	0	0	112.5	F190 V193 L194 Y196 E197 E201 L202 L207 T227	F190-F199 HydrophobicContact CD2-CE2 4.32Å; F190-F199 AromaticContact CE2-CE2 3.74Å; F190-F199 HydrophobicContact CE2-CE2 3.74Å; F190-F199 AromaticContact CE2-CZ 3.73Å; F190-F199 HydrophobicContact CE2-CZ 3.73Å; F190-F199 HydrophobicContact CZ-CZ 4.12Å; V193-F199 HydrophobicContact CG1-CB 4.31Å; V193-F199 HydrophobicContact CG1-CD2 3.72Å; V193-F199 HydrophobicContact CG1-CG 4.45Å; L194-F199 HydrophobicContact CD2-CD1 4.03Å; L194-F199 HydrophobicContact CD2-CD2 4.42Å; L194-F199 HydrophobicContact CD2-CE1 3.89Å; L194-F199 HydrophobicContact CD2-CE2 4.22Å; L194-F199 HydrophobicContact CD2-CG 4.31Å; L194-F199 HydrophobicContact CD2-CZ 3.96Å; Y196-F199 WeakPolarHBondContact O-CB 3.32Å; Y196-F199 PolarHBondContact O-N 3.48Å; E197-F199 PolarHBondContact O-N 3.36Å; E197-F199 VanDerWaalsContact O-N 3.09Å; F199-E201 PolarHBondContact O-N 3.47Å; F199-L202 HydrophobicContact CD1-CD1 4.43Å; F199-L202 HydrophobicContact CD2-CD1 3.35Å; F199-L202 HydrophobicContact CD2-CG 4.48Å; F199-L202 HydrophobicContact CE1-CD1 4.35Å; F199-L202 HydrophobicContact CE2-CD1 3.31Å; F199-L202 HydrophobicContact CG-CD1 3.96Å; F199-L202 HydrophobicContact CZ-CD1 3.84Å; F199-L202 VanDerWaalsContact O-CB 3.31Å; F199-L202 WeakPolarHBondContact O-CB 3.38Å; F199-L202 WeakPolarHBondContact O-CG 3.46Å; F199-L202 PolarHBondContact O-N 3.03Å; F199-L202 VanDerWaalsContact O-N 3.08Å; F199-L207 HydrophobicContact CE1-CD1 4.18Å; F199-L207 HydrophobicContact CZ-CD1 3.7Å; F199-T227 HydrophobicContact CD1-CG2 4.24Å; F199-T227 HydrophobicContact CE1-CG2 3.25Å; F199-T227 HydrophobicContact CZ-CG2 3.62Å
200	L	89	Confident	89.2	Confident	38 Å²	38	48.2 Å²	48.2	20%	0.199	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-67.2	-17	179.6	-60.2	173.7	0	0	0	112.4	E197 E198 L202 N230 W231 Y234 R239	E197-L200 WeakPolarHBondContact O-CB 3.28Å; E197-L200 PolarHBondContact O-N 3.41Å; E198-L200 PolarHBondContact O-N 3.28Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L200-N230 HydrophobicContact CD2-CB 4.25Å; L200-W231 HydrophobicContact CD2-CB 4.46Å; L200-Y234 HydrophobicContact CB-CD1 3.99Å; L200-Y234 HydrophobicContact CB-CD2 4.16Å; L200-Y234 HydrophobicContact CB-CE1 4.38Å; L200-Y234 HydrophobicContact CB-CG 3.89Å; L200-Y234 HydrophobicContact CD1-CD2 3.74Å; L200-Y234 HydrophobicContact CD1-CE2 4.23Å; L200-Y234 HydrophobicContact CD1-CG 4.17Å; L200-R239 VanDerWaalsContact O-CZ 3.27Å; L200-R239 PolarHBondContact O-NH1 2.97Å; L200-R239 PolarHBondContact O-NH2 3.27Å
201	E	88.6	Confident	89.3	Confident	84 Å²	84	48.2 Å²	48.2	39%	0.393	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-84.7	-3.7	175.5	-58.4	-161.1	160	0	0	113.8	R168 E198 F199	R168-E201 IonicContact NH1-OE2 2.92Å; R168-E201 PolarHBondContact NH1-OE2 3.3Å; E198-E201 WeakPolarHBondContact O-CB 3.38Å; E198-E201 PolarHBondContact O-N 2.99Å; F199-E201 PolarHBondContact O-N 3.47Å
202	L	89.4	Confident	89.4	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.268	C	S	.	.			trans	-56.4	137.3	-178.4	-81.9	170.5	0	0	0	112.4	V164 L167 F199 L200 V206 W231	V164-L202 HydrophobicContact CG1-CD2 3.9Å; V164-L202 HydrophobicContact CG1-CG 4.16Å; V164-L202 HydrophobicContact CG2-CD2 4.13Å; V164-L202 HydrophobicContact CG2-CG 4.17Å; L167-L202 HydrophobicContact CD2-CD2 3.43Å; L167-L202 VanDerWaalsContact CD2-CD2 3.43Å; F199-L202 HydrophobicContact CD1-CD1 4.43Å; F199-L202 HydrophobicContact CD2-CD1 3.35Å; F199-L202 HydrophobicContact CD2-CG 4.48Å; F199-L202 HydrophobicContact CE1-CD1 4.35Å; F199-L202 HydrophobicContact CE2-CD1 3.31Å; F199-L202 HydrophobicContact CG-CD1 3.96Å; F199-L202 HydrophobicContact CZ-CD1 3.84Å; F199-L202 VanDerWaalsContact O-CB 3.31Å; F199-L202 WeakPolarHBondContact O-CB 3.38Å; F199-L202 WeakPolarHBondContact O-CG 3.46Å; F199-L202 PolarHBondContact O-N 3.03Å; F199-L202 VanDerWaalsContact O-N 3.08Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L202-V206 HydrophobicContact CD2-CG1 4.44Å; L202-W231 PolarHBondContact O-NE1 3.47Å
203	P	89.3	Confident	89.4	Confident	43 Å²	43	50 Å²	50	28%	0.279	26%	0.255	S	S	.	.			trans	-59.1	147	168	-26.4	37.1	0	0	0	112.5	D205 V206 L207	P203-D205 VanDerWaalsContact C-N 3.34Å; P203-D205 WeakPolarHBondContact CB-OD1 3.37Å; P203-D205 PolarHBondContact O-N 2.95Å; P203-V206 HydrophobicContact CB-CG2 4.36Å; P203-V206 PolarHBondContact O-N 3.23Å; P203-L207 PolarHBondContact O-N 3.26Å
204	A	90.1	Very high	89.2	Confident	23 Å²	23	51.5 Å²	51.5	19%	0.19	26%	0.263	C	S	.	.	H	α-helix	trans	-64.4	-36.9	-175.6	0	0	0	0	0	112.9	L207 C208 W231 L242	A204-L207 PolarHBondContact O-N 3.06Å; A204-C208 WeakPolarHBondContact O-CB 3.34Å; A204-C208 PolarHBondContact O-N 3.29Å; A204-C208 PolarHBondContact O-SG 3.33Å; A204-W231 HydrophobicContact CB-CH2 3.67Å; A204-W231 HydrophobicContact CB-CZ2 3.93Å; A204-L242 HydrophobicContact CB-CD1 4.02Å
205	D	89.2	Confident	89.1	Confident	87 Å²	87	52.8 Å²	52.8	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-46.2	177.3	62.8	-49.3	0	0	0	111.3	K179 P203 C208 S209	K179-D205 IonicContact NZ-OD2 3.85Å; P203-D205 VanDerWaalsContact C-N 3.34Å; P203-D205 WeakPolarHBondContact CB-OD1 3.37Å; P203-D205 PolarHBondContact O-N 2.95Å; D205-C208 PolarHBondContact O-N 3.2Å; D205-S209 WeakPolarHBondContact O-CB 3.17Å; D205-S209 PolarHBondContact O-N 3.06Å; D205-S209 PolarHBondContact O-OG 2.95Å
206	V	89.6	Confident	89.1	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-45.2	178.7	-178.5	0	0	0	0	110.1	L167 Q183 L202 P203 C208 S209 T210	L167-V206 HydrophobicContact CD2-CB 4.24Å; L167-V206 HydrophobicContact CD2-CG1 3.65Å; L167-V206 HydrophobicContact CD2-CG2 4.19Å; Q183-V206 HydrophobicContact CG-CG1 4.01Å; L202-V206 HydrophobicContact CD2-CG1 4.44Å; P203-V206 HydrophobicContact CB-CG2 4.36Å; P203-V206 PolarHBondContact O-N 3.23Å; V206-C208 VanDerWaalsContact C-N 3.34Å; V206-C208 PolarHBondContact O-N 3.5Å; V206-S209 WeakPolarHBondContact CA-OG 3.39Å; V206-S209 PolarHBondContact O-N 2.98Å; V206-S209 VanDerWaalsContact O-N 3.15Å; V206-S209 PolarHBondContact O-OG 3.24Å; V206-T210 PolarHBondContact O-N 3.42Å; V206-T210 PolarHBondContact O-OG1 3.22Å; V206-T210 VanDerWaalsContact O-OG1 3.1Å
207	L	91.9	Very high	88.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-48.7	176.3	-178.2	64	0	0	0	111.4	F199 P203 A204 S209 T210 L211 W231 V246	F199-L207 HydrophobicContact CE1-CD1 4.18Å; F199-L207 HydrophobicContact CZ-CD1 3.7Å; P203-L207 PolarHBondContact O-N 3.26Å; A204-L207 PolarHBondContact O-N 3.06Å; L207-S209 VanDerWaalsContact C-N 3.34Å; L207-S209 PolarHBondContact O-N 3.26Å; L207-T210 PolarHBondContact O-N 3.25Å; L207-L211 HydrophobicContact CD1-CD1 3.95Å; L207-L211 HydrophobicContact CD1-CD2 4.45Å; L207-L211 HydrophobicContact CD1-CG 3.99Å; L207-L211 HydrophobicContact CG-CD1 3.88Å; L207-L211 HydrophobicContact CG-CG 4.25Å; L207-L211 WeakPolarHBondContact O-CB 3.47Å; L207-L211 VanDerWaalsContact O-CG 3.24Å; L207-L211 WeakPolarHBondContact O-CG 3.24Å; L207-L211 PolarHBondContact O-N 3.34Å; L207-W231 HydrophobicContact CD2-CB 4.26Å; L207-W231 HydrophobicContact CD2-CD2 3.48Å; L207-W231 VanDerWaalsContact CD2-CD2 3.48Å; L207-W231 HydrophobicContact CD2-CE3 3.85Å; L207-W231 HydrophobicContact CD2-CG 3.66Å; L207-W231 HydrophobicContact CD2-CZ2 4.33Å; L207-W231 HydrophobicContact CD2-CZ3 4.44Å; L207-V246 HydrophobicContact CD2-CG1 3.96Å; L207-V246 HydrophobicContact CG-CG1 4.48Å
208	C	92.5	Very high	88.9	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-43.1	178.1	-66.6	0	0	0	0	111.8	A204 D205 V206 T210 L211 K212 Y245	A204-C208 WeakPolarHBondContact O-CB 3.34Å; A204-C208 PolarHBondContact O-N 3.29Å; A204-C208 PolarHBondContact O-SG 3.33Å; D205-C208 PolarHBondContact O-N 3.2Å; V206-C208 VanDerWaalsContact C-N 3.34Å; V206-C208 PolarHBondContact O-N 3.5Å; C208-T210 VanDerWaalsContact C-N 3.33Å; C208-T210 PolarHBondContact O-N 2.91Å; C208-L211 PolarHBondContact O-N 3.13Å; C208-K212 VanDerWaalsContact O-CB 3.25Å; C208-K212 WeakPolarHBondContact O-CB 3.47Å; C208-K212 PolarHBondContact O-N 3.28Å; C208-Y245 HydrophobicContact CB-CE1 4.04Å; C208-Y245 VanDerWaalsContact SG-CD1 3.59Å; C208-Y245 WeakPolarHBondContact SG-CE1 3.44Å
209	S	90.7	Very high	88.4	Confident	54 Å²	54	38 Å²	38	38%	0.378	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-39.2	177.7	73.8	0	0	0	0	112.8	Q183 D205 V206 L207	Q183-S209 PolarHBondContact NE2-OG 3.21Å; D205-S209 WeakPolarHBondContact O-CB 3.17Å; D205-S209 PolarHBondContact O-N 3.06Å; D205-S209 PolarHBondContact O-OG 2.95Å; V206-S209 WeakPolarHBondContact CA-OG 3.39Å; V206-S209 PolarHBondContact O-N 2.98Å; V206-S209 VanDerWaalsContact O-N 3.15Å; V206-S209 PolarHBondContact O-OG 3.24Å; L207-S209 VanDerWaalsContact C-N 3.34Å; L207-S209 PolarHBondContact O-N 3.26Å
210	T	90.8	Very high	88.1	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-68	-47.5	176.3	-61.1	0	0	0	0	111	I186 I187 F190 V206 L207 C208 K212 S213 L216	I186-T210 HydrophobicContact CG2-CG2 3.97Å; I187-T210 HydrophobicContact CG1-CG2 3.94Å; F190-T210 HydrophobicContact CD2-CG2 4.25Å; F190-T210 HydrophobicContact CE2-CG2 4.22Å; V206-T210 PolarHBondContact O-N 3.42Å; V206-T210 PolarHBondContact O-OG1 3.22Å; V206-T210 VanDerWaalsContact O-OG1 3.1Å; L207-T210 PolarHBondContact O-N 3.25Å; C208-T210 VanDerWaalsContact C-N 3.33Å; C208-T210 PolarHBondContact O-N 2.91Å; T210-K212 VanDerWaalsContact C-N 3.32Å; T210-K212 PolarHBondContact O-N 3.15Å; T210-S213 WeakPolarHBondContact O-CB 3.44Å; T210-S213 PolarHBondContact O-N 2.93Å; T210-L216 HydrophobicContact CG2-CD1 3.78Å
211	L	91.8	Very high	88	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.7	-29	-177.8	-67.9	-175.7	0	0	0	113.4	F190 L207 C208 S213 L216 V224 V228 V246 N249 R301	F190-L211 HydrophobicContact CE2-CD2 4.35Å; F190-L211 HydrophobicContact CZ-CD2 3.96Å; L207-L211 HydrophobicContact CD1-CD1 3.95Å; L207-L211 HydrophobicContact CD1-CD2 4.45Å; L207-L211 HydrophobicContact CD1-CG 3.99Å; L207-L211 HydrophobicContact CG-CD1 3.88Å; L207-L211 HydrophobicContact CG-CG 4.25Å; L207-L211 WeakPolarHBondContact O-CB 3.47Å; L207-L211 VanDerWaalsContact O-CG 3.24Å; L207-L211 WeakPolarHBondContact O-CG 3.24Å; L207-L211 PolarHBondContact O-N 3.34Å; C208-L211 PolarHBondContact O-N 3.13Å; L211-S213 VanDerWaalsContact C-N 3.27Å; L211-S213 PolarHBondContact O-N 3.37Å; L211-L216 HydrophobicContact CD2-CD2 4.06Å; L211-V224 HydrophobicContact CD2-CG1 3.65Å; L211-V228 HydrophobicContact CD1-CG2 3.34Å; L211-V246 HydrophobicContact CD1-CG1 4.11Å; L211-N249 HydrophobicContact CB-CB 3.84Å; L211-R301 PolarHBondContact O-NH1 3.41Å; L211-R301 PolarHBondContact O-NH2 3.19Å
212	K	90.9	Very high	88	Confident	150 Å²	150	38.6 Å²	38.6	65%	0.652	20%	0.204	S	C	*	.	H	α-helix	trans	-68.8	-26	176	-171.6	172.2	-179.8	176.7	0	112.8	C208 T210	C208-K212 VanDerWaalsContact O-CB 3.25Å; C208-K212 WeakPolarHBondContact O-CB 3.47Å; C208-K212 PolarHBondContact O-N 3.28Å; T210-K212 VanDerWaalsContact C-N 3.32Å; T210-K212 PolarHBondContact O-N 3.15Å
213	S	89.1	Confident	88	Confident	26 Å²	26	41.3 Å²	41.3	18%	0.182	22%	0.217	C	C	.	.			trans	-63.7	134.1	-176.1	-173.2	0	0	0	0	113	T210 L211 D215 R301	T210-S213 WeakPolarHBondContact O-CB 3.44Å; T210-S213 PolarHBondContact O-N 2.93Å; L211-S213 VanDerWaalsContact C-N 3.27Å; L211-S213 PolarHBondContact O-N 3.37Å; S213-D215 VanDerWaalsContact C-N 3.26Å; S213-D215 PolarHBondContact O-N 3.38Å; S213-D215 PolarHBondContact OG-N 2.88Å; S213-R301 PolarHBondContact O-NH1 2.93Å
214	D	85.3	Confident	88.2	Confident	33 Å²	33	39.3 Å²	39.3	18%	0.176	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-24.3	171.3	-77.7	-32.5	0	0	0	112.7	L216 R251 K299 M302	D214-L216 VanDerWaalsContact C-N 3.27Å; D214-L216 PolarHBondContact O-N 2.69Å; D214-R251 IonicContact OD1-CZ 2.68Å; D214-R251 VanDerWaalsContact OD1-CZ 3.28Å; D214-R251 IonicContact OD1-NH1 2.68Å; D214-R251 PolarHBondContact OD1-NH1 3.21Å; D214-R251 VanDerWaalsContact OD1-NH1 3.08Å; D214-R251 IonicContact OD1-NH2 3.8Å; D214-R251 PolarHBondContact OD1-NH2 2.99Å; D214-K299 IonicContact OD1-NZ 3.89Å; D214-K299 IonicContact OD2-NZ 3.07Å; D214-K299 PolarHBondContact OD2-NZ 2.89Å; D214-M302 HydrophobicContact CB-CE 3.56Å; D214-M302 HydrophobicContact CB-CG 4.39Å; D214-M302 WeakPolarHBondContact O-CB 3.25Å; D214-M302 PolarHBondContact O-N 3.36Å
215	D	85.4	Confident	88.4	Confident	80 Å²	80	38.4 Å²	38.4	43%	0.428	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	2.1	-179.2	-71.1	-65.8	0	0	0	113.7	I187 S213 Y217 M302 H303	I187-D215 VanDerWaalsContact CG2-C 3.46Å; I187-D215 HydrophobicContact CG2-CB 3.77Å; I187-D215 VanDerWaalsContact CG2-O 3.26Å; I187-D215 WeakPolarHBondContact CG2-O 3.35Å; S213-D215 VanDerWaalsContact C-N 3.26Å; S213-D215 PolarHBondContact O-N 3.38Å; S213-D215 PolarHBondContact OG-N 2.88Å; D215-Y217 PolarHBondContact O-N 3.3Å; D215-Y217 VanDerWaalsContact O-N 3.16Å; D215-M302 HydrophobicContact CB-CE 4.11Å; D215-M302 WeakPolarHBondContact OD1-CE 3.49Å; D215-M302 WeakPolarHBondContact OD2-CE 3.49Å; D215-H303 PolarHBondContact O-CD2 2.66Å; D215-H303 VanDerWaalsContact O-CD2 3.23Å
216	L	88.6	Confident	88.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.			trans	-58.8	122	-178.8	-170.6	72.6	0	0	0	110.7	F190 T210 L211 D214 V218 V224	F190-L216 HydrophobicContact CB-CD1 3.94Å; F190-L216 HydrophobicContact CD1-CD1 4.16Å; F190-L216 HydrophobicContact CD1-CD2 4.37Å; F190-L216 HydrophobicContact CD1-CG 4.27Å; F190-L216 HydrophobicContact CD2-CD1 3.54Å; F190-L216 HydrophobicContact CD2-CG 4.49Å; F190-L216 HydrophobicContact CE1-CD2 4.21Å; F190-L216 HydrophobicContact CE2-CD1 3.97Å; F190-L216 HydrophobicContact CG-CD1 3.62Å; F190-L216 HydrophobicContact CG-CG 4.19Å; F190-L216 HydrophobicContact CZ-CD1 4.43Å; F190-L216 HydrophobicContact CZ-CD2 4.34Å; T210-L216 HydrophobicContact CG2-CD1 3.78Å; L211-L216 HydrophobicContact CD2-CD2 4.06Å; D214-L216 VanDerWaalsContact C-N 3.27Å; D214-L216 PolarHBondContact O-N 2.69Å; L216-V218 HydrophobicContact CD2-CG1 4.07Å; L216-V218 HydrophobicContact CD2-CG2 4.31Å; L216-V218 HydrophobicContact CG-CG1 4.16Å; L216-V218 HydrophobicContact CG-CG2 4.46Å; L216-V218 PolarHBondContact O-N 2.93Å; L216-V224 HydrophobicContact CD2-CG2 4.05Å
217	Y	85.1	Confident	88.7	Confident	110 Å²	110	39 Å²	39	43%	0.431	20%	0.196	S	C	.	.			trans	-78.8	86	-177.4	-164.7	-90.7	0	0	0	111	I187 Q188 T191 D215 H303	I187-Y217 WeakPolarHBondContact O-CB 3.24Å; I187-Y217 PolarHBondContact O-N 3.1Å; Q188-Y217 VanDerWaalsContact O-CB 3.29Å; Q188-Y217 WeakPolarHBondContact O-CB 3.35Å; T191-Y217 WeakPolarHBondContact CG2-O 3.42Å; D215-Y217 PolarHBondContact O-N 3.3Å; D215-Y217 VanDerWaalsContact O-N 3.16Å; Y217-H303 HydrophobicContact CD2-CB 4.11Å; Y217-H303 AromaticContact CD2-CD2 3.98Å; Y217-H303 AromaticContact CD2-CG 3.66Å; Y217-H303 AromaticContact CD2-ND1 3.71Å; Y217-H303 AromaticContact CE2-ND1 3.92Å
218	V	83.7	Confident	88.8	Confident	3 Å²	3	39 Å²	39	2%	0.018	20%	0.196	C	C	.	.			trans	-135	151.3	175.9	-70.2	0	0	0	0	110.9	F190 L216 V224	F190-V218 HydrophobicContact CD1-CG1 3.41Å; F190-V218 VanDerWaalsContact CD1-CG1 3.41Å; F190-V218 HydrophobicContact CE1-CG1 3.77Å; F190-V218 HydrophobicContact CG-CG1 4.45Å; L216-V218 HydrophobicContact CD2-CG1 4.07Å; L216-V218 HydrophobicContact CD2-CG2 4.31Å; L216-V218 HydrophobicContact CG-CG1 4.16Å; L216-V218 HydrophobicContact CG-CG2 4.46Å; L216-V218 PolarHBondContact O-N 2.93Å; V218-V224 HydrophobicContact CB-CG2 4.27Å; V218-V224 HydrophobicContact CG1-CG2 3.96Å; V218-V224 HydrophobicContact CG2-CG2 3.88Å
219	T	76.8	Confident	88.9	Confident	52 Å²	52	38.8 Å²	38.8	32%	0.319	20%	0.195	S	C	.	.	S	Bend	trans	-89.8	-30.9	178.8	54.8	0	0	0	0	112.8	Q223 F305	T219-Q223 PolarHBondContact OG1-NE2 2.96Å; T219-Q223 VanDerWaalsContact OG1-NE2 3.07Å; T219-Q223 PolarHBondContact OG1-OE1 3.46Å; T219-F305 HydrophobicContact CG2-CE2 3.94Å
220	E	82.1	Confident	89	Confident	120 Å²	120	40.2 Å²	40.2	56%	0.561	20%	0.198	S	C	*	.			trans	-146.3	143.7	-176	-61.4	-178.8	-176.9	0	0	110.2	A222 Q223	E220-A222 PolarHBondContact O-N 2.91Å; E220-Q223 PolarHBondContact O-N 3.17Å
221	E	88.1	Confident	89.1	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.019	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-18.5	178.2	-162.9	67.5	-170.3	0	0	112.5	Q223 V224 F225 V250 R251 L254 L255 R301	E221-Q223 VanDerWaalsContact C-N 3.27Å; E221-Q223 PolarHBondContact O-N 2.83Å; E221-V224 WeakPolarHBondContact O-CB 3.27Å; E221-V224 PolarHBondContact O-N 3.19Å; E221-V224 VanDerWaalsContact O-N 3.09Å; E221-F225 PolarHBondContact O-N 3.48Å; E221-V250 HydrophobicContact CG-CG1 4.05Å; E221-R251 HydrophobicContact CG-CB 3.88Å; E221-R251 PolarHBondContact OE1-N 3.1Å; E221-L254 HydrophobicContact CB-CB 4.44Å; E221-L255 VanDerWaalsContact C-CD2 3.5Å; E221-L255 HydrophobicContact CB-CD2 3.9Å; E221-L255 HydrophobicContact CG-CD2 4.31Å; E221-R301 IonicContact OE1-CZ 3.95Å; E221-R301 IonicContact OE1-NE 2.72Å; E221-R301 IonicContact OE1-NH2 2.73Å; E221-R301 PolarHBondContact OE1-NH2 3.37Å; E221-R301 IonicContact OE2-CZ 3.19Å; E221-R301 IonicContact OE2-NE 3.1Å; E221-R301 PolarHBondContact OE2-NE 3.16Å; E221-R301 IonicContact OE2-NH2 3.95Å
222	A	87.8	Confident	89.2	Confident	15 Å²	15	40.3 Å²	40.3	12%	0.124	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-39.7	173.8	0	0	0	0	0	111.7	E220 V224 F225 E226 L255 Y259	E220-A222 PolarHBondContact O-N 2.91Å; A222-V224 VanDerWaalsContact C-N 3.29Å; A222-V224 PolarHBondContact O-N 3.41Å; A222-F225 PolarHBondContact O-N 2.9Å; A222-E226 WeakPolarHBondContact O-CG 3.15Å; A222-E226 PolarHBondContact O-N 3.31Å; A222-L255 HydrophobicContact CB-CD2 4.06Å; A222-L255 VanDerWaalsContact N-CD2 3.28Å; A222-Y259 HydrophobicContact CB-CD1 4.42Å; A222-Y259 HydrophobicContact CB-CE1 4.01Å; A222-Y259 HydrophobicContact CB-CE2 4.32Å
223	Q	89.6	Confident	89.3	Confident	60 Å²	60	39 Å²	39	28%	0.28	19%	0.189	S	C	.	.	H	α-helix	trans	-62.6	-38.2	175.9	-67.6	174.1	-9.1	0	0	111.7	T219 E220 E221 T227	T219-Q223 PolarHBondContact OG1-NE2 2.96Å; T219-Q223 VanDerWaalsContact OG1-NE2 3.07Å; T219-Q223 PolarHBondContact OG1-OE1 3.46Å; E220-Q223 PolarHBondContact O-N 3.17Å; E221-Q223 VanDerWaalsContact C-N 3.27Å; E221-Q223 PolarHBondContact O-N 2.83Å; Q223-T227 WeakPolarHBondContact O-CB 3.43Å; Q223-T227 PolarHBondContact O-N 3.44Å; Q223-T227 PolarHBondContact O-OG1 2.87Å
224	V	92.8	Very high	89.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-45.5	177.8	-174.1	0	0	0	0	110.3	L211 L216 V218 E221 A222 T227 V228 V250	L211-V224 HydrophobicContact CD2-CG1 3.65Å; L216-V224 HydrophobicContact CD2-CG2 4.05Å; V218-V224 HydrophobicContact CB-CG2 4.27Å; V218-V224 HydrophobicContact CG1-CG2 3.96Å; V218-V224 HydrophobicContact CG2-CG2 3.88Å; E221-V224 WeakPolarHBondContact O-CB 3.27Å; E221-V224 PolarHBondContact O-N 3.19Å; E221-V224 VanDerWaalsContact O-N 3.09Å; A222-V224 VanDerWaalsContact C-N 3.29Å; A222-V224 PolarHBondContact O-N 3.41Å; V224-T227 WeakPolarHBondContact O-CB 3.41Å; V224-T227 PolarHBondContact O-N 3.01Å; V224-V228 WeakPolarHBondContact O-CG2 3.37Å; V224-V228 PolarHBondContact O-N 3.06Å; V224-V250 HydrophobicContact CG1-CG1 4.43Å; V224-V250 HydrophobicContact CG1-CG2 4.16Å
225	F	94.1	Very high	89.8	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-49.6	176.1	175.2	-99.9	0	0	0	111.7	E221 A222 T227 V228 M229 L247 V250 L252 Y259 T263 V264 I270	E221-F225 PolarHBondContact O-N 3.48Å; A222-F225 PolarHBondContact O-N 2.9Å; F225-T227 VanDerWaalsContact C-N 3.29Å; F225-T227 PolarHBondContact O-N 3.21Å; F225-V228 PolarHBondContact O-N 2.82Å; F225-M229 HydrophobicContact CD1-CG 4.3Å; F225-M229 HydrophobicContact CD2-CG 4.4Å; F225-M229 HydrophobicContact CE1-CG 3.79Å; F225-M229 HydrophobicContact CE2-CG 3.9Å; F225-M229 HydrophobicContact CE2-SD 4.13Å; F225-M229 HydrophobicContact CZ-CG 3.57Å; F225-M229 HydrophobicContact CZ-SD 4.06Å; F225-M229 WeakPolarHBondContact O-CG 3.46Å; F225-M229 PolarHBondContact O-N 3.33Å; F225-L247 HydrophobicContact CD2-CD1 3.92Å; F225-L247 HydrophobicContact CE2-CD1 3.98Å; F225-V250 HydrophobicContact CB-CG1 4.12Å; F225-L252 HydrophobicContact CD2-CD2 4.11Å; F225-Y259 HydrophobicContact CD1-CE1 4.08Å; F225-T263 HydrophobicContact CE1-CG2 4.25Å; F225-V264 HydrophobicContact CD1-CG2 4.13Å; F225-V264 HydrophobicContact CD2-CG2 4.24Å; F225-V264 HydrophobicContact CE1-CG2 3.84Å; F225-V264 HydrophobicContact CE2-CB 4.32Å; F225-V264 HydrophobicContact CE2-CG1 3.78Å; F225-V264 HydrophobicContact CE2-CG2 3.96Å; F225-V264 HydrophobicContact CG-CG2 4.32Å; F225-V264 HydrophobicContact CZ-CB 4.06Å; F225-V264 HydrophobicContact CZ-CG1 3.94Å; F225-V264 HydrophobicContact CZ-CG2 3.75Å; F225-I270 HydrophobicContact CE2-CD1 3.62Å; F225-I270 HydrophobicContact CZ-CD1 3.59Å
226	E	92.6	Very high	90	Very high	90 Å²	90	46.3 Å²	46.3	42%	0.421	21%	0.212	S	C	.	.	H	α-helix	trans	-59.4	-41.1	178.1	-73	173.2	-174.5	0	0	112	A222 V228 M229 N230 Y259	A222-E226 WeakPolarHBondContact O-CG 3.15Å; A222-E226 PolarHBondContact O-N 3.31Å; E226-V228 PolarHBondContact O-N 3.45Å; E226-M229 PolarHBondContact O-N 2.7Å; E226-N230 WeakPolarHBondContact O-CB 3.5Å; E226-N230 PolarHBondContact O-N 3.28Å; E226-N230 PolarHBondContact O-ND2 3.3Å; E226-Y259 WeakPolarHBondContact CG-OH 3.46Å; E226-Y259 PolarHBondContact OE1-OH 3.4Å
227	T	92.1	Very high	90.1	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-48.3	175.9	-61.9	0	0	0	0	111.7	F190 L194 F199 Q223 V224 F225 M229 N230 W231	F190-T227 HydrophobicContact CZ-CG2 3.97Å; L194-T227 WeakPolarHBondContact CD1-OG1 3.38Å; L194-T227 HydrophobicContact CD2-CG2 3.44Å; L194-T227 VanDerWaalsContact CD2-CG2 3.44Å; L194-T227 WeakPolarHBondContact CD2-OG1 3.3Å; F199-T227 HydrophobicContact CD1-CG2 4.24Å; F199-T227 HydrophobicContact CE1-CG2 3.25Å; F199-T227 HydrophobicContact CZ-CG2 3.62Å; Q223-T227 WeakPolarHBondContact O-CB 3.43Å; Q223-T227 PolarHBondContact O-N 3.44Å; Q223-T227 PolarHBondContact O-OG1 2.87Å; V224-T227 WeakPolarHBondContact O-CB 3.41Å; V224-T227 PolarHBondContact O-N 3.01Å; F225-T227 VanDerWaalsContact C-N 3.29Å; F225-T227 PolarHBondContact O-N 3.21Å; T227-M229 VanDerWaalsContact C-N 3.33Å; T227-M229 PolarHBondContact O-N 3.37Å; T227-N230 PolarHBondContact O-N 3.04Å; T227-W231 WeakPolarHBondContact O-CB 2.99Å; T227-W231 PolarHBondContact O-N 3.28Å
228	V	94.4	Very high	90.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-45.2	177.5	170	0	0	0	0	110.6	L211 V224 F225 E226 N230 W231 V232 V246 V250	L211-V228 HydrophobicContact CD1-CG2 3.34Å; V224-V228 WeakPolarHBondContact O-CG2 3.37Å; V224-V228 PolarHBondContact O-N 3.06Å; F225-V228 PolarHBondContact O-N 2.82Å; E226-V228 PolarHBondContact O-N 3.45Å; V228-N230 PolarHBondContact O-N 3.44Å; V228-W231 PolarHBondContact O-N 3.37Å; V228-V232 HydrophobicContact CG1-CG2 4.45Å; V228-V232 WeakPolarHBondContact O-CG2 3.38Å; V228-V232 PolarHBondContact O-N 2.68Å; V228-V246 HydrophobicContact CB-CG1 4.36Å; V228-V246 HydrophobicContact CG1-CB 4.31Å; V228-V246 HydrophobicContact CG1-CG1 3.64Å; V228-V246 HydrophobicContact CG2-CG1 3.83Å; V228-V250 HydrophobicContact CB-CG2 4.46Å; V228-V250 HydrophobicContact CG2-CG2 3.76Å
229	M	94.2	Very high	90.8	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-39.8	-179.8	-66.5	-53.6	-62.8	0	0	112.2	F225 E226 T227 V232 R233 L243 D267 L269 I270	F225-M229 HydrophobicContact CD1-CG 4.3Å; F225-M229 HydrophobicContact CD2-CG 4.4Å; F225-M229 HydrophobicContact CE1-CG 3.79Å; F225-M229 HydrophobicContact CE2-CG 3.9Å; F225-M229 HydrophobicContact CE2-SD 4.13Å; F225-M229 HydrophobicContact CZ-CG 3.57Å; F225-M229 HydrophobicContact CZ-SD 4.06Å; F225-M229 WeakPolarHBondContact O-CG 3.46Å; F225-M229 PolarHBondContact O-N 3.33Å; E226-M229 PolarHBondContact O-N 2.7Å; T227-M229 VanDerWaalsContact C-N 3.33Å; T227-M229 PolarHBondContact O-N 3.37Å; M229-V232 PolarHBondContact O-N 3.09Å; M229-R233 WeakPolarHBondContact O-CB 3.38Å; M229-R233 WeakPolarHBondContact O-CD 3.34Å; M229-R233 WeakPolarHBondContact O-CG 3.22Å; M229-R233 PolarHBondContact O-N 2.98Å; M229-L243 HydrophobicContact SD-CD1 4.17Å; M229-D267 WeakPolarHBondContact CE-OD1 3.43Å; M229-L269 HydrophobicContact CE-CB 4.22Å; M229-L269 HydrophobicContact CE-CD1 3.96Å; M229-I270 HydrophobicContact CE-CG1 4.47Å; M229-I270 HydrophobicContact SD-CD1 4.29Å; M229-I270 HydrophobicContact SD-CG1 4.49Å
230	N	92.9	Very high	91.5	Very high	83 Å²	83	53.4 Å²	53.4	44%	0.444	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-41.8	175.1	-70.5	-18.6	0	0	0	111.5	L200 E226 T227 V228 R233 Y234	L200-N230 HydrophobicContact CD2-CB 4.25Å; E226-N230 WeakPolarHBondContact O-CB 3.5Å; E226-N230 PolarHBondContact O-N 3.28Å; E226-N230 PolarHBondContact O-ND2 3.3Å; T227-N230 PolarHBondContact O-N 3.04Å; V228-N230 PolarHBondContact O-N 3.44Å; N230-R233 PolarHBondContact O-N 3.42Å; N230-Y234 PolarHBondContact O-N 3.21Å; N230-Y234 VanDerWaalsContact O-N 3.08Å
231	W	94.6	Very high	91.9	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-44.1	175	-178	92.9	0	0	0	111.9	L200 L202 A204 L207 T227 V228 Y234 R239 L242 V246	L200-W231 HydrophobicContact CD2-CB 4.46Å; L202-W231 PolarHBondContact O-NE1 3.47Å; A204-W231 HydrophobicContact CB-CH2 3.67Å; A204-W231 HydrophobicContact CB-CZ2 3.93Å; L207-W231 HydrophobicContact CD2-CB 4.26Å; L207-W231 HydrophobicContact CD2-CD2 3.48Å; L207-W231 VanDerWaalsContact CD2-CD2 3.48Å; L207-W231 HydrophobicContact CD2-CE3 3.85Å; L207-W231 HydrophobicContact CD2-CG 3.66Å; L207-W231 HydrophobicContact CD2-CZ2 4.33Å; L207-W231 HydrophobicContact CD2-CZ3 4.44Å; T227-W231 WeakPolarHBondContact O-CB 2.99Å; T227-W231 PolarHBondContact O-N 3.28Å; V228-W231 PolarHBondContact O-N 3.37Å; W231-Y234 PolarHBondContact O-N 3.19Å; W231-R239 HydrophobicContact CE3-CB 4.48Å; W231-R239 HydrophobicContact CE3-CG 4.36Å; W231-R239 HydrophobicContact CH2-CB 4.32Å; W231-R239 HydrophobicContact CH2-CG 3.74Å; W231-R239 HydrophobicContact CZ2-CG 4.28Å; W231-R239 VanDerWaalsContact CZ2-NE 3.31Å; W231-R239 HydrophobicContact CZ3-CB 3.93Å; W231-R239 HydrophobicContact CZ3-CG 3.79Å; W231-R239 VanDerWaalsContact NE1-CZ 3.31Å; W231-R239 WeakPolarHBondContact O-CD 3.37Å; W231-R239 PolarHBondContact O-NH1 2.91Å; W231-L242 HydrophobicContact CH2-CD1 4.39Å; W231-V246 HydrophobicContact CH2-CG2 4.48Å; W231-V246 HydrophobicContact CZ3-CG2 3.99Å
232	V	93.5	Very high	92.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-45.2	177.3	174.2	0	0	0	0	111.3	V228 M229 Y234 K235 E236 R239 L243 L269	V228-V232 HydrophobicContact CG1-CG2 4.45Å; V228-V232 WeakPolarHBondContact O-CG2 3.38Å; V228-V232 PolarHBondContact O-N 2.68Å; M229-V232 PolarHBondContact O-N 3.09Å; V232-Y234 VanDerWaalsContact C-N 3.27Å; V232-Y234 PolarHBondContact O-N 3.43Å; V232-K235 CarbonylContact O-C 3.58Å; V232-K235 VanDerWaalsContact O-C 3.29Å; V232-K235 PolarHBondContact O-N 2.95Å; V232-E236 VanDerWaalsContact O-CA 3.3Å; V232-E236 WeakPolarHBondContact O-CA 3.38Å; V232-E236 PolarHBondContact O-N 3.36Å; V232-E236 VanDerWaalsContact O-N 3.16Å; V232-R239 HydrophobicContact CG1-CB 4.29Å; V232-L243 HydrophobicContact CG2-CD1 3.98Å; V232-L269 HydrophobicContact CG1-CD1 4.31Å
233	R	93.3	Very high	92.3	Very high	121 Å²	121	54.6 Å²	54.6	46%	0.457	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-29.4	-179.9	-72.2	169	-175.5	163.8	-0.6	113.2	M229 N230 K235 D267 L269	M229-R233 WeakPolarHBondContact O-CB 3.38Å; M229-R233 WeakPolarHBondContact O-CD 3.34Å; M229-R233 WeakPolarHBondContact O-CG 3.22Å; M229-R233 PolarHBondContact O-N 2.98Å; N230-R233 PolarHBondContact O-N 3.42Å; R233-K235 VanDerWaalsContact C-N 3.31Å; R233-K235 PolarHBondContact O-N 3.36Å; R233-D267 IonicContact CZ-OD2 3.33Å; R233-D267 IonicContact NH2-OD2 2.74Å; R233-D267 PolarHBondContact NH2-OD2 3.47Å; R233-L269 HydrophobicContact CG-CD1 3.94Å
234	Y	92.5	Very high	92.4	Very high	109 Å²	109	52.9 Å²	52.9	43%	0.427	26%	0.263	S	S	.	.	H	α-helix	trans	-62.1	-35.4	178.2	-173.8	-105	0	0	0	113.3	L200 N230 W231 V232	L200-Y234 HydrophobicContact CB-CD1 3.99Å; L200-Y234 HydrophobicContact CB-CD2 4.16Å; L200-Y234 HydrophobicContact CB-CE1 4.38Å; L200-Y234 HydrophobicContact CB-CG 3.89Å; L200-Y234 HydrophobicContact CD1-CD2 3.74Å; L200-Y234 HydrophobicContact CD1-CE2 4.23Å; L200-Y234 HydrophobicContact CD1-CG 4.17Å; N230-Y234 PolarHBondContact O-N 3.21Å; N230-Y234 VanDerWaalsContact O-N 3.08Å; W231-Y234 PolarHBondContact O-N 3.19Å; V232-Y234 VanDerWaalsContact C-N 3.27Å; V232-Y234 PolarHBondContact O-N 3.43Å
235	K	91.9	Very high	92.4	Very high	84 Å²	84	59.5 Å²	59.5	37%	0.365	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	63.2	174.4	-66.5	-178.4	179.3	-174.2	0	110.8	V232 R233 S237 E238 R239	V232-K235 CarbonylContact O-C 3.58Å; V232-K235 VanDerWaalsContact O-C 3.29Å; V232-K235 PolarHBondContact O-N 2.95Å; R233-K235 VanDerWaalsContact C-N 3.31Å; R233-K235 PolarHBondContact O-N 3.36Å; K235-S237 VanDerWaalsContact C-N 3.31Å; K235-S237 PolarHBondContact O-N 3.33Å; K235-E238 PolarHBondContact O-N 3.26Å; K235-R239 HydrophobicContact CB-CG 4.04Å; K235-R239 VanDerWaalsContact O-CB 3.29Å; K235-R239 WeakPolarHBondContact O-CB 3.44Å; K235-R239 WeakPolarHBondContact O-CG 3.34Å; K235-R239 PolarHBondContact O-N 3.49Å
236	E	90.1	Very high	92.3	Very high	101 Å²	101	59.3 Å²	59.3	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-53.5	-44.8	-170.7	-170.5	178	156.3	0	0	113.1	V232 E238 R239 F240 L269	V232-E236 VanDerWaalsContact O-CA 3.3Å; V232-E236 WeakPolarHBondContact O-CA 3.38Å; V232-E236 PolarHBondContact O-N 3.36Å; V232-E236 VanDerWaalsContact O-N 3.16Å; E236-E238 PolarHBondContact O-N 3.36Å; E236-R239 PolarHBondContact O-N 2.99Å; E236-F240 WeakPolarHBondContact O-CB 3.45Å; E236-F240 PolarHBondContact O-N 2.99Å; E236-L269 HydrophobicContact CG-CD2 4.22Å; E236-L269 WeakPolarHBondContact OE1-CD2 3.44Å
237	S	89.8	Confident	92.3	Very high	108 Å²	108	55 Å²	55	76%	0.755	27%	0.268	S	S	*	.	H	α-helix	trans	-62.5	-38.1	-177.7	55.1	0	0	0	0	114.2	K235	K235-S237 VanDerWaalsContact C-N 3.31Å; K235-S237 PolarHBondContact O-N 3.33Å
238	E	91.8	Very high	92.3	Very high	132 Å²	132	59.4 Å²	59.4	62%	0.617	29%	0.288	S	S	*	.	H	α-helix	trans	-87.9	-32.1	-179.3	-65.8	176.5	-178.1	0	0	112.3	K235 E236	K235-E238 PolarHBondContact O-N 3.26Å; E236-E238 PolarHBondContact O-N 3.36Å
239	R	92.3	Very high	92.3	Very high	16 Å²	16	60.7 Å²	60.7	6%	0.06	29%	0.294	C	S	.	.	H	α-helix	trans	-97.2	-18.4	-170.2	-65.3	178.8	173.3	172.8	-5.4	114	L200 W231 V232 K235 E236 L242 L243	L200-R239 VanDerWaalsContact O-CZ 3.27Å; L200-R239 PolarHBondContact O-NH1 2.97Å; L200-R239 PolarHBondContact O-NH2 3.27Å; W231-R239 HydrophobicContact CE3-CB 4.48Å; W231-R239 HydrophobicContact CE3-CG 4.36Å; W231-R239 HydrophobicContact CH2-CB 4.32Å; W231-R239 HydrophobicContact CH2-CG 3.74Å; W231-R239 HydrophobicContact CZ2-CG 4.28Å; W231-R239 VanDerWaalsContact CZ2-NE 3.31Å; W231-R239 HydrophobicContact CZ3-CB 3.93Å; W231-R239 HydrophobicContact CZ3-CG 3.79Å; W231-R239 VanDerWaalsContact NE1-CZ 3.31Å; W231-R239 WeakPolarHBondContact O-CD 3.37Å; W231-R239 PolarHBondContact O-NH1 2.91Å; V232-R239 HydrophobicContact CG1-CB 4.29Å; K235-R239 HydrophobicContact CB-CG 4.04Å; K235-R239 VanDerWaalsContact O-CB 3.29Å; K235-R239 WeakPolarHBondContact O-CB 3.44Å; K235-R239 WeakPolarHBondContact O-CG 3.34Å; K235-R239 PolarHBondContact O-N 3.49Å; E236-R239 PolarHBondContact O-N 2.99Å; R239-L242 WeakPolarHBondContact O-CA 3.47Å; R239-L242 WeakPolarHBondContact O-CB 3.42Å; R239-L242 PolarHBondContact O-N 3.09Å; R239-L243 PolarHBondContact O-N 3.34Å
240	F	91.1	Very high	92.2	Very high	57 Å²	57	60.6 Å²	60.6	25%	0.25	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.5	-43.8	177.4	-178.9	-95.4	0	0	0	113.4	E236 L242 L243 L269 Q272 C273	E236-F240 WeakPolarHBondContact O-CB 3.45Å; E236-F240 PolarHBondContact O-N 2.99Å; F240-L242 PolarHBondContact O-N 3.26Å; F240-L243 VanDerWaalsContact O-CB 3.24Å; F240-L243 WeakPolarHBondContact O-CB 3.46Å; F240-L243 PolarHBondContact O-N 2.71Å; F240-L269 HydrophobicContact CD2-CD2 4.05Å; F240-L269 HydrophobicContact CE2-CB 4.34Å; F240-L269 HydrophobicContact CE2-CD2 4.17Å; F240-Q272 HydrophobicContact CE2-CB 4.24Å; F240-Q272 HydrophobicContact CZ-CB 3.93Å; F240-C273 HydrophobicContact CZ-CB 4.24Å
241	P	91.2	Very high	92.1	Very high	94 Å²	94	57.2 Å²	57.2	61%	0.61	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-65	-23.3	175.9	-21	34.2	0	0	0	114
