A0A087X3K4_POEFO Loading...

Leukocyte elastase inhibitor

AlphaFold DB , UniProt , Accession A0A087X3K4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 424 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	39.8	Very low	34.1	Very low	248 Å²	248	153.9 Å²	153.9	100%	1.222	90%	0.896	S	S	*	*				0	126.2	0	-91.4	175.6	-134.3	0	0	107.9
2	I	34.9	Very low	33.9	Very low	180 Å²	180	146.7 Å²	146.7	92%	0.923	88%	0.879	S	S	*	*			trans	-88.8	149.9	-165.5	-66.4	157.3	0	0	0	109.3
3	G	30.9	Very low	33.9	Very low	75 Å²	75	146.9 Å²	146.9	77%	0.773	88%	0.881	S	S	*	*			trans	172.3	70.9	164.3	0	0	0	0	0	116
4	R	38.1	Very low	33.8	Very low	257 Å²	257	154.3 Å²	154.3	97%	0.97	89%	0.885	S	S	*	*			trans	-82.5	145.4	148.5	-95.5	-176.6	173.6	-179.8	-1.7	107.7
5	G	31.1	Very low	33.6	Very low	80 Å²	80	148.3 Å²	148.3	83%	0.825	87%	0.87	S	S	*	*			trans	-177.7	104.7	169.2	0	0	0	0	0	113.3
6	S	33.1	Very low	33.8	Very low	123 Å²	123	149.4 Å²	149.4	86%	0.86	87%	0.87	S	S	*	*			trans	-66.2	150.9	164.4	50.4	0	0	0	0	112.5
7	A	34.2	Very low	34	Very low	101 Å²	101	153.9 Å²	153.9	84%	0.835	88%	0.877	S	S	*	*			trans	-163	132.9	143.4	0	0	0	0	0	111.3
8	E	32.5	Very low	34.4	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	86%	0.86	S	S	*	*			trans	-63.6	154.7	174.1	-61.5	161.3	135.4	0	0	112.2
9	T	33.4	Very low	34.8	Very low	141 Å²	141	147.8 Å²	147.8	87%	0.865	86%	0.863	S	S	*	*			trans	-152	120.1	140.8	18.8	0	0	0	0	110.4
10	N	30.1	Very low	34.9	Very low	164 Å²	164	149.2 Å²	149.2	88%	0.877	87%	0.865	S	S	*	*			trans	-72.9	121.7	174.2	-135.3	-19.1	0	0	0	108.6
11	V	37.1	Very low	35.2	Very low	137 Å²	137	150.2 Å²	150.2	83%	0.83	87%	0.867	S	S	*	*			trans	-113.2	112.7	167	177.8	0	0	0	0	108.3
12	G	31.8	Very low	35.2	Very low	67 Å²	67	145.4 Å²	145.4	69%	0.691	85%	0.845	S	S	*	*			trans	-71.6	151	-177.9	0	0	0	0	0	114
13	V	33.3	Very low	35.4	Very low	150 Å²	150	146.6 Å²	146.6	91%	0.909	84%	0.844	S	S	*	*			trans	-59.2	125.2	175.9	176.5	0	0	0	0	111.1
14	R	32.9	Very low	35.7	Very low	250 Å²	250	150.7 Å²	150.7	94%	0.943	85%	0.847	S	S	*	*			trans	-131.2	116.4	161	-102.5	-175.2	165.3	-176.5	-3.5	109.1
15	G	31.1	Very low	35.7	Very low	64 Å²	64	141.4 Å²	141.4	66%	0.66	82%	0.822	S	S	*	*			trans	95.3	107.2	157.2	0	0	0	0	0	115.7
16	I	36.4	Very low	36.1	Very low	167 Å²	167	144.6 Å²	144.6	86%	0.856	82%	0.819	S	S	*	*				-166.7	101.1	111.5	-81	144.2	0	0	0	105.5
17	F	37.9	Very low	36.4	Very low	226 Å²	226	142.2 Å²	142.2	99%	0.991	80%	0.803	S	S	*	*			trans	-96.6	114.2	164.2	-131.3	-93.2	0	0	0	105.2
18	G	41.6	Very low	36.6	Very low	55 Å²	55	140.5 Å²	140.5	57%	0.567	79%	0.785	S	S	*	*			trans	147.9	125.3	174.8	0	0	0	0	0	112.4
19	C	41.7	Very low	36.9	Very low	136 Å²	136	137.4 Å²	137.4	92%	0.919	77%	0.773	S	S	*	*			trans	86.8	53.6	174.3	-58.9	0	0	0	0	118
20	L	37	Very low	37.4	Very low	175 Å²	175	133.4 Å²	133.4	92%	0.916	75%	0.751	S	S	*	*			trans	-132.6	61.2	160.5	-140.4	105.9	0	0	0	112
21	L	41.3	Very low	38.2	Very low	171 Å²	171	130.5 Å²	130.5	90%	0.895	74%	0.736	S	S	*	*	S	Bend	trans	-146.8	23.9	176.9	-100.1	176.9	0	0	0	115.6
22	L	39.7	Very low	38.5	Very low	147 Å²	147	127.5 Å²	127.5	77%	0.77	72%	0.718	S	S	*	*	S	Bend	trans	-139.1	17.7	-177.2	-101.2	157.4	0	0	0	117.3
23	F	38.5	Very low	39.1	Very low	206 Å²	206	127.5 Å²	127.5	90%	0.904	71%	0.707	S	S	*	*	S	Bend	trans	-128.4	28.3	178.1	-83.9	-75	0	0	0	115.4
24	L	36.8	Very low	39.5	Very low	160 Å²	160	126.1 Å²	126.1	84%	0.838	69%	0.694	S	S	*	*	S	Bend	trans	-128.6	24.7	174.9	-84.8	166.2	0	0	0	114
25	S	39	Very low	39.8	Very low	62 Å²	62	120.4 Å²	120.4	43%	0.434	68%	0.678	S	S	.	*	S	Bend	trans	-122.6	4.7	177.2	61.7	0	0	0	0	115.7	L29	S25-L29 WeakPolarHBondContact O-CD1 3.46Å
26	L	38.5	Very low	39.9	Very low	148 Å²	148	123.3 Å²	123.3	78%	0.775	67%	0.674	S	S	*	*	S	Bend	trans	-110.9	-9.4	176.9	-94.6	107.1	0	0	0	116.1
27	S	40.4	Very low	40	Very low	73 Å²	73	118.7 Å²	118.7	51%	0.51	66%	0.662	S	S	.	*	S	Bend	trans	-90.9	-20.8	172.8	41.5	0	0	0	0	113.5	S30	S27-S30 PolarHBondContact O-OG 3.38Å
28	S	38	Very low	40	Very low	65 Å²	65	118.3 Å²	118.3	46%	0.455	65%	0.654	S	S	.	*	H	α-helix	trans	-84.4	-23.8	178	56.1	0	0	0	0	113.6	T32	S28-T32 WeakPolarHBondContact O-CB 3.47Å; S28-T32 PolarHBondContact O-N 2.9Å; S28-T32 PolarHBondContact O-OG1 3.17Å
29	L	39.2	Very low	39.5	Very low	121 Å²	121	123.3 Å²	123.3	63%	0.634	66%	0.662	S	S	*	*	H	α-helix	trans	-78.6	-28.1	179.3	-78.8	162.8	0	0	0	113.1	S25 S33	S25-L29 WeakPolarHBondContact O-CD1 3.46Å; L29-S33 WeakPolarHBondContact O-CB 3.4Å; L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 3.39Å
30	S	44	Very low	38.9	Very low	58 Å²	58	125.6 Å²	125.6	41%	0.406	66%	0.656	S	S	.	*	H	α-helix	trans	-76.3	-38	175.2	49.7	0	0	0	0	112.9	S27 S33 L34	S27-S30 PolarHBondContact O-OG 3.38Å; S30-S33 PolarHBondContact O-OG 3.38Å; S30-S33 VanDerWaalsContact O-OG 3.05Å; S30-L34 PolarHBondContact O-N 3.43Å
31	D	45.9	Very low	39	Very low	103 Å²	103	123.7 Å²	123.7	55%	0.551	64%	0.643	S	S	*	*	H	α-helix	trans	-73.1	-39.3	177.9	-88.9	-29.8	0	0	0	112	S33 L34 Q35	D31-S33 VanDerWaalsContact C-N 3.32Å; D31-S33 PolarHBondContact O-N 2.87Å; D31-L34 PolarHBondContact O-N 3.45Å; D31-Q35 WeakPolarHBondContact O-CB 3.48Å; D31-Q35 PolarHBondContact O-N 3.5Å
32	T	43	Very low	38.5	Very low	73 Å²	73	118.4 Å²	118.4	45%	0.448	62%	0.62	S	S	.	*	H	α-helix	trans	-65	-38.1	177.3	-46	0	0	0	0	111	S28 Q36	S28-T32 WeakPolarHBondContact O-CB 3.47Å; S28-T32 PolarHBondContact O-N 2.9Å; S28-T32 PolarHBondContact O-OG1 3.17Å; T32-Q36 WeakPolarHBondContact O-CB 3.4Å; T32-Q36 PolarHBondContact O-N 3.28Å
33	S	44.9	Very low	38.2	Very low	68 Å²	68	116.7 Å²	116.7	48%	0.476	62%	0.618	S	S	.	*	H	α-helix	trans	-72.2	-31.9	178.1	51.3	0	0	0	0	113.5	L29 S30 D31 A37	L29-S33 WeakPolarHBondContact O-CB 3.4Å; L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 3.39Å; S30-S33 PolarHBondContact O-OG 3.38Å; S30-S33 VanDerWaalsContact O-OG 3.05Å; D31-S33 VanDerWaalsContact C-N 3.32Å; D31-S33 PolarHBondContact O-N 2.87Å; S33-A37 VanDerWaalsContact O-CB 3.3Å; S33-A37 WeakPolarHBondContact O-CB 3.24Å; S33-A37 PolarHBondContact O-N 2.78Å; S33-A37 VanDerWaalsContact O-N 3.07Å
34	L	41.3	Very low	38.1	Very low	120 Å²	120	111 Å²	111	63%	0.628	60%	0.6	S	S	*	*	H	α-helix	trans	-74.1	-37.3	172.3	-78.4	164.3	0	0	0	112.8	S30 D31 R38	S30-L34 PolarHBondContact O-N 3.43Å; D31-L34 PolarHBondContact O-N 3.45Å; L34-R38 PolarHBondContact O-N 2.86Å; L34-R38 VanDerWaalsContact O-N 3.17Å
35	Q	39.6	Very low	38.4	Very low	130 Å²	130	106 Å²	106	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-67.9	-41.6	172.4	-95.2	169.4	-35.5	0	0	112.1	D31 A37 R38 E39	D31-Q35 WeakPolarHBondContact O-CB 3.48Å; D31-Q35 PolarHBondContact O-N 3.5Å; Q35-A37 VanDerWaalsContact C-N 3.3Å; Q35-A37 PolarHBondContact O-N 3.24Å; Q35-R38 PolarHBondContact O-N 2.96Å; Q35-R38 VanDerWaalsContact O-N 3.07Å; Q35-E39 PolarHBondContact O-N 2.89Å
36	Q	34.3	Very low	38.6	Very low	125 Å²	125	106.3 Å²	106.3	58%	0.584	58%	0.58	S	S	*	*	H	α-helix	trans	-73.6	-21.2	179.8	-147	168.3	26.8	0	0	112.9	T32	T32-Q36 WeakPolarHBondContact O-CB 3.4Å; T32-Q36 PolarHBondContact O-N 3.28Å
37	A	37.7	Very low	38.7	Very low	71 Å²	71	101.8 Å²	101.8	59%	0.587	56%	0.564	S	S	*	*	H	α-helix	trans	-77.4	-29.2	167	0	0	0	0	0	112.7	S33 Q35	S33-A37 VanDerWaalsContact O-CB 3.3Å; S33-A37 WeakPolarHBondContact O-CB 3.24Å; S33-A37 PolarHBondContact O-N 2.78Å; S33-A37 VanDerWaalsContact O-N 3.07Å; Q35-A37 VanDerWaalsContact C-N 3.3Å; Q35-A37 PolarHBondContact O-N 3.24Å
38	R	37.3	Very low	39.1	Very low	218 Å²	218	102.6 Å²	102.6	82%	0.823	56%	0.561	S	S	*	*	H	α-helix	trans	-80.7	-28.1	177.4	-133.7	172.2	-176	169.5	0.5	113.1	L34 Q35	L34-R38 PolarHBondContact O-N 2.86Å; L34-R38 VanDerWaalsContact O-N 3.17Å; Q35-R38 PolarHBondContact O-N 2.96Å; Q35-R38 VanDerWaalsContact O-N 3.07Å
39	E	31.2	Very low	39.7	Very low	160 Å²	160	99.9 Å²	99.9	75%	0.748	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.1	177.3	-77.2	-177.7	157.7	0	0	114.7	Q35 Q41	Q35-E39 PolarHBondContact O-N 2.89Å; E39-Q41 VanDerWaalsContact C-N 3.35Å
40	K	29.8	Very low	40.5	Very low	184 Å²	184	95.2 Å²	95.2	80%	0.8	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	12.5	174.4	-92.5	-176.1	179.3	179.4	0	114.9
41	Q	38.1	Very low	41.3	Very low	135 Å²	135	96.1 Å²	96.1	63%	0.631	52%	0.52	S	S	*	.	S	Bend	trans	-96.4	109.1	158.6	-92.4	173.5	-11.5	0	0	108.5	E39	E39-Q41 VanDerWaalsContact C-N 3.35Å
42	S	30.4	Very low	42.9	Very low	60 Å²	60	91.7 Å²	91.7	42%	0.42	50%	0.497	S	S	.	.			trans	-59.4	136.5	178.7	55.8	0	0	0	0	110.7	T44 S45	S42-T44 PolarHBondContact O-N 2.9Å; S42-S45 PolarHBondContact O-N 3.36Å; S42-S45 VanDerWaalsContact O-N 3.15Å; S42-S45 PolarHBondContact O-OG 3.4Å
43	P	33.9	Very low	45.1	Very low	110 Å²	110	88.4 Å²	88.4	71%	0.714	48%	0.477	S	S	*	.	H	α-helix	trans	-55.8	-17.6	172.1	-22.7	31.8	0	0	0	113.4
44	T	36.1	Very low	47.3	Very low	86 Å²	86	85.8 Å²	85.8	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-76.1	-30.8	-179	-20.9	0	0	0	0	113.1	S42 M48	S42-T44 PolarHBondContact O-N 2.9Å; T44-M48 HydrophobicContact CG2-CE 3.9Å; T44-M48 VanDerWaalsContact O-CB 3.32Å; T44-M48 WeakPolarHBondContact O-CB 3.36Å; T44-M48 WeakPolarHBondContact O-CE 3.16Å; T44-M48 WeakPolarHBondContact O-CG 3.42Å; T44-M48 PolarHBondContact O-N 2.67Å; T44-M48 VanDerWaalsContact O-N 3.15Å
45	S	43.9	Very low	49.8	Very low	57 Å²	57	83.2 Å²	83.2	40%	0.399	45%	0.446	S	S	.	.	H	α-helix	trans	-76.7	-36.5	-174.7	76.7	0	0	0	0	113.1	S42 A49	S42-S45 PolarHBondContact O-N 3.36Å; S42-S45 VanDerWaalsContact O-N 3.15Å; S42-S45 PolarHBondContact O-OG 3.4Å; S45-A49 WeakPolarHBondContact O-CB 3.48Å; S45-A49 PolarHBondContact O-N 2.79Å
46	S	42.5	Very low	52.4	Low	67 Å²	67	77.1 Å²	77.1	47%	0.469	42%	0.417	S	S	.	.	H	α-helix	trans	-72.6	-45.7	176.7	60.4	0	0	0	0	111.5	M48 A49 V50	S46-M48 PolarHBondContact O-N 3.43Å; S46-A49 PolarHBondContact O-N 3.49Å; S46-A49 VanDerWaalsContact O-N 3.1Å; S46-V50 VanDerWaalsContact O-CG2 3.26Å; S46-V50 WeakPolarHBondContact O-CG2 3.37Å; S46-V50 PolarHBondContact O-N 2.94Å
47	A	42.1	Very low	55.4	Low	53 Å²	53	71.1 Å²	71.1	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-39.2	177.4	0	0	0	0	0	112.9	A49 N51	A47-A49 VanDerWaalsContact C-N 3.3Å; A47-A49 PolarHBondContact O-N 3.35Å; A47-N51 PolarHBondContact O-N 3.41Å
48	M	48.2	Very low	58.2	Low	90 Å²	90	68 Å²	68	44%	0.443	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-33.4	173.2	-78.5	-170.8	-72.1	0	0	112.7	T44 S46 S52 T106	T44-M48 HydrophobicContact CG2-CE 3.9Å; T44-M48 VanDerWaalsContact O-CB 3.32Å; T44-M48 WeakPolarHBondContact O-CB 3.36Å; T44-M48 WeakPolarHBondContact O-CE 3.16Å; T44-M48 WeakPolarHBondContact O-CG 3.42Å; T44-M48 PolarHBondContact O-N 2.67Å; T44-M48 VanDerWaalsContact O-N 3.15Å; S46-M48 PolarHBondContact O-N 3.43Å; M48-S52 PolarHBondContact O-N 3.01Å; M48-T106 HydrophobicContact CB-CG2 4.29Å; M48-T106 HydrophobicContact SD-CG2 4.46Å
49	A	51.2	Low	60.9	Low	9 Å²	9	58.3 Å²	58.3	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-81.4	-26.4	-179	0	0	0	0	0	113.7	S45 S46 A47 S52 N53 Y114	S45-A49 WeakPolarHBondContact O-CB 3.48Å; S45-A49 PolarHBondContact O-N 2.79Å; S46-A49 PolarHBondContact O-N 3.49Å; S46-A49 VanDerWaalsContact O-N 3.1Å; A47-A49 VanDerWaalsContact C-N 3.3Å; A47-A49 PolarHBondContact O-N 3.35Å; A49-S52 WeakPolarHBondContact O-CB 3.45Å; A49-N53 PolarHBondContact O-N 3.41Å; A49-Y114 HydrophobicContact CB-CD1 4.28Å; A49-Y114 HydrophobicContact CB-CD2 3.62Å; A49-Y114 HydrophobicContact CB-CE1 3.94Å; A49-Y114 HydrophobicContact CB-CE2 3.23Å; A49-Y114 HydrophobicContact CB-CG 4.11Å; A49-Y114 PolarHBondContact O-OH 3.12Å
50	V	55.6	Low	64.1	Low	23 Å²	23	50.7 Å²	50.7	14%	0.139	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-48.6	169	179	0	0	0	0	110.8	S46 S52 N53 A54 T412 K413	S46-V50 VanDerWaalsContact O-CG2 3.26Å; S46-V50 WeakPolarHBondContact O-CG2 3.37Å; S46-V50 PolarHBondContact O-N 2.94Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.39Å; V50-N53 PolarHBondContact O-N 2.94Å; V50-A54 PolarHBondContact O-N 2.71Å; V50-T412 WeakPolarHBondContact CG2-O 3.38Å; V50-K413 HydrophobicContact CG1-CB 3.43Å; V50-K413 VanDerWaalsContact CG1-CB 3.43Å; V50-K413 HydrophobicContact CG1-CD 4.39Å; V50-K413 HydrophobicContact CG2-CB 4.35Å
51	N	60.1	Low	67.3	Low	76 Å²	76	42.1 Å²	42.1	41%	0.406	26%	0.258	S	S	.	.	H	α-helix	trans	-63.8	-39.9	-179.8	-74.5	6.2	0	0	0	111.4	A47 N53 A54 D55	A47-N51 PolarHBondContact O-N 3.41Å; N51-N53 PolarHBondContact O-N 3.35Å; N51-A54 PolarHBondContact O-N 3.04Å; N51-D55 WeakPolarHBondContact O-CB 3.14Å; N51-D55 PolarHBondContact O-N 3Å
52	S	79.4	Confident	70	Confident	11 Å²	11	39.2 Å²	39.2	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-54.6	-46	174.3	174.3	0	0	0	0	113.5	M48 A49 V50 F56 S104	M48-S52 PolarHBondContact O-N 3.01Å; A49-S52 WeakPolarHBondContact O-CB 3.45Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.39Å; S52-F56 PolarHBondContact O-N 3.48Å; S52-F56 VanDerWaalsContact O-N 3.08Å; S52-S104 WeakPolarHBondContact CB-O 3.34Å; S52-S104 WeakPolarHBondContact O-CB 3.45Å; S52-S104 PolarHBondContact OG-O 3.47Å
53	N	89.6	Confident	73.2	Confident	4 Å²	4	37 Å²	37	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-40.2	179	172.7	-114.4	0	0	0	112.5	A49 V50 N51 A57 L78 I415	A49-N53 PolarHBondContact O-N 3.41Å; V50-N53 PolarHBondContact O-N 2.94Å; N51-N53 PolarHBondContact O-N 3.35Å; N53-A57 VanDerWaalsContact O-CB 3.26Å; N53-A57 WeakPolarHBondContact O-CB 3.24Å; N53-A57 PolarHBondContact O-N 3.34Å; N53-L78 WeakPolarHBondContact ND2-CA 3.38Å; N53-I415 PolarHBondContact OD1-N 3.05Å; N53-I415 PolarHBondContact OD1-O 3.1Å
54	A	91.9	Very high	76.1	Confident	12 Å²	12	31.7 Å²	31.7	10%	0.099	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-40.6	177.5	0	0	0	0	0	112.2	V50 N51 A57 L58 P297 I415	V50-A54 PolarHBondContact O-N 2.71Å; N51-A54 PolarHBondContact O-N 3.04Å; A54-A57 PolarHBondContact O-N 2.97Å; A54-L58 WeakPolarHBondContact O-CG 3.29Å; A54-L58 PolarHBondContact O-N 3.42Å; A54-P297 HydrophobicContact CB-CB 3.86Å; A54-P297 HydrophobicContact CB-CG 4.28Å; A54-I415 HydrophobicContact CB-CD1 4.07Å
55	D	92.9	Very high	78.9	Confident	67 Å²	67	27.8 Å²	27.8	36%	0.358	17%	0.167	S	C	.	.	H	α-helix	trans	-57.3	-51.5	173.6	-83.1	-47.4	0	0	0	111.5	N51 A57 L58 G59 S104 P297	N51-D55 WeakPolarHBondContact O-CB 3.14Å; N51-D55 PolarHBondContact O-N 3Å; D55-A57 VanDerWaalsContact C-N 3.34Å; D55-A57 PolarHBondContact O-N 3.25Å; D55-L58 PolarHBondContact O-N 2.59Å; D55-G59 PolarHBondContact O-N 2.77Å; D55-S104 WeakPolarHBondContact CB-OG 3.45Å; D55-P297 HydrophobicContact CB-CG 4.46Å; D55-P297 WeakPolarHBondContact OD1-CG 3.36Å
56	F	95.3	Very high	81.2	Confident	1 Å²	1	31.4 Å²	31.4	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-61.3	-43.8	177.5	174.8	-112	0	0	0	111.6	S52 L58 G59 L60 P77 I80 A102 L103 L334 M337	S52-F56 PolarHBondContact O-N 3.48Å; S52-F56 VanDerWaalsContact O-N 3.08Å; F56-L58 PolarHBondContact O-N 2.97Å; F56-G59 PolarHBondContact O-N 2.84Å; F56-L60 HydrophobicContact CE1-CD2 4.14Å; F56-L60 HydrophobicContact CE2-CB 4.34Å; F56-L60 HydrophobicContact CZ-CB 4.33Å; F56-L60 HydrophobicContact CZ-CD2 3.91Å; F56-L60 VanDerWaalsContact O-CB 3.3Å; F56-L60 WeakPolarHBondContact O-CB 3.41Å; F56-L60 PolarHBondContact O-N 3.46Å; F56-P77 HydrophobicContact CD1-CB 4.15Å; F56-P77 HydrophobicContact CE1-CB 4.32Å; F56-P77 WeakPolarHBondContact CE1-O 3.44Å; F56-I80 HydrophobicContact CE1-CB 4.15Å; F56-I80 HydrophobicContact CE1-CG2 3.96Å; F56-I80 HydrophobicContact CZ-CB 4.39Å; F56-I80 HydrophobicContact CZ-CG2 3.71Å; F56-A102 WeakPolarHBondContact CD2-O 3.16Å; F56-L103 HydrophobicContact CD2-CD2 4.02Å; F56-L103 HydrophobicContact CE1-CD2 4.48Å; F56-L103 HydrophobicContact CE2-CD2 3.65Å; F56-L103 HydrophobicContact CZ-CD2 3.9Å; F56-L334 HydrophobicContact CE2-CD2 3.93Å; F56-L334 HydrophobicContact CZ-CD2 4.15Å; F56-M337 HydrophobicContact CD2-CE 3.66Å; F56-M337 HydrophobicContact CE2-CE 3.83Å; F56-M337 HydrophobicContact CE2-SD 4.3Å
57	A	96.1	Very high	83.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.9	-50.1	178.6	0	0	0	0	0	112.4	N53 A54 D55 F61 P77 I415	N53-A57 VanDerWaalsContact O-CB 3.26Å; N53-A57 WeakPolarHBondContact O-CB 3.24Å; N53-A57 PolarHBondContact O-N 3.34Å; A54-A57 PolarHBondContact O-N 2.97Å; D55-A57 VanDerWaalsContact C-N 3.34Å; D55-A57 PolarHBondContact O-N 3.25Å; A57-F61 WeakPolarHBondContact O-CB 3.08Å; A57-F61 PolarHBondContact O-N 2.89Å; A57-P77 HydrophobicContact CB-CB 3.5Å; A57-P77 HydrophobicContact CB-CG 3.5Å; A57-P77 VanDerWaalsContact CB-CG 3.5Å; A57-I415 HydrophobicContact CB-CB 4.48Å; A57-I415 HydrophobicContact CB-CD1 4.08Å; A57-I415 HydrophobicContact CB-CG2 4.43Å
58	L	95.9	Very high	85.9	Confident	4 Å²	4	30 Å²	30	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-69.5	-40.3	-179.9	-64.9	178.4	0	0	0	111.6	A54 D55 F56 F61 R62 L295 T296 P297 F418	A54-L58 WeakPolarHBondContact O-CG 3.29Å; A54-L58 PolarHBondContact O-N 3.42Å; D55-L58 PolarHBondContact O-N 2.59Å; F56-L58 PolarHBondContact O-N 2.97Å; L58-F61 PolarHBondContact O-N 3.36Å; L58-R62 VanDerWaalsContact O-CG 3.3Å; L58-R62 WeakPolarHBondContact O-CG 3.37Å; L58-R62 PolarHBondContact O-N 2.87Å; L58-L295 HydrophobicContact CD1-CB 4.48Å; L58-L295 HydrophobicContact CD2-CB 4.2Å; L58-L295 HydrophobicContact CD2-CD1 4.48Å; L58-T296 VanDerWaalsContact CD1-C 3.46Å; L58-P297 HydrophobicContact CD1-CG 4.18Å; L58-F418 HydrophobicContact CD2-CE1 4.47Å; L58-F418 HydrophobicContact CD2-CE2 4.12Å; L58-F418 HydrophobicContact CD2-CZ 3.86Å
59	G	95.8	Very high	87.7	Confident	16 Å²	16	30.1 Å²	30.1	17%	0.165	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-51.7	174.7	0	0	0	0	0	112.2	D55 F56 R62 T63	D55-G59 PolarHBondContact O-N 2.77Å; F56-G59 PolarHBondContact O-N 2.84Å; G59-R62 PolarHBondContact O-N 2.91Å; G59-T63 PolarHBondContact O-N 3.02Å
60	L	97.1	Very high	89.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-48.7	177.7	178.2	62.1	0	0	0	111.2	F56 R62 T63 L64 V75 I80 L330 H333 M337	F56-L60 HydrophobicContact CE1-CD2 4.14Å; F56-L60 HydrophobicContact CE2-CB 4.34Å; F56-L60 HydrophobicContact CZ-CB 4.33Å; F56-L60 HydrophobicContact CZ-CD2 3.91Å; F56-L60 VanDerWaalsContact O-CB 3.3Å; F56-L60 WeakPolarHBondContact O-CB 3.41Å; F56-L60 PolarHBondContact O-N 3.46Å; L60-R62 VanDerWaalsContact C-N 3.3Å; L60-R62 PolarHBondContact O-N 3.11Å; L60-T63 PolarHBondContact O-N 3.35Å; L60-T63 PolarHBondContact O-OG1 2.77Å; L60-L64 HydrophobicContact CD1-CD1 4.39Å; L60-L64 HydrophobicContact CD1-CG 4.35Å; L60-L64 HydrophobicContact CG-CD1 4.06Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 WeakPolarHBondContact O-CG 3.34Å; L60-L64 PolarHBondContact O-N 2.8Å; L60-V75 HydrophobicContact CD2-CG2 3.88Å; L60-I80 HydrophobicContact CD2-CD1 3.57Å; L60-L330 HydrophobicContact CD1-CD2 4.31Å; L60-H333 HydrophobicContact CD1-CB 4.17Å; L60-M337 HydrophobicContact CB-CE 4.46Å; L60-M337 HydrophobicContact CB-SD 4.13Å; L60-M337 HydrophobicContact CD1-SD 4.31Å
61	F	96.9	Very high	91	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.013	22%	0.22	C	C	.	.	H	α-helix	trans	-56.9	-42.1	-179.8	177.3	-93.7	0	0	0	112.2	A57 L58 T63 L64 S65 I73 E292 L404 F418 R420	A57-F61 WeakPolarHBondContact O-CB 3.08Å; A57-F61 PolarHBondContact O-N 2.89Å; L58-F61 PolarHBondContact O-N 3.36Å; F61-T63 VanDerWaalsContact C-N 3.34Å; F61-T63 PolarHBondContact O-N 3.32Å; F61-L64 PolarHBondContact O-N 3.39Å; F61-S65 WeakPolarHBondContact O-CB 3.32Å; F61-S65 PolarHBondContact O-N 3.35Å; F61-I73 HydrophobicContact CD2-CG2 3.85Å; F61-I73 HydrophobicContact CE2-CB 4.03Å; F61-I73 HydrophobicContact CE2-CD1 4.13Å; F61-I73 HydrophobicContact CE2-CG2 3.8Å; F61-I73 HydrophobicContact CZ-CD1 4.5Å; F61-E292 HydrophobicContact CE1-CB 4.25Å; F61-E292 HydrophobicContact CE1-CG 3.71Å; F61-E292 HydrophobicContact CZ-CG 4.27Å; F61-L404 HydrophobicContact CE1-CD2 4.25Å; F61-L404 HydrophobicContact CE2-CD2 4.48Å; F61-L404 HydrophobicContact CZ-CD2 3.64Å; F61-F418 HydrophobicContact CB-CD1 4.03Å; F61-F418 HydrophobicContact CB-CE1 4.28Å; F61-F418 HydrophobicContact CD1-CD1 4.27Å; F61-F418 AromaticContact CD1-CE1 3.82Å; F61-F418 HydrophobicContact CD1-CE1 3.82Å; F61-F418 AromaticContact CD2-CD1 3.39Å; F61-F418 HydrophobicContact CD2-CD1 3.39Å; F61-F418 AromaticContact CD2-CE1 3.73Å; F61-F418 HydrophobicContact CD2-CE1 3.73Å; F61-F418 HydrophobicContact CE1-CE1 4.08Å; F61-F418 AromaticContact CE2-CD1 3.86Å; F61-F418 HydrophobicContact CE2-CD1 3.86Å; F61-F418 AromaticContact CE2-CE1 3.95Å; F61-F418 HydrophobicContact CE2-CE1 3.95Å; F61-F418 AromaticContact CG-CD1 3.6Å; F61-F418 HydrophobicContact CG-CD1 3.6Å; F61-F418 AromaticContact CG-CE1 3.64Å; F61-F418 HydrophobicContact CG-CE1 3.64Å; F61-F418 HydrophobicContact CZ-CE1 4.14Å; F61-R420 HydrophobicContact CE2-CB 4.15Å; F61-R420 HydrophobicContact CZ-CB 4.09Å
62	R	95.6	Very high	92.7	Very high	75 Å²	75	37 Å²	37	28%	0.283	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-42.5	175.3	-72.6	-180	-162	123.9	-8.7	112.2	L58 G59 L60 L64 S65 Q66 L295	L58-R62 VanDerWaalsContact O-CG 3.3Å; L58-R62 WeakPolarHBondContact O-CG 3.37Å; L58-R62 PolarHBondContact O-N 2.87Å; G59-R62 PolarHBondContact O-N 2.91Å; L60-R62 VanDerWaalsContact C-N 3.3Å; L60-R62 PolarHBondContact O-N 3.11Å; R62-L64 VanDerWaalsContact C-N 3.3Å; R62-L64 PolarHBondContact O-N 3.07Å; R62-S65 PolarHBondContact O-N 3.2Å; R62-Q66 WeakPolarHBondContact O-CB 3.31Å; R62-Q66 VanDerWaalsContact O-CG 3.23Å; R62-Q66 WeakPolarHBondContact O-CG 3.38Å; R62-Q66 PolarHBondContact O-N 3.36Å; R62-L295 PolarHBondContact NH2-O 3.4Å
63	T	96.2	Very high	93.5	Very high	12 Å²	12	36.5 Å²	36.5	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-33.6	177.3	69.6	0	0	0	0	112.8	G59 L60 F61 A67 H333 K336 M337	G59-T63 PolarHBondContact O-N 3.02Å; L60-T63 PolarHBondContact O-N 3.35Å; L60-T63 PolarHBondContact O-OG1 2.77Å; F61-T63 VanDerWaalsContact C-N 3.34Å; F61-T63 PolarHBondContact O-N 3.32Å; T63-A67 PolarHBondContact O-N 3.4Å; T63-H333 PolarHBondContact O-ND1 2.78Å; T63-H333 WeakPolarHBondContact OG1-CB 3.43Å; T63-K336 HydrophobicContact CG2-CB 4.28Å; T63-M337 HydrophobicContact CG2-CG 3.86Å; T63-M337 HydrophobicContact CG2-SD 4.43Å
64	L	96	Very high	93.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-43.9	176.1	-67.6	174	0	0	0	111.1	L60 F61 R62 A67 N68 I73 V75 Y328 L330	L60-L64 HydrophobicContact CD1-CD1 4.39Å; L60-L64 HydrophobicContact CD1-CG 4.35Å; L60-L64 HydrophobicContact CG-CD1 4.06Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 WeakPolarHBondContact O-CG 3.34Å; L60-L64 PolarHBondContact O-N 2.8Å; F61-L64 PolarHBondContact O-N 3.39Å; R62-L64 VanDerWaalsContact C-N 3.3Å; R62-L64 PolarHBondContact O-N 3.07Å; L64-A67 PolarHBondContact O-N 3.44Å; L64-N68 PolarHBondContact O-N 3.07Å; L64-N68 VanDerWaalsContact O-N 3.08Å; L64-I73 HydrophobicContact CB-CD1 4.1Å; L64-I73 HydrophobicContact CB-CG2 4.34Å; L64-I73 HydrophobicContact CD1-CG2 4.21Å; L64-V75 HydrophobicContact CD1-CB 4.06Å; L64-V75 HydrophobicContact CD1-CG1 4Å; L64-V75 HydrophobicContact CD1-CG2 4.17Å; L64-Y328 HydrophobicContact CD1-CE1 4.44Å; L64-Y328 HydrophobicContact CD2-CD1 3.52Å; L64-Y328 HydrophobicContact CD2-CE1 3.73Å; L64-Y328 HydrophobicContact CD2-CG 4.16Å; L64-L330 HydrophobicContact CD2-CD2 4.5Å
65	S	94.5	Very high	94	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.028	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-47.9	177.1	179.5	0	0	0	0	112	F61 R62 A67 N68 P69 I73 E292 R420	F61-S65 WeakPolarHBondContact O-CB 3.32Å; F61-S65 PolarHBondContact O-N 3.35Å; R62-S65 PolarHBondContact O-N 3.2Å; S65-A67 PolarHBondContact O-N 2.97Å; S65-N68 CarbonylContact O-C 3.57Å; S65-N68 PolarHBondContact O-N 2.99Å; S65-P69 VanDerWaalsContact O-CA 3.29Å; S65-P69 WeakPolarHBondContact O-CA 3.49Å; S65-I73 VanDerWaalsContact CA-CD1 3.45Å; S65-E292 VanDerWaalsContact CB-OE2 3.29Å; S65-E292 WeakPolarHBondContact CB-OE2 3.44Å; S65-E292 PolarHBondContact OG-OE2 2.95Å; S65-R420 PolarHBondContact OG-NH1 3.14Å
66	Q	93	Very high	94.2	Very high	133 Å²	133	32.6 Å²	32.6	62%	0.621	18%	0.181	S	C	*	.	H	α-helix	trans	-59.6	-33.1	177.3	-72.9	170.2	2.3	0	0	113	R62	R62-Q66 WeakPolarHBondContact O-CB 3.31Å; R62-Q66 VanDerWaalsContact O-CG 3.23Å; R62-Q66 WeakPolarHBondContact O-CG 3.38Å; R62-Q66 PolarHBondContact O-N 3.36Å
67	A	92.9	Very high	94.1	Very high	45 Å²	45	32.5 Å²	32.5	37%	0.372	18%	0.181	S	C	.	.	H	α-helix	trans	-77.7	-25.5	177	0	0	0	0	0	113.1	T63 L64 S65	T63-A67 PolarHBondContact O-N 3.4Å; L64-A67 PolarHBondContact O-N 3.44Å; S65-A67 PolarHBondContact O-N 2.97Å
68	N	89.6	Confident	93.9	Very high	46 Å²	46	33 Å²	33	25%	0.246	18%	0.183	C	C	.	.	S	Bend	trans	-139.5	59.9	-172.9	-63.1	-77.2	0	0	0	112.3	L64 S65 A70 R71 R420	L64-N68 PolarHBondContact O-N 3.07Å; L64-N68 VanDerWaalsContact O-N 3.08Å; S65-N68 CarbonylContact O-C 3.57Å; S65-N68 PolarHBondContact O-N 2.99Å; N68-A70 VanDerWaalsContact C-N 3.28Å; N68-A70 PolarHBondContact O-N 2.9Å; N68-A70 VanDerWaalsContact O-N 3.08Å; N68-R71 HydrophobicContact CB-CB 4.19Å; N68-R71 PolarHBondContact O-N 3.02Å; N68-R71 VanDerWaalsContact O-N 3.16Å; N68-R420 PolarHBondContact O-NH2 3.33Å
69	P	86.8	Confident	93.7	Very high	91 Å²	91	33.1 Å²	33.1	59%	0.591	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.6	-164.7	21.7	-34.1	0	0	0	115.1	S65 R420	S65-P69 VanDerWaalsContact O-CA 3.29Å; S65-P69 WeakPolarHBondContact O-CA 3.49Å; P69-R420 PolarHBondContact O-NH1 3.13Å; P69-R420 PolarHBondContact O-NH2 2.96Å
70	A	83.9	Confident	93.7	Very high	84 Å²	84	32.4 Å²	32.4	69%	0.694	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-1.8	-177	0	0	0	0	0	114.5	N68	N68-A70 VanDerWaalsContact C-N 3.28Å; N68-A70 PolarHBondContact O-N 2.9Å; N68-A70 VanDerWaalsContact O-N 3.08Å
71	R	91.8	Very high	93.5	Very high	142 Å²	142	32.5 Å²	32.5	54%	0.536	18%	0.177	S	C	.	.	S	Bend	trans	-97.3	156.9	-176.1	-64.4	-172	61.5	-163.5	-10.2	111.9	N68 E326 R420 S422	N68-R71 HydrophobicContact CB-CB 4.19Å; N68-R71 PolarHBondContact O-N 3.02Å; N68-R71 VanDerWaalsContact O-N 3.16Å; R71-E326 IonicContact NH2-OE2 3.43Å; R71-E326 PolarHBondContact NH2-OE2 3.37Å; R71-R420 PolarHBondContact O-NE 2.9Å; R71-R420 PolarHBondContact O-NH2 3.11Å; R71-S422 PolarHBondContact O-OG 3.42Å
72	N	95.9	Very high	93.2	Very high	26 Å²	26	32.5 Å²	32.5	14%	0.139	18%	0.178	C	C	.	.			trans	-56.1	147.5	163.8	-62.9	-23.4	0	0	0	110	L324 R420 S422 S423	N72-L324 HydrophobicContact CB-CD1 4.47Å; N72-L324 HydrophobicContact CB-CD2 3.78Å; N72-L324 VanDerWaalsContact ND2-CD2 3.27Å; N72-L324 WeakPolarHBondContact ND2-CD2 3.27Å; N72-R420 VanDerWaalsContact CA-O 3.29Å; N72-R420 WeakPolarHBondContact CA-O 3.31Å; N72-S422 PolarHBondContact OD1-N 2.9Å; N72-S423 PolarHBondContact ND2-O 2.87Å; N72-S423 PolarHBondContact OD1-N 2.77Å; N72-S423 PolarHBondContact OD1-O 2.76Å
73	I	96.9	Very high	93	Very high	1 Å²	1	29 Å²	29	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.9	173.4	-66.5	176	0	0	0	106.8	F61 L64 S65 Y328 G419 R420	F61-I73 HydrophobicContact CD2-CG2 3.85Å; F61-I73 HydrophobicContact CE2-CB 4.03Å; F61-I73 HydrophobicContact CE2-CD1 4.13Å; F61-I73 HydrophobicContact CE2-CG2 3.8Å; F61-I73 HydrophobicContact CZ-CD1 4.5Å; L64-I73 HydrophobicContact CB-CD1 4.1Å; L64-I73 HydrophobicContact CB-CG2 4.34Å; L64-I73 HydrophobicContact CD1-CG2 4.21Å; S65-I73 VanDerWaalsContact CA-CD1 3.45Å; I73-Y328 WeakPolarHBondContact CA-OH 3.17Å; I73-G419 CarbonylContact O-C 3.46Å; I73-G419 WeakPolarHBondContact O-CA 3.29Å; I73-R420 HydrophobicContact CB-CB 4.26Å; I73-R420 VanDerWaalsContact CD1-NH2 3.31Å; I73-R420 PolarHBondContact N-O 3.18Å; I73-R420 PolarHBondContact O-N 3.39Å
74	F	95.6	Very high	93	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	113.3	172.5	-172.7	-113.8	0	0	0	110.3	L324 E326 Y328 A368 V370 F405 F417	F74-L324 HydrophobicContact CB-CB 4.01Å; F74-L324 HydrophobicContact CB-CD1 4.09Å; F74-L324 HydrophobicContact CG-CB 4.27Å; F74-E326 HydrophobicContact CB-CB 4.38Å; F74-E326 HydrophobicContact CB-CG 4.07Å; F74-Y328 PolarHBondContact N-OH 2.78Å; F74-Y328 WeakPolarHBondContact O-CE2 3.13Å; F74-A368 HydrophobicContact CD1-CB 3.64Å; F74-A368 HydrophobicContact CE1-CB 3.72Å; F74-V370 HydrophobicContact CD1-CB 4.35Å; F74-V370 HydrophobicContact CD1-CG1 3.87Å; F74-V370 HydrophobicContact CD2-CG1 3.94Å; F74-V370 HydrophobicContact CE1-CB 3.59Å; F74-V370 HydrophobicContact CE1-CG1 3.58Å; F74-V370 HydrophobicContact CE2-CB 4.04Å; F74-V370 HydrophobicContact CE2-CG1 3.65Å; F74-V370 HydrophobicContact CG-CG1 4.05Å; F74-V370 HydrophobicContact CZ-CB 3.4Å; F74-V370 VanDerWaalsContact CZ-CB 3.4Å; F74-V370 HydrophobicContact CZ-CG1 3.47Å; F74-V370 VanDerWaalsContact CZ-CG1 3.47Å; F74-V370 HydrophobicContact CZ-CG2 4.24Å; F74-F405 AromaticContact CD2-CE2 3.91Å; F74-F405 HydrophobicContact CD2-CE2 3.91Å; F74-F405 AromaticContact CD2-CZ 3.61Å; F74-F405 HydrophobicContact CD2-CZ 3.61Å; F74-F405 AromaticContact CE2-CE2 3.74Å; F74-F405 HydrophobicContact CE2-CE2 3.74Å; F74-F405 AromaticContact CE2-CZ 3.94Å; F74-F405 HydrophobicContact CE2-CZ 3.94Å; F74-F417 AromaticContact CE1-CD1 3.69Å; F74-F417 HydrophobicContact CE1-CD1 3.69Å; F74-F417 HydrophobicContact CE1-CE1 4.04Å; F74-F417 HydrophobicContact CE2-CB 3.65Å; F74-F417 AromaticContact CE2-CD1 3.91Å; F74-F417 HydrophobicContact CE2-CD1 3.91Å; F74-F417 HydrophobicContact CE2-CG 4.05Å; F74-F417 HydrophobicContact CZ-CB 3.77Å; F74-F417 AromaticContact CZ-CD1 3.17Å; F74-F417 HydrophobicContact CZ-CD1 3.17Å; F74-F417 AromaticContact CZ-CE1 3.84Å; F74-F417 HydrophobicContact CZ-CE1 3.84Å; F74-F417 AromaticContact CZ-CG 3.61Å; F74-F417 HydrophobicContact CZ-CG 3.61Å
75	V	96.3	Very high	92.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	154.5	-173.2	63	0	0	0	0	109.6	L60 L64 P77 I80 Y328 F417 F418	L60-V75 HydrophobicContact CD2-CG2 3.88Å; L64-V75 HydrophobicContact CD1-CB 4.06Å; L64-V75 HydrophobicContact CD1-CG1 4Å; L64-V75 HydrophobicContact CD1-CG2 4.17Å; V75-P77 HydrophobicContact CG1-CG 4.26Å; V75-P77 WeakPolarHBondContact O-CD 3.5Å; V75-I80 HydrophobicContact CG2-CD1 3.3Å; V75-Y328 HydrophobicContact CB-CE2 4.46Å; V75-F417 WeakPolarHBondContact O-CA 3.29Å; V75-F418 HydrophobicContact CG1-CB 4.5Å; V75-F418 WeakPolarHBondContact CG1-O 3.2Å; V75-F418 PolarHBondContact N-O 3.28Å; V75-F418 PolarHBondContact O-N 3.48Å
76	S	95.4	Very high	92.8	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	16%	0.16	C	C	.	.			trans	-108.5	93.1	167.1	-178.3	0	0	0	0	111.1	L78 S79 I80 I210 H366 L416	S76-L78 VanDerWaalsContact C-N 3.26Å; S76-L78 PolarHBondContact O-N 3.16Å; S76-S79 PolarHBondContact O-N 3.49Å; S76-S79 WeakPolarHBondContact OG-CB 3.46Å; S76-S79 PolarHBondContact OG-N 2.81Å; S76-I80 WeakPolarHBondContact O-CD1 3.45Å; S76-I80 WeakPolarHBondContact O-CG1 3.45Å; S76-I80 PolarHBondContact O-N 2.96Å; S76-I80 VanDerWaalsContact O-N 3.07Å; S76-I210 VanDerWaalsContact CB-CG2 3.47Å; S76-H366 PolarHBondContact N-NE2 3.27Å; S76-H366 VanDerWaalsContact N-NE2 3.12Å; S76-L416 VanDerWaalsContact CA-O 3.24Å; S76-L416 WeakPolarHBondContact CA-O 3.46Å; S76-L416 VanDerWaalsContact CB-O 3.26Å; S76-L416 WeakPolarHBondContact CB-O 3.19Å; S76-L416 PolarHBondContact OG-O 3.29Å
77	P	95.1	Very high	92.9	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-38.4	179.4	-24	34.8	0	0	0	112.4	F56 A57 V75 I80 S81 F418	F56-P77 HydrophobicContact CD1-CB 4.15Å; F56-P77 HydrophobicContact CE1-CB 4.32Å; F56-P77 WeakPolarHBondContact CE1-O 3.44Å; A57-P77 HydrophobicContact CB-CB 3.5Å; A57-P77 HydrophobicContact CB-CG 3.5Å; A57-P77 VanDerWaalsContact CB-CG 3.5Å; V75-P77 HydrophobicContact CG1-CG 4.26Å; V75-P77 WeakPolarHBondContact O-CD 3.5Å; P77-I80 PolarHBondContact O-N 3.21Å; P77-S81 WeakPolarHBondContact O-CB 3.21Å; P77-S81 PolarHBondContact O-N 3.15Å; P77-F418 HydrophobicContact CG-CB 4.12Å
78	L	91.8	Very high	93	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.047	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-44	178.9	-177.6	66	0	0	0	112.1	N53 S76 S81 S82 F115 L118 I122 I415 L416	N53-L78 WeakPolarHBondContact ND2-CA 3.38Å; S76-L78 VanDerWaalsContact C-N 3.26Å; S76-L78 PolarHBondContact O-N 3.16Å; L78-S81 PolarHBondContact O-N 2.75Å; L78-S82 WeakPolarHBondContact O-CB 3.26Å; L78-S82 PolarHBondContact O-N 3.27Å; L78-F115 HydrophobicContact CD1-CE1 4.07Å; L78-L118 HydrophobicContact CD1-CD2 3.44Å; L78-L118 VanDerWaalsContact CD1-CD2 3.44Å; L78-L118 HydrophobicContact CD2-CD2 4.03Å; L78-L118 HydrophobicContact CD2-CG 4.45Å; L78-L118 HydrophobicContact CG-CD2 4.3Å; L78-I122 HydrophobicContact CD2-CD1 3.28Å; L78-I415 WeakPolarHBondContact CB-O 3.35Å; L78-L416 HydrophobicContact CD2-CD2 3.41Å; L78-L416 VanDerWaalsContact CD2-CD2 3.41Å
79	S	91.8	Very high	93.2	Very high	7 Å²	7	20.6 Å²	20.6	5%	0.049	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-44.3	179.5	-161.3	0	0	0	0	111.3	S76 S82 A83 N208	S76-S79 PolarHBondContact O-N 3.49Å; S76-S79 WeakPolarHBondContact OG-CB 3.46Å; S76-S79 PolarHBondContact OG-N 2.81Å; S79-S82 PolarHBondContact O-N 3.39Å; S79-A83 VanDerWaalsContact O-CB 3.27Å; S79-A83 WeakPolarHBondContact O-CB 3.41Å; S79-A83 PolarHBondContact O-N 3.46Å; S79-N208 PolarHBondContact O-ND2 3.36Å; S79-N208 VanDerWaalsContact O-ND2 3.13Å; S79-N208 PolarHBondContact OG-ND2 2.89Å; S79-N208 PolarHBondContact OG-OD1 3.3Å
80	I	94.9	Very high	93.6	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-45.5	175.9	-65.4	161.9	0	0	0	110.8	F56 L60 V75 S76 P77 S82 A83 M84 L330 H366	F56-I80 HydrophobicContact CE1-CB 4.15Å; F56-I80 HydrophobicContact CE1-CG2 3.96Å; F56-I80 HydrophobicContact CZ-CB 4.39Å; F56-I80 HydrophobicContact CZ-CG2 3.71Å; L60-I80 HydrophobicContact CD2-CD1 3.57Å; V75-I80 HydrophobicContact CG2-CD1 3.3Å; S76-I80 WeakPolarHBondContact O-CD1 3.45Å; S76-I80 WeakPolarHBondContact O-CG1 3.45Å; S76-I80 PolarHBondContact O-N 2.96Å; S76-I80 VanDerWaalsContact O-N 3.07Å; P77-I80 PolarHBondContact O-N 3.21Å; I80-S82 VanDerWaalsContact C-N 3.35Å; I80-S82 PolarHBondContact O-N 2.82Å; I80-A83 PolarHBondContact O-N 3.33Å; I80-M84 HydrophobicContact CG2-CG 4.19Å; I80-M84 WeakPolarHBondContact O-CB 3.38Å; I80-M84 WeakPolarHBondContact O-CG 3.26Å; I80-M84 PolarHBondContact O-N 3.31Å; I80-L330 HydrophobicContact CB-CD1 4.39Å; I80-L330 HydrophobicContact CD1-CD1 3.48Å; I80-L330 VanDerWaalsContact CD1-CD1 3.48Å; I80-L330 HydrophobicContact CG1-CD1 3.71Å; I80-L330 HydrophobicContact CG2-CD1 3.74Å; I80-H366 HydrophobicContact CD1-CB 4.37Å; I80-H366 HydrophobicContact CG1-CB 4.35Å
81	S	93.2	Very high	94.2	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.014	6%	0.055	C	C	.	.	H	α-helix	trans	-60.5	-45.1	179.4	-169.1	0	0	0	0	111.3	P77 L78 M84 A85 F105 F115	P77-S81 WeakPolarHBondContact O-CB 3.21Å; P77-S81 PolarHBondContact O-N 3.15Å; L78-S81 PolarHBondContact O-N 2.75Å; S81-M84 PolarHBondContact O-N 3Å; S81-A85 WeakPolarHBondContact O-CB 3.44Å; S81-A85 PolarHBondContact O-N 3.03Å; S81-F105 WeakPolarHBondContact OG-CE1 3.44Å; S81-F115 WeakPolarHBondContact OG-CZ 3.39Å
82	S	90.1	Very high	94.4	Very high	4 Å²	4	10.4 Å²	10.4	3%	0.028	5%	0.05	C	C	.	.	H	α-helix	trans	-61.6	-44.4	174.7	-172.9	0	0	0	0	112	L78 S79 I80 A85 M86 N119 Y157	L78-S82 WeakPolarHBondContact O-CB 3.26Å; L78-S82 PolarHBondContact O-N 3.27Å; S79-S82 PolarHBondContact O-N 3.39Å; I80-S82 VanDerWaalsContact C-N 3.35Å; I80-S82 PolarHBondContact O-N 2.82Å; S82-A85 WeakPolarHBondContact O-CB 3.37Å; S82-A85 PolarHBondContact O-N 2.81Å; S82-M86 PolarHBondContact O-N 3.11Å; S82-N119 PolarHBondContact OG-ND2 3.3Å; S82-Y157 WeakPolarHBondContact O-CE1 3.23Å
83	A	92.4	Very high	94.4	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65.7	-42.5	178.5	0	0	0	0	0	112.6	S79 I80 A85 M86 L206 N208	S79-A83 VanDerWaalsContact O-CB 3.27Å; S79-A83 WeakPolarHBondContact O-CB 3.41Å; S79-A83 PolarHBondContact O-N 3.46Å; I80-A83 PolarHBondContact O-N 3.33Å; A83-A85 VanDerWaalsContact C-N 3.29Å; A83-A85 PolarHBondContact O-N 3.49Å; A83-M86 HydrophobicContact CB-CE 4.31Å; A83-M86 WeakPolarHBondContact O-CB 3.28Å; A83-M86 PolarHBondContact O-N 3Å; A83-L206 HydrophobicContact CB-CD1 4.04Å; A83-L206 HydrophobicContact CB-CD2 3.88Å; A83-L206 HydrophobicContact CB-CG 4.28Å; A83-N208 HydrophobicContact CB-CB 4.24Å
84	M	95.1	Very high	94.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.1	-25.9	174.7	-71.6	-57.8	-69.3	0	0	112.5	I80 S81 M86 V87 Y88 M99 L103 L206 L334 M339 L361 V364	I80-M84 HydrophobicContact CG2-CG 4.19Å; I80-M84 WeakPolarHBondContact O-CB 3.38Å; I80-M84 WeakPolarHBondContact O-CG 3.26Å; I80-M84 PolarHBondContact O-N 3.31Å; S81-M84 PolarHBondContact O-N 3Å; M84-M86 VanDerWaalsContact C-N 3.26Å; M84-M86 PolarHBondContact O-N 3.11Å; M84-V87 WeakPolarHBondContact O-CA 3.33Å; M84-V87 WeakPolarHBondContact O-CB 3.44Å; M84-V87 PolarHBondContact O-N 3.1Å; M84-Y88 PolarHBondContact O-N 2.85Å; M84-M99 HydrophobicContact CE-CE 3.85Å; M84-M99 WeakPolarHBondContact O-CE 3.32Å; M84-L103 HydrophobicContact CB-CD1 3.7Å; M84-L103 HydrophobicContact CB-CD2 3.85Å; M84-L103 HydrophobicContact CB-CG 4.44Å; M84-L103 HydrophobicContact CG-CD2 4.27Å; M84-L206 HydrophobicContact CG-CD2 4.16Å; M84-L206 HydrophobicContact SD-CD2 3.41Å; M84-L206 WeakPolarHBondContact SD-CD2 3.46Å; M84-L334 HydrophobicContact CE-CD1 4.15Å; M84-L334 HydrophobicContact SD-CD1 4.26Å; M84-M339 HydrophobicContact CE-CE 4.07Å; M84-M339 HydrophobicContact CE-SD 3.32Å; M84-M339 WeakPolarHBondContact CE-SD 3.45Å; M84-L361 HydrophobicContact CE-CD2 3.8Å; M84-L361 HydrophobicContact SD-CD2 4Å; M84-V364 HydrophobicContact SD-CG1 4.27Å; M84-V364 HydrophobicContact SD-CG2 4.11Å
85	A	93	Very high	94.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.3	-28.1	172.8	0	0	0	0	0	112.3	S81 S82 A83 V87 Y88 L89 F105 H112 F115 Y157	S81-A85 WeakPolarHBondContact O-CB 3.44Å; S81-A85 PolarHBondContact O-N 3.03Å; S82-A85 WeakPolarHBondContact O-CB 3.37Å; S82-A85 PolarHBondContact O-N 2.81Å; A83-A85 VanDerWaalsContact C-N 3.29Å; A83-A85 PolarHBondContact O-N 3.49Å; A85-V87 VanDerWaalsContact C-N 3.32Å; A85-Y88 PolarHBondContact O-N 3.47Å; A85-L89 PolarHBondContact O-N 3.26Å; A85-F105 HydrophobicContact CB-CE2 3.98Å; A85-F105 HydrophobicContact CB-CZ 3.78Å; A85-H112 PolarHBondContact O-CE1 2.94Å; A85-F115 HydrophobicContact CB-CD2 3.68Å; A85-F115 HydrophobicContact CB-CE2 3.63Å; A85-F115 HydrophobicContact CB-CZ 4.43Å; A85-Y157 HydrophobicContact CB-CE1 3.92Å; A85-Y157 WeakPolarHBondContact CB-OH 3.39Å
86	M	93.3	Very high	94.5	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-37.5	168.4	-60.9	-169.9	-74.8	0	0	111.9	S82 A83 M84 L89 N135 L137 F149 Y157 A159 L206	S82-M86 PolarHBondContact O-N 3.11Å; A83-M86 HydrophobicContact CB-CE 4.31Å; A83-M86 WeakPolarHBondContact O-CB 3.28Å; A83-M86 PolarHBondContact O-N 3Å; M84-M86 VanDerWaalsContact C-N 3.26Å; M84-M86 PolarHBondContact O-N 3.11Å; M86-L89 WeakPolarHBondContact O-CB 3.12Å; M86-N135 HydrophobicContact CE-CB 3.99Å; M86-L137 HydrophobicContact CB-CD1 3.96Å; M86-L137 HydrophobicContact CE-CG 4.49Å; M86-F149 WeakPolarHBondContact O-CE2 3.37Å; M86-Y157 HydrophobicContact CG-CD1 3.8Å; M86-Y157 HydrophobicContact CG-CD2 3.57Å; M86-Y157 HydrophobicContact CG-CE1 4.2Å; M86-Y157 HydrophobicContact CG-CE2 3.99Å; M86-Y157 HydrophobicContact CG-CG 3.47Å; M86-Y157 VanDerWaalsContact CG-CG 3.47Å; M86-Y157 HydrophobicContact SD-CD2 4.49Å; M86-Y157 HydrophobicContact SD-CG 4.1Å; M86-A159 HydrophobicContact CE-CB 4.35Å; M86-A159 HydrophobicContact SD-CB 3.53Å; M86-A159 VanDerWaalsContact SD-CB 3.53Å; M86-L206 HydrophobicContact CE-CD1 3.88Å
87	V	95.9	Very high	94.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.2	-41.3	174.8	-179.9	0	0	0	0	110.2	M84 A85 L89 G90 A91 M99 L137 L206 V342 L350 M353 L361	M84-V87 WeakPolarHBondContact O-CA 3.33Å; M84-V87 WeakPolarHBondContact O-CB 3.44Å; M84-V87 PolarHBondContact O-N 3.1Å; A85-V87 VanDerWaalsContact C-N 3.32Å; V87-L89 VanDerWaalsContact C-N 3.27Å; V87-L89 PolarHBondContact O-N 3.27Å; V87-G90 PolarHBondContact O-N 3.15Å; V87-G90 VanDerWaalsContact O-N 3.15Å; V87-A91 PolarHBondContact O-N 3.34Å; V87-M99 HydrophobicContact CB-CE 3.73Å; V87-M99 HydrophobicContact CG1-CE 3.64Å; V87-M99 HydrophobicContact CG1-SD 4.14Å; V87-L137 HydrophobicContact CG2-CD2 3.77Å; V87-L206 HydrophobicContact CG2-CD2 4.2Å; V87-V342 HydrophobicContact CG1-CG2 3.87Å; V87-L350 HydrophobicContact CG1-CD2 4.11Å; V87-M353 VanDerWaalsContact CA-CE 3.46Å; V87-M353 HydrophobicContact CB-CE 4.19Å; V87-M353 HydrophobicContact CG1-CE 3.95Å; V87-M353 WeakPolarHBondContact O-CE 3.49Å; V87-L361 HydrophobicContact CG1-CD2 4.32Å; V87-L361 HydrophobicContact CG2-CD1 4.45Å; V87-L361 HydrophobicContact CG2-CD2 4.28Å
88	Y	95.2	Very high	94.6	Very high	39 Å²	39	23.9 Å²	23.9	15%	0.153	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-34.8	179	179.6	-114	0	0	0	112.6	M84 A85 G90 A91 A96 M99 A100 F105 H112	M84-Y88 PolarHBondContact O-N 2.85Å; A85-Y88 PolarHBondContact O-N 3.47Å; Y88-G90 PolarHBondContact O-N 3.02Å; Y88-A91 WeakPolarHBondContact O-CB 3.41Å; Y88-A91 PolarHBondContact O-N 3.08Å; Y88-A96 HydrophobicContact CD2-CB 4.38Å; Y88-A96 HydrophobicContact CE2-CB 3.9Å; Y88-A96 VanDerWaalsContact CE2-O 3.29Å; Y88-A96 WeakPolarHBondContact CE2-O 3.37Å; Y88-M99 HydrophobicContact CD2-CB 3.93Å; Y88-A100 HydrophobicContact CE2-CB 3.92Å; Y88-F105 AromaticContact CD1-CD2 3.99Å; Y88-F105 HydrophobicContact CD1-CD2 3.99Å; Y88-F105 HydrophobicContact CD1-CE2 4.15Å; Y88-F105 HydrophobicContact CE1-CD2 4.22Å; Y88-F105 HydrophobicContact CG-CD2 4.26Å; Y88-F105 HydrophobicContact CG-CE2 4.25Å; Y88-H112 AromaticContact CD1-CE1 3.86Å
89	L	93.7	Very high	94.8	Very high	24 Å²	24	23.4 Å²	23.4	13%	0.126	13%	0.134	C	C	.	.	H	α-helix	trans	-53.1	-37.9	176	-179.3	67.4	0	0	0	112.5	A85 M86 V87 H112 F149 D152 T153	A85-L89 PolarHBondContact O-N 3.26Å; M86-L89 WeakPolarHBondContact O-CB 3.12Å; V87-L89 VanDerWaalsContact C-N 3.27Å; V87-L89 PolarHBondContact O-N 3.27Å; L89-H112 VanDerWaalsContact CA-CE1 3.45Å; L89-H112 WeakPolarHBondContact CA-CE1 3.42Å; L89-H112 VanDerWaalsContact CB-CE1 3.49Å; L89-H112 WeakPolarHBondContact CB-CE1 3.49Å; L89-H112 WeakPolarHBondContact CD1-NE2 3.29Å; L89-F149 HydrophobicContact CB-CE2 4.18Å; L89-F149 HydrophobicContact CD2-CD2 4.09Å; L89-F149 HydrophobicContact CD2-CE2 4.05Å; L89-F149 HydrophobicContact CG-CD2 4.2Å; L89-F149 HydrophobicContact CG-CE2 4.22Å; L89-D152 HydrophobicContact CD1-CB 4.21Å; L89-D152 HydrophobicContact CD2-CB 3.69Å; L89-D152 HydrophobicContact CG-CB 4.43Å; L89-T153 HydrophobicContact CD2-CG2 3.81Å
90	G	95	Very high	94.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-95.8	-6.3	178.9	0	0	0	0	0	114.8	V87 Y88 L350 G352	V87-G90 PolarHBondContact O-N 3.15Å; V87-G90 VanDerWaalsContact O-N 3.15Å; Y88-G90 PolarHBondContact O-N 3.02Å; G90-L350 CarbonylContact O-C 3.56Å; G90-L350 WeakPolarHBondContact O-CA 3.34Å; G90-G352 WeakPolarHBondContact O-CA 3.44Å; G90-G352 PolarHBondContact O-N 3.45Å
91	A	96.2	Very high	94.8	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.033	17%	0.171	C	C	.	.			trans	-78.5	146.5	-179.3	0	0	0	0	0	111.9	V87 Y88 T95 A96 M99 D349 L350	V87-A91 PolarHBondContact O-N 3.34Å; Y88-A91 WeakPolarHBondContact O-CB 3.41Å; Y88-A91 PolarHBondContact O-N 3.08Å; A91-T95 HydrophobicContact CB-CG2 4.03Å; A91-A96 HydrophobicContact CB-CB 3.98Å; A91-M99 HydrophobicContact CB-SD 3.78Å; A91-D349 CarbonylContact C-O 3.57Å; A91-D349 WeakPolarHBondContact CA-O 3.27Å; A91-L350 HydrophobicContact CB-CD2 4.02Å
92	K	95.9	Very high	94.8	Very high	98 Å²	98	32 Å²	32	43%	0.426	17%	0.173	S	C	.	.			trans	-133.4	173.6	174.6	-56.5	-65.1	168.3	-152.7	0	110.9	T95 A96 D349	K92-T95 WeakPolarHBondContact O-CB 3.28Å; K92-T95 PolarHBondContact O-N 2.92Å; K92-A96 PolarHBondContact O-N 2.9Å; K92-D349 HydrophobicContact CB-CB 4.48Å; K92-D349 WeakPolarHBondContact CB-OD2 3.35Å; K92-D349 PolarHBondContact N-O 2.97Å
93	G	95.6	Very high	95	Very high	46 Å²	46	31.8 Å²	31.8	47%	0.474	17%	0.171	S	C	.	.	H	α-helix	trans	52	-137.2	174.7	0	0	0	0	0	115.2	T95 A96 T97	G93-T95 VanDerWaalsContact C-N 3.27Å; G93-T95 PolarHBondContact O-N 3.39Å; G93-A96 PolarHBondContact O-N 3.37Å; G93-T97 PolarHBondContact O-N 3.36Å; G93-T97 VanDerWaalsContact O-N 3.11Å; G93-T97 PolarHBondContact O-OG1 2.75Å
94	D	97	Very high	94.9	Very high	114 Å²	114	33.5 Å²	33.5	61%	0.61	18%	0.183	S	C	*	.	H	α-helix	trans	-65.3	-31.6	179.6	-69.9	-22.3	0	0	0	112.3	T97 Q98	D94-T97 PolarHBondContact O-N 3.17Å; D94-Q98 WeakPolarHBondContact O-CB 3.39Å; D94-Q98 VanDerWaalsContact O-CG 3.29Å; D94-Q98 WeakPolarHBondContact O-CG 3.41Å; D94-Q98 PolarHBondContact O-N 3.43Å
95	T	97.8	Very high	94.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-50.8	175.6	-64.4	0	0	0	0	110.4	A91 K92 G93 T97 Q98 M99 V342 D349 L350	A91-T95 HydrophobicContact CB-CG2 4.03Å; K92-T95 WeakPolarHBondContact O-CB 3.28Å; K92-T95 PolarHBondContact O-N 2.92Å; G93-T95 VanDerWaalsContact C-N 3.27Å; G93-T95 PolarHBondContact O-N 3.39Å; T95-T97 VanDerWaalsContact C-N 3.34Å; T95-T97 PolarHBondContact O-N 3.18Å; T95-Q98 PolarHBondContact O-N 3.19Å; T95-M99 HydrophobicContact CG2-SD 4.19Å; T95-M99 WeakPolarHBondContact O-CB 3.39Å; T95-M99 VanDerWaalsContact O-CG 3.22Å; T95-M99 WeakPolarHBondContact O-CG 3.47Å; T95-M99 PolarHBondContact O-N 3.22Å; T95-V342 HydrophobicContact CG2-CB 3.78Å; T95-V342 HydrophobicContact CG2-CG2 3.99Å; T95-D349 PolarHBondContact OG1-N 3.04Å; T95-L350 HydrophobicContact CG2-CD2 4.32Å
96	A	95.8	Very high	93.6	Very high	15 Å²	15	37.6 Å²	37.6	12%	0.124	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-42.8	175.6	0	0	0	0	0	111.8	Y88 A91 K92 G93 M99 A100	Y88-A96 HydrophobicContact CD2-CB 4.38Å; Y88-A96 HydrophobicContact CE2-CB 3.9Å; Y88-A96 VanDerWaalsContact CE2-O 3.29Å; Y88-A96 WeakPolarHBondContact CE2-O 3.37Å; A91-A96 HydrophobicContact CB-CB 3.98Å; K92-A96 PolarHBondContact O-N 2.9Å; G93-A96 PolarHBondContact O-N 3.37Å; A96-M99 PolarHBondContact O-N 2.88Å; A96-A100 WeakPolarHBondContact O-CB 2.84Å; A96-A100 PolarHBondContact O-N 2.91Å
97	T	95.6	Very high	91.8	Very high	93 Å²	93	43 Å²	43	57%	0.571	25%	0.245	S	C	*	.	H	α-helix	trans	-62.5	-46	-178.7	-58.5	0	0	0	0	112	G93 D94 T95 K101	G93-T97 PolarHBondContact O-N 3.36Å; G93-T97 VanDerWaalsContact O-N 3.11Å; G93-T97 PolarHBondContact O-OG1 2.75Å; D94-T97 PolarHBondContact O-N 3.17Å; T95-T97 VanDerWaalsContact C-N 3.34Å; T95-T97 PolarHBondContact O-N 3.18Å; T97-K101 WeakPolarHBondContact O-CB 3.49Å; T97-K101 PolarHBondContact O-N 3.41Å; T97-K101 VanDerWaalsContact O-N 3.1Å
98	Q	97.1	Very high	90.1	Very high	42 Å²	42	45 Å²	45	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-43.3	176.4	-73.2	171.9	17.9	0	0	111.7	D94 T95 K101 A102 T340 D341	D94-Q98 WeakPolarHBondContact O-CB 3.39Å; D94-Q98 VanDerWaalsContact O-CG 3.29Å; D94-Q98 WeakPolarHBondContact O-CG 3.41Å; D94-Q98 PolarHBondContact O-N 3.43Å; T95-Q98 PolarHBondContact O-N 3.19Å; Q98-K101 PolarHBondContact O-N 2.99Å; Q98-A102 WeakPolarHBondContact O-CB 3.49Å; Q98-A102 PolarHBondContact O-N 2.68Å; Q98-T340 VanDerWaalsContact OE1-N 3.1Å; Q98-T340 PolarHBondContact OE1-OG1 3.44Å; Q98-D341 PolarHBondContact NE2-OD1 3.15Å; Q98-D341 PolarHBondContact NE2-OD2 2.96Å
99	M	95.8	Very high	88.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-48.7	177.5	-73.3	-178.4	77.4	0	0	112.2	M84 V87 Y88 A91 T95 A96 K101 A102 L103 M339 V342	M84-M99 HydrophobicContact CE-CE 3.85Å; M84-M99 WeakPolarHBondContact O-CE 3.32Å; V87-M99 HydrophobicContact CB-CE 3.73Å; V87-M99 HydrophobicContact CG1-CE 3.64Å; V87-M99 HydrophobicContact CG1-SD 4.14Å; Y88-M99 HydrophobicContact CD2-CB 3.93Å; A91-M99 HydrophobicContact CB-SD 3.78Å; T95-M99 HydrophobicContact CG2-SD 4.19Å; T95-M99 WeakPolarHBondContact O-CB 3.39Å; T95-M99 VanDerWaalsContact O-CG 3.22Å; T95-M99 WeakPolarHBondContact O-CG 3.47Å; T95-M99 PolarHBondContact O-N 3.22Å; A96-M99 PolarHBondContact O-N 2.88Å; M99-K101 VanDerWaalsContact C-N 3.3Å; M99-K101 PolarHBondContact O-N 3.42Å; M99-A102 PolarHBondContact O-N 2.8Å; M99-L103 HydrophobicContact CB-CD1 4.42Å; M99-L103 HydrophobicContact CE-CD1 4.43Å; M99-L103 VanDerWaalsContact O-CB 3.29Å; M99-L103 WeakPolarHBondContact O-CB 3.4Å; M99-L103 VanDerWaalsContact O-CG 3.27Å; M99-L103 WeakPolarHBondContact O-CG 3.47Å; M99-L103 PolarHBondContact O-N 3.18Å; M99-M339 HydrophobicContact CG-CE 4.41Å; M99-M339 HydrophobicContact CG-CG 3.79Å; M99-M339 HydrophobicContact CG-SD 3.85Å; M99-V342 HydrophobicContact SD-CB 4.33Å; M99-V342 HydrophobicContact SD-CG2 3.97Å
100	A	93.3	Very high	87.7	Confident	6 Å²	6	53.6 Å²	53.6	5%	0.05	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-43.6	178.7	0	0	0	0	0	111.4	Y88 A96 S104 F105	Y88-A100 HydrophobicContact CE2-CB 3.92Å; A96-A100 WeakPolarHBondContact O-CB 2.84Å; A96-A100 PolarHBondContact O-N 2.91Å; A100-S104 CarbonylContact O-C 3.19Å; A100-S104 WeakPolarHBondContact O-CA 3.43Å; A100-S104 PolarHBondContact O-N 3.48Å; A100-S104 VanDerWaalsContact O-N 3.1Å; A100-F105 HydrophobicContact CB-CB 4.29Å; A100-F105 PolarHBondContact O-N 2.9Å
101	K	93.3	Very high	87.4	Confident	177 Å²	177	54.1 Å²	54.1	77%	0.77	32%	0.323	S	S	*	.	H	α-helix	trans	-63.9	-49	177.1	-176.7	178.8	177.4	-178.1	0	112.5	T97 Q98 M99 S104	T97-K101 WeakPolarHBondContact O-CB 3.49Å; T97-K101 PolarHBondContact O-N 3.41Å; T97-K101 VanDerWaalsContact O-N 3.1Å; Q98-K101 PolarHBondContact O-N 2.99Å; M99-K101 VanDerWaalsContact C-N 3.3Å; M99-K101 PolarHBondContact O-N 3.42Å; K101-S104 PolarHBondContact O-N 3.37Å
102	A	94.7	Very high	87.1	Confident	6 Å²	6	55.2 Å²	55.2	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-69.4	-33.1	-176.2	0	0	0	0	0	112.9	F56 Q98 M99 S104 M337 M339	F56-A102 WeakPolarHBondContact CD2-O 3.16Å; Q98-A102 WeakPolarHBondContact O-CB 3.49Å; Q98-A102 PolarHBondContact O-N 2.68Å; M99-A102 PolarHBondContact O-N 2.8Å; A102-S104 VanDerWaalsContact C-N 3.25Å; A102-M337 HydrophobicContact CB-CB 4.2Å; A102-M337 WeakPolarHBondContact O-CE 3.32Å; A102-M339 HydrophobicContact CB-CB 3.81Å; A102-M339 HydrophobicContact CB-CE 3.71Å
103	L	92.8	Very high	86.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.2	175.7	-61.1	166.6	0	0	0	112.6	F56 M84 M99 F105 M339	F56-L103 HydrophobicContact CD2-CD2 4.02Å; F56-L103 HydrophobicContact CE1-CD2 4.48Å; F56-L103 HydrophobicContact CE2-CD2 3.65Å; F56-L103 HydrophobicContact CZ-CD2 3.9Å; M84-L103 HydrophobicContact CB-CD1 3.7Å; M84-L103 HydrophobicContact CB-CD2 3.85Å; M84-L103 HydrophobicContact CB-CG 4.44Å; M84-L103 HydrophobicContact CG-CD2 4.27Å; M99-L103 HydrophobicContact CB-CD1 4.42Å; M99-L103 HydrophobicContact CE-CD1 4.43Å; M99-L103 VanDerWaalsContact O-CB 3.29Å; M99-L103 WeakPolarHBondContact O-CB 3.4Å; M99-L103 VanDerWaalsContact O-CG 3.27Å; M99-L103 WeakPolarHBondContact O-CG 3.47Å; M99-L103 PolarHBondContact O-N 3.18Å; L103-F105 HydrophobicContact CB-CD1 3.88Å; L103-F105 HydrophobicContact CB-CD2 4Å; L103-F105 HydrophobicContact CB-CE1 3.68Å; L103-F105 HydrophobicContact CB-CE2 3.8Å; L103-F105 HydrophobicContact CB-CG 4.04Å; L103-F105 HydrophobicContact CB-CZ 3.63Å; L103-F105 HydrophobicContact CD1-CD2 4.12Å; L103-F105 HydrophobicContact CD1-CE2 3.37Å; L103-F105 HydrophobicContact CD1-CZ 3.6Å; L103-F105 HydrophobicContact CG-CE2 4.2Å; L103-F105 HydrophobicContact CG-CZ 4.13Å; L103-F105 WeakPolarHBondContact O-CD1 3.21Å; L103-F105 PolarHBondContact O-N 2.91Å; L103-M339 HydrophobicContact CD1-CE 4.04Å; L103-M339 HydrophobicContact CD2-CE 3.89Å; L103-M339 HydrophobicContact CG-CE 3.64Å
104	S	91.8	Very high	86.3	Confident	36 Å²	36	52.6 Å²	52.6	25%	0.252	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	27.1	-175.8	-57.6	0	0	0	0	114.1	S52 D55 A100 K101 A102 T106	S52-S104 WeakPolarHBondContact CB-O 3.34Å; S52-S104 WeakPolarHBondContact O-CB 3.45Å; S52-S104 PolarHBondContact OG-O 3.47Å; D55-S104 WeakPolarHBondContact CB-OG 3.45Å; A100-S104 CarbonylContact O-C 3.19Å; A100-S104 WeakPolarHBondContact O-CA 3.43Å; A100-S104 PolarHBondContact O-N 3.48Å; A100-S104 VanDerWaalsContact O-N 3.1Å; K101-S104 PolarHBondContact O-N 3.37Å; A102-S104 VanDerWaalsContact C-N 3.25Å; S104-T106 PolarHBondContact O-N 2.97Å
105	F	88	Confident	85.8	Confident	14 Å²	14	47.3 Å²	47.3	6%	0.061	28%	0.28	C	S	.	.			trans	-67.6	129.3	176.8	-64.3	-19.6	0	0	0	110.2	S81 A85 Y88 A100 L103 S107 V111 F115	S81-F105 WeakPolarHBondContact OG-CE1 3.44Å; A85-F105 HydrophobicContact CB-CE2 3.98Å; A85-F105 HydrophobicContact CB-CZ 3.78Å; Y88-F105 AromaticContact CD1-CD2 3.99Å; Y88-F105 HydrophobicContact CD1-CD2 3.99Å; Y88-F105 HydrophobicContact CD1-CE2 4.15Å; Y88-F105 HydrophobicContact CE1-CD2 4.22Å; Y88-F105 HydrophobicContact CG-CD2 4.26Å; Y88-F105 HydrophobicContact CG-CE2 4.25Å; A100-F105 HydrophobicContact CB-CB 4.29Å; A100-F105 PolarHBondContact O-N 2.9Å; L103-F105 HydrophobicContact CB-CD1 3.88Å; L103-F105 HydrophobicContact CB-CD2 4Å; L103-F105 HydrophobicContact CB-CE1 3.68Å; L103-F105 HydrophobicContact CB-CE2 3.8Å; L103-F105 HydrophobicContact CB-CG 4.04Å; L103-F105 HydrophobicContact CB-CZ 3.63Å; L103-F105 HydrophobicContact CD1-CD2 4.12Å; L103-F105 HydrophobicContact CD1-CE2 3.37Å; L103-F105 HydrophobicContact CD1-CZ 3.6Å; L103-F105 HydrophobicContact CG-CE2 4.2Å; L103-F105 HydrophobicContact CG-CZ 4.13Å; L103-F105 WeakPolarHBondContact O-CD1 3.21Å; L103-F105 PolarHBondContact O-N 2.91Å; F105-S107 PolarHBondContact O-N 2.96Å; F105-V111 HydrophobicContact CB-CG2 4Å; F105-V111 HydrophobicContact CD1-CG1 4.22Å; F105-V111 HydrophobicContact CD2-CG1 3.85Å; F105-V111 HydrophobicContact CE1-CG1 4.33Å; F105-V111 HydrophobicContact CE2-CG1 3.97Å; F105-V111 HydrophobicContact CG-CG1 3.99Å; F105-V111 HydrophobicContact CG-CG2 4.25Å; F105-V111 HydrophobicContact CZ-CG1 4.23Å; F105-F115 AromaticContact CE1-CE2 3.62Å; F105-F115 HydrophobicContact CE1-CE2 3.62Å; F105-F115 AromaticContact CE1-CZ 3.84Å; F105-F115 HydrophobicContact CE1-CZ 3.84Å; F105-F115 AromaticContact CZ-CE2 3.72Å; F105-F115 HydrophobicContact CZ-CE2 3.72Å; F105-F115 HydrophobicContact CZ-CZ 4.14Å
106	T	71.9	Confident	85.4	Confident	73 Å²	73	50.5 Å²	50.5	45%	0.448	30%	0.295	S	S	.	.			trans	-66.9	119.8	168.2	45.3	0	0	0	0	108.2	M48 S104 G108	M48-T106 HydrophobicContact CB-CG2 4.29Å; M48-T106 HydrophobicContact SD-CG2 4.46Å; S104-T106 PolarHBondContact O-N 2.97Å; T106-G108 PolarHBondContact O-N 3.05Å
107	S	54.6	Low	85	Confident	115 Å²	115	53.4 Å²	53.4	80%	0.804	31%	0.308	S	S	*	.	S	Bend	trans	-55	105.1	-176.1	-46.9	0	0	0	0	110.7	F105	F105-S107 PolarHBondContact O-N 2.96Å
108	G	61.1	Low	84.5	Confident	42 Å²	42	49.2 Å²	49.2	43%	0.433	28%	0.282	S	S	.	.	S	Bend	trans	175.5	160.1	179.5	0	0	0	0	0	114.1	T106 G110	T106-G108 PolarHBondContact O-N 3.05Å; G108-G110 PolarHBondContact O-N 3.03Å
109	E	58.4	Low	83.8	Confident	198 Å²	198	48.6 Å²	48.6	93%	0.925	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-5	-178.2	-63	-178.6	161.2	0	0	114
110	G	81.1	Confident	83.3	Confident	46 Å²	46	51.2 Å²	51.2	47%	0.474	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-10	-175.2	0	0	0	0	0	116	G108 H112 A113 Y114	G108-G110 PolarHBondContact O-N 3.03Å; G110-H112 PolarHBondContact O-N 2.77Å; G110-A113 PolarHBondContact O-N 2.81Å; G110-Y114 WeakPolarHBondContact O-CB 3.41Å; G110-Y114 PolarHBondContact O-N 2.78Å