242	L	91.5	Very high	91.8	Very high	70 Å²	70	57 Å²	57	37%	0.366	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-86.6	-9.7	179.6	-59.5	174.3	0	0	0	112.5	A204 W231 R239 F240 Y245 V246	A204-L242 HydrophobicContact CB-CD1 4.02Å; W231-L242 HydrophobicContact CH2-CD1 4.39Å; R239-L242 WeakPolarHBondContact O-CA 3.47Å; R239-L242 WeakPolarHBondContact O-CB 3.42Å; R239-L242 PolarHBondContact O-N 3.09Å; F240-L242 PolarHBondContact O-N 3.26Å; L242-Y245 PolarHBondContact O-N 3.36Å; L242-Y245 VanDerWaalsContact O-N 3.16Å; L242-V246 WeakPolarHBondContact O-CG2 3.46Å; L242-V246 PolarHBondContact O-N 3.07Å
243	L	92.4	Very high	91.4	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-53.1	-47.8	-176.3	174.7	66.6	0	0	0	113.3	M229 V232 R239 F240 Y245 V246 L247 L269 C273	M229-L243 HydrophobicContact SD-CD1 4.17Å; V232-L243 HydrophobicContact CG2-CD1 3.98Å; R239-L243 PolarHBondContact O-N 3.34Å; F240-L243 VanDerWaalsContact O-CB 3.24Å; F240-L243 WeakPolarHBondContact O-CB 3.46Å; F240-L243 PolarHBondContact O-N 2.71Å; L243-Y245 VanDerWaalsContact C-N 3.29Å; L243-Y245 PolarHBondContact O-N 2.74Å; L243-V246 PolarHBondContact O-N 3.08Å; L243-L247 WeakPolarHBondContact O-CB 3.18Å; L243-L247 PolarHBondContact O-N 3.02Å; L243-L269 HydrophobicContact CD2-CB 4.32Å; L243-C273 HydrophobicContact CD2-CB 4.41Å
244	P	91.9	Very high	90.9	Very high	25 Å²	25	52.3 Å²	52.3	16%	0.162	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-41.5	-180	-23.5	34.4	0	0	0	112.6	L247 E248 C273 D275 V276	P244-L247 PolarHBondContact O-N 3.28Å; P244-E248 PolarHBondContact O-N 2.96Å; P244-C273 WeakPolarHBondContact CG-SG 3.38Å; P244-D275 HydrophobicContact CB-CB 4.1Å; P244-D275 HydrophobicContact CG-CB 3.82Å; P244-V276 HydrophobicContact CB-CG2 4.31Å; P244-V276 HydrophobicContact CG-CG2 4.17Å
245	Y	91.6	Very high	90.4	Very high	138 Å²	138	47.5 Å²	47.5	54%	0.541	24%	0.24	S	C	.	.	H	α-helix	trans	-68.3	-43.1	-178	-178.4	-105	0	0	0	111.9	C208 L242 L243 N249	C208-Y245 HydrophobicContact CB-CE1 4.04Å; C208-Y245 VanDerWaalsContact SG-CD1 3.59Å; C208-Y245 WeakPolarHBondContact SG-CE1 3.44Å; L242-Y245 PolarHBondContact O-N 3.36Å; L242-Y245 VanDerWaalsContact O-N 3.16Å; L243-Y245 VanDerWaalsContact C-N 3.29Å; L243-Y245 PolarHBondContact O-N 2.74Å; Y245-N249 PolarHBondContact O-ND2 3.38Å
246	V	92.9	Very high	89.6	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-42.6	177.3	-176.8	0	0	0	0	110.4	L207 L211 V228 W231 L242 L243 E248 N249	L207-V246 HydrophobicContact CD2-CG1 3.96Å; L207-V246 HydrophobicContact CG-CG1 4.48Å; L211-V246 HydrophobicContact CD1-CG1 4.11Å; V228-V246 HydrophobicContact CB-CG1 4.36Å; V228-V246 HydrophobicContact CG1-CB 4.31Å; V228-V246 HydrophobicContact CG1-CG1 3.64Å; V228-V246 HydrophobicContact CG2-CG1 3.83Å; W231-V246 HydrophobicContact CH2-CG2 4.48Å; W231-V246 HydrophobicContact CZ3-CG2 3.99Å; L242-V246 WeakPolarHBondContact O-CG2 3.46Å; L242-V246 PolarHBondContact O-N 3.07Å; L243-V246 PolarHBondContact O-N 3.08Å; V246-E248 VanDerWaalsContact C-N 3.28Å; V246-E248 PolarHBondContact O-N 3.03Å; V246-N249 WeakPolarHBondContact O-CB 3.38Å; V246-N249 PolarHBondContact O-N 3.43Å; V246-N249 VanDerWaalsContact O-N 3.13Å; V246-N249 PolarHBondContact O-ND2 3.06Å
247	L	93	Very high	88.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68.9	-22.9	-177	-167.6	68.1	0	0	0	113.4	F225 L243 P244 N249 V250 L252 V276 R297	F225-L247 HydrophobicContact CD2-CD1 3.92Å; F225-L247 HydrophobicContact CE2-CD1 3.98Å; L243-L247 WeakPolarHBondContact O-CB 3.18Å; L243-L247 PolarHBondContact O-N 3.02Å; P244-L247 PolarHBondContact O-N 3.28Å; L247-N249 PolarHBondContact O-N 3.1Å; L247-V250 HydrophobicContact CD1-CB 4.23Å; L247-V250 HydrophobicContact CD1-CG2 4.07Å; L247-V250 WeakPolarHBondContact O-CB 3.45Å; L247-V250 PolarHBondContact O-N 3.37Å; L247-L252 HydrophobicContact CD1-CD2 4.4Å; L247-L252 HydrophobicContact CG-CD1 4.45Å; L247-V276 HydrophobicContact CD2-CB 4.37Å; L247-V276 HydrophobicContact CD2-CG1 3.39Å; L247-V276 HydrophobicContact CD2-CG2 4.02Å; L247-R297 PolarHBondContact O-NH2 2.85Å; L247-R297 VanDerWaalsContact O-NH2 3.08Å
248	E	92.3	Very high	88.3	Confident	104 Å²	104	49.3 Å²	49.3	49%	0.486	24%	0.239	S	C	.	.	H	α-helix	trans	-57.8	-31.3	171.1	-169.8	176.8	-173.3	0	0	112.2	P244 V246 V250 L279 R297	P244-E248 PolarHBondContact O-N 2.96Å; V246-E248 VanDerWaalsContact C-N 3.28Å; V246-E248 PolarHBondContact O-N 3.03Å; E248-V250 PolarHBondContact O-N 3.05Å; E248-L279 HydrophobicContact CB-CD1 4.49Å; E248-R297 WeakPolarHBondContact O-CD 3.32Å; E248-R297 PolarHBondContact O-NE 3.16Å
249	N	93	Very high	87.7	Confident	26 Å²	26	44.7 Å²	44.7	14%	0.139	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-2.8	178.6	-54.8	-76.6	0	0	0	113.4	L211 Y245 V246 L247 R301	L211-N249 HydrophobicContact CB-CB 3.84Å; Y245-N249 PolarHBondContact O-ND2 3.38Å; V246-N249 WeakPolarHBondContact O-CB 3.38Å; V246-N249 PolarHBondContact O-N 3.43Å; V246-N249 VanDerWaalsContact O-N 3.13Å; V246-N249 PolarHBondContact O-ND2 3.06Å; L247-N249 PolarHBondContact O-N 3.1Å; N249-R301 PolarHBondContact O-NH2 3.11Å
250	V	92.8	Very high	87.4	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-94.9	132.1	175	-173.9	0	0	0	0	109.9	E221 V224 F225 V228 L247 E248 L252 R297	E221-V250 HydrophobicContact CG-CG1 4.05Å; V224-V250 HydrophobicContact CG1-CG1 4.43Å; V224-V250 HydrophobicContact CG1-CG2 4.16Å; F225-V250 HydrophobicContact CB-CG1 4.12Å; V228-V250 HydrophobicContact CB-CG2 4.46Å; V228-V250 HydrophobicContact CG2-CG2 3.76Å; L247-V250 HydrophobicContact CD1-CB 4.23Å; L247-V250 HydrophobicContact CD1-CG2 4.07Å; L247-V250 WeakPolarHBondContact O-CB 3.45Å; L247-V250 PolarHBondContact O-N 3.37Å; E248-V250 PolarHBondContact O-N 3.05Å; V250-L252 VanDerWaalsContact C-N 3.26Å; V250-L252 HydrophobicContact CB-CD2 4.5Å; V250-L252 HydrophobicContact CG1-CD2 3.99Å; V250-L252 PolarHBondContact O-N 2.74Å; V250-R297 VanDerWaalsContact O-CZ 3.26Å; V250-R297 PolarHBondContact O-NE 3.43Å; V250-R297 PolarHBondContact O-NH2 2.53Å
251	R	90.2	Very high	87.2	Confident	12 Å²	12	45.4 Å²	45.4	5%	0.045	23%	0.227	C	C	.	.			trans	-85.5	61.6	-175.5	-53.5	-178.3	-170.2	-165	-0.9	111.4	D214 E221 P253 L254 R297 K299 P300	D214-R251 IonicContact OD1-CZ 2.68Å; D214-R251 VanDerWaalsContact OD1-CZ 3.28Å; D214-R251 IonicContact OD1-NH1 2.68Å; D214-R251 PolarHBondContact OD1-NH1 3.21Å; D214-R251 VanDerWaalsContact OD1-NH1 3.08Å; D214-R251 IonicContact OD1-NH2 3.8Å; D214-R251 PolarHBondContact OD1-NH2 2.99Å; E221-R251 HydrophobicContact CG-CB 3.88Å; E221-R251 PolarHBondContact OE1-N 3.1Å; R251-P253 VanDerWaalsContact C-N 3.27Å; R251-P253 VanDerWaalsContact O-N 3.11Å; R251-L254 HydrophobicContact CB-CB 4.38Å; R251-L254 HydrophobicContact CB-CD1 3.61Å; R251-L254 HydrophobicContact CB-CG 3.84Å; R251-L254 HydrophobicContact CG-CD1 4.3Å; R251-L254 VanDerWaalsContact O-CB 3.3Å; R251-L254 WeakPolarHBondContact O-CB 3.39Å; R251-L254 PolarHBondContact O-N 3.16Å; R251-R297 WeakPolarHBondContact CB-O 3.38Å; R251-K299 WeakPolarHBondContact CD-O 3.25Å; R251-K299 PolarHBondContact NH1-O 3.19Å; R251-P300 PolarHBondContact NH1-O 3.26Å
252	L	89.6	Confident	87	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-47.7	-37.1	-178.2	-59.9	176.4	0	0	0	115.2	F225 L247 V250 L254 L255 F260 V264 L279 L280 A283	F225-L252 HydrophobicContact CD2-CD2 4.11Å; L247-L252 HydrophobicContact CD1-CD2 4.4Å; L247-L252 HydrophobicContact CG-CD1 4.45Å; V250-L252 VanDerWaalsContact C-N 3.26Å; V250-L252 HydrophobicContact CB-CD2 4.5Å; V250-L252 HydrophobicContact CG1-CD2 3.99Å; V250-L252 PolarHBondContact O-N 2.74Å; L252-L254 PolarHBondContact O-N 3.06Å; L252-L254 VanDerWaalsContact O-N 3.11Å; L252-L255 HydrophobicContact CD2-CD1 3.66Å; L252-L255 WeakPolarHBondContact O-CB 3.44Å; L252-L255 PolarHBondContact O-N 2.86Å; L252-L255 VanDerWaalsContact O-N 3.14Å; L252-F260 HydrophobicContact CB-CE2 4.47Å; L252-V264 HydrophobicContact CD2-CG1 4.31Å; L252-L279 HydrophobicContact CD1-CB 4.18Å; L252-L280 HydrophobicContact CD1-CD2 4.15Å; L252-A283 HydrophobicContact CB-CB 3.99Å
253	P	84.9	Confident	86.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-63.6	-9.8	175	-22.8	34.6	0	0	0	115.5	R251 E282 A283 Y286 H287 R297 T298	R251-P253 VanDerWaalsContact C-N 3.27Å; R251-P253 VanDerWaalsContact O-N 3.11Å; P253-E282 HydrophobicContact CG-CG 4.45Å; P253-A283 HydrophobicContact CG-CB 4.2Å; P253-Y286 HydrophobicContact CB-CD1 3.7Å; P253-Y286 HydrophobicContact CB-CE1 4.49Å; P253-Y286 HydrophobicContact CB-CG 3.76Å; P253-Y286 WeakPolarHBondContact O-CD1 3.35Å; P253-Y286 VanDerWaalsContact O-CE1 3.31Å; P253-Y286 WeakPolarHBondContact O-CE1 3.29Å; P253-H287 PolarHBondContact O-NE2 3.37Å; P253-R297 HydrophobicContact CG-CB 4.47Å; P253-T298 HydrophobicContact CB-CG2 3.92Å; P253-T298 HydrophobicContact CG-CG2 4.05Å
254	L	81.6	Confident	86.9	Confident	22 Å²	22	45.2 Å²	45.2	12%	0.115	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-96.7	-8.4	177.4	-54	-173.7	0	0	0	113.1	E221 R251 L252 P300	E221-L254 HydrophobicContact CB-CB 4.44Å; R251-L254 HydrophobicContact CB-CB 4.38Å; R251-L254 HydrophobicContact CB-CD1 3.61Å; R251-L254 HydrophobicContact CB-CG 3.84Å; R251-L254 HydrophobicContact CG-CD1 4.3Å; R251-L254 VanDerWaalsContact O-CB 3.3Å; R251-L254 WeakPolarHBondContact O-CB 3.39Å; R251-L254 PolarHBondContact O-N 3.16Å; L252-L254 PolarHBondContact O-N 3.06Å; L252-L254 VanDerWaalsContact O-N 3.11Å; L254-P300 HydrophobicContact CD1-CB 4.42Å
255	L	82.7	Confident	86.8	Confident	8 Å²	8	45.8 Å²	45.8	4%	0.042	22%	0.22	C	C	.	.	S	Bend	trans	-68.4	151.5	177.4	-66.7	174	0	0	0	110.9	E221 A222 L252 Y259 F260 V264 H287	E221-L255 VanDerWaalsContact C-CD2 3.5Å; E221-L255 HydrophobicContact CB-CD2 3.9Å; E221-L255 HydrophobicContact CG-CD2 4.31Å; A222-L255 HydrophobicContact CB-CD2 4.06Å; A222-L255 VanDerWaalsContact N-CD2 3.28Å; L252-L255 HydrophobicContact CD2-CD1 3.66Å; L252-L255 WeakPolarHBondContact O-CB 3.44Å; L252-L255 PolarHBondContact O-N 2.86Å; L252-L255 VanDerWaalsContact O-N 3.14Å; L255-Y259 HydrophobicContact CD2-CD1 4.34Å; L255-Y259 HydrophobicContact CD2-CE1 4.45Å; L255-F260 HydrophobicContact CB-CB 4.44Å; L255-F260 HydrophobicContact CD1-CD2 4.39Å; L255-V264 HydrophobicContact CD1-CG2 3.72Å; L255-H287 PolarHBondContact O-NE2 2.69Å
256	D	76.1	Confident	86.7	Confident	94 Å²	94	41.3 Å²	41.3	50%	0.503	21%	0.211	S	C	.	.			trans	-58.4	132.6	170	178.1	-91	0	0	0	110.1	W258 Y259 F260	D256-W258 PolarHBondContact O-N 3.46Å; D256-W258 WeakPolarHBondContact OD1-CA 3.38Å; D256-W258 VanDerWaalsContact OD1-CB 3.23Å; D256-W258 WeakPolarHBondContact OD1-CB 3.42Å; D256-W258 PolarHBondContact OD1-N 3.24Å; D256-Y259 PolarHBondContact O-N 2.77Å; D256-Y259 VanDerWaalsContact O-N 3.15Å; D256-Y259 PolarHBondContact OD1-N 3.02Å; D256-F260 WeakPolarHBondContact O-CB 3.44Å; D256-F260 PolarHBondContact O-N 3.47Å
257	P	75.5	Confident	86.7	Confident	69 Å²	69	42.3 Å²	42.3	45%	0.448	22%	0.217	S	C	.	.	H	α-helix	trans	-58.4	-32.9	-176.5	-27.9	35.5	0	0	0	114.3	V261	P257-V261 WeakPolarHBondContact O-CG2 3.26Å; P257-V261 PolarHBondContact O-N 2.99Å
258	W	75.2	Confident	86.6	Confident	167 Å²	167	50.1 Å²	50.1	63%	0.633	25%	0.251	S	S	*	.	H	α-helix	trans	-71.8	-46.2	177.1	178.6	85.9	0	0	0	110.4	D256 F260 V261 E262	D256-W258 PolarHBondContact O-N 3.46Å; D256-W258 WeakPolarHBondContact OD1-CA 3.38Å; D256-W258 VanDerWaalsContact OD1-CB 3.23Å; D256-W258 WeakPolarHBondContact OD1-CB 3.42Å; D256-W258 PolarHBondContact OD1-N 3.24Å; W258-F260 VanDerWaalsContact C-N 3.31Å; W258-F260 PolarHBondContact O-N 3.42Å; W258-V261 PolarHBondContact O-N 3.45Å; W258-E262 WeakPolarHBondContact CZ2-OE2 3.15Å; W258-E262 PolarHBondContact NE1-OE2 3.3Å; W258-E262 WeakPolarHBondContact O-CB 3.41Å; W258-E262 PolarHBondContact O-N 2.91Å
259	Y	79.7	Confident	86.5	Confident	36 Å²	36	45.8 Å²	45.8	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-39.7	174.8	-175.4	-86.8	0	0	0	112.5	A222 F225 E226 L255 D256 T263 V264	A222-Y259 HydrophobicContact CB-CD1 4.42Å; A222-Y259 HydrophobicContact CB-CE1 4.01Å; A222-Y259 HydrophobicContact CB-CE2 4.32Å; F225-Y259 HydrophobicContact CD1-CE1 4.08Å; E226-Y259 WeakPolarHBondContact CG-OH 3.46Å; E226-Y259 PolarHBondContact OE1-OH 3.4Å; L255-Y259 HydrophobicContact CD2-CD1 4.34Å; L255-Y259 HydrophobicContact CD2-CE1 4.45Å; D256-Y259 PolarHBondContact O-N 2.77Å; D256-Y259 VanDerWaalsContact O-N 3.15Å; D256-Y259 PolarHBondContact OD1-N 3.02Å; Y259-T263 HydrophobicContact CE1-CG2 4.21Å; Y259-T263 HydrophobicContact CE2-CG2 4.23Å; Y259-T263 VanDerWaalsContact O-CB 3.26Å; Y259-T263 WeakPolarHBondContact O-CB 3.49Å; Y259-T263 PolarHBondContact O-N 2.97Å; Y259-T263 PolarHBondContact O-OG1 3.27Å; Y259-V264 HydrophobicContact CD1-CG2 4.35Å; Y259-V264 HydrophobicContact CE1-CG2 4.23Å
260	F	86.8	Confident	86.4	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	23%	0.225	C	C	.	.	I	π-helix	trans	-60.3	-47.1	178	176.5	-99.8	0	0	0	112.1	L252 L255 D256 W258 V264 E265 L280 A283 R284	L252-F260 HydrophobicContact CB-CE2 4.47Å; L255-F260 HydrophobicContact CB-CB 4.44Å; L255-F260 HydrophobicContact CD1-CD2 4.39Å; D256-F260 WeakPolarHBondContact O-CB 3.44Å; D256-F260 PolarHBondContact O-N 3.47Å; W258-F260 VanDerWaalsContact C-N 3.31Å; W258-F260 PolarHBondContact O-N 3.42Å; F260-V264 HydrophobicContact CD2-CB 4.06Å; F260-V264 HydrophobicContact CD2-CG1 4.24Å; F260-V264 HydrophobicContact CD2-CG2 4.22Å; F260-V264 HydrophobicContact CE2-CB 4.44Å; F260-V264 HydrophobicContact CE2-CG1 4.19Å; F260-V264 VanDerWaalsContact O-CB 3.27Å; F260-V264 WeakPolarHBondContact O-CB 3.27Å; F260-V264 PolarHBondContact O-N 3.31Å; F260-E265 HydrophobicContact CD1-CG 4.24Å; F260-E265 HydrophobicContact CE1-CG 3.81Å; F260-E265 WeakPolarHBondContact CE1-OE1 3.46Å; F260-E265 HydrophobicContact CZ-CG 4.06Å; F260-E265 PolarHBondContact O-N 2.85Å; F260-L280 HydrophobicContact CE2-CD2 3.79Å; F260-L280 HydrophobicContact CZ-CB 4.22Å; F260-L280 HydrophobicContact CZ-CD2 3.88Å; F260-A283 HydrophobicContact CD2-CB 4.43Å; F260-A283 HydrophobicContact CE2-CB 3.75Å; F260-A283 HydrophobicContact CZ-CB 3.84Å; F260-R284 HydrophobicContact CE1-CG 3.89Å; F260-R284 HydrophobicContact CZ-CG 4.37Å
261	V	85.7	Confident	86.3	Confident	85 Å²	85	53.3 Å²	53.3	52%	0.515	26%	0.257	S	S	.	.	I	π-helix	trans	-73	-43.3	-179	177.1	0	0	0	0	111.5	P257 W258	P257-V261 WeakPolarHBondContact O-CG2 3.26Å; P257-V261 PolarHBondContact O-N 2.99Å; W258-V261 PolarHBondContact O-N 3.45Å
262	E	87.9	Confident	86.2	Confident	109 Å²	109	58.6 Å²	58.6	51%	0.509	28%	0.283	S	S	.	.	I	π-helix	trans	-77.6	-35.3	-173.6	-173.1	160.1	155.5	0	0	113.5	W258 A266	W258-E262 WeakPolarHBondContact CZ2-OE2 3.15Å; W258-E262 PolarHBondContact NE1-OE2 3.3Å; W258-E262 WeakPolarHBondContact O-CB 3.41Å; W258-E262 PolarHBondContact O-N 2.91Å; E262-A266 WeakPolarHBondContact O-CB 3.47Å
263	T	89.2	Confident	86.3	Confident	51 Å²	51	59.1 Å²	59.1	31%	0.313	29%	0.286	S	S	.	.	I	π-helix	trans	-104.9	-54.7	-174.6	-50.4	0	0	0	0	111.4	F225 Y259 D267	F225-T263 HydrophobicContact CE1-CG2 4.25Å; Y259-T263 HydrophobicContact CE1-CG2 4.21Å; Y259-T263 HydrophobicContact CE2-CG2 4.23Å; Y259-T263 VanDerWaalsContact O-CB 3.26Å; Y259-T263 WeakPolarHBondContact O-CB 3.49Å; Y259-T263 PolarHBondContact O-N 2.97Å; Y259-T263 PolarHBondContact O-OG1 3.27Å; T263-D267 PolarHBondContact O-N 3.24Å
264	V	91.9	Very high	86.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	I	π-helix	trans	-71.3	-52.3	-172.4	-175.6	0	0	0	0	111	F225 L252 L255 Y259 F260 A266 D267 I270 L280	F225-V264 HydrophobicContact CD1-CG2 4.13Å; F225-V264 HydrophobicContact CD2-CG2 4.24Å; F225-V264 HydrophobicContact CE1-CG2 3.84Å; F225-V264 HydrophobicContact CE2-CB 4.32Å; F225-V264 HydrophobicContact CE2-CG1 3.78Å; F225-V264 HydrophobicContact CE2-CG2 3.96Å; F225-V264 HydrophobicContact CG-CG2 4.32Å; F225-V264 HydrophobicContact CZ-CB 4.06Å; F225-V264 HydrophobicContact CZ-CG1 3.94Å; F225-V264 HydrophobicContact CZ-CG2 3.75Å; L252-V264 HydrophobicContact CD2-CG1 4.31Å; L255-V264 HydrophobicContact CD1-CG2 3.72Å; Y259-V264 HydrophobicContact CD1-CG2 4.35Å; Y259-V264 HydrophobicContact CE1-CG2 4.23Å; F260-V264 HydrophobicContact CD2-CB 4.06Å; F260-V264 HydrophobicContact CD2-CG1 4.24Å; F260-V264 HydrophobicContact CD2-CG2 4.22Å; F260-V264 HydrophobicContact CE2-CB 4.44Å; F260-V264 HydrophobicContact CE2-CG1 4.19Å; F260-V264 VanDerWaalsContact O-CB 3.27Å; F260-V264 WeakPolarHBondContact O-CB 3.27Å; F260-V264 PolarHBondContact O-N 3.31Å; V264-A266 VanDerWaalsContact C-N 3.3Å; V264-A266 PolarHBondContact O-N 3.43Å; V264-D267 PolarHBondContact O-N 3.34Å; V264-I270 HydrophobicContact CG1-CD1 3.77Å; V264-I270 WeakPolarHBondContact O-CD1 3.26Å; V264-L280 HydrophobicContact CG1-CD2 3.89Å
265	E	89.7	Confident	86.8	Confident	38 Å²	38	68.1 Å²	68.1	18%	0.178	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-22.1	-178.9	-63.7	-167	153.9	0	0	113.5	F260 R271 R284	F260-E265 HydrophobicContact CD1-CG 4.24Å; F260-E265 HydrophobicContact CE1-CG 3.81Å; F260-E265 WeakPolarHBondContact CE1-OE1 3.46Å; F260-E265 HydrophobicContact CZ-CG 4.06Å; F260-E265 PolarHBondContact O-N 2.85Å; E265-R271 PolarHBondContact O-NE 2.88Å; E265-R271 PolarHBondContact O-NH2 3.37Å; E265-R284 IonicContact OE1-CZ 2.76Å; E265-R284 IonicContact OE1-NE 3.81Å; E265-R284 PolarHBondContact OE1-NE 3.42Å; E265-R284 IonicContact OE1-NH2 2.88Å; E265-R284 PolarHBondContact OE1-NH2 3.4Å; E265-R284 IonicContact OE2-NH2 3.82Å
266	A	90.4	Very high	87.2	Confident	43 Å²	43	67.7 Å²	67.7	36%	0.355	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-19.4	177	0	0	0	0	0	113.5	E262 V264 K268	E262-A266 WeakPolarHBondContact O-CB 3.47Å; V264-A266 VanDerWaalsContact C-N 3.3Å; V264-A266 PolarHBondContact O-N 3.43Å; A266-K268 PolarHBondContact O-N 3.46Å
267	D	92.8	Very high	87.8	Confident	21 Å²	21	68.2 Å²	68.2	11%	0.112	34%	0.336	C	S	.	.			trans	-62	134.7	-176.2	-169.7	-77.9	0	0	0	112.1	M229 R233 T263 V264 L269 I270 R271	M229-D267 WeakPolarHBondContact CE-OD1 3.43Å; R233-D267 IonicContact CZ-OD2 3.33Å; R233-D267 IonicContact NH2-OD2 2.74Å; R233-D267 PolarHBondContact NH2-OD2 3.47Å; T263-D267 PolarHBondContact O-N 3.24Å; V264-D267 PolarHBondContact O-N 3.34Å; D267-L269 WeakPolarHBondContact OD1-CB 3.38Å; D267-L269 PolarHBondContact OD1-N 3.15Å; D267-I270 HydrophobicContact CB-CB 4.3Å; D267-I270 HydrophobicContact CB-CD1 4.1Å; D267-I270 HydrophobicContact CB-CG1 4.22Å; D267-I270 PolarHBondContact OD1-N 2.98Å; D267-R271 WeakPolarHBondContact O-CG 3.41Å; D267-R271 PolarHBondContact O-N 3.35Å; D267-R271 VanDerWaalsContact O-N 3.14Å
268	K	90.7	Very high	88.5	Confident	165 Å²	165	68.7 Å²	68.7	72%	0.717	34%	0.338	S	S	*	.	H	α-helix	trans	-66.5	-39.1	-175.8	-66.5	-179.9	-177.9	175.1	0	112.6	A266 R271 Q272	A266-K268 PolarHBondContact O-N 3.46Å; K268-R271 PolarHBondContact O-N 2.94Å; K268-Q272 VanDerWaalsContact O-CG 3.26Å; K268-Q272 WeakPolarHBondContact O-CG 3.35Å; K268-Q272 PolarHBondContact O-N 3.27Å; K268-Q272 VanDerWaalsContact O-N 3.16Å
269	L	90.5	Very high	89.2	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-39.9	-177.7	-61.5	176.3	0	0	0	110.5	M229 V232 R233 E236 F240 L243 D267 Q272 C273	M229-L269 HydrophobicContact CE-CB 4.22Å; M229-L269 HydrophobicContact CE-CD1 3.96Å; V232-L269 HydrophobicContact CG1-CD1 4.31Å; R233-L269 HydrophobicContact CG-CD1 3.94Å; E236-L269 HydrophobicContact CG-CD2 4.22Å; E236-L269 WeakPolarHBondContact OE1-CD2 3.44Å; F240-L269 HydrophobicContact CD2-CD2 4.05Å; F240-L269 HydrophobicContact CE2-CB 4.34Å; F240-L269 HydrophobicContact CE2-CD2 4.17Å; L243-L269 HydrophobicContact CD2-CB 4.32Å; D267-L269 WeakPolarHBondContact OD1-CB 3.38Å; D267-L269 PolarHBondContact OD1-N 3.15Å; L269-Q272 PolarHBondContact O-N 3.29Å; L269-C273 PolarHBondContact O-N 3.28Å
270	I	91.1	Very high	89.8	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-43.2	177.2	-66.5	179.3	0	0	0	110.8	F225 M229 V264 D267 Q272 C273 V276 L280	F225-I270 HydrophobicContact CE2-CD1 3.62Å; F225-I270 HydrophobicContact CZ-CD1 3.59Å; M229-I270 HydrophobicContact CE-CG1 4.47Å; M229-I270 HydrophobicContact SD-CD1 4.29Å; M229-I270 HydrophobicContact SD-CG1 4.49Å; V264-I270 HydrophobicContact CG1-CD1 3.77Å; V264-I270 WeakPolarHBondContact O-CD1 3.26Å; D267-I270 HydrophobicContact CB-CB 4.3Å; D267-I270 HydrophobicContact CB-CD1 4.1Å; D267-I270 HydrophobicContact CB-CG1 4.22Å; D267-I270 PolarHBondContact OD1-N 2.98Å; I270-Q272 VanDerWaalsContact C-N 3.27Å; I270-Q272 PolarHBondContact O-N 2.97Å; I270-C273 PolarHBondContact O-N 3.3Å; I270-V276 HydrophobicContact CG2-CG1 3.97Å; I270-L280 HydrophobicContact CG2-CD1 3.85Å; I270-L280 HydrophobicContact CG2-CD2 4.48Å
271	R	89.4	Confident	89.8	Confident	179 Å²	179	65.5 Å²	65.5	68%	0.675	33%	0.333	S	S	*	.	H	α-helix	trans	-64.5	-30	177.1	-73.9	178.5	177.6	-171.2	-0.7	113.9	E265 D267 K268 C273	E265-R271 PolarHBondContact O-NE 2.88Å; E265-R271 PolarHBondContact O-NH2 3.37Å; D267-R271 WeakPolarHBondContact O-CG 3.41Å; D267-R271 PolarHBondContact O-N 3.35Å; D267-R271 VanDerWaalsContact O-N 3.14Å; K268-R271 PolarHBondContact O-N 2.94Å; R271-C273 VanDerWaalsContact C-N 3.3Å
272	Q	89.6	Confident	89.8	Confident	124 Å²	124	63.2 Å²	63.2	58%	0.579	32%	0.316	S	S	*	.	H	α-helix	trans	-78.4	-15.9	178.7	-73.5	173.1	1.9	0	0	112.8	F240 K268 L269 I270 P274	F240-Q272 HydrophobicContact CE2-CB 4.24Å; F240-Q272 HydrophobicContact CZ-CB 3.93Å; K268-Q272 VanDerWaalsContact O-CG 3.26Å; K268-Q272 WeakPolarHBondContact O-CG 3.35Å; K268-Q272 PolarHBondContact O-N 3.27Å; K268-Q272 VanDerWaalsContact O-N 3.16Å; L269-Q272 PolarHBondContact O-N 3.29Å; I270-Q272 VanDerWaalsContact C-N 3.27Å; I270-Q272 PolarHBondContact O-N 2.97Å; Q272-P274 WeakPolarHBondContact O-CD 3.24Å
273	C	90.4	Very high	89.7	Confident	10 Å²	10	58 Å²	58	7%	0.068	29%	0.292	C	S	.	.			trans	-105.8	103.3	-176.7	-166.9	0	0	0	0	111.7	F240 L243 P244 L269 I270 R271 D275 V276	F240-C273 HydrophobicContact CZ-CB 4.24Å; L243-C273 HydrophobicContact CD2-CB 4.41Å; P244-C273 WeakPolarHBondContact CG-SG 3.38Å; L269-C273 PolarHBondContact O-N 3.28Å; I270-C273 PolarHBondContact O-N 3.3Å; R271-C273 VanDerWaalsContact C-N 3.3Å; C273-D275 VanDerWaalsContact C-N 3.27Å; C273-D275 PolarHBondContact O-N 2.67Å; C273-V276 HydrophobicContact CB-CG2 4.05Å; C273-V276 PolarHBondContact O-N 3.31Å
274	P	87.7	Confident	89.4	Confident	97 Å²	97	59.6 Å²	59.6	63%	0.63	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67.2	-27.1	-178.8	27	-33.9	0	0	0	113.1	Q272 V276 F277	Q272-P274 WeakPolarHBondContact O-CD 3.24Å; P274-V276 PolarHBondContact O-N 3.47Å; P274-F277 WeakPolarHBondContact O-CB 3.3Å; P274-F277 PolarHBondContact O-N 2.9Å
275	D	90.4	Very high	88.6	Confident	115 Å²	115	62.3 Å²	62.3	62%	0.615	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-67.7	-16.9	-177.4	-59.2	-39.7	0	0	0	113.2	P244 C273 F277 P278	P244-D275 HydrophobicContact CB-CB 4.1Å; P244-D275 HydrophobicContact CG-CB 3.82Å; C273-D275 VanDerWaalsContact C-N 3.27Å; C273-D275 PolarHBondContact O-N 2.67Å; D275-F277 VanDerWaalsContact C-N 3.34Å; D275-P278 WeakPolarHBondContact O-CD 3.46Å
276	V	91.2	Very high	88	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-79.5	-18.5	175.3	175.4	0	0	0	0	112.1	P244 L247 I270 C273 P274 P278 L279 L280	P244-V276 HydrophobicContact CB-CG2 4.31Å; P244-V276 HydrophobicContact CG-CG2 4.17Å; L247-V276 HydrophobicContact CD2-CB 4.37Å; L247-V276 HydrophobicContact CD2-CG1 3.39Å; L247-V276 HydrophobicContact CD2-CG2 4.02Å; I270-V276 HydrophobicContact CG2-CG1 3.97Å; C273-V276 HydrophobicContact CB-CG2 4.05Å; C273-V276 PolarHBondContact O-N 3.31Å; P274-V276 PolarHBondContact O-N 3.47Å; V276-P278 VanDerWaalsContact C-CD 3.46Å; V276-L279 WeakPolarHBondContact O-CB 3.38Å; V276-L279 PolarHBondContact O-N 3.46Å; V276-L280 HydrophobicContact CG1-CD1 4.28Å; V276-L280 HydrophobicContact CG1-CD2 4.36Å; V276-L280 HydrophobicContact CG1-CG 4.02Å; V276-L280 PolarHBondContact O-N 2.87Å
277	F	88.8	Confident	87.1	Confident	105 Å²	105	61.7 Å²	61.7	46%	0.461	30%	0.295	S	S	.	.	H	α-helix	trans	-55.9	-41.8	-173.1	-173.7	-95.4	0	0	0	115	P274 D275 L279 L280 Q281	P274-F277 WeakPolarHBondContact O-CB 3.3Å; P274-F277 PolarHBondContact O-N 2.9Å; D275-F277 VanDerWaalsContact C-N 3.34Å; F277-L279 PolarHBondContact O-N 3.29Å; F277-L280 PolarHBondContact O-N 2.71Å; F277-Q281 PolarHBondContact O-N 2.99Å
278	P	90.6	Very high	86	Confident	78 Å²	78	66.6 Å²	66.6	51%	0.506	32%	0.321	S	S	.	.	H	α-helix	trans	-58.5	-37.3	176.4	-24.2	35.5	0	0	0	112.8	D275 V276 Q281 E282	D275-P278 WeakPolarHBondContact O-CD 3.46Å; V276-P278 VanDerWaalsContact C-CD 3.46Å; P278-Q281 PolarHBondContact O-N 3.27Å; P278-E282 PolarHBondContact O-N 3.14Å
279	L	89.9	Confident	84.7	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-40.2	-180	-46.2	-175.4	0	0	0	111.4	E248 L252 V276 F277 A283	E248-L279 HydrophobicContact CB-CD1 4.49Å; L252-L279 HydrophobicContact CD1-CB 4.18Å; V276-L279 WeakPolarHBondContact O-CB 3.38Å; V276-L279 PolarHBondContact O-N 3.46Å; F277-L279 PolarHBondContact O-N 3.29Å; L279-A283 PolarHBondContact O-N 3.45Å
280	L	91.2	Very high	83.4	Confident	13 Å²	13	59 Å²	59	7%	0.068	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-39	174.9	-59.5	177.9	0	0	0	111.3	L252 F260 V264 I270 V276 F277 A283 R284	L252-L280 HydrophobicContact CD1-CD2 4.15Å; F260-L280 HydrophobicContact CE2-CD2 3.79Å; F260-L280 HydrophobicContact CZ-CB 4.22Å; F260-L280 HydrophobicContact CZ-CD2 3.88Å; V264-L280 HydrophobicContact CG1-CD2 3.89Å; I270-L280 HydrophobicContact CG2-CD1 3.85Å; I270-L280 HydrophobicContact CG2-CD2 4.48Å; V276-L280 HydrophobicContact CG1-CD1 4.28Å; V276-L280 HydrophobicContact CG1-CD2 4.36Å; V276-L280 HydrophobicContact CG1-CG 4.02Å; V276-L280 PolarHBondContact O-N 2.87Å; F277-L280 PolarHBondContact O-N 2.71Å; L280-A283 PolarHBondContact O-N 3.47Å; L280-R284 WeakPolarHBondContact O-CG 3.47Å; L280-R284 PolarHBondContact O-N 2.93Å
281	Q	86.8	Confident	81.8	Confident	101 Å²	101	60.4 Å²	60.4	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-39.5	178.9	-171.8	173.4	6.8	0	0	111.9	F277 P278 R284 M285	F277-Q281 PolarHBondContact O-N 2.99Å; P278-Q281 PolarHBondContact O-N 3.27Å; Q281-R284 PolarHBondContact O-N 2.91Å; Q281-M285 WeakPolarHBondContact O-CB 3.2Å; Q281-M285 VanDerWaalsContact O-CG 3.26Å; Q281-M285 WeakPolarHBondContact O-CG 3.4Å; Q281-M285 PolarHBondContact O-N 2.59Å
282	E	85.6	Confident	80.1	Confident	37 Å²	37	54.2 Å²	54.2	17%	0.173	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-51.7	171.9	-176.6	-173.3	-171.6	0	0	111.1	P253 P278 R284 M285 Y286 I293 T295 R297	P253-E282 HydrophobicContact CG-CG 4.45Å; P278-E282 PolarHBondContact O-N 3.14Å; E282-R284 PolarHBondContact O-N 3.36Å; E282-M285 PolarHBondContact O-N 2.77Å; E282-Y286 WeakPolarHBondContact O-CB 3.39Å; E282-Y286 PolarHBondContact O-N 3.11Å; E282-I293 HydrophobicContact CG-CG2 4.42Å; E282-T295 WeakPolarHBondContact OE1-CB 3.43Å; E282-T295 VanDerWaalsContact OE1-CG2 3.24Å; E282-T295 WeakPolarHBondContact OE1-CG2 3.39Å; E282-T295 PolarHBondContact OE1-OG1 2.98Å; E282-R297 IonicContact OE2-NH1 3.69Å
283	A	85.2	Confident	78.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-43.2	179.4	0	0	0	0	0	112.7	L252 P253 F260 L279 L280 M285 Y286 H287	L252-A283 HydrophobicContact CB-CB 3.99Å; P253-A283 HydrophobicContact CG-CB 4.2Å; F260-A283 HydrophobicContact CD2-CB 4.43Å; F260-A283 HydrophobicContact CE2-CB 3.75Å; F260-A283 HydrophobicContact CZ-CB 3.84Å; L279-A283 PolarHBondContact O-N 3.45Å; L280-A283 PolarHBondContact O-N 3.47Å; A283-M285 PolarHBondContact O-N 2.77Å; A283-Y286 PolarHBondContact O-N 3.38Å; A283-H287 VanDerWaalsContact O-CG 3.31Å; A283-H287 PolarHBondContact O-N 3.09Å; A283-H287 PolarHBondContact O-ND1 3.19Å
284	R	82.8	Confident	77.7	Confident	84 Å²	84	50.5 Å²	50.5	32%	0.317	26%	0.259	S	S	.	.	H	α-helix	trans	-58.6	-47.9	174.8	-74.8	178.5	-168.8	133.8	4.5	112.1	F260 E265 L280 Q281 E282 Y286 H287 L288	F260-R284 HydrophobicContact CE1-CG 3.89Å; F260-R284 HydrophobicContact CZ-CG 4.37Å; E265-R284 IonicContact OE1-CZ 2.76Å; E265-R284 IonicContact OE1-NE 3.81Å; E265-R284 PolarHBondContact OE1-NE 3.42Å; E265-R284 IonicContact OE1-NH2 2.88Å; E265-R284 PolarHBondContact OE1-NH2 3.4Å; E265-R284 IonicContact OE2-NH2 3.82Å; L280-R284 WeakPolarHBondContact O-CG 3.47Å; L280-R284 PolarHBondContact O-N 2.93Å; Q281-R284 PolarHBondContact O-N 2.91Å; E282-R284 PolarHBondContact O-N 3.36Å; R284-Y286 VanDerWaalsContact C-N 3.31Å; R284-Y286 PolarHBondContact O-N 3.22Å; R284-H287 PolarHBondContact O-N 3.21Å; R284-L288 WeakPolarHBondContact O-CB 3.47Å; R284-L288 VanDerWaalsContact O-CG 3.3Å; R284-L288 WeakPolarHBondContact O-CG 3.29Å; R284-L288 PolarHBondContact O-N 3.41Å
285	M	76.9	Confident	77.1	Confident	57 Å²	57	47.9 Å²	47.9	28%	0.281	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-45.5	179.5	-72.2	-67	-58.7	0	0	109.6	Q281 E282 A283 H287 L288 S289 I293	Q281-M285 WeakPolarHBondContact O-CB 3.2Å; Q281-M285 VanDerWaalsContact O-CG 3.26Å; Q281-M285 WeakPolarHBondContact O-CG 3.4Å; Q281-M285 PolarHBondContact O-N 2.59Å; E282-M285 PolarHBondContact O-N 2.77Å; A283-M285 PolarHBondContact O-N 2.77Å; M285-H287 PolarHBondContact O-N 2.99Å; M285-L288 PolarHBondContact O-N 3.01Å; M285-L288 VanDerWaalsContact O-N 3.1Å; M285-S289 PolarHBondContact O-N 2.9Å; M285-S289 PolarHBondContact O-OG 3.43Å; M285-I293 HydrophobicContact CB-CD1 3.35Å; M285-I293 HydrophobicContact CG-CD1 4.3Å
286	Y	75.2	Confident	76.5	Confident	19 Å²	19	46.4 Å²	46.4	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-56.6	-44.1	175.4	-173.9	-93.8	0	0	0	112.8	P253 E282 A283 R284 L288 G290 N291 T298 R594	P253-Y286 HydrophobicContact CB-CD1 3.7Å; P253-Y286 HydrophobicContact CB-CE1 4.49Å; P253-Y286 HydrophobicContact CB-CG 3.76Å; P253-Y286 WeakPolarHBondContact O-CD1 3.35Å; P253-Y286 VanDerWaalsContact O-CE1 3.31Å; P253-Y286 WeakPolarHBondContact O-CE1 3.29Å; E282-Y286 WeakPolarHBondContact O-CB 3.39Å; E282-Y286 PolarHBondContact O-N 3.11Å; A283-Y286 PolarHBondContact O-N 3.38Å; R284-Y286 VanDerWaalsContact C-N 3.31Å; R284-Y286 PolarHBondContact O-N 3.22Å; Y286-L288 VanDerWaalsContact C-N 3.34Å; Y286-L288 PolarHBondContact O-N 3.16Å; Y286-G290 WeakPolarHBondContact CD2-O 3.09Å; Y286-G290 WeakPolarHBondContact O-CA 3.29Å; Y286-G290 PolarHBondContact O-N 2.93Å; Y286-N291 PolarHBondContact OH-OD1 3.36Å; Y286-T298 HydrophobicContact CD2-CG2 3.67Å; Y286-T298 HydrophobicContact CE2-CG2 4.03Å; Y286-T298 HydrophobicContact CG-CG2 4.25Å; Y286-R594 VanDerWaalsContact CZ-CZ 3.43Å; Y286-R594 PolarHBondContact OH-NE 3.21Å; Y286-R594 PolarHBondContact OH-NH1 3.32Å; Y286-R594 PolarHBondContact OH-NH2 3.09Å
287	H	73.6	Confident	76.1	Confident	50 Å²	50	47.5 Å²	47.5	23%	0.231	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-31.6	176.3	-63.4	156.9	0	0	0	113.7	P253 L255 A283 R284 M285	P253-H287 PolarHBondContact O-NE2 3.37Å; L255-H287 PolarHBondContact O-NE2 2.69Å; A283-H287 VanDerWaalsContact O-CG 3.31Å; A283-H287 PolarHBondContact O-N 3.09Å; A283-H287 PolarHBondContact O-ND1 3.19Å; R284-H287 PolarHBondContact O-N 3.21Å; M285-H287 PolarHBondContact O-N 2.99Å
288	L	68.6	Low	75.5	Confident	124 Å²	124	42.6 Å²	42.6	65%	0.649	21%	0.213	S	C	*	.	H	α-helix	trans	-83.5	-47.8	-179	-71.1	169.9	0	0	0	113	R284 M285 Y286	R284-L288 WeakPolarHBondContact O-CB 3.47Å; R284-L288 VanDerWaalsContact O-CG 3.3Å; R284-L288 WeakPolarHBondContact O-CG 3.29Å; R284-L288 PolarHBondContact O-N 3.41Å; M285-L288 PolarHBondContact O-N 3.01Å; M285-L288 VanDerWaalsContact O-N 3.1Å; Y286-L288 VanDerWaalsContact C-N 3.34Å; Y286-L288 PolarHBondContact O-N 3.16Å
289	S	63.7	Low	74.8	Confident	11 Å²	11	39.9 Å²	39.9	8%	0.077	19%	0.194	C	C	.	.	H	α-helix	trans	-92.5	-16.1	-176.8	57.5	0	0	0	0	113.8	M285 E292	M285-S289 PolarHBondContact O-N 2.9Å; M285-S289 PolarHBondContact O-OG 3.43Å; S289-E292 WeakPolarHBondContact CB-OE2 3.34Å
290	G	63.7	Low	74.1	Confident	6 Å²	6	38.9 Å²	38.9	6%	0.062	19%	0.189	C	C	.	.			trans	71.6	-140.9	-170.7	0	0	0	0	0	112	Y286 E292	Y286-G290 WeakPolarHBondContact CD2-O 3.09Å; Y286-G290 WeakPolarHBondContact O-CA 3.29Å; Y286-G290 PolarHBondContact O-N 2.93Å; G290-E292 PolarHBondContact O-N 2.65Å
291	N	57.2	Low	73.5	Confident	35 Å²	35	38.4 Å²	38.4	19%	0.187	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	19.2	-171.4	-64.2	-8.5	0	0	0	115.6	Y286 I293	Y286-N291 PolarHBondContact OH-OD1 3.36Å; N291-I293 VanDerWaalsContact C-N 3.25Å; N291-I293 PolarHBondContact O-N 3.04Å
292	E	54.3	Low	72.7	Confident	49 Å²	49	36.3 Å²	36.3	23%	0.229	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-23.5	175.2	-64.3	-166.5	151	0	0	112.5	S289 G290 V407 S454	S289-E292 WeakPolarHBondContact CB-OE2 3.34Å; G290-E292 PolarHBondContact O-N 2.65Å; E292-V407 VanDerWaalsContact OE1-C 3.29Å; E292-S454 WeakPolarHBondContact OE1-CB 3.3Å; E292-S454 PolarHBondContact OE1-OG 3.36Å