111	V	86.8	Confident	82.9	Confident	11 Å²	11	54 Å²	54	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-46	-174.2	175	0	0	0	0	111.7	F105 Y114 F115	F105-V111 HydrophobicContact CB-CG2 4Å; F105-V111 HydrophobicContact CD1-CG1 4.22Å; F105-V111 HydrophobicContact CD2-CG1 3.85Å; F105-V111 HydrophobicContact CE1-CG1 4.33Å; F105-V111 HydrophobicContact CE2-CG1 3.97Å; F105-V111 HydrophobicContact CG-CG1 3.99Å; F105-V111 HydrophobicContact CG-CG2 4.25Å; F105-V111 HydrophobicContact CZ-CG1 4.23Å; V111-Y114 WeakPolarHBondContact O-CB 3.2Å; V111-Y114 PolarHBondContact O-N 2.84Å; V111-F115 HydrophobicContact CG1-CD2 3.94Å; V111-F115 HydrophobicContact CG1-CE2 3.87Å; V111-F115 VanDerWaalsContact O-CD2 3.32Å; V111-F115 WeakPolarHBondContact O-CD2 3.09Å; V111-F115 PolarHBondContact O-N 2.63Å
112	H	90.2	Very high	82.3	Confident	26 Å²	26	45.7 Å²	45.7	12%	0.12	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-39.7	-177.8	-54.3	-62.4	0	0	0	112	A85 Y88 L89 G110 Y114 F115 Q116 F156 Y157	A85-H112 PolarHBondContact O-CE1 2.94Å; Y88-H112 AromaticContact CD1-CE1 3.86Å; L89-H112 VanDerWaalsContact CA-CE1 3.45Å; L89-H112 WeakPolarHBondContact CA-CE1 3.42Å; L89-H112 VanDerWaalsContact CB-CE1 3.49Å; L89-H112 WeakPolarHBondContact CB-CE1 3.49Å; L89-H112 WeakPolarHBondContact CD1-NE2 3.29Å; G110-H112 PolarHBondContact O-N 2.77Å; H112-Y114 VanDerWaalsContact C-N 3.31Å; H112-Y114 PolarHBondContact O-N 3.11Å; H112-F115 PolarHBondContact O-N 3.33Å; H112-Q116 WeakPolarHBondContact O-CB 3.2Å; H112-Q116 PolarHBondContact O-N 3.01Å; H112-F156 HydrophobicContact CB-CB 4.14Å; H112-F156 HydrophobicContact CB-CD1 3.9Å; H112-F156 HydrophobicContact CB-CD2 3.74Å; H112-F156 HydrophobicContact CB-CE1 4.19Å; H112-F156 HydrophobicContact CB-CE2 4.05Å; H112-F156 HydrophobicContact CB-CG 3.67Å; H112-F156 HydrophobicContact CB-CZ 4.26Å; H112-Y157 AromaticContact ND1-CE2 3.81Å; H112-Y157 AromaticContact ND1-CZ 3.7Å; H112-Y157 PolarHBondContact ND1-OH 3Å
113	A	88.3	Confident	81.6	Confident	37 Å²	37	48.6 Å²	48.6	31%	0.306	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-35.2	173.8	0	0	0	0	0	112.1	G110 Q116 N117	G110-A113 PolarHBondContact O-N 2.81Å; A113-Q116 PolarHBondContact O-N 3.19Å; A113-N117 PolarHBondContact O-N 2.63Å; A113-N117 VanDerWaalsContact O-N 3.08Å; A113-N117 PolarHBondContact O-ND2 2.91Å
114	Y	86.5	Confident	81.1	Confident	52 Å²	52	50.4 Å²	50.4	20%	0.204	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-52.1	172.5	165.8	-103.1	0	0	0	111.2	A49 G110 V111 H112 Q116 N117 L118	A49-Y114 HydrophobicContact CB-CD1 4.28Å; A49-Y114 HydrophobicContact CB-CD2 3.62Å; A49-Y114 HydrophobicContact CB-CE1 3.94Å; A49-Y114 HydrophobicContact CB-CE2 3.23Å; A49-Y114 HydrophobicContact CB-CG 4.11Å; A49-Y114 PolarHBondContact O-OH 3.12Å; G110-Y114 WeakPolarHBondContact O-CB 3.41Å; G110-Y114 PolarHBondContact O-N 2.78Å; V111-Y114 WeakPolarHBondContact O-CB 3.2Å; V111-Y114 PolarHBondContact O-N 2.84Å; H112-Y114 VanDerWaalsContact C-N 3.31Å; H112-Y114 PolarHBondContact O-N 3.11Å; Y114-Q116 VanDerWaalsContact C-N 3.28Å; Y114-Q116 PolarHBondContact O-N 3.15Å; Y114-N117 PolarHBondContact O-N 3.25Å; Y114-L118 HydrophobicContact CE1-CD2 3.81Å; Y114-L118 HydrophobicContact CE2-CD2 4.43Å; Y114-L118 VanDerWaalsContact O-CB 3.3Å; Y114-L118 WeakPolarHBondContact O-CB 3.37Å; Y114-L118 PolarHBondContact O-N 2.96Å
115	F	87.6	Confident	80.3	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.013	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-34.4	177.9	-81.2	-68.1	0	0	0	112.8	L78 S81 A85 F105 V111 H112 L118 N119 Y157	L78-F115 HydrophobicContact CD1-CE1 4.07Å; S81-F115 WeakPolarHBondContact OG-CZ 3.39Å; A85-F115 HydrophobicContact CB-CD2 3.68Å; A85-F115 HydrophobicContact CB-CE2 3.63Å; A85-F115 HydrophobicContact CB-CZ 4.43Å; F105-F115 AromaticContact CE1-CE2 3.62Å; F105-F115 HydrophobicContact CE1-CE2 3.62Å; F105-F115 AromaticContact CE1-CZ 3.84Å; F105-F115 HydrophobicContact CE1-CZ 3.84Å; F105-F115 AromaticContact CZ-CE2 3.72Å; F105-F115 HydrophobicContact CZ-CE2 3.72Å; F105-F115 HydrophobicContact CZ-CZ 4.14Å; V111-F115 HydrophobicContact CG1-CD2 3.94Å; V111-F115 HydrophobicContact CG1-CE2 3.87Å; V111-F115 VanDerWaalsContact O-CD2 3.32Å; V111-F115 WeakPolarHBondContact O-CD2 3.09Å; V111-F115 PolarHBondContact O-N 2.63Å; H112-F115 PolarHBondContact O-N 3.33Å; F115-L118 HydrophobicContact CD1-CD2 4.32Å; F115-L118 HydrophobicContact CE1-CD2 4.43Å; F115-L118 PolarHBondContact O-N 2.87Å; F115-N119 WeakPolarHBondContact O-CB 3.22Å; F115-N119 PolarHBondContact O-N 2.97Å; F115-N119 PolarHBondContact O-ND2 2.95Å; F115-N119 VanDerWaalsContact O-ND2 3.12Å; F115-Y157 HydrophobicContact CB-CD1 4.38Å; F115-Y157 HydrophobicContact CB-CE1 3.63Å; F115-Y157 HydrophobicContact CD2-CE1 4.34Å; F115-Y157 HydrophobicContact CG-CE1 4.06Å
116	Q	88.5	Confident	79.9	Confident	68 Å²	68	59.2 Å²	59.2	32%	0.318	37%	0.367	S	S	.	.	H	α-helix	trans	-58.4	-50.4	173.3	-172.5	-178.2	26.3	0	0	111.6	H112 A113 Y114 A120 K155 F156	H112-Q116 WeakPolarHBondContact O-CB 3.2Å; H112-Q116 PolarHBondContact O-N 3.01Å; A113-Q116 PolarHBondContact O-N 3.19Å; Y114-Q116 VanDerWaalsContact C-N 3.28Å; Y114-Q116 PolarHBondContact O-N 3.15Å; Q116-A120 WeakPolarHBondContact O-CB 3.31Å; Q116-A120 PolarHBondContact O-N 3.32Å; Q116-A120 VanDerWaalsContact O-N 3.12Å; Q116-K155 PolarHBondContact NE2-O 3.18Å; Q116-F156 VanDerWaalsContact CA-O 3.31Å; Q116-F156 WeakPolarHBondContact CA-O 3.41Å; Q116-F156 HydrophobicContact CB-CD1 4.13Å
117	N	87.2	Confident	80.3	Confident	76 Å²	76	56.8 Å²	56.8	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-66.8	-42.1	178.9	-67.7	-30.4	0	0	0	111.8	A113 Y114 A120 D121	A113-N117 PolarHBondContact O-N 2.63Å; A113-N117 VanDerWaalsContact O-N 3.08Å; A113-N117 PolarHBondContact O-ND2 2.91Å; Y114-N117 PolarHBondContact O-N 3.25Å; N117-A120 PolarHBondContact O-N 3.36Å; N117-D121 PolarHBondContact O-N 2.92Å
118	L	85	Confident	81.6	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-44.1	-179.7	-177.2	63.9	0	0	0	112	L78 Y114 F115 A120 D121 I122 T412	L78-L118 HydrophobicContact CD1-CD2 3.44Å; L78-L118 VanDerWaalsContact CD1-CD2 3.44Å; L78-L118 HydrophobicContact CD2-CD2 4.03Å; L78-L118 HydrophobicContact CD2-CG 4.45Å; L78-L118 HydrophobicContact CG-CD2 4.3Å; Y114-L118 HydrophobicContact CE1-CD2 3.81Å; Y114-L118 HydrophobicContact CE2-CD2 4.43Å; Y114-L118 VanDerWaalsContact O-CB 3.3Å; Y114-L118 WeakPolarHBondContact O-CB 3.37Å; Y114-L118 PolarHBondContact O-N 2.96Å; F115-L118 HydrophobicContact CD1-CD2 4.32Å; F115-L118 HydrophobicContact CE1-CD2 4.43Å; F115-L118 PolarHBondContact O-N 2.87Å; L118-A120 VanDerWaalsContact C-N 3.28Å; L118-A120 PolarHBondContact O-N 3.02Å; L118-D121 PolarHBondContact O-N 3.46Å; L118-I122 HydrophobicContact CD1-CD1 3.55Å; L118-I122 HydrophobicContact CD1-CG1 4.15Å; L118-I122 HydrophobicContact CD2-CD1 4.43Å; L118-I122 HydrophobicContact CG-CD1 3.67Å; L118-I122 WeakPolarHBondContact O-CB 3.47Å; L118-I122 WeakPolarHBondContact O-CG1 3.25Å; L118-I122 PolarHBondContact O-N 2.7Å; L118-T412 HydrophobicContact CD1-CG2 3.79Å
119	N	83.3	Confident	82.6	Confident	29 Å²	29	52 Å²	52	16%	0.155	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-36.4	176	-72	-27.2	0	0	0	111.1	S82 F115 N123	S82-N119 PolarHBondContact OG-ND2 3.3Å; F115-N119 WeakPolarHBondContact O-CB 3.22Å; F115-N119 PolarHBondContact O-N 2.97Å; F115-N119 PolarHBondContact O-ND2 2.95Å; F115-N119 VanDerWaalsContact O-ND2 3.12Å; N119-N123 VanDerWaalsContact O-CB 3.31Å; N119-N123 WeakPolarHBondContact O-CB 3.31Å; N119-N123 PolarHBondContact O-N 2.93Å; N119-N123 PolarHBondContact O-ND2 3.05Å
120	A	84.8	Confident	83.8	Confident	56 Å²	56	46.1 Å²	46.1	46%	0.463	29%	0.286	S	S	.	.	H	α-helix	trans	-67.8	-39.2	175.6	0	0	0	0	0	112.4	Q116 N117 L118 S124	Q116-A120 WeakPolarHBondContact O-CB 3.31Å; Q116-A120 PolarHBondContact O-N 3.32Å; Q116-A120 VanDerWaalsContact O-N 3.12Å; N117-A120 PolarHBondContact O-N 3.36Å; L118-A120 VanDerWaalsContact C-N 3.28Å; L118-A120 PolarHBondContact O-N 3.02Å; A120-S124 PolarHBondContact O-N 2.81Å
121	D	84.4	Confident	83.8	Confident	63 Å²	63	45 Å²	45	34%	0.337	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-46.9	176	-91.5	-8.7	0	0	0	111.6	N117 L118 K411	N117-D121 PolarHBondContact O-N 2.92Å; L118-D121 PolarHBondContact O-N 3.46Å; D121-K411 IonicContact OD1-NZ 3.83Å; D121-K411 PolarHBondContact OD1-NZ 2.82Å; D121-K411 IonicContact OD2-NZ 3.36Å; D121-K411 PolarHBondContact OD2-NZ 2.64Å
122	I	81.9	Confident	83.5	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	28%	0.282	C	S	.	.	H	α-helix	trans	-77.7	-34.3	-174.1	-65.3	168.3	0	0	0	112.4	L78 L118 S124 Y129 L131 L416	L78-I122 HydrophobicContact CD2-CD1 3.28Å; L118-I122 HydrophobicContact CD1-CD1 3.55Å; L118-I122 HydrophobicContact CD1-CG1 4.15Å; L118-I122 HydrophobicContact CD2-CD1 4.43Å; L118-I122 HydrophobicContact CG-CD1 3.67Å; L118-I122 WeakPolarHBondContact O-CB 3.47Å; L118-I122 WeakPolarHBondContact O-CG1 3.25Å; L118-I122 PolarHBondContact O-N 2.7Å; I122-S124 VanDerWaalsContact C-N 3.3Å; I122-Y129 PolarHBondContact O-OH 3.14Å; I122-L131 HydrophobicContact CG2-CD2 3.29Å; I122-L416 HydrophobicContact CD1-CD2 3.71Å; I122-L416 HydrophobicContact CG1-CD2 4.45Å; I122-L416 HydrophobicContact CG2-CD2 4.28Å
123	N	79.3	Confident	83.1	Confident	68 Å²	68	49.4 Å²	49.4	36%	0.364	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	26.3	177.1	-57.3	-72.9	0	0	0	111.8	N119	N119-N123 VanDerWaalsContact O-CB 3.31Å; N119-N123 WeakPolarHBondContact O-CB 3.31Å; N119-N123 PolarHBondContact O-N 2.93Å; N119-N123 PolarHBondContact O-ND2 3.05Å
124	S	81.7	Confident	82.9	Confident	38 Å²	38	47.7 Å²	47.7	27%	0.266	28%	0.278	S	S	.	.			trans	-56.6	131.6	177.1	-179.9	0	0	0	0	109.8	A120 I122 S126 A127	A120-S124 PolarHBondContact O-N 2.81Å; I122-S124 VanDerWaalsContact C-N 3.3Å; S124-S126 PolarHBondContact O-N 2.91Å; S124-S126 PolarHBondContact OG-N 3.17Å; S124-S126 PolarHBondContact OG-OG 2.82Å; S124-A127 VanDerWaalsContact O-CB 3.22Å; S124-A127 WeakPolarHBondContact O-CB 3.35Å; S124-A127 PolarHBondContact O-N 2.98Å
125	P	76.9	Confident	82.9	Confident	141 Å²	141	46.2 Å²	46.2	92%	0.916	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-17	175	-24.4	34	0	0	0	114.1
126	S	78.9	Confident	83.1	Confident	93 Å²	93	47.5 Å²	47.5	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.1	176.7	68.3	0	0	0	0	114	S124	S124-S126 PolarHBondContact O-N 2.91Å; S124-S126 PolarHBondContact OG-N 3.17Å; S124-S126 PolarHBondContact OG-OG 2.82Å
127	A	80.1	Confident	83.5	Confident	23 Å²	23	44.3 Å²	44.3	19%	0.19	26%	0.263	C	S	.	.			trans	-62.1	142.5	-176.2	0	0	0	0	0	111.3	S124 Y129 E270	S124-A127 VanDerWaalsContact O-CB 3.22Å; S124-A127 WeakPolarHBondContact O-CB 3.35Å; S124-A127 PolarHBondContact O-N 2.98Å; A127-Y129 HydrophobicContact CB-CD1 4.09Å; A127-Y129 HydrophobicContact CB-CE1 3.81Å; A127-Y129 HydrophobicContact CB-CE2 4.41Å; A127-Y129 PolarHBondContact O-N 3.31Å; A127-E270 WeakPolarHBondContact CA-OE2 3.14Å
128	S	82.4	Confident	83.9	Confident	40 Å²	40	40.7 Å²	40.7	28%	0.28	24%	0.244	S	C	.	.	S	Bend	trans	-77.5	-0.9	-179.5	66.8	0	0	0	0	113.7	V267 E270	S128-V267 PolarHBondContact OG-O 3.5Å; S128-E270 PolarHBondContact N-OE2 2.98Å
129	Y	82.6	Confident	84.5	Confident	17 Å²	17	40.4 Å²	40.4	7%	0.067	24%	0.242	C	C	.	.	S	Bend	trans	-128.3	160.5	-175.5	58.4	-89	0	0	0	111.5	I122 A127 L131 F212 E270 L271	I122-Y129 PolarHBondContact O-OH 3.14Å; A127-Y129 HydrophobicContact CB-CD1 4.09Å; A127-Y129 HydrophobicContact CB-CE1 3.81Å; A127-Y129 HydrophobicContact CB-CE2 4.41Å; A127-Y129 PolarHBondContact O-N 3.31Å; Y129-L131 HydrophobicContact CD2-CB 4.02Å; Y129-L131 HydrophobicContact CE2-CB 3.9Å; Y129-F212 HydrophobicContact CD2-CD2 4.42Å; Y129-F212 HydrophobicContact CD2-CE2 4.07Å; Y129-F212 HydrophobicContact CG-CE2 4.2Å; Y129-E270 HydrophobicContact CD1-CB 4.48Å; Y129-E270 HydrophobicContact CE1-CB 3.99Å; Y129-E270 VanDerWaalsContact CE1-OE2 3.24Å; Y129-E270 WeakPolarHBondContact CE1-OE2 3.36Å; Y129-L271 HydrophobicContact CD1-CD1 3.6Å; Y129-L271 HydrophobicContact CD1-CG 3.74Å; Y129-L271 HydrophobicContact CD2-CD1 3.68Å; Y129-L271 HydrophobicContact CE1-CD1 3.74Å; Y129-L271 HydrophobicContact CE1-CD2 3.97Å; Y129-L271 HydrophobicContact CE1-CG 3.58Å; Y129-L271 HydrophobicContact CE2-CD1 3.81Å; Y129-L271 HydrophobicContact CE2-CG 4.43Å; Y129-L271 HydrophobicContact CG-CD1 3.56Å; Y129-L271 HydrophobicContact CG-CG 4.23Å
130	I	81.6	Confident	85.1	Confident	74 Å²	74	39 Å²	39	38%	0.379	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.9	173.1	-56.4	173.8	0	0	0	107.8	K132 Y211 F212 K213	I130-K132 HydrophobicContact CG2-CD 4.28Å; I130-K132 HydrophobicContact CG2-CG 3.95Å; I130-Y211 HydrophobicContact CG2-CE1 4.49Å; I130-F212 WeakPolarHBondContact O-CA 3.34Å; I130-K213 HydrophobicContact CB-CB 4.2Å; I130-K213 HydrophobicContact CD1-CD 4.48Å; I130-K213 PolarHBondContact N-O 2.85Å; I130-K213 PolarHBondContact O-N 2.86Å
131	L	83.1	Confident	85.6	Confident	21 Å²	21	40 Å²	40	11%	0.11	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.7	165.1	-164.9	73.4	0	0	0	108.4	I122 Y129 V133 I210 F212 F417	I122-L131 HydrophobicContact CG2-CD2 3.29Å; Y129-L131 HydrophobicContact CD2-CB 4.02Å; Y129-L131 HydrophobicContact CE2-CB 3.9Å; L131-V133 HydrophobicContact CD2-CG2 4.08Å; L131-V133 HydrophobicContact CG-CG2 4.12Å; L131-I210 HydrophobicContact CD1-CD1 3.96Å; L131-I210 HydrophobicContact CD1-CG1 4.11Å; L131-I210 HydrophobicContact CD2-CD1 4.43Å; L131-I210 HydrophobicContact CG-CD1 4.32Å; L131-F212 HydrophobicContact CD1-CB 3.96Å; L131-F212 HydrophobicContact CD1-CD2 4.01Å; L131-F212 HydrophobicContact CD1-CG 4.46Å; L131-F417 HydrophobicContact CD1-CE2 3.79Å; L131-F417 HydrophobicContact CD1-CZ 3.88Å
132	K	80.3	Confident	86.1	Confident	78 Å²	78	41.6 Å²	41.6	34%	0.339	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.2	174.3	-60.4	-62	-171.2	176.5	0	108.3	I130 E186 I210 Y211	I130-K132 HydrophobicContact CG2-CD 4.28Å; I130-K132 HydrophobicContact CG2-CG 3.95Å; K132-E186 WeakPolarHBondContact CE-OE1 3.42Å; K132-E186 IonicContact NZ-OE1 3.02Å; K132-I210 WeakPolarHBondContact O-CA 3.5Å; K132-Y211 HydrophobicContact CB-CD1 4.39Å; K132-Y211 HydrophobicContact CG-CD1 4.22Å; K132-Y211 PolarHBondContact N-O 2.81Å; K132-Y211 PolarHBondContact O-N 3.09Å
133	V	81.8	Confident	86.7	Confident	52 Å²	52	42.3 Å²	42.3	32%	0.315	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.4	178.7	-176.9	0	0	0	0	108.1	L131 N135 I210	L131-V133 HydrophobicContact CD2-CG2 4.08Å; L131-V133 HydrophobicContact CG-CG2 4.12Å; V133-N135 HydrophobicContact CG1-CB 4.39Å; V133-N135 WeakPolarHBondContact CG1-ND2 3.18Å; V133-N135 WeakPolarHBondContact CG1-OD1 3.36Å; V133-I210 HydrophobicContact CG2-CD1 3.8Å; V133-I210 HydrophobicContact CG2-CG1 3.97Å
134	A	82.4	Confident	87.4	Confident	2 Å²	2	45.7 Å²	45.7	2%	0.017	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	90.6	175.5	0	0	0	0	0	108.7	W180 K184 T185 A209	A134-W180 HydrophobicContact CB-CH2 4.04Å; A134-W180 HydrophobicContact CB-CZ3 4.04Å; A134-K184 HydrophobicContact CB-CB 3.66Å; A134-K184 HydrophobicContact CB-CG 4.44Å; A134-T185 HydrophobicContact CB-CG2 4.12Å; A134-A209 HydrophobicContact CB-CB 4.23Å; A134-A209 PolarHBondContact N-O 3.02Å; A134-A209 PolarHBondContact O-N 3.32Å
135	N	87.1	Confident	88.1	Confident	21 Å²	21	45.3 Å²	45.3	11%	0.112	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.7	-179.7	-64.9	-6.2	0	0	0	109.3	M86 V133 V207 N208	M86-N135 HydrophobicContact CE-CB 3.99Å; V133-N135 HydrophobicContact CG1-CB 4.39Å; V133-N135 WeakPolarHBondContact CG1-ND2 3.18Å; V133-N135 WeakPolarHBondContact CG1-OD1 3.36Å; N135-V207 WeakPolarHBondContact CA-O 3.33Å; N135-N208 VanDerWaalsContact CG-ND2 3.27Å; N135-N208 PolarHBondContact ND2-ND2 3.04Å; N135-N208 PolarHBondContact OD1-ND2 3.03Å
136	R	92.9	Very high	89	Confident	29 Å²	29	40.4 Å²	40.4	11%	0.109	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	145.4	176.2	178.3	168.3	-82.1	179.8	-2.9	111.7	Y138 D160 W180 V207	R136-Y138 HydrophobicContact CB-CD2 4.39Å; R136-Y138 HydrophobicContact CB-CE2 3.81Å; R136-Y138 VanDerWaalsContact CD-CE2 3.5Å; R136-Y138 VanDerWaalsContact CD-OH 3.29Å; R136-Y138 WeakPolarHBondContact CD-OH 3.33Å; R136-Y138 HydrophobicContact CG-CD2 3.92Å; R136-Y138 HydrophobicContact CG-CE2 3.48Å; R136-Y138 VanDerWaalsContact CG-CE2 3.48Å; R136-D160 WeakPolarHBondContact CG-O 3.46Å; R136-D160 IonicContact CZ-OD2 2.89Å; R136-D160 IonicContact NH2-OD2 3.4Å; R136-D160 PolarHBondContact NH2-OD2 3.06Å; R136-W180 HydrophobicContact CB-CH2 3.44Å; R136-W180 VanDerWaalsContact CB-CH2 3.44Å; R136-W180 HydrophobicContact CB-CZ2 4.01Å; R136-W180 HydrophobicContact CB-CZ3 3.74Å; R136-W180 HydrophobicContact CG-CH2 4.46Å; R136-W180 VanDerWaalsContact CZ-CE2 3.46Å; R136-W180 VanDerWaalsContact CZ-NE1 3.32Å; R136-W180 VanDerWaalsContact NH1-CD1 3.28Å; R136-W180 VanDerWaalsContact NH1-CE2 3.35Å; R136-V207 HydrophobicContact CB-CG2 4.12Å; R136-V207 PolarHBondContact N-O 3.32Å; R136-V207 VanDerWaalsContact N-O 3.12Å; R136-V207 WeakPolarHBondContact O-CG2 3.26Å; R136-V207 PolarHBondContact O-N 2.85Å
137	L	95.2	Very high	89.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.7	166.6	-72.4	169.1	0	0	0	109.6	M86 V87 F149 L161 K162 L204 L206	M86-L137 HydrophobicContact CB-CD1 3.96Å; M86-L137 HydrophobicContact CE-CG 4.49Å; V87-L137 HydrophobicContact CG2-CD2 3.77Å; L137-F149 HydrophobicContact CD1-CE1 4.34Å; L137-F149 HydrophobicContact CD1-CZ 3.89Å; L137-L161 HydrophobicContact CB-CB 4.16Å; L137-L161 HydrophobicContact CB-CD1 3.94Å; L137-L161 HydrophobicContact CB-CG 3.96Å; L137-L161 HydrophobicContact CD1-CD1 4.4Å; L137-L161 CarbonylContact O-C 3.55Å; L137-L161 WeakPolarHBondContact O-CA 3.34Å; L137-K162 PolarHBondContact O-N 3.32Å; L137-L204 HydrophobicContact CB-CD1 4.46Å; L137-L204 HydrophobicContact CD2-CD1 4.2Å; L137-L204 HydrophobicContact CD2-CD2 4.5Å; L137-L204 HydrophobicContact CD2-CG 4.37Å; L137-L206 HydrophobicContact CD2-CB 3.98Å; L137-L206 HydrophobicContact CD2-CD1 3.52Å; L137-L206 HydrophobicContact CD2-CG 4.31Å; L137-L206 HydrophobicContact CG-CD1 4.04Å
138	Y	97	Very high	90.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	115.7	171.2	-70.8	-94.3	0	0	0	108.5	R136 K162 V164 I177 L204 A205 V207	R136-Y138 HydrophobicContact CB-CD2 4.39Å; R136-Y138 HydrophobicContact CB-CE2 3.81Å; R136-Y138 VanDerWaalsContact CD-CE2 3.5Å; R136-Y138 VanDerWaalsContact CD-OH 3.29Å; R136-Y138 WeakPolarHBondContact CD-OH 3.33Å; R136-Y138 HydrophobicContact CG-CD2 3.92Å; R136-Y138 HydrophobicContact CG-CE2 3.48Å; R136-Y138 VanDerWaalsContact CG-CE2 3.48Å; Y138-K162 CarbonylContact C-O 3.55Å; Y138-K162 VanDerWaalsContact CA-O 3.31Å; Y138-K162 WeakPolarHBondContact CA-O 3.45Å; Y138-K162 HydrophobicContact CD1-CB 3.92Å; Y138-K162 HydrophobicContact CD1-CG 4.46Å; Y138-K162 HydrophobicContact CE1-CB 3.95Å; Y138-K162 HydrophobicContact CE1-CD 3.96Å; Y138-K162 HydrophobicContact CE1-CG 4.35Å; Y138-V164 HydrophobicContact CD1-CG1 3.82Å; Y138-V164 HydrophobicContact CD1-CG2 4.36Å; Y138-V164 HydrophobicContact CE1-CG1 4.41Å; Y138-I177 HydrophobicContact CD1-CD1 4.04Å; Y138-I177 HydrophobicContact CD1-CG1 3.67Å; Y138-I177 HydrophobicContact CD2-CD1 4.19Å; Y138-I177 HydrophobicContact CD2-CG1 3.97Å; Y138-I177 HydrophobicContact CE1-CD1 4.41Å; Y138-I177 HydrophobicContact CE1-CG1 3.54Å; Y138-I177 HydrophobicContact CE2-CB 4.48Å; Y138-I177 HydrophobicContact CE2-CG1 3.86Å; Y138-I177 HydrophobicContact CE2-CG2 4.06Å; Y138-I177 HydrophobicContact CG-CD1 3.91Å; Y138-I177 HydrophobicContact CG-CG1 3.88Å; Y138-L204 CarbonylContact O-C 3.53Å; Y138-L204 WeakPolarHBondContact O-CA 2.86Å; Y138-A205 PolarHBondContact N-O 3.03Å; Y138-A205 PolarHBondContact O-N 2.99Å; Y138-V207 HydrophobicContact CD2-CG1 4.46Å; Y138-V207 HydrophobicContact CD2-CG2 3.93Å; Y138-V207 HydrophobicContact CE2-CG2 3.52Å
139	G	96.7	Very high	91.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	147.7	-178.1	0	0	0	0	0	111.6	T141 K162 A163 V164	G139-T141 PolarHBondContact O-N 3.12Å; G139-K162 PolarHBondContact N-O 3.02Å; G139-A163 CarbonylContact O-C 3.46Å; G139-A163 VanDerWaalsContact O-CA 3.32Å; G139-A163 WeakPolarHBondContact O-CA 3.35Å; G139-V164 PolarHBondContact O-N 3.21Å
140	E	96.9	Very high	91.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	133.8	172.8	176.6	53.4	-133.2	0	0	111	T142 S143 V164 F166 I167 R203	E140-T142 HydrophobicContact CG-CG2 4.48Å; E140-T142 WeakPolarHBondContact CG-OG1 3.49Å; E140-T142 PolarHBondContact O-N 3.08Å; E140-T142 VanDerWaalsContact O-N 3.11Å; E140-S143 WeakPolarHBondContact O-CB 3.32Å; E140-S143 PolarHBondContact O-N 2.64Å; E140-V164 CarbonylContact C-O 3.37Å; E140-V164 WeakPolarHBondContact CA-O 3.32Å; E140-F166 VanDerWaalsContact OE2-CA 3.24Å; E140-F166 WeakPolarHBondContact OE2-CA 3.42Å; E140-F166 WeakPolarHBondContact OE2-CB 3.37Å; E140-F166 PolarHBondContact OE2-N 3.31Å; E140-I167 HydrophobicContact CG-CD1 3.72Å; E140-I167 HydrophobicContact CG-CG1 4.02Å; E140-I167 PolarHBondContact OE2-N 3Å; E140-R203 PolarHBondContact N-O 3.23Å
141	T	95.3	Very high	92.3	Very high	76 Å²	76	49.2 Å²	49.2	47%	0.466	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.7	-171.6	-167.4	0	0	0	0	114	G139 S143 V164 N165	G139-T141 PolarHBondContact O-N 3.12Å; T141-S143 VanDerWaalsContact C-N 3.25Å; T141-S143 PolarHBondContact O-N 3.21Å; T141-V164 PolarHBondContact N-O 2.88Å; T141-N165 HydrophobicContact CG2-CB 4.13Å
142	T	94.1	Very high	92.8	Very high	96 Å²	96	49.9 Å²	49.9	59%	0.589	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-13.3	175	63.6	0	0	0	0	113.1	E140 I167	E140-T142 HydrophobicContact CG-CG2 4.48Å; E140-T142 WeakPolarHBondContact CG-OG1 3.49Å; E140-T142 PolarHBondContact O-N 3.08Å; E140-T142 VanDerWaalsContact O-N 3.11Å; T142-I167 HydrophobicContact CG2-CD1 4.29Å
143	S	94	Very high	93.4	Very high	19 Å²	19	46.2 Å²	46.2	13%	0.133	24%	0.24	C	C	.	.	S	Bend	trans	-82.6	140.1	179.2	-65.8	0	0	0	0	111.9	E140 T141 F145 L359	E140-S143 WeakPolarHBondContact O-CB 3.32Å; E140-S143 PolarHBondContact O-N 2.64Å; T141-S143 VanDerWaalsContact C-N 3.25Å; T141-S143 PolarHBondContact O-N 3.21Å; S143-F145 PolarHBondContact O-N 2.85Å; S143-L359 VanDerWaalsContact OG-CD2 3.29Å; S143-L359 WeakPolarHBondContact OG-CD2 3.48Å
144	K	94.8	Very high	93.8	Very high	138 Å²	138	48.1 Å²	48.1	60%	0.6	25%	0.245	S	C	*	.			trans	-96.1	87.3	179.2	-62.5	-176.3	-160.1	130.6	0	110.2	L146 N354 D356	K144-L146 PolarHBondContact O-N 2.98Å; K144-N354 PolarHBondContact N-OD1 3.2Å; K144-N354 PolarHBondContact O-OD1 3.06Å; K144-N354 VanDerWaalsContact O-OD1 3.07Å; K144-D356 WeakPolarHBondContact CE-OD2 3.4Å; K144-D356 IonicContact NZ-OD1 2.69Å; K144-D356 IonicContact NZ-OD2 3.43Å; K144-D356 PolarHBondContact NZ-OD2 3.35Å
145	F	95.9	Very high	94.3	Very high	30 Å²	30	53.7 Å²	53.7	13%	0.132	27%	0.269	C	S	.	.			trans	-65.8	132	179.8	-62.7	-74.4	0	0	0	111.7	S143 L150 L161 M353 L359	S143-F145 PolarHBondContact O-N 2.85Å; F145-L150 HydrophobicContact CB-CD1 4.35Å; F145-L150 HydrophobicContact CB-CD2 4.14Å; F145-L150 HydrophobicContact CB-CG 4.35Å; F145-L161 HydrophobicContact CD1-CD1 3.65Å; F145-L161 HydrophobicContact CD1-CD2 4.03Å; F145-L161 HydrophobicContact CD2-CD2 3.54Å; F145-L161 HydrophobicContact CE1-CD1 3.57Å; F145-L161 HydrophobicContact CE1-CD2 4.06Å; F145-L161 HydrophobicContact CE2-CD2 3.59Å; F145-L161 HydrophobicContact CG-CD1 4.22Å; F145-L161 HydrophobicContact CG-CD2 3.79Å; F145-L161 HydrophobicContact CZ-CD1 4.1Å; F145-L161 HydrophobicContact CZ-CD2 3.88Å; F145-M353 CarbonylContact C-O 3.55Å; F145-M353 VanDerWaalsContact CA-O 3.31Å; F145-M353 WeakPolarHBondContact CA-O 3.26Å; F145-M353 HydrophobicContact CD1-CB 4.48Å; F145-L359 HydrophobicContact CD1-CD1 4.4Å; F145-L359 HydrophobicContact CE1-CD1 3.67Å; F145-L359 HydrophobicContact CZ-CD1 4.38Å
146	L	96.4	Very high	94.4	Very high	38 Å²	38	54.1 Å²	54.1	20%	0.199	27%	0.27	C	S	.	.			trans	-66.8	131.6	-179.5	-69.1	176.5	0	0	0	110.8	K144 K148 F149 L150 M353 E355	K144-L146 PolarHBondContact O-N 2.98Å; L146-K148 PolarHBondContact O-N 2.85Å; L146-F149 HydrophobicContact CB-CB 4.15Å; L146-F149 WeakPolarHBondContact O-CB 3.29Å; L146-F149 PolarHBondContact O-N 3.34Å; L146-L150 PolarHBondContact O-N 3.46Å; L146-M353 PolarHBondContact N-O 3.06Å; L146-E355 HydrophobicContact CD1-CG 4.21Å; L146-E355 HydrophobicContact CD2-CG 3.88Å; L146-E355 HydrophobicContact CG-CG 4.49Å
147	P	95.8	Very high	94.1	Very high	86 Å²	86	53.6 Å²	53.6	56%	0.558	27%	0.268	S	S	*	.	H	α-helix	trans	-54.2	-42.3	178	-28.3	35.1	0	0	0	112.8	F149 L150 E151	P147-F149 VanDerWaalsContact C-N 3.32Å; P147-F149 PolarHBondContact O-N 2.95Å; P147-L150 PolarHBondContact O-N 3.4Å; P147-E151 WeakPolarHBondContact O-CG 3.37Å; P147-E151 PolarHBondContact O-N 2.81Å
148	K	95	Very high	93.8	Very high	147 Å²	147	61 Å²	61	64%	0.639	30%	0.302	S	S	*	.	H	α-helix	trans	-58.6	-41.7	176.6	-179.9	170.7	-178.8	167	0	112.7	L146 E151 D152	L146-K148 PolarHBondContact O-N 2.85Å; K148-E151 PolarHBondContact O-N 3.44Å; K148-D152 WeakPolarHBondContact O-CB 3.35Å; K148-D152 PolarHBondContact O-N 2.89Å
149	F	95.2	Very high	93.3	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-45.1	177.7	174.6	-99.1	0	0	0	110.9	M86 L89 L137 L146 P147 D152 T153 L161 M353	M86-F149 WeakPolarHBondContact O-CE2 3.37Å; L89-F149 HydrophobicContact CB-CE2 4.18Å; L89-F149 HydrophobicContact CD2-CD2 4.09Å; L89-F149 HydrophobicContact CD2-CE2 4.05Å; L89-F149 HydrophobicContact CG-CD2 4.2Å; L89-F149 HydrophobicContact CG-CE2 4.22Å; L137-F149 HydrophobicContact CD1-CE1 4.34Å; L137-F149 HydrophobicContact CD1-CZ 3.89Å; L146-F149 HydrophobicContact CB-CB 4.15Å; L146-F149 WeakPolarHBondContact O-CB 3.29Å; L146-F149 PolarHBondContact O-N 3.34Å; P147-F149 VanDerWaalsContact C-N 3.32Å; P147-F149 PolarHBondContact O-N 2.95Å; F149-D152 PolarHBondContact O-N 2.78Å; F149-T153 HydrophobicContact CD1-CG2 4.37Å; F149-T153 HydrophobicContact CD2-CG2 4.44Å; F149-T153 HydrophobicContact CE1-CG2 3.86Å; F149-T153 HydrophobicContact CE2-CG2 3.93Å; F149-T153 HydrophobicContact CZ-CG2 3.62Å; F149-T153 WeakPolarHBondContact O-CG2 3.19Å; F149-T153 PolarHBondContact O-N 3.13Å; F149-T153 PolarHBondContact O-OG1 3.19Å; F149-L161 HydrophobicContact CE1-CD1 3.76Å; F149-M353 HydrophobicContact CD1-CB 4.34Å; F149-M353 HydrophobicContact CD1-CG 4.35Å; F149-M353 HydrophobicContact CD2-CB 4.46Å; F149-M353 HydrophobicContact CD2-CG 3.9Å; F149-M353 HydrophobicContact CE1-CB 4.44Å; F149-M353 HydrophobicContact CE1-CG 4.11Å; F149-M353 HydrophobicContact CE1-SD 4.34Å; F149-M353 HydrophobicContact CE2-CE 3.83Å; F149-M353 HydrophobicContact CE2-CG 3.64Å; F149-M353 HydrophobicContact CE2-SD 4.24Å; F149-M353 HydrophobicContact CG-CB 4.36Å; F149-M353 HydrophobicContact CG-CG 4.25Å; F149-M353 HydrophobicContact CZ-CE 3.74Å; F149-M353 HydrophobicContact CZ-CG 3.75Å; F149-M353 HydrophobicContact CZ-SD 3.88Å
150	L	94.9	Very high	92.7	Very high	63 Å²	63	64.9 Å²	64.9	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-46.1	177.5	-58.5	176	0	0	0	111.7	F145 L146 P147 T153 Q154 L161	F145-L150 HydrophobicContact CB-CD1 4.35Å; F145-L150 HydrophobicContact CB-CD2 4.14Å; F145-L150 HydrophobicContact CB-CG 4.35Å; L146-L150 PolarHBondContact O-N 3.46Å; P147-L150 PolarHBondContact O-N 3.4Å; L150-T153 WeakPolarHBondContact CA-OG1 3.27Å; L150-T153 PolarHBondContact O-N 2.9Å; L150-T153 PolarHBondContact O-OG1 2.94Å; L150-Q154 PolarHBondContact O-N 2.86Å; L150-Q154 VanDerWaalsContact O-N 3.08Å; L150-L161 HydrophobicContact CD2-CB 3.73Å; L150-L161 HydrophobicContact CD2-CD2 4.35Å; L150-L161 HydrophobicContact CD2-CG 4.48Å
151	E	94.7	Very high	92.5	Very high	131 Å²	131	66 Å²	66	61%	0.612	33%	0.33	S	S	*	.	H	α-helix	trans	-59.4	-46.6	176	-73.1	172.9	-168	0	0	112	P147 K148 Q154 K155	P147-E151 WeakPolarHBondContact O-CG 3.37Å; P147-E151 PolarHBondContact O-N 2.81Å; K148-E151 PolarHBondContact O-N 3.44Å; E151-Q154 PolarHBondContact O-N 3.43Å; E151-K155 VanDerWaalsContact O-CB 3.28Å; E151-K155 WeakPolarHBondContact O-CB 3.25Å; E151-K155 PolarHBondContact O-N 3.24Å
152	D	93.1	Very high	92.4	Very high	34 Å²	34	66 Å²	66	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-68.1	-38	-179.7	-77	-28.7	0	0	0	111.4	L89 K148 F149 Q154 K155 F156	L89-D152 HydrophobicContact CD1-CB 4.21Å; L89-D152 HydrophobicContact CD2-CB 3.69Å; L89-D152 HydrophobicContact CG-CB 4.43Å; K148-D152 WeakPolarHBondContact O-CB 3.35Å; K148-D152 PolarHBondContact O-N 2.89Å; F149-D152 PolarHBondContact O-N 2.78Å; D152-Q154 VanDerWaalsContact C-N 3.34Å; D152-Q154 PolarHBondContact O-N 3.37Å; D152-K155 PolarHBondContact O-N 3.23Å; D152-F156 HydrophobicContact CB-CD2 4.05Å; D152-F156 HydrophobicContact CB-CE2 4.01Å; D152-F156 WeakPolarHBondContact O-CD2 3.48Å; D152-F156 PolarHBondContact O-N 3.46Å
153	T	92.1	Very high	92.5	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-60.5	-43.3	173.3	49.7	0	0	0	0	112	L89 F149 L150 Y157 Q158 A159	L89-T153 HydrophobicContact CD2-CG2 3.81Å; F149-T153 HydrophobicContact CD1-CG2 4.37Å; F149-T153 HydrophobicContact CD2-CG2 4.44Å; F149-T153 HydrophobicContact CE1-CG2 3.86Å; F149-T153 HydrophobicContact CE2-CG2 3.93Å; F149-T153 HydrophobicContact CZ-CG2 3.62Å; F149-T153 WeakPolarHBondContact O-CG2 3.19Å; F149-T153 PolarHBondContact O-N 3.13Å; F149-T153 PolarHBondContact O-OG1 3.19Å; L150-T153 WeakPolarHBondContact CA-OG1 3.27Å; L150-T153 PolarHBondContact O-N 2.9Å; L150-T153 PolarHBondContact O-OG1 2.94Å; T153-Y157 WeakPolarHBondContact O-CA 3.33Å; T153-Y157 WeakPolarHBondContact O-CB 3.34Å; T153-Y157 PolarHBondContact O-N 2.87Å; T153-Q158 PolarHBondContact O-N 3.31Å; T153-A159 CarbonylContact C-O 3.59Å
154	Q	91.1	Very high	92.7	Very high	91 Å²	91	63.4 Å²	63.4	43%	0.425	31%	0.312	S	S	.	.	H	α-helix	trans	-67.2	-42.7	177.4	-174.4	59.9	15.1	0	0	111.6	L150 E151 D152 Q158 D160	L150-Q154 PolarHBondContact O-N 2.86Å; L150-Q154 VanDerWaalsContact O-N 3.08Å; E151-Q154 PolarHBondContact O-N 3.43Å; D152-Q154 VanDerWaalsContact C-N 3.34Å; D152-Q154 PolarHBondContact O-N 3.37Å; Q154-Q158 VanDerWaalsContact O-CA 3.27Å; Q154-Q158 WeakPolarHBondContact O-CA 3.42Å; Q154-Q158 PolarHBondContact O-N 3.42Å; Q154-D160 PolarHBondContact OE1-OD1 2.87Å
155	K	91.4	Very high	92.8	Very high	119 Å²	119	59.9 Å²	59.9	52%	0.517	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-49	-179.4	176.4	-176.7	172	-173.5	0	112.6	Q116 E151 D152	Q116-K155 PolarHBondContact NE2-O 3.18Å; E151-K155 VanDerWaalsContact O-CB 3.28Å; E151-K155 WeakPolarHBondContact O-CB 3.25Å; E151-K155 PolarHBondContact O-N 3.24Å; D152-K155 PolarHBondContact O-N 3.23Å
156	F	89.2	Confident	92.9	Very high	30 Å²	30	58.4 Å²	58.4	13%	0.132	29%	0.293	C	S	.	.	H	α-helix	trans	-89.8	-28.4	-171.6	-64	-61	0	0	0	113.4	H112 Q116 D152	H112-F156 HydrophobicContact CB-CB 4.14Å; H112-F156 HydrophobicContact CB-CD1 3.9Å; H112-F156 HydrophobicContact CB-CD2 3.74Å; H112-F156 HydrophobicContact CB-CE1 4.19Å; H112-F156 HydrophobicContact CB-CE2 4.05Å; H112-F156 HydrophobicContact CB-CG 3.67Å; H112-F156 HydrophobicContact CB-CZ 4.26Å; Q116-F156 VanDerWaalsContact CA-O 3.31Å; Q116-F156 WeakPolarHBondContact CA-O 3.41Å; Q116-F156 HydrophobicContact CB-CD1 4.13Å; D152-F156 HydrophobicContact CB-CD2 4.05Å; D152-F156 HydrophobicContact CB-CE2 4.01Å; D152-F156 WeakPolarHBondContact O-CD2 3.48Å; D152-F156 PolarHBondContact O-N 3.46Å
157	Y	88.2	Confident	92.9	Very high	19 Å²	19	60.3 Å²	60.3	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-123	-7.1	-170.8	-58.2	-82.9	0	0	0	114.3	S82 A85 M86 H112 F115 T153 A159	S82-Y157 WeakPolarHBondContact O-CE1 3.23Å; A85-Y157 HydrophobicContact CB-CE1 3.92Å; A85-Y157 WeakPolarHBondContact CB-OH 3.39Å; M86-Y157 HydrophobicContact CG-CD1 3.8Å; M86-Y157 HydrophobicContact CG-CD2 3.57Å; M86-Y157 HydrophobicContact CG-CE1 4.2Å; M86-Y157 HydrophobicContact CG-CE2 3.99Å; M86-Y157 HydrophobicContact CG-CG 3.47Å; M86-Y157 VanDerWaalsContact CG-CG 3.47Å; M86-Y157 HydrophobicContact SD-CD2 4.49Å; M86-Y157 HydrophobicContact SD-CG 4.1Å; H112-Y157 AromaticContact ND1-CE2 3.81Å; H112-Y157 AromaticContact ND1-CZ 3.7Å; H112-Y157 PolarHBondContact ND1-OH 3Å; F115-Y157 HydrophobicContact CB-CD1 4.38Å; F115-Y157 HydrophobicContact CB-CE1 3.63Å; F115-Y157 HydrophobicContact CD2-CE1 4.34Å; F115-Y157 HydrophobicContact CG-CE1 4.06Å; T153-Y157 WeakPolarHBondContact O-CA 3.33Å; T153-Y157 WeakPolarHBondContact O-CB 3.34Å; T153-Y157 PolarHBondContact O-N 2.87Å; Y157-A159 PolarHBondContact O-N 3.33Å; Y157-A159 VanDerWaalsContact O-N 3.15Å
158	Q	87.3	Confident	93	Very high	155 Å²	155	58.2 Å²	58.2	72%	0.724	30%	0.297	S	S	*	.	S	Bend	trans	52.1	32.7	-173.5	-55.2	176.9	7.9	0	0	112	T153 Q154	T153-Q158 PolarHBondContact O-N 3.31Å; Q154-Q158 VanDerWaalsContact O-CA 3.27Å; Q154-Q158 WeakPolarHBondContact O-CA 3.42Å; Q154-Q158 PolarHBondContact O-N 3.42Å
159	A	86.6	Confident	93.1	Very high	6 Å²	6	55 Å²	55	5%	0.05	29%	0.287	C	S	.	.			trans	-126.1	136.2	-173.9	0	0	0	0	0	109.7	M86 T153 Y157	M86-A159 HydrophobicContact CE-CB 4.35Å; M86-A159 HydrophobicContact SD-CB 3.53Å; M86-A159 VanDerWaalsContact SD-CB 3.53Å; T153-A159 CarbonylContact C-O 3.59Å; Y157-A159 PolarHBondContact O-N 3.33Å; Y157-A159 VanDerWaalsContact O-N 3.15Å
160	D	84.6	Confident	93.2	Very high	77 Å²	77	56.1 Å²	56.1	41%	0.412	30%	0.295	S	S	.	.			trans	-86	158.2	176	-47.8	-61.5	0	0	0	111.2	R136 Q154	R136-D160 WeakPolarHBondContact CG-O 3.46Å; R136-D160 IonicContact CZ-OD2 2.89Å; R136-D160 IonicContact NH2-OD2 3.4Å; R136-D160 PolarHBondContact NH2-OD2 3.06Å; Q154-D160 PolarHBondContact OE1-OD1 2.87Å
161	L	92.6	Very high	93.3	Very high	22 Å²	22	57 Å²	57	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129	152.7	-177.7	151.3	0	0	0	108.7	L137 F145 F149 L150 L204	L137-L161 HydrophobicContact CB-CB 4.16Å; L137-L161 HydrophobicContact CB-CD1 3.94Å; L137-L161 HydrophobicContact CB-CG 3.96Å; L137-L161 HydrophobicContact CD1-CD1 4.4Å; L137-L161 CarbonylContact O-C 3.55Å; L137-L161 WeakPolarHBondContact O-CA 3.34Å; F145-L161 HydrophobicContact CD1-CD1 3.65Å; F145-L161 HydrophobicContact CD1-CD2 4.03Å; F145-L161 HydrophobicContact CD2-CD2 3.54Å; F145-L161 HydrophobicContact CE1-CD1 3.57Å; F145-L161 HydrophobicContact CE1-CD2 4.06Å; F145-L161 HydrophobicContact CE2-CD2 3.59Å; F145-L161 HydrophobicContact CG-CD1 4.22Å; F145-L161 HydrophobicContact CG-CD2 3.79Å; F145-L161 HydrophobicContact CZ-CD1 4.1Å; F145-L161 HydrophobicContact CZ-CD2 3.88Å; F149-L161 HydrophobicContact CE1-CD1 3.76Å; L150-L161 HydrophobicContact CD2-CB 3.73Å; L150-L161 HydrophobicContact CD2-CD2 4.35Å; L150-L161 HydrophobicContact CD2-CG 4.48Å; L161-L204 HydrophobicContact CD1-CD1 4.36Å
162	K	94.6	Very high	93.4	Very high	78 Å²	78	55.8 Å²	55.8	34%	0.339	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.5	174.8	-168.9	171.2	-177.6	-179	0	110.8	L137 Y138 G139 V164 E176	L137-K162 PolarHBondContact O-N 3.32Å; Y138-K162 CarbonylContact C-O 3.55Å; Y138-K162 VanDerWaalsContact CA-O 3.31Å; Y138-K162 WeakPolarHBondContact CA-O 3.45Å; Y138-K162 HydrophobicContact CD1-CB 3.92Å; Y138-K162 HydrophobicContact CD1-CG 4.46Å; Y138-K162 HydrophobicContact CE1-CB 3.95Å; Y138-K162 HydrophobicContact CE1-CD 3.96Å; Y138-K162 HydrophobicContact CE1-CG 4.35Å; G139-K162 PolarHBondContact N-O 3.02Å; K162-V164 HydrophobicContact CD-CG1 4.41Å; K162-V164 HydrophobicContact CG-CG1 4.12Å; K162-E176 WeakPolarHBondContact CD-OE1 3.2Å; K162-E176 WeakPolarHBondContact CE-OE1 3.34Å; K162-E176 VanDerWaalsContact NZ-CD 3.29Å; K162-E176 IonicContact NZ-OE1 3.74Å; K162-E176 PolarHBondContact NZ-OE1 2.84Å; K162-E176 IonicContact NZ-OE2 3.77Å
163	A	95.8	Very high	93.6	Very high	51 Å²	51	54.5 Å²	54.5	42%	0.421	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.7	170.7	0	0	0	0	0	110.2	G139	G139-A163 CarbonylContact O-C 3.46Å; G139-A163 VanDerWaalsContact O-CA 3.32Å; G139-A163 WeakPolarHBondContact O-CA 3.35Å
164	V	97.1	Very high	93.9	Very high	9 Å²	9	56.3 Å²	56.3	6%	0.055	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.2	-178.5	-62.8	0	0	0	0	110.9	Y138 G139 E140 T141 K162 F166 C173	Y138-V164 HydrophobicContact CD1-CG1 3.82Å; Y138-V164 HydrophobicContact CD1-CG2 4.36Å; Y138-V164 HydrophobicContact CE1-CG1 4.41Å; G139-V164 PolarHBondContact O-N 3.21Å; E140-V164 CarbonylContact C-O 3.37Å; E140-V164 WeakPolarHBondContact CA-O 3.32Å; T141-V164 PolarHBondContact N-O 2.88Å; K162-V164 HydrophobicContact CD-CG1 4.41Å; K162-V164 HydrophobicContact CG-CG1 4.12Å; V164-F166 HydrophobicContact CG2-CD1 4.25Å; V164-F166 HydrophobicContact CG2-CD2 3.68Å; V164-F166 HydrophobicContact CG2-CE1 3.93Å; V164-F166 HydrophobicContact CG2-CE2 3.32Å; V164-F166 HydrophobicContact CG2-CG 4.14Å; V164-F166 HydrophobicContact CG2-CZ 3.46Å; V164-F166 VanDerWaalsContact CG2-CZ 3.46Å; V164-F166 PolarHBondContact O-N 2.96Å; V164-C173 HydrophobicContact CB-CB 4.46Å; V164-C173 HydrophobicContact CG2-CB 4.41Å
165	N	97.1	Very high	94.2	Very high	63 Å²	63	54.1 Å²	54.1	34%	0.337	29%	0.292	S	S	.	.			trans	-96.1	70.7	-175.9	-177.5	17.7	0	0	0	111.4	T141 I167 G168 N169 C173	T141-N165 HydrophobicContact CG2-CB 4.13Å; N165-I167 VanDerWaalsContact C-N 3.27Å; N165-I167 PolarHBondContact O-N 3.34Å; N165-G168 WeakPolarHBondContact OD1-CA 3.39Å; N165-G168 PolarHBondContact OD1-N 2.94Å; N165-N169 CarbonylContact O-C 3.51Å; N165-N169 WeakPolarHBondContact O-CA 3.33Å; N165-N169 PolarHBondContact O-N 2.99Å; N165-C173 PolarHBondContact O-SG 3.26Å; N165-C173 VanDerWaalsContact O-SG 3.39Å
166	F	97.8	Very high	94.4	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-34.9	174.9	-65	-65.3	0	0	0	112	E140 V164 P170 C173 I177 V198 G200 T202 A205	E140-F166 VanDerWaalsContact OE2-CA 3.24Å; E140-F166 WeakPolarHBondContact OE2-CA 3.42Å; E140-F166 WeakPolarHBondContact OE2-CB 3.37Å; E140-F166 PolarHBondContact OE2-N 3.31Å; V164-F166 HydrophobicContact CG2-CD1 4.25Å; V164-F166 HydrophobicContact CG2-CD2 3.68Å; V164-F166 HydrophobicContact CG2-CE1 3.93Å; V164-F166 HydrophobicContact CG2-CE2 3.32Å; V164-F166 HydrophobicContact CG2-CG 4.14Å; V164-F166 HydrophobicContact CG2-CZ 3.46Å; V164-F166 VanDerWaalsContact CG2-CZ 3.46Å; V164-F166 PolarHBondContact O-N 2.96Å; F166-P170 WeakPolarHBondContact O-CB 3.06Å; F166-P170 VanDerWaalsContact O-CD 3.24Å; F166-P170 WeakPolarHBondContact O-CD 3.49Å; F166-C173 HydrophobicContact CD1-CB 3.72Å; F166-C173 HydrophobicContact CE1-CB 3.76Å; F166-I177 HydrophobicContact CE1-CD1 3.9Å; F166-I177 HydrophobicContact CZ-CD1 3.96Å; F166-V198 HydrophobicContact CD1-CB 3.99Å; F166-V198 HydrophobicContact CD1-CG1 4.4Å; F166-V198 HydrophobicContact CD1-CG2 4.29Å; F166-V198 HydrophobicContact CE1-CB 3.9Å; F166-V198 HydrophobicContact CE1-CG1 3.84Å; F166-V198 HydrophobicContact CE1-CG2 4.15Å; F166-V198 HydrophobicContact CZ-CG1 4.45Å; F166-G200 WeakPolarHBondContact O-CA 3.08Å; F166-T202 HydrophobicContact CB-CG2 4.34Å; F166-T202 HydrophobicContact CD1-CG2 4Å; F166-T202 HydrophobicContact CD2-CG2 3.55Å; F166-T202 HydrophobicContact CE1-CG2 4.11Å; F166-T202 HydrophobicContact CE2-CG2 3.66Å; F166-T202 HydrophobicContact CG-CG2 3.72Å; F166-T202 HydrophobicContact CZ-CG2 3.93Å; F166-A205 HydrophobicContact CE2-CB 4.41Å; F166-A205 HydrophobicContact CZ-CB 3.96Å
167	I	97	Very high	94.8	Very high	77 Å²	77	50.5 Å²	50.5	40%	0.395	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-49.8	-179.9	-69	171.6	0	0	0	111.4	E140 T142 N165	E140-I167 HydrophobicContact CG-CD1 3.72Å; E140-I167 HydrophobicContact CG-CG1 4.02Å; E140-I167 PolarHBondContact OE2-N 3Å; T142-I167 HydrophobicContact CG2-CD1 4.29Å; N165-I167 VanDerWaalsContact C-N 3.27Å; N165-I167 PolarHBondContact O-N 3.34Å
168	G	97.5	Very high	95.1	Very high	43 Å²	43	50 Å²	50	44%	0.443	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-43.5	-177.3	0	0	0	0	0	113.7	N165	N165-G168 WeakPolarHBondContact OD1-CA 3.39Å; N165-G168 PolarHBondContact OD1-N 2.94Å
169	N	96.9	Very high	95.6	Very high	78 Å²	78	46 Å²	46	42%	0.417	26%	0.263	S	S	.	.			trans	-135.3	60.7	-166.7	-62.9	16.1	0	0	0	112.4	N165 E171 D172 C173	N165-N169 CarbonylContact O-C 3.51Å; N165-N169 WeakPolarHBondContact O-CA 3.33Å; N165-N169 PolarHBondContact O-N 2.99Å; N169-E171 PolarHBondContact O-N 3.44Å; N169-D172 HydrophobicContact CB-CB 4.19Å; N169-D172 PolarHBondContact ND2-OD2 3.44Å; N169-D172 PolarHBondContact O-N 3.27Å; N169-C173 PolarHBondContact O-N 2.84Å; N169-C173 VanDerWaalsContact O-N 3.12Å; N169-C173 PolarHBondContact O-SG 3.3Å
170	P	97.1	Very high	96	Very high	31 Å²	31	47.3 Å²	47.3	20%	0.201	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-36	-173	23.3	-31.4	0	0	0	114.1	F166 C173 R174	F166-P170 WeakPolarHBondContact O-CB 3.06Å; F166-P170 VanDerWaalsContact O-CD 3.24Å; F166-P170 WeakPolarHBondContact O-CD 3.49Å; P170-C173 WeakPolarHBondContact O-CB 3.37Å; P170-C173 PolarHBondContact O-N 3.45Å; P170-R174 PolarHBondContact O-N 3.12Å
171	E	97.3	Very high	96.3	Very high	82 Å²	82	43.6 Å²	43.6	38%	0.383	25%	0.247	S	C	.	.	H	α-helix	trans	-71.1	-37.3	179.5	-77.4	-60.9	134.8	0	0	112.8	N169 C173 R174 A175	N169-E171 PolarHBondContact O-N 3.44Å; E171-C173 VanDerWaalsContact C-N 3.33Å; E171-R174 WeakPolarHBondContact O-CB 3.47Å; E171-R174 PolarHBondContact O-N 2.75Å; E171-R174 IonicContact OE1-NE 2.64Å; E171-R174 IonicContact OE2-CZ 3.68Å; E171-R174 VanDerWaalsContact OE2-CZ 3.28Å; E171-R174 IonicContact OE2-NE 2.82Å; E171-R174 PolarHBondContact OE2-NE 2.93Å; E171-R174 IonicContact OE2-NH2 3.28Å; E171-R174 PolarHBondContact OE2-NH2 3.47Å; E171-A175 PolarHBondContact O-N 2.85Å
172	D	97.2	Very high	96.4	Very high	105 Å²	105	44.9 Å²	44.9	56%	0.561	25%	0.252	S	S	*	.	H	α-helix	trans	-63.7	-42.7	172.8	-66.1	-21.7	0	0	0	110.3	N169 R174 A175 E176	N169-D172 HydrophobicContact CB-CB 4.19Å; N169-D172 PolarHBondContact ND2-OD2 3.44Å; N169-D172 PolarHBondContact O-N 3.27Å; D172-R174 VanDerWaalsContact C-N 3.31Å; D172-R174 PolarHBondContact O-N 3.12Å; D172-A175 PolarHBondContact O-N 3.08Å; D172-E176 WeakPolarHBondContact O-CB 3.5Å; D172-E176 PolarHBondContact O-N 3.22Å
173	C	97.4	Very high	96.2	Very high	7 Å²	7	47.4 Å²	47.4	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-42.7	174.5	-62.8	0	0	0	0	111.1	V164 N165 F166 N169 P170 E171 E176 I177	V164-C173 HydrophobicContact CB-CB 4.46Å; V164-C173 HydrophobicContact CG2-CB 4.41Å; N165-C173 PolarHBondContact O-SG 3.26Å; N165-C173 VanDerWaalsContact O-SG 3.39Å; F166-C173 HydrophobicContact CD1-CB 3.72Å; F166-C173 HydrophobicContact CE1-CB 3.76Å; N169-C173 PolarHBondContact O-N 2.84Å; N169-C173 VanDerWaalsContact O-N 3.12Å; N169-C173 PolarHBondContact O-SG 3.3Å; P170-C173 WeakPolarHBondContact O-CB 3.37Å; P170-C173 PolarHBondContact O-N 3.45Å; E171-C173 VanDerWaalsContact C-N 3.33Å; C173-E176 PolarHBondContact O-N 3.05Å; C173-I177 WeakPolarHBondContact O-CB 3.35Å; C173-I177 WeakPolarHBondContact O-CD1 3.4Å; C173-I177 WeakPolarHBondContact O-CG1 3.36Å; C173-I177 PolarHBondContact O-N 3.37Å
174	R	97.6	Very high	95.9	Very high	40 Å²	40	50.2 Å²	50.2	15%	0.151	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-47.5	176.3	-168.4	-173.3	61	73	7.1	111.7	P170 E171 D172 I177 N178 L193 K194 V198	P170-R174 PolarHBondContact O-N 3.12Å; E171-R174 WeakPolarHBondContact O-CB 3.47Å; E171-R174 PolarHBondContact O-N 2.75Å; E171-R174 IonicContact OE1-NE 2.64Å; E171-R174 IonicContact OE2-CZ 3.68Å; E171-R174 VanDerWaalsContact OE2-CZ 3.28Å; E171-R174 IonicContact OE2-NE 2.82Å; E171-R174 PolarHBondContact OE2-NE 2.93Å; E171-R174 IonicContact OE2-NH2 3.28Å; E171-R174 PolarHBondContact OE2-NH2 3.47Å; D172-R174 VanDerWaalsContact C-N 3.31Å; D172-R174 PolarHBondContact O-N 3.12Å; R174-I177 PolarHBondContact O-N 2.92Å; R174-N178 PolarHBondContact NH1-ND2 3.32Å; R174-N178 PolarHBondContact O-N 3.21Å; R174-L193 HydrophobicContact CG-CB 3.64Å; R174-L193 HydrophobicContact CG-CD1 4.35Å; R174-L193 PolarHBondContact NH1-O 3.25Å; R174-K194 VanDerWaalsContact CD-O 3.27Å; R174-K194 WeakPolarHBondContact CD-O 3.34Å; R174-V198 HydrophobicContact CB-CG2 3.68Å; R174-V198 HydrophobicContact CG-CG2 4.1Å
175	A	97.3	Very high	95.2	Very high	44 Å²	44	49.8 Å²	49.8	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-41.8	179.1	0	0	0	0	0	111.9	E171 D172 N178 T179	E171-A175 PolarHBondContact O-N 2.85Å; D172-A175 PolarHBondContact O-N 3.08Å; A175-N178 PolarHBondContact O-N 3.19Å; A175-T179 WeakPolarHBondContact O-CB 3.45Å; A175-T179 PolarHBondContact O-N 2.69Å; A175-T179 PolarHBondContact O-OG1 3.41Å
176	E	96.8	Very high	94.7	Very high	74 Å²	74	51.6 Å²	51.6	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-46.7	175.7	-169	-161.2	114.4	0	0	111.7	K162 D172 C173 N178 T179 W180	K162-E176 WeakPolarHBondContact CD-OE1 3.2Å; K162-E176 WeakPolarHBondContact CE-OE1 3.34Å; K162-E176 VanDerWaalsContact NZ-CD 3.29Å; K162-E176 IonicContact NZ-OE1 3.74Å; K162-E176 PolarHBondContact NZ-OE1 2.84Å; K162-E176 IonicContact NZ-OE2 3.77Å; D172-E176 WeakPolarHBondContact O-CB 3.5Å; D172-E176 PolarHBondContact O-N 3.22Å; C173-E176 PolarHBondContact O-N 3.05Å; E176-N178 PolarHBondContact O-N 3.24Å; E176-T179 PolarHBondContact O-N 2.84Å; E176-W180 PolarHBondContact O-N 2.83Å
177	I	96.1	Very high	94.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-47	177.9	-68.6	163.2	0	0	0	110.6	Y138 F166 C173 R174 T179 W180 V181 L193 V207	Y138-I177 HydrophobicContact CD1-CD1 4.04Å; Y138-I177 HydrophobicContact CD1-CG1 3.67Å; Y138-I177 HydrophobicContact CD2-CD1 4.19Å; Y138-I177 HydrophobicContact CD2-CG1 3.97Å; Y138-I177 HydrophobicContact CE1-CD1 4.41Å; Y138-I177 HydrophobicContact CE1-CG1 3.54Å; Y138-I177 HydrophobicContact CE2-CB 4.48Å; Y138-I177 HydrophobicContact CE2-CG1 3.86Å; Y138-I177 HydrophobicContact CE2-CG2 4.06Å; Y138-I177 HydrophobicContact CG-CD1 3.91Å; Y138-I177 HydrophobicContact CG-CG1 3.88Å; F166-I177 HydrophobicContact CE1-CD1 3.9Å; F166-I177 HydrophobicContact CZ-CD1 3.96Å; C173-I177 WeakPolarHBondContact O-CB 3.35Å; C173-I177 WeakPolarHBondContact O-CD1 3.4Å; C173-I177 WeakPolarHBondContact O-CG1 3.36Å; C173-I177 PolarHBondContact O-N 3.37Å; R174-I177 PolarHBondContact O-N 2.92Å; I177-T179 PolarHBondContact O-N 3.08Å; I177-W180 PolarHBondContact O-N 3.11Å; I177-V181 WeakPolarHBondContact O-CG2 3.38Å; I177-V181 PolarHBondContact O-N 2.93Å; I177-L193 HydrophobicContact CB-CD1 3.91Å; I177-L193 HydrophobicContact CD1-CD1 3.68Å; I177-L193 HydrophobicContact CG1-CD1 4.39Å; I177-L193 HydrophobicContact CG2-CD1 3.55Å; I177-L193 HydrophobicContact CG2-CG 4.07Å; I177-V207 HydrophobicContact CG2-CG1 3.7Å; I177-V207 HydrophobicContact CG2-CG2 4.41Å
178	N	96.3	Very high	93.8	Very high	9 Å²	9	57 Å²	57	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-43.2	178.8	-78.1	-11.9	0	0	0	112.1	R174 A175 E176 W180 V181 E182 L192 L193	R174-N178 PolarHBondContact NH1-ND2 3.32Å; R174-N178 PolarHBondContact O-N 3.21Å; A175-N178 PolarHBondContact O-N 3.19Å; E176-N178 PolarHBondContact O-N 3.24Å; N178-W180 VanDerWaalsContact C-N 3.35Å; N178-W180 PolarHBondContact O-N 3.43Å; N178-V181 PolarHBondContact O-N 3.35Å; N178-E182 WeakPolarHBondContact O-CB 3.49Å; N178-E182 PolarHBondContact O-N 3.28Å; N178-L192 PolarHBondContact OD1-N 2.84Å; N178-L192 VanDerWaalsContact OD1-N 3.16Å; N178-L193 PolarHBondContact ND2-O 3.33Å; N178-L193 PolarHBondContact OD1-N 3.4Å
179	T	96.3	Very high	93.2	Very high	71 Å²	71	55 Å²	55	44%	0.436	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-46.5	177.1	-55.9	0	0	0	0	110.8	A175 E176 I177 V181 E182 E183	A175-T179 WeakPolarHBondContact O-CB 3.45Å; A175-T179 PolarHBondContact O-N 2.69Å; A175-T179 PolarHBondContact O-OG1 3.41Å; E176-T179 PolarHBondContact O-N 2.84Å; I177-T179 PolarHBondContact O-N 3.08Å; T179-V181 PolarHBondContact O-N 2.98Å; T179-E182 PolarHBondContact O-N 3.22Å; T179-E183 WeakPolarHBondContact O-CG 3.38Å; T179-E183 PolarHBondContact O-N 2.94Å
180	W	95	Very high	93	Very high	32 Å²	32	55.8 Å²	55.8	12%	0.121	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-41.4	178.2	176.1	80.8	0	0	0	112.4	A134 R136 E176 I177 N178 K184 V207	A134-W180 HydrophobicContact CB-CH2 4.04Å; A134-W180 HydrophobicContact CB-CZ3 4.04Å; R136-W180 HydrophobicContact CB-CH2 3.44Å; R136-W180 VanDerWaalsContact CB-CH2 3.44Å; R136-W180 HydrophobicContact CB-CZ2 4.01Å; R136-W180 HydrophobicContact CB-CZ3 3.74Å; R136-W180 HydrophobicContact CG-CH2 4.46Å; R136-W180 VanDerWaalsContact CZ-CE2 3.46Å; R136-W180 VanDerWaalsContact CZ-NE1 3.32Å; R136-W180 VanDerWaalsContact NH1-CD1 3.28Å; R136-W180 VanDerWaalsContact NH1-CE2 3.35Å; E176-W180 PolarHBondContact O-N 2.83Å; I177-W180 PolarHBondContact O-N 3.11Å; N178-W180 VanDerWaalsContact C-N 3.35Å; N178-W180 PolarHBondContact O-N 3.43Å; W180-K184 HydrophobicContact CD2-CG 4.12Å; W180-K184 HydrophobicContact CH2-CG 4.4Å; W180-K184 HydrophobicContact CZ2-CD 4.49Å; W180-K184 HydrophobicContact CZ2-CG 3.83Å; W180-K184 WeakPolarHBondContact O-CB 3.43Å; W180-K184 VanDerWaalsContact O-CG 3.26Å; W180-K184 WeakPolarHBondContact O-CG 3.44Å; W180-K184 PolarHBondContact O-N 3.27Å; W180-V207 HydrophobicContact CZ3-CG2 4.02Å
181	V	92.4	Very high	92.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-44	175.9	170.6	0	0	0	0	111	I177 N178 T179 E183 K184 T185 I189 L192 A209	I177-V181 WeakPolarHBondContact O-CG2 3.38Å; I177-V181 PolarHBondContact O-N 2.93Å; N178-V181 PolarHBondContact O-N 3.35Å; T179-V181 PolarHBondContact O-N 2.98Å; V181-E183 PolarHBondContact O-N 3.01Å; V181-K184 PolarHBondContact O-N 2.74Å; V181-T185 HydrophobicContact CG1-CG2 4.3Å; V181-T185 WeakPolarHBondContact O-CB 3.5Å; V181-T185 VanDerWaalsContact O-CG2 3.28Å; V181-T185 WeakPolarHBondContact O-CG2 3.39Å; V181-T185 PolarHBondContact O-N 2.93Å; V181-T185 PolarHBondContact O-OG1 3.48Å; V181-I189 HydrophobicContact CG1-CB 4.21Å; V181-I189 HydrophobicContact CG1-CG2 3.87Å; V181-L192 HydrophobicContact CG1-CB 4.26Å; V181-L192 HydrophobicContact CG1-CD2 4.32Å; V181-L192 HydrophobicContact CG2-CB 4.49Å; V181-L192 HydrophobicContact CG2-CD2 3.71Å; V181-A209 HydrophobicContact CG1-CB 3.49Å; V181-A209 VanDerWaalsContact CG1-CB 3.49Å
182	E	92.9	Very high	92.5	Very high	49 Å²	49	55.9 Å²	55.9	23%	0.229	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-47.2	179	-171.6	174.1	-178.2	0	0	111	N178 T179 K184 T185 E186 N187 I189 K190	N178-E182 WeakPolarHBondContact O-CB 3.49Å; N178-E182 PolarHBondContact O-N 3.28Å; T179-E182 PolarHBondContact O-N 3.22Å; E182-K184 PolarHBondContact O-N 3.15Å; E182-T185 CarbonylContact O-C 3.51Å; E182-T185 PolarHBondContact O-N 3.08Å; E182-T185 PolarHBondContact O-OG1 2.71Å; E182-E186 PolarHBondContact O-N 2.8Å; E182-N187 HydrophobicContact CG-CB 4.05Å; E182-N187 WeakPolarHBondContact CG-OD1 3.36Å; E182-N187 WeakPolarHBondContact O-CA 3.28Å; E182-N187 PolarHBondContact O-N 2.61Å; E182-N187 PolarHBondContact OE1-OD1 3.5Å; E182-I189 WeakPolarHBondContact CA-O 3.38Å; E182-K190 HydrophobicContact CG-CG 4.08Å; E182-K190 WeakPolarHBondContact OE1-CD 3.42Å; E182-K190 WeakPolarHBondContact OE1-CE 3.29Å; E182-K190 IonicContact OE1-NZ 2.7Å; E182-K190 PolarHBondContact OE1-NZ 3.12Å
183	E	91.9	Very high	92.4	Very high	130 Å²	130	50.9 Å²	50.9	61%	0.607	25%	0.25	S	S	*	.	H	α-helix	trans	-60.6	-46.2	176.3	-72	174.5	177.8	0	0	112.4	T179 V181 T185 E186	T179-E183 WeakPolarHBondContact O-CG 3.38Å; T179-E183 PolarHBondContact O-N 2.94Å; V181-E183 PolarHBondContact O-N 3.01Å; E183-T185 PolarHBondContact O-N 3.4Å; E183-E186 PolarHBondContact O-N 3.42Å
184	K	88.1	Confident	92.2	Very high	111 Å²	111	55.4 Å²	55.4	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-69.5	-20.9	-178.7	-69.7	-62.6	-178.6	-175.3	0	113.8	A134 W180 V181 E182	A134-K184 HydrophobicContact CB-CB 3.66Å; A134-K184 HydrophobicContact CB-CG 4.44Å; W180-K184 HydrophobicContact CD2-CG 4.12Å; W180-K184 HydrophobicContact CH2-CG 4.4Å; W180-K184 HydrophobicContact CZ2-CD 4.49Å; W180-K184 HydrophobicContact CZ2-CG 3.83Å; W180-K184 WeakPolarHBondContact O-CB 3.43Å; W180-K184 VanDerWaalsContact O-CG 3.26Å; W180-K184 WeakPolarHBondContact O-CG 3.44Å; W180-K184 PolarHBondContact O-N 3.27Å; V181-K184 PolarHBondContact O-N 2.74Å; E182-K184 PolarHBondContact O-N 3.15Å
185	T	84.1	Confident	92.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	17.9	-179.3	62.6	0	0	0	0	112.5	A134 V181 E182 E183 N187 K188 I189 A209	A134-T185 HydrophobicContact CB-CG2 4.12Å; V181-T185 HydrophobicContact CG1-CG2 4.3Å; V181-T185 WeakPolarHBondContact O-CB 3.5Å; V181-T185 VanDerWaalsContact O-CG2 3.28Å; V181-T185 WeakPolarHBondContact O-CG2 3.39Å; V181-T185 PolarHBondContact O-N 2.93Å; V181-T185 PolarHBondContact O-OG1 3.48Å; E182-T185 CarbonylContact O-C 3.51Å; E182-T185 PolarHBondContact O-N 3.08Å; E182-T185 PolarHBondContact O-OG1 2.71Å; E183-T185 PolarHBondContact O-N 3.4Å; T185-N187 PolarHBondContact O-N 3.32Å; T185-K188 VanDerWaalsContact O-CB 3.23Å; T185-K188 WeakPolarHBondContact O-CB 3.48Å; T185-K188 VanDerWaalsContact O-CG 3.26Å; T185-K188 WeakPolarHBondContact O-CG 3.37Å; T185-K188 PolarHBondContact O-N 2.87Å; T185-I189 HydrophobicContact CG2-CB 4.02Å; T185-I189 HydrophobicContact CG2-CD1 3.99Å; T185-I189 HydrophobicContact CG2-CG1 4.15Å; T185-I189 WeakPolarHBondContact OG1-CB 3.31Å; T185-I189 PolarHBondContact OG1-N 3.48Å; T185-I189 VanDerWaalsContact OG1-N 3.15Å; T185-I189 PolarHBondContact OG1-O 3.33Å; T185-A209 HydrophobicContact CG2-CB 4.13Å
186	E	86	Confident	91.8	Very high	101 Å²	101	58.8 Å²	58.8	47%	0.472	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	38.7	179.7	-60.4	179.6	-169.4	0	0	112.7	K132 E182 E183 K188	K132-E186 WeakPolarHBondContact CE-OE1 3.42Å; K132-E186 IonicContact NZ-OE1 3.02Å; E182-E186 PolarHBondContact O-N 2.8Å; E183-E186 PolarHBondContact O-N 3.42Å; E186-K188 PolarHBondContact O-N 2.98Å
187	N	88.8	Confident	91.6	Very high	95 Å²	95	57.4 Å²	57.4	51%	0.508	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	16.5	-177.2	-44.4	-81.2	0	0	0	115.2	E182 T185 K190	E182-N187 HydrophobicContact CG-CB 4.05Å; E182-N187 WeakPolarHBondContact CG-OD1 3.36Å; E182-N187 WeakPolarHBondContact O-CA 3.28Å; E182-N187 PolarHBondContact O-N 2.61Å; E182-N187 PolarHBondContact OE1-OD1 3.5Å; T185-N187 PolarHBondContact O-N 3.32Å; N187-K190 WeakPolarHBondContact O-CE 3.4Å
188	K	86.4	Confident	91.6	Very high	96 Å²	96	57.4 Å²	57.4	42%	0.417	30%	0.299	S	S	.	.	S	Bend	trans	-80.2	-30	176.7	-60.5	-60.6	179.6	-173.6	0	112.9	T185 E186 Y211	T185-K188 VanDerWaalsContact O-CB 3.23Å; T185-K188 WeakPolarHBondContact O-CB 3.48Å; T185-K188 VanDerWaalsContact O-CG 3.26Å; T185-K188 WeakPolarHBondContact O-CG 3.37Å; T185-K188 PolarHBondContact O-N 2.87Å; E186-K188 PolarHBondContact O-N 2.98Å; K188-Y211 HydrophobicContact CB-CD2 4.02Å; K188-Y211 HydrophobicContact CB-CE2 4.37Å; K188-Y211 HydrophobicContact CB-CG 4.24Å; K188-Y211 HydrophobicContact CD-CE2 4.36Å; K188-Y211 HydrophobicContact CG-CD1 4.31Å; K188-Y211 HydrophobicContact CG-CD2 4.01Å; K188-Y211 HydrophobicContact CG-CE1 4.2Å; K188-Y211 HydrophobicContact CG-CE2 3.93Å; K188-Y211 HydrophobicContact CG-CG 4.2Å