293	I	61.9	Low	71.6	Confident	46 Å²	46	38.5 Å²	38.5	24%	0.236	19%	0.187	C	C	.	.			trans	-109.1	116.7	176.8	-61.5	172.1	0	0	0	107.5	E282 M285 N291 T295	E282-I293 HydrophobicContact CG-CG2 4.42Å; M285-I293 HydrophobicContact CB-CD1 3.35Å; M285-I293 HydrophobicContact CG-CD1 4.3Å; N291-I293 VanDerWaalsContact C-N 3.25Å; N291-I293 PolarHBondContact O-N 3.04Å; I293-T295 HydrophobicContact CG2-CG2 3.96Å
294	I	66.1	Low	70.5	Confident	10 Å²	10	39.2 Å²	39.2	5%	0.051	19%	0.191	C	C	.	.			trans	-123	109.5	179.7	-57.8	175.5	0	0	0	107.7	F503 P544	I294-F503 HydrophobicContact CB-CD2 4.47Å; I294-F503 HydrophobicContact CG2-CD2 4.25Å; I294-F503 HydrophobicContact CG2-CE2 4.05Å; I294-P544 HydrophobicContact CD1-CB 3.43Å; I294-P544 VanDerWaalsContact CD1-CB 3.43Å; I294-P544 HydrophobicContact CD1-CG 3.23Å
295	T	76	Confident	69.6	Low	41 Å²	41	40.6 Å²	40.6	25%	0.252	20%	0.199	S	C	.	.			trans	-132.4	170.1	178.2	68.4	0	0	0	0	109.8	E282 I293 R297 T298	E282-T295 WeakPolarHBondContact OE1-CB 3.43Å; E282-T295 VanDerWaalsContact OE1-CG2 3.24Å; E282-T295 WeakPolarHBondContact OE1-CG2 3.39Å; E282-T295 PolarHBondContact OE1-OG1 2.98Å; I293-T295 HydrophobicContact CG2-CG2 3.96Å; T295-R297 PolarHBondContact O-N 2.74Å; T295-R297 VanDerWaalsContact O-N 3.16Å; T295-R297 PolarHBondContact OG1-N 3.49Å; T295-T298 PolarHBondContact N-OG1 3.08Å; T295-T298 PolarHBondContact O-N 2.88Å; T295-T298 PolarHBondContact O-OG1 3.42Å
296	E	77.3	Confident	69.3	Low	84 Å²	84	41.8 Å²	41.8	39%	0.393	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-54.8	-31.5	173.3	-77.9	-63.6	109.3	0	0	112.6	T298 K299 N547	E296-T298 VanDerWaalsContact C-N 3.29Å; E296-T298 PolarHBondContact O-N 3.36Å; E296-K299 WeakPolarHBondContact O-CB 3.32Å; E296-K299 PolarHBondContact O-N 2.98Å; E296-N547 WeakPolarHBondContact OE1-CB 3.48Å; E296-N547 VanDerWaalsContact OE1-CG 3.25Å; E296-N547 PolarHBondContact OE1-ND2 3.18Å
297	R	83.4	Confident	69.3	Low	23 Å²	23	41 Å²	41	9%	0.087	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-80.4	-9.9	-179.8	-60.9	178.8	68.2	171.8	6.8	114	L247 E248 V250 R251 P253 E282 T295	L247-R297 PolarHBondContact O-NH2 2.85Å; L247-R297 VanDerWaalsContact O-NH2 3.08Å; E248-R297 WeakPolarHBondContact O-CD 3.32Å; E248-R297 PolarHBondContact O-NE 3.16Å; V250-R297 VanDerWaalsContact O-CZ 3.26Å; V250-R297 PolarHBondContact O-NE 3.43Å; V250-R297 PolarHBondContact O-NH2 2.53Å; R251-R297 WeakPolarHBondContact CB-O 3.38Å; P253-R297 HydrophobicContact CG-CB 4.47Å; E282-R297 IonicContact OE2-NH1 3.69Å; T295-R297 PolarHBondContact O-N 2.74Å; T295-R297 VanDerWaalsContact O-N 3.16Å; T295-R297 PolarHBondContact OG1-N 3.49Å
298	T	75.7	Confident	69.7	Low	2 Å²	2	38.8 Å²	38.8	1%	0.012	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-94.9	-1.3	173.4	63.5	0	0	0	0	112.8	P253 Y286 T295 E296 R594	P253-T298 HydrophobicContact CB-CG2 3.92Å; P253-T298 HydrophobicContact CG-CG2 4.05Å; Y286-T298 HydrophobicContact CD2-CG2 3.67Å; Y286-T298 HydrophobicContact CE2-CG2 4.03Å; Y286-T298 HydrophobicContact CG-CG2 4.25Å; T295-T298 PolarHBondContact N-OG1 3.08Å; T295-T298 PolarHBondContact O-N 2.88Å; T295-T298 PolarHBondContact O-OG1 3.42Å; E296-T298 VanDerWaalsContact C-N 3.29Å; E296-T298 PolarHBondContact O-N 3.36Å; T298-R594 PolarHBondContact O-NH2 3.44Å
299	K	76.8	Confident	70.6	Confident	21 Å²	21	32.9 Å²	32.9	9%	0.091	16%	0.16	C	C	.	.	S	Bend	trans	-88.5	122.3	176.8	-176.7	-172.2	177.3	-169.3	0	110.2	D214 R251 E296	D214-K299 IonicContact OD1-NZ 3.89Å; D214-K299 IonicContact OD2-NZ 3.07Å; D214-K299 PolarHBondContact OD2-NZ 2.89Å; R251-K299 WeakPolarHBondContact CD-O 3.25Å; R251-K299 PolarHBondContact NH1-O 3.19Å; E296-K299 WeakPolarHBondContact O-CB 3.32Å; E296-K299 PolarHBondContact O-N 2.98Å
300	P	74.1	Confident	71.7	Confident	4 Å²	4	32.4 Å²	32.4	3%	0.026	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-60.6	154.8	174.7	-24.7	35.7	0	0	0	114.2	R251 L254 E304 Q306	R251-P300 PolarHBondContact NH1-O 3.26Å; L254-P300 HydrophobicContact CD1-CB 4.42Å; P300-E304 WeakPolarHBondContact CB-OE2 3.37Å; P300-Q306 WeakPolarHBondContact CB-O 3.31Å
301	R	78.8	Confident	73	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.008	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-73.9	154.1	173.9	-68.4	177	-171.7	-83	-0.9	110.4	L211 S213 E221 N249 H303 E304	L211-R301 PolarHBondContact O-NH1 3.41Å; L211-R301 PolarHBondContact O-NH2 3.19Å; S213-R301 PolarHBondContact O-NH1 2.93Å; E221-R301 IonicContact OE1-CZ 3.95Å; E221-R301 IonicContact OE1-NE 2.72Å; E221-R301 IonicContact OE1-NH2 2.73Å; E221-R301 PolarHBondContact OE1-NH2 3.37Å; E221-R301 IonicContact OE2-CZ 3.19Å; E221-R301 IonicContact OE2-NE 3.1Å; E221-R301 PolarHBondContact OE2-NE 3.16Å; E221-R301 IonicContact OE2-NH2 3.95Å; N249-R301 PolarHBondContact O-NH2 3.11Å; R301-H303 VanDerWaalsContact C-N 3.25Å; R301-H303 PolarHBondContact O-N 2.62Å; R301-E304 HydrophobicContact CB-CB 4.32Å; R301-E304 PolarHBondContact N-OE2 3.34Å; R301-E304 WeakPolarHBondContact O-CB 3.28Å; R301-E304 PolarHBondContact O-N 2.8Å; R301-E304 VanDerWaalsContact O-N 3.17Å
302	M	69.6	Low	74.6	Confident	58 Å²	58	31 Å²	31	29%	0.286	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.7	-176.2	-78.4	-169.7	-87.7	0	0	114	D214 D215 R333	D214-M302 HydrophobicContact CB-CE 3.56Å; D214-M302 HydrophobicContact CB-CG 4.39Å; D214-M302 WeakPolarHBondContact O-CB 3.25Å; D214-M302 PolarHBondContact O-N 3.36Å; D215-M302 HydrophobicContact CB-CE 4.11Å; D215-M302 WeakPolarHBondContact OD1-CE 3.49Å; D215-M302 WeakPolarHBondContact OD2-CE 3.49Å; M302-R333 PolarHBondContact O-NH2 2.86Å
303	H	63.7	Low	76.4	Confident	82 Å²	82	28.7 Å²	28.7	38%	0.38	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-7	178.1	-67.4	-69	0	0	0	114	D215 Y217 R301	D215-H303 PolarHBondContact O-CD2 2.66Å; D215-H303 VanDerWaalsContact O-CD2 3.23Å; Y217-H303 HydrophobicContact CD2-CB 4.11Å; Y217-H303 AromaticContact CD2-CD2 3.98Å; Y217-H303 AromaticContact CD2-CG 3.66Å; Y217-H303 AromaticContact CD2-ND1 3.71Å; Y217-H303 AromaticContact CE2-ND1 3.92Å; R301-H303 VanDerWaalsContact C-N 3.25Å; R301-H303 PolarHBondContact O-N 2.62Å
304	E	61.7	Low	77.8	Confident	16 Å²	16	26.5 Å²	26.5	8%	0.075	13%	0.126	C	C	.	.	S	Bend	trans	-64	139.7	171.2	-166.6	171.3	-173.1	0	0	108.9	P300 R301 Q306 R333	P300-E304 WeakPolarHBondContact CB-OE2 3.37Å; R301-E304 HydrophobicContact CB-CB 4.32Å; R301-E304 PolarHBondContact N-OE2 3.34Å; R301-E304 WeakPolarHBondContact O-CB 3.28Å; R301-E304 PolarHBondContact O-N 2.8Å; R301-E304 VanDerWaalsContact O-N 3.17Å; E304-Q306 PolarHBondContact O-N 2.83Å; E304-R333 PolarHBondContact O-NH2 3.37Å
305	F	64.1	Low	78.8	Confident	113 Å²	113	26.1 Å²	26.1	50%	0.496	12%	0.124	S	C	.	.	S	Bend	trans	-63.2	-10	-179.1	-71	-75.9	0	0	0	112.9	T219 S596 Y597 T598	T219-F305 HydrophobicContact CG2-CE2 3.94Å; F305-S596 CarbonylContact O-C 3.59Å; F305-S596 WeakPolarHBondContact O-CA 3.29Å; F305-Y597 PolarHBondContact O-N 3.06Å; F305-T598 HydrophobicContact CB-CG2 4.19Å; F305-T598 HydrophobicContact CD1-CG2 3.81Å; F305-T598 HydrophobicContact CE1-CG2 4.49Å; F305-T598 HydrophobicContact CG-CG2 4.12Å
306	Q	69.1	Low	79.4	Confident	81 Å²	81	24.6 Å²	24.6	38%	0.379	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138.5	177.4	-56.2	-168.9	9.2	0	0	111.1	P300 E304 K595	P300-Q306 WeakPolarHBondContact CB-O 3.31Å; E304-Q306 PolarHBondContact O-N 2.83Å; Q306-K595 CarbonylContact C-O 3.55Å; Q306-K595 WeakPolarHBondContact CA-O 3.11Å
307	S	75.5	Confident	79.8	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.021	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.1	168.4	-149.1	0	0	0	0	110.4	D330 R333 R594 K595	S307-D330 VanDerWaalsContact CB-OD2 3.24Å; S307-D330 WeakPolarHBondContact CB-OD2 3.37Å; S307-D330 PolarHBondContact OG-OD1 3.31Å; S307-D330 PolarHBondContact OG-OD2 2.77Å; S307-R333 PolarHBondContact OG-NH1 3.1Å; S307-R594 CarbonylContact O-C 3.52Å; S307-R594 VanDerWaalsContact O-CA 3.29Å; S307-R594 WeakPolarHBondContact O-CA 2.83Å; S307-K595 PolarHBondContact N-O 2.73Å; S307-K595 PolarHBondContact O-N 3.49Å
308	E	83.1	Confident	79.7	Confident	4 Å²	4	25 Å²	25	2%	0.019	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	121.7	160.8	-162.8	176.3	-150.2	0	0	109.4	C545 N546 T592	E308-C545 PolarHBondContact O-SG 3.09Å; E308-N546 PolarHBondContact O-ND2 3.04Å; E308-N546 WeakPolarHBondContact OE2-CA 3.48Å; E308-N546 PolarHBondContact OE2-N 2.91Å; E308-T592 VanDerWaalsContact CD-CG2 3.49Å; E308-T592 HydrophobicContact CG-CG2 3.31Å; E308-T592 WeakPolarHBondContact OE1-CG2 3.48Å
309	V	86.4	Confident	79.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.5	-180	-56.3	0	0	0	0	108.8	C328 L329 D330 T592 L593 K595 Y597	V309-C328 HydrophobicContact CB-CB 4.31Å; V309-C328 HydrophobicContact CG2-CB 3.94Å; V309-L329 WeakPolarHBondContact CA-O 3.42Å; V309-L329 WeakPolarHBondContact CB-O 3.39Å; V309-D330 HydrophobicContact CG1-CB 3.97Å; V309-T592 WeakPolarHBondContact O-CA 3.32Å; V309-L593 HydrophobicContact CG2-CD2 3.74Å; V309-L593 HydrophobicContact CG2-CG 3.81Å; V309-L593 WeakPolarHBondContact CG2-O 3.39Å; V309-L593 PolarHBondContact N-O 3.39Å; V309-L593 PolarHBondContact O-N 2.79Å; V309-K595 HydrophobicContact CG1-CB 4.39Å; V309-K595 HydrophobicContact CG2-CB 3.92Å; V309-Y597 HydrophobicContact CG1-CE2 4.21Å; V309-Y597 WeakPolarHBondContact CG1-OH 3.26Å
310	F	87.1	Confident	79.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.2	164.4	59.2	-88.9	0	0	0	109.4	I312 L329 P331 C545 F550 T552 V565 V591	F310-I312 HydrophobicContact CD2-CG1 4.42Å; F310-I312 HydrophobicContact CE2-CD1 4.31Å; F310-L329 HydrophobicContact CD2-CB 4.32Å; F310-L329 HydrophobicContact CE1-CB 4.46Å; F310-L329 HydrophobicContact CE1-CD2 4.24Å; F310-L329 HydrophobicContact CE1-CG 4.42Å; F310-L329 HydrophobicContact CE2-CB 3.88Å; F310-L329 HydrophobicContact CE2-CD2 3.55Å; F310-L329 HydrophobicContact CE2-CG 4.18Å; F310-L329 HydrophobicContact CZ-CB 3.97Å; F310-L329 HydrophobicContact CZ-CD2 3.27Å; F310-L329 HydrophobicContact CZ-CG 3.85Å; F310-L329 PolarHBondContact N-O 3.36Å; F310-L329 VanDerWaalsContact N-O 3.15Å; F310-L329 PolarHBondContact O-N 2.72Å; F310-P331 HydrophobicContact CD1-CG 4.29Å; F310-P331 HydrophobicContact CE1-CB 4.07Å; F310-P331 HydrophobicContact CE1-CG 3.91Å; F310-C545 HydrophobicContact CD1-CB 4.08Å; F310-F550 HydrophobicContact CD1-CB 4.44Å; F310-F550 HydrophobicContact CD1-CD1 4.46Å; F310-F550 HydrophobicContact CD1-CD2 4.35Å; F310-F550 HydrophobicContact CD1-CG 4.16Å; F310-F550 HydrophobicContact CE1-CB 4.28Å; F310-F550 AromaticContact CE1-CD1 3.65Å; F310-F550 HydrophobicContact CE1-CD1 3.65Å; F310-F550 HydrophobicContact CE1-CD2 4.26Å; F310-F550 AromaticContact CE1-CE1 4Å; F310-F550 HydrophobicContact CE1-CE1 4Å; F310-F550 AromaticContact CE1-CG 3.79Å; F310-F550 HydrophobicContact CE1-CG 3.79Å; F310-F550 HydrophobicContact CE1-CZ 4.45Å; F310-F550 HydrophobicContact CZ-CB 4.45Å; F310-F550 AromaticContact CZ-CD1 3.92Å; F310-F550 HydrophobicContact CZ-CD1 3.92Å; F310-F550 HydrophobicContact CZ-CE1 4.48Å; F310-F550 HydrophobicContact CZ-CG 4.27Å; F310-T552 HydrophobicContact CD2-CG2 3.95Å; F310-T552 HydrophobicContact CE2-CG2 3.63Å; F310-V565 HydrophobicContact CE2-CG1 4.34Å; F310-V565 HydrophobicContact CZ-CG1 4.05Å; F310-V591 CarbonylContact C-O 3.58Å; F310-V591 VanDerWaalsContact CA-O 3.31Å; F310-V591 WeakPolarHBondContact CA-O 3.36Å
311	M	90.3	Very high	80.2	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.6	-176.8	-173.1	-175.9	-135.6	0	0	109.5	I313 V326 T327 V339 V368 Y383 S590 V591 L593	M311-I313 HydrophobicContact CB-CG1 4.48Å; M311-I313 HydrophobicContact CG-CD1 4.32Å; M311-I313 HydrophobicContact CG-CG1 3.73Å; M311-I313 HydrophobicContact SD-CD1 3.98Å; M311-I313 HydrophobicContact SD-CG1 3.91Å; M311-V326 HydrophobicContact CE-CG1 3.34Å; M311-V326 HydrophobicContact CG-CG1 3.56Å; M311-V326 HydrophobicContact SD-CG1 3.83Å; M311-T327 WeakPolarHBondContact CA-O 3.46Å; M311-V339 HydrophobicContact CE-CB 4.47Å; M311-V339 HydrophobicContact CE-CG2 3.36Å; M311-V368 HydrophobicContact SD-CG1 4.5Å; M311-V368 HydrophobicContact SD-CG2 3.94Å; M311-Y383 HydrophobicContact CE-CD1 3.88Å; M311-Y383 HydrophobicContact CE-CE1 3.72Å; M311-Y383 HydrophobicContact CE-CG 4.43Å; M311-S590 WeakPolarHBondContact O-CA 3.45Å; M311-V591 HydrophobicContact CB-CG2 3.96Å; M311-V591 PolarHBondContact N-O 2.85Å; M311-V591 PolarHBondContact O-N 3.28Å; M311-V591 VanDerWaalsContact O-N 3.12Å; M311-V591 HydrophobicContact SD-CG2 4.35Å; M311-L593 HydrophobicContact CB-CD2 3.46Å; M311-L593 VanDerWaalsContact CB-CD2 3.46Å; M311-L593 HydrophobicContact CG-CD2 4.27Å; M311-L593 HydrophobicContact SD-CD2 4.06Å
312	I	91.6	Very high	80.5	Confident	12 Å²	12	40.8 Å²	40.8	6%	0.062	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116	175.6	-63.6	170.5	0	0	0	106.7	F310 V326 T327 T552 L581 V585 H588 G589	F310-I312 HydrophobicContact CD2-CG1 4.42Å; F310-I312 HydrophobicContact CE2-CD1 4.31Å; I312-V326 WeakPolarHBondContact O-CA 2.81Å; I312-T327 PolarHBondContact N-O 2.89Å; I312-T327 PolarHBondContact O-N 3.4Å; I312-T552 HydrophobicContact CD1-CG2 4.22Å; I312-L581 HydrophobicContact CD1-CD1 3.79Å; I312-L581 HydrophobicContact CD1-CD2 3.17Å; I312-L581 HydrophobicContact CD1-CG 4.11Å; I312-V585 HydrophobicContact CG2-CG2 4.19Å; I312-H588 HydrophobicContact CG2-CB 4.3Å; I312-G589 WeakPolarHBondContact CA-O 3.32Å
313	I	92.5	Very high	81.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.7	-170.2	-52.4	169.9	0	0	0	107.5	M311 V326 L342 F359 C361 V368 I370 W390 H588 G589 V591	M311-I313 HydrophobicContact CB-CG1 4.48Å; M311-I313 HydrophobicContact CG-CD1 4.32Å; M311-I313 HydrophobicContact CG-CG1 3.73Å; M311-I313 HydrophobicContact SD-CD1 3.98Å; M311-I313 HydrophobicContact SD-CG1 3.91Å; I313-V326 HydrophobicContact CB-CG1 4.37Å; I313-V326 HydrophobicContact CG1-CG1 3.9Å; I313-V326 HydrophobicContact CG2-CG1 4.44Å; I313-V326 HydrophobicContact CG2-CG2 4.05Å; I313-L342 HydrophobicContact CG2-CD1 4.05Å; I313-L342 HydrophobicContact CG2-CD2 3.68Å; I313-L342 HydrophobicContact CG2-CG 4.07Å; I313-F359 HydrophobicContact CB-CZ 4.18Å; I313-F359 HydrophobicContact CG2-CE2 4.02Å; I313-F359 HydrophobicContact CG2-CZ 3.8Å; I313-F359 WeakPolarHBondContact O-CZ 3.21Å; I313-C361 HydrophobicContact CD1-CB 4.13Å; I313-V368 HydrophobicContact CD1-CG1 3.61Å; I313-I370 HydrophobicContact CG2-CG2 4.48Å; I313-W390 HydrophobicContact CG2-CH2 4.49Å; I313-W390 HydrophobicContact CG2-CZ2 4.42Å; I313-H588 WeakPolarHBondContact O-CA 3.47Å; I313-G589 PolarHBondContact N-O 3.02Å; I313-G589 PolarHBondContact O-N 2.87Å; I313-V591 HydrophobicContact CD1-CG2 3.85Å
314	G	90.1	Very high	82.4	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.01	17%	0.167	C	C	.	.			trans	57.4	-137.3	173.7	0	0	0	0	0	115.6	V323 E325 H588	G314-V323 CarbonylContact C-O 3.59Å; G314-V323 WeakPolarHBondContact CA-O 3.41Å; G314-E325 PolarHBondContact N-O 3.29Å; G314-H588 WeakPolarHBondContact O-CB 3.46Å
315	G	88.4	Confident	83.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	17%	0.173	C	C	.	.			trans	111.7	-164	179.7	0	0	0	0	0	113.4	F322 V323 S586	G315-F322 WeakPolarHBondContact O-CA 3.25Å; G315-F322 WeakPolarHBondContact O-CD2 3.35Å; G315-V323 PolarHBondContact O-N 3.5Å; G315-S586 CarbonylContact C-O 3.58Å; G315-S586 WeakPolarHBondContact CA-O 3.43Å
316	C	87.3	Confident	85	Confident	10 Å²	10	30.8 Å²	30.8	7%	0.068	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-127.9	138	-176.7	-58.8	0	0	0	0	111.5	K321 S586	C316-K321 WeakPolarHBondContact CA-O 3.36Å; C316-S586 PolarHBondContact N-O 2.83Å; C316-S586 PolarHBondContact O-N 2.73Å; C316-S586 PolarHBondContact O-OG 2.89Å
317	T	86.1	Confident	86	Confident	16 Å²	16	27.9 Å²	27.9	10%	0.098	14%	0.138	C	C	.	.			trans	-79.8	178.5	172.7	70.8	0	0	0	0	111.8	D319 E320 K321 V323 R555 R583	T317-D319 VanDerWaalsContact C-N 3.27Å; T317-D319 PolarHBondContact O-N 3.25Å; T317-E320 PolarHBondContact O-N 3.37Å; T317-E320 VanDerWaalsContact O-N 3.09Å; T317-K321 PolarHBondContact N-O 3.15Å; T317-K321 WeakPolarHBondContact OG1-CB 3.48Å; T317-K321 PolarHBondContact OG1-N 3.21Å; T317-K321 PolarHBondContact OG1-O 3.01Å; T317-V323 HydrophobicContact CG2-CG2 3.62Å; T317-R555 PolarHBondContact O-NH2 2.98Å; T317-R583 HydrophobicContact CG2-CG 4.43Å
318	K	81.8	Confident	86.6	Confident	100 Å²	100	27.8 Å²	27.8	44%	0.435	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-47.6	176.1	-175.1	-179.7	177.4	160.8	0	112.3	E320 R555 E560 V561	K318-E320 PolarHBondContact O-N 2.87Å; K318-E320 VanDerWaalsContact O-N 3.1Å; K318-R555 PolarHBondContact O-NH1 2.92Å; K318-E560 VanDerWaalsContact CD-OE2 3.25Å; K318-E560 WeakPolarHBondContact CD-OE2 3.35Å; K318-E560 VanDerWaalsContact CE-CD 3.43Å; K318-E560 WeakPolarHBondContact CE-OE1 3.36Å; K318-E560 WeakPolarHBondContact CE-OE2 3.36Å; K318-E560 IonicContact NZ-OE1 3.02Å; K318-E560 PolarHBondContact NZ-OE1 2.96Å; K318-E560 IonicContact NZ-OE2 2.86Å; K318-E560 PolarHBondContact NZ-OE2 3.2Å; K318-V561 HydrophobicContact CB-CG2 4.07Å
319	D	80.1	Confident	86.7	Confident	118 Å²	118	28.7 Å²	28.7	63%	0.631	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	17.5	-176.9	-51.4	-41	0	0	0	113.3	T317 K321	T317-D319 VanDerWaalsContact C-N 3.27Å; T317-D319 PolarHBondContact O-N 3.25Å; D319-K321 HydrophobicContact CB-CG 4.28Å; D319-K321 PolarHBondContact O-N 3.23Å; D319-K321 VanDerWaalsContact O-N 3.07Å
320	E	76.8	Confident	86.6	Confident	125 Å²	125	28.7 Å²	28.7	58%	0.584	14%	0.142	S	C	*	.	S	Bend	trans	57.5	21.2	-176.1	-54.4	-170.5	163.5	0	0	114.2	T317 K318	T317-E320 PolarHBondContact O-N 3.37Å; T317-E320 VanDerWaalsContact O-N 3.09Å; K318-E320 PolarHBondContact O-N 2.87Å; K318-E320 VanDerWaalsContact O-N 3.1Å
321	K	81.1	Confident	86.2	Confident	99 Å²	99	29.8 Å²	29.8	43%	0.43	15%	0.149	S	C	.	.			trans	-76.7	136.9	171	-61.8	-174	179.3	-166.7	0	109.6	C316 T317 D319 N351	C316-K321 WeakPolarHBondContact CA-O 3.36Å; T317-K321 PolarHBondContact N-O 3.15Å; T317-K321 WeakPolarHBondContact OG1-CB 3.48Å; T317-K321 PolarHBondContact OG1-N 3.21Å; T317-K321 PolarHBondContact OG1-O 3.01Å; D319-K321 HydrophobicContact CB-CG 4.28Å; D319-K321 PolarHBondContact O-N 3.23Å; D319-K321 VanDerWaalsContact O-N 3.07Å; K321-N351 PolarHBondContact NZ-OD1 2.91Å; K321-N351 VanDerWaalsContact NZ-OD1 3.15Å
322	F	84.5	Confident	85.4	Confident	17 Å²	17	32.9 Å²	32.9	8%	0.075	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-76.7	146.4	179.2	178.2	-108.5	0	0	0	111.8	G315 A324 L342 T345 N353 W356 V357	G315-F322 WeakPolarHBondContact O-CA 3.25Å; G315-F322 WeakPolarHBondContact O-CD2 3.35Å; F322-A324 HydrophobicContact CD1-CB 4.49Å; F322-A324 HydrophobicContact CE1-CB 3.92Å; F322-L342 HydrophobicContact CE1-CD1 4.47Å; F322-L342 HydrophobicContact CE2-CD1 4.36Å; F322-L342 HydrophobicContact CZ-CD1 3.58Å; F322-T345 HydrophobicContact CE1-CG2 3.95Å; F322-N353 WeakPolarHBondContact CB-O 3.35Å; F322-N353 HydrophobicContact CD1-CB 4.25Å; F322-N353 WeakPolarHBondContact CG-O 3.45Å; F322-W356 HydrophobicContact CE1-CB 4.45Å; F322-W356 HydrophobicContact CE2-CB 3.55Å; F322-W356 WeakPolarHBondContact CE2-O 3.45Å; F322-W356 HydrophobicContact CZ-CB 3.48Å; F322-W356 VanDerWaalsContact CZ-CB 3.48Å; F322-W356 AromaticContact CZ-CD1 3.94Å; F322-W356 HydrophobicContact CZ-CG 4.06Å; F322-V357 HydrophobicContact CD2-CG2 4.37Å
323	V	86.8	Confident	84.4	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.03	18%	0.177	C	C	.	.			trans	-109.6	117.4	177.7	170.1	0	0	0	0	107.4	G314 G315 T317 E325 V585	G314-V323 CarbonylContact C-O 3.59Å; G314-V323 WeakPolarHBondContact CA-O 3.41Å; G315-V323 PolarHBondContact O-N 3.5Å; T317-V323 HydrophobicContact CG2-CG2 3.62Å; V323-E325 HydrophobicContact CG1-CB 4.14Å; V323-E325 WeakPolarHBondContact CG1-OE2 3.35Å; V323-V585 HydrophobicContact CG2-CG1 4.19Å
324	A	87.1	Confident	83.6	Confident	11 Å²	11	46 Å²	46	9%	0.091	21%	0.214	C	C	.	.			trans	-90.8	-15	176.8	0	0	0	0	0	112.8	F322 K341 L342 T345	F322-A324 HydrophobicContact CD1-CB 4.49Å; F322-A324 HydrophobicContact CE1-CB 3.92Å; A324-K341 WeakPolarHBondContact O-CA 3.12Å; A324-L342 PolarHBondContact O-N 3.3Å; A324-T345 HydrophobicContact CB-CG2 3.77Å
325	E	88.8	Confident	83	Confident	42 Å²	42	47.4 Å²	47.4	20%	0.196	22%	0.223	C	C	.	.			trans	-62.2	141.4	-179.6	-70.4	73.6	-137.2	0	0	111.8	G314 V323 K341 R583	G314-E325 PolarHBondContact N-O 3.29Å; V323-E325 HydrophobicContact CG1-CB 4.14Å; V323-E325 WeakPolarHBondContact CG1-OE2 3.35Å; E325-K341 IonicContact OE1-NZ 2.72Å; E325-K341 PolarHBondContact OE1-NZ 2.99Å; E325-R583 IonicContact OE2-CZ 2.62Å; E325-R583 IonicContact OE2-NH2 2.73Å; E325-R583 PolarHBondContact OE2-NH2 3.01Å
326	V	90.9	Very high	82.6	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.5	173.3	-172.7	0	0	0	0	108.4	M311 I312 I313 V339 L342 W390	M311-V326 HydrophobicContact CE-CG1 3.34Å; M311-V326 HydrophobicContact CG-CG1 3.56Å; M311-V326 HydrophobicContact SD-CG1 3.83Å; I312-V326 WeakPolarHBondContact O-CA 2.81Å; I313-V326 HydrophobicContact CB-CG1 4.37Å; I313-V326 HydrophobicContact CG1-CG1 3.9Å; I313-V326 HydrophobicContact CG2-CG1 4.44Å; I313-V326 HydrophobicContact CG2-CG2 4.05Å; V326-V339 HydrophobicContact CB-CG2 3.62Å; V326-V339 HydrophobicContact CG1-CG2 3.55Å; V326-V339 PolarHBondContact O-N 2.86Å; V326-L342 HydrophobicContact CG2-CG 3.97Å; V326-W390 HydrophobicContact CG2-CZ2 4.4Å
327	T	89.4	Confident	82.4	Confident	21 Å²	21	54.7 Å²	54.7	13%	0.129	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.7	-171.2	-54.1	0	0	0	0	109.9	M311 I312 R336	M311-T327 WeakPolarHBondContact CA-O 3.46Å; I312-T327 PolarHBondContact N-O 2.89Å; I312-T327 PolarHBondContact O-N 3.4Å; T327-R336 HydrophobicContact CG2-CB 4.36Å
328	C	88.2	Confident	82.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.9	166.9	-64.3	0	0	0	0	109.1	V309 R336 L337	V309-C328 HydrophobicContact CB-CB 4.31Å; V309-C328 HydrophobicContact CG2-CB 3.94Å; C328-R336 CarbonylContact O-C 3.54Å; C328-R336 WeakPolarHBondContact O-CA 3.23Å; C328-L337 HydrophobicContact CB-CB 4.42Å; C328-L337 PolarHBondContact N-O 3.44Å; C328-L337 PolarHBondContact O-N 2.7Å
329	L	85.8	Confident	82.7	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.12	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.8	174.4	-173.7	65.7	0	0	0	109.5	V309 F310 P331 R336 C579	V309-L329 WeakPolarHBondContact CA-O 3.42Å; V309-L329 WeakPolarHBondContact CB-O 3.39Å; F310-L329 HydrophobicContact CD2-CB 4.32Å; F310-L329 HydrophobicContact CE1-CB 4.46Å; F310-L329 HydrophobicContact CE1-CD2 4.24Å; F310-L329 HydrophobicContact CE1-CG 4.42Å; F310-L329 HydrophobicContact CE2-CB 3.88Å; F310-L329 HydrophobicContact CE2-CD2 3.55Å; F310-L329 HydrophobicContact CE2-CG 4.18Å; F310-L329 HydrophobicContact CZ-CB 3.97Å; F310-L329 HydrophobicContact CZ-CD2 3.27Å; F310-L329 HydrophobicContact CZ-CG 3.85Å; F310-L329 PolarHBondContact N-O 3.36Å; F310-L329 VanDerWaalsContact N-O 3.15Å; F310-L329 PolarHBondContact O-N 2.72Å; L329-P331 WeakPolarHBondContact O-CD 3.3Å; L329-R336 HydrophobicContact CD1-CB 4.18Å; L329-C579 WeakPolarHBondContact CD2-SG 3.47Å
330	D	84.4	Confident	82.9	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	108	173.1	-175.3	-25.3	0	0	0	108.9	S307 V309 L332 R333 R334 S335 Y597	S307-D330 VanDerWaalsContact CB-OD2 3.24Å; S307-D330 WeakPolarHBondContact CB-OD2 3.37Å; S307-D330 PolarHBondContact OG-OD1 3.31Å; S307-D330 PolarHBondContact OG-OD2 2.77Å; V309-D330 HydrophobicContact CG1-CB 3.97Å; D330-L332 VanDerWaalsContact C-N 3.32Å; D330-L332 WeakPolarHBondContact OD1-CA 3.16Å; D330-L332 WeakPolarHBondContact OD1-CB 3.42Å; D330-L332 PolarHBondContact OD1-N 2.6Å; D330-R333 HydrophobicContact CB-CB 4.34Å; D330-R333 PolarHBondContact OD1-N 2.93Å; D330-R333 WeakPolarHBondContact OD2-CB 3.36Å; D330-R333 WeakPolarHBondContact OD2-CD 3.23Å; D330-R333 WeakPolarHBondContact OD2-CG 3.18Å; D330-R333 IonicContact OD2-NH1 2.96Å; D330-R333 PolarHBondContact OD2-NH1 3.42Å; D330-R334 VanDerWaalsContact O-CA 3.23Å; D330-R334 WeakPolarHBondContact O-CA 3.42Å; D330-R334 PolarHBondContact O-N 2.83Å; D330-S335 PolarHBondContact N-O 2.91Å; D330-S335 PolarHBondContact O-N 3.33Å; D330-Y597 VanDerWaalsContact CB-OH 3.25Å; D330-Y597 WeakPolarHBondContact CB-OH 3.07Å; D330-Y597 PolarHBondContact OD2-OH 2.8Å
331	P	77.9	Confident	83.5	Confident	24 Å²	24	49.3 Å²	49.3	16%	0.156	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-27.3	179.9	28.7	-33.5	0	0	0	112.7	F310 L329 N546 F550	F310-P331 HydrophobicContact CD1-CG 4.29Å; F310-P331 HydrophobicContact CE1-CB 4.07Å; F310-P331 HydrophobicContact CE1-CG 3.91Å; L329-P331 WeakPolarHBondContact O-CD 3.3Å; P331-N546 WeakPolarHBondContact CG-ND2 3.02Å; P331-F550 HydrophobicContact CB-CE1 3.69Å; P331-F550 HydrophobicContact CB-CE2 4.35Å; P331-F550 HydrophobicContact CB-CZ 3.47Å; P331-F550 VanDerWaalsContact CB-CZ 3.47Å; P331-F550 HydrophobicContact CG-CE1 4.27Å; P331-F550 HydrophobicContact CG-CE2 4.12Å; P331-F550 HydrophobicContact CG-CZ 3.71Å
332	L	73.3	Confident	83.8	Confident	64 Å²	64	44.7 Å²	44.7	34%	0.335	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-48.9	178.9	-66.9	175.3	0	0	0	110.6	D330 R334 N546	D330-L332 VanDerWaalsContact C-N 3.32Å; D330-L332 WeakPolarHBondContact OD1-CA 3.16Å; D330-L332 WeakPolarHBondContact OD1-CB 3.42Å; D330-L332 PolarHBondContact OD1-N 2.6Å; L332-R334 VanDerWaalsContact C-N 3.33Å; L332-N546 HydrophobicContact CD1-CB 4.34Å; L332-N546 WeakPolarHBondContact CD1-OD1 3.39Å; L332-N546 HydrophobicContact CD2-CB 4.38Å; L332-N546 HydrophobicContact CG-CB 4.28Å
333	R	72.3	Confident	83.8	Confident	84 Å²	84	44.3 Å²	44.3	32%	0.317	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-3.5	-178.7	-61.5	-171	179.3	87.3	-6.8	113.7	M302 E304 S307 D330 S335	M302-R333 PolarHBondContact O-NH2 2.86Å; E304-R333 PolarHBondContact O-NH2 3.37Å; S307-R333 PolarHBondContact OG-NH1 3.1Å; D330-R333 HydrophobicContact CB-CB 4.34Å; D330-R333 PolarHBondContact OD1-N 2.93Å; D330-R333 WeakPolarHBondContact OD2-CB 3.36Å; D330-R333 WeakPolarHBondContact OD2-CD 3.23Å; D330-R333 WeakPolarHBondContact OD2-CG 3.18Å; D330-R333 IonicContact OD2-NH1 2.96Å; D330-R333 PolarHBondContact OD2-NH1 3.42Å; R333-S335 PolarHBondContact O-N 3.48Å; R333-S335 VanDerWaalsContact O-N 3.13Å
334	R	74.6	Confident	83.1	Confident	204 Å²	204	47.9 Å²	47.9	77%	0.77	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.3	40.3	-172.4	-62.6	-178.6	171.9	-176.1	-4.1	111.9	D330 L332	D330-R334 VanDerWaalsContact O-CA 3.23Å; D330-R334 WeakPolarHBondContact O-CA 3.42Å; D330-R334 PolarHBondContact O-N 2.83Å; L332-R334 VanDerWaalsContact C-N 3.33Å
335	S	76.8	Confident	82.3	Confident	30 Å²	30	47.9 Å²	47.9	21%	0.21	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	151.2	-174.4	75.8	0	0	0	0	110.4	D330 R333 Y597	D330-S335 PolarHBondContact N-O 2.91Å; D330-S335 PolarHBondContact O-N 3.33Å; R333-S335 PolarHBondContact O-N 3.48Å; R333-S335 VanDerWaalsContact O-N 3.13Å; S335-Y597 WeakPolarHBondContact OG-CE1 3.13Å
336	R	81.4	Confident	81	Confident	123 Å²	123	54 Å²	54	46%	0.464	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.3	177.9	70	-177.2	-173.7	-165.3	3.4	110.5	T327 C328 L329	T327-R336 HydrophobicContact CG2-CB 4.36Å; C328-R336 CarbonylContact O-C 3.54Å; C328-R336 WeakPolarHBondContact O-CA 3.23Å; L329-R336 HydrophobicContact CD1-CB 4.18Å
337	L	83.4	Confident	79.3	Confident	41 Å²	41	62.9 Å²	62.9	22%	0.215	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.5	173.6	174.4	70.5	0	0	0	109.2	C328 V339 K595 I600	C328-L337 HydrophobicContact CB-CB 4.42Å; C328-L337 PolarHBondContact N-O 3.44Å; C328-L337 PolarHBondContact O-N 2.7Å; L337-V339 HydrophobicContact CD2-CG1 4.11Å; L337-V339 HydrophobicContact CG-CG1 4.24Å; L337-K595 HydrophobicContact CD2-CD 3.94Å; L337-I600 HydrophobicContact CB-CD1 4.11Å; L337-I600 HydrophobicContact CD1-CD1 4.44Å; L337-I600 HydrophobicContact CD1-CG1 4.06Å; L337-I600 HydrophobicContact CD1-CG2 4.39Å; L337-I600 HydrophobicContact CD2-CD1 3.62Å; L337-I600 HydrophobicContact CD2-CG1 3.86Å; L337-I600 HydrophobicContact CG-CD1 4.24Å; L337-I600 HydrophobicContact CG-CG1 4.37Å
338	E	85.6	Confident	77.7	Confident	120 Å²	120	65.3 Å²	65.3	56%	0.561	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.7	166.5	-68.5	-179.4	-172.5	0	0	110.3
339	V	87.2	Confident	76.2	Confident	13 Å²	13	69.6 Å²	69.6	8%	0.079	33%	0.33	C	S	.	.			trans	-121.1	-174.9	-177.8	-49.1	0	0	0	0	110.2	M311 V326 L337 K341 Y383 N388	M311-V339 HydrophobicContact CE-CB 4.47Å; M311-V339 HydrophobicContact CE-CG2 3.36Å; V326-V339 HydrophobicContact CB-CG2 3.62Å; V326-V339 HydrophobicContact CG1-CG2 3.55Å; V326-V339 PolarHBondContact O-N 2.86Å; L337-V339 HydrophobicContact CD2-CG1 4.11Å; L337-V339 HydrophobicContact CG-CG1 4.24Å; V339-K341 PolarHBondContact O-N 3.07Å; V339-K341 VanDerWaalsContact O-N 3.15Å; V339-Y383 WeakPolarHBondContact CB-OH 3.45Å; V339-Y383 HydrophobicContact CG2-CE2 4.29Å; V339-N388 WeakPolarHBondContact CB-OD1 3.4Å
340	A	85.3	Confident	74.8	Confident	24 Å²	24	76 Å²	76	20%	0.198	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-49.4	124.7	175.3	0	0	0	0	0	111.6	Y383 N388 W390	A340-Y383 HydrophobicContact CB-CE2 4.11Å; A340-N388 WeakPolarHBondContact CB-O 3.35Å; A340-N388 PolarHBondContact N-OD1 2.9Å; A340-W390 PolarHBondContact O-NE1 2.82Å; A340-W390 VanDerWaalsContact O-NE1 3.1Å
341	K	89.1	Confident	73.2	Confident	89 Å²	89	81.3 Å²	81.3	39%	0.387	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-58.4	160.3	174.5	-64.4	-164.9	-179.5	-152.9	0	110.4	A324 E325 V339 W390	A324-K341 WeakPolarHBondContact O-CA 3.12Å; E325-K341 IonicContact OE1-NZ 2.72Å; E325-K341 PolarHBondContact OE1-NZ 2.99Å; V339-K341 PolarHBondContact O-N 3.07Å; V339-K341 VanDerWaalsContact O-N 3.15Å; K341-W390 PolarHBondContact O-NE1 2.66Å
342	L	87.4	Confident	72.1	Confident	2 Å²	2	86.7 Å²	86.7	1%	0.01	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-56.3	147.9	178	-81.9	167.5	0	0	0	111.7	I313 F322 A324 V326 T345 W356 I370 W390	I313-L342 HydrophobicContact CG2-CD1 4.05Å; I313-L342 HydrophobicContact CG2-CD2 3.68Å; I313-L342 HydrophobicContact CG2-CG 4.07Å; F322-L342 HydrophobicContact CE1-CD1 4.47Å; F322-L342 HydrophobicContact CE2-CD1 4.36Å; F322-L342 HydrophobicContact CZ-CD1 3.58Å; A324-L342 PolarHBondContact O-N 3.3Å; V326-L342 HydrophobicContact CG2-CG 3.97Å; L342-T345 HydrophobicContact CB-CG2 3.96Å; L342-T345 WeakPolarHBondContact O-CG2 3.31Å; L342-T345 PolarHBondContact O-OG1 2.85Å; L342-W356 HydrophobicContact CD1-CB 4.35Å; L342-W356 HydrophobicContact CD1-CG 4.33Å; L342-I370 HydrophobicContact CD2-CD1 3.45Å; L342-I370 VanDerWaalsContact CD2-CD1 3.45Å; L342-W390 HydrophobicContact CD2-CH2 4.38Å; L342-W390 HydrophobicContact CD2-CZ2 4.01Å
343	P	83.9	Confident	71.5	Confident	10 Å²	10	84.1 Å²	84.1	7%	0.065	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	148.4	-179	-22	31.9	0	0	0	113.1	T345 W356 I370 W381 W390	P343-T345 WeakPolarHBondContact O-CG2 3.32Å; P343-T345 PolarHBondContact O-N 3.19Å; P343-W356 HydrophobicContact CB-CZ2 4.21Å; P343-W356 HydrophobicContact CG-CZ2 4.24Å; P343-W356 PolarHBondContact O-NE1 2.86Å; P343-I370 HydrophobicContact CG-CD1 4.43Å; P343-W381 HydrophobicContact CB-CD2 3.55Å; P343-W381 VanDerWaalsContact CB-CE2 3.48Å; P343-W381 HydrophobicContact CB-CE3 3.67Å; P343-W381 HydrophobicContact CB-CG 4.25Å; P343-W381 HydrophobicContact CB-CH2 3.75Å; P343-W381 HydrophobicContact CB-CZ2 3.61Å; P343-W381 HydrophobicContact CB-CZ3 3.77Å; P343-W381 HydrophobicContact CG-CB 4.12Å; P343-W381 HydrophobicContact CG-CD2 3.31Å; P343-W381 HydrophobicContact CG-CE3 3.45Å; P343-W381 VanDerWaalsContact CG-CE3 3.45Å; P343-W381 HydrophobicContact CG-CG 3.64Å; P343-W381 HydrophobicContact CG-CH2 4.46Å; P343-W381 HydrophobicContact CG-CZ2 4.35Å; P343-W381 HydrophobicContact CG-CZ3 4.04Å; P343-W390 HydrophobicContact CG-CB 3.57Å; P343-W390 HydrophobicContact CG-CD2 4.1Å; P343-W390 HydrophobicContact CG-CE3 4.5Å; P343-W390 HydrophobicContact CG-CG 3.69Å
344	I	73	Confident	71	Confident	79 Å²	79	84.7 Å²	84.7	41%	0.405	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	27.8	171.8	-35	173.4	0	0	0	113	W381	I344-W381 HydrophobicContact CD1-CZ2 3.87Å; I344-W381 HydrophobicContact CG1-CH2 4.43Å; I344-W381 HydrophobicContact CG1-CZ2 3.94Å
345	T	70.4	Confident	70.6	Confident	12 Å²	12	76.5 Å²	76.5	7%	0.074	37%	0.372	C	S	.	.			trans	-106.2	-8.1	178	65.4	0	0	0	0	114.2	F322 A324 L342 P343 N353	F322-T345 HydrophobicContact CE1-CG2 3.95Å; A324-T345 HydrophobicContact CB-CG2 3.77Å; L342-T345 HydrophobicContact CB-CG2 3.96Å; L342-T345 WeakPolarHBondContact O-CG2 3.31Å; L342-T345 PolarHBondContact O-OG1 2.85Å; P343-T345 WeakPolarHBondContact O-CG2 3.32Å; P343-T345 PolarHBondContact O-N 3.19Å; T345-N353 VanDerWaalsContact CB-ND2 3.29Å; T345-N353 WeakPolarHBondContact CB-ND2 3.42Å; T345-N353 WeakPolarHBondContact CG2-ND2 3.36Å