189	I	86.1	Confident	91.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	-116.9	109.8	179.5	-59.2	-177.5	0	0	0	108.4	V181 E182 T185 A209 I210 K367 F369	V181-I189 HydrophobicContact CG1-CB 4.21Å; V181-I189 HydrophobicContact CG1-CG2 3.87Å; E182-I189 WeakPolarHBondContact CA-O 3.38Å; T185-I189 HydrophobicContact CG2-CB 4.02Å; T185-I189 HydrophobicContact CG2-CD1 3.99Å; T185-I189 HydrophobicContact CG2-CG1 4.15Å; T185-I189 WeakPolarHBondContact OG1-CB 3.31Å; T185-I189 PolarHBondContact OG1-N 3.48Å; T185-I189 VanDerWaalsContact OG1-N 3.15Å; T185-I189 PolarHBondContact OG1-O 3.33Å; I189-A209 HydrophobicContact CD1-CB 3.85Å; I189-A209 HydrophobicContact CG2-CB 4.1Å; I189-I210 WeakPolarHBondContact CD1-O 3.33Å; I189-K367 HydrophobicContact CG2-CB 4Å; I189-K367 HydrophobicContact CG2-CD 3.6Å; I189-K367 HydrophobicContact CG2-CG 3.79Å; I189-F369 HydrophobicContact CG1-CB 4.45Å
190	K	91.1	Very high	91.6	Very high	95 Å²	95	58.1 Å²	58.1	41%	0.413	31%	0.307	S	S	.	.			trans	-111.7	157.9	177.3	-55.2	-171.1	-175.1	-129.4	0	110.5	E182 N187 L192 K367	E182-K190 HydrophobicContact CG-CG 4.08Å; E182-K190 WeakPolarHBondContact OE1-CD 3.42Å; E182-K190 WeakPolarHBondContact OE1-CE 3.29Å; E182-K190 IonicContact OE1-NZ 2.7Å; E182-K190 PolarHBondContact OE1-NZ 3.12Å; N187-K190 WeakPolarHBondContact O-CE 3.4Å; K190-L192 VanDerWaalsContact C-N 3.28Å; K190-L192 PolarHBondContact O-N 3.07Å; K190-K367 PolarHBondContact O-NZ 2.59Å
191	D	91.9	Very high	91.6	Very high	106 Å²	106	63.1 Å²	63.1	57%	0.567	33%	0.334	S	S	*	.			trans	48.7	47.1	172	-61.6	-53.1	0	0	0	113.6	L193	D191-L193 VanDerWaalsContact C-N 3.3Å; D191-L193 PolarHBondContact O-N 3.47Å
192	L	92.8	Very high	91.8	Very high	8 Å²	8	63.2 Å²	63.2	4%	0.042	34%	0.335	C	S	.	.			trans	-56.2	-47.3	179.1	175.4	67.7	0	0	0	111.2	N178 V181 K190 V207 A365 K367	N178-L192 PolarHBondContact OD1-N 2.84Å; N178-L192 VanDerWaalsContact OD1-N 3.16Å; V181-L192 HydrophobicContact CG1-CB 4.26Å; V181-L192 HydrophobicContact CG1-CD2 4.32Å; V181-L192 HydrophobicContact CG2-CB 4.49Å; V181-L192 HydrophobicContact CG2-CD2 3.71Å; K190-L192 VanDerWaalsContact C-N 3.28Å; K190-L192 PolarHBondContact O-N 3.07Å; L192-V207 HydrophobicContact CD2-CB 3.64Å; L192-V207 HydrophobicContact CD2-CG1 3.9Å; L192-A365 HydrophobicContact CD1-CB 4.3Å; L192-A365 HydrophobicContact CD2-CB 4.32Å; L192-A365 HydrophobicContact CG-CB 4.11Å; L192-K367 HydrophobicContact CD1-CB 3.29Å; L192-K367 HydrophobicContact CD1-CD 4.28Å; L192-K367 HydrophobicContact CD1-CG 4.41Å
193	L	94.8	Very high	92	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.336	C	S	.	.	S	Bend	trans	-96.3	115.6	176.3	-58.3	-173.9	0	0	0	110	R174 I177 N178 D191 T197 V198 V207 A365	R174-L193 HydrophobicContact CG-CB 3.64Å; R174-L193 HydrophobicContact CG-CD1 4.35Å; R174-L193 PolarHBondContact NH1-O 3.25Å; I177-L193 HydrophobicContact CB-CD1 3.91Å; I177-L193 HydrophobicContact CD1-CD1 3.68Å; I177-L193 HydrophobicContact CG1-CD1 4.39Å; I177-L193 HydrophobicContact CG2-CD1 3.55Å; I177-L193 HydrophobicContact CG2-CG 4.07Å; N178-L193 PolarHBondContact ND2-O 3.33Å; N178-L193 PolarHBondContact OD1-N 3.4Å; D191-L193 VanDerWaalsContact C-N 3.3Å; D191-L193 PolarHBondContact O-N 3.47Å; L193-T197 HydrophobicContact CD2-CG2 3.84Å; L193-V198 HydrophobicContact CD1-CG1 4.03Å; L193-V207 HydrophobicContact CD1-CG1 4.48Å; L193-V207 HydrophobicContact CD2-CG1 4.25Å; L193-A365 HydrophobicContact CD2-CB 3.34Å
194	K	94.1	Very high	92.2	Very high	103 Å²	103	57.9 Å²	57.9	45%	0.448	31%	0.307	S	S	.	.			trans	-73.8	156.2	174.1	-67.1	173.8	178	158.1	0	110.2	R174 G196 T197 D327	R174-K194 VanDerWaalsContact CD-O 3.27Å; R174-K194 WeakPolarHBondContact CD-O 3.34Å; K194-G196 PolarHBondContact O-N 3.49Å; K194-T197 PolarHBondContact N-OG1 3.25Å; K194-T197 VanDerWaalsContact O-CB 3.29Å; K194-T197 WeakPolarHBondContact O-CB 3.49Å; K194-T197 PolarHBondContact O-N 3.46Å; K194-T197 PolarHBondContact O-OG1 3.03Å; K194-D327 WeakPolarHBondContact CE-OD2 3.36Å; K194-D327 IonicContact NZ-OD1 3.67Å; K194-D327 PolarHBondContact NZ-OD1 2.93Å; K194-D327 IonicContact NZ-OD2 3.64Å; K194-D327 PolarHBondContact NZ-OD2 2.95Å
195	P	94.1	Very high	92.7	Very high	103 Å²	103	52.6 Å²	52.6	67%	0.669	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	134	174.3	-27.2	35.7	0	0	0	111.6	T197	P195-T197 VanDerWaalsContact C-N 3.31Å; P195-T197 PolarHBondContact O-N 3.33Å
196	G	91.6	Very high	93.2	Very high	52 Å²	52	52.6 Å²	52.6	54%	0.536	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-5.9	-177.8	0	0	0	0	0	116.4	K194 V198	K194-G196 PolarHBondContact O-N 3.49Å; G196-V198 VanDerWaalsContact C-N 3.27Å; G196-V198 PolarHBondContact O-N 3.44Å
197	T	92.4	Very high	93.6	Very high	44 Å²	44	47.8 Å²	47.8	27%	0.27	26%	0.261	S	S	.	.	S	Bend	trans	-62.1	-35.3	174.2	-60.7	0	0	0	0	112	L193 K194 P195 T363	L193-T197 HydrophobicContact CD2-CG2 3.84Å; K194-T197 PolarHBondContact N-OG1 3.25Å; K194-T197 VanDerWaalsContact O-CB 3.29Å; K194-T197 WeakPolarHBondContact O-CB 3.49Å; K194-T197 PolarHBondContact O-N 3.46Å; K194-T197 PolarHBondContact O-OG1 3.03Å; P195-T197 VanDerWaalsContact C-N 3.31Å; P195-T197 PolarHBondContact O-N 3.33Å; T197-T363 HydrophobicContact CG2-CG2 4.46Å
198	V	95.6	Very high	93.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	24%	0.237	C	C	.	.	S	Bend	trans	-116	146.8	171.1	-63.6	0	0	0	0	109.9	F166 R174 L193 G196 T202 T363	F166-V198 HydrophobicContact CD1-CB 3.99Å; F166-V198 HydrophobicContact CD1-CG1 4.4Å; F166-V198 HydrophobicContact CD1-CG2 4.29Å; F166-V198 HydrophobicContact CE1-CB 3.9Å; F166-V198 HydrophobicContact CE1-CG1 3.84Å; F166-V198 HydrophobicContact CE1-CG2 4.15Å; F166-V198 HydrophobicContact CZ-CG1 4.45Å; R174-V198 HydrophobicContact CB-CG2 3.68Å; R174-V198 HydrophobicContact CG-CG2 4.1Å; L193-V198 HydrophobicContact CD1-CG1 4.03Å; G196-V198 VanDerWaalsContact C-N 3.27Å; G196-V198 PolarHBondContact O-N 3.44Å; V198-T202 WeakPolarHBondContact CA-OG1 3.07Å; V198-T202 HydrophobicContact CB-CG2 4.44Å; V198-T202 HydrophobicContact CG1-CG2 4.25Å; V198-T363 HydrophobicContact CG1-CG2 4.27Å
199	N	96.3	Very high	94	Very high	61 Å²	61	38.8 Å²	38.8	33%	0.326	22%	0.218	S	C	.	.			trans	-154.1	-178.4	-177.1	60.7	57.7	0	0	0	110.9	M201 T202	N199-M201 PolarHBondContact O-N 3.25Å; N199-M201 WeakPolarHBondContact OD1-CA 3.29Å; N199-M201 VanDerWaalsContact OD1-CB 3.29Å; N199-M201 WeakPolarHBondContact OD1-CB 2.78Å; N199-M201 PolarHBondContact OD1-N 2.9Å; N199-T202 PolarHBondContact N-OG1 2.81Å; N199-T202 WeakPolarHBondContact O-CB 3.37Å; N199-T202 PolarHBondContact O-N 3.42Å; N199-T202 PolarHBondContact O-OG1 3.26Å; N199-T202 VanDerWaalsContact O-OG1 3.11Å
200	G	96.4	Very high	94.1	Very high	33 Å²	33	39 Å²	39	34%	0.34	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-13	-178.3	0	0	0	0	0	115.7	F166 R203	F166-G200 WeakPolarHBondContact O-CA 3.08Å; G200-R203 PolarHBondContact O-NH1 2.86Å
201	M	95.3	Very high	93.8	Very high	137 Å²	137	35.2 Å²	35.2	68%	0.675	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-8	173.9	-56.6	-174.2	-69.9	0	0	113	N199 R203	N199-M201 PolarHBondContact O-N 3.25Å; N199-M201 WeakPolarHBondContact OD1-CA 3.29Å; N199-M201 VanDerWaalsContact OD1-CB 3.29Å; N199-M201 WeakPolarHBondContact OD1-CB 2.78Å; N199-M201 PolarHBondContact OD1-N 2.9Å; M201-R203 PolarHBondContact O-N 2.92Å; M201-R203 PolarHBondContact O-NH1 2.89Å
202	T	97.1	Very high	93.4	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	18%	0.176	C	C	.	.			trans	-62.6	134.1	176.5	-59.3	0	0	0	0	109.8	F166 V198 N199 A205	F166-T202 HydrophobicContact CB-CG2 4.34Å; F166-T202 HydrophobicContact CD1-CG2 4Å; F166-T202 HydrophobicContact CD2-CG2 3.55Å; F166-T202 HydrophobicContact CE1-CG2 4.11Å; F166-T202 HydrophobicContact CE2-CG2 3.66Å; F166-T202 HydrophobicContact CG-CG2 3.72Å; F166-T202 HydrophobicContact CZ-CG2 3.93Å; V198-T202 WeakPolarHBondContact CA-OG1 3.07Å; V198-T202 HydrophobicContact CB-CG2 4.44Å; V198-T202 HydrophobicContact CG1-CG2 4.25Å; N199-T202 PolarHBondContact N-OG1 2.81Å; N199-T202 WeakPolarHBondContact O-CB 3.37Å; N199-T202 PolarHBondContact O-N 3.42Å; N199-T202 PolarHBondContact O-OG1 3.26Å; N199-T202 VanDerWaalsContact O-OG1 3.11Å; T202-A205 HydrophobicContact CG2-CB 4.36Å
203	R	96.6	Very high	93	Very high	66 Å²	66	34.3 Å²	34.3	25%	0.249	19%	0.193	C	C	.	.			trans	-120.4	-37.7	177.4	-66.4	-61.6	175.9	-92.6	1.3	112.6	E140 G200 M201 L359 F360 S362	E140-R203 PolarHBondContact N-O 3.23Å; G200-R203 PolarHBondContact O-NH1 2.86Å; M201-R203 PolarHBondContact O-N 2.92Å; M201-R203 PolarHBondContact O-NH1 2.89Å; R203-L359 HydrophobicContact CB-CD2 4.22Å; R203-F360 HydrophobicContact CB-CD1 4.24Å; R203-F360 HydrophobicContact CB-CE1 4.02Å; R203-F360 HydrophobicContact CB-CZ 4.46Å; R203-F360 HydrophobicContact CG-CD1 4.07Å; R203-F360 HydrophobicContact CG-CE1 3.47Å; R203-F360 VanDerWaalsContact CG-CE1 3.47Å; R203-F360 HydrophobicContact CG-CZ 4.02Å; R203-S362 PolarHBondContact N-OG 3.11Å
204	L	97.3	Very high	92.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	127.4	176.2	-173.7	68.6	0	0	0	108.7	L137 Y138 L161 L350 M353 F360 L361 S362	L137-L204 HydrophobicContact CB-CD1 4.46Å; L137-L204 HydrophobicContact CD2-CD1 4.2Å; L137-L204 HydrophobicContact CD2-CD2 4.5Å; L137-L204 HydrophobicContact CD2-CG 4.37Å; Y138-L204 CarbonylContact O-C 3.53Å; Y138-L204 WeakPolarHBondContact O-CA 2.86Å; L161-L204 HydrophobicContact CD1-CD1 4.36Å; L204-L350 HydrophobicContact CD2-CD1 3.91Å; L204-M353 HydrophobicContact CD2-CE 4.46Å; L204-M353 HydrophobicContact CD2-SD 3.98Å; L204-F360 WeakPolarHBondContact CB-O 3.36Å; L204-L361 HydrophobicContact CB-CD1 4.49Å; L204-L361 HydrophobicContact CD2-CD1 4.05Å; L204-L361 HydrophobicContact CG-CD1 4.05Å; L204-S362 PolarHBondContact N-OG 3.19Å; L204-S362 WeakPolarHBondContact O-CB 3.3Å; L204-S362 PolarHBondContact O-N 3.36Å
205	A	97.1	Very high	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.1	173.6	0	0	0	0	0	109	Y138 F166 T202 T363	Y138-A205 PolarHBondContact N-O 3.03Å; Y138-A205 PolarHBondContact O-N 2.99Å; F166-A205 HydrophobicContact CE2-CB 4.41Å; F166-A205 HydrophobicContact CZ-CB 3.96Å; T202-A205 HydrophobicContact CG2-CB 4.36Å; A205-T363 HydrophobicContact CB-CG2 3.6Å
206	L	96.5	Very high	92.2	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.4	169.8	178	65.4	0	0	0	108.6	A83 M84 M86 V87 L137 L361 T363 V364 A365	A83-L206 HydrophobicContact CB-CD1 4.04Å; A83-L206 HydrophobicContact CB-CD2 3.88Å; A83-L206 HydrophobicContact CB-CG 4.28Å; M84-L206 HydrophobicContact CG-CD2 4.16Å; M84-L206 HydrophobicContact SD-CD2 3.41Å; M84-L206 WeakPolarHBondContact SD-CD2 3.46Å; M86-L206 HydrophobicContact CE-CD1 3.88Å; V87-L206 HydrophobicContact CG2-CD2 4.2Å; L137-L206 HydrophobicContact CD2-CB 3.98Å; L137-L206 HydrophobicContact CD2-CD1 3.52Å; L137-L206 HydrophobicContact CD2-CG 4.31Å; L137-L206 HydrophobicContact CG-CD1 4.04Å; L206-L361 HydrophobicContact CB-CD1 3.94Å; L206-T363 PolarHBondContact N-O 2.73Å; L206-V364 HydrophobicContact CB-CG2 4.39Å; L206-V364 HydrophobicContact CD2-CG1 4.07Å; L206-V364 HydrophobicContact CG-CG1 4.49Å; L206-V364 WeakPolarHBondContact O-CA 3.18Å; L206-A365 PolarHBondContact O-N 3.06Å
207	V	94	Very high	92.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.6	172.4	-61	0	0	0	0	110.8	N135 R136 Y138 I177 W180 L192 L193 A365	N135-V207 WeakPolarHBondContact CA-O 3.33Å; R136-V207 HydrophobicContact CB-CG2 4.12Å; R136-V207 PolarHBondContact N-O 3.32Å; R136-V207 VanDerWaalsContact N-O 3.12Å; R136-V207 WeakPolarHBondContact O-CG2 3.26Å; R136-V207 PolarHBondContact O-N 2.85Å; Y138-V207 HydrophobicContact CD2-CG1 4.46Å; Y138-V207 HydrophobicContact CD2-CG2 3.93Å; Y138-V207 HydrophobicContact CE2-CG2 3.52Å; I177-V207 HydrophobicContact CG2-CG1 3.7Å; I177-V207 HydrophobicContact CG2-CG2 4.41Å; W180-V207 HydrophobicContact CZ3-CG2 4.02Å; L192-V207 HydrophobicContact CD2-CB 3.64Å; L192-V207 HydrophobicContact CD2-CG1 3.9Å; L193-V207 HydrophobicContact CD1-CG1 4.48Å; L193-V207 HydrophobicContact CD2-CG1 4.25Å; V207-A365 HydrophobicContact CG1-CB 4.49Å
208	N	93.3	Very high	92.3	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	103.5	-178.1	-178.3	-103.1	0	0	0	109.2	S79 A83 N135 A365 H366 K367	S79-N208 PolarHBondContact O-ND2 3.36Å; S79-N208 VanDerWaalsContact O-ND2 3.13Å; S79-N208 PolarHBondContact OG-ND2 2.89Å; S79-N208 PolarHBondContact OG-OD1 3.3Å; A83-N208 HydrophobicContact CB-CB 4.24Å; N135-N208 VanDerWaalsContact CG-ND2 3.27Å; N135-N208 PolarHBondContact ND2-ND2 3.04Å; N135-N208 PolarHBondContact OD1-ND2 3.03Å; N208-A365 PolarHBondContact N-O 3.04Å; N208-H366 VanDerWaalsContact O-CA 3.26Å; N208-H366 WeakPolarHBondContact O-CA 3.29Å; N208-H366 PolarHBondContact O-ND1 2.89Å; N208-H366 PolarHBondContact OD1-CE1 3.2Å; N208-H366 PolarHBondContact OD1-ND1 3.31Å; N208-K367 PolarHBondContact O-N 3.14Å
209	A	89.4	Confident	92.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.5	175	0	0	0	0	0	109.6	A134 V181 T185 I189 K367	A134-A209 HydrophobicContact CB-CB 4.23Å; A134-A209 PolarHBondContact N-O 3.02Å; A134-A209 PolarHBondContact O-N 3.32Å; V181-A209 HydrophobicContact CG1-CB 3.49Å; V181-A209 VanDerWaalsContact CG1-CB 3.49Å; T185-A209 HydrophobicContact CG2-CB 4.13Å; I189-A209 HydrophobicContact CD1-CB 3.85Å; I189-A209 HydrophobicContact CG2-CB 4.1Å; A209-K367 WeakPolarHBondContact CA-O 3.24Å
210	I	87.8	Confident	91.9	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	130.6	-177.1	-173.8	173.3	0	0	0	111.9	S76 L131 K132 V133 I189 K367 A368 F369 F417	S76-I210 VanDerWaalsContact CB-CG2 3.47Å; L131-I210 HydrophobicContact CD1-CD1 3.96Å; L131-I210 HydrophobicContact CD1-CG1 4.11Å; L131-I210 HydrophobicContact CD2-CD1 4.43Å; L131-I210 HydrophobicContact CG-CD1 4.32Å; K132-I210 WeakPolarHBondContact O-CA 3.5Å; V133-I210 HydrophobicContact CG2-CD1 3.8Å; V133-I210 HydrophobicContact CG2-CG1 3.97Å; I189-I210 WeakPolarHBondContact CD1-O 3.33Å; I210-K367 PolarHBondContact N-O 2.88Å; I210-K367 VanDerWaalsContact N-O 3.09Å; I210-A368 HydrophobicContact CG2-CB 4.12Å; I210-F369 PolarHBondContact O-N 3.17Å; I210-F417 HydrophobicContact CD1-CE1 4.19Å; I210-F417 HydrophobicContact CD1-CE2 4.49Å; I210-F417 HydrophobicContact CD1-CZ 3.74Å; I210-F417 HydrophobicContact CG1-CE1 4.19Å; I210-F417 HydrophobicContact CG1-CZ 3.81Å; I210-F417 HydrophobicContact CG2-CE1 3.91Å; I210-F417 HydrophobicContact CG2-CZ 4.41Å
211	Y	85.1	Confident	91.8	Very high	16 Å²	16	33.9 Å²	33.9	6%	0.063	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.9	179.3	168.1	-112.9	0	0	0	109.7	I130 K132 K188 K213 F369	I130-Y211 HydrophobicContact CG2-CE1 4.49Å; K132-Y211 HydrophobicContact CB-CD1 4.39Å; K132-Y211 HydrophobicContact CG-CD1 4.22Å; K132-Y211 PolarHBondContact N-O 2.81Å; K132-Y211 PolarHBondContact O-N 3.09Å; K188-Y211 HydrophobicContact CB-CD2 4.02Å; K188-Y211 HydrophobicContact CB-CE2 4.37Å; K188-Y211 HydrophobicContact CB-CG 4.24Å; K188-Y211 HydrophobicContact CD-CE2 4.36Å; K188-Y211 HydrophobicContact CG-CD1 4.31Å; K188-Y211 HydrophobicContact CG-CD2 4.01Å; K188-Y211 HydrophobicContact CG-CE1 4.2Å; K188-Y211 HydrophobicContact CG-CE2 3.93Å; K188-Y211 HydrophobicContact CG-CG 4.2Å; Y211-K213 HydrophobicContact CE1-CB 4.12Å; Y211-K213 WeakPolarHBondContact OH-CB 3.2Å; Y211-F369 HydrophobicContact CD2-CB 4.39Å; Y211-F369 AromaticContact CD2-CD1 3.57Å; Y211-F369 HydrophobicContact CD2-CD1 3.57Å; Y211-F369 HydrophobicContact CD2-CE1 4.29Å; Y211-F369 HydrophobicContact CD2-CG 4.34Å; Y211-F369 AromaticContact CE2-CD1 3.6Å; Y211-F369 HydrophobicContact CE2-CD1 3.6Å; Y211-F369 AromaticContact CE2-CE1 3.86Å; Y211-F369 HydrophobicContact CE2-CE1 3.86Å
212	F	83.9	Confident	91.7	Very high	5 Å²	5	30.3 Å²	30.3	2%	0.022	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.3	175.2	170.6	-105	0	0	0	111.3	Y129 I130 L131 G214 Y266 L271 I407 F417	Y129-F212 HydrophobicContact CD2-CD2 4.42Å; Y129-F212 HydrophobicContact CD2-CE2 4.07Å; Y129-F212 HydrophobicContact CG-CE2 4.2Å; I130-F212 WeakPolarHBondContact O-CA 3.34Å; L131-F212 HydrophobicContact CD1-CB 3.96Å; L131-F212 HydrophobicContact CD1-CD2 4.01Å; L131-F212 HydrophobicContact CD1-CG 4.46Å; F212-G214 VanDerWaalsContact CZ-CA 3.46Å; F212-G214 VanDerWaalsContact CZ-N 3.35Å; F212-Y266 AromaticContact CE1-CE1 3.89Å; F212-Y266 HydrophobicContact CE1-CE1 3.89Å; F212-Y266 HydrophobicContact CE1-CE2 4.23Å; F212-Y266 AromaticContact CE1-CZ 3.62Å; F212-Y266 WeakPolarHBondContact CE1-OH 3.42Å; F212-Y266 HydrophobicContact CZ-CD1 4.21Å; F212-Y266 HydrophobicContact CZ-CD2 4.37Å; F212-Y266 AromaticContact CZ-CE1 3.83Å; F212-Y266 HydrophobicContact CZ-CE1 3.83Å; F212-Y266 AromaticContact CZ-CE2 3.99Å; F212-Y266 HydrophobicContact CZ-CE2 3.99Å; F212-Y266 HydrophobicContact CZ-CG 4.47Å; F212-Y266 AromaticContact CZ-CZ 3.71Å; F212-L271 HydrophobicContact CD2-CD1 4.26Å; F212-L271 HydrophobicContact CE2-CD1 3.32Å; F212-L271 HydrophobicContact CZ-CD1 3.82Å; F212-I407 HydrophobicContact CD1-CD1 3.73Å; F212-I407 HydrophobicContact CE1-CD1 3.67Å; F212-I407 HydrophobicContact CZ-CD1 4.48Å; F212-F417 HydrophobicContact CB-CD2 4.4Å; F212-F417 HydrophobicContact CB-CE1 4.45Å; F212-F417 HydrophobicContact CB-CE2 3.44Å; F212-F417 VanDerWaalsContact CB-CE2 3.44Å; F212-F417 HydrophobicContact CB-CZ 3.46Å; F212-F417 VanDerWaalsContact CB-CZ 3.46Å; F212-F417 HydrophobicContact CD2-CE2 4.35Å; F212-F417 AromaticContact CG-CE2 3.89Å; F212-F417 HydrophobicContact CG-CE2 3.89Å; F212-F417 HydrophobicContact CG-CZ 4.4Å
213	K	83.4	Confident	91.6	Very high	89 Å²	89	33.9 Å²	33.9	39%	0.387	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	111.2	165.7	-171.1	-178.3	-178	-178.6	0	109.3	I130 Y211 E375	I130-K213 HydrophobicContact CB-CB 4.2Å; I130-K213 HydrophobicContact CD1-CD 4.48Å; I130-K213 PolarHBondContact N-O 2.85Å; I130-K213 PolarHBondContact O-N 2.86Å; Y211-K213 HydrophobicContact CE1-CB 4.12Å; Y211-K213 WeakPolarHBondContact OH-CB 3.2Å; K213-E375 IonicContact NZ-OE2 2.78Å
214	G	84.9	Confident	91.6	Very high	20 Å²	20	33.9 Å²	33.9	21%	0.206	20%	0.195	C	C	.	.			trans	-110.8	163.3	171	0	0	0	0	0	111.5	F212	F212-G214 VanDerWaalsContact CZ-CA 3.46Å; F212-G214 VanDerWaalsContact CZ-N 3.35Å
215	S	90.1	Very high	91.6	Very high	35 Å²	35	34.8 Å²	34.8	25%	0.245	20%	0.201	C	C	.	.			trans	-115.3	131.8	170.7	-87.6	0	0	0	0	109.1	Y266 V267 G376	S215-Y266 CarbonylContact O-C 3.47Å; S215-Y266 VanDerWaalsContact O-CA 3.26Å; S215-Y266 WeakPolarHBondContact O-CA 3.35Å; S215-Y266 WeakPolarHBondContact O-CB 3.34Å; S215-Y266 WeakPolarHBondContact O-CD1 3.17Å; S215-V267 WeakPolarHBondContact O-CG2 3.47Å; S215-V267 PolarHBondContact O-N 3.48Å; S215-G376 WeakPolarHBondContact OG-CA 3.27Å; S215-G376 PolarHBondContact OG-N 3.14Å
216	W	93.2	Very high	91.6	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.038	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-60.5	143.7	177.4	-58.9	118.5	0	0	0	110.7	S218 L264 Y266 M273 V372 N373 E375	W216-S218 VanDerWaalsContact C-N 3.25Å; W216-S218 WeakPolarHBondContact CB-O 3.41Å; W216-L264 HydrophobicContact CE3-CB 4.05Å; W216-L264 HydrophobicContact CH2-CB 4.46Å; W216-L264 HydrophobicContact CH2-CD1 4.49Å; W216-L264 HydrophobicContact CZ3-CB 3.71Å; W216-L264 HydrophobicContact CZ3-CD1 4.49Å; W216-Y266 HydrophobicContact CD2-CE1 4.27Å; W216-Y266 AromaticContact CE3-CD1 3.98Å; W216-Y266 HydrophobicContact CE3-CD1 3.98Å; W216-Y266 AromaticContact CE3-CE1 3.74Å; W216-Y266 HydrophobicContact CE3-CE1 3.74Å; W216-Y266 HydrophobicContact CE3-CG 4.5Å; W216-Y266 AromaticContact CH2-CE1 3.92Å; W216-Y266 HydrophobicContact CH2-CE1 3.92Å; W216-Y266 HydrophobicContact CH2-CE2 4.46Å; W216-Y266 AromaticContact CH2-CZ 3.66Å; W216-Y266 WeakPolarHBondContact CH2-OH 2.98Å; W216-Y266 HydrophobicContact CZ2-CE1 4.42Å; W216-Y266 HydrophobicContact CZ3-CD1 4.15Å; W216-Y266 HydrophobicContact CZ3-CD2 4.43Å; W216-Y266 AromaticContact CZ3-CE1 3.55Å; W216-Y266 HydrophobicContact CZ3-CE1 3.55Å; W216-Y266 AromaticContact CZ3-CE2 3.87Å; W216-Y266 HydrophobicContact CZ3-CE2 3.87Å; W216-Y266 AromaticContact CZ3-CZ 3.38Å; W216-M273 HydrophobicContact CH2-CB 3.98Å; W216-M273 HydrophobicContact CH2-CE 3.94Å; W216-M273 HydrophobicContact CH2-CG 4.5Å; W216-M273 HydrophobicContact CH2-SD 3.76Å; W216-M273 HydrophobicContact CZ3-CB 3.89Å; W216-V372 HydrophobicContact CZ2-CG1 4.09Å; W216-N373 PolarHBondContact NE1-O 2.85Å; W216-E375 PolarHBondContact N-O 2.95Å
217	M	92.8	Very high	91.7	Very high	96 Å²	96	47.8 Å²	47.8	47%	0.473	26%	0.26	S	S	.	.	S	Bend	trans	-64.9	-37.1	166.7	-171.8	179.4	117	0	0	110.5	P265 Q269	M217-P265 HydrophobicContact CB-CB 4.21Å; M217-P265 WeakPolarHBondContact CB-O 3.22Å; M217-P265 PolarHBondContact N-O 3.37Å; M217-P265 HydrophobicContact SD-CB 4.31Å; M217-Q269 HydrophobicContact SD-CG 3.47Å; M217-Q269 WeakPolarHBondContact SD-CG 3.44Å
218	S	91.5	Very high	91.9	Very high	36 Å²	36	49.6 Å²	49.6	25%	0.252	27%	0.268	S	S	.	.	S	Bend	trans	-121.7	100.6	174.9	-64.2	0	0	0	0	109.7	W216 Q245	W216-S218 VanDerWaalsContact C-N 3.25Å; W216-S218 WeakPolarHBondContact CB-O 3.41Å; S218-Q245 PolarHBondContact O-NE2 3.01Å
219	R	91.4	Very high	92.1	Very high	96 Å²	96	52.7 Å²	52.7	36%	0.362	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.1	154.6	178.3	-84.5	-177.4	168.6	151.8	21.4	113.6	E374 E375 G376 T377	R219-E374 WeakPolarHBondContact CG-O 3.29Å; R219-E375 VanDerWaalsContact NE-C 3.27Å; R219-G376 VanDerWaalsContact CD-C 3.44Å; R219-G376 WeakPolarHBondContact CD-O 3.48Å; R219-G376 WeakPolarHBondContact CG-O 3.4Å; R219-G376 VanDerWaalsContact CZ-CA 3.48Å; R219-G376 PolarHBondContact NE-O 3.17Å; R219-T377 VanDerWaalsContact NH1-CA 3.35Å
220	F	93.4	Very high	92.5	Very high	5 Å²	5	52.7 Å²	52.7	2%	0.022	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-83.1	140.6	157.7	-62.2	-94.9	0	0	0	109.2	M243 Q245 V317 L319 E374	F220-M243 HydrophobicContact CB-CB 4Å; F220-M243 HydrophobicContact CB-SD 4.32Å; F220-M243 HydrophobicContact CD1-CB 3.46Å; F220-M243 VanDerWaalsContact CD1-CB 3.46Å; F220-M243 HydrophobicContact CD2-CB 4.4Å; F220-M243 HydrophobicContact CD2-CE 3.96Å; F220-M243 HydrophobicContact CD2-SD 4.08Å; F220-M243 HydrophobicContact CE1-CB 3.95Å; F220-M243 HydrophobicContact CE2-CE 3.91Å; F220-M243 HydrophobicContact CG-CB 3.71Å; F220-M243 HydrophobicContact CG-CE 4.38Å; F220-M243 HydrophobicContact CG-CG 4.49Å; F220-M243 HydrophobicContact CG-SD 4.15Å; F220-M243 HydrophobicContact CZ-CE 4.27Å; F220-Q245 HydrophobicContact CD1-CB 3.96Å; F220-Q245 HydrophobicContact CD1-CG 3.82Å; F220-Q245 HydrophobicContact CE1-CB 4.22Å; F220-Q245 HydrophobicContact CE1-CG 3.6Å; F220-Q245 VanDerWaalsContact CE1-NE2 3.33Å; F220-Q245 HydrophobicContact CZ-CG 4.19Å; F220-V317 HydrophobicContact CE1-CG1 4.1Å; F220-V317 HydrophobicContact CZ-CG1 4.13Å; F220-L319 HydrophobicContact CE1-CB 4.36Å; F220-L319 HydrophobicContact CE2-CD2 4.27Å; F220-L319 HydrophobicContact CZ-CB 4.07Å; F220-L319 HydrophobicContact CZ-CD2 4.01Å; F220-E374 HydrophobicContact CB-CB 4.28Å; F220-E374 HydrophobicContact CB-CG 4.1Å
221	D	93.5	Very high	92.8	Very high	90 Å²	90	56.7 Å²	56.7	48%	0.481	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-82	121.1	170.9	-177.4	-11	0	0	0	108.7	A223 N224	D221-A223 PolarHBondContact O-N 3.41Å; D221-A223 VanDerWaalsContact O-N 3.15Å; D221-A223 WeakPolarHBondContact OD1-CB 3.35Å; D221-A223 PolarHBondContact OD1-N 2.89Å; D221-N224 WeakPolarHBondContact O-CA 3.42Å; D221-N224 WeakPolarHBondContact O-CB 3.26Å; D221-N224 PolarHBondContact O-N 3.33Å
222	A	94.1	Very high	93.2	Very high	63 Å²	63	57.4 Å²	57.4	52%	0.521	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-59.6	-24.8	-179.7	0	0	0	0	0	113	N224 T225 E374	A222-N224 PolarHBondContact O-N 3.07Å; A222-T225 PolarHBondContact O-N 3.07Å; A222-E374 HydrophobicContact CB-CG 4.22Å
223	A	95.1	Very high	93.3	Very high	77 Å²	77	60 Å²	60	64%	0.636	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-68.1	-20.7	173.5	0	0	0	0	0	113	D221	D221-A223 PolarHBondContact O-N 3.41Å; D221-A223 VanDerWaalsContact O-N 3.15Å; D221-A223 WeakPolarHBondContact OD1-CB 3.35Å; D221-A223 PolarHBondContact OD1-N 2.89Å
224	N	95.4	Very high	93.3	Very high	66 Å²	66	62.2 Å²	62.2	35%	0.353	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-93.4	-9.3	176.9	-66.2	-37.5	0	0	0	113.1	D221 A222 K226 Y244	D221-N224 WeakPolarHBondContact O-CA 3.42Å; D221-N224 WeakPolarHBondContact O-CB 3.26Å; D221-N224 PolarHBondContact O-N 3.33Å; A222-N224 PolarHBondContact O-N 3.07Å; N224-K226 PolarHBondContact O-N 3.42Å; N224-Y244 HydrophobicContact CB-CD1 4.04Å
225	T	97.4	Very high	93.4	Very high	20 Å²	20	69 Å²	69	12%	0.123	38%	0.377	C	S	.	.			trans	-68.3	125.7	173.4	-59.9	0	0	0	0	109.9	A222 Q241 M242 M243 E374	A222-T225 PolarHBondContact O-N 3.07Å; T225-Q241 HydrophobicContact CG2-CB 3.91Å; T225-M242 WeakPolarHBondContact CA-O 3.32Å; T225-M243 HydrophobicContact CG2-CG 4.43Å; T225-E374 PolarHBondContact OG1-OE1 3.47Å
226	K	97.7	Very high	93.5	Very high	136 Å²	136	71.5 Å²	71.5	59%	0.591	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	154.6	-176.8	-67.5	178.4	-175.4	173.3	0	111.8	N224 M228 M242	N224-K226 PolarHBondContact O-N 3.42Å; K226-M228 PolarHBondContact O-N 3.33Å; K226-M242 PolarHBondContact N-O 3.42Å; K226-M242 WeakPolarHBondContact O-CB 3.46Å; K226-M242 PolarHBondContact O-N 2.88Å
227	E	98.4	Very high	93.6	Very high	138 Å²	138	75 Å²	75	65%	0.645	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	122.9	168.6	-73.5	-173.2	174.3	0	0	110.7	T239 V240	E227-T239 HydrophobicContact CB-CG2 3.67Å; E227-T239 HydrophobicContact CG-CG2 3.85Å; E227-V240 WeakPolarHBondContact CA-O 3.41Å
228	M	98.3	Very high	93.8	Very high	38 Å²	38	74 Å²	74	19%	0.187	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153	175.8	-64.4	-172.5	67.7	0	0	110.8	K226 V240 M242	K226-M228 PolarHBondContact O-N 3.33Å; M228-V240 PolarHBondContact N-O 2.73Å; M228-V240 WeakPolarHBondContact O-CG2 3.3Å; M228-V240 PolarHBondContact O-N 3.05Å; M228-M242 HydrophobicContact CB-CB 3.72Å; M228-M242 HydrophobicContact CB-CG 4.28Å; M228-M242 HydrophobicContact CG-CB 3.73Å; M228-M242 HydrophobicContact CG-CG 4.25Å; M228-M242 HydrophobicContact SD-CB 3.67Å; M228-M242 HydrophobicContact SD-CG 3.56Å; M228-M242 VanDerWaalsContact SD-CG 3.56Å
229	P	97.8	Very high	94.1	Very high	66 Å²	66	76.8 Å²	76.8	43%	0.429	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	137.7	174.5	27.5	-33.8	0	0	0	111.3	T237 K238	P229-T237 HydrophobicContact CB-CG2 3.4Å; P229-K238 CarbonylContact C-O 3.53Å
230	F	97.4	Very high	94.4	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.9	168.9	-174.8	-83.4	0	0	0	109	V232 T237 K238 V240 P320 D400 H401 P402 F403 F421 S422	F230-V232 HydrophobicContact CD1-CG2 3.93Å; F230-V232 HydrophobicContact CE1-CG2 4.31Å; F230-V232 PolarHBondContact O-N 2.62Å; F230-T237 CarbonylContact O-C 3.58Å; F230-T237 VanDerWaalsContact O-CA 3.27Å; F230-T237 WeakPolarHBondContact O-CA 3.42Å; F230-K238 PolarHBondContact N-O 2.79Å; F230-K238 PolarHBondContact O-N 3.23Å; F230-V240 HydrophobicContact CB-CB 4.45Å; F230-V240 HydrophobicContact CB-CG1 3.6Å; F230-V240 HydrophobicContact CB-CG2 3.97Å; F230-V240 HydrophobicContact CG-CG1 4.21Å; F230-P320 HydrophobicContact CE2-CG 4.42Å; F230-D400 CarbonylContact C-O 3.6Å; F230-D400 VanDerWaalsContact CA-O 3.28Å; F230-D400 WeakPolarHBondContact CA-O 3.49Å; F230-D400 VanDerWaalsContact CD2-C 3.43Å; F230-H401 VanDerWaalsContact CE2-N 3.34Å; F230-H401 WeakPolarHBondContact CE2-O 3.46Å; F230-H401 WeakPolarHBondContact CZ-O 3.36Å; F230-P402 HydrophobicContact CE1-CG 4.44Å; F230-F403 HydrophobicContact CE2-CE1 4.23Å; F230-F421 HydrophobicContact CD2-CE1 4.09Å; F230-F421 HydrophobicContact CE1-CD1 4.48Å; F230-F421 HydrophobicContact CE1-CE1 4.24Å; F230-F421 AromaticContact CE2-CD1 3.72Å; F230-F421 HydrophobicContact CE2-CD1 3.72Å; F230-F421 AromaticContact CE2-CE1 3.53Å; F230-F421 HydrophobicContact CE2-CE1 3.53Å; F230-F421 AromaticContact CZ-CD1 3.58Å; F230-F421 HydrophobicContact CZ-CD1 3.58Å; F230-F421 AromaticContact CZ-CE1 3.6Å; F230-F421 HydrophobicContact CZ-CE1 3.6Å; F230-S422 WeakPolarHBondContact CE1-O 3.16Å
231	K	95	Very high	94.6	Very high	89 Å²	89	76.1 Å²	76.1	39%	0.387	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	94.8	-177.1	-61.5	172.6	-176.3	172.9	0	109.6	S233 L280 D400 H401 P402	K231-S233 VanDerWaalsContact C-N 3.33Å; K231-L280 HydrophobicContact CD-CD1 3.66Å; K231-L280 HydrophobicContact CD-CD2 4.43Å; K231-L280 VanDerWaalsContact NZ-CD1 3.32Å; K231-D400 PolarHBondContact N-O 3.24Å; K231-H401 HydrophobicContact CB-CB 4.23Å; K231-P402 WeakPolarHBondContact O-CD 3.29Å
232	V	91.5	Very high	94.9	Very high	30 Å²	30	71.9 Å²	71.9	18%	0.182	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	-38.2	177.6	178.4	0	0	0	0	110.7	F230 E236 K238	F230-V232 HydrophobicContact CD1-CG2 3.93Å; F230-V232 HydrophobicContact CE1-CG2 4.31Å; F230-V232 PolarHBondContact O-N 2.62Å; V232-E236 HydrophobicContact CB-CB 4.24Å; V232-E236 HydrophobicContact CB-CG 4.13Å; V232-E236 PolarHBondContact N-O 3.24Å; V232-K238 HydrophobicContact CG2-CB 4.38Å; V232-K238 HydrophobicContact CG2-CD 4Å; V232-K238 HydrophobicContact CG2-CG 3.98Å
233	S	86.7	Confident	95	Very high	59 Å²	59	68.9 Å²	68.9	41%	0.413	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	179.4	173.7	70.6	0	0	0	0	110.3	K231 N235 E236	K231-S233 VanDerWaalsContact C-N 3.33Å; S233-N235 PolarHBondContact O-N 2.9Å; S233-N235 VanDerWaalsContact O-N 3.11Å; S233-N235 PolarHBondContact OG-N 2.86Å; S233-E236 PolarHBondContact N-O 2.94Å; S233-E236 VanDerWaalsContact N-O 3.16Å; S233-E236 PolarHBondContact O-N 3.31Å; S233-E236 VanDerWaalsContact O-O 3.08Å; S233-E236 WeakPolarHBondContact OG-CB 3.43Å; S233-E236 PolarHBondContact OG-N 2.79Å
234	L	83.3	Confident	95.1	Very high	137 Å²	137	68.9 Å²	68.9	72%	0.717	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.6	175	-71	173.5	0	0	0	113.2
235	N	86.9	Confident	95.1	Very high	162 Å²	162	66.2 Å²	66.2	87%	0.866	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-4.4	-174.4	-61.8	-30.1	0	0	0	113.5	S233	S233-N235 PolarHBondContact O-N 2.9Å; S233-N235 VanDerWaalsContact O-N 3.11Å; S233-N235 PolarHBondContact OG-N 2.86Å
236	E	91.8	Very high	95	Very high	88 Å²	88	68.1 Å²	68.1	41%	0.411	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.1	-175	-171.7	-179.3	178.1	0	0	110.9	V232 S233 K238	V232-E236 HydrophobicContact CB-CB 4.24Å; V232-E236 HydrophobicContact CB-CG 4.13Å; V232-E236 PolarHBondContact N-O 3.24Å; S233-E236 PolarHBondContact N-O 2.94Å; S233-E236 VanDerWaalsContact N-O 3.16Å; S233-E236 PolarHBondContact O-N 3.31Å; S233-E236 VanDerWaalsContact O-O 3.08Å; S233-E236 WeakPolarHBondContact OG-CB 3.43Å; S233-E236 PolarHBondContact OG-N 2.79Å; E236-K238 WeakPolarHBondContact OE1-CE 3.24Å; E236-K238 IonicContact OE1-NZ 3.42Å
237	T	95.3	Very high	94.7	Very high	82 Å²	82	66.1 Å²	66.1	50%	0.503	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.5	174.3	-63.8	0	0	0	0	108.9	P229 F230	P229-T237 HydrophobicContact CB-CG2 3.4Å; F230-T237 CarbonylContact O-C 3.58Å; F230-T237 VanDerWaalsContact O-CA 3.27Å; F230-T237 WeakPolarHBondContact O-CA 3.42Å
238	K	97.2	Very high	94.5	Very high	76 Å²	76	65.3 Å²	65.3	33%	0.33	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.5	175.4	-66.9	-175.1	-175.5	173.3	0	110	P229 F230 V232 E236 S423 P424	P229-K238 CarbonylContact C-O 3.53Å; F230-K238 PolarHBondContact N-O 2.79Å; F230-K238 PolarHBondContact O-N 3.23Å; V232-K238 HydrophobicContact CG2-CB 4.38Å; V232-K238 HydrophobicContact CG2-CD 4Å; V232-K238 HydrophobicContact CG2-CG 3.98Å; E236-K238 WeakPolarHBondContact OE1-CE 3.24Å; E236-K238 IonicContact OE1-NZ 3.42Å; K238-S423 PolarHBondContact NZ-OG 2.57Å; K238-P424 HydrophobicContact CB-CG 3.79Å; K238-P424 HydrophobicContact CD-CG 3.92Å
239	T	97.9	Very high	94.3	Very high	94 Å²	94	63.8 Å²	63.8	58%	0.577	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.3	173.3	-57.2	0	0	0	0	109.8	E227	E227-T239 HydrophobicContact CB-CG2 3.67Å; E227-T239 HydrophobicContact CG-CG2 3.85Å
240	V	98.2	Very high	94.3	Very high	8 Å²	8	61 Å²	61	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	155.2	174.8	-59.8	0	0	0	0	111	E227 M228 F230 M242 P320 P424	E227-V240 WeakPolarHBondContact CA-O 3.41Å; M228-V240 PolarHBondContact N-O 2.73Å; M228-V240 WeakPolarHBondContact O-CG2 3.3Å; M228-V240 PolarHBondContact O-N 3.05Å; F230-V240 HydrophobicContact CB-CB 4.45Å; F230-V240 HydrophobicContact CB-CG1 3.6Å; F230-V240 HydrophobicContact CB-CG2 3.97Å; F230-V240 HydrophobicContact CG-CG1 4.21Å; V240-M242 HydrophobicContact CG2-CB 4.45Å; V240-M242 HydrophobicContact CG2-CE 3.72Å; V240-M242 PolarHBondContact O-N 3.06Å; V240-P320 HydrophobicContact CB-CB 4.4Å; V240-P320 HydrophobicContact CG2-CB 4.19Å; V240-P424 HydrophobicContact CG1-CB 3.42Å; V240-P424 VanDerWaalsContact CG1-CB 3.42Å; V240-P424 HydrophobicContact CG1-CG 3.43Å; V240-P424 VanDerWaalsContact CG1-CG 3.43Å
241	Q	98.3	Very high	94.3	Very high	79 Å²	79	61.6 Å²	61.6	37%	0.369	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	102.5	164.8	-66.1	-61.6	-36.5	0	0	108.1	T225 K321	T225-Q241 HydrophobicContact CG2-CB 3.91Å; Q241-K321 HydrophobicContact CB-CB 4.17Å; Q241-K321 WeakPolarHBondContact O-CB 3.34Å; Q241-K321 PolarHBondContact O-N 2.81Å
242	M	98.4	Very high	94.4	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.2	-177.6	-170.9	66.8	71.7	0	0	109.5	T225 K226 M228 V240 H318 L319 D400	T225-M242 WeakPolarHBondContact CA-O 3.32Å; K226-M242 PolarHBondContact N-O 3.42Å; K226-M242 WeakPolarHBondContact O-CB 3.46Å; K226-M242 PolarHBondContact O-N 2.88Å; M228-M242 HydrophobicContact CB-CB 3.72Å; M228-M242 HydrophobicContact CB-CG 4.28Å; M228-M242 HydrophobicContact CG-CB 3.73Å; M228-M242 HydrophobicContact CG-CG 4.25Å; M228-M242 HydrophobicContact SD-CB 3.67Å; M228-M242 HydrophobicContact SD-CG 3.56Å; M228-M242 VanDerWaalsContact SD-CG 3.56Å; V240-M242 HydrophobicContact CG2-CB 4.45Å; V240-M242 HydrophobicContact CG2-CE 3.72Å; V240-M242 PolarHBondContact O-N 3.06Å; M242-H318 HydrophobicContact CG-CB 3.77Å; M242-H318 VanDerWaalsContact SD-C 3.55Å; M242-H318 HydrophobicContact SD-CB 3.79Å; M242-L319 PolarHBondContact SD-N 3.41Å; M242-L319 VanDerWaalsContact SD-N 3.35Å; M242-D400 HydrophobicContact CE-CB 3.93Å
243	M	97.8	Very high	94.6	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	150.1	173.4	-51.9	-176.8	-64.2	0	0	109.6	F220 T225 H318 L319 K321 V372 E374	F220-M243 HydrophobicContact CB-CB 4Å; F220-M243 HydrophobicContact CB-SD 4.32Å; F220-M243 HydrophobicContact CD1-CB 3.46Å; F220-M243 VanDerWaalsContact CD1-CB 3.46Å; F220-M243 HydrophobicContact CD2-CB 4.4Å; F220-M243 HydrophobicContact CD2-CE 3.96Å; F220-M243 HydrophobicContact CD2-SD 4.08Å; F220-M243 HydrophobicContact CE1-CB 3.95Å; F220-M243 HydrophobicContact CE2-CE 3.91Å; F220-M243 HydrophobicContact CG-CB 3.71Å; F220-M243 HydrophobicContact CG-CE 4.38Å; F220-M243 HydrophobicContact CG-CG 4.49Å; F220-M243 HydrophobicContact CG-SD 4.15Å; F220-M243 HydrophobicContact CZ-CE 4.27Å; T225-M243 HydrophobicContact CG2-CG 4.43Å; M243-H318 WeakPolarHBondContact O-CA 3.29Å; M243-L319 WeakPolarHBondContact CB-O 3.23Å; M243-L319 HydrophobicContact CE-CB 4.19Å; M243-L319 HydrophobicContact CE-CD2 3.87Å; M243-L319 HydrophobicContact CE-CG 3.9Å; M243-L319 PolarHBondContact N-O 3.41Å; M243-L319 PolarHBondContact O-N 2.82Å; M243-L319 VanDerWaalsContact O-N 3.08Å; M243-K321 HydrophobicContact CG-CB 4.05Å; M243-K321 HydrophobicContact SD-CB 4.23Å; M243-V372 HydrophobicContact CE-CG1 4.1Å; M243-E374 HydrophobicContact CG-CG 4.21Å; M243-E374 HydrophobicContact SD-CG 3.85Å
244	Y	96.9	Very high	95.1	Very high	77 Å²	77	59.6 Å²	59.6	30%	0.302	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.3	-177.3	171.7	-89.4	0	0	0	112.1	N224 I316 V317 H318	N224-Y244 HydrophobicContact CB-CD1 4.04Å; Y244-I316 HydrophobicContact CD2-CG2 4.36Å; Y244-I316 HydrophobicContact CE2-CG2 3.52Å; Y244-V317 WeakPolarHBondContact CA-O 3.4Å; Y244-H318 AromaticContact CD2-CD2 3.92Å; Y244-H318 AromaticContact CD2-CE1 3.58Å; Y244-H318 AromaticContact CD2-NE2 3.44Å; Y244-H318 WeakPolarHBondContact CD2-NE2 3.29Å; Y244-H318 AromaticContact CE2-CE1 3.74Å; Y244-H318 AromaticContact CE2-NE2 3.92Å
245	Q	94.5	Very high	95.5	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160	165.1	68.3	177.1	-68	0	0	111.5	S218 F220 V317	S218-Q245 PolarHBondContact O-NE2 3.01Å; F220-Q245 HydrophobicContact CD1-CB 3.96Å; F220-Q245 HydrophobicContact CD1-CG 3.82Å; F220-Q245 HydrophobicContact CE1-CB 4.22Å; F220-Q245 HydrophobicContact CE1-CG 3.6Å; F220-Q245 VanDerWaalsContact CE1-NE2 3.33Å; F220-Q245 HydrophobicContact CZ-CG 4.19Å; Q245-V317 HydrophobicContact CG-CB 4.08Å; Q245-V317 PolarHBondContact N-O 3.16Å; Q245-V317 VanDerWaalsContact N-O 3.11Å; Q245-V317 PolarHBondContact O-N 3.08Å
246	M	94.8	Very high	95.6	Very high	61 Å²	61	56.4 Å²	56.4	30%	0.3	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	113.7	170.1	-179.2	176.1	179.1	0	0	108.3	E314 I315 I316	M246-E314 HydrophobicContact CE-CB 3.86Å; M246-E314 WeakPolarHBondContact CE-OE2 3.39Å; M246-E314 HydrophobicContact CG-CB 4.34Å; M246-I315 WeakPolarHBondContact CA-O 3.39Å; M246-I316 HydrophobicContact CG-CG1 4.12Å; M246-I316 HydrophobicContact SD-CG1 4.18Å
247	K	92.6	Very high	95.4	Very high	94 Å²	94	54 Å²	54	41%	0.409	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	157.5	-175.8	-68.7	-61.8	174.9	-177.4	0	111.1	L249 I315	K247-L249 HydrophobicContact CB-CD1 4.15Å; K247-L249 HydrophobicContact CB-CG 4Å; K247-L249 PolarHBondContact O-N 3.01Å; K247-I315 PolarHBondContact N-O 3.19Å; K247-I315 PolarHBondContact O-N 2.94Å
248	K	93.7	Very high	95.3	Very high	121 Å²	121	50.5 Å²	50.5	53%	0.526	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	109.1	164.9	-62	-174.4	177.9	-170.5	0	108.9	Q312 E314	K248-Q312 WeakPolarHBondContact CD-O 3.5Å; K248-Q312 VanDerWaalsContact CE-O 3.23Å; K248-Q312 WeakPolarHBondContact CE-O 3.28Å; K248-E314 HydrophobicContact CG-CG 3.68Å
249	L	94.8	Very high	95.3	Very high	6 Å²	6	47 Å²	47	3%	0.031	23%	0.234	C	C	.	.			trans	-132.4	146.2	-177.1	-70.2	166	0	0	0	108.7	K247 F251 L262 L264 I315 V317	K247-L249 HydrophobicContact CB-CD1 4.15Å; K247-L249 HydrophobicContact CB-CG 4Å; K247-L249 PolarHBondContact O-N 3.01Å; L249-F251 PolarHBondContact O-N 3.26Å; L249-F251 VanDerWaalsContact O-N 3.14Å; L249-L262 HydrophobicContact CB-CD1 3.88Å; L249-L262 HydrophobicContact CD1-CD1 4.3Å; L249-L264 HydrophobicContact CD1-CD2 3.74Å; L249-L264 HydrophobicContact CD2-CD2 4.31Å; L249-I315 HydrophobicContact CB-CG1 4.45Å; L249-V317 HydrophobicContact CD1-CG2 3.73Å
250	P	97.2	Very high	95.3	Very high	8 Å²	8	44.3 Å²	44.3	5%	0.052	22%	0.215	C	C	.	.			trans	-60.6	120.5	176.1	-16	28.2	0	0	0	110.2	E263 M309 D310 I311	P250-E263 HydrophobicContact CB-CB 3.79Å; P250-E263 HydrophobicContact CG-CB 3.95Å; P250-E263 HydrophobicContact CG-CG 4.38Å; P250-E263 WeakPolarHBondContact CG-OE2 3.48Å; P250-E263 PolarHBondContact O-N 3.35Å; P250-M309 VanDerWaalsContact C-CE 3.48Å; P250-M309 HydrophobicContact CB-CB 4.06Å; P250-M309 HydrophobicContact CB-CE 3.97Å; P250-M309 HydrophobicContact CB-SD 3.86Å; P250-M309 VanDerWaalsContact O-CE 3.28Å; P250-M309 WeakPolarHBondContact O-CE 3.44Å; P250-D310 CarbonylContact C-O 3.56Å; P250-D310 VanDerWaalsContact CA-O 3.29Å; P250-D310 WeakPolarHBondContact CA-O 3.3Å; P250-I311 HydrophobicContact CB-CG2 4.01Å; P250-I311 HydrophobicContact CG-CG2 4.14Å
251	F	97.5	Very high	95.3	Very high	11 Å²	11	43.9 Å²	43.9	5%	0.048	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.1	-177.1	172.4	-96.1	0	0	0	110.8	L249 Q260 I261 M309 D310 I315 F397	L249-F251 PolarHBondContact O-N 3.26Å; L249-F251 VanDerWaalsContact O-N 3.14Å; F251-Q260 HydrophobicContact CE2-CB 4.01Å; F251-Q260 HydrophobicContact CE2-CG 4.21Å; F251-Q260 HydrophobicContact CZ-CB 4.41Å; F251-Q260 HydrophobicContact CZ-CG 4.19Å; F251-I261 CarbonylContact C-O 3.56Å; F251-I261 WeakPolarHBondContact CA-O 3.27Å; F251-I261 WeakPolarHBondContact CD2-O 3.29Å; F251-M309 CarbonylContact O-C 3.44Å; F251-M309 WeakPolarHBondContact O-CA 3.34Å; F251-D310 PolarHBondContact N-O 2.87Å; F251-D310 PolarHBondContact O-N 3.39Å; F251-I315 HydrophobicContact CB-CD1 3.7Å; F251-I315 HydrophobicContact CB-CG1 3.99Å; F251-I315 HydrophobicContact CD1-CD1 4.26Å; F251-I315 HydrophobicContact CD2-CD1 4.48Å; F251-I315 HydrophobicContact CG-CD1 3.91Å; F251-F397 HydrophobicContact CD2-CD2 4.36Å; F251-F397 HydrophobicContact CE2-CD2 4.09Å
252	N	97.1	Very high	95.3	Very high	28 Å²	28	40.1 Å²	40.1	15%	0.15	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.1	173.3	-161.2	2.2	0	0	0	110.3	I261 W303 M309	N252-I261 HydrophobicContact CB-CB 4.32Å; N252-I261 PolarHBondContact N-O 3.03Å; N252-I261 PolarHBondContact O-N 3.18Å; N252-W303 PolarHBondContact ND2-O 2.87Å; N252-W303 VanDerWaalsContact ND2-O 3.14Å; N252-M309 HydrophobicContact CB-CE 4.24Å; N252-M309 HydrophobicContact CB-CG 4.14Å
253	Y	96.6	Very high	95.3	Very high	90 Å²	90	40.2 Å²	40.2	35%	0.353	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126	173.1	179.3	-111.7	0	0	0	108.9	P255 L259 Q260 E279	Y253-P255 HydrophobicContact CD1-CG 3.97Å; Y253-P255 HydrophobicContact CE1-CB 4.07Å; Y253-P255 HydrophobicContact CE1-CG 3.93Å; Y253-P255 WeakPolarHBondContact O-CD 3.11Å; Y253-L259 CarbonylContact C-O 3.54Å; Y253-L259 WeakPolarHBondContact CA-O 3.48Å; Y253-L259 WeakPolarHBondContact CD2-O 3.44Å; Y253-Q260 HydrophobicContact CD2-CG 3.89Å; Y253-Q260 HydrophobicContact CE2-CG 4.35Å; Y253-E279 PolarHBondContact OH-OE1 2.82Å; Y253-E279 VanDerWaalsContact OH-OE1 3.11Å
254	I	96.1	Very high	95.3	Very high	19 Å²	19	40.4 Å²	40.4	10%	0.097	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	99.3	-179.9	-45.3	-58.6	0	0	0	108.4	D256 F257 G258 L259 I261 W303	I254-D256 VanDerWaalsContact C-N 3.34Å; I254-D256 PolarHBondContact O-N 3.02Å; I254-F257 HydrophobicContact CG2-CB 4.42Å; I254-F257 HydrophobicContact CG2-CD2 3.71Å; I254-F257 HydrophobicContact CG2-CG 4.49Å; I254-F257 PolarHBondContact O-N 3.43Å; I254-F257 VanDerWaalsContact O-N 3.16Å; I254-G258 PolarHBondContact O-N 3.46Å; I254-G258 VanDerWaalsContact O-N 3.14Å; I254-L259 HydrophobicContact CB-CB 4.22Å; I254-L259 HydrophobicContact CG1-CD2 4.34Å; I254-L259 PolarHBondContact N-O 3.43Å; I254-L259 PolarHBondContact O-N 3Å; I254-I261 HydrophobicContact CD1-CD1 4.49Å; I254-I261 HydrophobicContact CG1-CD1 4Å; I254-W303 HydrophobicContact CD1-CB 4.26Å; I254-W303 HydrophobicContact CD1-CG 3.89Å; I254-W303 HydrophobicContact CG1-CD2 4.18Å; I254-W303 HydrophobicContact CG1-CG 4.04Å; I254-W303 HydrophobicContact CG2-CZ2 4.35Å
255	P	92.6	Very high	95.2	Very high	91 Å²	91	37.3 Å²	37.3	59%	0.591	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-61.8	-38.3	-171.7	-24.8	35.3	0	0	0	113.7	Y253 F257 G258	Y253-P255 HydrophobicContact CD1-CG 3.97Å; Y253-P255 HydrophobicContact CE1-CB 4.07Å; Y253-P255 HydrophobicContact CE1-CG 3.93Å; Y253-P255 WeakPolarHBondContact O-CD 3.11Å; P255-F257 PolarHBondContact O-N 2.83Å; P255-G258 PolarHBondContact O-N 2.82Å; P255-G258 VanDerWaalsContact O-N 3.13Å
256	D	88.3	Confident	95.2	Very high	140 Å²	140	37.1 Å²	37.1	75%	0.749	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-61.1	-18.9	-178.8	-65.2	-15.6	0	0	0	113.2	I254	I254-D256 VanDerWaalsContact C-N 3.34Å; I254-D256 PolarHBondContact O-N 3.02Å
257	F	87.8	Confident	95	Very high	38 Å²	38	36.2 Å²	36.2	17%	0.167	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-114.8	-6.2	-178.9	-71.3	-90.6	0	0	0	113.7	I254 P255 L259 E294 W303	I254-F257 HydrophobicContact CG2-CB 4.42Å; I254-F257 HydrophobicContact CG2-CD2 3.71Å; I254-F257 HydrophobicContact CG2-CG 4.49Å; I254-F257 PolarHBondContact O-N 3.43Å; I254-F257 VanDerWaalsContact O-N 3.16Å; P255-F257 PolarHBondContact O-N 2.83Å; F257-L259 HydrophobicContact CB-CB 3.7Å; F257-L259 PolarHBondContact O-N 2.85Å; F257-E294 HydrophobicContact CE1-CB 3.81Å; F257-E294 HydrophobicContact CE1-CG 4.28Å; F257-E294 WeakPolarHBondContact CE1-OE2 3.43Å; F257-E294 HydrophobicContact CZ-CB 4.48Å; F257-E294 WeakPolarHBondContact CZ-OE2 3.33Å; F257-W303 HydrophobicContact CD1-CH2 4.32Å; F257-W303 HydrophobicContact CD2-CH2 4.07Å; F257-W303 AromaticContact CD2-CZ2 3.83Å; F257-W303 HydrophobicContact CD2-CZ2 3.83Å; F257-W303 HydrophobicContact CE1-CH2 4.27Å; F257-W303 HydrophobicContact CE2-CH2 4.03Å; F257-W303 AromaticContact CE2-CZ2 3.66Å; F257-W303 HydrophobicContact CE2-CZ2 3.66Å; F257-W303 HydrophobicContact CG-CH2 4.24Å; F257-W303 HydrophobicContact CG-CZ2 4.44Å; F257-W303 HydrophobicContact CZ-CH2 4.14Å; F257-W303 HydrophobicContact CZ-CZ2 4.14Å
258	G	93.4	Very high	94.9	Very high	9 Å²	9	38.8 Å²	38.8	9%	0.093	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	46.3	-166.6	0	0	0	0	0	110.6	I254 P255 P278 E279	I254-G258 PolarHBondContact O-N 3.46Å; I254-G258 VanDerWaalsContact O-N 3.14Å; P255-G258 PolarHBondContact O-N 2.82Å; P255-G258 VanDerWaalsContact O-N 3.13Å; G258-P278 CarbonylContact O-C 3.49Å; G258-E279 WeakPolarHBondContact O-CB 3.42Å; G258-E279 WeakPolarHBondContact O-CG 3.47Å; G258-E279 PolarHBondContact O-N 3.26Å
259	L	96.6	Very high	94.8	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.8	-167.9	173.8	66.4	0	0	0	111	Y253 I254 F257 I261 L276 P278 L291 W303	Y253-L259 CarbonylContact C-O 3.54Å; Y253-L259 WeakPolarHBondContact CA-O 3.48Å; Y253-L259 WeakPolarHBondContact CD2-O 3.44Å; I254-L259 HydrophobicContact CB-CB 4.22Å; I254-L259 HydrophobicContact CG1-CD2 4.34Å; I254-L259 PolarHBondContact N-O 3.43Å; I254-L259 PolarHBondContact O-N 3Å; F257-L259 HydrophobicContact CB-CB 3.7Å; F257-L259 PolarHBondContact O-N 2.85Å; L259-I261 HydrophobicContact CD2-CD1 3.93Å; L259-I261 HydrophobicContact CD2-CG1 4.08Å; L259-I261 HydrophobicContact CG-CD1 4.3Å; L259-I261 HydrophobicContact CG-CG1 3.91Å; L259-L276 HydrophobicContact CD1-CB 4.02Å; L259-P278 HydrophobicContact CD1-CB 4.44Å; L259-L291 HydrophobicContact CD1-CD1 4.49Å; L259-L291 HydrophobicContact CD1-CD2 3.91Å; L259-L291 HydrophobicContact CD2-CD1 3.79Å; L259-W303 HydrophobicContact CD2-CE3 3.85Å; L259-W303 HydrophobicContact CD2-CH2 4.38Å; L259-W303 HydrophobicContact CD2-CZ3 3.71Å
260	Q	98	Very high	94.7	Very high	38 Å²	38	39.3 Å²	39.3	18%	0.178	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	138.1	168.3	-63.9	-174.2	-66.5	0	0	110.3	F251 Y253 L277 H396 F397	F251-Q260 HydrophobicContact CE2-CB 4.01Å; F251-Q260 HydrophobicContact CE2-CG 4.21Å; F251-Q260 HydrophobicContact CZ-CB 4.41Å; F251-Q260 HydrophobicContact CZ-CG 4.19Å; Y253-Q260 HydrophobicContact CD2-CG 3.89Å; Y253-Q260 HydrophobicContact CE2-CG 4.35Å; Q260-L277 HydrophobicContact CB-CB 4.39Å; Q260-L277 PolarHBondContact N-O 2.9Å; Q260-L277 PolarHBondContact O-N 3.21Å; Q260-H396 PolarHBondContact NE2-O 3Å; Q260-F397 HydrophobicContact CB-CD2 3.87Å; Q260-F397 HydrophobicContact CB-CE2 3.79Å
261	I	98.4	Very high	94.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.7	178.6	-54.3	179.6	0	0	0	109.2	F251 N252 I254 L259 I275 L276 W303 T304 M309	F251-I261 CarbonylContact C-O 3.56Å; F251-I261 WeakPolarHBondContact CA-O 3.27Å; F251-I261 WeakPolarHBondContact CD2-O 3.29Å; N252-I261 HydrophobicContact CB-CB 4.32Å; N252-I261 PolarHBondContact N-O 3.03Å; N252-I261 PolarHBondContact O-N 3.18Å; I254-I261 HydrophobicContact CD1-CD1 4.49Å; I254-I261 HydrophobicContact CG1-CD1 4Å; L259-I261 HydrophobicContact CD2-CD1 3.93Å; L259-I261 HydrophobicContact CD2-CG1 4.08Å; L259-I261 HydrophobicContact CG-CD1 4.3Å; L259-I261 HydrophobicContact CG-CG1 3.91Å; I261-I275 VanDerWaalsContact CA-O 3.3Å; I261-I275 WeakPolarHBondContact CA-O 3.47Å; I261-L276 HydrophobicContact CD1-CG 4.39Å; I261-L276 HydrophobicContact CG1-CG 4.19Å; I261-L276 HydrophobicContact CG2-CD1 4.21Å; I261-W303 HydrophobicContact CD1-CB 3.5Å; I261-W303 VanDerWaalsContact CD1-CB 3.5Å; I261-W303 HydrophobicContact CD1-CD2 4.4Å; I261-W303 HydrophobicContact CD1-CE3 4.24Å; I261-W303 HydrophobicContact CD1-CG 4.16Å; I261-T304 HydrophobicContact CG2-CG2 4.08Å; I261-M309 HydrophobicContact CG2-CE 4.22Å
262	L	98.4	Very high	94.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.7	177.7	-177.3	68.3	0	0	0	110.3	L249 L264 F274 I275 I315 V317 F397	L249-L262 HydrophobicContact CB-CD1 3.88Å; L249-L262 HydrophobicContact CD1-CD1 4.3Å; L262-L264 HydrophobicContact CD2-CD1 4.32Å; L262-L264 HydrophobicContact CD2-CD2 3.93Å; L262-L264 HydrophobicContact CD2-CG 4.04Å; L262-L264 HydrophobicContact CG-CD2 4.26Å; L262-L264 HydrophobicContact CG-CG 4.23Å; L262-F274 WeakPolarHBondContact O-CA 3.49Å; L262-I275 PolarHBondContact N-O 3.26Å; L262-I275 PolarHBondContact O-N 3.45Å; L262-I315 HydrophobicContact CD1-CG2 4.38Å; L262-V317 HydrophobicContact CD1-CG2 4.41Å; L262-V317 HydrophobicContact CD2-CB 4.38Å; L262-V317 HydrophobicContact CD2-CG1 3.7Å; L262-V317 HydrophobicContact CD2-CG2 3.72Å; L262-F397 HydrophobicContact CB-CD1 4.15Å; L262-F397 HydrophobicContact CB-CD2 3.77Å; L262-F397 HydrophobicContact CB-CE1 4Å; L262-F397 HydrophobicContact CB-CE2 3.61Å; L262-F397 HydrophobicContact CB-CG 4.03Å; L262-F397 HydrophobicContact CB-CZ 3.74Å; L262-F397 HydrophobicContact CD2-CB 4.38Å; L262-F397 HydrophobicContact CD2-CD1 3.56Å; L262-F397 HydrophobicContact CD2-CD2 4.48Å; L262-F397 HydrophobicContact CD2-CE1 3.89Å; L262-F397 HydrophobicContact CD2-CG 3.88Å; L262-F397 HydrophobicContact CD2-CZ 4.48Å; L262-F397 HydrophobicContact CG-CD1 4.47Å; L262-F397 HydrophobicContact CG-CG 4.46Å
263	E	98.3	Very high	94.4	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.5	166.9	-172	178.9	-179.9	0	0	110.1	P250 P265 S272 F274 R306 M309	P250-E263 HydrophobicContact CB-CB 3.79Å; P250-E263 HydrophobicContact CG-CB 3.95Å; P250-E263 HydrophobicContact CG-CG 4.38Å; P250-E263 WeakPolarHBondContact CG-OE2 3.48Å; P250-E263 PolarHBondContact O-N 3.35Å; E263-P265 HydrophobicContact CG-CG 4.41Å; E263-P265 WeakPolarHBondContact O-CD 3.34Å; E263-S272 VanDerWaalsContact OE1-CB 3.27Å; E263-S272 WeakPolarHBondContact OE1-CB 3.41Å; E263-S272 PolarHBondContact OE1-OG 3.27Å; E263-F274 HydrophobicContact CB-CD1 4.03Å; E263-F274 HydrophobicContact CB-CE1 3.61Å; E263-F274 HydrophobicContact CB-CZ 4.18Å; E263-F274 VanDerWaalsContact CD-CZ 3.43Å; E263-F274 HydrophobicContact CG-CD1 4.17Å; E263-F274 HydrophobicContact CG-CE1 3.48Å; E263-F274 VanDerWaalsContact CG-CE1 3.48Å; E263-F274 HydrophobicContact CG-CE2 4.27Å; E263-F274 HydrophobicContact CG-CZ 3.51Å; E263-R306 IonicContact OE1-CZ 3.13Å; E263-R306 IonicContact OE1-NH2 3.04Å; E263-R306 PolarHBondContact OE1-NH2 2.71Å; E263-R306 IonicContact OE2-CZ 3.72Å; E263-R306 IonicContact OE2-NE 3.12Å; E263-R306 PolarHBondContact OE2-NE 3.26Å; E263-R306 IonicContact OE2-NH2 2.71Å; E263-R306 PolarHBondContact OE2-NH2 3.07Å; E263-R306 VanDerWaalsContact OE2-NH2 3.12Å; E263-M309 HydrophobicContact CB-CE 4.17Å; E263-M309 HydrophobicContact CB-SD 4.49Å
264	L	96.9	Very high	94.5	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	97.8	171.6	-66.2	174.4	0	0	0	108.9	W216 L249 L262 M273 I275 L319	W216-L264 HydrophobicContact CE3-CB 4.05Å; W216-L264 HydrophobicContact CH2-CB 4.46Å; W216-L264 HydrophobicContact CH2-CD1 4.49Å; W216-L264 HydrophobicContact CZ3-CB 3.71Å; W216-L264 HydrophobicContact CZ3-CD1 4.49Å; L249-L264 HydrophobicContact CD1-CD2 3.74Å; L249-L264 HydrophobicContact CD2-CD2 4.31Å; L262-L264 HydrophobicContact CD2-CD1 4.32Å; L262-L264 HydrophobicContact CD2-CD2 3.93Å; L262-L264 HydrophobicContact CD2-CG 4.04Å; L262-L264 HydrophobicContact CG-CD2 4.26Å; L262-L264 HydrophobicContact CG-CG 4.23Å; L264-M273 HydrophobicContact CB-CB 4.4Å; L264-M273 PolarHBondContact N-O 3.45Å; L264-M273 PolarHBondContact O-N 3.49Å; L264-I275 HydrophobicContact CD1-CD1 3.84Å; L264-L319 HydrophobicContact CD1-CD2 3.64Å
265	P	96.1	Very high	94.6	Very high	11 Å²	11	32 Å²	32	7%	0.071	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.8	179.3	-17.7	30.9	0	0	0	112	M217 E263 Q269	M217-P265 HydrophobicContact CB-CB 4.21Å; M217-P265 WeakPolarHBondContact CB-O 3.22Å; M217-P265 PolarHBondContact N-O 3.37Å; M217-P265 HydrophobicContact SD-CB 4.31Å; E263-P265 HydrophobicContact CG-CG 4.41Å; E263-P265 WeakPolarHBondContact O-CD 3.34Å; P265-Q269 HydrophobicContact CB-CG 3.94Å
266	Y	93.4	Very high	94.9	Very high	6 Å²	6	27.7 Å²	27.7	2%	0.024	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-83.7	168	164.1	-66.4	-84.4	0	0	0	110.4	F212 S215 W216 Q269 L271 M273 I407	F212-Y266 AromaticContact CE1-CE1 3.89Å; F212-Y266 HydrophobicContact CE1-CE1 3.89Å; F212-Y266 HydrophobicContact CE1-CE2 4.23Å; F212-Y266 AromaticContact CE1-CZ 3.62Å; F212-Y266 WeakPolarHBondContact CE1-OH 3.42Å; F212-Y266 HydrophobicContact CZ-CD1 4.21Å; F212-Y266 HydrophobicContact CZ-CD2 4.37Å; F212-Y266 AromaticContact CZ-CE1 3.83Å; F212-Y266 HydrophobicContact CZ-CE1 3.83Å; F212-Y266 AromaticContact CZ-CE2 3.99Å; F212-Y266 HydrophobicContact CZ-CE2 3.99Å; F212-Y266 HydrophobicContact CZ-CG 4.47Å; F212-Y266 AromaticContact CZ-CZ 3.71Å; S215-Y266 CarbonylContact O-C 3.47Å; S215-Y266 VanDerWaalsContact O-CA 3.26Å; S215-Y266 WeakPolarHBondContact O-CA 3.35Å; S215-Y266 WeakPolarHBondContact O-CB 3.34Å; S215-Y266 WeakPolarHBondContact O-CD1 3.17Å; W216-Y266 HydrophobicContact CD2-CE1 4.27Å; W216-Y266 AromaticContact CE3-CD1 3.98Å; W216-Y266 HydrophobicContact CE3-CD1 3.98Å; W216-Y266 AromaticContact CE3-CE1 3.74Å; W216-Y266 HydrophobicContact CE3-CE1 3.74Å; W216-Y266 HydrophobicContact CE3-CG 4.5Å; W216-Y266 AromaticContact CH2-CE1 3.92Å; W216-Y266 HydrophobicContact CH2-CE1 3.92Å; W216-Y266 HydrophobicContact CH2-CE2 4.46Å; W216-Y266 AromaticContact CH2-CZ 3.66Å; W216-Y266 WeakPolarHBondContact CH2-OH 2.98Å; W216-Y266 HydrophobicContact CZ2-CE1 4.42Å; W216-Y266 HydrophobicContact CZ3-CD1 4.15Å; W216-Y266 HydrophobicContact CZ3-CD2 4.43Å; W216-Y266 AromaticContact CZ3-CE1 3.55Å; W216-Y266 HydrophobicContact CZ3-CE1 3.55Å; W216-Y266 AromaticContact CZ3-CE2 3.87Å; W216-Y266 HydrophobicContact CZ3-CE2 3.87Å; W216-Y266 AromaticContact CZ3-CZ 3.38Å; Y266-Q269 WeakPolarHBondContact O-CA 3.49Å; Y266-Q269 PolarHBondContact O-N 3.46Å; Y266-L271 HydrophobicContact CD2-CB 3.67Å; Y266-L271 HydrophobicContact CE2-CB 4.45Å; Y266-L271 HydrophobicContact CG-CB 4.3Å; Y266-L271 PolarHBondContact N-O 3.27Å; Y266-M273 HydrophobicContact CE2-CB 4.03Å; Y266-M273 WeakPolarHBondContact OH-CE 3.42Å; Y266-I407 HydrophobicContact CE2-CG2 4.13Å
267	V	91.5	Very high	95.4	Very high	42 Å²	42	21 Å²	21	26%	0.255	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-48.4	139.9	177.3	171.3	0	0	0	0	111.4	S128 S215 Q269	S128-V267 PolarHBondContact OG-O 3.5Å; S215-V267 WeakPolarHBondContact O-CG2 3.47Å; S215-V267 PolarHBondContact O-N 3.48Å; V267-Q269 PolarHBondContact O-N 2.83Å
268	E	90.2	Very high	95.8	Very high	149 Å²	149	19.4 Å²	19.4	70%	0.696	10%	0.097	S	C	*	.	G	3₁₀ helix	trans	60.2	2.6	-171.8	-58.7	-50.9	133.7	0	0	115.9	E270	E268-E270 HydrophobicContact CB-CG 4.18Å; E268-E270 PolarHBondContact O-N 2.9Å; E268-E270 VanDerWaalsContact O-N 3.07Å