346	E	61.3	Low	70.5	Confident	169 Å²	169	75.1 Å²	75.1	79%	0.79	36%	0.362	S	S	*	.	S	Bend	trans	-85.4	-15.4	-171.7	-62.9	-178.4	170.1	0	0	114
347	Q	53.8	Low	70.6	Confident	189 Å²	189	70.6 Å²	70.6	88%	0.883	35%	0.348	S	S	*	.	S	Bend	trans	-104.9	-2.5	-173.1	-66.7	-177.7	-7.9	0	0	114.2
348	E	57.5	Low	70.8	Confident	71 Å²	71	69.5 Å²	69.5	33%	0.332	34%	0.342	S	S	.	.	S	Bend	trans	-117.1	146.8	-176.3	-72.3	175.3	176.4	0	0	111.1	K355	E348-K355 WeakPolarHBondContact OE1-CE 3.46Å; E348-K355 IonicContact OE1-NZ 3.67Å; E348-K355 PolarHBondContact OE1-NZ 2.9Å; E348-K355 WeakPolarHBondContact OE2-CE 3.38Å; E348-K355 IonicContact OE2-NZ 3.04Å; E348-K355 PolarHBondContact OE2-NZ 2.75Å
349	T	56	Low	71.2	Confident	90 Å²	90	64.5 Å²	64.5	55%	0.552	32%	0.318	S	S	*	.			trans	-65	140.4	174.7	62.5	0	0	0	0	109.9	N351 E352	T349-N351 PolarHBondContact O-N 2.87Å; T349-E352 PolarHBondContact O-N 3.18Å
350	E	55.9	Low	71.5	Confident	157 Å²	157	64.1 Å²	64.1	73%	0.734	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-19.6	-174.9	-68.4	-177.4	163	0	0	114.6
351	N	51.4	Low	72	Confident	113 Å²	113	64 Å²	64	60%	0.604	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-15.2	-179.2	-71.1	-28.7	0	0	0	114.2	K321 T349	K321-N351 PolarHBondContact NZ-OD1 2.91Å; K321-N351 VanDerWaalsContact NZ-OD1 3.15Å; T349-N351 PolarHBondContact O-N 2.87Å
352	E	54.3	Low	72.3	Confident	137 Å²	137	61.8 Å²	61.8	64%	0.64	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-12.8	-177.1	-68.5	-179.9	157.3	0	0	113.6	T349 K354	T349-E352 PolarHBondContact O-N 3.18Å; E352-K354 PolarHBondContact O-N 3.49Å
353	N	60.1	Low	72.5	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.053	31%	0.311	C	S	.	.			trans	-74.8	90.1	-174.3	-166.1	-8.7	0	0	0	110.6	F322 T345	F322-N353 WeakPolarHBondContact CB-O 3.35Å; F322-N353 HydrophobicContact CD1-CB 4.25Å; F322-N353 WeakPolarHBondContact CG-O 3.45Å; T345-N353 VanDerWaalsContact CB-ND2 3.29Å; T345-N353 WeakPolarHBondContact CB-ND2 3.42Å; T345-N353 WeakPolarHBondContact CG2-ND2 3.36Å
354	K	61.8	Low	72.8	Confident	96 Å²	96	62.3 Å²	62.3	42%	0.417	31%	0.309	S	S	.	.			trans	-108.7	16.4	173.3	-71.1	-175.1	-179.8	-178.7	0	112.7	E352 V357	E352-K354 PolarHBondContact O-N 3.49Å; K354-V357 HydrophobicContact CB-CG2 4.47Å; K354-V357 WeakPolarHBondContact O-CG2 3.44Å
355	K	67.4	Low	73.2	Confident	32 Å²	32	64.6 Å²	64.6	14%	0.139	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-55.8	-166.7	-74.8	-176.7	179.1	169.4	0	113.4	E348 V357 E375 T376	E348-K355 WeakPolarHBondContact OE1-CE 3.46Å; E348-K355 IonicContact OE1-NZ 3.67Å; E348-K355 PolarHBondContact OE1-NZ 2.9Å; E348-K355 WeakPolarHBondContact OE2-CE 3.38Å; E348-K355 IonicContact OE2-NZ 3.04Å; E348-K355 PolarHBondContact OE2-NZ 2.75Å; K355-V357 VanDerWaalsContact C-N 3.33Å; K355-V357 PolarHBondContact O-N 3.21Å; K355-E375 HydrophobicContact CG-CB 4.47Å; K355-E375 WeakPolarHBondContact CG-OE2 3.25Å; K355-E375 PolarHBondContact O-N 2.82Å; K355-T376 HydrophobicContact CB-CG2 3.86Å; K355-T376 PolarHBondContact O-OG1 3.21Å
356	W	75.3	Confident	73.8	Confident	1 Å²	1	66.6 Å²	66.6	0%	0.004	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	41.9	-174.9	-59.3	98	0	0	0	112.7	F322 L342 P343 F359 I370 T376 D379 W381	F322-W356 HydrophobicContact CE1-CB 4.45Å; F322-W356 HydrophobicContact CE2-CB 3.55Å; F322-W356 WeakPolarHBondContact CE2-O 3.45Å; F322-W356 HydrophobicContact CZ-CB 3.48Å; F322-W356 VanDerWaalsContact CZ-CB 3.48Å; F322-W356 AromaticContact CZ-CD1 3.94Å; F322-W356 HydrophobicContact CZ-CG 4.06Å; L342-W356 HydrophobicContact CD1-CB 4.35Å; L342-W356 HydrophobicContact CD1-CG 4.33Å; P343-W356 HydrophobicContact CB-CZ2 4.21Å; P343-W356 HydrophobicContact CG-CZ2 4.24Å; P343-W356 PolarHBondContact O-NE1 2.86Å; W356-F359 HydrophobicContact CB-CD1 4.11Å; W356-F359 HydrophobicContact CB-CE1 4.44Å; W356-F359 HydrophobicContact CE3-CB 4.1Å; W356-F359 HydrophobicContact CE3-CG 4.25Å; W356-F359 WeakPolarHBondContact O-CD1 3.3Å; W356-F359 WeakPolarHBondContact O-CE1 3.46Å; W356-I370 HydrophobicContact CD2-CD1 4.42Å; W356-I370 HydrophobicContact CE3-CD1 4Å; W356-I370 HydrophobicContact CH2-CD1 3.75Å; W356-I370 HydrophobicContact CH2-CG1 4.22Å; W356-I370 HydrophobicContact CZ2-CD1 4.12Å; W356-I370 HydrophobicContact CZ3-CD1 3.65Å; W356-I370 HydrophobicContact CZ3-CG1 3.99Å; W356-T376 HydrophobicContact CD2-CG2 4.12Å; W356-T376 HydrophobicContact CE3-CG2 4.38Å; W356-T376 HydrophobicContact CH2-CG2 4.2Å; W356-T376 HydrophobicContact CZ2-CG2 4.02Å; W356-T376 HydrophobicContact CZ3-CG2 4.41Å; W356-D379 HydrophobicContact CH2-CB 4.15Å; W356-W381 AromaticContact CH2-CD1 3.34Å; W356-W381 HydrophobicContact CH2-CG 4.27Å; W356-W381 AromaticContact CH2-NE1 3.63Å; W356-W381 AromaticContact CZ2-CD1 3.77Å; W356-W381 AromaticContact CZ2-NE1 3.69Å
357	V	82.6	Confident	75	Confident	27 Å²	27	60.8 Å²	60.8	16%	0.164	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	129.1	173.3	176.8	0	0	0	0	109.4	F322 K354 K355 F359 G373 K374	F322-V357 HydrophobicContact CD2-CG2 4.37Å; K354-V357 HydrophobicContact CB-CG2 4.47Å; K354-V357 WeakPolarHBondContact O-CG2 3.44Å; K355-V357 VanDerWaalsContact C-N 3.33Å; K355-V357 PolarHBondContact O-N 3.21Å; V357-F359 VanDerWaalsContact C-N 3.3Å; V357-F359 PolarHBondContact O-N 2.82Å; V357-G373 WeakPolarHBondContact O-CA 3.49Å; V357-K374 HydrophobicContact CB-CB 4.49Å; V357-K374 PolarHBondContact O-N 3.21Å
358	E	87.8	Confident	76.9	Confident	19 Å²	19	51.8 Å²	51.8	9%	0.089	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	35	178.4	-60.2	178.5	119.4	0	0	114.6	W401 R402 H587	E358-W401 HydrophobicContact CB-CE3 4.12Å; E358-W401 WeakPolarHBondContact OE2-CZ3 3.36Å; E358-R402 HydrophobicContact CB-CG 3.79Å; E358-R402 VanDerWaalsContact CD-CG 3.46Å; E358-R402 HydrophobicContact CG-CG 4.14Å; E358-R402 PolarHBondContact O-N 2.88Å; E358-R402 WeakPolarHBondContact OE1-CG 2.83Å; E358-R402 IonicContact OE1-CZ 3.62Å; E358-R402 IonicContact OE1-NE 3.08Å; E358-R402 PolarHBondContact OE1-NE 3.19Å; E358-R402 IonicContact OE1-NH1 3.28Å; E358-R402 IonicContact OE1-NH2 3.83Å; E358-R402 PolarHBondContact OE1-NH2 3.37Å; E358-R402 IonicContact OE2-CZ 3.74Å; E358-R402 IonicContact OE2-NE 2.65Å; E358-R402 PolarHBondContact OE2-NE 3.46Å; E358-R402 IonicContact OE2-NH2 3.92Å; E358-R402 PolarHBondContact OE2-NH2 3.04Å; E358-H587 IonicContact OE1-CD2 2.66Å
359	F	93.4	Very high	78.7	Confident	14 Å²	14	48.6 Å²	48.6	6%	0.061	24%	0.242	C	C	.	.			trans	-70.9	171.2	166.5	73.2	-75.2	0	0	0	111.6	I313 W356 V357 C361 I370 G372	I313-F359 HydrophobicContact CB-CZ 4.18Å; I313-F359 HydrophobicContact CG2-CE2 4.02Å; I313-F359 HydrophobicContact CG2-CZ 3.8Å; I313-F359 WeakPolarHBondContact O-CZ 3.21Å; W356-F359 HydrophobicContact CB-CD1 4.11Å; W356-F359 HydrophobicContact CB-CE1 4.44Å; W356-F359 HydrophobicContact CE3-CB 4.1Å; W356-F359 HydrophobicContact CE3-CG 4.25Å; W356-F359 WeakPolarHBondContact O-CD1 3.3Å; W356-F359 WeakPolarHBondContact O-CE1 3.46Å; V357-F359 VanDerWaalsContact C-N 3.3Å; V357-F359 PolarHBondContact O-N 2.82Å; F359-C361 HydrophobicContact CE2-CB 4.11Å; F359-I370 HydrophobicContact CD2-CB 4Å; F359-I370 HydrophobicContact CD2-CG2 4.06Å; F359-I370 HydrophobicContact CE2-CB 4.23Å; F359-I370 HydrophobicContact CE2-CG2 3.78Å; F359-G372 WeakPolarHBondContact CB-O 3.3Å
360	A	94.7	Very high	80.6	Confident	5 Å²	5	44.3 Å²	44.3	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	151.3	171.1	0	0	0	0	0	110.8	I370 S371 H403 M405	A360-I370 CarbonylContact O-C 3.57Å; A360-I370 VanDerWaalsContact O-CA 3.28Å; A360-I370 WeakPolarHBondContact O-CA 3.44Å; A360-S371 PolarHBondContact N-O 3.21Å; A360-S371 PolarHBondContact O-N 2.87Å; A360-H403 WeakPolarHBondContact CB-NE2 3.49Å; A360-M405 HydrophobicContact CB-CB 4.38Å; A360-M405 HydrophobicContact CB-CG 3.66Å; A360-M405 HydrophobicContact CB-SD 3.82Å
361	C	94.8	Very high	82.5	Confident	23 Å²	23	36.8 Å²	36.8	16%	0.155	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.1	176.1	62.7	0	0	0	0	111.6	I313 F359 Y369 I370 G589 V591	I313-C361 HydrophobicContact CD1-CB 4.13Å; F359-C361 HydrophobicContact CE2-CB 4.11Å; C361-Y369 CarbonylContact C-O 3.47Å; C361-Y369 WeakPolarHBondContact CA-O 3.46Å; C361-I370 HydrophobicContact CB-CG2 3.92Å; C361-G589 WeakPolarHBondContact SG-CA 3.01Å; C361-V591 HydrophobicContact CB-CG1 3.99Å; C361-V591 WeakPolarHBondContact SG-CG1 3.49Å
362	I	94.8	Very high	84.5	Confident	41 Å²	41	31.4 Å²	31.4	21%	0.21	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	155.1	173.9	-163.5	60.2	0	0	0	110.7	Y369 M405 V407 V412	I362-Y369 PolarHBondContact N-O 2.92Å; I362-Y369 PolarHBondContact O-N 3.28Å; I362-M405 HydrophobicContact CB-CB 3.81Å; I362-M405 HydrophobicContact CG2-CB 3.85Å; I362-M405 HydrophobicContact CG2-CE 3.73Å; I362-M405 HydrophobicContact CG2-SD 4.27Å; I362-V407 HydrophobicContact CG1-CG2 3.78Å; I362-V407 HydrophobicContact CG2-CG2 4.47Å; I362-V412 HydrophobicContact CG2-CG1 3.89Å; I362-V412 HydrophobicContact CG2-CG2 4.32Å
363	T	92.1	Very high	86.1	Confident	20 Å²	20	24.9 Å²	24.9	12%	0.123	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.9	171.1	-56.6	0	0	0	0	110.4	E367 V407 V591 T592	T363-E367 CarbonylContact C-O 3.5Å; T363-E367 VanDerWaalsContact CA-O 3.3Å; T363-E367 WeakPolarHBondContact CA-O 3.33Å; T363-E367 WeakPolarHBondContact CG2-O 3.32Å; T363-V407 WeakPolarHBondContact O-CG2 3.41Å; T363-V591 WeakPolarHBondContact OG1-CB 3.47Å; T363-T592 WeakPolarHBondContact CB-O 3.33Å; T363-T592 WeakPolarHBondContact CG2-O 3.39Å; T363-T592 PolarHBondContact OG1-O 2.53Å
364	L	89.8	Confident	87.3	Confident	3 Å²	3	29 Å²	29	2%	0.016	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.9	167.2	172	65.3	0	0	0	108.6	N366 E367 Y369 V407 G410 V412 P432	L364-N366 PolarHBondContact O-N 3.17Å; L364-E367 PolarHBondContact N-O 2.69Å; L364-E367 WeakPolarHBondContact O-CB 3.4Å; L364-E367 PolarHBondContact O-N 3.24Å; L364-Y369 HydrophobicContact CB-CD2 4.19Å; L364-Y369 HydrophobicContact CB-CE2 3.85Å; L364-V407 HydrophobicContact CB-CG2 3.89Å; L364-V407 HydrophobicContact CD1-CG1 3.65Å; L364-V407 HydrophobicContact CD1-CG2 4.15Å; L364-G410 WeakPolarHBondContact CD2-O 3.48Å; L364-V412 HydrophobicContact CB-CG2 4.12Å; L364-V412 HydrophobicContact CD2-CG2 3.72Å; L364-P432 HydrophobicContact CD2-CG 4.13Å
365	K	82.8	Confident	88.3	Confident	128 Å²	128	29.5 Å²	29.5	56%	0.557	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	42.9	178.2	-61.9	-178.6	178.4	-177.8	0	113.9	E367	K365-E367 PolarHBondContact O-N 2.69Å
366	N	81.6	Confident	89	Confident	54 Å²	54	28.2 Å²	28.2	29%	0.289	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	9.1	-177.8	-155.3	40.4	0	0	0	116.1	L364 L593 R594	L364-N366 PolarHBondContact O-N 3.17Å; N366-L593 WeakPolarHBondContact OD1-CB 3.31Å; N366-R594 PolarHBondContact ND2-O 2.9Å; N366-R594 WeakPolarHBondContact OD1-CA 3.3Å; N366-R594 PolarHBondContact OD1-N 2.86Å; N366-R594 PolarHBondContact OD1-O 3.38Å; N366-R594 VanDerWaalsContact OD1-O 3.11Å
367	E	87.6	Confident	89.4	Confident	46 Å²	46	31.1 Å²	31.1	22%	0.215	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.9	169.5	-58.8	-178.9	124.6	0	0	109.3	T363 L364 K365 Y369 K382	T363-E367 CarbonylContact C-O 3.5Å; T363-E367 VanDerWaalsContact CA-O 3.3Å; T363-E367 WeakPolarHBondContact CA-O 3.33Å; T363-E367 WeakPolarHBondContact CG2-O 3.32Å; L364-E367 PolarHBondContact N-O 2.69Å; L364-E367 WeakPolarHBondContact O-CB 3.4Å; L364-E367 PolarHBondContact O-N 3.24Å; K365-E367 PolarHBondContact O-N 2.69Å; E367-Y369 HydrophobicContact CB-CE2 3.81Å; E367-Y369 PolarHBondContact OE2-OH 2.9Å; E367-K382 HydrophobicContact CB-CD 4.32Å; E367-K382 HydrophobicContact CB-CG 4.22Å; E367-K382 WeakPolarHBondContact OE1-CE 3.49Å; E367-K382 IonicContact OE1-NZ 2.77Å; E367-K382 PolarHBondContact OE1-NZ 2.9Å; E367-K382 WeakPolarHBondContact OE2-CD 3.24Å; E367-K382 IonicContact OE2-NZ 3.64Å; E367-K382 PolarHBondContact OE2-NZ 2.81Å
368	V	93.8	Very high	89.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.5	178.9	177.2	0	0	0	0	109.3	M311 I313 K382 Y383 W390 V591	M311-V368 HydrophobicContact SD-CG1 4.5Å; M311-V368 HydrophobicContact SD-CG2 3.94Å; I313-V368 HydrophobicContact CD1-CG1 3.61Å; V368-K382 CarbonylContact O-C 3.58Å; V368-K382 WeakPolarHBondContact O-CA 3.36Å; V368-Y383 PolarHBondContact N-O 3.04Å; V368-Y383 PolarHBondContact O-N 3.23Å; V368-W390 HydrophobicContact CG1-CH2 4.15Å; V368-V591 HydrophobicContact CG1-CG2 3.93Å; V368-V591 HydrophobicContact CG2-CG2 3.79Å
369	Y	95.3	Very high	90.1	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.4	176.3	-66	-103.2	0	0	0	108.6	C361 I362 L364 E367 W381 K382 I393 V412 Y430	C361-Y369 CarbonylContact C-O 3.47Å; C361-Y369 WeakPolarHBondContact CA-O 3.46Å; I362-Y369 PolarHBondContact N-O 2.92Å; I362-Y369 PolarHBondContact O-N 3.28Å; L364-Y369 HydrophobicContact CB-CD2 4.19Å; L364-Y369 HydrophobicContact CB-CE2 3.85Å; E367-Y369 HydrophobicContact CB-CE2 3.81Å; E367-Y369 PolarHBondContact OE2-OH 2.9Å; Y369-W381 CarbonylContact C-O 3.53Å; Y369-W381 WeakPolarHBondContact CA-O 3.46Å; Y369-K382 HydrophobicContact CD1-CB 4.24Å; Y369-K382 HydrophobicContact CD1-CD 4.47Å; Y369-K382 HydrophobicContact CD1-CG 4.24Å; Y369-K382 HydrophobicContact CE1-CB 4.12Å; Y369-K382 HydrophobicContact CE1-CD 3.6Å; Y369-K382 HydrophobicContact CE1-CG 3.84Å; Y369-K382 HydrophobicContact CE2-CD 4.17Å; Y369-K382 HydrophobicContact CE2-CG 4.22Å; Y369-K382 VanDerWaalsContact CZ-CD 3.41Å; Y369-K382 WeakPolarHBondContact OH-CD 3.45Å; Y369-I393 HydrophobicContact CD1-CD1 3.84Å; Y369-I393 HydrophobicContact CE1-CD1 3.89Å; Y369-V412 HydrophobicContact CD2-CG2 4.4Å; Y369-V412 HydrophobicContact CG-CG2 4.4Å; Y369-Y430 HydrophobicContact CD1-CE1 4.47Å; Y369-Y430 HydrophobicContact CE1-CD1 4.3Å; Y369-Y430 AromaticContact CE1-CE1 3.76Å; Y369-Y430 HydrophobicContact CE1-CE1 3.76Å
370	I	95.5	Very high	90.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.2	168.9	63.7	177.1	0	0	0	108.9	I313 L342 P343 W356 F359 A360 C361 V380 W381 W390	I313-I370 HydrophobicContact CG2-CG2 4.48Å; L342-I370 HydrophobicContact CD2-CD1 3.45Å; L342-I370 VanDerWaalsContact CD2-CD1 3.45Å; P343-I370 HydrophobicContact CG-CD1 4.43Å; W356-I370 HydrophobicContact CD2-CD1 4.42Å; W356-I370 HydrophobicContact CE3-CD1 4Å; W356-I370 HydrophobicContact CH2-CD1 3.75Å; W356-I370 HydrophobicContact CH2-CG1 4.22Å; W356-I370 HydrophobicContact CZ2-CD1 4.12Å; W356-I370 HydrophobicContact CZ3-CD1 3.65Å; W356-I370 HydrophobicContact CZ3-CG1 3.99Å; F359-I370 HydrophobicContact CD2-CB 4Å; F359-I370 HydrophobicContact CD2-CG2 4.06Å; F359-I370 HydrophobicContact CE2-CB 4.23Å; F359-I370 HydrophobicContact CE2-CG2 3.78Å; A360-I370 CarbonylContact O-C 3.57Å; A360-I370 VanDerWaalsContact O-CA 3.28Å; A360-I370 WeakPolarHBondContact O-CA 3.44Å; C361-I370 HydrophobicContact CB-CG2 3.92Å; I370-V380 WeakPolarHBondContact O-CA 3.31Å; I370-V380 WeakPolarHBondContact O-CG1 3.31Å; I370-W381 HydrophobicContact CD1-CB 3.99Å; I370-W381 HydrophobicContact CD1-CG 4.48Å; I370-W381 HydrophobicContact CG1-CB 3.69Å; I370-W381 HydrophobicContact CG1-CG 4.48Å; I370-W381 PolarHBondContact N-O 3.47Å; I370-W381 PolarHBondContact O-N 2.97Å; I370-W390 HydrophobicContact CB-CZ3 4.25Å; I370-W390 HydrophobicContact CD1-CE3 3.96Å; I370-W390 HydrophobicContact CD1-CH2 4.01Å; I370-W390 HydrophobicContact CD1-CZ3 3.65Å; I370-W390 HydrophobicContact CG1-CE3 4.17Å; I370-W390 HydrophobicContact CG1-CH2 4.29Å; I370-W390 HydrophobicContact CG1-CZ3 3.65Å; I370-W390 HydrophobicContact CG2-CH2 3.62Å; I370-W390 HydrophobicContact CG2-CZ3 3.71Å
371	S	95.4	Very high	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.6	177.7	65.6	0	0	0	0	112.7	A360 D379 H403 M405	A360-S371 PolarHBondContact N-O 3.21Å; A360-S371 PolarHBondContact O-N 2.87Å; S371-D379 WeakPolarHBondContact CA-O 3.16Å; S371-H403 PolarHBondContact O-CE1 2.82Å; S371-H403 PolarHBondContact O-NE2 2.67Å; S371-H403 VanDerWaalsContact O-NE2 3.09Å; S371-H403 PolarHBondContact OG-NE2 3.46Å; S371-M405 PolarHBondContact OG-SD 2.9Å
372	G	92.9	Very high	90.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.166	C	C	.	.			trans	63.1	-158.9	172.9	0	0	0	0	0	113.5	F359 T376 Q377 D379 R400	F359-G372 WeakPolarHBondContact CB-O 3.3Å; G372-T376 CarbonylContact C-O 3.55Å; G372-T376 VanDerWaalsContact C-O 3.26Å; G372-T376 WeakPolarHBondContact CA-O 3.16Å; G372-T376 PolarHBondContact O-OG1 2.93Å; G372-Q377 WeakPolarHBondContact CA-O 3.35Å; G372-D379 PolarHBondContact N-O 3.05Å; G372-R400 VanDerWaalsContact CA-O 3.26Å; G372-R400 WeakPolarHBondContact CA-O 3.34Å
373	G	89.6	Confident	90.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.156	C	C	.	.			trans	126.5	167.4	-172.3	0	0	0	0	0	111	V357 E375 T376 Q377 R400 W401	V357-G373 WeakPolarHBondContact O-CA 3.49Å; G373-E375 VanDerWaalsContact C-N 3.3Å; G373-E375 PolarHBondContact O-N 2.93Å; G373-T376 WeakPolarHBondContact CA-OG1 2.9Å; G373-Q377 WeakPolarHBondContact O-CA 3.49Å; G373-Q377 WeakPolarHBondContact O-CG 3.35Å; G373-Q377 PolarHBondContact O-N 2.84Å; G373-R400 PolarHBondContact N-O 3.44Å; G373-W401 VanDerWaalsContact C-CB 3.49Å
374	K	84.6	Confident	89.5	Confident	95 Å²	95	34 Å²	34	41%	0.413	16%	0.16	S	C	.	.	S	Bend	trans	-55	-44.9	-171.7	-168.1	177.8	-170.9	-179.7	0	113.2	V357 Q377 W401	V357-K374 HydrophobicContact CB-CB 4.49Å; V357-K374 PolarHBondContact O-N 3.21Å; K374-Q377 WeakPolarHBondContact O-CG 3.24Å; K374-Q377 PolarHBondContact O-NE2 2.82Å; K374-W401 HydrophobicContact CB-CD2 4.14Å; K374-W401 HydrophobicContact CB-CE3 3.34Å; K374-W401 HydrophobicContact CB-CZ3 3.6Å; K374-W401 HydrophobicContact CD-CE3 4.09Å; K374-W401 HydrophobicContact CD-CH2 3.83Å; K374-W401 HydrophobicContact CD-CZ3 3.39Å; K374-W401 HydrophobicContact CG-CD2 4.22Å; K374-W401 HydrophobicContact CG-CE3 3.53Å; K374-W401 HydrophobicContact CG-CH2 3.82Å; K374-W401 HydrophobicContact CG-CZ2 4.47Å; K374-W401 HydrophobicContact CG-CZ3 3.32Å
375	E	83.3	Confident	89	Confident	108 Å²	108	35.3 Å²	35.3	51%	0.505	17%	0.171	S	C	.	.	S	Bend	trans	-110.5	-16.9	-177.5	-47.7	179.2	164	0	0	112	K355 G373	K355-E375 HydrophobicContact CG-CB 4.47Å; K355-E375 WeakPolarHBondContact CG-OE2 3.25Å; K355-E375 PolarHBondContact O-N 2.82Å; G373-E375 VanDerWaalsContact C-N 3.3Å; G373-E375 PolarHBondContact O-N 2.93Å
376	T	81.4	Confident	88.4	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.031	18%	0.179	C	C	.	.			trans	-98.5	36.1	177.2	50	0	0	0	0	111.9	K355 W356 G372 G373 N378 D379	K355-T376 HydrophobicContact CB-CG2 3.86Å; K355-T376 PolarHBondContact O-OG1 3.21Å; W356-T376 HydrophobicContact CD2-CG2 4.12Å; W356-T376 HydrophobicContact CE3-CG2 4.38Å; W356-T376 HydrophobicContact CH2-CG2 4.2Å; W356-T376 HydrophobicContact CZ2-CG2 4.02Å; W356-T376 HydrophobicContact CZ3-CG2 4.41Å; G372-T376 CarbonylContact C-O 3.55Å; G372-T376 VanDerWaalsContact C-O 3.26Å; G372-T376 WeakPolarHBondContact CA-O 3.16Å; G372-T376 PolarHBondContact O-OG1 2.93Å; G373-T376 WeakPolarHBondContact CA-OG1 2.9Å; T376-N378 VanDerWaalsContact C-N 3.27Å; T376-N378 PolarHBondContact O-N 3.1Å; T376-D379 PolarHBondContact O-N 3.12Å
377	Q	82.8	Confident	88.1	Confident	61 Å²	61	36.1 Å²	36.1	29%	0.285	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-38.6	-162.5	-69.6	-177.2	19.1	0	0	114.3	G372 G373 K374 G399 R400	G372-Q377 WeakPolarHBondContact CA-O 3.35Å; G373-Q377 WeakPolarHBondContact O-CA 3.49Å; G373-Q377 WeakPolarHBondContact O-CG 3.35Å; G373-Q377 PolarHBondContact O-N 2.84Å; K374-Q377 WeakPolarHBondContact O-CG 3.24Å; K374-Q377 PolarHBondContact O-NE2 2.82Å; Q377-G399 CarbonylContact O-C 3.26Å; Q377-G399 WeakPolarHBondContact O-CA 3.46Å; Q377-R400 PolarHBondContact O-N 2.79Å
378	N	92.5	Very high	87.8	Confident	61 Å²	61	37.3 Å²	37.3	33%	0.326	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-11.9	-179.1	-66.7	80.2	0	0	0	113.7	T376 Y395 L396 G399	T376-N378 VanDerWaalsContact C-N 3.27Å; T376-N378 PolarHBondContact O-N 3.1Å; N378-Y395 HydrophobicContact CB-CD1 4.24Å; N378-Y395 CarbonylContact O-C 3.51Å; N378-Y395 VanDerWaalsContact O-CA 3.31Å; N378-Y395 WeakPolarHBondContact O-CA 3.45Å; N378-L396 PolarHBondContact ND2-O 2.85Å; N378-L396 PolarHBondContact O-N 2.79Å; N378-G399 PolarHBondContact ND2-N 3.03Å; N378-G399 WeakPolarHBondContact OD1-CA 3.33Å
379	D	93.4	Very high	87.3	Confident	33 Å²	33	43.6 Å²	43.6	18%	0.176	22%	0.223	C	C	.	.			trans	-72.3	141.1	-169.9	-66.6	-0.2	0	0	0	110.8	W356 S371 G372 T376 Y395	W356-D379 HydrophobicContact CH2-CB 4.15Å; S371-D379 WeakPolarHBondContact CA-O 3.16Å; G372-D379 PolarHBondContact N-O 3.05Å; T376-D379 PolarHBondContact O-N 3.12Å; D379-Y395 VanDerWaalsContact OD1-CE1 3.32Å; D379-Y395 WeakPolarHBondContact OD1-CE1 3.44Å
380	V	95.4	Very high	87.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	127.6	175.3	-169.6	0	0	0	0	108.6	I370 Q392 I393 E394 L396 W437	I370-V380 WeakPolarHBondContact O-CA 3.31Å; I370-V380 WeakPolarHBondContact O-CG1 3.31Å; V380-Q392 PolarHBondContact O-NE2 2.82Å; V380-Q392 VanDerWaalsContact O-NE2 3.14Å; V380-I393 HydrophobicContact CB-CD1 4.28Å; V380-I393 HydrophobicContact CB-CG1 3.81Å; V380-I393 HydrophobicContact CG1-CD1 3.52Å; V380-I393 HydrophobicContact CG1-CG1 3.58Å; V380-I393 WeakPolarHBondContact O-CG1 3.5Å; V380-I393 PolarHBondContact O-N 3.11Å; V380-E394 WeakPolarHBondContact CG2-O 3.33Å; V380-L396 HydrophobicContact CG2-CD2 3.77Å; V380-L396 HydrophobicContact CG2-CG 3.64Å; V380-W437 HydrophobicContact CG1-CZ2 4.07Å; V380-W437 HydrophobicContact CG2-CZ2 3.89Å
381	W	95.1	Very high	86.9	Confident	38 Å²	38	47.8 Å²	47.8	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.8	-179.6	-62.8	69	0	0	0	110.9	P343 I344 W356 Y369 I370 W390 I391 Q392	P343-W381 HydrophobicContact CB-CD2 3.55Å; P343-W381 VanDerWaalsContact CB-CE2 3.48Å; P343-W381 HydrophobicContact CB-CE3 3.67Å; P343-W381 HydrophobicContact CB-CG 4.25Å; P343-W381 HydrophobicContact CB-CH2 3.75Å; P343-W381 HydrophobicContact CB-CZ2 3.61Å; P343-W381 HydrophobicContact CB-CZ3 3.77Å; P343-W381 HydrophobicContact CG-CB 4.12Å; P343-W381 HydrophobicContact CG-CD2 3.31Å; P343-W381 HydrophobicContact CG-CE3 3.45Å; P343-W381 VanDerWaalsContact CG-CE3 3.45Å; P343-W381 HydrophobicContact CG-CG 3.64Å; P343-W381 HydrophobicContact CG-CH2 4.46Å; P343-W381 HydrophobicContact CG-CZ2 4.35Å; P343-W381 HydrophobicContact CG-CZ3 4.04Å; I344-W381 HydrophobicContact CD1-CZ2 3.87Å; I344-W381 HydrophobicContact CG1-CH2 4.43Å; I344-W381 HydrophobicContact CG1-CZ2 3.94Å; W356-W381 AromaticContact CH2-CD1 3.34Å; W356-W381 HydrophobicContact CH2-CG 4.27Å; W356-W381 AromaticContact CH2-NE1 3.63Å; W356-W381 AromaticContact CZ2-CD1 3.77Å; W356-W381 AromaticContact CZ2-NE1 3.69Å; Y369-W381 CarbonylContact C-O 3.53Å; Y369-W381 WeakPolarHBondContact CA-O 3.46Å; I370-W381 HydrophobicContact CD1-CB 3.99Å; I370-W381 HydrophobicContact CD1-CG 4.48Å; I370-W381 HydrophobicContact CG1-CB 3.69Å; I370-W381 HydrophobicContact CG1-CG 4.48Å; I370-W381 PolarHBondContact N-O 3.47Å; I370-W381 PolarHBondContact O-N 2.97Å; W381-W390 HydrophobicContact CB-CE3 3.87Å; W381-W390 HydrophobicContact CE3-CB 3.84Å; W381-W390 HydrophobicContact CZ3-CB 4.46Å; W381-I391 CarbonylContact C-O 3.47Å; W381-I391 WeakPolarHBondContact CA-O 3.4Å; W381-I391 VanDerWaalsContact CE3-C 3.49Å; W381-Q392 HydrophobicContact CD2-CB 4.13Å; W381-Q392 HydrophobicContact CE3-CB 3.98Å; W381-Q392 HydrophobicContact CH2-CB 3.9Å; W381-Q392 HydrophobicContact CZ2-CB 4.04Å; W381-Q392 HydrophobicContact CZ3-CB 3.88Å
382	K	94.4	Very high	86.8	Confident	41 Å²	41	50.4 Å²	50.4	18%	0.178	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.6	176	-174.8	177.6	76.4	153.4	0	109.9	E367 V368 Y369 W390 I391 I393	E367-K382 HydrophobicContact CB-CD 4.32Å; E367-K382 HydrophobicContact CB-CG 4.22Å; E367-K382 WeakPolarHBondContact OE1-CE 3.49Å; E367-K382 IonicContact OE1-NZ 2.77Å; E367-K382 PolarHBondContact OE1-NZ 2.9Å; E367-K382 WeakPolarHBondContact OE2-CD 3.24Å; E367-K382 IonicContact OE2-NZ 3.64Å; E367-K382 PolarHBondContact OE2-NZ 2.81Å; V368-K382 CarbonylContact O-C 3.58Å; V368-K382 WeakPolarHBondContact O-CA 3.36Å; Y369-K382 HydrophobicContact CD1-CB 4.24Å; Y369-K382 HydrophobicContact CD1-CD 4.47Å; Y369-K382 HydrophobicContact CD1-CG 4.24Å; Y369-K382 HydrophobicContact CE1-CB 4.12Å; Y369-K382 HydrophobicContact CE1-CD 3.6Å; Y369-K382 HydrophobicContact CE1-CG 3.84Å; Y369-K382 HydrophobicContact CE2-CD 4.17Å; Y369-K382 HydrophobicContact CE2-CG 4.22Å; Y369-K382 VanDerWaalsContact CZ-CD 3.41Å; Y369-K382 WeakPolarHBondContact OH-CD 3.45Å; K382-W390 CarbonylContact O-C 3.57Å; K382-W390 WeakPolarHBondContact O-CA 3.29Å; K382-I391 PolarHBondContact N-O 2.96Å; K382-I391 PolarHBondContact O-N 3.37Å; K382-I393 HydrophobicContact CB-CG2 4.07Å
383	Y	92.4	Very high	86.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.3	171.1	178.1	-109.8	0	0	0	110	M311 V339 A340 V368 A385 N388 W390 K595	M311-Y383 HydrophobicContact CE-CD1 3.88Å; M311-Y383 HydrophobicContact CE-CE1 3.72Å; M311-Y383 HydrophobicContact CE-CG 4.43Å; V339-Y383 WeakPolarHBondContact CB-OH 3.45Å; V339-Y383 HydrophobicContact CG2-CE2 4.29Å; A340-Y383 HydrophobicContact CB-CE2 4.11Å; V368-Y383 PolarHBondContact N-O 3.04Å; V368-Y383 PolarHBondContact O-N 3.23Å; Y383-A385 HydrophobicContact CD1-CB 4.46Å; Y383-A385 HydrophobicContact CE1-CB 3.93Å; Y383-N388 WeakPolarHBondContact CE2-OD1 3.48Å; Y383-N388 PolarHBondContact OH-OD1 3.04Å; Y383-W390 HydrophobicContact CD2-CD2 4.16Å; Y383-W390 AromaticContact CD2-CE2 3.94Å; Y383-W390 HydrophobicContact CD2-CG 4.34Å; Y383-W390 HydrophobicContact CD2-CZ2 4.36Å; Y383-W390 AromaticContact CD2-NE1 3.98Å; Y383-W390 HydrophobicContact CG-CD2 4.47Å; Y383-W390 HydrophobicContact CG-CZ2 4.36Å; Y383-K595 PolarHBondContact OH-NZ 3.1Å
384	N	79.6	Confident	87.2	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.203	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	111.9	170.5	-172.9	-28.5	0	0	0	109.5	S386 I387 N388 K389 I391	N384-S386 VanDerWaalsContact C-N 3.33Å; N384-S386 PolarHBondContact O-N 2.89Å; N384-S386 PolarHBondContact OD1-N 3.4Å; N384-S386 PolarHBondContact OD1-OG 3.46Å; N384-I387 HydrophobicContact CB-CD1 4.27Å; N384-I387 HydrophobicContact CB-CG1 3.86Å; N384-N388 WeakPolarHBondContact O-CA 3.11Å; N384-N388 PolarHBondContact O-N 3.13Å; N384-K389 PolarHBondContact N-O 3.07Å; N384-K389 PolarHBondContact O-N 3.2Å; N384-I391 HydrophobicContact CB-CD1 3.95Å
385	A	78.9	Confident	87.7	Confident	30 Å²	30	56.5 Å²	56.5	25%	0.248	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.9	-176.8	0	0	0	0	0	113.9	Y383	Y383-A385 HydrophobicContact CD1-CB 4.46Å; Y383-A385 HydrophobicContact CE1-CB 3.93Å
386	S	71	Confident	88.3	Confident	103 Å²	103	51.6 Å²	51.6	72%	0.72	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-34	-176.3	68	0	0	0	0	112.8	N384	N384-S386 VanDerWaalsContact C-N 3.33Å; N384-S386 PolarHBondContact O-N 2.89Å; N384-S386 PolarHBondContact OD1-N 3.4Å; N384-S386 PolarHBondContact OD1-OG 3.46Å
387	I	75.1	Confident	88.9	Confident	95 Å²	95	56.7 Å²	56.7	49%	0.487	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	0.7	178.4	61	170.1	0	0	0	113.2	N384 K389 I391	N384-I387 HydrophobicContact CB-CD1 4.27Å; N384-I387 HydrophobicContact CB-CG1 3.86Å; I387-K389 HydrophobicContact CD1-CB 4.12Å; I387-K389 HydrophobicContact CD1-CD 4.44Å; I387-K389 HydrophobicContact CG1-CB 4.14Å; I387-K389 PolarHBondContact O-N 2.82Å; I387-I391 HydrophobicContact CD1-CD1 4.42Å
388	N	81.1	Confident	89.4	Confident	71 Å²	71	56.4 Å²	56.4	38%	0.38	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	54.8	-176.8	-172.6	35.9	0	0	0	112.5	V339 A340 Y383 N384	V339-N388 WeakPolarHBondContact CB-OD1 3.4Å; A340-N388 WeakPolarHBondContact CB-O 3.35Å; A340-N388 PolarHBondContact N-OD1 2.9Å; Y383-N388 WeakPolarHBondContact CE2-OD1 3.48Å; Y383-N388 PolarHBondContact OH-OD1 3.04Å; N384-N388 WeakPolarHBondContact O-CA 3.11Å; N384-N388 PolarHBondContact O-N 3.13Å
389	K	83.7	Confident	89.4	Confident	133 Å²	133	53.9 Å²	53.9	58%	0.578	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	149	179.7	-73.5	-177.5	179.9	-178	0	111.7	N384 I387	N384-K389 PolarHBondContact N-O 3.07Å; N384-K389 PolarHBondContact O-N 3.2Å; I387-K389 HydrophobicContact CD1-CB 4.12Å; I387-K389 HydrophobicContact CD1-CD 4.44Å; I387-K389 HydrophobicContact CG1-CB 4.14Å; I387-K389 PolarHBondContact O-N 2.82Å
390	W	91.2	Very high	89.4	Confident	27 Å²	27	52.3 Å²	52.3	10%	0.102	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138.9	167.2	-66.3	95.2	0	0	0	110.4	I313 V326 A340 K341 L342 P343 V368 I370 W381 K382 Y383	I313-W390 HydrophobicContact CG2-CH2 4.49Å; I313-W390 HydrophobicContact CG2-CZ2 4.42Å; V326-W390 HydrophobicContact CG2-CZ2 4.4Å; A340-W390 PolarHBondContact O-NE1 2.82Å; A340-W390 VanDerWaalsContact O-NE1 3.1Å; K341-W390 PolarHBondContact O-NE1 2.66Å; L342-W390 HydrophobicContact CD2-CH2 4.38Å; L342-W390 HydrophobicContact CD2-CZ2 4.01Å; P343-W390 HydrophobicContact CG-CB 3.57Å; P343-W390 HydrophobicContact CG-CD2 4.1Å; P343-W390 HydrophobicContact CG-CE3 4.5Å; P343-W390 HydrophobicContact CG-CG 3.69Å; V368-W390 HydrophobicContact CG1-CH2 4.15Å; I370-W390 HydrophobicContact CB-CZ3 4.25Å; I370-W390 HydrophobicContact CD1-CE3 3.96Å; I370-W390 HydrophobicContact CD1-CH2 4.01Å; I370-W390 HydrophobicContact CD1-CZ3 3.65Å; I370-W390 HydrophobicContact CG1-CE3 4.17Å; I370-W390 HydrophobicContact CG1-CH2 4.29Å; I370-W390 HydrophobicContact CG1-CZ3 3.65Å; I370-W390 HydrophobicContact CG2-CH2 3.62Å; I370-W390 HydrophobicContact CG2-CZ3 3.71Å; W381-W390 HydrophobicContact CB-CE3 3.87Å; W381-W390 HydrophobicContact CE3-CB 3.84Å; W381-W390 HydrophobicContact CZ3-CB 4.46Å; K382-W390 CarbonylContact O-C 3.57Å; K382-W390 WeakPolarHBondContact O-CA 3.29Å; Y383-W390 HydrophobicContact CD2-CD2 4.16Å; Y383-W390 AromaticContact CD2-CE2 3.94Å; Y383-W390 HydrophobicContact CD2-CG 4.34Å; Y383-W390 HydrophobicContact CD2-CZ2 4.36Å; Y383-W390 AromaticContact CD2-NE1 3.98Å; Y383-W390 HydrophobicContact CG-CD2 4.47Å; Y383-W390 HydrophobicContact CG-CZ2 4.36Å
391	I	91.5	Very high	89.4	Confident	65 Å²	65	53.9 Å²	53.9	33%	0.333	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	121.8	-178.3	-55.4	173.5	0	0	0	107.2	W381 K382 N384 I387	W381-I391 CarbonylContact C-O 3.47Å; W381-I391 WeakPolarHBondContact CA-O 3.4Å; W381-I391 VanDerWaalsContact CE3-C 3.49Å; K382-I391 PolarHBondContact N-O 2.96Å; K382-I391 PolarHBondContact O-N 3.37Å; N384-I391 HydrophobicContact CB-CD1 3.95Å; I387-I391 HydrophobicContact CD1-CD1 4.42Å
392	Q	92.7	Very high	89.3	Confident	55 Å²	55	55.5 Å²	55.5	26%	0.257	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	133.7	172.3	177.6	75.6	50	0	0	108.7	V380 W381 Y395	V380-Q392 PolarHBondContact O-NE2 2.82Å; V380-Q392 VanDerWaalsContact O-NE2 3.14Å; W381-Q392 HydrophobicContact CD2-CB 4.13Å; W381-Q392 HydrophobicContact CE3-CB 3.98Å; W381-Q392 HydrophobicContact CH2-CB 3.9Å; W381-Q392 HydrophobicContact CZ2-CB 4.04Å; W381-Q392 HydrophobicContact CZ3-CB 3.88Å; Q392-Y395 VanDerWaalsContact NE2-CE1 3.34Å
393	I	94.9	Very high	89.4	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.097	27%	0.272	C	S	.	.			trans	-120.9	-172.3	174.2	61.3	164.1	0	0	0	110	Y369 V380 K382 Y395 Y430	Y369-I393 HydrophobicContact CD1-CD1 3.84Å; Y369-I393 HydrophobicContact CE1-CD1 3.89Å; V380-I393 HydrophobicContact CB-CD1 4.28Å; V380-I393 HydrophobicContact CB-CG1 3.81Å; V380-I393 HydrophobicContact CG1-CD1 3.52Å; V380-I393 HydrophobicContact CG1-CG1 3.58Å; V380-I393 WeakPolarHBondContact O-CG1 3.5Å; V380-I393 PolarHBondContact O-N 3.11Å; K382-I393 HydrophobicContact CB-CG2 4.07Å; I393-Y395 PolarHBondContact O-N 2.87Å; I393-Y430 HydrophobicContact CD1-CE1 3.83Å; I393-Y430 HydrophobicContact CD1-CE2 3.99Å
394	E	95.9	Very high	89.6	Confident	88 Å²	88	55.6 Å²	55.6	41%	0.411	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-55.2	133.2	-177.1	-158.2	59.2	-148.4	0	0	112.4	V380 Y430 N435 W437	V380-E394 WeakPolarHBondContact CG2-O 3.33Å; E394-Y430 HydrophobicContact CB-CE2 4.44Å; E394-N435 PolarHBondContact N-OD1 2.9Å; E394-N435 PolarHBondContact OE2-ND2 3.18Å; E394-W437 PolarHBondContact O-NE1 2.92Å
395	Y	95.8	Very high	90.4	Very high	116 Å²	116	54.3 Å²	54.3	46%	0.455	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-68	150.6	-179.2	-64.6	-88.4	0	0	0	111.5	N378 D379 Q392 I393 W437	N378-Y395 HydrophobicContact CB-CD1 4.24Å; N378-Y395 CarbonylContact O-C 3.51Å; N378-Y395 VanDerWaalsContact O-CA 3.31Å; N378-Y395 WeakPolarHBondContact O-CA 3.45Å; D379-Y395 VanDerWaalsContact OD1-CE1 3.32Å; D379-Y395 WeakPolarHBondContact OD1-CE1 3.44Å; Q392-Y395 VanDerWaalsContact NE2-CE1 3.34Å; I393-Y395 PolarHBondContact O-N 2.87Å; Y395-W437 PolarHBondContact O-NE1 3.5Å
396	L	95.7	Very high	91.1	Very high	4 Å²	4	53 Å²	53	2%	0.021	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-61.3	141.3	169.9	-60.3	177.6	0	0	0	110	N378 V380 V398 R400 V414 W437	N378-L396 PolarHBondContact ND2-O 2.85Å; N378-L396 PolarHBondContact O-N 2.79Å; V380-L396 HydrophobicContact CG2-CD2 3.77Å; V380-L396 HydrophobicContact CG2-CG 3.64Å; L396-V398 VanDerWaalsContact C-N 3.3Å; L396-R400 HydrophobicContact CD1-CG 3.82Å; L396-V414 HydrophobicContact CD1-CG1 4.33Å; L396-V414 HydrophobicContact CD2-CB 4.3Å; L396-V414 HydrophobicContact CD2-CG1 4.14Å; L396-V414 HydrophobicContact CD2-CG2 3.97Å; L396-W437 HydrophobicContact CD2-CD2 4.14Å; L396-W437 HydrophobicContact CD2-CE3 4.21Å; L396-W437 HydrophobicContact CD2-CH2 3.57Å; L396-W437 HydrophobicContact CD2-CZ2 3.47Å; L396-W437 VanDerWaalsContact CD2-CZ2 3.47Å; L396-W437 HydrophobicContact CD2-CZ3 3.94Å
397	N	93.9	Very high	92.2	Very high	112 Å²	112	48.4 Å²	48.4	60%	0.599	23%	0.23	S	C	*	.	S	Bend	trans	-66.3	-38.7	173.3	-62.2	-66.7	0	0	0	110.6	E428 W437	N397-E428 VanDerWaalsContact CB-OE2 3.25Å; N397-E428 WeakPolarHBondContact CB-OE2 3.41Å; N397-E428 PolarHBondContact N-OE2 2.78Å; N397-E428 PolarHBondContact ND2-OE2 2.92Å; N397-W437 VanDerWaalsContact ND2-CB 3.3Å; N397-W437 WeakPolarHBondContact ND2-CB 3.42Å
398	V	92.5	Very high	93	Very high	56 Å²	56	44.1 Å²	44.1	34%	0.339	21%	0.209	S	C	.	.	S	Bend	trans	-116.1	114.8	175.7	-176.3	0	0	0	0	110	L396 R400 D419 I424 E428	L396-V398 VanDerWaalsContact C-N 3.3Å; V398-R400 PolarHBondContact O-NE 3.04Å; V398-D419 HydrophobicContact CG1-CB 4.4Å; V398-I424 HydrophobicContact CG1-CD1 4.05Å; V398-E428 PolarHBondContact N-OE1 2.82Å
399	G	92.8	Very high	93.3	Very high	8 Å²	8	44.1 Å²	44.1	8%	0.082	23%	0.225	C	C	.	.			trans	-62.6	135.4	176.1	0	0	0	0	0	111.4	Q377 N378 D419	Q377-G399 CarbonylContact O-C 3.26Å; Q377-G399 WeakPolarHBondContact O-CA 3.46Å; N378-G399 PolarHBondContact ND2-N 3.03Å; N378-G399 WeakPolarHBondContact OD1-CA 3.33Å; G399-D419 WeakPolarHBondContact O-CA 3.37Å
400	R	94.5	Very high	93.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.			trans	-156.9	158.6	-173.3	59.9	-174.8	85.2	-160.8	8.5	114.4	G372 G373 Q377 L396 V398 H403 V414 G416 F418 I424 S426 E428	G372-R400 VanDerWaalsContact CA-O 3.26Å; G372-R400 WeakPolarHBondContact CA-O 3.34Å; G373-R400 PolarHBondContact N-O 3.44Å; Q377-R400 PolarHBondContact O-N 2.79Å; L396-R400 HydrophobicContact CD1-CG 3.82Å; V398-R400 PolarHBondContact O-NE 3.04Å; R400-H403 HydrophobicContact CG-CB 4.21Å; R400-V414 VanDerWaalsContact CD-CG1 3.44Å; R400-V414 HydrophobicContact CG-CG1 4.44Å; R400-G416 WeakPolarHBondContact CD-O 3.47Å; R400-G416 PolarHBondContact NH1-O 2.84Å; R400-F418 VanDerWaalsContact CA-O 3.22Å; R400-F418 WeakPolarHBondContact CA-O 3.17Å; R400-I424 HydrophobicContact CB-CD1 4.12Å; R400-S426 PolarHBondContact NH1-O 2.98Å; R400-S426 PolarHBondContact NH1-OG 3.19Å; R400-S426 PolarHBondContact NH2-OG 3.2Å; R400-E428 IonicContact CZ-OE1 2.84Å; R400-E428 IonicContact NH2-OE1 2.73Å; R400-E428 PolarHBondContact NH2-OE1 2.97Å
401	W	93.8	Very high	93.7	Very high	32 Å²	32	40.5 Å²	40.5	12%	0.121	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-139.6	166.2	169.2	71.5	-26.8	0	0	0	110.4	E358 G373 K374 H403 F418	E358-W401 HydrophobicContact CB-CE3 4.12Å; E358-W401 WeakPolarHBondContact OE2-CZ3 3.36Å; G373-W401 VanDerWaalsContact C-CB 3.49Å; K374-W401 HydrophobicContact CB-CD2 4.14Å; K374-W401 HydrophobicContact CB-CE3 3.34Å; K374-W401 HydrophobicContact CB-CZ3 3.6Å; K374-W401 HydrophobicContact CD-CE3 4.09Å; K374-W401 HydrophobicContact CD-CH2 3.83Å; K374-W401 HydrophobicContact CD-CZ3 3.39Å; K374-W401 HydrophobicContact CG-CD2 4.22Å; K374-W401 HydrophobicContact CG-CE3 3.53Å; K374-W401 HydrophobicContact CG-CH2 3.82Å; K374-W401 HydrophobicContact CG-CZ2 4.47Å; K374-W401 HydrophobicContact CG-CZ3 3.32Å; W401-H403 PolarHBondContact O-N 2.59Å; W401-H403 VanDerWaalsContact O-N 3.08Å; W401-F418 AromaticContact CD1-CD1 3.77Å; W401-F418 VanDerWaalsContact CD1-O 3.23Å; W401-F418 AromaticContact CE2-CD1 3.91Å; W401-F418 HydrophobicContact CZ2-CD1 4.28Å; W401-F418 HydrophobicContact CZ2-CE1 4.4Å; W401-F418 PolarHBondContact N-O 2.97Å; W401-F418 AromaticContact NE1-CD1 2.94Å; W401-F418 AromaticContact NE1-CE1 3.83Å; W401-F418 AromaticContact NE1-CG 3.59Å; W401-F418 PolarHBondContact O-N 2.93Å
402	R	93.9	Very high	93.9	Very high	72 Å²	72	37.4 Å²	37.4	27%	0.272	20%	0.199	S	C	.	.	S	Bend	trans	56.8	18.8	-174.1	-55.5	173.8	-177.5	-143.1	-12.7	113.6	E358 S449	E358-R402 HydrophobicContact CB-CG 3.79Å; E358-R402 VanDerWaalsContact CD-CG 3.46Å; E358-R402 HydrophobicContact CG-CG 4.14Å; E358-R402 PolarHBondContact O-N 2.88Å; E358-R402 WeakPolarHBondContact OE1-CG 2.83Å; E358-R402 IonicContact OE1-CZ 3.62Å; E358-R402 IonicContact OE1-NE 3.08Å; E358-R402 PolarHBondContact OE1-NE 3.19Å; E358-R402 IonicContact OE1-NH1 3.28Å; E358-R402 IonicContact OE1-NH2 3.83Å; E358-R402 PolarHBondContact OE1-NH2 3.37Å; E358-R402 IonicContact OE2-CZ 3.74Å; E358-R402 IonicContact OE2-NE 2.65Å; E358-R402 PolarHBondContact OE2-NE 3.46Å; E358-R402 IonicContact OE2-NH2 3.92Å; E358-R402 PolarHBondContact OE2-NH2 3.04Å; R402-S449 PolarHBondContact O-N 2.84Å
403	H	96.1	Very high	94.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.191	C	C	.	.			trans	-79.5	175.8	170.3	60.6	-69.3	0	0	0	110.1	A360 S371 R400 W401 I415 G416	A360-H403 WeakPolarHBondContact CB-NE2 3.49Å; S371-H403 PolarHBondContact O-CE1 2.82Å; S371-H403 PolarHBondContact O-NE2 2.67Å; S371-H403 VanDerWaalsContact O-NE2 3.09Å; S371-H403 PolarHBondContact OG-NE2 3.46Å; R400-H403 HydrophobicContact CG-CB 4.21Å; W401-H403 PolarHBondContact O-N 2.59Å; W401-H403 VanDerWaalsContact O-N 3.08Å; H403-I415 VanDerWaalsContact CB-O 3.28Å; H403-I415 WeakPolarHBondContact CB-O 3.48Å; H403-G416 WeakPolarHBondContact CB-O 3.48Å
404	K	96.3	Very high	94.2	Very high	43 Å²	43	35 Å²	35	19%	0.187	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157.8	169.3	-65.2	-65.4	171.9	-169.6	0	110.7	I415 F450 A452 N499	K404-I415 PolarHBondContact N-O 2.83Å; K404-I415 PolarHBondContact O-N 3.45Å; K404-F450 HydrophobicContact CB-CD2 4.31Å; K404-F450 HydrophobicContact CB-CE2 3.65Å; K404-F450 HydrophobicContact CB-CZ 3.88Å; K404-F450 WeakPolarHBondContact CE-O 3.41Å; K404-F450 HydrophobicContact CG-CD2 3.93Å; K404-F450 HydrophobicContact CG-CE2 3.75Å; K404-F450 HydrophobicContact CG-CG 4.44Å; K404-F450 HydrophobicContact CG-CZ 4.07Å; K404-F450 WeakPolarHBondContact CG-O 3.49Å; K404-A452 HydrophobicContact CB-CB 3.54Å; K404-A452 HydrophobicContact CG-CB 4.1Å; K404-N499 VanDerWaalsContact CE-OD1 3.26Å; K404-N499 WeakPolarHBondContact CE-OD1 3.46Å; K404-N499 PolarHBondContact NZ-OD1 3.41Å
405	M	96.1	Very high	94.2	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.049	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.4	174.1	-67.8	170.6	85.1	0	0	109.6	A360 I362 S371 V412 Y413 V414	A360-M405 HydrophobicContact CB-CB 4.38Å; A360-M405 HydrophobicContact CB-CG 3.66Å; A360-M405 HydrophobicContact CB-SD 3.82Å; I362-M405 HydrophobicContact CB-CB 3.81Å; I362-M405 HydrophobicContact CG2-CB 3.85Å; I362-M405 HydrophobicContact CG2-CE 3.73Å; I362-M405 HydrophobicContact CG2-SD 4.27Å; S371-M405 PolarHBondContact OG-SD 2.9Å; M405-V412 HydrophobicContact CE-CG1 3.3Å; M405-Y413 CarbonylContact C-O 3.53Å; M405-Y413 WeakPolarHBondContact CA-O 3.39Å; M405-V414 HydrophobicContact CE-CG2 4.16Å; M405-V414 HydrophobicContact CG-CG2 3.85Å
406	A	95.1	Very high	94.3	Very high	2 Å²	2	25.2 Å²	25.2	2%	0.017	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.6	171	0	0	0	0	0	109.8	Y413 I415 L459	A406-Y413 PolarHBondContact N-O 2.93Å; A406-Y413 PolarHBondContact O-N 2.81Å; A406-I415 HydrophobicContact CB-CD1 4.13Å; A406-L459 HydrophobicContact CB-CD2 3.55Å
407	V	93.8	Very high	94.2	Very high	7 Å²	7	25 Å²	25	4%	0.042	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	143.4	171.9	169.8	0	0	0	0	108.8	E292 I362 T363 L364 K411 V412 S454	E292-V407 VanDerWaalsContact OE1-C 3.29Å; I362-V407 HydrophobicContact CG1-CG2 3.78Å; I362-V407 HydrophobicContact CG2-CG2 4.47Å; T363-V407 WeakPolarHBondContact O-CG2 3.41Å; L364-V407 HydrophobicContact CB-CG2 3.89Å; L364-V407 HydrophobicContact CD1-CG1 3.65Å; L364-V407 HydrophobicContact CD1-CG2 4.15Å; V407-K411 WeakPolarHBondContact CA-O 3.34Å; V407-V412 HydrophobicContact CG2-CG2 4.43Å; V407-S454 WeakPolarHBondContact O-CB 3.29Å; V407-S454 PolarHBondContact O-OG 2.91Å; V407-S454 VanDerWaalsContact O-OG 3.07Å
408	L	92.1	Very high	94.2	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.031	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	126.5	169.6	177.9	72.3	0	0	0	109.6	G410 K411 Y413 K457 L459 Y478 P480	L408-G410 PolarHBondContact O-N 2.87Å; L408-K411 PolarHBondContact N-O 2.95Å; L408-K411 PolarHBondContact O-N 3.29Å; L408-Y413 HydrophobicContact CB-CD2 3.86Å; L408-Y413 HydrophobicContact CB-CE2 3.65Å; L408-Y413 HydrophobicContact CD2-CE2 4.09Å; L408-Y413 HydrophobicContact CG-CE2 4.31Å; L408-K457 VanDerWaalsContact CD1-CA 3.47Å; L408-K457 HydrophobicContact CD1-CB 4.4Å; L408-K457 WeakPolarHBondContact CD1-O 3.27Å; L408-L459 HydrophobicContact CB-CD1 4.48Å; L408-L459 HydrophobicContact CB-CD2 3.84Å; L408-L459 HydrophobicContact CB-CG 4.24Å; L408-L459 HydrophobicContact CD2-CD1 4.19Å; L408-L459 HydrophobicContact CD2-CD2 4.39Å; L408-L459 HydrophobicContact CD2-CG 3.92Å; L408-L459 HydrophobicContact CG-CD2 4.49Å; L408-Y478 HydrophobicContact CD2-CD1 4.26Å; L408-Y478 HydrophobicContact CD2-CE1 4.18Å; L408-P480 HydrophobicContact CD2-CB 3.73Å; L408-P480 HydrophobicContact CD2-CG 3.71Å; L408-P480 HydrophobicContact CG-CG 4.49Å
409	G	87.8	Confident	94.2	Very high	71 Å²	71	20.4 Å²	20.4	73%	0.732	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	34.2	174.9	0	0	0	0	0	113.7	K411	G409-K411 VanDerWaalsContact C-N 3.28Å; G409-K411 PolarHBondContact O-N 2.99Å
410	G	88.8	Confident	94	Very high	15 Å²	15	21.7 Å²	21.7	16%	0.155	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	6.7	-179.1	0	0	0	0	0	115.3	L364 L408	L364-G410 WeakPolarHBondContact CD2-O 3.48Å; L408-G410 PolarHBondContact O-N 2.87Å
411	K	92.8	Very high	93.8	Very high	68 Å²	68	29.1 Å²	29.1	30%	0.296	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	156.9	174.2	-65.8	-172.1	177.7	-168.5	0	111.1	V407 L408 G409 Y413 Y430	V407-K411 WeakPolarHBondContact CA-O 3.34Å; L408-K411 PolarHBondContact N-O 2.95Å; L408-K411 PolarHBondContact O-N 3.29Å; G409-K411 VanDerWaalsContact C-N 3.28Å; G409-K411 PolarHBondContact O-N 2.99Å; K411-Y413 HydrophobicContact CB-CD2 4.44Å; K411-Y413 HydrophobicContact CB-CE2 3.9Å; K411-Y430 WeakPolarHBondContact CA-O 3.36Å; K411-Y430 WeakPolarHBondContact CB-O 3.43Å
412	V	95.9	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122	174.4	173.5	0	0	0	0	109	I362 L364 Y369 M405 V407 A429 Y430	I362-V412 HydrophobicContact CG2-CG1 3.89Å; I362-V412 HydrophobicContact CG2-CG2 4.32Å; L364-V412 HydrophobicContact CB-CG2 4.12Å; L364-V412 HydrophobicContact CD2-CG2 3.72Å; Y369-V412 HydrophobicContact CD2-CG2 4.4Å; Y369-V412 HydrophobicContact CG-CG2 4.4Å; M405-V412 HydrophobicContact CE-CG1 3.3Å; V407-V412 HydrophobicContact CG2-CG2 4.43Å; V412-A429 CarbonylContact O-C 3.58Å; V412-A429 WeakPolarHBondContact O-CA 3.3Å; V412-Y430 HydrophobicContact CB-CD1 4.37Å; V412-Y430 PolarHBondContact N-O 2.94Å; V412-Y430 PolarHBondContact O-N 3.11Å
413	Y	96.8	Very high	93.7	Very high	23 Å²	23	32 Å²	32	9%	0.09	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.1	176.8	-72.8	-103.2	0	0	0	110	M405 A406 L408 K411 M427 E428 A429 A440 L459 Y478	M405-Y413 CarbonylContact C-O 3.53Å; M405-Y413 WeakPolarHBondContact CA-O 3.39Å; A406-Y413 PolarHBondContact N-O 2.93Å; A406-Y413 PolarHBondContact O-N 2.81Å; L408-Y413 HydrophobicContact CB-CD2 3.86Å; L408-Y413 HydrophobicContact CB-CE2 3.65Å; L408-Y413 HydrophobicContact CD2-CE2 4.09Å; L408-Y413 HydrophobicContact CG-CE2 4.31Å; K411-Y413 HydrophobicContact CB-CD2 4.44Å; K411-Y413 HydrophobicContact CB-CE2 3.9Å; Y413-M427 HydrophobicContact CD1-CE 3.99Å; Y413-M427 HydrophobicContact CD1-CG 4.03Å; Y413-M427 HydrophobicContact CD1-SD 3.75Å; Y413-M427 HydrophobicContact CE1-CE 4.18Å; Y413-E428 CarbonylContact C-O 3.56Å; Y413-E428 VanDerWaalsContact CA-O 3.32Å; Y413-E428 WeakPolarHBondContact CA-O 3.48Å; Y413-A429 HydrophobicContact CD1-CB 3.81Å; Y413-A429 HydrophobicContact CE1-CB 3.52Å; Y413-A429 HydrophobicContact CE2-CB 4.31Å; Y413-A429 HydrophobicContact CG-CB 4.34Å; Y413-A440 HydrophobicContact CE1-CB 4.15Å; Y413-L459 HydrophobicContact CD1-CD1 3.95Å; Y413-L459 HydrophobicContact CD2-CD1 4.13Å; Y413-L459 HydrophobicContact CG-CD1 3.71Å; Y413-Y478 HydrophobicContact CE1-CE1 4.15Å
414	V	97.1	Very high	93.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	122	172.5	165.1	0	0	0	0	108.1	L396 R400 M405 M427 E428 W437	L396-V414 HydrophobicContact CD1-CG1 4.33Å; L396-V414 HydrophobicContact CD2-CB 4.3Å; L396-V414 HydrophobicContact CD2-CG1 4.14Å; L396-V414 HydrophobicContact CD2-CG2 3.97Å; R400-V414 VanDerWaalsContact CD-CG1 3.44Å; R400-V414 HydrophobicContact CG-CG1 4.44Å; M405-V414 HydrophobicContact CE-CG2 4.16Å; M405-V414 HydrophobicContact CG-CG2 3.85Å; V414-M427 WeakPolarHBondContact O-CA 3.48Å; V414-E428 PolarHBondContact N-O 2.84Å; V414-E428 PolarHBondContact O-N 3.42Å; V414-W437 HydrophobicContact CB-CH2 4.24Å; V414-W437 HydrophobicContact CB-CZ3 3.89Å; V414-W437 HydrophobicContact CG2-CH2 3.4Å; V414-W437 VanDerWaalsContact CG2-CH2 3.4Å; V414-W437 HydrophobicContact CG2-CZ3 3.54Å
415	I	97.4	Very high	93.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.6	-161	-50.6	172	0	0	0	109.8	H403 K404 A406 M427 L443 F450 A452 L459 V461	H403-I415 VanDerWaalsContact CB-O 3.28Å; H403-I415 WeakPolarHBondContact CB-O 3.48Å; K404-I415 PolarHBondContact N-O 2.83Å; K404-I415 PolarHBondContact O-N 3.45Å; A406-I415 HydrophobicContact CB-CD1 4.13Å; I415-M427 HydrophobicContact CD1-SD 4.44Å; I415-M427 HydrophobicContact CG1-CG 4.11Å; I415-M427 HydrophobicContact CG1-SD 3.95Å; I415-L443 HydrophobicContact CG2-CD1 3.78Å; I415-L443 HydrophobicContact CG2-CD2 3.94Å; I415-L443 HydrophobicContact CG2-CG 4.18Å; I415-F450 HydrophobicContact CB-CE2 4.37Å; I415-F450 HydrophobicContact CB-CZ 3.97Å; I415-F450 HydrophobicContact CG2-CE2 4.13Å; I415-F450 HydrophobicContact CG2-CZ 3.83Å; I415-F450 WeakPolarHBondContact O-CZ 3.38Å; I415-A452 HydrophobicContact CD1-CB 4.49Å; I415-L459 HydrophobicContact CD1-CD1 4.15Å; I415-V461 HydrophobicContact CD1-CG2 4.41Å; I415-V461 HydrophobicContact CG2-CG2 3.86Å
416	G	96.3	Very high	93.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.201	C	C	.	.			trans	54.7	-145.6	169.4	0	0	0	0	0	114.2	R400 H403 I424 S426	R400-G416 WeakPolarHBondContact CD-O 3.47Å; R400-G416 PolarHBondContact NH1-O 2.84Å; H403-G416 WeakPolarHBondContact CB-O 3.48Å; G416-I424 WeakPolarHBondContact CA-O 3.48Å; G416-I424 WeakPolarHBondContact O-CG1 3.18Å; G416-S426 PolarHBondContact N-O 2.93Å
417	G	95.5	Very high	93.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.2	C	C	.	.			trans	106	-153.5	177.9	0	0	0	0	0	113.6	R423 I424 V447	G417-R423 WeakPolarHBondContact O-CA 3.41Å; G417-I424 PolarHBondContact O-N 3.24Å; G417-V447 PolarHBondContact N-O 2.83Å
418	F	93.9	Very high	93.8	Very high	34 Å²	34	34.3 Å²	34.3	15%	0.149	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-130.3	137.7	174	-177.3	-102.5	0	0	0	109.6	R400 W401 G420 L421 Q422 R423	R400-F418 VanDerWaalsContact CA-O 3.22Å; R400-F418 WeakPolarHBondContact CA-O 3.17Å; W401-F418 AromaticContact CD1-CD1 3.77Å; W401-F418 VanDerWaalsContact CD1-O 3.23Å; W401-F418 AromaticContact CE2-CD1 3.91Å; W401-F418 HydrophobicContact CZ2-CD1 4.28Å; W401-F418 HydrophobicContact CZ2-CE1 4.4Å; W401-F418 PolarHBondContact N-O 2.97Å; W401-F418 AromaticContact NE1-CD1 2.94Å; W401-F418 AromaticContact NE1-CE1 3.83Å; W401-F418 AromaticContact NE1-CG 3.59Å; W401-F418 PolarHBondContact O-N 2.93Å; F418-G420 WeakPolarHBondContact CE1-O 3.39Å; F418-G420 VanDerWaalsContact CZ-C 3.44Å; F418-G420 WeakPolarHBondContact CZ-O 3.3Å; F418-L421 WeakPolarHBondContact CE2-O 3.49Å; F418-Q422 WeakPolarHBondContact CA-O 3.41Å; F418-Q422 WeakPolarHBondContact CD2-O 3.18Å; F418-Q422 VanDerWaalsContact CE2-N 3.33Å; F418-R423 HydrophobicContact CD2-CG 4.34Å; F418-R423 VanDerWaalsContact CG-NH1 3.28Å
419	D	92.2	Very high	94.1	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.193	20%	0.199	C	C	.	.			trans	-95.4	7.9	-176.8	63	3.8	0	0	0	113.6	V398 G399 L421 Q422 I424	V398-D419 HydrophobicContact CG1-CB 4.4Å; G399-D419 WeakPolarHBondContact O-CA 3.37Å; D419-L421 WeakPolarHBondContact OD1-CA 3.49Å; D419-L421 PolarHBondContact OD1-N 3.19Å; D419-Q422 PolarHBondContact N-O 3.11Å; D419-Q422 PolarHBondContact OD1-N 2.79Å; D419-Q422 WeakPolarHBondContact OD2-CG 3.47Å; D419-I424 HydrophobicContact CB-CD1 4.47Å; D419-I424 HydrophobicContact CB-CG2 3.9Å; D419-I424 WeakPolarHBondContact OD2-CG2 3.41Å
420	G	87.9	Confident	94.5	Very high	36 Å²	36	31.1 Å²	31.1	37%	0.371	17%	0.166	S	C	.	.	S	Bend	trans	100.9	-21.9	-172.6	0	0	0	0	0	113.3	F418	F418-G420 WeakPolarHBondContact CE1-O 3.39Å; F418-G420 VanDerWaalsContact CZ-C 3.44Å; F418-G420 WeakPolarHBondContact CZ-O 3.3Å
421	L	89.3	Confident	94.6	Very high	156 Å²	156	31.7 Å²	31.7	82%	0.817	17%	0.165	S	C	*	.	S	Bend	trans	-118.4	-47.6	-177.3	-61.6	174.7	0	0	0	112.1	F418 D419	F418-L421 WeakPolarHBondContact CE2-O 3.49Å; D419-L421 WeakPolarHBondContact OD1-CA 3.49Å; D419-L421 PolarHBondContact OD1-N 3.19Å
422	Q	92.3	Very high	94.5	Very high	124 Å²	124	30.5 Å²	30.5	58%	0.579	17%	0.165	S	C	*	.	S	Bend	trans	-142.8	161.3	-173	62.9	-178.3	-17.1	0	0	112.8	F418 D419 I424	F418-Q422 WeakPolarHBondContact CA-O 3.41Å; F418-Q422 WeakPolarHBondContact CD2-O 3.18Å; F418-Q422 VanDerWaalsContact CE2-N 3.33Å; D419-Q422 PolarHBondContact N-O 3.11Å; D419-Q422 PolarHBondContact OD1-N 2.79Å; D419-Q422 WeakPolarHBondContact OD2-CG 3.47Å; Q422-I424 HydrophobicContact CG-CG2 4.31Å
423	R	94.1	Very high	94.1	Very high	39 Å²	39	39 Å²	39	15%	0.147	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-76.9	123.6	173.2	-64.3	-61.3	-168	-100.9	14.4	108.3	G417 F418 N446 S448	G417-R423 WeakPolarHBondContact O-CA 3.41Å; F418-R423 HydrophobicContact CD2-CG 4.34Å; F418-R423 VanDerWaalsContact CG-NH1 3.28Å; R423-N446 HydrophobicContact CB-CB 4.38Å; R423-N446 WeakPolarHBondContact CB-ND2 3.47Å; R423-N446 WeakPolarHBondContact O-CB 3.44Å; R423-N446 PolarHBondContact O-ND2 3.41Å; R423-S448 VanDerWaalsContact CD-CB 3.5Å; R423-S448 VanDerWaalsContact CZ-OG 3.24Å; R423-S448 VanDerWaalsContact NE-CB 3.28Å; R423-S448 PolarHBondContact NE-OG 2.8Å; R423-S448 PolarHBondContact NH2-OG 2.93Å; R423-S448 VanDerWaalsContact NH2-OG 3.11Å
424	I	95.3	Very high	93.8	Very high	14 Å²	14	43.7 Å²	43.7	7%	0.072	22%	0.224	C	C	.	.			trans	-100.7	150.4	-174.5	61.3	-179.9	0	0	0	111.1	V398 R400 G416 G417 D419 Q422	V398-I424 HydrophobicContact CG1-CD1 4.05Å; R400-I424 HydrophobicContact CB-CD1 4.12Å; G416-I424 WeakPolarHBondContact CA-O 3.48Å; G416-I424 WeakPolarHBondContact O-CG1 3.18Å; G417-I424 PolarHBondContact O-N 3.24Å; D419-I424 HydrophobicContact CB-CD1 4.47Å; D419-I424 HydrophobicContact CB-CG2 3.9Å; D419-I424 WeakPolarHBondContact OD2-CG2 3.41Å; Q422-I424 HydrophobicContact CG-CG2 4.31Å
425	N	95.6	Very high	93.5	Very high	69 Å²	69	46.6 Å²	46.6	37%	0.369	24%	0.24	S	C	.	.			trans	-106.9	2.7	171.4	63.3	-16.4	0	0	0	112.8	P442 L443 N446	N425-P442 HydrophobicContact CB-CB 4.41Å; N425-P442 CarbonylContact O-C 3.58Å; N425-P442 WeakPolarHBondContact O-CA 3.45Å; N425-P442 WeakPolarHBondContact O-CB 3.41Å; N425-L443 HydrophobicContact CB-CB 3.89Å; N425-L443 HydrophobicContact CB-CD1 4.41Å; N425-L443 WeakPolarHBondContact CB-O 3.36Å; N425-L443 PolarHBondContact ND2-O 2.86Å; N425-L443 VanDerWaalsContact ND2-O 3.14Å; N425-L443 WeakPolarHBondContact O-CD1 3.37Å; N425-L443 PolarHBondContact O-N 2.91Å; N425-N446 HydrophobicContact CB-CB 3.94Å
426	S	96.3	Very high	93.4	Very high	23 Å²	23	49.1 Å²	49.1	16%	0.161	26%	0.257	C	S	.	.			trans	-67.2	146.3	-179.7	64.4	0	0	0	0	111.7	R400 G416	R400-S426 PolarHBondContact NH1-O 2.98Å; R400-S426 PolarHBondContact NH1-OG 3.19Å; R400-S426 PolarHBondContact NH2-OG 3.2Å; G416-S426 PolarHBondContact N-O 2.93Å
427	M	96.7	Very high	93.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.6	175.3	-177.6	168.9	69.7	0	0	109.2	Y413 V414 I415 A440 L459 Y478 W485	Y413-M427 HydrophobicContact CD1-CE 3.99Å; Y413-M427 HydrophobicContact CD1-CG 4.03Å; Y413-M427 HydrophobicContact CD1-SD 3.75Å; Y413-M427 HydrophobicContact CE1-CE 4.18Å; V414-M427 WeakPolarHBondContact O-CA 3.48Å; I415-M427 HydrophobicContact CD1-SD 4.44Å; I415-M427 HydrophobicContact CG1-CG 4.11Å; I415-M427 HydrophobicContact CG1-SD 3.95Å; M427-A440 HydrophobicContact CB-CB 4.36Å; M427-A440 HydrophobicContact CE-CB 3.38Å; M427-A440 HydrophobicContact CG-CB 4.15Å; M427-A440 PolarHBondContact O-N 2.74Å; M427-L459 HydrophobicContact SD-CD1 4.24Å; M427-Y478 HydrophobicContact CE-CD1 3.97Å; M427-Y478 HydrophobicContact CE-CD2 3.88Å; M427-Y478 HydrophobicContact CE-CE1 3.78Å; M427-Y478 HydrophobicContact CE-CE2 3.69Å; M427-Y478 HydrophobicContact CE-CG 4.02Å; M427-W485 HydrophobicContact CE-CZ2 4Å; M427-W485 HydrophobicContact SD-CZ2 3.7Å
428	E	96.6	Very high	93.4	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.028	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140	177.4	-60.1	-178.1	-127.5	0	0	109.5	N397 V398 R400 Y413 V414 W437 S438	N397-E428 VanDerWaalsContact CB-OE2 3.25Å; N397-E428 WeakPolarHBondContact CB-OE2 3.41Å; N397-E428 PolarHBondContact N-OE2 2.78Å; N397-E428 PolarHBondContact ND2-OE2 2.92Å; V398-E428 PolarHBondContact N-OE1 2.82Å; R400-E428 IonicContact CZ-OE1 2.84Å; R400-E428 IonicContact NH2-OE1 2.73Å; R400-E428 PolarHBondContact NH2-OE1 2.97Å; Y413-E428 CarbonylContact C-O 3.56Å; Y413-E428 VanDerWaalsContact CA-O 3.32Å; Y413-E428 WeakPolarHBondContact CA-O 3.48Å; V414-E428 PolarHBondContact N-O 2.84Å; V414-E428 PolarHBondContact O-N 3.42Å; E428-W437 HydrophobicContact CB-CE3 3.66Å; E428-W437 HydrophobicContact CB-CZ3 4.2Å; E428-S438 CarbonylContact C-O 3.56Å; E428-S438 WeakPolarHBondContact CA-O 3.31Å
429	A	96.7	Very high	93.5	Very high	3 Å²	3	58.7 Å²	58.7	3%	0.025	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.6	177.9	0	0	0	0	0	109.9	V412 Y413 S438	V412-A429 CarbonylContact O-C 3.58Å; V412-A429 WeakPolarHBondContact O-CA 3.3Å; Y413-A429 HydrophobicContact CD1-CB 3.81Å; Y413-A429 HydrophobicContact CE1-CB 3.52Å; Y413-A429 HydrophobicContact CE2-CB 4.31Å; Y413-A429 HydrophobicContact CG-CB 4.34Å; A429-S438 PolarHBondContact N-O 3.17Å; A429-S438 PolarHBondContact O-N 3.12Å; A429-S438 PolarHBondContact O-OG 2.72Å
430	Y	96.6	Very high	93.6	Very high	7 Å²	7	57.4 Å²	57.4	3%	0.027	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.7	175.8	177.2	-111.9	0	0	0	111.1	Y369 I393 E394 K411 V412 P432 N435 W437	Y369-Y430 HydrophobicContact CD1-CE1 4.47Å; Y369-Y430 HydrophobicContact CE1-CD1 4.3Å; Y369-Y430 AromaticContact CE1-CE1 3.76Å; Y369-Y430 HydrophobicContact CE1-CE1 3.76Å; I393-Y430 HydrophobicContact CD1-CE1 3.83Å; I393-Y430 HydrophobicContact CD1-CE2 3.99Å; E394-Y430 HydrophobicContact CB-CE2 4.44Å; K411-Y430 WeakPolarHBondContact CA-O 3.36Å; K411-Y430 WeakPolarHBondContact CB-O 3.43Å; V412-Y430 HydrophobicContact CB-CD1 4.37Å; V412-Y430 PolarHBondContact N-O 2.94Å; V412-Y430 PolarHBondContact O-N 3.11Å; Y430-P432 HydrophobicContact CD1-CB 4.37Å; Y430-P432 HydrophobicContact CE1-CB 3.8Å; Y430-P432 WeakPolarHBondContact O-CD 3.2Å; Y430-N435 PolarHBondContact OH-OD1 2.79Å; Y430-W437 VanDerWaalsContact CB-CZ3 3.45Å; Y430-W437 HydrophobicContact CD2-CD2 4.08Å; Y430-W437 AromaticContact CD2-CE2 3.69Å; Y430-W437 HydrophobicContact CD2-CG 4.37Å; Y430-W437 AromaticContact CD2-CZ2 3.99Å; Y430-W437 HydrophobicContact CD2-CZ2 3.99Å; Y430-W437 AromaticContact CD2-NE1 3.8Å; Y430-W437 HydrophobicContact CG-CD2 4.41Å; Y430-W437 HydrophobicContact CG-CH2 4.25Å; Y430-W437 AromaticContact CG-CZ2 4Å; Y430-W437 HydrophobicContact CG-CZ2 4Å
431	D	91.5	Very high	94	Very high	28 Å²	28	56.4 Å²	56.4	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.7	170	-171.3	-19.9	0	0	0	109.8	F433 H434 N435 C436	D431-F433 PolarHBondContact O-N 3.14Å; D431-F433 WeakPolarHBondContact OD1-CB 3.36Å; D431-F433 PolarHBondContact OD1-N 2.7Å; D431-H434 HydrophobicContact CB-CB 4.45Å; D431-H434 PolarHBondContact O-N 2.8Å; D431-H434 IonicContact OD1-ND1 2.67Å; D431-H434 IonicContact OD2-CE1 3.98Å; D431-H434 IonicContact OD2-CG 2.7Å; D431-H434 IonicContact OD2-ND1 3.06Å; D431-H434 PolarHBondContact OD2-ND1 3.37Å; D431-N435 WeakPolarHBondContact O-CA 2.94Å; D431-N435 PolarHBondContact O-N 2.82Å; D431-C436 PolarHBondContact N-O 3.16Å; D431-C436 PolarHBondContact O-N 2.84Å
432	P	90.1	Very high	94.3	Very high	43 Å²	43	52 Å²	52	28%	0.279	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18	-179.2	28.2	-34.9	0	0	0	113.6	L364 Y430	L364-P432 HydrophobicContact CD2-CG 4.13Å; Y430-P432 HydrophobicContact CD1-CB 4.37Å; Y430-P432 HydrophobicContact CE1-CB 3.8Å; Y430-P432 WeakPolarHBondContact O-CD 3.2Å
433	F	88.4	Confident	94.5	Very high	178 Å²	178	46.2 Å²	46.2	78%	0.781	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-42.3	177.7	-177.2	-92.5	0	0	0	111.4	D431	D431-F433 PolarHBondContact O-N 3.14Å; D431-F433 WeakPolarHBondContact OD1-CB 3.36Å; D431-F433 PolarHBondContact OD1-N 2.7Å
434	H	89.3	Confident	94.5	Very high	121 Å²	121	48.7 Å²	48.7	56%	0.56	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-7.3	-179.2	-61.6	105.6	0	0	0	113.6	D431 C436	D431-H434 HydrophobicContact CB-CB 4.45Å; D431-H434 PolarHBondContact O-N 2.8Å; D431-H434 IonicContact OD1-ND1 2.67Å; D431-H434 IonicContact OD2-CE1 3.98Å; D431-H434 IonicContact OD2-CG 2.7Å; D431-H434 IonicContact OD2-ND1 3.06Å; D431-H434 PolarHBondContact OD2-ND1 3.37Å; H434-C436 VanDerWaalsContact C-N 3.32Å; H434-C436 PolarHBondContact O-N 2.91Å
435	N	92.6	Very high	94.4	Very high	61 Å²	61	49.2 Å²	49.2	33%	0.326	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	52.6	-172.5	-177.9	55.5	0	0	0	111.6	E394 Y430 D431	E394-N435 PolarHBondContact N-OD1 2.9Å; E394-N435 PolarHBondContact OE2-ND2 3.18Å; Y430-N435 PolarHBondContact OH-OD1 2.79Å; D431-N435 WeakPolarHBondContact O-CA 2.94Å; D431-N435 PolarHBondContact O-N 2.82Å
436	C	94.8	Very high	94.4	Very high	53 Å²	53	48.8 Å²	48.8	36%	0.358	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	153	-179.6	70.8	0	0	0	0	112	D431 H434	D431-C436 PolarHBondContact N-O 3.16Å; D431-C436 PolarHBondContact O-N 2.84Å; H434-C436 VanDerWaalsContact C-N 3.32Å; H434-C436 PolarHBondContact O-N 2.91Å
437	W	96.8	Very high	94.4	Very high	25 Å²	25	47.7 Å²	47.7	10%	0.095	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.8	174.7	-67	94.3	0	0	0	110.7	V380 E394 Y395 L396 N397 V414 E428 Y430	V380-W437 HydrophobicContact CG1-CZ2 4.07Å; V380-W437 HydrophobicContact CG2-CZ2 3.89Å; E394-W437 PolarHBondContact O-NE1 2.92Å; Y395-W437 PolarHBondContact O-NE1 3.5Å; L396-W437 HydrophobicContact CD2-CD2 4.14Å; L396-W437 HydrophobicContact CD2-CE3 4.21Å; L396-W437 HydrophobicContact CD2-CH2 3.57Å; L396-W437 HydrophobicContact CD2-CZ2 3.47Å; L396-W437 VanDerWaalsContact CD2-CZ2 3.47Å; L396-W437 HydrophobicContact CD2-CZ3 3.94Å; N397-W437 VanDerWaalsContact ND2-CB 3.3Å; N397-W437 WeakPolarHBondContact ND2-CB 3.42Å; V414-W437 HydrophobicContact CB-CH2 4.24Å; V414-W437 HydrophobicContact CB-CZ3 3.89Å; V414-W437 HydrophobicContact CG2-CH2 3.4Å; V414-W437 VanDerWaalsContact CG2-CH2 3.4Å; V414-W437 HydrophobicContact CG2-CZ3 3.54Å; E428-W437 HydrophobicContact CB-CE3 3.66Å; E428-W437 HydrophobicContact CB-CZ3 4.2Å; Y430-W437 VanDerWaalsContact CB-CZ3 3.45Å; Y430-W437 HydrophobicContact CD2-CD2 4.08Å; Y430-W437 AromaticContact CD2-CE2 3.69Å; Y430-W437 HydrophobicContact CD2-CG 4.37Å; Y430-W437 AromaticContact CD2-CZ2 3.99Å; Y430-W437 HydrophobicContact CD2-CZ2 3.99Å; Y430-W437 AromaticContact CD2-NE1 3.8Å; Y430-W437 HydrophobicContact CG-CD2 4.41Å; Y430-W437 HydrophobicContact CG-CH2 4.25Å; Y430-W437 AromaticContact CG-CZ2 4Å; Y430-W437 HydrophobicContact CG-CZ2 4Å
438	S	95.2	Very high	94.3	Very high	51 Å²	51	47.7 Å²	47.7	36%	0.357	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.2	175.8	53	0	0	0	0	109.9	E428 A429	E428-S438 CarbonylContact C-O 3.56Å; E428-S438 WeakPolarHBondContact CA-O 3.31Å; A429-S438 PolarHBondContact N-O 3.17Å; A429-S438 PolarHBondContact O-N 3.12Å; A429-S438 PolarHBondContact O-OG 2.72Å
439	E	95.5	Very high	94.2	Very high	159 Å²	159	47.9 Å²	47.9	74%	0.743	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.7	177	-167.9	175.5	-172.6	0	0	110.7
440	A	94.5	Very high	94.2	Very high	10 Å²	10	47.7 Å²	47.7	8%	0.083	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	167.4	173.7	0	0	0	0	0	110.4	Y413 M427	Y413-A440 HydrophobicContact CE1-CB 4.15Å; M427-A440 HydrophobicContact CB-CB 4.36Å; M427-A440 HydrophobicContact CE-CB 3.38Å; M427-A440 HydrophobicContact CG-CB 4.15Å; M427-A440 PolarHBondContact O-N 2.74Å
441	A	95.1	Very high	94.2	Very high	15 Å²	15	47.4 Å²	47.4	12%	0.124	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-55.1	132.7	-173.6	0	0	0	0	0	112.5	Y478 N483 W485	A441-Y478 HydrophobicContact CB-CE2 4.05Å; A441-N483 WeakPolarHBondContact CB-O 3.49Å; A441-N483 VanDerWaalsContact CB-OD1 3.25Å; A441-N483 WeakPolarHBondContact CB-OD1 3.33Å; A441-N483 PolarHBondContact N-OD1 3.33Å; A441-N483 VanDerWaalsContact N-OD1 3.13Å; A441-W485 PolarHBondContact O-NE1 3.42Å
442	P	96.4	Very high	94.4	Very high	63 Å²	63	46.6 Å²	46.6	41%	0.409	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-71.4	151	-177.8	30	-35.6	0	0	0	111.3	N425 W485	N425-P442 HydrophobicContact CB-CB 4.41Å; N425-P442 CarbonylContact O-C 3.58Å; N425-P442 WeakPolarHBondContact O-CA 3.45Å; N425-P442 WeakPolarHBondContact O-CB 3.41Å; P442-W485 PolarHBondContact O-NE1 3.15Å
443	L	96.1	Very high	94.7	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-58.3	149.1	174.4	-61.5	134.7	0	0	0	110.9	I415 N425 V445 V461 W485	I415-L443 HydrophobicContact CG2-CD1 3.78Å; I415-L443 HydrophobicContact CG2-CD2 3.94Å; I415-L443 HydrophobicContact CG2-CG 4.18Å; N425-L443 HydrophobicContact CB-CB 3.89Å; N425-L443 HydrophobicContact CB-CD1 4.41Å; N425-L443 WeakPolarHBondContact CB-O 3.36Å; N425-L443 PolarHBondContact ND2-O 2.86Å; N425-L443 VanDerWaalsContact ND2-O 3.14Å; N425-L443 WeakPolarHBondContact O-CD1 3.37Å; N425-L443 PolarHBondContact O-N 2.91Å; L443-V445 VanDerWaalsContact C-N 3.3Å; L443-V445 WeakPolarHBondContact CB-O 3.44Å; L443-V461 HydrophobicContact CD2-CB 3.98Å; L443-V461 HydrophobicContact CD2-CG1 3.83Å; L443-V461 HydrophobicContact CD2-CG2 3.86Å; L443-W485 HydrophobicContact CD2-CE3 4.43Å; L443-W485 HydrophobicContact CD2-CH2 3.69Å; L443-W485 HydrophobicContact CD2-CZ2 3.77Å; L443-W485 HydrophobicContact CD2-CZ3 4.04Å; L443-W485 HydrophobicContact CG-CH2 4.49Å; L443-W485 HydrophobicContact CG-CZ2 4.07Å
444	M	95.1	Very high	94.9	Very high	90 Å²	90	37.1 Å²	37.1	44%	0.443	21%	0.205	S	C	.	.	S	Bend	trans	-70.8	-31.4	173.7	-58.9	179.3	-57.5	0	0	111.8	Q476 W485 L487	M444-Q476 HydrophobicContact CE-CB 4.32Å; M444-Q476 HydrophobicContact CE-CG 3.99Å; M444-W485 HydrophobicContact CE-CB 4.39Å; M444-W485 HydrophobicContact CG-CB 3.76Å; M444-W485 HydrophobicContact SD-CB 4.17Å; M444-L487 HydrophobicContact CE-CB 4.29Å; M444-L487 HydrophobicContact CE-CD2 3.33Å; M444-L487 HydrophobicContact CE-CG 3.4Å; M444-L487 VanDerWaalsContact CE-CG 3.4Å; M444-L487 HydrophobicContact SD-CG 4.37Å
445	V	93.6	Very high	95.1	Very high	25 Å²	25	32 Å²	32	15%	0.152	18%	0.181	C	C	.	.	S	Bend	trans	-125.3	122.1	175.3	-173.9	0	0	0	0	108.5	L443 V447 P466 K474 Q476	L443-V445 VanDerWaalsContact C-N 3.3Å; L443-V445 WeakPolarHBondContact CB-O 3.44Å; V445-V447 HydrophobicContact CG1-CG1 4.1Å; V445-P466 HydrophobicContact CG1-CB 4.3Å; V445-K474 HydrophobicContact CG2-CD 3.85Å; V445-Q476 PolarHBondContact O-NE2 3.39Å; V445-Q476 VanDerWaalsContact O-NE2 3.16Å
446	N	94.4	Very high	94.8	Very high	60 Å²	60	34.7 Å²	34.7	32%	0.321	19%	0.19	S	C	.	.			trans	-67.6	128.7	172.7	59.7	-46.6	0	0	0	110.1	R423 N425 P466	R423-N446 HydrophobicContact CB-CB 4.38Å; R423-N446 WeakPolarHBondContact CB-ND2 3.47Å; R423-N446 WeakPolarHBondContact O-CB 3.44Å; R423-N446 PolarHBondContact O-ND2 3.41Å; N425-N446 HydrophobicContact CB-CB 3.94Å; N446-P466 VanDerWaalsContact O-CA 3.31Å; N446-P466 WeakPolarHBondContact O-CA 3.25Å