269	Q	92.3	Very high	95.7	Very high	78 Å²	78	24 Å²	24	36%	0.364	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	54.9	23.7	-179.1	-52.9	-176.4	58.4	0	0	113.8	M217 P265 Y266 V267 L271 R306 N410	M217-Q269 HydrophobicContact SD-CG 3.47Å; M217-Q269 WeakPolarHBondContact SD-CG 3.44Å; P265-Q269 HydrophobicContact CB-CG 3.94Å; Y266-Q269 WeakPolarHBondContact O-CA 3.49Å; Y266-Q269 PolarHBondContact O-N 3.46Å; V267-Q269 PolarHBondContact O-N 2.83Å; Q269-L271 VanDerWaalsContact C-N 3.28Å; Q269-R306 VanDerWaalsContact OE1-NH1 3.16Å; Q269-N410 PolarHBondContact O-ND2 3.36Å
270	E	91.2	Very high	95.2	Very high	60 Å²	60	27.5 Å²	27.5	28%	0.28	14%	0.135	S	C	.	.	S	Bend	trans	-66	-37.1	172.8	-66.3	-171.4	158.8	0	0	110.7	A127 S128 Y129 E268 H409 N410	A127-E270 WeakPolarHBondContact CA-OE2 3.14Å; S128-E270 PolarHBondContact N-OE2 2.98Å; Y129-E270 HydrophobicContact CD1-CB 4.48Å; Y129-E270 HydrophobicContact CE1-CB 3.99Å; Y129-E270 VanDerWaalsContact CE1-OE2 3.24Å; Y129-E270 WeakPolarHBondContact CE1-OE2 3.36Å; E268-E270 HydrophobicContact CB-CG 4.18Å; E268-E270 PolarHBondContact O-N 2.9Å; E268-E270 VanDerWaalsContact O-N 3.07Å; E270-H409 PolarHBondContact O-CD2 2.86Å; E270-H409 VanDerWaalsContact O-CD2 3.32Å; E270-N410 PolarHBondContact O-N 3.31Å
271	L	93.1	Very high	94.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.1	174.3	-53.8	-177.9	0	0	0	110.9	Y129 F212 Y266 Q269 I407 R408 H409 L416	Y129-L271 HydrophobicContact CD1-CD1 3.6Å; Y129-L271 HydrophobicContact CD1-CG 3.74Å; Y129-L271 HydrophobicContact CD2-CD1 3.68Å; Y129-L271 HydrophobicContact CE1-CD1 3.74Å; Y129-L271 HydrophobicContact CE1-CD2 3.97Å; Y129-L271 HydrophobicContact CE1-CG 3.58Å; Y129-L271 HydrophobicContact CE2-CD1 3.81Å; Y129-L271 HydrophobicContact CE2-CG 4.43Å; Y129-L271 HydrophobicContact CG-CD1 3.56Å; Y129-L271 HydrophobicContact CG-CG 4.23Å; F212-L271 HydrophobicContact CD2-CD1 4.26Å; F212-L271 HydrophobicContact CE2-CD1 3.32Å; F212-L271 HydrophobicContact CZ-CD1 3.82Å; Y266-L271 HydrophobicContact CD2-CB 3.67Å; Y266-L271 HydrophobicContact CE2-CB 4.45Å; Y266-L271 HydrophobicContact CG-CB 4.3Å; Y266-L271 PolarHBondContact N-O 3.27Å; Q269-L271 VanDerWaalsContact C-N 3.28Å; L271-I407 HydrophobicContact CB-CG2 4.38Å; L271-I407 HydrophobicContact CD1-CG2 4.35Å; L271-R408 VanDerWaalsContact CA-O 3.26Å; L271-R408 WeakPolarHBondContact CA-O 3.48Å; L271-H409 VanDerWaalsContact CD2-CA 3.5Å; L271-H409 HydrophobicContact CD2-CB 3.72Å; L271-L416 HydrophobicContact CD1-CD1 4.05Å; L271-L416 HydrophobicContact CD2-CD1 3.47Å; L271-L416 VanDerWaalsContact CD2-CD1 3.47Å; L271-L416 HydrophobicContact CG-CD1 4.42Å
272	S	96.1	Very high	93.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143	166.1	-66.7	0	0	0	0	110.6	E263 I407 R408 N410	E263-S272 VanDerWaalsContact OE1-CB 3.27Å; E263-S272 WeakPolarHBondContact OE1-CB 3.41Å; E263-S272 PolarHBondContact OE1-OG 3.27Å; S272-I407 WeakPolarHBondContact O-CA 3.3Å; S272-R408 PolarHBondContact N-O 2.86Å; S272-R408 PolarHBondContact O-N 3.08Å; S272-N410 PolarHBondContact OG-ND2 3.15Å
273	M	97.6	Very high	92	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.9	162.1	-178.8	177.9	-76.1	0	0	108.9	W216 L264 Y266 I275 V372 F405 F406 I407	W216-M273 HydrophobicContact CH2-CB 3.98Å; W216-M273 HydrophobicContact CH2-CE 3.94Å; W216-M273 HydrophobicContact CH2-CG 4.5Å; W216-M273 HydrophobicContact CH2-SD 3.76Å; W216-M273 HydrophobicContact CZ3-CB 3.89Å; L264-M273 HydrophobicContact CB-CB 4.4Å; L264-M273 PolarHBondContact N-O 3.45Å; L264-M273 PolarHBondContact O-N 3.49Å; Y266-M273 HydrophobicContact CE2-CB 4.03Å; Y266-M273 WeakPolarHBondContact OH-CE 3.42Å; M273-I275 HydrophobicContact CG-CG1 4.26Å; M273-I275 HydrophobicContact SD-CD1 4.49Å; M273-I275 HydrophobicContact SD-CG1 4.3Å; M273-V372 HydrophobicContact CE-CG2 3.87Å; M273-F405 HydrophobicContact CE-CD2 4.06Å; M273-F405 HydrophobicContact CE-CE2 4.39Å; M273-F405 HydrophobicContact SD-CD2 4.38Å; M273-F406 CarbonylContact C-O 3.42Å; M273-F406 WeakPolarHBondContact CA-O 3.44Å; M273-I407 HydrophobicContact CB-CG1 4.34Å; M273-I407 HydrophobicContact CE-CD1 3.99Å; M273-I407 HydrophobicContact CE-CG1 4.01Å; M273-I407 HydrophobicContact CG-CG1 4.44Å
274	F	98.5	Very high	90.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	135	169.9	-68.1	-90.8	0	0	0	108.7	L262 E263 L276 T304 M309 F405 F406 R408	L262-F274 WeakPolarHBondContact O-CA 3.49Å; E263-F274 HydrophobicContact CB-CD1 4.03Å; E263-F274 HydrophobicContact CB-CE1 3.61Å; E263-F274 HydrophobicContact CB-CZ 4.18Å; E263-F274 VanDerWaalsContact CD-CZ 3.43Å; E263-F274 HydrophobicContact CG-CD1 4.17Å; E263-F274 HydrophobicContact CG-CE1 3.48Å; E263-F274 VanDerWaalsContact CG-CE1 3.48Å; E263-F274 HydrophobicContact CG-CE2 4.27Å; E263-F274 HydrophobicContact CG-CZ 3.51Å; F274-L276 HydrophobicContact CB-CD1 4.3Å; F274-T304 HydrophobicContact CD1-CG2 3.67Å; F274-T304 HydrophobicContact CE1-CG2 4.14Å; F274-T304 HydrophobicContact CG-CG2 4.2Å; F274-M309 HydrophobicContact CE1-SD 4.45Å; F274-F405 CarbonylContact O-C 3.59Å; F274-F405 WeakPolarHBondContact O-CA 3.35Å; F274-F405 WeakPolarHBondContact O-CB 3.44Å; F274-F406 HydrophobicContact CB-CD1 3.78Å; F274-F406 HydrophobicContact CB-CD2 4.24Å; F274-F406 HydrophobicContact CB-CE1 3.33Å; F274-F406 HydrophobicContact CB-CE2 3.86Å; F274-F406 HydrophobicContact CB-CG 4.21Å; F274-F406 HydrophobicContact CB-CZ 3.4Å; F274-F406 VanDerWaalsContact CB-CZ 3.4Å; F274-F406 HydrophobicContact CD1-CZ 4.26Å; F274-F406 AromaticContact CD2-CD2 3.97Å; F274-F406 HydrophobicContact CD2-CD2 3.97Å; F274-F406 HydrophobicContact CD2-CE1 4.36Å; F274-F406 AromaticContact CD2-CE2 3.3Å; F274-F406 HydrophobicContact CD2-CE2 3.3Å; F274-F406 AromaticContact CD2-CZ 3.55Å; F274-F406 HydrophobicContact CD2-CZ 3.55Å; F274-F406 HydrophobicContact CE2-CE2 4.1Å; F274-F406 HydrophobicContact CE2-CZ 4.45Å; F274-F406 HydrophobicContact CG-CD2 4.46Å; F274-F406 AromaticContact CG-CE1 3.95Å; F274-F406 HydrophobicContact CG-CE1 3.95Å; F274-F406 AromaticContact CG-CE2 3.73Å; F274-F406 HydrophobicContact CG-CE2 3.73Å; F274-F406 AromaticContact CG-CZ 3.45Å; F274-F406 HydrophobicContact CG-CZ 3.45Å; F274-F406 VanDerWaalsContact CG-CZ 3.45Å; F274-F406 PolarHBondContact N-O 2.82Å; F274-F406 PolarHBondContact O-N 2.95Å; F274-R408 HydrophobicContact CD2-CB 4.31Å; F274-R408 HydrophobicContact CE2-CB 4.09Å
275	I	98.6	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.1	175.3	-52.8	172.5	0	0	0	107.7	I261 L262 L264 M273 L319 F397 F403 F405	I261-I275 VanDerWaalsContact CA-O 3.3Å; I261-I275 WeakPolarHBondContact CA-O 3.47Å; L262-I275 PolarHBondContact N-O 3.26Å; L262-I275 PolarHBondContact O-N 3.45Å; L264-I275 HydrophobicContact CD1-CD1 3.84Å; M273-I275 HydrophobicContact CG-CG1 4.26Å; M273-I275 HydrophobicContact SD-CD1 4.49Å; M273-I275 HydrophobicContact SD-CG1 4.3Å; I275-L319 HydrophobicContact CD1-CD1 3.46Å; I275-L319 VanDerWaalsContact CD1-CD1 3.46Å; I275-L319 HydrophobicContact CD1-CD2 3.93Å; I275-L319 HydrophobicContact CD1-CG 4.29Å; I275-F397 HydrophobicContact CB-CE1 4.11Å; I275-F397 HydrophobicContact CB-CZ 3.72Å; I275-F397 HydrophobicContact CD1-CE1 4.22Å; I275-F397 HydrophobicContact CG2-CE1 3.93Å; I275-F397 HydrophobicContact CG2-CZ 3.58Å; I275-F403 HydrophobicContact CG2-CB 4.2Å; I275-F403 HydrophobicContact CG2-CD2 3.64Å; I275-F403 HydrophobicContact CG2-CE2 4.18Å; I275-F403 HydrophobicContact CG2-CG 3.96Å; I275-F405 HydrophobicContact CG1-CB 4.39Å
276	L	98.5	Very high	89.4	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	103.8	178.3	-83.4	68.3	0	0	0	107.2	L259 I261 F274 P278 L291 L295 L300 F403 L404 F406	L259-L276 HydrophobicContact CD1-CB 4.02Å; I261-L276 HydrophobicContact CD1-CG 4.39Å; I261-L276 HydrophobicContact CG1-CG 4.19Å; I261-L276 HydrophobicContact CG2-CD1 4.21Å; F274-L276 HydrophobicContact CB-CD1 4.3Å; L276-P278 WeakPolarHBondContact O-CD 3.45Å; L276-L291 HydrophobicContact CB-CD2 4.11Å; L276-L291 HydrophobicContact CD2-CD2 4.44Å; L276-L295 HydrophobicContact CD2-CD1 4.41Å; L276-L295 HydrophobicContact CD2-CD2 3.95Å; L276-L300 HydrophobicContact CD2-CD1 4.08Å; L276-F403 WeakPolarHBondContact O-CB 3.05Å; L276-L404 HydrophobicContact CB-CB 4.17Å; L276-L404 PolarHBondContact N-O 3.43Å; L276-L404 PolarHBondContact O-N 3.39Å; L276-F406 HydrophobicContact CD1-CD1 4.09Å; L276-F406 HydrophobicContact CD1-CE1 3.64Å
277	L	98.1	Very high	89.2	Confident	1 Å²	1	50 Å²	50	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	96.7	-173.7	-177.7	69.1	0	0	0	109.3	Q260 F397 R398 A399 H401 F403	Q260-L277 HydrophobicContact CB-CB 4.39Å; Q260-L277 PolarHBondContact N-O 2.9Å; Q260-L277 PolarHBondContact O-N 3.21Å; L277-F397 HydrophobicContact CB-CE2 3.8Å; L277-F397 HydrophobicContact CB-CZ 3.68Å; L277-F397 HydrophobicContact CD2-CD2 4.43Å; L277-F397 HydrophobicContact CD2-CE1 4.28Å; L277-F397 HydrophobicContact CD2-CE2 4.12Å; L277-F397 HydrophobicContact CD2-CZ 4.03Å; L277-F397 HydrophobicContact CG-CZ 4.5Å; L277-R398 VanDerWaalsContact CD2-O 3.32Å; L277-R398 WeakPolarHBondContact CD2-O 3.31Å; L277-A399 HydrophobicContact CD1-CB 4.32Å; L277-A399 HydrophobicContact CD2-CB 4.45Å; L277-H401 WeakPolarHBondContact CD1-NE2 3.3Å; L277-F403 HydrophobicContact CD1-CB 3.82Å; L277-F403 HydrophobicContact CD1-CD1 4.47Å
278	P	95.9	Very high	89.2	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	147	174.1	32.1	-34.6	0	0	0	109.9	G258 L259 L276 P287 L288 L291 H401	G258-P278 CarbonylContact O-C 3.49Å; L259-P278 HydrophobicContact CD1-CB 4.44Å; L276-P278 WeakPolarHBondContact O-CD 3.45Å; P278-P287 HydrophobicContact CB-CB 3.86Å; P278-P287 HydrophobicContact CG-CB 4.39Å; P278-L288 HydrophobicContact CG-CB 4.34Å; P278-L288 HydrophobicContact CG-CD1 3.92Å; P278-L291 HydrophobicContact CG-CD2 4.43Å; P278-H401 PolarHBondContact O-NE2 3.18Å
279	E	92.5	Very high	89.1	Confident	105 Å²	105	45.2 Å²	45.2	49%	0.491	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-57.8	151.6	174.9	-79.8	178.1	178.3	0	0	111.9	Y253 G258 S281 P287	Y253-E279 PolarHBondContact OH-OE1 2.82Å; Y253-E279 VanDerWaalsContact OH-OE1 3.11Å; G258-E279 WeakPolarHBondContact O-CB 3.42Å; G258-E279 WeakPolarHBondContact O-CG 3.47Å; G258-E279 PolarHBondContact O-N 3.26Å; E279-S281 PolarHBondContact O-N 3.3Å; E279-P287 WeakPolarHBondContact O-CB 3.48Å; E279-P287 VanDerWaalsContact O-CG 3.32Å; E279-P287 WeakPolarHBondContact O-CG 3.4Å
280	L	85.8	Confident	89	Confident	75 Å²	75	46.3 Å²	46.3	39%	0.393	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-63.5	133.1	172.9	-75.4	168.9	0	0	0	110.7	K231 H401	K231-L280 HydrophobicContact CD-CD1 3.66Å; K231-L280 HydrophobicContact CD-CD2 4.43Å; K231-L280 VanDerWaalsContact NZ-CD1 3.32Å; L280-H401 HydrophobicContact CD2-CB 3.59Å; L280-H401 HydrophobicContact CG-CB 4.35Å
281	S	79.2	Confident	89.1	Confident	20 Å²	20	43.6 Å²	43.6	14%	0.14	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-62.4	140	172.5	-179.3	0	0	0	0	111.6	E279 D283 G284 S285	E279-S281 PolarHBondContact O-N 3.3Å; S281-D283 PolarHBondContact OG-N 2.92Å; S281-D283 PolarHBondContact OG-OD1 3.47Å; S281-G284 PolarHBondContact OG-N 3.47Å; S281-G284 VanDerWaalsContact OG-N 3.13Å; S281-S285 WeakPolarHBondContact CB-O 3.15Å; S281-S285 PolarHBondContact OG-N 2.92Å; S281-S285 VanDerWaalsContact OG-N 3.1Å; S281-S285 PolarHBondContact OG-O 2.93Å; S281-S285 VanDerWaalsContact OG-O 3.07Å; S281-S285 PolarHBondContact OG-OG 3.41Å
282	T	72.8	Confident	89.1	Confident	146 Å²	146	43.8 Å²	43.8	90%	0.896	25%	0.253	S	S	*	.	S	Bend	trans	-110.8	-7.1	172.5	54.2	0	0	0	0	112.8
283	D	74.9	Confident	88.8	Confident	125 Å²	125	48.2 Å²	48.2	67%	0.668	28%	0.277	S	S	*	.	S	Bend	trans	-123.8	4.9	-170.7	67.3	-5.1	0	0	0	113.9	S281 S285	S281-D283 PolarHBondContact OG-N 2.92Å; S281-D283 PolarHBondContact OG-OD1 3.47Å; D283-S285 WeakPolarHBondContact OD1-CB 3.36Å; D283-S285 PolarHBondContact OD1-N 3.33Å; D283-S285 PolarHBondContact OD1-OG 2.87Å
284	G	71.1	Confident	88.5	Confident	60 Å²	60	51.2 Å²	51.2	62%	0.619	29%	0.291	S	S	*	.	S	Bend	trans	86.7	3.2	-179.6	0	0	0	0	0	114.5	S281	S281-G284 PolarHBondContact OG-N 3.47Å; S281-G284 VanDerWaalsContact OG-N 3.13Å
285	S	80.6	Confident	88.3	Confident	62 Å²	62	51.2 Å²	51.2	43%	0.434	29%	0.291	S	S	.	.			trans	-63.8	162.7	165.2	58.9	0	0	0	0	112.3	S281 D283 P287	S281-S285 WeakPolarHBondContact CB-O 3.15Å; S281-S285 PolarHBondContact OG-N 2.92Å; S281-S285 VanDerWaalsContact OG-N 3.1Å; S281-S285 PolarHBondContact OG-O 2.93Å; S281-S285 VanDerWaalsContact OG-O 3.07Å; S281-S285 PolarHBondContact OG-OG 3.41Å; D283-S285 WeakPolarHBondContact OD1-CB 3.36Å; D283-S285 PolarHBondContact OD1-N 3.33Å; D283-S285 PolarHBondContact OD1-OG 2.87Å; S285-P287 WeakPolarHBondContact O-CD 3.26Å
286	D	86.6	Confident	88.1	Confident	90 Å²	90	53.3 Å²	53.3	48%	0.481	30%	0.303	S	S	.	.			trans	-110.1	94.5	169.8	-174.6	-17.8	0	0	0	109	L288 L289 K290	D286-L288 PolarHBondContact O-N 2.9Å; D286-L288 WeakPolarHBondContact OD1-CB 3.19Å; D286-L288 PolarHBondContact OD1-N 3.06Å; D286-L288 VanDerWaalsContact OD1-N 3.14Å; D286-L289 HydrophobicContact CB-CB 3.81Å; D286-L289 VanDerWaalsContact CG-CB 3.45Å; D286-L289 PolarHBondContact O-N 2.9Å; D286-L289 PolarHBondContact OD1-N 2.94Å; D286-K290 PolarHBondContact O-N 2.93Å
287	P	88.6	Confident	87.8	Confident	32 Å²	32	53.7 Å²	53.7	21%	0.208	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-29.7	-177.3	-25.9	38.5	0	0	0	112.3	P278 E279 S285 L291	P278-P287 HydrophobicContact CB-CB 3.86Å; P278-P287 HydrophobicContact CG-CB 4.39Å; E279-P287 WeakPolarHBondContact O-CB 3.48Å; E279-P287 VanDerWaalsContact O-CG 3.32Å; E279-P287 WeakPolarHBondContact O-CG 3.4Å; S285-P287 WeakPolarHBondContact O-CD 3.26Å; P287-L291 WeakPolarHBondContact O-CB 3.39Å; P287-L291 PolarHBondContact O-N 2.82Å
288	L	90.3	Very high	87.6	Confident	13 Å²	13	59 Å²	59	7%	0.068	33%	0.331	C	S	.	.	H	α-helix	trans	-68.7	-50	175.6	-167.2	73.1	0	0	0	109.8	P278 D286 K290 L291 E292 P402 L404 R420	P278-L288 HydrophobicContact CG-CB 4.34Å; P278-L288 HydrophobicContact CG-CD1 3.92Å; D286-L288 PolarHBondContact O-N 2.9Å; D286-L288 WeakPolarHBondContact OD1-CB 3.19Å; D286-L288 PolarHBondContact OD1-N 3.06Å; D286-L288 VanDerWaalsContact OD1-N 3.14Å; L288-K290 VanDerWaalsContact C-N 3.27Å; L288-K290 PolarHBondContact O-N 3.26Å; L288-L291 CarbonylContact O-C 3.53Å; L288-L291 WeakPolarHBondContact O-CA 3.42Å; L288-L291 WeakPolarHBondContact O-CB 3.35Å; L288-L291 PolarHBondContact O-N 3.47Å; L288-E292 VanDerWaalsContact O-CG 3.28Å; L288-E292 WeakPolarHBondContact O-CG 3.44Å; L288-E292 PolarHBondContact O-N 2.57Å; L288-P402 HydrophobicContact CD2-CB 3.67Å; L288-L404 HydrophobicContact CD1-CD2 3.93Å; L288-L404 HydrophobicContact CD1-CG 3.74Å; L288-L404 HydrophobicContact CG-CD2 4.38Å; L288-R420 VanDerWaalsContact CD2-CD 3.45Å; L288-R420 HydrophobicContact CD2-CG 3.9Å
289	L	89.4	Confident	87.5	Confident	76 Å²	76	62.6 Å²	62.6	40%	0.398	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-38.4	176	-177.6	62.3	0	0	0	112.2	D286 E292 N293	D286-L289 HydrophobicContact CB-CB 3.81Å; D286-L289 VanDerWaalsContact CG-CB 3.45Å; D286-L289 PolarHBondContact O-N 2.9Å; D286-L289 PolarHBondContact OD1-N 2.94Å; L289-E292 PolarHBondContact O-N 3.41Å; L289-N293 PolarHBondContact O-N 2.81Å; L289-N293 VanDerWaalsContact O-N 3.13Å; L289-N293 PolarHBondContact O-ND2 2.78Å
290	K	90.1	Very high	87.6	Confident	101 Å²	101	57.9 Å²	57.9	44%	0.439	32%	0.322	S	S	.	.	H	α-helix	trans	-58.6	-50.4	172.4	-175.6	-175.5	174.6	-169	0	110.4	D286 L288 E292 N293 E294	D286-K290 PolarHBondContact O-N 2.93Å; L288-K290 VanDerWaalsContact C-N 3.27Å; L288-K290 PolarHBondContact O-N 3.26Å; K290-E292 PolarHBondContact O-N 3.19Å; K290-N293 PolarHBondContact O-N 3.1Å; K290-E294 WeakPolarHBondContact CE-OE1 3.34Å; K290-E294 VanDerWaalsContact O-CB 3.3Å; K290-E294 WeakPolarHBondContact O-CB 3.34Å; K290-E294 WeakPolarHBondContact O-CG 3.26Å; K290-E294 PolarHBondContact O-N 3.38Å
291	L	93.4	Very high	87.9	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-57.1	-46.2	177.3	178.3	63.8	0	0	0	111.9	L259 L276 P278 P287 L288 N293 E294 L295 W303 L404	L259-L291 HydrophobicContact CD1-CD1 4.49Å; L259-L291 HydrophobicContact CD1-CD2 3.91Å; L259-L291 HydrophobicContact CD2-CD1 3.79Å; L276-L291 HydrophobicContact CB-CD2 4.11Å; L276-L291 HydrophobicContact CD2-CD2 4.44Å; P278-L291 HydrophobicContact CG-CD2 4.43Å; P287-L291 WeakPolarHBondContact O-CB 3.39Å; P287-L291 PolarHBondContact O-N 2.82Å; L288-L291 CarbonylContact O-C 3.53Å; L288-L291 WeakPolarHBondContact O-CA 3.42Å; L288-L291 WeakPolarHBondContact O-CB 3.35Å; L288-L291 PolarHBondContact O-N 3.47Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 3.38Å; L291-E294 PolarHBondContact O-N 3.3Å; L291-L295 HydrophobicContact CD1-CD1 4.37Å; L291-L295 HydrophobicContact CD1-CD2 4.2Å; L291-L295 HydrophobicContact CD1-CG 3.93Å; L291-L295 HydrophobicContact CG-CD1 4.13Å; L291-L295 HydrophobicContact CG-CG 4.18Å; L291-L295 WeakPolarHBondContact O-CB 3.48Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 3.26Å; L291-W303 HydrophobicContact CD1-CH2 4.42Å; L291-W303 HydrophobicContact CD1-CZ3 3.95Å; L291-L404 HydrophobicContact CD2-CD1 3.81Å; L291-L404 HydrophobicContact CD2-CG 4.22Å; L291-L404 HydrophobicContact CG-CD1 4.01Å
292	E	93	Very high	88.7	Confident	5 Å²	5	61 Å²	61	2%	0.023	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-38.6	179.5	-66.2	-178.3	-178.7	0	0	113.3	F61 S65 L288 L289 K290 L404 R420	F61-E292 HydrophobicContact CE1-CB 4.25Å; F61-E292 HydrophobicContact CE1-CG 3.71Å; F61-E292 HydrophobicContact CZ-CG 4.27Å; S65-E292 VanDerWaalsContact CB-OE2 3.29Å; S65-E292 WeakPolarHBondContact CB-OE2 3.44Å; S65-E292 PolarHBondContact OG-OE2 2.95Å; L288-E292 VanDerWaalsContact O-CG 3.28Å; L288-E292 WeakPolarHBondContact O-CG 3.44Å; L288-E292 PolarHBondContact O-N 2.57Å; L289-E292 PolarHBondContact O-N 3.41Å; K290-E292 PolarHBondContact O-N 3.19Å; E292-L404 HydrophobicContact CG-CD1 4Å; E292-L404 HydrophobicContact CG-CD2 4.17Å; E292-R420 VanDerWaalsContact OE1-CD 3.23Å; E292-R420 WeakPolarHBondContact OE1-CD 2.97Å; E292-R420 IonicContact OE1-CZ 3.8Å; E292-R420 IonicContact OE1-NE 4Å; E292-R420 IonicContact OE1-NH1 2.8Å; E292-R420 PolarHBondContact OE1-NH1 3.16Å; E292-R420 IonicContact OE2-NH1 2.77Å; E292-R420 PolarHBondContact OE2-NH1 3.03Å
293	N	90.4	Very high	89.8	Confident	93 Å²	93	54.7 Å²	54.7	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-74.3	-31.6	178.1	-71.8	-41.3	0	0	0	112.4	L289 K290 L291	L289-N293 PolarHBondContact O-N 2.81Å; L289-N293 VanDerWaalsContact O-N 3.13Å; L289-N293 PolarHBondContact O-ND2 2.78Å; K290-N293 PolarHBondContact O-N 3.1Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 3.38Å
294	E	91.1	Very high	90.8	Very high	63 Å²	63	48.8 Å²	48.8	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-96	-12.7	-172.8	-77.2	-152.3	-130.9	0	0	114.7	F257 K290 L291 T296 R299	F257-E294 HydrophobicContact CE1-CB 3.81Å; F257-E294 HydrophobicContact CE1-CG 4.28Å; F257-E294 WeakPolarHBondContact CE1-OE2 3.43Å; F257-E294 HydrophobicContact CZ-CB 4.48Å; F257-E294 WeakPolarHBondContact CZ-OE2 3.33Å; K290-E294 WeakPolarHBondContact CE-OE1 3.34Å; K290-E294 VanDerWaalsContact O-CB 3.3Å; K290-E294 WeakPolarHBondContact O-CB 3.34Å; K290-E294 WeakPolarHBondContact O-CG 3.26Å; K290-E294 PolarHBondContact O-N 3.38Å; L291-E294 PolarHBondContact O-N 3.3Å; E294-T296 PolarHBondContact O-N 3.1Å; E294-R299 WeakPolarHBondContact O-CD 3.17Å; E294-R299 PolarHBondContact O-NH1 2.89Å; E294-R299 IonicContact OE2-CZ 3.81Å; E294-R299 IonicContact OE2-NH1 2.96Å; E294-R299 PolarHBondContact OE2-NH1 2.78Å; E294-R299 IonicContact OE2-NH2 3.74Å
295	L	93.8	Very high	91.9	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.248	C	C	.	.			trans	-61.9	129.3	175	-87.4	170.7	0	0	0	111	L58 R62 L276 L291 L300 W303 L404 F418	L58-L295 HydrophobicContact CD1-CB 4.48Å; L58-L295 HydrophobicContact CD2-CB 4.2Å; L58-L295 HydrophobicContact CD2-CD1 4.48Å; R62-L295 PolarHBondContact NH2-O 3.4Å; L276-L295 HydrophobicContact CD2-CD1 4.41Å; L276-L295 HydrophobicContact CD2-CD2 3.95Å; L291-L295 HydrophobicContact CD1-CD1 4.37Å; L291-L295 HydrophobicContact CD1-CD2 4.2Å; L291-L295 HydrophobicContact CD1-CG 3.93Å; L291-L295 HydrophobicContact CG-CD1 4.13Å; L291-L295 HydrophobicContact CG-CG 4.18Å; L291-L295 WeakPolarHBondContact O-CB 3.48Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 3.26Å; L295-L300 HydrophobicContact CD2-CD1 4.06Å; L295-W303 HydrophobicContact CD2-CE3 4.23Å; L295-W303 HydrophobicContact CD2-CZ3 3.69Å; L295-L404 HydrophobicContact CD1-CD1 3.49Å; L295-L404 VanDerWaalsContact CD1-CD1 3.49Å; L295-F418 HydrophobicContact CD1-CZ 4.24Å
296	T	94.2	Very high	92.5	Very high	43 Å²	43	50.3 Å²	50.3	26%	0.264	24%	0.244	S	C	.	.			trans	-126.8	160.8	168.4	79.2	0	0	0	0	109.2	L58 E294 E298 R299 L300	L58-T296 VanDerWaalsContact CD1-C 3.46Å; E294-T296 PolarHBondContact O-N 3.1Å; T296-E298 VanDerWaalsContact CB-OE2 3.24Å; T296-E298 WeakPolarHBondContact CB-OE2 3.29Å; T296-E298 PolarHBondContact O-N 2.84Å; T296-E298 PolarHBondContact OG1-N 3.4Å; T296-E298 PolarHBondContact OG1-OE2 3.48Å; T296-R299 PolarHBondContact O-N 3.07Å; T296-R299 PolarHBondContact OG1-N 2.78Å; T296-L300 WeakPolarHBondContact O-CB 3.5Å; T296-L300 PolarHBondContact O-N 3.41Å
297	P	92.4	Very high	92.9	Very high	10 Å²	10	50.1 Å²	50.1	7%	0.065	26%	0.255	C	S	.	.	H	α-helix	trans	-56.6	-38.5	175.6	-22.1	31.6	0	0	0	112.7	A54 D55 L58 L300 D301	A54-P297 HydrophobicContact CB-CB 3.86Å; A54-P297 HydrophobicContact CB-CG 4.28Å; D55-P297 HydrophobicContact CB-CG 4.46Å; D55-P297 WeakPolarHBondContact OD1-CG 3.36Å; L58-P297 HydrophobicContact CD1-CG 4.18Å; P297-L300 PolarHBondContact O-N 2.81Å; P297-D301 WeakPolarHBondContact O-CB 3.47Å; P297-D301 PolarHBondContact O-N 3.47Å
298	E	93.3	Very high	93.2	Very high	111 Å²	111	52.5 Å²	52.5	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-47.7	179.9	-57.6	71.8	-155	0	0	110.7	T296 L300 D301 E302	T296-E298 VanDerWaalsContact CB-OE2 3.24Å; T296-E298 WeakPolarHBondContact CB-OE2 3.29Å; T296-E298 PolarHBondContact O-N 2.84Å; T296-E298 PolarHBondContact OG1-N 3.4Å; T296-E298 PolarHBondContact OG1-OE2 3.48Å; E298-L300 VanDerWaalsContact C-N 3.33Å; E298-L300 PolarHBondContact O-N 3.42Å; E298-D301 PolarHBondContact O-N 2.95Å; E298-E302 VanDerWaalsContact O-CB 3.24Å; E298-E302 WeakPolarHBondContact O-CB 3.47Å; E298-E302 PolarHBondContact O-N 3.23Å
299	R	94.5	Very high	93.5	Very high	80 Å²	80	52.5 Å²	52.5	30%	0.302	27%	0.266	S	S	.	.	H	α-helix	trans	-60.3	-44.8	175	-75.7	176.8	171.8	-174.8	-8.8	110.8	E294 T296 D301 E302 W303	E294-R299 WeakPolarHBondContact O-CD 3.17Å; E294-R299 PolarHBondContact O-NH1 2.89Å; E294-R299 IonicContact OE2-CZ 3.81Å; E294-R299 IonicContact OE2-NH1 2.96Å; E294-R299 PolarHBondContact OE2-NH1 2.78Å; E294-R299 IonicContact OE2-NH2 3.74Å; T296-R299 PolarHBondContact O-N 3.07Å; T296-R299 PolarHBondContact OG1-N 2.78Å; R299-D301 PolarHBondContact O-N 3.44Å; R299-E302 PolarHBondContact O-N 2.92Å; R299-W303 HydrophobicContact CB-CD2 4.13Å; R299-W303 HydrophobicContact CB-CE3 4.3Å; R299-W303 HydrophobicContact CB-CH2 4.03Å; R299-W303 HydrophobicContact CB-CZ2 3.81Å; R299-W303 HydrophobicContact CB-CZ3 4.25Å; R299-W303 HydrophobicContact CG-CH2 4.33Å; R299-W303 HydrophobicContact CG-CZ2 3.85Å; R299-W303 WeakPolarHBondContact O-CB 3.46Å; R299-W303 VanDerWaalsContact O-CD2 3.29Å; R299-W303 PolarHBondContact O-N 2.72Å
300	L	94.4	Very high	93.7	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-44.7	179.6	-164.5	67.3	0	0	0	111.5	L276 L295 T296 P297 E298 T304 F406 I415 F418	L276-L300 HydrophobicContact CD2-CD1 4.08Å; L295-L300 HydrophobicContact CD2-CD1 4.06Å; T296-L300 WeakPolarHBondContact O-CB 3.5Å; T296-L300 PolarHBondContact O-N 3.41Å; P297-L300 PolarHBondContact O-N 2.81Å; E298-L300 VanDerWaalsContact C-N 3.33Å; E298-L300 PolarHBondContact O-N 3.42Å; L300-T304 WeakPolarHBondContact O-CB 2.97Å; L300-T304 WeakPolarHBondContact O-CG2 3.49Å; L300-T304 PolarHBondContact O-N 3.23Å; L300-T304 PolarHBondContact O-OG1 3.28Å; L300-F406 HydrophobicContact CD1-CD1 4.22Å; L300-F406 HydrophobicContact CD1-CE1 3.44Å; L300-F406 VanDerWaalsContact CD1-CE1 3.44Å; L300-F406 HydrophobicContact CD1-CZ 3.86Å; L300-F406 HydrophobicContact CD2-CE1 4.27Å; L300-F406 HydrophobicContact CD2-CZ 4.24Å; L300-F406 HydrophobicContact CG-CE1 4.08Å; L300-F406 HydrophobicContact CG-CZ 4.03Å; L300-I415 HydrophobicContact CD2-CD1 3.58Å; L300-F418 HydrophobicContact CD2-CE2 4.44Å
301	D	92.9	Very high	93.9	Very high	49 Å²	49	50.8 Å²	50.8	26%	0.262	26%	0.261	S	S	.	.	H	α-helix	trans	-65.6	-45.3	177.1	-167.1	59.6	0	0	0	111.5	P297 E298 R299 T304 N305 K413	P297-D301 WeakPolarHBondContact O-CB 3.47Å; P297-D301 PolarHBondContact O-N 3.47Å; E298-D301 PolarHBondContact O-N 2.95Å; R299-D301 PolarHBondContact O-N 3.44Å; D301-T304 CarbonylContact O-C 3.58Å; D301-N305 VanDerWaalsContact O-CB 3.31Å; D301-N305 WeakPolarHBondContact O-CB 3.17Å; D301-N305 PolarHBondContact O-N 2.67Å; D301-K413 VanDerWaalsContact CG-NZ 3.35Å; D301-K413 WeakPolarHBondContact OD1-CD 3.24Å; D301-K413 WeakPolarHBondContact OD1-CE 3.23Å; D301-K413 IonicContact OD1-NZ 2.68Å; D301-K413 PolarHBondContact OD1-NZ 3.41Å; D301-K413 IonicContact OD2-NZ 3.56Å; D301-K413 PolarHBondContact OD2-NZ 2.86Å; D301-K413 VanDerWaalsContact OD2-NZ 3.14Å
302	E	94.6	Very high	93.8	Very high	112 Å²	112	56.8 Å²	56.8	52%	0.523	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-52	178.5	-178.7	-175.2	177.5	0	0	111.8	E298 R299 T304 N305 N308	E298-E302 VanDerWaalsContact O-CB 3.24Å; E298-E302 WeakPolarHBondContact O-CB 3.47Å; E298-E302 PolarHBondContact O-N 3.23Å; R299-E302 PolarHBondContact O-N 2.92Å; E302-T304 VanDerWaalsContact C-N 3.27Å; E302-T304 PolarHBondContact O-N 3.08Å; E302-N305 PolarHBondContact O-N 3.45Å; E302-N308 PolarHBondContact O-ND2 2.95Å
303	W	95.8	Very high	93.6	Very high	14 Å²	14	57.9 Å²	57.9	5%	0.053	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-27.1	-174.7	-63.6	-13.6	0	0	0	113.1	N252 I254 F257 L259 I261 L291 L295 R299	N252-W303 PolarHBondContact ND2-O 2.87Å; N252-W303 VanDerWaalsContact ND2-O 3.14Å; I254-W303 HydrophobicContact CD1-CB 4.26Å; I254-W303 HydrophobicContact CD1-CG 3.89Å; I254-W303 HydrophobicContact CG1-CD2 4.18Å; I254-W303 HydrophobicContact CG1-CG 4.04Å; I254-W303 HydrophobicContact CG2-CZ2 4.35Å; F257-W303 HydrophobicContact CD1-CH2 4.32Å; F257-W303 HydrophobicContact CD2-CH2 4.07Å; F257-W303 AromaticContact CD2-CZ2 3.83Å; F257-W303 HydrophobicContact CD2-CZ2 3.83Å; F257-W303 HydrophobicContact CE1-CH2 4.27Å; F257-W303 HydrophobicContact CE2-CH2 4.03Å; F257-W303 AromaticContact CE2-CZ2 3.66Å; F257-W303 HydrophobicContact CE2-CZ2 3.66Å; F257-W303 HydrophobicContact CG-CH2 4.24Å; F257-W303 HydrophobicContact CG-CZ2 4.44Å; F257-W303 HydrophobicContact CZ-CH2 4.14Å; F257-W303 HydrophobicContact CZ-CZ2 4.14Å; L259-W303 HydrophobicContact CD2-CE3 3.85Å; L259-W303 HydrophobicContact CD2-CH2 4.38Å; L259-W303 HydrophobicContact CD2-CZ3 3.71Å; I261-W303 HydrophobicContact CD1-CB 3.5Å; I261-W303 VanDerWaalsContact CD1-CB 3.5Å; I261-W303 HydrophobicContact CD1-CD2 4.4Å; I261-W303 HydrophobicContact CD1-CE3 4.24Å; I261-W303 HydrophobicContact CD1-CG 4.16Å; L291-W303 HydrophobicContact CD1-CH2 4.42Å; L291-W303 HydrophobicContact CD1-CZ3 3.95Å; L295-W303 HydrophobicContact CD2-CE3 4.23Å; L295-W303 HydrophobicContact CD2-CZ3 3.69Å; R299-W303 HydrophobicContact CB-CD2 4.13Å; R299-W303 HydrophobicContact CB-CE3 4.3Å; R299-W303 HydrophobicContact CB-CH2 4.03Å; R299-W303 HydrophobicContact CB-CZ2 3.81Å; R299-W303 HydrophobicContact CB-CZ3 4.25Å; R299-W303 HydrophobicContact CG-CH2 4.33Å; R299-W303 HydrophobicContact CG-CZ2 3.85Å; R299-W303 WeakPolarHBondContact O-CB 3.46Å; R299-W303 VanDerWaalsContact O-CD2 3.29Å; R299-W303 PolarHBondContact O-N 2.72Å