447	V	95.8	Very high	94.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.			trans	-145.4	147.3	-174.8	-73.6	0	0	0	0	111	G417 V445 F450 V461 T472	G417-V447 PolarHBondContact N-O 2.83Å; V445-V447 HydrophobicContact CG1-CG1 4.1Å; V447-F450 HydrophobicContact CB-CB 4.36Å; V447-F450 HydrophobicContact CB-CD1 3.98Å; V447-F450 HydrophobicContact CB-CG 4.44Å; V447-F450 HydrophobicContact CG2-CB 4.1Å; V447-F450 HydrophobicContact CG2-CD1 3.48Å; V447-F450 VanDerWaalsContact CG2-CD1 3.48Å; V447-F450 HydrophobicContact CG2-CE1 3.96Å; V447-F450 HydrophobicContact CG2-CG 3.81Å; V447-F450 WeakPolarHBondContact O-CD1 3.15Å; V447-F450 WeakPolarHBondContact O-CE1 3.31Å; V447-V461 HydrophobicContact CG2-CG1 3.92Å; V447-T472 HydrophobicContact CG1-CG2 4.05Å
448	S	95.3	Very high	94.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.007	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-120.5	165	161.9	77.2	0	0	0	0	111	R423 F450 G464 G465	R423-S448 VanDerWaalsContact CD-CB 3.5Å; R423-S448 VanDerWaalsContact CZ-OG 3.24Å; R423-S448 VanDerWaalsContact NE-CB 3.28Å; R423-S448 PolarHBondContact NE-OG 2.8Å; R423-S448 PolarHBondContact NH2-OG 2.93Å; R423-S448 VanDerWaalsContact NH2-OG 3.11Å; S448-F450 PolarHBondContact O-N 2.86Å; S448-F450 VanDerWaalsContact O-N 3.13Å; S448-G464 WeakPolarHBondContact O-CA 3.45Å; S448-G465 PolarHBondContact N-O 2.92Å; S448-G465 PolarHBondContact O-N 3.44Å
449	S	94.4	Very high	94.5	Very high	9 Å²	9	38.3 Å²	38.3	6%	0.063	19%	0.194	C	C	.	.	S	Bend	trans	55.9	30.9	174.1	-46.7	0	0	0	0	112.1	R402 K496 C497	R402-S449 PolarHBondContact O-N 2.84Å; S449-K496 CarbonylContact O-C 3.57Å; S449-C497 PolarHBondContact O-N 2.95Å
450	F	96.2	Very high	94.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.			trans	-90.5	171.8	177.4	60.8	-89.7	0	0	0	110.2	K404 I415 V447 S448 A452 V461 G463	K404-F450 HydrophobicContact CB-CD2 4.31Å; K404-F450 HydrophobicContact CB-CE2 3.65Å; K404-F450 HydrophobicContact CB-CZ 3.88Å; K404-F450 WeakPolarHBondContact CE-O 3.41Å; K404-F450 HydrophobicContact CG-CD2 3.93Å; K404-F450 HydrophobicContact CG-CE2 3.75Å; K404-F450 HydrophobicContact CG-CG 4.44Å; K404-F450 HydrophobicContact CG-CZ 4.07Å; K404-F450 WeakPolarHBondContact CG-O 3.49Å; I415-F450 HydrophobicContact CB-CE2 4.37Å; I415-F450 HydrophobicContact CB-CZ 3.97Å; I415-F450 HydrophobicContact CG2-CE2 4.13Å; I415-F450 HydrophobicContact CG2-CZ 3.83Å; I415-F450 WeakPolarHBondContact O-CZ 3.38Å; V447-F450 HydrophobicContact CB-CB 4.36Å; V447-F450 HydrophobicContact CB-CD1 3.98Å; V447-F450 HydrophobicContact CB-CG 4.44Å; V447-F450 HydrophobicContact CG2-CB 4.1Å; V447-F450 HydrophobicContact CG2-CD1 3.48Å; V447-F450 VanDerWaalsContact CG2-CD1 3.48Å; V447-F450 HydrophobicContact CG2-CE1 3.96Å; V447-F450 HydrophobicContact CG2-CG 3.81Å; V447-F450 WeakPolarHBondContact O-CD1 3.15Å; V447-F450 WeakPolarHBondContact O-CE1 3.31Å; S448-F450 PolarHBondContact O-N 2.86Å; S448-F450 VanDerWaalsContact O-N 3.13Å; F450-A452 HydrophobicContact CD2-CB 4.28Å; F450-A452 HydrophobicContact CE2-CB 3.9Å; F450-V461 HydrophobicContact CB-CG1 4.45Å; F450-V461 HydrophobicContact CD2-CB 4.32Å; F450-V461 HydrophobicContact CD2-CG1 3.51Å; F450-V461 HydrophobicContact CD2-CG2 4.24Å; F450-V461 HydrophobicContact CE2-CB 4.36Å; F450-V461 HydrophobicContact CE2-CG1 3.79Å; F450-V461 HydrophobicContact CE2-CG2 3.82Å; F450-V461 HydrophobicContact CG-CG1 4.04Å; F450-G463 VanDerWaalsContact CB-O 3.3Å; F450-G463 WeakPolarHBondContact CB-O 3.32Å
451	A	96.3	Very high	94.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.4	172.4	0	0	0	0	0	110.4	V461 I462 I498 A500 V509	A451-V461 WeakPolarHBondContact O-CA 3.44Å; A451-I462 HydrophobicContact CB-CB 4.32Å; A451-I462 PolarHBondContact N-O 2.65Å; A451-I462 PolarHBondContact O-N 3.2Å; A451-I498 HydrophobicContact CB-CB 4.25Å; A451-I498 HydrophobicContact CB-CD1 3.75Å; A451-I498 HydrophobicContact CB-CG1 3.77Å; A451-A500 HydrophobicContact CB-CB 3.71Å; A451-V509 HydrophobicContact CB-CG1 3.99Å
452	A	96.5	Very high	94.9	Very high	11 Å²	11	30.1 Å²	30.1	9%	0.091	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.3	178.4	0	0	0	0	0	111.2	K404 I415 F450 Y460	K404-A452 HydrophobicContact CB-CB 3.54Å; K404-A452 HydrophobicContact CG-CB 4.1Å; I415-A452 HydrophobicContact CD1-CB 4.49Å; F450-A452 HydrophobicContact CD2-CB 4.28Å; F450-A452 HydrophobicContact CE2-CB 3.9Å; A452-Y460 VanDerWaalsContact CA-O 3.24Å; A452-Y460 WeakPolarHBondContact CA-O 3.39Å
453	A	95.4	Very high	94.8	Very high	7 Å²	7	27.1 Å²	27.1	6%	0.058	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	153.3	176.1	0	0	0	0	0	111	Y460 A500 S502 I507	A453-Y460 PolarHBondContact N-O 3.14Å; A453-Y460 VanDerWaalsContact N-O 3.11Å; A453-Y460 PolarHBondContact O-N 2.9Å; A453-A500 HydrophobicContact CB-CB 4.04Å; A453-S502 WeakPolarHBondContact CB-OG 3.43Å; A453-I507 HydrophobicContact CB-CD1 4.37Å; A453-I507 HydrophobicContact CB-CG1 4.46Å; A453-I507 HydrophobicContact CB-CG2 3.74Å
454	S	94.3	Very high	94.8	Very high	15 Å²	15	27 Å²	27	11%	0.105	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.3	173.2	62.7	0	0	0	0	111	E292 V407 K458 S502	E292-S454 WeakPolarHBondContact OE1-CB 3.3Å; E292-S454 PolarHBondContact OE1-OG 3.36Å; V407-S454 WeakPolarHBondContact O-CB 3.29Å; V407-S454 PolarHBondContact O-OG 2.91Å; V407-S454 VanDerWaalsContact O-OG 3.07Å; S454-K458 CarbonylContact C-O 3.57Å; S454-K458 WeakPolarHBondContact CA-O 3.31Å; S454-S502 WeakPolarHBondContact O-CB 3.41Å; S454-S502 PolarHBondContact O-OG 2.87Å
455	Y	92.9	Very high	94.7	Very high	15 Å²	15	22.8 Å²	22.8	6%	0.059	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	129.3	179	178.8	-95.7	0	0	0	110.9	K457 K458 Y460 D505 P522 H523	Y455-K457 VanDerWaalsContact C-N 3.3Å; Y455-K457 PolarHBondContact O-N 2.82Å; Y455-K458 PolarHBondContact N-O 3.13Å; Y455-K458 PolarHBondContact O-N 3.21Å; Y455-Y460 HydrophobicContact CD1-CE2 4.43Å; Y455-D505 WeakPolarHBondContact CE2-O 3.23Å; Y455-D505 PolarHBondContact OH-O 2.88Å; Y455-D505 PolarHBondContact OH-OD1 2.84Å; Y455-P522 HydrophobicContact CD1-CB 3.59Å; Y455-P522 HydrophobicContact CD1-CG 3.46Å; Y455-P522 VanDerWaalsContact CD1-CG 3.46Å; Y455-P522 HydrophobicContact CD2-CG 4.48Å; Y455-P522 HydrophobicContact CE1-CB 3.75Å; Y455-P522 HydrophobicContact CE1-CG 3.73Å; Y455-P522 HydrophobicContact CG-CB 4.44Å; Y455-P522 HydrophobicContact CG-CG 3.86Å; Y455-H523 AromaticContact CZ-NE2 3.95Å; Y455-H523 PolarHBondContact OH-CD2 2.85Å; Y455-H523 PolarHBondContact OH-NE2 3.19Å
456	K	86.6	Confident	94.6	Very high	117 Å²	117	23 Å²	23	51%	0.509	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	38.3	56.5	179.5	-71.5	-174.1	178.9	162.6	0	113.1	K458 D505 H523	K456-K458 VanDerWaalsContact C-N 3.31Å; K456-K458 PolarHBondContact O-N 3.48Å; K456-D505 IonicContact NZ-OD1 2.66Å; K456-D505 PolarHBondContact NZ-OD1 2.82Å; K456-H523 WeakPolarHBondContact CD-NE2 3.06Å; K456-H523 PolarHBondContact NZ-NE2 2.83Å
457	K	89.1	Confident	94.2	Very high	138 Å²	138	24.8 Å²	24.8	60%	0.6	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	24.3	178.4	-51.2	178.6	179.3	179.3	0	115.4	L408 Y455 P480	L408-K457 VanDerWaalsContact CD1-CA 3.47Å; L408-K457 HydrophobicContact CD1-CB 4.4Å; L408-K457 WeakPolarHBondContact CD1-O 3.27Å; Y455-K457 VanDerWaalsContact C-N 3.3Å; Y455-K457 PolarHBondContact O-N 2.82Å; K457-P480 WeakPolarHBondContact O-CD 3.36Å; K457-P480 VanDerWaalsContact O-CG 3.23Å; K457-P480 WeakPolarHBondContact O-CG 3.43Å
458	K	94.8	Very high	93.1	Very high	67 Å²	67	26.6 Å²	26.6	29%	0.291	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	157.1	172.4	-62.2	-168.2	178.9	-156.8	0	110.5	S454 Y455 K456 Y460 Y478 D479	S454-K458 CarbonylContact C-O 3.57Å; S454-K458 WeakPolarHBondContact CA-O 3.31Å; Y455-K458 PolarHBondContact N-O 3.13Å; Y455-K458 PolarHBondContact O-N 3.21Å; K456-K458 VanDerWaalsContact C-N 3.31Å; K456-K458 PolarHBondContact O-N 3.48Å; K458-Y460 HydrophobicContact CB-CE2 3.83Å; K458-Y478 WeakPolarHBondContact CA-O 3.38Å; K458-Y478 WeakPolarHBondContact CB-O 3.48Å; K458-D479 WeakPolarHBondContact CE-OD2 3.18Å; K458-D479 IonicContact NZ-OD2 2.94Å; K458-D479 PolarHBondContact NZ-OD2 2.77Å
459	L	96.8	Very high	92.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.5	172.2	-57.1	174.3	0	0	0	110.1	A406 L408 Y413 I415 M427 C477 Y478	A406-L459 HydrophobicContact CB-CD2 3.55Å; L408-L459 HydrophobicContact CB-CD1 4.48Å; L408-L459 HydrophobicContact CB-CD2 3.84Å; L408-L459 HydrophobicContact CB-CG 4.24Å; L408-L459 HydrophobicContact CD2-CD1 4.19Å; L408-L459 HydrophobicContact CD2-CD2 4.39Å; L408-L459 HydrophobicContact CD2-CG 3.92Å; L408-L459 HydrophobicContact CG-CD2 4.49Å; Y413-L459 HydrophobicContact CD1-CD1 3.95Å; Y413-L459 HydrophobicContact CD2-CD1 4.13Å; Y413-L459 HydrophobicContact CG-CD1 3.71Å; I415-L459 HydrophobicContact CD1-CD1 4.15Å; M427-L459 HydrophobicContact SD-CD1 4.24Å; L459-C477 CarbonylContact O-C 3.47Å; L459-C477 VanDerWaalsContact O-CA 3.3Å; L459-C477 WeakPolarHBondContact O-CA 3.5Å; L459-Y478 HydrophobicContact CB-CD1 4.39Å; L459-Y478 HydrophobicContact CD1-CD1 3.93Å; L459-Y478 HydrophobicContact CG-CD1 4.19Å; L459-Y478 PolarHBondContact N-O 2.89Å; L459-Y478 PolarHBondContact O-N 2.94Å
460	Y	97.3	Very high	92	Very high	11 Å²	11	39.9 Å²	39.9	4%	0.043	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.9	177.2	-65.6	-98.2	0	0	0	109.1	A452 A453 Y455 K458 T475 Q476 C477 I507 Y520 P522	A452-Y460 VanDerWaalsContact CA-O 3.24Å; A452-Y460 WeakPolarHBondContact CA-O 3.39Å; A453-Y460 PolarHBondContact N-O 3.14Å; A453-Y460 VanDerWaalsContact N-O 3.11Å; A453-Y460 PolarHBondContact O-N 2.9Å; Y455-Y460 HydrophobicContact CD1-CE2 4.43Å; K458-Y460 HydrophobicContact CB-CE2 3.83Å; Y460-T475 HydrophobicContact CD1-CG2 4.43Å; Y460-Q476 CarbonylContact C-O 3.57Å; Y460-Q476 WeakPolarHBondContact CA-O 3.47Å; Y460-C477 HydrophobicContact CD1-CB 4.05Å; Y460-C477 HydrophobicContact CE1-CB 3.84Å; Y460-C477 VanDerWaalsContact CE1-SG 3.6Å; Y460-I507 HydrophobicContact CD1-CD1 4.13Å; Y460-I507 HydrophobicContact CD2-CD1 3.43Å; Y460-I507 VanDerWaalsContact CD2-CD1 3.43Å; Y460-I507 HydrophobicContact CE2-CD1 4.07Å; Y460-I507 HydrophobicContact CG-CD1 3.48Å; Y460-I507 VanDerWaalsContact CG-CD1 3.48Å; Y460-Y520 AromaticContact CD1-CE1 3.84Å; Y460-Y520 HydrophobicContact CD1-CE1 3.84Å; Y460-Y520 AromaticContact CE1-CE1 3.78Å; Y460-Y520 HydrophobicContact CE1-CE1 3.78Å; Y460-P522 HydrophobicContact CE1-CB 4.04Å; Y460-P522 HydrophobicContact CE2-CB 4.42Å; Y460-P522 WeakPolarHBondContact OH-CB 3.41Å
461	V	97.8	Very high	91.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.1	175.3	167.1	0	0	0	0	108	I415 L443 V447 F450 A451 T475 Q476 W485	I415-V461 HydrophobicContact CD1-CG2 4.41Å; I415-V461 HydrophobicContact CG2-CG2 3.86Å; L443-V461 HydrophobicContact CD2-CB 3.98Å; L443-V461 HydrophobicContact CD2-CG1 3.83Å; L443-V461 HydrophobicContact CD2-CG2 3.86Å; V447-V461 HydrophobicContact CG2-CG1 3.92Å; F450-V461 HydrophobicContact CB-CG1 4.45Å; F450-V461 HydrophobicContact CD2-CB 4.32Å; F450-V461 HydrophobicContact CD2-CG1 3.51Å; F450-V461 HydrophobicContact CD2-CG2 4.24Å; F450-V461 HydrophobicContact CE2-CB 4.36Å; F450-V461 HydrophobicContact CE2-CG1 3.79Å; F450-V461 HydrophobicContact CE2-CG2 3.82Å; F450-V461 HydrophobicContact CG-CG1 4.04Å; A451-V461 WeakPolarHBondContact O-CA 3.44Å; V461-T475 CarbonylContact O-C 3.46Å; V461-T475 WeakPolarHBondContact O-CA 3.28Å; V461-Q476 HydrophobicContact CB-CB 4.3Å; V461-Q476 PolarHBondContact N-O 2.92Å; V461-Q476 PolarHBondContact O-N 3.4Å; V461-W485 HydrophobicContact CB-CH2 4.36Å; V461-W485 HydrophobicContact CB-CZ3 4.15Å; V461-W485 HydrophobicContact CG2-CH2 3.67Å; V461-W485 HydrophobicContact CG2-CZ3 3.94Å
462	I	97.4	Very high	91.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.7	-167.1	-61.2	162.6	0	0	0	108.3	A451 T475 M491 I498 I507 V509 W527	A451-I462 HydrophobicContact CB-CB 4.32Å; A451-I462 PolarHBondContact N-O 2.65Å; A451-I462 PolarHBondContact O-N 3.2Å; I462-T475 HydrophobicContact CG1-CG2 3.89Å; I462-M491 HydrophobicContact CG2-CB 4.34Å; I462-M491 HydrophobicContact CG2-CE 4.43Å; I462-M491 HydrophobicContact CG2-SD 3.65Å; I462-I498 VanDerWaalsContact O-CD1 3.32Å; I462-I498 WeakPolarHBondContact O-CD1 3.42Å; I462-I507 HydrophobicContact CD1-CG2 3.96Å; I462-V509 HydrophobicContact CD1-CG2 3.75Å; I462-V509 HydrophobicContact CG2-CG1 4.48Å; I462-V509 HydrophobicContact CG2-CG2 4.42Å; I462-W527 HydrophobicContact CD1-CH2 4.04Å; I462-W527 HydrophobicContact CD1-CZ2 4.46Å; I462-W527 HydrophobicContact CG1-CH2 4.45Å; I462-W527 HydrophobicContact CG2-CH2 3.69Å; I462-W527 HydrophobicContact CG2-CZ2 4Å
463	G	95.8	Very high	91.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	23%	0.226	C	C	.	.			trans	62.6	-145.4	173.2	0	0	0	0	0	114.7	F450 T472 K474	F450-G463 VanDerWaalsContact CB-O 3.3Å; F450-G463 WeakPolarHBondContact CB-O 3.32Å; G463-T472 WeakPolarHBondContact CA-O 3.29Å; G463-K474 PolarHBondContact N-O 3.42Å
464	G	94.9	Very high	91.7	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.			trans	99	-172.9	-177.7	0	0	0	0	0	114.1	S448 A471 T472 A495	S448-G464 WeakPolarHBondContact O-CA 3.45Å; G464-A471 CarbonylContact O-C 3.53Å; G464-A471 VanDerWaalsContact O-CA 3.31Å; G464-A471 WeakPolarHBondContact O-CA 3.43Å; G464-T472 PolarHBondContact O-N 3.44Å; G464-A495 WeakPolarHBondContact CA-O 3.5Å; G464-A495 PolarHBondContact N-O 2.9Å
465	G	93.9	Very high	91.9	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.021	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-111.2	113.7	-178.6	0	0	0	0	0	112.6	S448 L470	S448-G465 PolarHBondContact N-O 2.92Å; S448-G465 PolarHBondContact O-N 3.44Å; G465-L470 WeakPolarHBondContact CA-O 3.39Å
466	P	91.6	Very high	92.1	Very high	28 Å²	28	46.7 Å²	46.7	18%	0.182	23%	0.234	C	C	.	.	S	Bend	trans	-80.5	-29.1	-179.6	29.6	-34.6	0	0	0	114.2	V445 N446 L470	V445-P466 HydrophobicContact CG1-CB 4.3Å; N446-P466 VanDerWaalsContact O-CA 3.31Å; N446-P466 WeakPolarHBondContact O-CA 3.25Å; P466-L470 WeakPolarHBondContact CD-O 3.47Å
467	N	84.6	Confident	92.6	Very high	99 Å²	99	41.1 Å²	41.1	53%	0.529	21%	0.21	S	C	.	.	S	Bend	trans	-141	24.7	-174.6	63.4	11.6	0	0	0	113.7	K469 L470	N467-K469 PolarHBondContact O-N 2.87Å; N467-L470 PolarHBondContact OD1-N 3.35Å
468	G	72.8	Confident	93	Very high	38 Å²	38	35 Å²	35	39%	0.392	18%	0.183	S	C	.	.	S	Bend	trans	76.7	-30.9	175.5	0	0	0	0	0	115.7	K496	G468-K496 PolarHBondContact O-NZ 3.02Å
469	K	78.8	Confident	93	Very high	188 Å²	188	33.2 Å²	33.2	82%	0.817	18%	0.177	S	C	*	.	S	Bend	trans	-90.2	-50.5	179.4	-65.9	-177.3	-179	179.3	0	112.3	N467	N467-K469 PolarHBondContact O-N 2.87Å
470	L	88.1	Confident	92.8	Very high	101 Å²	101	35.3 Å²	35.3	53%	0.529	19%	0.191	S	C	.	.			trans	-91.3	155.7	-175.9	-60.3	173.9	0	0	0	111.3	G465 P466 N467	G465-L470 WeakPolarHBondContact CA-O 3.39Å; P466-L470 WeakPolarHBondContact CD-O 3.47Å; N467-L470 PolarHBondContact OD1-N 3.35Å
471	A	92.8	Very high	92.6	Very high	20 Å²	20	40.5 Å²	40.5	17%	0.165	22%	0.224	C	C	.	.			trans	-95.2	170.4	159.7	0	0	0	0	0	109.1	G464 E494	G464-A471 CarbonylContact O-C 3.53Å; G464-A471 VanDerWaalsContact O-CA 3.31Å; G464-A471 WeakPolarHBondContact O-CA 3.43Å; A471-E494 HydrophobicContact CB-CB 3.95Å; A471-E494 HydrophobicContact CB-CG 4.24Å
472	T	94.4	Very high	92.4	Very high	15 Å²	15	44.4 Å²	44.4	9%	0.092	25%	0.248	C	C	.	.			trans	-128.9	153.7	167.8	-173	0	0	0	0	109.3	V447 G463 G464 K474	V447-T472 HydrophobicContact CG1-CG2 4.05Å; G463-T472 WeakPolarHBondContact CA-O 3.29Å; G464-T472 PolarHBondContact O-N 3.44Å; T472-K474 WeakPolarHBondContact OG1-CG 3.44Å; T472-K474 PolarHBondContact OG1-N 2.88Å
473	D	95	Very high	92.2	Very high	64 Å²	64	48.2 Å²	48.2	34%	0.342	27%	0.268	S	S	.	.			trans	-97.7	-4	172.9	61.1	-15.8	0	0	0	112.6	T475 A490 M491 E494	D473-T475 PolarHBondContact O-N 3.09Å; D473-A490 HydrophobicContact CB-CB 4.27Å; D473-A490 CarbonylContact O-C 3.59Å; D473-A490 WeakPolarHBondContact O-CA 3.38Å; D473-M491 WeakPolarHBondContact CB-O 3.17Å; D473-M491 PolarHBondContact O-N 3.5Å; D473-E494 HydrophobicContact CB-CB 4.34Å
474	K	96.7	Very high	92.2	Very high	89 Å²	89	51.8 Å²	51.8	39%	0.387	29%	0.29	S	S	.	.			trans	-65.2	134.3	-172.7	-70.5	179.2	178.9	-177	0	111.9	V445 G463 T472 L487	V445-K474 HydrophobicContact CG2-CD 3.85Å; G463-K474 PolarHBondContact N-O 3.42Å; T472-K474 WeakPolarHBondContact OG1-CG 3.44Å; T472-K474 PolarHBondContact OG1-N 2.88Å; K474-L487 HydrophobicContact CB-CD2 4.43Å; K474-L487 HydrophobicContact CD-CD2 4.47Å
475	T	97.4	Very high	92.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.7	169.4	-54.6	0	0	0	0	109.1	Y460 V461 I462 D473 K488 A489 Y520	Y460-T475 HydrophobicContact CD1-CG2 4.43Å; V461-T475 CarbonylContact O-C 3.46Å; V461-T475 WeakPolarHBondContact O-CA 3.28Å; I462-T475 HydrophobicContact CG1-CG2 3.89Å; D473-T475 PolarHBondContact O-N 3.09Å; T475-K488 HydrophobicContact CG2-CB 3.78Å; T475-K488 PolarHBondContact O-N 3.03Å; T475-A489 WeakPolarHBondContact CB-O 3.02Å; T475-A489 PolarHBondContact OG1-O 2.74Å; T475-Y520 HydrophobicContact CG2-CE1 4.5Å
476	Q	97.4	Very high	92.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.1	179.7	-54.8	-179.9	77.4	0	0	109	M444 V445 Y460 V461 W485 S486 L487	M444-Q476 HydrophobicContact CE-CB 4.32Å; M444-Q476 HydrophobicContact CE-CG 3.99Å; V445-Q476 PolarHBondContact O-NE2 3.39Å; V445-Q476 VanDerWaalsContact O-NE2 3.16Å; Y460-Q476 CarbonylContact C-O 3.57Å; Y460-Q476 WeakPolarHBondContact CA-O 3.47Å; V461-Q476 HydrophobicContact CB-CB 4.3Å; V461-Q476 PolarHBondContact N-O 2.92Å; V461-Q476 PolarHBondContact O-N 3.4Å; Q476-W485 HydrophobicContact CB-CE3 3.7Å; Q476-W485 HydrophobicContact CB-CZ3 3.96Å; Q476-S486 CarbonylContact C-O 3.56Å; Q476-S486 WeakPolarHBondContact CA-O 3.35Å; Q476-L487 HydrophobicContact CG-CD2 4.25Å
477	C	97.4	Very high	92.8	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.007	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123	179.5	178.8	0	0	0	0	110.5	L459 Y460 W485 S486 K488	L459-C477 CarbonylContact O-C 3.47Å; L459-C477 VanDerWaalsContact O-CA 3.3Å; L459-C477 WeakPolarHBondContact O-CA 3.5Å; Y460-C477 HydrophobicContact CD1-CB 4.05Å; Y460-C477 HydrophobicContact CE1-CB 3.84Å; Y460-C477 VanDerWaalsContact CE1-SG 3.6Å; C477-W485 VanDerWaalsContact C-CE3 3.45Å; C477-W485 CarbonylContact O-C 3.29Å; C477-W485 VanDerWaalsContact O-CA 3.32Å; C477-W485 WeakPolarHBondContact O-CA 3.41Å; C477-S486 PolarHBondContact N-O 3.05Å; C477-S486 PolarHBondContact O-N 2.98Å; C477-S486 PolarHBondContact O-OG 2.88Å; C477-K488 HydrophobicContact CB-CD 4.43Å; C477-K488 HydrophobicContact CB-CG 3.67Å
478	Y	97.5	Very high	93.4	Very high	8 Å²	8	57.2 Å²	57.2	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.4	175.5	176.5	-114.5	0	0	0	110.6	L408 Y413 M427 A441 K458 L459 P480 N483 W485	L408-Y478 HydrophobicContact CD2-CD1 4.26Å; L408-Y478 HydrophobicContact CD2-CE1 4.18Å; Y413-Y478 HydrophobicContact CE1-CE1 4.15Å; M427-Y478 HydrophobicContact CE-CD1 3.97Å; M427-Y478 HydrophobicContact CE-CD2 3.88Å; M427-Y478 HydrophobicContact CE-CE1 3.78Å; M427-Y478 HydrophobicContact CE-CE2 3.69Å; M427-Y478 HydrophobicContact CE-CG 4.02Å; A441-Y478 HydrophobicContact CB-CE2 4.05Å; K458-Y478 WeakPolarHBondContact CA-O 3.38Å; K458-Y478 WeakPolarHBondContact CB-O 3.48Å; L459-Y478 HydrophobicContact CB-CD1 4.39Å; L459-Y478 HydrophobicContact CD1-CD1 3.93Å; L459-Y478 HydrophobicContact CG-CD1 4.19Å; L459-Y478 PolarHBondContact N-O 2.89Å; L459-Y478 PolarHBondContact O-N 2.94Å; Y478-P480 HydrophobicContact CE1-CB 3.9Å; Y478-N483 WeakPolarHBondContact CE2-OD1 3.37Å; Y478-N483 PolarHBondContact OH-OD1 2.74Å; Y478-W485 AromaticContact CD2-CD1 3.99Å; Y478-W485 HydrophobicContact CD2-CD2 4.18Å; Y478-W485 AromaticContact CD2-CE2 3.8Å; Y478-W485 HydrophobicContact CD2-CG 4.32Å; Y478-W485 HydrophobicContact CD2-CZ2 4.28Å; Y478-W485 AromaticContact CD2-NE1 3.65Å; Y478-W485 HydrophobicContact CG-CD2 4.39Å; Y478-W485 HydrophobicContact CG-CH2 4.48Å; Y478-W485 HydrophobicContact CG-CZ2 4.09Å; Y478-W485 VanDerWaalsContact N-CE3 3.35Å
479	D	94.9	Very high	94.6	Very high	30 Å²	30	56.9 Å²	56.9	16%	0.16	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	113.1	170.3	-164.7	-35.9	0	0	0	109.7	K458 T481 N483 T484	K458-D479 WeakPolarHBondContact CE-OD2 3.18Å; K458-D479 IonicContact NZ-OD2 2.94Å; K458-D479 PolarHBondContact NZ-OD2 2.77Å; D479-T481 PolarHBondContact O-N 3.46Å; D479-T481 WeakPolarHBondContact OD1-CB 3.39Å; D479-T481 PolarHBondContact OD1-N 2.8Å; D479-T481 PolarHBondContact OD1-OG1 2.91Å; D479-N483 WeakPolarHBondContact O-CA 3.32Å; D479-N483 PolarHBondContact O-N 2.91Å; D479-T484 PolarHBondContact N-O 3.25Å; D479-T484 PolarHBondContact O-N 2.76Å
480	P	92.4	Very high	95.4	Very high	45 Å²	45	50.3 Å²	50.3	29%	0.292	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.4	-179.7	30.9	-38	0	0	0	113.1	L408 K457 Y478	L408-P480 HydrophobicContact CD2-CB 3.73Å; L408-P480 HydrophobicContact CD2-CG 3.71Å; L408-P480 HydrophobicContact CG-CG 4.49Å; K457-P480 WeakPolarHBondContact O-CD 3.36Å; K457-P480 VanDerWaalsContact O-CG 3.23Å; K457-P480 WeakPolarHBondContact O-CG 3.43Å; Y478-P480 HydrophobicContact CE1-CB 3.9Å
481	T	92.8	Very high	95.7	Very high	120 Å²	120	45.7 Å²	45.7	74%	0.736	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-36.1	-178.6	64.4	0	0	0	0	111.9	D479	D479-T481 PolarHBondContact O-N 3.46Å; D479-T481 WeakPolarHBondContact OD1-CB 3.39Å; D479-T481 PolarHBondContact OD1-N 2.8Å; D479-T481 PolarHBondContact OD1-OG1 2.91Å
482	T	93.4	Very high	95.7	Very high	82 Å²	82	48.3 Å²	48.3	50%	0.503	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-11.1	176.4	59	0	0	0	0	112.5	T484	T482-T484 VanDerWaalsContact C-N 3.3Å; T482-T484 PolarHBondContact O-N 2.82Å; T482-T484 PolarHBondContact OG1-OG1 3.02Å
483	N	94.1	Very high	95.6	Very high	80 Å²	80	50.4 Å²	50.4	43%	0.428	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	46.4	-172.4	-170.1	31.6	0	0	0	111.5	A441 Y478 D479	A441-N483 WeakPolarHBondContact CB-O 3.49Å; A441-N483 VanDerWaalsContact CB-OD1 3.25Å; A441-N483 WeakPolarHBondContact CB-OD1 3.33Å; A441-N483 PolarHBondContact N-OD1 3.33Å; A441-N483 VanDerWaalsContact N-OD1 3.13Å; Y478-N483 WeakPolarHBondContact CE2-OD1 3.37Å; Y478-N483 PolarHBondContact OH-OD1 2.74Å; D479-N483 WeakPolarHBondContact O-CA 3.32Å; D479-N483 PolarHBondContact O-N 2.91Å
484	T	96.2	Very high	95.5	Very high	75 Å²	75	53 Å²	53	46%	0.46	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	152.6	-178.3	57.9	0	0	0	0	112.3	D479 T482	D479-T484 PolarHBondContact N-O 3.25Å; D479-T484 PolarHBondContact O-N 2.76Å; T482-T484 VanDerWaalsContact C-N 3.3Å; T482-T484 PolarHBondContact O-N 2.82Å; T482-T484 PolarHBondContact OG1-OG1 3.02Å
485	W	97.6	Very high	95.4	Very high	24 Å²	24	49 Å²	49	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	149.3	171.9	-69.7	90	0	0	0	111.8	M427 A441 P442 L443 M444 V461 Q476 C477 Y478	M427-W485 HydrophobicContact CE-CZ2 4Å; M427-W485 HydrophobicContact SD-CZ2 3.7Å; A441-W485 PolarHBondContact O-NE1 3.42Å; P442-W485 PolarHBondContact O-NE1 3.15Å; L443-W485 HydrophobicContact CD2-CE3 4.43Å; L443-W485 HydrophobicContact CD2-CH2 3.69Å; L443-W485 HydrophobicContact CD2-CZ2 3.77Å; L443-W485 HydrophobicContact CD2-CZ3 4.04Å; L443-W485 HydrophobicContact CG-CH2 4.49Å; L443-W485 HydrophobicContact CG-CZ2 4.07Å; M444-W485 HydrophobicContact CE-CB 4.39Å; M444-W485 HydrophobicContact CG-CB 3.76Å; M444-W485 HydrophobicContact SD-CB 4.17Å; V461-W485 HydrophobicContact CB-CH2 4.36Å; V461-W485 HydrophobicContact CB-CZ3 4.15Å; V461-W485 HydrophobicContact CG2-CH2 3.67Å; V461-W485 HydrophobicContact CG2-CZ3 3.94Å; Q476-W485 HydrophobicContact CB-CE3 3.7Å; Q476-W485 HydrophobicContact CB-CZ3 3.96Å; C477-W485 VanDerWaalsContact C-CE3 3.45Å; C477-W485 CarbonylContact O-C 3.29Å; C477-W485 VanDerWaalsContact O-CA 3.32Å; C477-W485 WeakPolarHBondContact O-CA 3.41Å; Y478-W485 AromaticContact CD2-CD1 3.99Å; Y478-W485 HydrophobicContact CD2-CD2 4.18Å; Y478-W485 AromaticContact CD2-CE2 3.8Å; Y478-W485 HydrophobicContact CD2-CG 4.32Å; Y478-W485 HydrophobicContact CD2-CZ2 4.28Å; Y478-W485 AromaticContact CD2-NE1 3.65Å; Y478-W485 HydrophobicContact CG-CD2 4.39Å; Y478-W485 HydrophobicContact CG-CH2 4.48Å; Y478-W485 HydrophobicContact CG-CZ2 4.09Å; Y478-W485 VanDerWaalsContact N-CE3 3.35Å
486	S	97	Very high	95.2	Very high	50 Å²	50	53.1 Å²	53.1	35%	0.35	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.6	175.3	58.7	0	0	0	0	110.8	Q476 C477	Q476-S486 CarbonylContact C-O 3.56Å; Q476-S486 WeakPolarHBondContact CA-O 3.35Å; C477-S486 PolarHBondContact N-O 3.05Å; C477-S486 PolarHBondContact O-N 2.98Å; C477-S486 PolarHBondContact O-OG 2.88Å
487	L	97.5	Very high	94.9	Very high	102 Å²	102	54.5 Å²	54.5	53%	0.534	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	144.3	173.6	-72.2	175.8	0	0	0	110.3	M444 K474 Q476	M444-L487 HydrophobicContact CE-CB 4.29Å; M444-L487 HydrophobicContact CE-CD2 3.33Å; M444-L487 HydrophobicContact CE-CG 3.4Å; M444-L487 VanDerWaalsContact CE-CG 3.4Å; M444-L487 HydrophobicContact SD-CG 4.37Å; K474-L487 HydrophobicContact CB-CD2 4.43Å; K474-L487 HydrophobicContact CD-CD2 4.47Å; Q476-L487 HydrophobicContact CG-CD2 4.25Å
488	K	97.5	Very high	94.8	Very high	67 Å²	67	54.4 Å²	54.4	29%	0.291	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	177.4	176.8	-68.8	-61.2	-177.7	176.5	0	110.5	T475 C477 A490 Y520 D525	T475-K488 HydrophobicContact CG2-CB 3.78Å; T475-K488 PolarHBondContact O-N 3.03Å; C477-K488 HydrophobicContact CB-CD 4.43Å; C477-K488 HydrophobicContact CB-CG 3.67Å; K488-A490 PolarHBondContact O-N 2.94Å; K488-Y520 WeakPolarHBondContact CB-OH 3.31Å; K488-D525 WeakPolarHBondContact CB-OD1 3.3Å
489	A	96.8	Very high	94.7	Very high	31 Å²	31	55.5 Å²	55.5	26%	0.256	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-52	130.1	177.5	0	0	0	0	0	111.3	T475 Y520 D525 W527	T475-A489 WeakPolarHBondContact CB-O 3.02Å; T475-A489 PolarHBondContact OG1-O 2.74Å; A489-Y520 HydrophobicContact CB-CE2 4.34Å; A489-D525 WeakPolarHBondContact CB-O 3.38Å; A489-D525 VanDerWaalsContact CB-OD1 3.29Å; A489-D525 WeakPolarHBondContact CB-OD1 3.4Å; A489-D525 PolarHBondContact N-OD1 2.95Å; A489-D525 PolarHBondContact N-OD2 3.45Å; A489-W527 PolarHBondContact O-NE1 2.83Å
490	A	96.2	Very high	94.7	Very high	50 Å²	50	54.9 Å²	54.9	41%	0.413	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-67.4	142.9	-179	0	0	0	0	0	110.8	D473 K488 W527	D473-A490 HydrophobicContact CB-CB 4.27Å; D473-A490 CarbonylContact O-C 3.59Å; D473-A490 WeakPolarHBondContact O-CA 3.38Å; K488-A490 PolarHBondContact O-N 2.94Å; A490-W527 PolarHBondContact O-NE1 2.75Å
491	M	94.3	Very high	94.8	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.02	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-62.8	142	175.5	-176.2	168.8	69.4	0	0	110.1	I462 D473 V493 A495 I498 V509 M514 W527	I462-M491 HydrophobicContact CG2-CB 4.34Å; I462-M491 HydrophobicContact CG2-CE 4.43Å; I462-M491 HydrophobicContact CG2-SD 3.65Å; D473-M491 WeakPolarHBondContact CB-O 3.17Å; D473-M491 PolarHBondContact O-N 3.5Å; M491-V493 WeakPolarHBondContact CE-O 3.44Å; M491-V493 PolarHBondContact O-N 2.95Å; M491-V493 VanDerWaalsContact O-N 3.12Å; M491-A495 HydrophobicContact CE-CB 3.83Å; M491-I498 HydrophobicContact CE-CD1 3.96Å; M491-I498 HydrophobicContact SD-CD1 4.4Å; M491-V509 HydrophobicContact SD-CG1 4.18Å; M491-M514 HydrophobicContact CE-SD 4.05Å; M491-M514 HydrophobicContact SD-CE 4.49Å; M491-M514 HydrophobicContact SD-SD 4.04Å; M491-W527 HydrophobicContact CB-CH2 4.07Å; M491-W527 HydrophobicContact CB-CZ2 3.79Å; M491-W527 HydrophobicContact CG-CE3 4.46Å; M491-W527 HydrophobicContact CG-CH2 3.91Å; M491-W527 HydrophobicContact CG-CZ2 4.14Å; M491-W527 HydrophobicContact CG-CZ3 4.08Å; M491-W527 HydrophobicContact SD-CH2 4.14Å; M491-W527 HydrophobicContact SD-CZ3 4.45Å
492	P	93.5	Very high	94.8	Very high	75 Å²	75	48.4 Å²	48.4	49%	0.487	28%	0.28	S	S	.	.	S	Bend	trans	-61.7	-25.2	-174.5	-26.9	35.8	0	0	0	115.3	Y518 W527	P492-Y518 HydrophobicContact CB-CE1 4.17Å; P492-Y518 HydrophobicContact CG-CD1 4.13Å; P492-Y518 HydrophobicContact CG-CE1 4.05Å; P492-W527 HydrophobicContact CG-CB 3.74Å; P492-W527 HydrophobicContact CG-CG 4.12Å
493	V	92.4	Very high	94.8	Very high	59 Å²	59	44.5 Å²	44.5	36%	0.358	26%	0.256	S	S	.	.	S	Bend	trans	-133	127.1	-178.1	-179.1	0	0	0	0	107.8	M491 A495 M514 Y518	M491-V493 WeakPolarHBondContact CE-O 3.44Å; M491-V493 PolarHBondContact O-N 2.95Å; M491-V493 VanDerWaalsContact O-N 3.12Å; V493-A495 PolarHBondContact O-N 3.3Å; V493-M514 HydrophobicContact CB-SD 4.47Å; V493-M514 HydrophobicContact CG1-CG 4.31Å; V493-Y518 HydrophobicContact CG2-CE2 4.41Å
494	E	93.4	Very high	94.4	Very high	118 Å²	118	45.1 Å²	45.1	55%	0.551	25%	0.253	S	S	*	.			trans	-66.7	130	172.7	58.1	175.5	-160.7	0	0	110.8	A471 D473	A471-E494 HydrophobicContact CB-CB 3.95Å; A471-E494 HydrophobicContact CB-CG 4.24Å; D473-E494 HydrophobicContact CB-CB 4.34Å
495	A	93.3	Very high	94.1	Very high	5 Å²	5	45.5 Å²	45.5	4%	0.041	25%	0.252	C	S	.	.			trans	-149.8	151	-177.3	0	0	0	0	0	113	G464 M491 V493 I498 M514	G464-A495 WeakPolarHBondContact CA-O 3.5Å; G464-A495 PolarHBondContact N-O 2.9Å; M491-A495 HydrophobicContact CE-CB 3.83Å; V493-A495 PolarHBondContact O-N 3.3Å; A495-I498 HydrophobicContact CB-CG2 3.64Å; A495-M514 HydrophobicContact CB-CE 4.37Å; A495-M514 HydrophobicContact CB-CG 3.66Å; A495-M514 HydrophobicContact CB-SD 3.71Å
496	K	92.8	Very high	93.9	Very high	87 Å²	87	47.3 Å²	47.3	38%	0.378	26%	0.261	S	S	.	.	S	Bend	trans	-125.3	165.5	168.7	67.7	-176	179.9	-168.9	0	109.2	S449 G468 I498 G512	S449-K496 CarbonylContact O-C 3.57Å; G468-K496 PolarHBondContact O-NZ 3.02Å; K496-I498 VanDerWaalsContact C-N 3.28Å; K496-G512 WeakPolarHBondContact O-CA 3.43Å
497	C	92.6	Very high	93.9	Very high	31 Å²	31	44.9 Å²	44.9	21%	0.209	24%	0.244	C	C	.	.	S	Bend	trans	61.9	38.5	-174.4	-53.4	0	0	0	0	112.5	S449 G512 S539	S449-C497 PolarHBondContact O-N 2.95Å; C497-G512 PolarHBondContact O-N 2.87Å; C497-S539 PolarHBondContact O-N 3.33Å; C497-S539 VanDerWaalsContact O-N 3.1Å
498	I	94.6	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	159.3	179.7	51.6	169.1	0	0	0	110.9	A451 I462 M491 A495 K496 V509 V510 M514	A451-I498 HydrophobicContact CB-CB 4.25Å; A451-I498 HydrophobicContact CB-CD1 3.75Å; A451-I498 HydrophobicContact CB-CG1 3.77Å; I462-I498 VanDerWaalsContact O-CD1 3.32Å; I462-I498 WeakPolarHBondContact O-CD1 3.42Å; M491-I498 HydrophobicContact CE-CD1 3.96Å; M491-I498 HydrophobicContact SD-CD1 4.4Å; A495-I498 HydrophobicContact CB-CG2 3.64Å; K496-I498 VanDerWaalsContact C-N 3.28Å; I498-V509 HydrophobicContact CB-CG1 4.4Å; I498-V509 HydrophobicContact CD1-CG1 4.13Å; I498-V510 CarbonylContact C-O 3.59Å; I498-V510 WeakPolarHBondContact CA-O 3.37Å; I498-M514 HydrophobicContact CB-CE 4.42Å; I498-M514 HydrophobicContact CG2-CE 3.53Å; I498-M514 HydrophobicContact CG2-SD 4.49Å
499	N	95.5	Very high	93.8	Very high	31 Å²	31	37.9 Å²	37.9	17%	0.166	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.1	173.1	-80.8	-54.2	0	0	0	110.5	K404 V509 V510 C540 I542	K404-N499 VanDerWaalsContact CE-OD1 3.26Å; K404-N499 WeakPolarHBondContact CE-OD1 3.46Å; K404-N499 PolarHBondContact NZ-OD1 3.41Å; N499-V509 WeakPolarHBondContact O-CA 3.26Å; N499-V510 PolarHBondContact N-O 2.94Å; N499-V510 PolarHBondContact O-N 2.86Å; N499-C540 PolarHBondContact ND2-O 2.85Å; N499-I542 HydrophobicContact CB-CG2 3.81Å
500	A	95.4	Very high	93.8	Very high	16 Å²	16	36.4 Å²	36.4	13%	0.132	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152.6	176.3	0	0	0	0	0	111.5	A451 A453 I507 Y508 V509	A451-A500 HydrophobicContact CB-CB 3.71Å; A453-A500 HydrophobicContact CB-CB 4.04Å; A500-I507 HydrophobicContact CB-CG2 3.96Å; A500-Y508 CarbonylContact C-O 3.56Å; A500-Y508 WeakPolarHBondContact CA-O 3.28Å; A500-Y508 WeakPolarHBondContact CB-O 3.15Å; A500-V509 HydrophobicContact CB-CG2 4.08Å
501	A	94.2	Very high	93.6	Very high	8 Å²	8	34 Å²	34	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.6	169.4	0	0	0	0	0	109.3	Y508 I542 P544 L549	A501-Y508 PolarHBondContact N-O 3.12Å; A501-Y508 PolarHBondContact O-N 3.2Å; A501-I542 HydrophobicContact CB-CD1 4.28Å; A501-I542 HydrophobicContact CB-CG1 4.05Å; A501-I542 HydrophobicContact CB-CG2 4.01Å; A501-P544 HydrophobicContact CB-CG 4.46Å; A501-L549 HydrophobicContact CB-CD2 4.31Å
502	S	93.3	Very high	93.4	Very high	21 Å²	21	34 Å²	34	15%	0.147	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.8	165.7	-65	0	0	0	0	109	A453 S454	A453-S502 WeakPolarHBondContact CB-OG 3.43Å; S454-S502 WeakPolarHBondContact O-CB 3.41Å; S454-S502 PolarHBondContact O-OG 2.87Å
503	F	91.7	Very high	93.1	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	124	-179	177.2	-110.9	0	0	0	109.6	I294 D505 H506 Y508 P544 N547 L549 P570	I294-F503 HydrophobicContact CB-CD2 4.47Å; I294-F503 HydrophobicContact CG2-CD2 4.25Å; I294-F503 HydrophobicContact CG2-CE2 4.05Å; F503-D505 PolarHBondContact O-N 2.84Å; F503-H506 PolarHBondContact N-O 2.8Å; F503-H506 PolarHBondContact O-N 2.89Å; F503-H506 VanDerWaalsContact O-O 3.05Å; F503-Y508 HydrophobicContact CB-CD2 3.85Å; F503-Y508 HydrophobicContact CB-CE2 3.94Å; F503-Y508 HydrophobicContact CD1-CD2 4.31Å; F503-Y508 AromaticContact CD1-CE2 3.74Å; F503-Y508 HydrophobicContact CD1-CE2 3.74Å; F503-Y508 HydrophobicContact CG-CE2 4.34Å; F503-Y508 WeakPolarHBondContact O-CE2 3.4Å; F503-P544 HydrophobicContact CB-CB 4.26Å; F503-P544 HydrophobicContact CD2-CB 3.62Å; F503-P544 HydrophobicContact CE2-CB 4.42Å; F503-P544 HydrophobicContact CG-CB 4.26Å; F503-N547 VanDerWaalsContact CZ-C 3.49Å; F503-N547 VanDerWaalsContact CZ-O 3.28Å; F503-N547 WeakPolarHBondContact CZ-O 3.48Å; F503-N547 WeakPolarHBondContact CZ-OD1 3.31Å; F503-L549 HydrophobicContact CB-CD1 4.29Å; F503-L549 HydrophobicContact CB-CD2 3.7Å; F503-L549 HydrophobicContact CB-CG 4.14Å; F503-L549 HydrophobicContact CD1-CD1 3.65Å; F503-L549 HydrophobicContact CD1-CD2 4.13Å; F503-L549 HydrophobicContact CD1-CG 3.61Å; F503-L549 HydrophobicContact CD2-CD2 4.37Å; F503-L549 HydrophobicContact CD2-CG 4.45Å; F503-L549 HydrophobicContact CE1-CD1 4.34Å; F503-L549 HydrophobicContact CE1-CG 4.12Å; F503-L549 HydrophobicContact CG-CD1 4.16Å; F503-L549 HydrophobicContact CG-CD2 3.8Å; F503-L549 HydrophobicContact CG-CG 3.8Å; F503-P570 HydrophobicContact CE1-CB 4.28Å; F503-P570 HydrophobicContact CE1-CG 3.86Å; F503-P570 HydrophobicContact CZ-CG 4.05Å
504	R	87.6	Confident	93	Very high	93 Å²	93	31.1 Å²	31.1	35%	0.351	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-128.7	-169.5	-57.3	178.8	175.5	-170.7	-2.9	110.3	N547	R504-N547 PolarHBondContact NE-OD1 2.65Å; R504-N547 VanDerWaalsContact NE-OD1 3.11Å; R504-N547 PolarHBondContact NH2-ND2 3.1Å; R504-N547 PolarHBondContact NH2-OD1 2.66Å
505	D	89.8	Confident	92.9	Very high	82 Å²	82	29.5 Å²	29.5	44%	0.439	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	8.6	-178.6	-77.6	-58.3	0	0	0	115.2	Y455 K456 F503	Y455-D505 WeakPolarHBondContact CE2-O 3.23Å; Y455-D505 PolarHBondContact OH-O 2.88Å; Y455-D505 PolarHBondContact OH-OD1 2.84Å; K456-D505 IonicContact NZ-OD1 2.66Å; K456-D505 PolarHBondContact NZ-OD1 2.82Å; F503-D505 PolarHBondContact O-N 2.84Å
506	H	93.5	Very high	93	Very high	62 Å²	62	29.4 Å²	29.4	29%	0.287	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.6	-172.7	-65.2	70.8	0	0	0	112.4	F503 Y508 Y520	F503-H506 PolarHBondContact N-O 2.8Å; F503-H506 PolarHBondContact O-N 2.89Å; F503-H506 VanDerWaalsContact O-O 3.05Å; H506-Y508 HydrophobicContact CB-CD2 4.27Å; H506-Y508 HydrophobicContact CB-CE2 3.71Å; H506-Y520 WeakPolarHBondContact CA-O 3.45Å
507	I	96.6	Very high	93.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.2	169.5	-59	176.8	0	0	0	107.9	A453 Y460 I462 A500 V509 S519 Y520 P522	A453-I507 HydrophobicContact CB-CD1 4.37Å; A453-I507 HydrophobicContact CB-CG1 4.46Å; A453-I507 HydrophobicContact CB-CG2 3.74Å; Y460-I507 HydrophobicContact CD1-CD1 4.13Å; Y460-I507 HydrophobicContact CD2-CD1 3.43Å; Y460-I507 VanDerWaalsContact CD2-CD1 3.43Å; Y460-I507 HydrophobicContact CE2-CD1 4.07Å; Y460-I507 HydrophobicContact CG-CD1 3.48Å; Y460-I507 VanDerWaalsContact CG-CD1 3.48Å; I462-I507 HydrophobicContact CD1-CG2 3.96Å; A500-I507 HydrophobicContact CB-CG2 3.96Å; I507-V509 HydrophobicContact CG2-CG2 4.32Å; I507-S519 CarbonylContact O-C 3.5Å; I507-S519 WeakPolarHBondContact O-CA 3.5Å; I507-Y520 HydrophobicContact CD1-CD1 4.28Å; I507-Y520 PolarHBondContact N-O 2.98Å; I507-Y520 PolarHBondContact O-N 2.78Å; I507-P522 HydrophobicContact CD1-CG 3.93Å; I507-P522 HydrophobicContact CG1-CG 4.06Å
508	Y	96.4	Very high	93.3	Very high	21 Å²	21	25.3 Å²	25.3	8%	0.082	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.2	179.8	-69.7	-98.8	0	0	0	110.1	A500 A501 F503 H506 L517 Y518 V530 L549	A500-Y508 CarbonylContact C-O 3.56Å; A500-Y508 WeakPolarHBondContact CA-O 3.28Å; A500-Y508 WeakPolarHBondContact CB-O 3.15Å; A501-Y508 PolarHBondContact N-O 3.12Å; A501-Y508 PolarHBondContact O-N 3.2Å; F503-Y508 HydrophobicContact CB-CD2 3.85Å; F503-Y508 HydrophobicContact CB-CE2 3.94Å; F503-Y508 HydrophobicContact CD1-CD2 4.31Å; F503-Y508 AromaticContact CD1-CE2 3.74Å; F503-Y508 HydrophobicContact CD1-CE2 3.74Å; F503-Y508 HydrophobicContact CG-CE2 4.34Å; F503-Y508 WeakPolarHBondContact O-CE2 3.4Å; H506-Y508 HydrophobicContact CB-CD2 4.27Å; H506-Y508 HydrophobicContact CB-CE2 3.71Å; Y508-L517 HydrophobicContact CD1-CD1 4.32Å; Y508-L517 HydrophobicContact CD1-CD2 4.12Å; Y508-L517 HydrophobicContact CD1-CG 4.18Å; Y508-Y518 CarbonylContact C-O 3.56Å; Y508-Y518 VanDerWaalsContact CA-O 3.31Å; Y508-Y518 WeakPolarHBondContact CA-O 3.48Å; Y508-V530 HydrophobicContact CD1-CG2 4.1Å; Y508-V530 HydrophobicContact CE1-CG1 4.42Å; Y508-V530 HydrophobicContact CE1-CG2 3.83Å; Y508-L549 HydrophobicContact CD1-CD1 3.49Å; Y508-L549 VanDerWaalsContact CD1-CD1 3.49Å; Y508-L549 HydrophobicContact CD2-CD1 3.6Å; Y508-L549 HydrophobicContact CE1-CD1 3.8Å; Y508-L549 HydrophobicContact CE2-CD1 3.9Å; Y508-L549 HydrophobicContact CG-CD1 3.37Å
509	V	96.8	Very high	93.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.7	-175.7	-169	0	0	0	0	110.1	A451 I462 M491 I498 N499 A500 I507 M514 Y518 W527	A451-V509 HydrophobicContact CB-CG1 3.99Å; I462-V509 HydrophobicContact CD1-CG2 3.75Å; I462-V509 HydrophobicContact CG2-CG1 4.48Å; I462-V509 HydrophobicContact CG2-CG2 4.42Å; M491-V509 HydrophobicContact SD-CG1 4.18Å; I498-V509 HydrophobicContact CB-CG1 4.4Å; I498-V509 HydrophobicContact CD1-CG1 4.13Å; N499-V509 WeakPolarHBondContact O-CA 3.26Å; A500-V509 HydrophobicContact CB-CG2 4.08Å; I507-V509 HydrophobicContact CG2-CG2 4.32Å; V509-M514 HydrophobicContact CG1-CE 4.11Å; V509-Y518 PolarHBondContact N-O 3.19Å; V509-Y518 PolarHBondContact O-N 3.1Å; V509-W527 HydrophobicContact CB-CZ3 4.33Å; V509-W527 HydrophobicContact CG2-CH2 3.83Å; V509-W527 HydrophobicContact CG2-CZ3 3.88Å
510	V	95.8	Very high	93.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157.7	-178	68	0	0	0	0	111.8	I498 N499 L517 F533 I542 I551	I498-V510 CarbonylContact C-O 3.59Å; I498-V510 WeakPolarHBondContact CA-O 3.37Å; N499-V510 PolarHBondContact N-O 2.94Å; N499-V510 PolarHBondContact O-N 2.86Å; V510-L517 HydrophobicContact CB-CD1 3.93Å; V510-F533 HydrophobicContact CG2-CE2 3.54Å; V510-F533 HydrophobicContact CG2-CZ 3.9Å; V510-I542 HydrophobicContact CB-CD1 4.5Å; V510-I542 HydrophobicContact CG1-CB 3.69Å; V510-I542 HydrophobicContact CG1-CD1 3.74Å; V510-I542 HydrophobicContact CG1-CG1 4.19Å; V510-I542 HydrophobicContact CG1-CG2 4.06Å; V510-I551 HydrophobicContact CG1-CG1 4.42Å; V510-I551 HydrophobicContact CG1-CG2 4.49Å; V510-I551 HydrophobicContact CG2-CD1 4.13Å; V510-I551 HydrophobicContact CG2-CG2 4.42Å
511	G	93	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	109.7	-158.5	170.4	0	0	0	0	0	113	M514 R537	G511-M514 VanDerWaalsContact O-CB 3.27Å; G511-M514 WeakPolarHBondContact O-CB 3.26Å; G511-M514 PolarHBondContact O-N 3.2Å; G511-M514 VanDerWaalsContact O-N 3.14Å; G511-R537 VanDerWaalsContact CA-O 3.31Å; G511-R537 WeakPolarHBondContact CA-O 3.44Å
512	G	89.3	Confident	93.6	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.031	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	-147.5	-169.8	0	0	0	0	0	112.4	K496 C497 M514 A538	K496-G512 WeakPolarHBondContact O-CA 3.43Å; C497-G512 PolarHBondContact O-N 2.87Å; G512-M514 PolarHBondContact O-N 3.13Å; G512-A538 WeakPolarHBondContact O-CA 3.41Å; G512-A538 PolarHBondContact O-N 2.79Å
513	A	86.8	Confident	93.5	Very high	68 Å²	68	29 Å²	29	56%	0.562	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	9.2	172.3	0	0	0	0	0	112.8	K515	A513-K515 PolarHBondContact O-N 3.26Å
514	M	90.8	Very high	93.7	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.03	18%	0.179	C	C	.	.			trans	-78.8	120.7	178.5	-54.3	-173.5	-56.7	0	0	109.5	M491 V493 A495 I498 V509 G511 G512 A516 Y518	M491-M514 HydrophobicContact CE-SD 4.05Å; M491-M514 HydrophobicContact SD-CE 4.49Å; M491-M514 HydrophobicContact SD-SD 4.04Å; V493-M514 HydrophobicContact CB-SD 4.47Å; V493-M514 HydrophobicContact CG1-CG 4.31Å; A495-M514 HydrophobicContact CB-CE 4.37Å; A495-M514 HydrophobicContact CB-CG 3.66Å; A495-M514 HydrophobicContact CB-SD 3.71Å; I498-M514 HydrophobicContact CB-CE 4.42Å; I498-M514 HydrophobicContact CG2-CE 3.53Å; I498-M514 HydrophobicContact CG2-SD 4.49Å; V509-M514 HydrophobicContact CG1-CE 4.11Å; G511-M514 VanDerWaalsContact O-CB 3.27Å; G511-M514 WeakPolarHBondContact O-CB 3.26Å; G511-M514 PolarHBondContact O-N 3.2Å; G511-M514 VanDerWaalsContact O-N 3.14Å; G512-M514 PolarHBondContact O-N 3.13Å; M514-A516 PolarHBondContact O-N 3.42Å; M514-Y518 HydrophobicContact SD-CD2 4.13Å; M514-Y518 HydrophobicContact SD-CE2 4.19Å
515	K	92.2	Very high	94.1	Very high	84 Å²	84	34 Å²	34	37%	0.365	18%	0.176	S	C	.	.			trans	-86.2	37.3	172.2	-58.4	-175.7	-176	-163	0	111.5	A513 Q532 F533 E536 E557	A513-K515 PolarHBondContact O-N 3.26Å; K515-Q532 CarbonylContact O-C 3.57Å; K515-Q532 WeakPolarHBondContact O-CA 3.34Å; K515-F533 PolarHBondContact O-N 3.07Å; K515-E536 HydrophobicContact CD-CG 4.35Å; K515-E536 WeakPolarHBondContact CE-OE1 3.46Å; K515-E536 HydrophobicContact CG-CG 3.73Å; K515-E557 WeakPolarHBondContact CE-OE1 3.46Å; K515-E557 IonicContact NZ-OE1 2.64Å; K515-E557 PolarHBondContact NZ-OE1 2.94Å; K515-E557 IonicContact NZ-OE2 2.86Å; K515-E557 PolarHBondContact NZ-OE2 2.98Å
516	A	94.6	Very high	94.4	Very high	4 Å²	4	33 Å²	33	3%	0.033	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	157.1	-173.3	0	0	0	0	0	113.3	M514 Y518 L529 T531 F533	M514-A516 PolarHBondContact O-N 3.42Å; A516-Y518 HydrophobicContact CB-CD2 4.26Å; A516-Y518 HydrophobicContact CB-CE2 3.71Å; A516-L529 HydrophobicContact CB-CD1 3.53Å; A516-T531 VanDerWaalsContact CA-O 3.3Å; A516-T531 WeakPolarHBondContact CA-O 3.39Å; A516-T531 WeakPolarHBondContact CB-O 3.33Å; A516-F533 WeakPolarHBondContact O-CE2 3.45Å
517	L	95.9	Very high	94.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.9	163.9	-177.9	63.1	0	0	0	108.6	Y508 V510 V530 T531 F533 I542 W568	Y508-L517 HydrophobicContact CD1-CD1 4.32Å; Y508-L517 HydrophobicContact CD1-CD2 4.12Å; Y508-L517 HydrophobicContact CD1-CG 4.18Å; V510-L517 HydrophobicContact CB-CD1 3.93Å; L517-V530 HydrophobicContact CB-CB 4.26Å; L517-V530 HydrophobicContact CD2-CB 4.14Å; L517-V530 HydrophobicContact CD2-CG1 3.95Å; L517-V530 HydrophobicContact CG-CB 4.08Å; L517-V530 HydrophobicContact CG-CG1 4.44Å; L517-V530 HydrophobicContact CG-CG2 4.37Å; L517-V530 WeakPolarHBondContact O-CB 3.47Å; L517-V530 PolarHBondContact O-N 3.39Å; L517-T531 HydrophobicContact CB-CG2 3.89Å; L517-T531 HydrophobicContact CD2-CG2 4.35Å; L517-T531 PolarHBondContact N-O 2.86Å; L517-T531 PolarHBondContact O-N 3.49Å; L517-F533 HydrophobicContact CB-CE1 4.47Å; L517-F533 HydrophobicContact CB-CZ 3.82Å; L517-I542 HydrophobicContact CD1-CD1 4.16Å; L517-W568 HydrophobicContact CD2-CB 4.28Å; L517-W568 HydrophobicContact CD2-CD2 4.48Å; L517-W568 HydrophobicContact CD2-CG 4.12Å
518	Y	96.6	Very high	94.6	Very high	31 Å²	31	35.6 Å²	35.6	12%	0.122	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	148.5	173.3	-70	-80	0	0	0	110.5	P492 V493 Y508 V509 M514 A516 L529	P492-Y518 HydrophobicContact CB-CE1 4.17Å; P492-Y518 HydrophobicContact CG-CD1 4.13Å; P492-Y518 HydrophobicContact CG-CE1 4.05Å; V493-Y518 HydrophobicContact CG2-CE2 4.41Å; Y508-Y518 CarbonylContact C-O 3.56Å; Y508-Y518 VanDerWaalsContact CA-O 3.31Å; Y508-Y518 WeakPolarHBondContact CA-O 3.48Å; V509-Y518 PolarHBondContact N-O 3.19Å; V509-Y518 PolarHBondContact O-N 3.1Å; M514-Y518 HydrophobicContact SD-CD2 4.13Å; M514-Y518 HydrophobicContact SD-CE2 4.19Å; A516-Y518 HydrophobicContact CB-CD2 4.26Å; A516-Y518 HydrophobicContact CB-CE2 3.71Å; Y518-L529 HydrophobicContact CD1-CB 4.28Å; Y518-L529 HydrophobicContact CD1-CD1 4.21Å; Y518-L529 HydrophobicContact CE1-CB 4.02Å; Y518-L529 HydrophobicContact CE1-CD1 3.77Å; Y518-L529 HydrophobicContact CE1-CG 4.48Å
519	S	96.4	Very high	94.6	Very high	8 Å²	8	38.2 Å²	38.2	6%	0.056	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.3	168.4	60.9	0	0	0	0	109.3	I507 W527 C528 V530	I507-S519 CarbonylContact O-C 3.5Å; I507-S519 WeakPolarHBondContact O-CA 3.5Å; S519-W527 WeakPolarHBondContact O-CA 3.3Å; S519-C528 PolarHBondContact N-O 2.85Å; S519-C528 PolarHBondContact O-N 2.82Å; S519-C528 PolarHBondContact OG-O 3.03Å; S519-V530 WeakPolarHBondContact OG-CG2 3.21Å
520	Y	97.6	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.9	172.5	173.9	-113.2	0	0	0	108.2	Y460 T475 K488 A489 H506 I507 P522 D525 T526 W527	Y460-Y520 AromaticContact CD1-CE1 3.84Å; Y460-Y520 HydrophobicContact CD1-CE1 3.84Å; Y460-Y520 AromaticContact CE1-CE1 3.78Å; Y460-Y520 HydrophobicContact CE1-CE1 3.78Å; T475-Y520 HydrophobicContact CG2-CE1 4.5Å; K488-Y520 WeakPolarHBondContact CB-OH 3.31Å; A489-Y520 HydrophobicContact CB-CE2 4.34Å; H506-Y520 WeakPolarHBondContact CA-O 3.45Å; I507-Y520 HydrophobicContact CD1-CD1 4.28Å; I507-Y520 PolarHBondContact N-O 2.98Å; I507-Y520 PolarHBondContact O-N 2.78Å; Y520-P522 HydrophobicContact CD1-CB 4.45Å; Y520-P522 HydrophobicContact CD1-CG 3.9Å; Y520-P522 HydrophobicContact CE1-CB 3.92Å; Y520-P522 HydrophobicContact CE1-CG 3.87Å; Y520-P522 VanDerWaalsContact O-CD 3.31Å; Y520-P522 WeakPolarHBondContact O-CD 3.42Å; Y520-D525 WeakPolarHBondContact CE2-OD1 3.49Å; Y520-D525 PolarHBondContact OH-OD1 3.28Å; Y520-T526 WeakPolarHBondContact CA-O 3.25Å; Y520-T526 WeakPolarHBondContact CD2-O 3.26Å; Y520-W527 AromaticContact CD2-CD1 3.81Å; Y520-W527 AromaticContact CD2-CD2 3.85Å; Y520-W527 HydrophobicContact CD2-CD2 3.85Å; Y520-W527 AromaticContact CD2-CE2 3.47Å; Y520-W527 VanDerWaalsContact CD2-CE2 3.47Å; Y520-W527 HydrophobicContact CD2-CG 4.06Å; Y520-W527 AromaticContact CD2-CZ2 3.94Å; Y520-W527 HydrophobicContact CD2-CZ2 3.94Å; Y520-W527 AromaticContact CD2-NE1 3.42Å; Y520-W527 AromaticContact CE2-NE1 3.86Å; Y520-W527 HydrophobicContact CG-CD2 4.28Å; Y520-W527 AromaticContact CG-CE2 3.93Å; Y520-W527 HydrophobicContact CG-CH2 4.34Å; Y520-W527 AromaticContact CG-CZ2 3.97Å; Y520-W527 HydrophobicContact CG-CZ2 3.97Å
521	S	96.3	Very high	94.5	Very high	11 Å²	11	41.3 Å²	41.3	8%	0.077	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.6	173.4	177.2	0	0	0	0	108.8	H523 E524 D525 T526	S521-H523 PolarHBondContact O-N 2.88Å; S521-E524 PolarHBondContact O-N 3.07Å; S521-E524 PolarHBondContact OG-N 2.96Å; S521-D525 VanDerWaalsContact O-CA 3.32Å; S521-D525 WeakPolarHBondContact O-CA 3.3Å; S521-D525 PolarHBondContact O-N 3.42Å; S521-T526 PolarHBondContact N-O 3.01Å; S521-T526 PolarHBondContact O-N 2.86Å
522	P	94.1	Very high	94.5	Very high	13 Å²	13	48 Å²	48	8%	0.084	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.1	-178	-18.7	35.2	0	0	0	113.3	Y455 Y460 I507 Y520	Y455-P522 HydrophobicContact CD1-CB 3.59Å; Y455-P522 HydrophobicContact CD1-CG 3.46Å; Y455-P522 VanDerWaalsContact CD1-CG 3.46Å; Y455-P522 HydrophobicContact CD2-CG 4.48Å; Y455-P522 HydrophobicContact CE1-CB 3.75Å; Y455-P522 HydrophobicContact CE1-CG 3.73Å; Y455-P522 HydrophobicContact CG-CB 4.44Å; Y455-P522 HydrophobicContact CG-CG 3.86Å; Y460-P522 HydrophobicContact CE1-CB 4.04Å; Y460-P522 HydrophobicContact CE2-CB 4.42Å; Y460-P522 WeakPolarHBondContact OH-CB 3.41Å; I507-P522 HydrophobicContact CD1-CG 3.93Å; I507-P522 HydrophobicContact CG1-CG 4.06Å; Y520-P522 HydrophobicContact CD1-CB 4.45Å; Y520-P522 HydrophobicContact CD1-CG 3.9Å; Y520-P522 HydrophobicContact CE1-CB 3.92Å; Y520-P522 HydrophobicContact CE1-CG 3.87Å; Y520-P522 VanDerWaalsContact O-CD 3.31Å; Y520-P522 WeakPolarHBondContact O-CD 3.42Å
523	H	92.3	Very high	94.5	Very high	122 Å²	122	48.9 Å²	48.9	57%	0.565	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-47	174.7	-80.7	-60	0	0	0	112.7	Y455 K456 S521	Y455-H523 AromaticContact CZ-NE2 3.95Å; Y455-H523 PolarHBondContact OH-CD2 2.85Å; Y455-H523 PolarHBondContact OH-NE2 3.19Å; K456-H523 WeakPolarHBondContact CD-NE2 3.06Å; K456-H523 PolarHBondContact NZ-NE2 2.83Å; S521-H523 PolarHBondContact O-N 2.88Å
524	E	94.4	Very high	94.5	Very high	144 Å²	144	51.4 Å²	51.4	67%	0.673	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.2	-179	-63.1	-175.5	171.1	0	0	112.4	S521 T526	S521-E524 PolarHBondContact O-N 3.07Å; S521-E524 PolarHBondContact OG-N 2.96Å; E524-T526 VanDerWaalsContact C-N 3.32Å; E524-T526 HydrophobicContact CB-CG2 4Å; E524-T526 WeakPolarHBondContact CB-OG1 3.2Å; E524-T526 PolarHBondContact OE2-OG1 2.78Å
525	D	96.6	Very high	94.3	Very high	54 Å²	54	56.2 Å²	56.2	29%	0.289	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	45.4	-170.9	-160.5	15.5	0	0	0	111.7	K488 A489 Y520 S521	K488-D525 WeakPolarHBondContact CB-OD1 3.3Å; A489-D525 WeakPolarHBondContact CB-O 3.38Å; A489-D525 VanDerWaalsContact CB-OD1 3.29Å; A489-D525 WeakPolarHBondContact CB-OD1 3.4Å; A489-D525 PolarHBondContact N-OD1 2.95Å; A489-D525 PolarHBondContact N-OD2 3.45Å; Y520-D525 WeakPolarHBondContact CE2-OD1 3.49Å; Y520-D525 PolarHBondContact OH-OD1 3.28Å; S521-D525 VanDerWaalsContact O-CA 3.32Å; S521-D525 WeakPolarHBondContact O-CA 3.3Å; S521-D525 PolarHBondContact O-N 3.42Å
526	T	97.3	Very high	94.2	Very high	61 Å²	61	54.4 Å²	54.4	37%	0.374	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.8	-176.1	57.7	0	0	0	0	111.9	Y520 S521 E524	Y520-T526 WeakPolarHBondContact CA-O 3.25Å; Y520-T526 WeakPolarHBondContact CD2-O 3.26Å; S521-T526 PolarHBondContact N-O 3.01Å; S521-T526 PolarHBondContact O-N 2.86Å; E524-T526 VanDerWaalsContact C-N 3.32Å; E524-T526 HydrophobicContact CB-CG2 4Å; E524-T526 WeakPolarHBondContact CB-OG1 3.2Å; E524-T526 PolarHBondContact OE2-OG1 2.78Å
527	W	97.6	Very high	94.1	Very high	43 Å²	43	55.2 Å²	55.2	16%	0.163	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.7	176.7	-73.9	91.9	0	0	0	110.9	I462 A489 A490 M491 P492 V509 S519 Y520	I462-W527 HydrophobicContact CD1-CH2 4.04Å; I462-W527 HydrophobicContact CD1-CZ2 4.46Å; I462-W527 HydrophobicContact CG1-CH2 4.45Å; I462-W527 HydrophobicContact CG2-CH2 3.69Å; I462-W527 HydrophobicContact CG2-CZ2 4Å; A489-W527 PolarHBondContact O-NE1 2.83Å; A490-W527 PolarHBondContact O-NE1 2.75Å; M491-W527 HydrophobicContact CB-CH2 4.07Å; M491-W527 HydrophobicContact CB-CZ2 3.79Å; M491-W527 HydrophobicContact CG-CE3 4.46Å; M491-W527 HydrophobicContact CG-CH2 3.91Å; M491-W527 HydrophobicContact CG-CZ2 4.14Å; M491-W527 HydrophobicContact CG-CZ3 4.08Å; M491-W527 HydrophobicContact SD-CH2 4.14Å; M491-W527 HydrophobicContact SD-CZ3 4.45Å; P492-W527 HydrophobicContact CG-CB 3.74Å; P492-W527 HydrophobicContact CG-CG 4.12Å; V509-W527 HydrophobicContact CB-CZ3 4.33Å; V509-W527 HydrophobicContact CG2-CH2 3.83Å; V509-W527 HydrophobicContact CG2-CZ3 3.88Å; S519-W527 WeakPolarHBondContact O-CA 3.3Å; Y520-W527 AromaticContact CD2-CD1 3.81Å; Y520-W527 AromaticContact CD2-CD2 3.85Å; Y520-W527 HydrophobicContact CD2-CD2 3.85Å; Y520-W527 AromaticContact CD2-CE2 3.47Å; Y520-W527 VanDerWaalsContact CD2-CE2 3.47Å; Y520-W527 HydrophobicContact CD2-CG 4.06Å; Y520-W527 AromaticContact CD2-CZ2 3.94Å; Y520-W527 HydrophobicContact CD2-CZ2 3.94Å; Y520-W527 AromaticContact CD2-NE1 3.42Å; Y520-W527 AromaticContact CE2-NE1 3.86Å; Y520-W527 HydrophobicContact CG-CD2 4.28Å; Y520-W527 AromaticContact CG-CE2 3.93Å; Y520-W527 HydrophobicContact CG-CH2 4.34Å; Y520-W527 AromaticContact CG-CZ2 3.97Å; Y520-W527 HydrophobicContact CG-CZ2 3.97Å
528	C	96.1	Very high	93.8	Very high	74 Å²	74	56.5 Å²	56.5	50%	0.5	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.2	177.2	-176.5	0	0	0	0	110.8	S519 V530	S519-C528 PolarHBondContact N-O 2.85Å; S519-C528 PolarHBondContact O-N 2.82Å; S519-C528 PolarHBondContact OG-O 3.03Å; C528-V530 PolarHBondContact O-N 3Å
529	L	96.4	Very high	93.5	Very high	77 Å²	77	55.6 Å²	55.6	40%	0.403	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.8	170.9	174.2	64.4	0	0	0	108.9	A516 Y518 Q532	A516-L529 HydrophobicContact CB-CD1 3.53Å; Y518-L529 HydrophobicContact CD1-CB 4.28Å; Y518-L529 HydrophobicContact CD1-CD1 4.21Å; Y518-L529 HydrophobicContact CE1-CB 4.02Å; Y518-L529 HydrophobicContact CE1-CD1 3.77Å; Y518-L529 HydrophobicContact CE1-CG 4.48Å; L529-Q532 HydrophobicContact CD1-CG 4.21Å; L529-Q532 HydrophobicContact CD2-CG 4.07Å
530	V	95.1	Very high	93.4	Very high	33 Å²	33	55.2 Å²	55.2	20%	0.2	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-52.3	-178.4	-178.2	0	0	0	0	110.4	Y508 L517 S519 C528 W568	Y508-V530 HydrophobicContact CD1-CG2 4.1Å; Y508-V530 HydrophobicContact CE1-CG1 4.42Å; Y508-V530 HydrophobicContact CE1-CG2 3.83Å; L517-V530 HydrophobicContact CB-CB 4.26Å; L517-V530 HydrophobicContact CD2-CB 4.14Å; L517-V530 HydrophobicContact CD2-CG1 3.95Å; L517-V530 HydrophobicContact CG-CB 4.08Å; L517-V530 HydrophobicContact CG-CG1 4.44Å; L517-V530 HydrophobicContact CG-CG2 4.37Å; L517-V530 WeakPolarHBondContact O-CB 3.47Å; L517-V530 PolarHBondContact O-N 3.39Å; S519-V530 WeakPolarHBondContact OG-CG2 3.21Å; C528-V530 PolarHBondContact O-N 3Å; V530-W568 HydrophobicContact CG1-CD2 3.97Å; V530-W568 HydrophobicContact CG1-CE3 4.39Å; V530-W568 HydrophobicContact CG1-CH2 3.76Å; V530-W568 HydrophobicContact CG1-CZ2 3.28Å; V530-W568 HydrophobicContact CG1-CZ3 4.3Å
531	T	94.7	Very high	93.1	Very high	32 Å²	32	55.2 Å²	55.2	20%	0.196	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	160.4	179.1	-171.3	0	0	0	0	111	A516 L517 F533 W568 L575	A516-T531 VanDerWaalsContact CA-O 3.3Å; A516-T531 WeakPolarHBondContact CA-O 3.39Å; A516-T531 WeakPolarHBondContact CB-O 3.33Å; L517-T531 HydrophobicContact CB-CG2 3.89Å; L517-T531 HydrophobicContact CD2-CG2 4.35Å; L517-T531 PolarHBondContact N-O 2.86Å; L517-T531 PolarHBondContact O-N 3.49Å; T531-F533 HydrophobicContact CG2-CE1 4.02Å; T531-W568 HydrophobicContact CG2-CE3 4.01Å; T531-W568 HydrophobicContact CG2-CZ3 4.08Å; T531-L575 HydrophobicContact CG2-CD2 4.26Å
532	Q	93.1	Very high	93.1	Very high	140 Å²	140	55.2 Å²	55.2	65%	0.654	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	148	177.7	-68.6	-178	-22.6	0	0	110.7	K515 L529	K515-Q532 CarbonylContact O-C 3.57Å; K515-Q532 WeakPolarHBondContact O-CA 3.34Å; L529-Q532 HydrophobicContact CD1-CG 4.21Å; L529-Q532 HydrophobicContact CD2-CG 4.07Å
533	F	90.1	Very high	93	Very high	21 Å²	21	54.8 Å²	54.8	9%	0.092	29%	0.287	C	S	.	.			trans	-107.8	153.4	176.3	-49.7	-46.8	0	0	0	110.7	V510 K515 A516 L517 T531 H535 I551 L566 L575	V510-F533 HydrophobicContact CG2-CE2 3.54Å; V510-F533 HydrophobicContact CG2-CZ 3.9Å; K515-F533 PolarHBondContact O-N 3.07Å; A516-F533 WeakPolarHBondContact O-CE2 3.45Å; L517-F533 HydrophobicContact CB-CE1 4.47Å; L517-F533 HydrophobicContact CB-CZ 3.82Å; T531-F533 HydrophobicContact CG2-CE1 4.02Å; F533-H535 VanDerWaalsContact C-N 3.33Å; F533-H535 WeakPolarHBondContact CB-O 3.33Å; F533-I551 HydrophobicContact CE1-CD1 4.21Å; F533-I551 HydrophobicContact CZ-CD1 3.7Å; F533-L566 HydrophobicContact CD1-CD1 4.34Å; F533-L566 HydrophobicContact CE1-CD1 4.27Å; F533-L575 HydrophobicContact CD1-CD2 3.64Å; F533-L575 HydrophobicContact CE1-CD1 4.37Å; F533-L575 HydrophobicContact CE1-CD2 3.6Å
534	T	85.9	Confident	92.9	Very high	121 Å²	121	49.9 Å²	49.9	74%	0.742	27%	0.266	S	S	*	.	S	Bend	trans	-70.7	-31	174	-41.7	0	0	0	0	112.4
535	H	86.9	Confident	92.6	Very high	107 Å²	107	43 Å²	43	50%	0.495	23%	0.234	S	C	.	.	S	Bend	trans	-133	152.9	-173.9	-60.2	-58	0	0	0	111.4	F533	F533-H535 VanDerWaalsContact C-N 3.33Å; F533-H535 WeakPolarHBondContact CB-O 3.33Å
536	E	90.5	Very high	92	Very high	47 Å²	47	40.8 Å²	40.8	22%	0.22	22%	0.222	C	C	.	.			trans	-62.7	152	168.3	-62.7	175	-164.7	0	0	111.3	K515 R555 D556 E557	K515-E536 HydrophobicContact CD-CG 4.35Å; K515-E536 WeakPolarHBondContact CE-OE1 3.46Å; K515-E536 HydrophobicContact CG-CG 3.73Å; E536-R555 CarbonylContact C-O 3.57Å; E536-D556 WeakPolarHBondContact O-CA 3.49Å; E536-E557 HydrophobicContact CB-CG 3.89Å; E536-E557 HydrophobicContact CG-CG 3.56Å; E536-E557 PolarHBondContact N-OE1 3.22Å; E536-E557 WeakPolarHBondContact OE1-CG 3.42Å
537	R	92.1	Very high	91.5	Very high	21 Å²	21	38.2 Å²	38.2	8%	0.079	21%	0.206	C	C	.	.			trans	-136.6	61.4	177.4	-65.2	-167.1	170.7	-119.8	3	110	G511 C540 R555 I562 T564 L566	G511-R537 VanDerWaalsContact CA-O 3.31Å; G511-R537 WeakPolarHBondContact CA-O 3.44Å; R537-C540 HydrophobicContact CB-CB 4.09Å; R537-C540 WeakPolarHBondContact O-CB 3.28Å; R537-C540 PolarHBondContact O-N 2.89Å; R537-C540 PolarHBondContact O-SG 2.89Å; R537-R555 CarbonylContact C-O 3.47Å; R537-R555 VanDerWaalsContact CA-O 3.29Å; R537-R555 WeakPolarHBondContact CA-O 3.41Å; R537-I562 HydrophobicContact CB-CD1 4.43Å; R537-I562 HydrophobicContact CG-CD1 3.73Å; R537-I562 VanDerWaalsContact NH1-CG2 3.25Å; R537-T564 PolarHBondContact NH1-O 3.22Å; R537-T564 VanDerWaalsContact NH1-O 3.09Å; R537-T564 PolarHBondContact NH1-OG1 3.46Å; R537-T564 PolarHBondContact NH2-OG1 2.66Å; R537-L566 VanDerWaalsContact CZ-CD1 3.49Å
538	A	90	Very high	91.2	Very high	26 Å²	26	39.3 Å²	39.3	22%	0.215	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-62.5	139.2	-178.8	0	0	0	0	0	111.2	G512 C540 G554 R555	G512-A538 WeakPolarHBondContact O-CA 3.41Å; G512-A538 PolarHBondContact O-N 2.79Å; A538-C540 PolarHBondContact O-N 2.94Å; A538-G554 CarbonylContact O-C 3.56Å; A538-G554 WeakPolarHBondContact O-CA 3.05Å; A538-R555 PolarHBondContact N-O 3.05Å; A538-R555 PolarHBondContact O-N 3.01Å
539	S	90.4	Very high	91	Very high	12 Å²	12	35.8 Å²	35.8	8%	0.084	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	32.6	179.5	-55.1	0	0	0	0	114.3	C497 H587	C497-S539 PolarHBondContact O-N 3.33Å; C497-S539 VanDerWaalsContact O-N 3.1Å; S539-H587 PolarHBondContact O-N 3.28Å; S539-H587 VanDerWaalsContact O-N 3.09Å; S539-H587 PolarHBondContact OG-CD2 2.74Å; S539-H587 VanDerWaalsContact OG-CD2 3.22Å; S539-H587 PolarHBondContact OG-CE1 3.01Å; S539-H587 PolarHBondContact OG-NE2 3.05Å
540	C	93.8	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.			trans	-76.2	157.7	170.7	66.5	0	0	0	0	111.5	N499 R537 A538 I551 T552 G553	N499-C540 PolarHBondContact ND2-O 2.85Å; R537-C540 HydrophobicContact CB-CB 4.09Å; R537-C540 WeakPolarHBondContact O-CB 3.28Å; R537-C540 PolarHBondContact O-N 2.89Å; R537-C540 PolarHBondContact O-SG 2.89Å; A538-C540 PolarHBondContact O-N 2.94Å; C540-I551 HydrophobicContact CB-CG2 4.17Å; C540-T552 CarbonylContact C-O 3.57Å; C540-T552 WeakPolarHBondContact CA-O 3.22Å; C540-T552 WeakPolarHBondContact CB-O 3.4Å; C540-G553 WeakPolarHBondContact CB-O 3.46Å
541	G	92.7	Very high	90.8	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	149.3	169.1	0	0	0	0	0	111.3	I551 T552 H588	G541-I551 CarbonylContact O-C 3.59Å; G541-I551 VanDerWaalsContact O-CA 3.3Å; G541-I551 WeakPolarHBondContact O-CA 3.4Å; G541-T552 PolarHBondContact N-O 3.31Å; G541-T552 PolarHBondContact O-N 3.06Å; G541-H588 PolarHBondContact N-CE1 3.41Å
542	I	94.3	Very high	90.8	Very high	11 Å²	11	29.3 Å²	29.3	6%	0.056	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133	166.2	-172.7	172.6	0	0	0	108.7	N499 A501 V510 L517 L549 F550 I551	N499-I542 HydrophobicContact CB-CG2 3.81Å; A501-I542 HydrophobicContact CB-CD1 4.28Å; A501-I542 HydrophobicContact CB-CG1 4.05Å; A501-I542 HydrophobicContact CB-CG2 4.01Å; V510-I542 HydrophobicContact CB-CD1 4.5Å; V510-I542 HydrophobicContact CG1-CB 3.69Å; V510-I542 HydrophobicContact CG1-CD1 3.74Å; V510-I542 HydrophobicContact CG1-CG1 4.19Å; V510-I542 HydrophobicContact CG1-CG2 4.06Å; L517-I542 HydrophobicContact CD1-CD1 4.16Å; I542-L549 HydrophobicContact CD1-CD2 4.34Å; I542-L549 HydrophobicContact CG1-CD2 4.39Å; I542-F550 WeakPolarHBondContact CA-O 3.45Å; I542-I551 HydrophobicContact CG1-CG1 4.37Å
543	S	92.1	Very high	90.7	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.021	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	128.9	-178.3	-61	0	0	0	0	110	F550 S590 V591	S543-F550 PolarHBondContact N-O 3.08Å; S543-F550 PolarHBondContact O-N 2.93Å; S543-S590 WeakPolarHBondContact OG-CB 3.47Å; S543-S590 PolarHBondContact OG-O 3.15Å; S543-S590 PolarHBondContact OG-OG 3.04Å; S543-V591 PolarHBondContact OG-N 2.84Å
544	P	91.5	Very high	90.8	Very high	19 Å²	19	21.6 Å²	21.6	12%	0.123	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.4	172.3	32.4	-30.8	0	0	0	109.1	I294 A501 F503 K548 L549 T592	I294-P544 HydrophobicContact CD1-CB 3.43Å; I294-P544 VanDerWaalsContact CD1-CB 3.43Å; I294-P544 HydrophobicContact CD1-CG 3.23Å; A501-P544 HydrophobicContact CB-CG 4.46Å; F503-P544 HydrophobicContact CB-CB 4.26Å; F503-P544 HydrophobicContact CD2-CB 3.62Å; F503-P544 HydrophobicContact CE2-CB 4.42Å; F503-P544 HydrophobicContact CG-CB 4.26Å; P544-K548 CarbonylContact C-O 3.53Å; P544-K548 WeakPolarHBondContact CA-O 3.03Å; P544-L549 HydrophobicContact CB-CD2 3.98Å; P544-T592 VanDerWaalsContact O-CB 3.31Å; P544-T592 WeakPolarHBondContact O-CB 3.49Å; P544-T592 VanDerWaalsContact O-CG2 3.31Å; P544-T592 WeakPolarHBondContact O-CG2 3.42Å; P544-T592 PolarHBondContact O-OG1 2.73Å
545	C	88.8	Confident	91.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	137.6	-179.5	-173.3	0	0	0	0	108.5	E308 F310 N547 K548 F550 T592	E308-C545 PolarHBondContact O-SG 3.09Å; F310-C545 HydrophobicContact CD1-CB 4.08Å; C545-N547 VanDerWaalsContact C-N 3.26Å; C545-N547 PolarHBondContact O-N 2.92Å; C545-K548 PolarHBondContact N-O 3.04Å; C545-K548 PolarHBondContact O-N 2.91Å; C545-K548 VanDerWaalsContact O-O 3.05Å; C545-F550 HydrophobicContact CB-CD2 3.74Å; C545-F550 HydrophobicContact CB-CE2 3.92Å; C545-F550 WeakPolarHBondContact O-CE2 3.38Å; C545-T592 HydrophobicContact CB-CG2 4.11Å
546	N	83.8	Confident	91.3	Very high	8 Å²	8	13.2 Å²	13.2	4%	0.043	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	44.7	178	-65.6	-53.8	0	0	0	113.3	E308 P331 L332 K548	E308-N546 PolarHBondContact O-ND2 3.04Å; E308-N546 WeakPolarHBondContact OE2-CA 3.48Å; E308-N546 PolarHBondContact OE2-N 2.91Å; P331-N546 WeakPolarHBondContact CG-ND2 3.02Å; L332-N546 HydrophobicContact CD1-CB 4.34Å; L332-N546 WeakPolarHBondContact CD1-OD1 3.39Å; L332-N546 HydrophobicContact CD2-CB 4.38Å; L332-N546 HydrophobicContact CG-CB 4.28Å; N546-K548 PolarHBondContact O-N 3.05Å
547	N	85.8	Confident	91.3	Very high	7 Å²	7	15.6 Å²	15.6	4%	0.037	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	28.7	-175.3	-162.3	30.8	0	0	0	115.2	E296 F503 R504 C545	E296-N547 WeakPolarHBondContact OE1-CB 3.48Å; E296-N547 VanDerWaalsContact OE1-CG 3.25Å; E296-N547 PolarHBondContact OE1-ND2 3.18Å; F503-N547 VanDerWaalsContact CZ-C 3.49Å; F503-N547 VanDerWaalsContact CZ-O 3.28Å; F503-N547 WeakPolarHBondContact CZ-O 3.48Å; F503-N547 WeakPolarHBondContact CZ-OD1 3.31Å; R504-N547 PolarHBondContact NE-OD1 2.65Å; R504-N547 VanDerWaalsContact NE-OD1 3.11Å; R504-N547 PolarHBondContact NH2-ND2 3.1Å; R504-N547 PolarHBondContact NH2-OD1 2.66Å; C545-N547 VanDerWaalsContact C-N 3.26Å; C545-N547 PolarHBondContact O-N 2.92Å
548	K	90.9	Very high	91.1	Very high	65 Å²	65	22.8 Å²	22.8	28%	0.283	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	165.4	171	-58.6	-170.2	-170.9	-161.6	0	110.3	P544 C545 N546 F550 C567 D569	P544-K548 CarbonylContact C-O 3.53Å; P544-K548 WeakPolarHBondContact CA-O 3.03Å; C545-K548 PolarHBondContact N-O 3.04Å; C545-K548 PolarHBondContact O-N 2.91Å; C545-K548 VanDerWaalsContact O-O 3.05Å; N546-K548 PolarHBondContact O-N 3.05Å; K548-F550 HydrophobicContact CB-CE2 3.92Å; K548-F550 HydrophobicContact CB-CZ 4.47Å; K548-C567 VanDerWaalsContact CD-SG 3.5Å; K548-D569 HydrophobicContact CD-CB 4.18Å; K548-D569 VanDerWaalsContact CE-OD2 3.3Å; K548-D569 WeakPolarHBondContact CE-OD2 2.89Å; K548-D569 IonicContact NZ-OD2 3.62Å; K548-D569 PolarHBondContact NZ-OD2 2.94Å
549	L	93.1	Very high	90.9	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.8	177.1	-78.6	171.1	0	0	0	110.3	A501 F503 Y508 I542 P544 C567 W568	A501-L549 HydrophobicContact CB-CD2 4.31Å; F503-L549 HydrophobicContact CB-CD1 4.29Å; F503-L549 HydrophobicContact CB-CD2 3.7Å; F503-L549 HydrophobicContact CB-CG 4.14Å; F503-L549 HydrophobicContact CD1-CD1 3.65Å; F503-L549 HydrophobicContact CD1-CD2 4.13Å; F503-L549 HydrophobicContact CD1-CG 3.61Å; F503-L549 HydrophobicContact CD2-CD2 4.37Å; F503-L549 HydrophobicContact CD2-CG 4.45Å; F503-L549 HydrophobicContact CE1-CD1 4.34Å; F503-L549 HydrophobicContact CE1-CG 4.12Å; F503-L549 HydrophobicContact CG-CD1 4.16Å; F503-L549 HydrophobicContact CG-CD2 3.8Å; F503-L549 HydrophobicContact CG-CG 3.8Å; Y508-L549 HydrophobicContact CD1-CD1 3.49Å; Y508-L549 VanDerWaalsContact CD1-CD1 3.49Å; Y508-L549 HydrophobicContact CD2-CD1 3.6Å; Y508-L549 HydrophobicContact CE1-CD1 3.8Å; Y508-L549 HydrophobicContact CE2-CD1 3.9Å; Y508-L549 HydrophobicContact CG-CD1 3.37Å; I542-L549 HydrophobicContact CD1-CD2 4.34Å; I542-L549 HydrophobicContact CG1-CD2 4.39Å; P544-L549 HydrophobicContact CB-CD2 3.98Å; L549-C567 CarbonylContact O-C 3.59Å; L549-C567 WeakPolarHBondContact O-CA 3.49Å; L549-W568 HydrophobicContact CB-CB 4.12Å; L549-W568 PolarHBondContact N-O 3.37Å; L549-W568 VanDerWaalsContact N-O 3.1Å; L549-W568 PolarHBondContact O-N 2.93Å
550	F	93.1	Very high	90.8	Very high	5 Å²	5	28.6 Å²	28.6	2%	0.022	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.4	177.5	-69.2	-95.1	0	0	0	110.5	F310 P331 I542 S543 C545 K548 V565 L566 C567 E578	F310-F550 HydrophobicContact CD1-CB 4.44Å; F310-F550 HydrophobicContact CD1-CD1 4.46Å; F310-F550 HydrophobicContact CD1-CD2 4.35Å; F310-F550 HydrophobicContact CD1-CG 4.16Å; F310-F550 HydrophobicContact CE1-CB 4.28Å; F310-F550 AromaticContact CE1-CD1 3.65Å; F310-F550 HydrophobicContact CE1-CD1 3.65Å; F310-F550 HydrophobicContact CE1-CD2 4.26Å; F310-F550 AromaticContact CE1-CE1 4Å; F310-F550 HydrophobicContact CE1-CE1 4Å; F310-F550 AromaticContact CE1-CG 3.79Å; F310-F550 HydrophobicContact CE1-CG 3.79Å; F310-F550 HydrophobicContact CE1-CZ 4.45Å; F310-F550 HydrophobicContact CZ-CB 4.45Å; F310-F550 AromaticContact CZ-CD1 3.92Å; F310-F550 HydrophobicContact CZ-CD1 3.92Å; F310-F550 HydrophobicContact CZ-CE1 4.48Å; F310-F550 HydrophobicContact CZ-CG 4.27Å; P331-F550 HydrophobicContact CB-CE1 3.69Å; P331-F550 HydrophobicContact CB-CE2 4.35Å; P331-F550 HydrophobicContact CB-CZ 3.47Å; P331-F550 VanDerWaalsContact CB-CZ 3.47Å; P331-F550 HydrophobicContact CG-CE1 4.27Å; P331-F550 HydrophobicContact CG-CE2 4.12Å; P331-F550 HydrophobicContact CG-CZ 3.71Å; I542-F550 WeakPolarHBondContact CA-O 3.45Å; S543-F550 PolarHBondContact N-O 3.08Å; S543-F550 PolarHBondContact O-N 2.93Å; C545-F550 HydrophobicContact CB-CD2 3.74Å; C545-F550 HydrophobicContact CB-CE2 3.92Å; C545-F550 WeakPolarHBondContact O-CE2 3.38Å; K548-F550 HydrophobicContact CB-CE2 3.92Å; K548-F550 HydrophobicContact CB-CZ 4.47Å; F550-V565 HydrophobicContact CB-CG1 4.43Å; F550-V565 HydrophobicContact CD1-CG1 3.91Å; F550-L566 CarbonylContact C-O 3.59Å; F550-L566 WeakPolarHBondContact CA-O 3.37Å; F550-C567 HydrophobicContact CD1-CB 4.16Å; F550-C567 HydrophobicContact CE1-CB 3.93Å; F550-C567 HydrophobicContact CZ-CB 4.44Å; F550-E578 HydrophobicContact CE1-CB 4.42Å; F550-E578 HydrophobicContact CE1-CG 4.06Å
551	I	94.4	Very high	90.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.4	174.6	-55.6	162.6	0	0	0	107.7	V510 F533 C540 G541 I542 V565 L566	V510-I551 HydrophobicContact CG1-CG1 4.42Å; V510-I551 HydrophobicContact CG1-CG2 4.49Å; V510-I551 HydrophobicContact CG2-CD1 4.13Å; V510-I551 HydrophobicContact CG2-CG2 4.42Å; F533-I551 HydrophobicContact CE1-CD1 4.21Å; F533-I551 HydrophobicContact CZ-CD1 3.7Å; C540-I551 HydrophobicContact CB-CG2 4.17Å; G541-I551 CarbonylContact O-C 3.59Å; G541-I551 VanDerWaalsContact O-CA 3.3Å; G541-I551 WeakPolarHBondContact O-CA 3.4Å; I542-I551 HydrophobicContact CG1-CG1 4.37Å; I551-V565 WeakPolarHBondContact O-CA 3.38Å; I551-L566 HydrophobicContact CB-CB 4.24Å; I551-L566 PolarHBondContact N-O 2.87Å; I551-L566 PolarHBondContact O-N 3.43Å
552	T	93.1	Very high	90.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.4	-171.2	56.2	0	0	0	0	111	F310 I312 C540 G541 V565 H588 S590	F310-T552 HydrophobicContact CD2-CG2 3.95Å; F310-T552 HydrophobicContact CE2-CG2 3.63Å; I312-T552 HydrophobicContact CD1-CG2 4.22Å; C540-T552 CarbonylContact C-O 3.57Å; C540-T552 WeakPolarHBondContact CA-O 3.22Å; C540-T552 WeakPolarHBondContact CB-O 3.4Å; G541-T552 PolarHBondContact N-O 3.31Å; G541-T552 PolarHBondContact O-N 3.06Å; T552-V565 HydrophobicContact CG2-CG1 3.9Å; T552-V565 HydrophobicContact CG2-CG2 4.14Å; T552-H588 PolarHBondContact O-CE1 3.15Å; T552-H588 PolarHBondContact O-NE2 2.92Å; T552-H588 PolarHBondContact OG1-NE2 3.37Å; T552-S590 PolarHBondContact OG1-OG 2.99Å
553	G	92.1	Very high	90.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.158	C	C	.	.			trans	57.7	-144.5	170.9	0	0	0	0	0	115.4	C540 I562 V585	C540-G553 WeakPolarHBondContact CB-O 3.46Å; G553-I562 VanDerWaalsContact CA-O 3.26Å; G553-I562 WeakPolarHBondContact CA-O 3.49Å; G553-V585 WeakPolarHBondContact CA-O 3.18Å
554	G	92.6	Very high	90.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.166	C	C	.	.			trans	102.9	-172.8	-176.4	0	0	0	0	0	113.1	A538 I562 V585	A538-G554 CarbonylContact O-C 3.56Å; A538-G554 WeakPolarHBondContact O-CA 3.05Å; G554-I562 PolarHBondContact O-N 3.04Å; G554-V585 PolarHBondContact N-O 2.92Å
555	R	91.6	Very high	90.3	Very high	14 Å²	14	32.3 Å²	32.3	5%	0.053	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-122.1	145.3	173.5	-59.9	-166.4	178.4	-123.4	1.1	112.2	T317 K318 E536 R537 A538 N559 E560 V561 S586	T317-R555 PolarHBondContact O-NH2 2.98Å; K318-R555 PolarHBondContact O-NH1 2.92Å; E536-R555 CarbonylContact C-O 3.57Å; R537-R555 CarbonylContact C-O 3.47Å; R537-R555 VanDerWaalsContact CA-O 3.29Å; R537-R555 WeakPolarHBondContact CA-O 3.41Å; A538-R555 PolarHBondContact N-O 3.05Å; A538-R555 PolarHBondContact O-N 3.01Å; R555-N559 WeakPolarHBondContact CD-OD1 3.19Å; R555-N559 PolarHBondContact NH1-O 2.79Å; R555-N559 PolarHBondContact NH1-OD1 3.09Å; R555-E560 WeakPolarHBondContact CA-O 3.09Å; R555-V561 HydrophobicContact CG-CG1 4.39Å; R555-S586 PolarHBondContact NE-OG 2.99Å; R555-S586 PolarHBondContact NH2-OG 3.35Å
556	D	91.2	Very high	90.6	Very high	37 Å²	37	32.8 Å²	32.8	20%	0.198	16%	0.163	C	C	.	.			trans	-85.4	-179.1	173.5	76.9	1.3	0	0	0	112.7	E536 K558 N559 E560 I562	E536-D556 WeakPolarHBondContact O-CA 3.49Å; D556-K558 PolarHBondContact O-N 3.06Å; D556-K558 VanDerWaalsContact OD1-C 3.31Å; D556-K558 VanDerWaalsContact OD1-CA 3.3Å; D556-K558 WeakPolarHBondContact OD1-CA 3.04Å; D556-K558 WeakPolarHBondContact OD1-CB 3.31Å; D556-K558 PolarHBondContact OD1-N 3.09Å; D556-N559 WeakPolarHBondContact O-CA 3.25Å; D556-N559 PolarHBondContact O-N 3.11Å; D556-N559 PolarHBondContact OD1-N 2.74Å; D556-E560 PolarHBondContact N-O 2.95Å; D556-E560 WeakPolarHBondContact OD1-CB 3.38Å; D556-E560 PolarHBondContact OD1-N 2.72Å; D556-I562 HydrophobicContact CB-CD1 4.17Å; D556-I562 HydrophobicContact CB-CG1 4.43Å
557	E	89.4	Confident	91	Very high	98 Å²	98	32.4 Å²	32.4	46%	0.458	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23	177.3	-70.6	161.5	-124	0	0	113.6	K515 E536 N559	K515-E557 WeakPolarHBondContact CE-OE1 3.46Å; K515-E557 IonicContact NZ-OE1 2.64Å; K515-E557 PolarHBondContact NZ-OE1 2.94Å; K515-E557 IonicContact NZ-OE2 2.86Å; K515-E557 PolarHBondContact NZ-OE2 2.98Å; E536-E557 HydrophobicContact CB-CG 3.89Å; E536-E557 HydrophobicContact CG-CG 3.56Å; E536-E557 PolarHBondContact N-OE1 3.22Å; E536-E557 WeakPolarHBondContact OE1-CG 3.42Å; E557-N559 VanDerWaalsContact C-N 3.3Å
558	K	88.5	Confident	91.4	Very high	171 Å²	171	33 Å²	33	74%	0.743	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	5.9	177.7	-60.8	177	-176.7	173.3	0	111.9	D556 E560	D556-K558 PolarHBondContact O-N 3.06Å; D556-K558 VanDerWaalsContact OD1-C 3.31Å; D556-K558 VanDerWaalsContact OD1-CA 3.3Å; D556-K558 WeakPolarHBondContact OD1-CA 3.04Å; D556-K558 WeakPolarHBondContact OD1-CB 3.31Å; D556-K558 PolarHBondContact OD1-N 3.09Å; K558-E560 HydrophobicContact CB-CG 4.06Å; K558-E560 PolarHBondContact O-N 3.38Å
559	N	85.6	Confident	91.5	Very high	91 Å²	91	30.8 Å²	30.8	49%	0.487	15%	0.154	S	C	.	.	S	Bend	trans	64.9	19.2	-175.2	-162.1	39.8	0	0	0	113.8	R555 D556 E557	R555-N559 WeakPolarHBondContact CD-OD1 3.19Å; R555-N559 PolarHBondContact NH1-O 2.79Å; R555-N559 PolarHBondContact NH1-OD1 3.09Å; D556-N559 WeakPolarHBondContact O-CA 3.25Å; D556-N559 PolarHBondContact O-N 3.11Å; D556-N559 PolarHBondContact OD1-N 2.74Å; E557-N559 VanDerWaalsContact C-N 3.3Å
560	E	89.6	Confident	91.2	Very high	70 Å²	70	31.6 Å²	31.6	33%	0.327	16%	0.159	S	C	.	.	P	Polyproline II helix	trans	-79.5	141.6	174.5	-62.1	-66.1	147.1	0	0	110.3	K318 R555 D556 K558	K318-E560 VanDerWaalsContact CD-OE2 3.25Å; K318-E560 WeakPolarHBondContact CD-OE2 3.35Å; K318-E560 VanDerWaalsContact CE-CD 3.43Å; K318-E560 WeakPolarHBondContact CE-OE1 3.36Å; K318-E560 WeakPolarHBondContact CE-OE2 3.36Å; K318-E560 IonicContact NZ-OE1 3.02Å; K318-E560 PolarHBondContact NZ-OE1 2.96Å; K318-E560 IonicContact NZ-OE2 2.86Å; K318-E560 PolarHBondContact NZ-OE2 3.2Å; R555-E560 WeakPolarHBondContact CA-O 3.09Å; D556-E560 PolarHBondContact N-O 2.95Å; D556-E560 WeakPolarHBondContact OD1-CB 3.38Å; D556-E560 PolarHBondContact OD1-N 2.72Å; K558-E560 HydrophobicContact CB-CG 4.06Å; K558-E560 PolarHBondContact O-N 3.38Å
561	V	91.1	Very high	91	Very high	35 Å²	35	37.9 Å²	37.9	21%	0.212	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-77.4	137.4	176.8	-69.3	0	0	0	0	111.1	K318 R555 G584	K318-V561 HydrophobicContact CB-CG2 4.07Å; R555-V561 HydrophobicContact CG-CG1 4.39Å; V561-G584 WeakPolarHBondContact CG2-O 3.37Å
562	I	91.3	Very high	90.8	Very high	22 Å²	22	41.5 Å²	41.5	11%	0.113	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-98.8	135.3	-178.7	-55.5	169.5	0	0	0	108.9	R537 G553 G554 D556 T564 G584 V585	R537-I562 HydrophobicContact CB-CD1 4.43Å; R537-I562 HydrophobicContact CG-CD1 3.73Å; R537-I562 VanDerWaalsContact NH1-CG2 3.25Å; G553-I562 VanDerWaalsContact CA-O 3.26Å; G553-I562 WeakPolarHBondContact CA-O 3.49Å; G554-I562 PolarHBondContact O-N 3.04Å; D556-I562 HydrophobicContact CB-CD1 4.17Å; D556-I562 HydrophobicContact CB-CG1 4.43Å; I562-T564 VanDerWaalsContact CG2-OG1 3.28Å; I562-T564 WeakPolarHBondContact CG2-OG1 3.43Å; I562-G584 VanDerWaalsContact O-CA 3.3Å; I562-G584 WeakPolarHBondContact O-CA 3.44Å; I562-V585 PolarHBondContact O-N 3.06Å
563	A	90.2	Very high	90.6	Very high	24 Å²	24	48.5 Å²	48.5	20%	0.198	24%	0.244	C	C	.	.			trans	-105.4	-14.3	175.3	0	0	0	0	0	112.8	V580 L581	A563-V580 HydrophobicContact CB-CG1 3.65Å; A563-L581 HydrophobicContact CB-CB 4.34Å; A563-L581 WeakPolarHBondContact O-CB 3.4Å; A563-L581 VanDerWaalsContact O-CG 3.31Å; A563-L581 WeakPolarHBondContact O-CG 3.36Å; A563-L581 PolarHBondContact O-N 2.79Å
564	T	90.4	Very high	90.6	Very high	31 Å²	31	55.2 Å²	55.2	19%	0.19	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.4	-177.6	53.7	0	0	0	0	111.6	R537 I562 V580	R537-T564 PolarHBondContact NH1-O 3.22Å; R537-T564 VanDerWaalsContact NH1-O 3.09Å; R537-T564 PolarHBondContact NH1-OG1 3.46Å; R537-T564 PolarHBondContact NH2-OG1 2.66Å; I562-T564 VanDerWaalsContact CG2-OG1 3.28Å; I562-T564 WeakPolarHBondContact CG2-OG1 3.43Å; T564-V580 HydrophobicContact CG2-CG2 4.42Å
565	V	91.1	Very high	90.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118	172.2	-177.5	0	0	0	0	108.5	F310 F550 I551 T552 E578 C579 L581	F310-V565 HydrophobicContact CE2-CG1 4.34Å; F310-V565 HydrophobicContact CZ-CG1 4.05Å; F550-V565 HydrophobicContact CB-CG1 4.43Å; F550-V565 HydrophobicContact CD1-CG1 3.91Å; I551-V565 WeakPolarHBondContact O-CA 3.38Å; T552-V565 HydrophobicContact CG2-CG1 3.9Å; T552-V565 HydrophobicContact CG2-CG2 4.14Å; V565-E578 PolarHBondContact O-N 3.39Å; V565-E578 VanDerWaalsContact O-N 3.11Å; V565-C579 WeakPolarHBondContact CB-O 3.22Å; V565-C579 PolarHBondContact N-O 3.42Å; V565-L581 HydrophobicContact CG2-CD1 4.43Å; V565-L581 HydrophobicContact CG2-CD2 3.57Å; V565-L581 HydrophobicContact CG2-CG 3.76Å
566	L	93.1	Very high	90.6	Very high	10 Å²	10	59.7 Å²	59.7	5%	0.052	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	143.8	175	-54.6	176.7	0	0	0	109.7	F533 R537 F550 I551 L575 T576 E577	F533-L566 HydrophobicContact CD1-CD1 4.34Å; F533-L566 HydrophobicContact CE1-CD1 4.27Å; R537-L566 VanDerWaalsContact CZ-CD1 3.49Å; F550-L566 CarbonylContact C-O 3.59Å; F550-L566 WeakPolarHBondContact CA-O 3.37Å; I551-L566 HydrophobicContact CB-CB 4.24Å; I551-L566 PolarHBondContact N-O 2.87Å; I551-L566 PolarHBondContact O-N 3.43Å; L566-L575 HydrophobicContact CB-CD1 4.04Å; L566-L575 HydrophobicContact CB-CG 4.49Å; L566-L575 HydrophobicContact CD1-CD2 4.24Å; L566-T576 CarbonylContact C-O 3.53Å; L566-T576 WeakPolarHBondContact CA-O 3.26Å; L566-E577 HydrophobicContact CD2-CG 3.82Å
567	C	93.4	Very high	90.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.1	173.4	179.4	0	0	0	0	109.3	K548 L549 F550 L575 T576 E578	K548-C567 VanDerWaalsContact CD-SG 3.5Å; L549-C567 CarbonylContact O-C 3.59Å; L549-C567 WeakPolarHBondContact O-CA 3.49Å; F550-C567 HydrophobicContact CD1-CB 4.16Å; F550-C567 HydrophobicContact CE1-CB 3.93Å; F550-C567 HydrophobicContact CZ-CB 4.44Å; C567-L575 CarbonylContact O-C 3.51Å; C567-L575 WeakPolarHBondContact O-CA 3.21Å; C567-T576 PolarHBondContact N-O 3.05Å; C567-T576 PolarHBondContact O-N 3.07Å; C567-E578 HydrophobicContact CB-CB 4.37Å; C567-E578 HydrophobicContact CB-CG 3.19Å
568	W	94.1	Very high	90.3	Very high	19 Å²	19	62.9 Å²	62.9	7%	0.072	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.5	168.5	172	-98.6	0	0	0	108.9	L517 V530 T531 L549 P570 Q573 L575	L517-W568 HydrophobicContact CD2-CB 4.28Å; L517-W568 HydrophobicContact CD2-CD2 4.48Å; L517-W568 HydrophobicContact CD2-CG 4.12Å; V530-W568 HydrophobicContact CG1-CD2 3.97Å; V530-W568 HydrophobicContact CG1-CE3 4.39Å; V530-W568 HydrophobicContact CG1-CH2 3.76Å; V530-W568 HydrophobicContact CG1-CZ2 3.28Å; V530-W568 HydrophobicContact CG1-CZ3 4.3Å; T531-W568 HydrophobicContact CG2-CE3 4.01Å; T531-W568 HydrophobicContact CG2-CZ3 4.08Å; L549-W568 HydrophobicContact CB-CB 4.12Å; L549-W568 PolarHBondContact N-O 3.37Å; L549-W568 VanDerWaalsContact N-O 3.1Å; L549-W568 PolarHBondContact O-N 2.93Å; W568-P570 WeakPolarHBondContact O-CD 3.37Å; W568-Q573 VanDerWaalsContact CH2-C 3.42Å; W568-Q573 HydrophobicContact CH2-CB 3.98Å; W568-Q573 WeakPolarHBondContact CH2-O 3.42Å; W568-Q573 HydrophobicContact CZ2-CB 4.24Å; W568-Q573 WeakPolarHBondContact CZ3-O 3.43Å; W568-L575 HydrophobicContact CB-CD1 4.11Å; W568-L575 HydrophobicContact CE3-CB 4.13Å; W568-L575 HydrophobicContact CE3-CD1 4.4Å
569	D	91.8	Very high	90.1	Very high	18 Å²	18	56.8 Å²	56.8	10%	0.096	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.3	174.1	-173.5	-30.9	0	0	0	109.5	K548 E571 T572 Q573 K574	K548-D569 HydrophobicContact CD-CB 4.18Å; K548-D569 VanDerWaalsContact CE-OD2 3.3Å; K548-D569 WeakPolarHBondContact CE-OD2 2.89Å; K548-D569 IonicContact NZ-OD2 3.62Å; K548-D569 PolarHBondContact NZ-OD2 2.94Å; D569-E571 VanDerWaalsContact C-N 3.27Å; D569-E571 PolarHBondContact O-N 2.64Å; D569-E571 WeakPolarHBondContact OD1-CB 3.17Å; D569-E571 PolarHBondContact OD1-N 2.88Å; D569-T572 WeakPolarHBondContact CB-OG1 3.46Å; D569-T572 PolarHBondContact OD1-N 2.88Å; D569-Q573 VanDerWaalsContact O-CA 3.25Å; D569-Q573 WeakPolarHBondContact O-CA 3.33Å; D569-Q573 PolarHBondContact O-N 3.14Å; D569-K574 PolarHBondContact N-O 2.96Å; D569-K574 PolarHBondContact O-N 2.7Å
570	P	87.8	Confident	90.1	Very high	19 Å²	19	57.2 Å²	57.2	12%	0.123	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.9	-178.3	32.2	-39.7	0	0	0	113.7	F503 W568	F503-P570 HydrophobicContact CE1-CB 4.28Å; F503-P570 HydrophobicContact CE1-CG 3.86Å; F503-P570 HydrophobicContact CZ-CG 4.05Å; W568-P570 WeakPolarHBondContact O-CD 3.37Å
571	E	88.2	Confident	89.7	Confident	136 Å²	136	54.6 Å²	54.6	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-44.9	179.9	-60.3	-172.1	166.9	0	0	111.1	D569 Q573	D569-E571 VanDerWaalsContact C-N 3.27Å; D569-E571 PolarHBondContact O-N 2.64Å; D569-E571 WeakPolarHBondContact OD1-CB 3.17Å; D569-E571 PolarHBondContact OD1-N 2.88Å; E571-Q573 VanDerWaalsContact C-N 3.35Å
572	T	90	Very high	89	Confident	76 Å²	76	57.2 Å²	57.2	47%	0.466	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.5	177.8	64.7	0	0	0	0	113	D569 K574	D569-T572 WeakPolarHBondContact CB-OG1 3.46Å; D569-T572 PolarHBondContact OD1-N 2.88Å; T572-K574 PolarHBondContact O-N 3.4Å
573	Q	90.4	Very high	88.6	Confident	148 Å²	148	61.4 Å²	61.4	69%	0.692	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	37	-173.1	-59	-176.1	3.3	0	0	112.5	W568 D569 E571	W568-Q573 VanDerWaalsContact CH2-C 3.42Å; W568-Q573 HydrophobicContact CH2-CB 3.98Å; W568-Q573 WeakPolarHBondContact CH2-O 3.42Å; W568-Q573 HydrophobicContact CZ2-CB 4.24Å; W568-Q573 WeakPolarHBondContact CZ3-O 3.43Å; D569-Q573 VanDerWaalsContact O-CA 3.25Å; D569-Q573 WeakPolarHBondContact O-CA 3.33Å; D569-Q573 PolarHBondContact O-N 3.14Å; E571-Q573 VanDerWaalsContact C-N 3.35Å
574	K	91.4	Very high	88.3	Confident	141 Å²	141	60.7 Å²	60.7	61%	0.613	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.7	-178.7	-73.8	178.3	-177.5	-179.2	0	110.9	D569 T572	D569-K574 PolarHBondContact N-O 2.96Å; D569-K574 PolarHBondContact O-N 2.7Å; T572-K574 PolarHBondContact O-N 3.4Å
575	L	92.6	Very high	88.3	Confident	55 Å²	55	59.6 Å²	59.6	29%	0.288	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.2	169.2	-170.5	73.2	0	0	0	108.2	T531 F533 L566 C567 W568	T531-L575 HydrophobicContact CG2-CD2 4.26Å; F533-L575 HydrophobicContact CD1-CD2 3.64Å; F533-L575 HydrophobicContact CE1-CD1 4.37Å; F533-L575 HydrophobicContact CE1-CD2 3.6Å; L566-L575 HydrophobicContact CB-CD1 4.04Å; L566-L575 HydrophobicContact CB-CG 4.49Å; L566-L575 HydrophobicContact CD1-CD2 4.24Å; C567-L575 CarbonylContact O-C 3.51Å; C567-L575 WeakPolarHBondContact O-CA 3.21Å; W568-L575 HydrophobicContact CB-CD1 4.11Å; W568-L575 HydrophobicContact CE3-CB 4.13Å; W568-L575 HydrophobicContact CE3-CD1 4.4Å
576	T	92.2	Very high	88.2	Confident	52 Å²	52	59.6 Å²	59.6	32%	0.319	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	153.9	179.2	52.5	0	0	0	0	110.9	L566 C567 E578	L566-T576 CarbonylContact C-O 3.53Å; L566-T576 WeakPolarHBondContact CA-O 3.26Å; C567-T576 PolarHBondContact N-O 3.05Å; C567-T576 PolarHBondContact O-N 3.07Å; T576-E578 PolarHBondContact OG1-OE1 2.81Å
577	E	90.1	Very high	88.1	Confident	138 Å²	138	61.5 Å²	61.5	65%	0.645	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	112.7	166.3	-56.9	-162.7	155.8	0	0	108.3	L566	L566-E577 HydrophobicContact CD2-CG 3.82Å
578	E	84.5	Confident	88	Confident	65 Å²	65	62.1 Å²	62.1	30%	0.304	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-42.3	-175.2	-71.3	-63.4	149.6	0	0	112.5	F550 V565 C567 T576	F550-E578 HydrophobicContact CE1-CB 4.42Å; F550-E578 HydrophobicContact CE1-CG 4.06Å; V565-E578 PolarHBondContact O-N 3.39Å; V565-E578 VanDerWaalsContact O-N 3.11Å; C567-E578 HydrophobicContact CB-CB 4.37Å; C567-E578 HydrophobicContact CB-CG 3.19Å; T576-E578 PolarHBondContact OG1-OE1 2.81Å
579	C	82.7	Confident	87.9	Confident	42 Å²	42	61.4 Å²	61.4	28%	0.284	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	170.6	-177.7	63.8	0	0	0	0	112.4	L329 V565	L329-C579 WeakPolarHBondContact CD2-SG 3.47Å; V565-C579 WeakPolarHBondContact CB-O 3.22Å; V565-C579 PolarHBondContact N-O 3.42Å
580	V	85.3	Confident	87.9	Confident	101 Å²	101	61.4 Å²	61.4	61%	0.612	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	130.7	176.8	-171.4	0	0	0	0	109.2	A563 T564	A563-V580 HydrophobicContact CB-CG1 3.65Å; T564-V580 HydrophobicContact CG2-CG2 4.42Å
581	L	82.8	Confident	88.1	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.073	31%	0.314	C	S	.	.			trans	-65	147.1	173.3	-59.2	-178.8	0	0	0	110	I312 A563 V565 R583 V585	I312-L581 HydrophobicContact CD1-CD1 3.79Å; I312-L581 HydrophobicContact CD1-CD2 3.17Å; I312-L581 HydrophobicContact CD1-CG 4.11Å; A563-L581 HydrophobicContact CB-CB 4.34Å; A563-L581 WeakPolarHBondContact O-CB 3.4Å; A563-L581 VanDerWaalsContact O-CG 3.31Å; A563-L581 WeakPolarHBondContact O-CG 3.36Å; A563-L581 PolarHBondContact O-N 2.79Å; V565-L581 HydrophobicContact CG2-CD1 4.43Å; V565-L581 HydrophobicContact CG2-CD2 3.57Å; V565-L581 HydrophobicContact CG2-CG 3.76Å; L581-R583 WeakPolarHBondContact CB-O 3.49Å; L581-R583 PolarHBondContact O-N 3.3Å; L581-V585 HydrophobicContact CD1-CG2 3.87Å
582	P	75.2	Confident	88.2	Confident	91 Å²	91	55 Å²	55	59%	0.591	29%	0.288	S	S	*	.	S	Bend	trans	-55.8	-28	177.8	-22	31.3	0	0	0	113
583	R	82.4	Confident	88	Confident	109 Å²	109	51.4 Å²	51.4	41%	0.411	27%	0.265	S	S	.	.	S	Bend	trans	-145.1	141.1	178	-176.9	169.5	59.3	-165.2	-15.6	109.1	T317 E325 L581	T317-R583 HydrophobicContact CG2-CG 4.43Å; E325-R583 IonicContact OE2-CZ 2.62Å; E325-R583 IonicContact OE2-NH2 2.73Å; E325-R583 PolarHBondContact OE2-NH2 3.01Å; L581-R583 WeakPolarHBondContact CB-O 3.49Å; L581-R583 PolarHBondContact O-N 3.3Å
584	G	84.9	Confident	87.6	Confident	10 Å²	10	45.5 Å²	45.5	10%	0.103	24%	0.237	C	C	.	.			trans	-66.7	131.4	170.6	0	0	0	0	0	110.7	V561 I562	V561-G584 WeakPolarHBondContact CG2-O 3.37Å; I562-G584 VanDerWaalsContact O-CA 3.3Å; I562-G584 WeakPolarHBondContact O-CA 3.44Å
585	V	89.6	Confident	86.9	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.042	21%	0.212	C	C	.	.			trans	-135.1	149.1	-176.3	-69.5	0	0	0	0	111	I312 V323 G553 G554 I562 L581 H588	I312-V585 HydrophobicContact CG2-CG2 4.19Å; V323-V585 HydrophobicContact CG2-CG1 4.19Å; G553-V585 WeakPolarHBondContact CA-O 3.18Å; G554-V585 PolarHBondContact N-O 2.92Å; I562-V585 PolarHBondContact O-N 3.06Å; L581-V585 HydrophobicContact CD1-CG2 3.87Å; V585-H588 HydrophobicContact CB-CB 4.47Å; V585-H588 HydrophobicContact CG2-CB 4.25Å
586	S	90.8	Very high	85.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-136	156.7	174.6	63.1	0	0	0	0	110.1	G315 C316 R555 H588	G315-S586 CarbonylContact C-O 3.58Å; G315-S586 WeakPolarHBondContact CA-O 3.43Å; C316-S586 PolarHBondContact N-O 2.83Å; C316-S586 PolarHBondContact O-N 2.73Å; C316-S586 PolarHBondContact O-OG 2.89Å; R555-S586 PolarHBondContact NE-OG 2.99Å; R555-S586 PolarHBondContact NH2-OG 3.35Å; S586-H588 PolarHBondContact O-N 3.17Å; S586-H588 VanDerWaalsContact O-N 3.09Å
587	H	89.4	Confident	84.4	Confident	51 Å²	51	38.9 Å²	38.9	24%	0.236	21%	0.207	C	C	.	.	S	Bend	trans	57.3	20.6	-176.8	-49.7	85.9	0	0	0	113.4	E358 S539	E358-H587 IonicContact OE1-CD2 2.66Å; S539-H587 PolarHBondContact O-N 3.28Å; S539-H587 VanDerWaalsContact O-N 3.09Å; S539-H587 PolarHBondContact OG-CD2 2.74Å; S539-H587 VanDerWaalsContact OG-CD2 3.22Å; S539-H587 PolarHBondContact OG-CE1 3.01Å; S539-H587 PolarHBondContact OG-NE2 3.05Å
588	H	92.1	Very high	82.5	Confident	12 Å²	12	36.6 Å²	36.6	6%	0.056	20%	0.203	C	C	.	.			trans	-76.1	154	173.4	59.8	-74.3	0	0	0	110.2	I312 I313 G314 G541 T552 V585 S586	I312-H588 HydrophobicContact CG2-CB 4.3Å; I313-H588 WeakPolarHBondContact O-CA 3.47Å; G314-H588 WeakPolarHBondContact O-CB 3.46Å; G541-H588 PolarHBondContact N-CE1 3.41Å; T552-H588 PolarHBondContact O-CE1 3.15Å; T552-H588 PolarHBondContact O-NE2 2.92Å; T552-H588 PolarHBondContact OG1-NE2 3.37Å; V585-H588 HydrophobicContact CB-CB 4.47Å; V585-H588 HydrophobicContact CG2-CB 4.25Å; S586-H588 PolarHBondContact O-N 3.17Å; S586-H588 VanDerWaalsContact O-N 3.09Å
589	G	90.9	Very high	80.4	Confident	5 Å²	5	42 Å²	42	5%	0.052	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	139.7	163.9	0	0	0	0	0	110.4	I312 I313 C361	I312-G589 WeakPolarHBondContact CA-O 3.32Å; I313-G589 PolarHBondContact N-O 3.02Å; I313-G589 PolarHBondContact O-N 2.87Å; C361-G589 WeakPolarHBondContact SG-CA 3.01Å
590	S	91.7	Very high	78.4	Confident	18 Å²	18	41.8 Å²	41.8	13%	0.126	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	118.6	172	-169.5	0	0	0	0	108.2	M311 S543 T552	M311-S590 WeakPolarHBondContact O-CA 3.45Å; S543-S590 WeakPolarHBondContact OG-CB 3.47Å; S543-S590 PolarHBondContact OG-O 3.15Å; S543-S590 PolarHBondContact OG-OG 3.04Å; T552-S590 PolarHBondContact OG1-OG 2.99Å
591	V	92.4	Very high	75.9	Confident	8 Å²	8	47.9 Å²	47.9	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.4	179.9	-61.1	0	0	0	0	110.7	F310 M311 I313 C361 T363 V368 S543	F310-V591 CarbonylContact C-O 3.58Å; F310-V591 VanDerWaalsContact CA-O 3.31Å; F310-V591 WeakPolarHBondContact CA-O 3.36Å; M311-V591 HydrophobicContact CB-CG2 3.96Å; M311-V591 PolarHBondContact N-O 2.85Å; M311-V591 PolarHBondContact O-N 3.28Å; M311-V591 VanDerWaalsContact O-N 3.12Å; M311-V591 HydrophobicContact SD-CG2 4.35Å; I313-V591 HydrophobicContact CD1-CG2 3.85Å; C361-V591 HydrophobicContact CB-CG1 3.99Å; C361-V591 WeakPolarHBondContact SG-CG1 3.49Å; T363-V591 WeakPolarHBondContact OG1-CB 3.47Å; V368-V591 HydrophobicContact CG1-CG2 3.93Å; V368-V591 HydrophobicContact CG2-CG2 3.79Å; S543-V591 PolarHBondContact OG-N 2.84Å
592	T	90.6	Very high	73.4	Confident	13 Å²	13	58.4 Å²	58.4	8%	0.08	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	137	176.1	-52.8	0	0	0	0	110.4	E308 V309 T363 P544 C545	E308-T592 VanDerWaalsContact CD-CG2 3.49Å; E308-T592 HydrophobicContact CG-CG2 3.31Å; E308-T592 WeakPolarHBondContact OE1-CG2 3.48Å; V309-T592 WeakPolarHBondContact O-CA 3.32Å; T363-T592 WeakPolarHBondContact CB-O 3.33Å; T363-T592 WeakPolarHBondContact CG2-O 3.39Å; T363-T592 PolarHBondContact OG1-O 2.53Å; P544-T592 VanDerWaalsContact O-CB 3.31Å; P544-T592 WeakPolarHBondContact O-CB 3.49Å; P544-T592 VanDerWaalsContact O-CG2 3.31Å; P544-T592 WeakPolarHBondContact O-CG2 3.42Å; P544-T592 PolarHBondContact O-OG1 2.73Å; C545-T592 HydrophobicContact CB-CG2 4.11Å
593	L	87	Confident	71.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	159.8	174.2	71.9	154	0	0	0	110.6	V309 M311 N366	V309-L593 HydrophobicContact CG2-CD2 3.74Å; V309-L593 HydrophobicContact CG2-CG 3.81Å; V309-L593 WeakPolarHBondContact CG2-O 3.39Å; V309-L593 PolarHBondContact N-O 3.39Å; V309-L593 PolarHBondContact O-N 2.79Å; M311-L593 HydrophobicContact CB-CD2 3.46Å; M311-L593 VanDerWaalsContact CB-CD2 3.46Å; M311-L593 HydrophobicContact CG-CD2 4.27Å; M311-L593 HydrophobicContact SD-CD2 4.06Å; N366-L593 WeakPolarHBondContact OD1-CB 3.31Å
594	R	81.1	Confident	68.9	Low	23 Å²	23	59.4 Å²	59.4	9%	0.087	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.7	168.3	-67.4	-175.9	-177.9	161.1	3.2	110.2	Y286 T298 S307 N366	Y286-R594 VanDerWaalsContact CZ-CZ 3.43Å; Y286-R594 PolarHBondContact OH-NE 3.21Å; Y286-R594 PolarHBondContact OH-NH1 3.32Å; Y286-R594 PolarHBondContact OH-NH2 3.09Å; T298-R594 PolarHBondContact O-NH2 3.44Å; S307-R594 CarbonylContact O-C 3.52Å; S307-R594 VanDerWaalsContact O-CA 3.29Å; S307-R594 WeakPolarHBondContact O-CA 2.83Å; N366-R594 PolarHBondContact ND2-O 2.9Å; N366-R594 WeakPolarHBondContact OD1-CA 3.3Å; N366-R594 PolarHBondContact OD1-N 2.86Å; N366-R594 PolarHBondContact OD1-O 3.38Å; N366-R594 VanDerWaalsContact OD1-O 3.11Å
595	K	76.4	Confident	66.2	Low	21 Å²	21	65.1 Å²	65.1	9%	0.091	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.2	-177.9	-165.7	155.8	-166.2	156.1	0	111.9	Q306 S307 V309 L337 Y383 Y597	Q306-K595 CarbonylContact C-O 3.55Å; Q306-K595 WeakPolarHBondContact CA-O 3.11Å; S307-K595 PolarHBondContact N-O 2.73Å; S307-K595 PolarHBondContact O-N 3.49Å; V309-K595 HydrophobicContact CG1-CB 4.39Å; V309-K595 HydrophobicContact CG2-CB 3.92Å; L337-K595 HydrophobicContact CD2-CD 3.94Å; Y383-K595 PolarHBondContact OH-NZ 3.1Å; K595-Y597 WeakPolarHBondContact O-CD2 2.83Å
596	S	69.7	Low	63.4	Low	52 Å²	52	68 Å²	68	36%	0.364	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.4	173	-177.1	0	0	0	0	111.3	F305 T598	F305-S596 CarbonylContact O-C 3.59Å; F305-S596 WeakPolarHBondContact O-CA 3.29Å; S596-T598 WeakPolarHBondContact OG-CG2 3.17Å; S596-T598 PolarHBondContact OG-OG1 3.27Å
597	Y	62.8	Low	60.3	Low	37 Å²	37	72.8 Å²	72.8	15%	0.145	39%	0.39	C	S	.	.			trans	-92.4	6.3	-177	-83	-105.3	0	0	0	113.7	F305 V309 D330 S335 K595 H599 I600	F305-Y597 PolarHBondContact O-N 3.06Å; V309-Y597 HydrophobicContact CG1-CE2 4.21Å; V309-Y597 WeakPolarHBondContact CG1-OH 3.26Å; D330-Y597 VanDerWaalsContact CB-OH 3.25Å; D330-Y597 WeakPolarHBondContact CB-OH 3.07Å; D330-Y597 PolarHBondContact OD2-OH 2.8Å; S335-Y597 WeakPolarHBondContact OG-CE1 3.13Å; K595-Y597 WeakPolarHBondContact O-CD2 2.83Å; Y597-H599 PolarHBondContact O-N 3.25Å; Y597-I600 HydrophobicContact CD1-CB 4.08Å; Y597-I600 HydrophobicContact CD1-CD1 3.28Å; Y597-I600 HydrophobicContact CD1-CG1 4.13Å; Y597-I600 HydrophobicContact CD1-CG2 4.41Å; Y597-I600 HydrophobicContact CD2-CD1 4.16Å; Y597-I600 HydrophobicContact CE1-CD1 3.27Å; Y597-I600 HydrophobicContact CE1-CG1 4.43Å; Y597-I600 HydrophobicContact CE2-CD1 4.12Å; Y597-I600 HydrophobicContact CG-CD1 3.71Å; Y597-I600 PolarHBondContact O-N 3.48Å
598	T	51.3	Low	57.6	Low	90 Å²	90	76.5 Å²	76.5	55%	0.552	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-8.1	-175	53.7	0	0	0	0	115.2	F305 S596	F305-T598 HydrophobicContact CB-CG2 4.19Å; F305-T598 HydrophobicContact CD1-CG2 3.81Å; F305-T598 HydrophobicContact CE1-CG2 4.49Å; F305-T598 HydrophobicContact CG-CG2 4.12Å; S596-T598 WeakPolarHBondContact OG-CG2 3.17Å; S596-T598 PolarHBondContact OG-OG1 3.27Å
599	H	38.9	Very low	54.6	Low	179 Å²	179	81.3 Å²	81.3	83%	0.829	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	11.6	178.1	-93.7	65.5	0	0	0	115	Y597 R601	Y597-H599 PolarHBondContact O-N 3.25Å; H599-R601 PolarHBondContact O-N 2.86Å; H599-R601 VanDerWaalsContact O-N 3.12Å
600	I	41.1	Very low	51.7	Low	36 Å²	36	91.1 Å²	91.1	19%	0.185	51%	0.51	C	S	.	.			trans	-82.4	102.6	-179	-63.2	176.7	0	0	0	108.1	L337 Y597 R602	L337-I600 HydrophobicContact CB-CD1 4.11Å; L337-I600 HydrophobicContact CD1-CD1 4.44Å; L337-I600 HydrophobicContact CD1-CG1 4.06Å; L337-I600 HydrophobicContact CD1-CG2 4.39Å; L337-I600 HydrophobicContact CD2-CD1 3.62Å; L337-I600 HydrophobicContact CD2-CG1 3.86Å; L337-I600 HydrophobicContact CG-CD1 4.24Å; L337-I600 HydrophobicContact CG-CG1 4.37Å; Y597-I600 HydrophobicContact CD1-CB 4.08Å; Y597-I600 HydrophobicContact CD1-CD1 3.28Å; Y597-I600 HydrophobicContact CD1-CG1 4.13Å; Y597-I600 HydrophobicContact CD1-CG2 4.41Å; Y597-I600 HydrophobicContact CD2-CD1 4.16Å; Y597-I600 HydrophobicContact CE1-CD1 3.27Å; Y597-I600 HydrophobicContact CE1-CG1 4.43Å; Y597-I600 HydrophobicContact CE2-CD1 4.12Å; Y597-I600 HydrophobicContact CG-CD1 3.71Å; Y597-I600 PolarHBondContact O-N 3.48Å; I600-R602 PolarHBondContact O-N 3.07Å
601	R	33.8	Very low	49.7	Very low	230 Å²	230	94.8 Å²	94.8	87%	0.868	53%	0.529	S	S	*	.			trans	-46.7	112.1	163.4	-75.7	-176.1	176.4	-178.1	-0.9	106.9	H599 I603	H599-R601 PolarHBondContact O-N 2.86Å; H599-R601 VanDerWaalsContact O-N 3.12Å; R601-I603 PolarHBondContact O-N 2.92Å
602	R	30.2	Very low	47.4	Very low	234 Å²	234	99.3 Å²	99.3	88%	0.883	55%	0.554	S	S	*	*			trans	-47.3	106.4	167.8	-89.7	-179.8	171.2	175.2	-2.9	106.9	I600 V604	I600-R602 PolarHBondContact O-N 3.07Å; R602-V604 VanDerWaalsContact C-N 3.26Å; R602-V604 PolarHBondContact O-N 3.02Å
603	I	33	Very low	45	Very low	117 Å²	117	104.1 Å²	104.1	60%	0.6	58%	0.581	S	S	*	*			trans	-70.1	100.4	162.1	-62	176.7	0	0	0	103.8	R601	R601-I603 PolarHBondContact O-N 2.92Å
604	V	28.5	Very low	42.6	Very low	105 Å²	105	110.2 Å²	110.2	64%	0.636	62%	0.615	S	S	*	*			trans	-58.7	126.7	169.5	-178	0	0	0	0	106.4	R602 G606	R602-V604 VanDerWaalsContact C-N 3.26Å; R602-V604 PolarHBondContact O-N 3.02Å; V604-G606 PolarHBondContact O-N 2.62Å
605	P	28.2	Very low	40.2	Very low	129 Å²	129	115.7 Å²	115.7	84%	0.838	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	106	172	5.7	3.9	0	0	0	107.4
606	G	31.5	Very low	37.7	Very low	67 Å²	67	122 Å²	122	69%	0.691	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	156.8	-13.6	177.2	0	0	0	0	0	117.5	V604 V608	V604-G606 PolarHBondContact O-N 2.62Å; G606-V608 PolarHBondContact O-N 2.88Å
607	A	26.7	Very low	35.5	Very low	101 Å²	101	127 Å²	127	84%	0.835	71%	0.708	S	S	*	*			trans	-84.3	86.8	177	0	0	0	0	0	110.9	S609	A607-S609 PolarHBondContact O-N 3Å
608	V	31.8	Very low	33.4	Very low	130 Å²	130	133.9 Å²	133.9	79%	0.788	75%	0.751	S	S	*	*			trans	-65.1	118.7	158.2	-176.7	0	0	0	0	106.5	G606 V610	G606-V608 PolarHBondContact O-N 2.88Å; V608-V610 PolarHBondContact O-N 3.15Å
609	S	28.6	Very low	31.9	Very low	112 Å²	112	137.6 Å²	137.6	78%	0.783	77%	0.768	S	S	*	*			trans	-64.7	118.3	170.7	52.5	0	0	0	0	108.8	A607	A607-S609 PolarHBondContact O-N 3Å
610	V	30.2	Very low	31.2	Very low	211 Å²	211	133.8 Å²	133.8	100%	1.279	76%	0.762	S	S	*	*			trans	-71.6	0	163.7	-178.5	0	0	0	0	109.3	V608	V608-V610 PolarHBondContact O-N 3.15Å

Retrieved 610 of 610 residues in 253.9 ms (Link to these results)

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