304	T	95.8	Very high	93.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	13.9	-179.7	69.1	0	0	0	0	113.5	I261 F274 L300 D301 E302 R306 F406 R408	I261-T304 HydrophobicContact CG2-CG2 4.08Å; F274-T304 HydrophobicContact CD1-CG2 3.67Å; F274-T304 HydrophobicContact CE1-CG2 4.14Å; F274-T304 HydrophobicContact CG-CG2 4.2Å; L300-T304 WeakPolarHBondContact O-CB 2.97Å; L300-T304 WeakPolarHBondContact O-CG2 3.49Å; L300-T304 PolarHBondContact O-N 3.23Å; L300-T304 PolarHBondContact O-OG1 3.28Å; D301-T304 CarbonylContact O-C 3.58Å; E302-T304 VanDerWaalsContact C-N 3.27Å; E302-T304 PolarHBondContact O-N 3.08Å; T304-R306 PolarHBondContact O-N 3.19Å; T304-F406 HydrophobicContact CG2-CE1 4.19Å; T304-F406 HydrophobicContact CG2-CZ 3.79Å; T304-R408 PolarHBondContact O-NH2 3.22Å; T304-R408 PolarHBondContact OG1-NH1 3.47Å
305	N	94.9	Very high	93.9	Very high	59 Å²	59	54.3 Å²	54.3	32%	0.316	28%	0.276	S	S	.	.			trans	-75	120.2	169.7	-173.4	-29	0	0	0	108.5	D301 E302 A307 N308 M309	D301-N305 VanDerWaalsContact O-CB 3.31Å; D301-N305 WeakPolarHBondContact O-CB 3.17Å; D301-N305 PolarHBondContact O-N 2.67Å; E302-N305 PolarHBondContact O-N 3.45Å; N305-A307 PolarHBondContact O-N 3.43Å; N305-A307 WeakPolarHBondContact OD1-CB 3.42Å; N305-A307 PolarHBondContact OD1-N 3.31Å; N305-N308 WeakPolarHBondContact O-CA 3.27Å; N305-N308 WeakPolarHBondContact O-CB 2.99Å; N305-N308 PolarHBondContact O-N 2.75Å; N305-M309 WeakPolarHBondContact O-CG 3.48Å
306	R	92.9	Very high	94	Very high	95 Å²	95	54.7 Å²	54.7	36%	0.358	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-56.3	-25.8	-178.5	-170.3	171.1	-71.3	-136.9	12.4	113.9	E263 Q269 T304 N308 M309 I311	E263-R306 IonicContact OE1-CZ 3.13Å; E263-R306 IonicContact OE1-NH2 3.04Å; E263-R306 PolarHBondContact OE1-NH2 2.71Å; E263-R306 IonicContact OE2-CZ 3.72Å; E263-R306 IonicContact OE2-NE 3.12Å; E263-R306 PolarHBondContact OE2-NE 3.26Å; E263-R306 IonicContact OE2-NH2 2.71Å; E263-R306 PolarHBondContact OE2-NH2 3.07Å; E263-R306 VanDerWaalsContact OE2-NH2 3.12Å; Q269-R306 VanDerWaalsContact OE1-NH1 3.16Å; T304-R306 PolarHBondContact O-N 3.19Å; R306-N308 PolarHBondContact O-N 2.85Å; R306-M309 PolarHBondContact O-N 3.22Å; R306-I311 HydrophobicContact CG-CG2 4.48Å
307	A	94.6	Very high	94.2	Very high	86 Å²	86	52.7 Å²	52.7	71%	0.711	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66.6	-22	174.5	0	0	0	0	0	113.4	N305	N305-A307 PolarHBondContact O-N 3.43Å; N305-A307 WeakPolarHBondContact OD1-CB 3.42Å; N305-A307 PolarHBondContact OD1-N 3.31Å
308	N	95.1	Very high	94.5	Very high	82 Å²	82	53.6 Å²	53.6	44%	0.439	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-99.6	1.3	179.4	-61.7	-21.7	0	0	0	112.7	E302 N305 R306	E302-N308 PolarHBondContact O-ND2 2.95Å; N305-N308 WeakPolarHBondContact O-CA 3.27Å; N305-N308 WeakPolarHBondContact O-CB 2.99Å; N305-N308 PolarHBondContact O-N 2.75Å; R306-N308 PolarHBondContact O-N 2.85Å
309	M	96.3	Very high	94.7	Very high	13 Å²	13	48.3 Å²	48.3	6%	0.064	25%	0.245	C	C	.	.	S	Bend	trans	-105.7	142.2	-176.9	-55.7	-174	79.5	0	0	111	P250 F251 N252 I261 E263 F274 N305 R306	P250-M309 VanDerWaalsContact C-CE 3.48Å; P250-M309 HydrophobicContact CB-CB 4.06Å; P250-M309 HydrophobicContact CB-CE 3.97Å; P250-M309 HydrophobicContact CB-SD 3.86Å; P250-M309 VanDerWaalsContact O-CE 3.28Å; P250-M309 WeakPolarHBondContact O-CE 3.44Å; F251-M309 CarbonylContact O-C 3.44Å; F251-M309 WeakPolarHBondContact O-CA 3.34Å; N252-M309 HydrophobicContact CB-CE 4.24Å; N252-M309 HydrophobicContact CB-CG 4.14Å; I261-M309 HydrophobicContact CG2-CE 4.22Å; E263-M309 HydrophobicContact CB-CE 4.17Å; E263-M309 HydrophobicContact CB-SD 4.49Å; F274-M309 HydrophobicContact CE1-SD 4.45Å; N305-M309 WeakPolarHBondContact O-CG 3.48Å; R306-M309 PolarHBondContact O-N 3.22Å
310	D	95.3	Very high	94.9	Very high	63 Å²	63	44.5 Å²	44.5	34%	0.337	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-70.8	126.8	167.6	-175	-0.6	0	0	0	109.6	P250 F251 Q312 T313	P250-D310 CarbonylContact C-O 3.56Å; P250-D310 VanDerWaalsContact CA-O 3.29Å; P250-D310 WeakPolarHBondContact CA-O 3.3Å; F251-D310 PolarHBondContact N-O 2.87Å; F251-D310 PolarHBondContact O-N 3.39Å; D310-Q312 PolarHBondContact OD1-N 2.97Å; D310-T313 PolarHBondContact OD1-N 3.08Å; D310-T313 WeakPolarHBondContact OD2-CB 3.47Å; D310-T313 PolarHBondContact OD2-OG1 3.35Å
311	I	94.2	Very high	94.9	Very high	79 Å²	79	48.1 Å²	48.1	41%	0.405	25%	0.246	S	C	.	.			trans	-118.9	1.2	178.3	60.9	167	0	0	0	112.7	P250 R306	P250-I311 HydrophobicContact CB-CG2 4.01Å; P250-I311 HydrophobicContact CG-CG2 4.14Å; R306-I311 HydrophobicContact CG-CG2 4.48Å
312	Q	90.1	Very high	95	Very high	128 Å²	128	46.3 Å²	46.3	60%	0.598	24%	0.236	S	C	*	.	S	Bend	trans	-101.7	-34.4	-172.8	-62	-58.6	-37.2	0	0	112.3	K248 D310	K248-Q312 WeakPolarHBondContact CD-O 3.5Å; K248-Q312 VanDerWaalsContact CE-O 3.23Å; K248-Q312 WeakPolarHBondContact CE-O 3.28Å; D310-Q312 PolarHBondContact OD1-N 2.97Å
313	T	88.8	Confident	94.8	Very high	28 Å²	28	47 Å²	47	17%	0.172	24%	0.237	C	C	.	.	S	Bend	trans	-71.3	139.4	178.5	-59.5	0	0	0	0	111.8	D310 I315 R393 E395	D310-T313 PolarHBondContact OD1-N 3.08Å; D310-T313 WeakPolarHBondContact OD2-CB 3.47Å; D310-T313 PolarHBondContact OD2-OG1 3.35Å; T313-I315 HydrophobicContact CG2-CD1 4.07Å; T313-R393 WeakPolarHBondContact CG2-O 3.46Å; T313-E395 HydrophobicContact CG2-CB 4.19Å; T313-E395 HydrophobicContact CG2-CG 3.82Å
314	E	92.4	Very high	94.6	Very high	81 Å²	81	46.6 Å²	46.6	38%	0.379	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	124.9	168.5	-72.1	-175.9	142.1	0	0	110	M246 K248	M246-E314 HydrophobicContact CE-CB 3.86Å; M246-E314 WeakPolarHBondContact CE-OE2 3.39Å; M246-E314 HydrophobicContact CG-CB 4.34Å; K248-E314 HydrophobicContact CG-CG 3.68Å
315	I	94.9	Very high	94.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129.3	-179.1	-45.5	-58.9	0	0	0	108.7	M246 K247 L249 F251 L262 T313 V317 E395 F397	M246-I315 WeakPolarHBondContact CA-O 3.39Å; K247-I315 PolarHBondContact N-O 3.19Å; K247-I315 PolarHBondContact O-N 2.94Å; L249-I315 HydrophobicContact CB-CG1 4.45Å; F251-I315 HydrophobicContact CB-CD1 3.7Å; F251-I315 HydrophobicContact CB-CG1 3.99Å; F251-I315 HydrophobicContact CD1-CD1 4.26Å; F251-I315 HydrophobicContact CD2-CD1 4.48Å; F251-I315 HydrophobicContact CG-CD1 3.91Å; L262-I315 HydrophobicContact CD1-CG2 4.38Å; T313-I315 HydrophobicContact CG2-CD1 4.07Å; I315-V317 HydrophobicContact CB-CG2 4.26Å; I315-V317 HydrophobicContact CG2-CG2 3.94Å; I315-V317 PolarHBondContact O-N 3.04Å; I315-E395 WeakPolarHBondContact CA-O 3.41Å; I315-E395 HydrophobicContact CD1-CB 3.68Å; I315-E395 HydrophobicContact CD1-CG 4.43Å; I315-F397 HydrophobicContact CG2-CB 3.82Å
316	I	97.2	Very high	94.3	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	106.4	170	-62.8	172.1	0	0	0	107.9	Y244 M246 E394 E395 F397	Y244-I316 HydrophobicContact CD2-CG2 4.36Å; Y244-I316 HydrophobicContact CE2-CG2 3.52Å; M246-I316 HydrophobicContact CG-CG1 4.12Å; M246-I316 HydrophobicContact SD-CG1 4.18Å; I316-E394 HydrophobicContact CD1-CB 4.24Å; I316-E394 WeakPolarHBondContact CD1-OE2 3.1Å; I316-E395 PolarHBondContact N-O 3.39Å; I316-F397 PolarHBondContact O-N 2.97Å
317	V	97.9	Very high	94.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.8	-174.5	-177.4	0	0	0	0	110.4	F220 Y244 Q245 L249 L262 I315 L319 F397	F220-V317 HydrophobicContact CE1-CG1 4.1Å; F220-V317 HydrophobicContact CZ-CG1 4.13Å; Y244-V317 WeakPolarHBondContact CA-O 3.4Å; Q245-V317 HydrophobicContact CG-CB 4.08Å; Q245-V317 PolarHBondContact N-O 3.16Å; Q245-V317 VanDerWaalsContact N-O 3.11Å; Q245-V317 PolarHBondContact O-N 3.08Å; L249-V317 HydrophobicContact CD1-CG2 3.73Å; L262-V317 HydrophobicContact CD1-CG2 4.41Å; L262-V317 HydrophobicContact CD2-CB 4.38Å; L262-V317 HydrophobicContact CD2-CG1 3.7Å; L262-V317 HydrophobicContact CD2-CG2 3.72Å; I315-V317 HydrophobicContact CB-CG2 4.26Å; I315-V317 HydrophobicContact CG2-CG2 3.94Å; I315-V317 PolarHBondContact O-N 3.04Å; V317-L319 HydrophobicContact CG1-CB 4.35Å; V317-F397 CarbonylContact C-O 3.57Å; V317-F397 WeakPolarHBondContact CA-O 3.37Å; V317-F397 HydrophobicContact CG1-CD1 4.44Å
318	H	98.4	Very high	94.3	Very high	29 Å²	29	44.2 Å²	44.2	13%	0.134	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	118.9	163.2	-64	77.3	0	0	0	108.6	M242 M243 Y244 F397 R398 A399	M242-H318 HydrophobicContact CG-CB 3.77Å; M242-H318 VanDerWaalsContact SD-C 3.55Å; M242-H318 HydrophobicContact SD-CB 3.79Å; M243-H318 WeakPolarHBondContact O-CA 3.29Å; Y244-H318 AromaticContact CD2-CD2 3.92Å; Y244-H318 AromaticContact CD2-CE1 3.58Å; Y244-H318 AromaticContact CD2-NE2 3.44Å; Y244-H318 WeakPolarHBondContact CD2-NE2 3.29Å; Y244-H318 AromaticContact CE2-CE1 3.74Å; Y244-H318 AromaticContact CE2-NE2 3.92Å; H318-F397 PolarHBondContact N-O 2.82Å; H318-R398 HydrophobicContact CB-CB 4.31Å; H318-R398 HydrophobicContact CB-CG 4.01Å; H318-A399 PolarHBondContact O-N 2.5Å
319	L	98.1	Very high	94.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	126.1	-178.4	177	60.2	0	0	0	109.7	F220 M242 M243 L264 I275 V317 K321 F322 V372 A399 F403	F220-L319 HydrophobicContact CE1-CB 4.36Å; F220-L319 HydrophobicContact CE2-CD2 4.27Å; F220-L319 HydrophobicContact CZ-CB 4.07Å; F220-L319 HydrophobicContact CZ-CD2 4.01Å; M242-L319 PolarHBondContact SD-N 3.41Å; M242-L319 VanDerWaalsContact SD-N 3.35Å; M243-L319 WeakPolarHBondContact CB-O 3.23Å; M243-L319 HydrophobicContact CE-CB 4.19Å; M243-L319 HydrophobicContact CE-CD2 3.87Å; M243-L319 HydrophobicContact CE-CG 3.9Å; M243-L319 PolarHBondContact N-O 3.41Å; M243-L319 PolarHBondContact O-N 2.82Å; M243-L319 VanDerWaalsContact O-N 3.08Å; L264-L319 HydrophobicContact CD1-CD2 3.64Å; I275-L319 HydrophobicContact CD1-CD1 3.46Å; I275-L319 VanDerWaalsContact CD1-CD1 3.46Å; I275-L319 HydrophobicContact CD1-CD2 3.93Å; I275-L319 HydrophobicContact CD1-CG 4.29Å; V317-L319 HydrophobicContact CG1-CB 4.35Å; L319-K321 PolarHBondContact O-N 3.3Å; L319-F322 HydrophobicContact CD1-CE1 4.48Å; L319-V372 HydrophobicContact CD2-CG1 4.31Å; L319-A399 HydrophobicContact CD1-CB 4.31Å; L319-F403 HydrophobicContact CD1-CZ 4.26Å
320	P	97.8	Very high	94.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.4	174.8	21.4	-33.9	0	0	0	110.8	F230 V240 F322 A399 F403 F421	F230-P320 HydrophobicContact CE2-CG 4.42Å; V240-P320 HydrophobicContact CB-CB 4.4Å; V240-P320 HydrophobicContact CG2-CB 4.19Å; P320-F322 HydrophobicContact CB-CD1 4.36Å; P320-F322 HydrophobicContact CG-CD1 4.18Å; P320-F322 WeakPolarHBondContact O-CD1 3.49Å; P320-A399 WeakPolarHBondContact CD-O 3.37Å; P320-F403 HydrophobicContact CG-CE1 3.79Å; P320-F403 HydrophobicContact CG-CZ 4.02Å; P320-F421 HydrophobicContact CB-CE1 4.27Å; P320-F421 HydrophobicContact CB-CZ 4.49Å; P320-F421 HydrophobicContact CG-CD1 4.29Å; P320-F421 HydrophobicContact CG-CE1 3.9Å; P320-F421 HydrophobicContact CG-CZ 4.5Å
321	K	95.6	Very high	94.3	Very high	83 Å²	83	43.1 Å²	43.1	36%	0.361	20%	0.202	S	C	.	.			trans	-74.9	125.4	160.7	179.5	173.7	-174.2	158.7	0	108	Q241 M243 L319 V372 N373 E374	Q241-K321 HydrophobicContact CB-CB 4.17Å; Q241-K321 WeakPolarHBondContact O-CB 3.34Å; Q241-K321 PolarHBondContact O-N 2.81Å; M243-K321 HydrophobicContact CG-CB 4.05Å; M243-K321 HydrophobicContact SD-CB 4.23Å; L319-K321 PolarHBondContact O-N 3.3Å; K321-V372 WeakPolarHBondContact CA-O 3.43Å; K321-V372 WeakPolarHBondContact CG-O 3.13Å; K321-N373 HydrophobicContact CD-CB 4.38Å; K321-N373 HydrophobicContact CG-CB 4.28Å; K321-E374 WeakPolarHBondContact CE-OE2 3.3Å; K321-E374 IonicContact NZ-OE1 2.75Å; K321-E374 PolarHBondContact NZ-OE1 2.99Å; K321-E374 IonicContact NZ-OE2 2.59Å; K321-E374 PolarHBondContact NZ-OE2 3.05Å
322	F	93.8	Very high	94.4	Very high	11 Å²	11	44.9 Å²	44.9	5%	0.048	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159	-177.8	63.1	-97.4	0	0	0	112.6	L319 P320 L324 V370 V372 F403 F405 F421	L319-F322 HydrophobicContact CD1-CE1 4.48Å; P320-F322 HydrophobicContact CB-CD1 4.36Å; P320-F322 HydrophobicContact CG-CD1 4.18Å; P320-F322 WeakPolarHBondContact O-CD1 3.49Å; F322-L324 HydrophobicContact CD2-CD1 4.23Å; F322-L324 HydrophobicContact CD2-CG 3.9Å; F322-L324 HydrophobicContact CE2-CD1 4.06Å; F322-L324 HydrophobicContact CE2-CG 4.2Å; F322-V370 HydrophobicContact CE2-CG1 4.47Å; F322-V372 HydrophobicContact CD1-CB 4.15Å; F322-V372 HydrophobicContact CD1-CG1 4.28Å; F322-V372 HydrophobicContact CD2-CB 4.19Å; F322-V372 HydrophobicContact CD2-CG2 4.07Å; F322-V372 HydrophobicContact CE1-CB 3.95Å; F322-V372 HydrophobicContact CE1-CG1 3.88Å; F322-V372 HydrophobicContact CE1-CG2 4.03Å; F322-V372 HydrophobicContact CE2-CB 4.03Å; F322-V372 HydrophobicContact CE2-CG2 3.49Å; F322-V372 VanDerWaalsContact CE2-CG2 3.49Å; F322-V372 HydrophobicContact CG-CB 4.26Å; F322-V372 HydrophobicContact CZ-CB 3.91Å; F322-V372 HydrophobicContact CZ-CG1 4.16Å; F322-V372 HydrophobicContact CZ-CG2 3.47Å; F322-V372 VanDerWaalsContact CZ-CG2 3.47Å; F322-V372 PolarHBondContact N-O 2.83Å; F322-V372 VanDerWaalsContact N-O 3.08Å; F322-V372 PolarHBondContact O-N 3.11Å; F322-F403 HydrophobicContact CE1-CE2 4.38Å; F322-F403 AromaticContact CE1-CZ 3.92Å; F322-F403 HydrophobicContact CE1-CZ 3.92Å; F322-F403 HydrophobicContact CZ-CZ 4.47Å; F322-F405 HydrophobicContact CE2-CE1 4.33Å; F322-F405 HydrophobicContact CE2-CZ 4.06Å; F322-F405 HydrophobicContact CZ-CE1 4.3Å; F322-F405 HydrophobicContact CZ-CZ 4.26Å; F322-F421 HydrophobicContact CB-CD2 4.18Å; F322-F421 HydrophobicContact CB-CE2 3.46Å; F322-F421 VanDerWaalsContact CB-CE2 3.46Å; F322-F421 HydrophobicContact CB-CZ 3.94Å; F322-F421 HydrophobicContact CD1-CD2 4.17Å; F322-F421 HydrophobicContact CD1-CE2 4.11Å; F322-F421 HydrophobicContact CD1-CZ 4.41Å; F322-F421 HydrophobicContact CD2-CD2 4.06Å; F322-F421 HydrophobicContact CD2-CE2 4.2Å; F322-F421 HydrophobicContact CE2-CD2 4.46Å; F322-F421 AromaticContact CG-CD2 3.89Å; F322-F421 HydrophobicContact CG-CD2 3.89Å; F322-F421 AromaticContact CG-CE2 3.68Å; F322-F421 HydrophobicContact CG-CE2 3.68Å; F322-F421 HydrophobicContact CG-CZ 4.32Å
323	K	91.5	Very high	94.7	Very high	126 Å²	126	39.8 Å²	39.8	55%	0.548	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132	170.5	-55.9	-169.3	-170.6	-149.6	0	108.3	F369 V370 D371	K323-F369 HydrophobicContact CD-CZ 4.48Å; K323-V370 VanDerWaalsContact CA-O 3.29Å; K323-V370 WeakPolarHBondContact CA-O 3.37Å; K323-D371 HydrophobicContact CD-CB 4.4Å; K323-D371 VanDerWaalsContact CE-CG 3.46Å; K323-D371 WeakPolarHBondContact CE-OD1 3.23Å; K323-D371 WeakPolarHBondContact CE-OD2 3.44Å; K323-D371 HydrophobicContact CG-CB 4.25Å; K323-D371 IonicContact NZ-OD1 2.67Å; K323-D371 IonicContact NZ-OD2 3.66Å; K323-D371 PolarHBondContact NZ-OD2 2.91Å
324	L	91.1	Very high	95.1	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.5	174.1	-61.4	178.2	0	0	0	109.2	N72 F74 F322 F369 V370 F405 F421	N72-L324 HydrophobicContact CB-CD1 4.47Å; N72-L324 HydrophobicContact CB-CD2 3.78Å; N72-L324 VanDerWaalsContact ND2-CD2 3.27Å; N72-L324 WeakPolarHBondContact ND2-CD2 3.27Å; F74-L324 HydrophobicContact CB-CB 4.01Å; F74-L324 HydrophobicContact CB-CD1 4.09Å; F74-L324 HydrophobicContact CG-CB 4.27Å; F322-L324 HydrophobicContact CD2-CD1 4.23Å; F322-L324 HydrophobicContact CD2-CG 3.9Å; F322-L324 HydrophobicContact CE2-CD1 4.06Å; F322-L324 HydrophobicContact CE2-CG 4.2Å; L324-F369 WeakPolarHBondContact O-CA 3.29Å; L324-V370 HydrophobicContact CB-CG1 3.95Å; L324-V370 PolarHBondContact N-O 3.36Å; L324-V370 PolarHBondContact O-N 2.83Å; L324-F405 HydrophobicContact CD1-CE1 4Å; L324-F405 HydrophobicContact CD1-CZ 3.86Å; L324-F421 HydrophobicContact CD1-CD2 4.43Å; L324-F421 HydrophobicContact CD2-CD2 4.27Å
325	E	90.8	Very high	95.4	Very high	89 Å²	89	35.9 Å²	35.9	42%	0.416	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	102.1	173.6	-173.3	-180	158	0	0	106.9	K367 A368 F369	E325-K367 WeakPolarHBondContact OE1-CE 3.37Å; E325-K367 IonicContact OE1-NZ 2.81Å; E325-K367 PolarHBondContact OE1-NZ 2.99Å; E325-A368 WeakPolarHBondContact CA-O 3.41Å; E325-F369 HydrophobicContact CB-CD2 3.87Å; E325-F369 HydrophobicContact CB-CE2 4.48Å; E325-F369 HydrophobicContact CG-CD2 4.03Å
326	E	93.2	Very high	95.5	Very high	24 Å²	24	42.2 Å²	42.2	11%	0.112	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.3	-177.1	-63.4	-66.2	158.9	0	0	109.9	R71 F74 Y328 K367 A368	R71-E326 IonicContact NH2-OE2 3.43Å; R71-E326 PolarHBondContact NH2-OE2 3.37Å; F74-E326 HydrophobicContact CB-CB 4.38Å; F74-E326 HydrophobicContact CB-CG 4.07Å; E326-Y328 HydrophobicContact CB-CE2 3.61Å; E326-Y328 WeakPolarHBondContact CB-OH 3.3Å; E326-K367 WeakPolarHBondContact O-CA 3.37Å; E326-A368 PolarHBondContact N-O 3.45Å; E326-A368 VanDerWaalsContact N-O 3.14Å; E326-A368 PolarHBondContact O-N 3.41Å
327	D	92.9	Very high	95.4	Very high	57 Å²	57	43.7 Å²	43.7	31%	0.305	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.2	178.7	78.9	-102	0	0	0	110.8	K194 H366 K367	K194-D327 WeakPolarHBondContact CE-OD2 3.36Å; K194-D327 IonicContact NZ-OD1 3.67Å; K194-D327 PolarHBondContact NZ-OD1 2.93Å; K194-D327 IonicContact NZ-OD2 3.64Å; K194-D327 PolarHBondContact NZ-OD2 2.95Å; D327-H366 CarbonylContact C-O 3.58Å; D327-H366 WeakPolarHBondContact CA-O 3.41Å; D327-K367 HydrophobicContact CB-CB 4.24Å; D327-K367 HydrophobicContact CB-CD 3.83Å; D327-K367 HydrophobicContact CB-CG 3.97Å
328	Y	94.2	Very high	95.4	Very high	20 Å²	20	45.5 Å²	45.5	8%	0.078	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.5	-175.2	-55.8	-81.6	0	0	0	111.7	L64 I73 F74 V75 E326 L330 H366	L64-Y328 HydrophobicContact CD1-CE1 4.44Å; L64-Y328 HydrophobicContact CD2-CD1 3.52Å; L64-Y328 HydrophobicContact CD2-CE1 3.73Å; L64-Y328 HydrophobicContact CD2-CG 4.16Å; I73-Y328 WeakPolarHBondContact CA-OH 3.17Å; F74-Y328 PolarHBondContact N-OH 2.78Å; F74-Y328 WeakPolarHBondContact O-CE2 3.13Å; V75-Y328 HydrophobicContact CB-CE2 4.46Å; E326-Y328 HydrophobicContact CB-CE2 3.61Å; E326-Y328 WeakPolarHBondContact CB-OH 3.3Å; Y328-L330 HydrophobicContact CG-CD2 4.31Å; Y328-H366 AromaticContact CD2-CD2 3.97Å; Y328-H366 PolarHBondContact N-O 3.3Å; Y328-H366 PolarHBondContact O-N 2.95Å
329	E	95.1	Very high	95.3	Very high	74 Å²	74	44.1 Å²	44.1	35%	0.346	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	109.1	154.2	-142.8	-56.6	-146.5	0	0	107.6	K331 H333 T363 V364	E329-K331 WeakPolarHBondContact OE1-CB 3.27Å; E329-K331 WeakPolarHBondContact OE2-CB 3.33Å; E329-K331 PolarHBondContact OE2-N 2.98Å; E329-H333 PolarHBondContact O-CD2 2.98Å; E329-T363 VanDerWaalsContact CD-OG1 3.23Å; E329-T363 WeakPolarHBondContact OE1-CA 3.28Å; E329-T363 PolarHBondContact OE1-OG1 2.93Å; E329-V364 PolarHBondContact OE2-N 3.45Å
330	L	96.8	Very high	95.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.233	C	C	.	.			trans	-81.4	-10.3	-173.8	-59.3	-179.7	0	0	0	115	L60 L64 I80 Y328 E332 H333 L334 V364 H366	L60-L330 HydrophobicContact CD1-CD2 4.31Å; L64-L330 HydrophobicContact CD2-CD2 4.5Å; I80-L330 HydrophobicContact CB-CD1 4.39Å; I80-L330 HydrophobicContact CD1-CD1 3.48Å; I80-L330 VanDerWaalsContact CD1-CD1 3.48Å; I80-L330 HydrophobicContact CG1-CD1 3.71Å; I80-L330 HydrophobicContact CG2-CD1 3.74Å; Y328-L330 HydrophobicContact CG-CD2 4.31Å; L330-E332 PolarHBondContact O-N 3.08Å; L330-H333 PolarHBondContact O-N 3.2Å; L330-H333 VanDerWaalsContact O-N 3.11Å; L330-L334 HydrophobicContact CB-CD1 3.79Å; L330-L334 HydrophobicContact CB-CG 4.11Å; L330-L334 WeakPolarHBondContact O-CB 3.38Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.5Å; L330-L334 PolarHBondContact O-N 3.27Å; L330-V364 HydrophobicContact CB-CB 4.07Å; L330-V364 HydrophobicContact CB-CG1 3.97Å; L330-V364 HydrophobicContact CD1-CG1 3.98Å; L330-V364 HydrophobicContact CG-CG1 4.36Å; L330-V364 PolarHBondContact N-O 2.89Å; L330-H366 HydrophobicContact CD1-CB 3.65Å; L330-H366 HydrophobicContact CG-CB 4.04Å
331	K	95.4	Very high	95.3	Very high	61 Å²	61	47.8 Å²	47.8	27%	0.265	24%	0.237	S	C	.	.	H	α-helix	trans	-48.9	-52.3	-177.6	169.9	174.7	167.6	175.3	0	113.3	E329 S335 F343	E329-K331 WeakPolarHBondContact OE1-CB 3.27Å; E329-K331 WeakPolarHBondContact OE2-CB 3.33Å; E329-K331 PolarHBondContact OE2-N 2.98Å; K331-S335 VanDerWaalsContact O-CB 3.28Å; K331-S335 WeakPolarHBondContact O-CB 3.42Å; K331-S335 PolarHBondContact O-N 2.61Å; K331-S335 PolarHBondContact O-OG 2.9Å; K331-F343 HydrophobicContact CB-CD1 4.14Å; K331-F343 HydrophobicContact CB-CE1 4.05Å; K331-F343 HydrophobicContact CD-CB 4.31Å; K331-F343 HydrophobicContact CD-CD1 4.1Å; K331-F343 HydrophobicContact CD-CG 4.32Å; K331-F343 HydrophobicContact CG-CB 4.26Å; K331-F343 HydrophobicContact CG-CD1 3.7Å; K331-F343 HydrophobicContact CG-CD2 4.32Å; K331-F343 HydrophobicContact CG-CE1 4.1Å; K331-F343 HydrophobicContact CG-CG 3.85Å
332	E	96.1	Very high	95.4	Very high	116 Å²	116	43.9 Å²	43.9	54%	0.542	22%	0.22	S	C	.	.	H	α-helix	trans	-68.9	-36.4	-177.7	-66.9	-58.4	138.9	0	0	111.9	L330 S335 K336	L330-E332 PolarHBondContact O-N 3.08Å; E332-S335 PolarHBondContact O-N 3.36Å; E332-K336 WeakPolarHBondContact O-CG 3.26Å; E332-K336 PolarHBondContact O-N 3.24Å
333	H	97.1	Very high	95.6	Very high	21 Å²	21	44 Å²	44	10%	0.097	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-47.5	178	-63.3	-67.3	0	0	0	111.4	L60 T63 E329 L330 S335 K336 M337	L60-H333 HydrophobicContact CD1-CB 4.17Å; T63-H333 PolarHBondContact O-ND1 2.78Å; T63-H333 WeakPolarHBondContact OG1-CB 3.43Å; E329-H333 PolarHBondContact O-CD2 2.98Å; L330-H333 PolarHBondContact O-N 3.2Å; L330-H333 VanDerWaalsContact O-N 3.11Å; H333-S335 VanDerWaalsContact C-N 3.34Å; H333-S335 PolarHBondContact O-N 3.12Å; H333-K336 WeakPolarHBondContact O-CB 3.45Å; H333-K336 PolarHBondContact O-N 3.4Å; H333-M337 WeakPolarHBondContact O-CG 3.43Å; H333-M337 PolarHBondContact O-N 2.71Å
334	L	97.5	Very high	95.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-35.7	176.9	-65.7	170.3	0	0	0	111.7	F56 M84 L330 K336 M337 G338 M339 F343 V364	F56-L334 HydrophobicContact CE2-CD2 3.93Å; F56-L334 HydrophobicContact CZ-CD2 4.15Å; M84-L334 HydrophobicContact CE-CD1 4.15Å; M84-L334 HydrophobicContact SD-CD1 4.26Å; L330-L334 HydrophobicContact CB-CD1 3.79Å; L330-L334 HydrophobicContact CB-CG 4.11Å; L330-L334 WeakPolarHBondContact O-CB 3.38Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.5Å; L330-L334 PolarHBondContact O-N 3.27Å; L334-K336 PolarHBondContact O-N 3.44Å; L334-M337 HydrophobicContact CD2-SD 4.4Å; L334-M337 WeakPolarHBondContact O-CA 3.18Å; L334-M337 WeakPolarHBondContact O-CB 3.22Å; L334-M337 PolarHBondContact O-N 3Å; L334-M337 VanDerWaalsContact O-N 3.08Å; L334-G338 PolarHBondContact O-N 2.87Å; L334-M339 HydrophobicContact CB-CB 4.5Å; L334-M339 HydrophobicContact CB-SD 4.33Å; L334-M339 HydrophobicContact CD2-CE 4.19Å; L334-M339 WeakPolarHBondContact O-CB 3.12Å; L334-M339 PolarHBondContact O-N 3.24Å; L334-M339 VanDerWaalsContact O-N 3.15Å; L334-F343 HydrophobicContact CB-CE2 3.88Å; L334-F343 HydrophobicContact CB-CZ 3.9Å; L334-F343 HydrophobicContact CD1-CZ 3.95Å; L334-V364 HydrophobicContact CD1-CG1 4.45Å; L334-V364 HydrophobicContact CD1-CG2 4.47Å
335	S	97.2	Very high	95.9	Very high	27 Å²	27	43.1 Å²	43.1	19%	0.189	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-41.9	173.5	-63.5	0	0	0	0	112	K331 E332 H333 M337 G338 M339 F343	K331-S335 VanDerWaalsContact O-CB 3.28Å; K331-S335 WeakPolarHBondContact O-CB 3.42Å; K331-S335 PolarHBondContact O-N 2.61Å; K331-S335 PolarHBondContact O-OG 2.9Å; E332-S335 PolarHBondContact O-N 3.36Å; H333-S335 VanDerWaalsContact C-N 3.34Å; H333-S335 PolarHBondContact O-N 3.12Å; S335-M337 PolarHBondContact O-N 3.44Å; S335-G338 PolarHBondContact O-N 3.1Å; S335-M339 WeakPolarHBondContact CA-O 3.37Å; S335-F343 WeakPolarHBondContact OG-CD2 3.49Å
336	K	97.1	Very high	96.1	Very high	133 Å²	133	42.6 Å²	42.6	58%	0.578	25%	0.252	S	S	*	.	H	α-helix	trans	-63.2	-24.6	173.8	-73	173	-177.4	178.3	0	113.1	T63 E332 H333 L334 G338	T63-K336 HydrophobicContact CG2-CB 4.28Å; E332-K336 WeakPolarHBondContact O-CG 3.26Å; E332-K336 PolarHBondContact O-N 3.24Å; H333-K336 WeakPolarHBondContact O-CB 3.45Å; H333-K336 PolarHBondContact O-N 3.4Å; L334-K336 PolarHBondContact O-N 3.44Å; K336-G338 PolarHBondContact O-N 3.29Å
337	M	96.8	Very high	96.3	Very high	41 Å²	41	47.8 Å²	47.8	20%	0.202	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.8	173.5	-60.6	174.1	68.2	0	0	113	F56 L60 T63 A102 H333 L334 S335	F56-M337 HydrophobicContact CD2-CE 3.66Å; F56-M337 HydrophobicContact CE2-CE 3.83Å; F56-M337 HydrophobicContact CE2-SD 4.3Å; L60-M337 HydrophobicContact CB-CE 4.46Å; L60-M337 HydrophobicContact CB-SD 4.13Å; L60-M337 HydrophobicContact CD1-SD 4.31Å; T63-M337 HydrophobicContact CG2-CG 3.86Å; T63-M337 HydrophobicContact CG2-SD 4.43Å; A102-M337 HydrophobicContact CB-CB 4.2Å; A102-M337 WeakPolarHBondContact O-CE 3.32Å; H333-M337 WeakPolarHBondContact O-CG 3.43Å; H333-M337 PolarHBondContact O-N 2.71Å; L334-M337 HydrophobicContact CD2-SD 4.4Å; L334-M337 WeakPolarHBondContact O-CA 3.18Å; L334-M337 WeakPolarHBondContact O-CB 3.22Å; L334-M337 PolarHBondContact O-N 3Å; L334-M337 VanDerWaalsContact O-N 3.08Å; S335-M337 PolarHBondContact O-N 3.44Å
338	G	96.4	Very high	96.5	Very high	39 Å²	39	45.9 Å²	45.9	40%	0.402	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	7.6	176.4	0	0	0	0	0	114.8	L334 S335 K336 T340	L334-G338 PolarHBondContact O-N 2.87Å; S335-G338 PolarHBondContact O-N 3.1Å; K336-G338 PolarHBondContact O-N 3.29Å; G338-T340 PolarHBondContact O-N 3.26Å
339	M	95.9	Very high	96.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.276	C	S	.	.			trans	-92.7	83	175.7	-169.2	-170.1	-53.3	0	0	109.9	M84 M99 A102 L103 L334 S335 V342 F343	M84-M339 HydrophobicContact CE-CE 4.07Å; M84-M339 HydrophobicContact CE-SD 3.32Å; M84-M339 WeakPolarHBondContact CE-SD 3.45Å; M99-M339 HydrophobicContact CG-CE 4.41Å; M99-M339 HydrophobicContact CG-CG 3.79Å; M99-M339 HydrophobicContact CG-SD 3.85Å; A102-M339 HydrophobicContact CB-CB 3.81Å; A102-M339 HydrophobicContact CB-CE 3.71Å; L103-M339 HydrophobicContact CD1-CE 4.04Å; L103-M339 HydrophobicContact CD2-CE 3.89Å; L103-M339 HydrophobicContact CG-CE 3.64Å; L334-M339 HydrophobicContact CB-CB 4.5Å; L334-M339 HydrophobicContact CB-SD 4.33Å; L334-M339 HydrophobicContact CD2-CE 4.19Å; L334-M339 WeakPolarHBondContact O-CB 3.12Å; L334-M339 PolarHBondContact O-N 3.24Å; L334-M339 VanDerWaalsContact O-N 3.15Å; S335-M339 WeakPolarHBondContact CA-O 3.37Å; M339-V342 HydrophobicContact CG-CG1 3.75Å; M339-V342 HydrophobicContact SD-CG1 3.98Å; M339-F343 HydrophobicContact CB-CE2 4.45Å; M339-F343 HydrophobicContact CG-CE2 4.21Å; M339-F343 WeakPolarHBondContact O-CD2 3.32Å; M339-F343 WeakPolarHBondContact O-CE2 3.47Å; M339-F343 HydrophobicContact SD-CE2 4.21Å; M339-F343 HydrophobicContact SD-CZ 4.32Å
340	T	97.7	Very high	96.8	Very high	63 Å²	63	44 Å²	44	39%	0.387	26%	0.261	S	S	.	.			trans	-106.6	-39.2	-171.2	53.2	0	0	0	0	114.1	Q98 G338 V342 F343	Q98-T340 VanDerWaalsContact OE1-N 3.1Å; Q98-T340 PolarHBondContact OE1-OG1 3.44Å; G338-T340 PolarHBondContact O-N 3.26Å; T340-V342 VanDerWaalsContact C-N 3.35Å; T340-V342 PolarHBondContact O-N 3.15Å; T340-F343 PolarHBondContact O-N 3.2Å
341	D	98.3	Very high	96.8	Very high	13 Å²	13	46.8 Å²	46.8	7%	0.07	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-69.6	-35.2	-168.3	-70.8	-4.8	0	0	0	112.1	Q98 F343 C344 K347 A348	Q98-D341 PolarHBondContact NE2-OD1 3.15Å; Q98-D341 PolarHBondContact NE2-OD2 2.96Å; D341-F343 PolarHBondContact O-N 3.32Å; D341-F343 VanDerWaalsContact O-N 3.08Å; D341-C344 PolarHBondContact O-N 3.41Å; D341-K347 HydrophobicContact CB-CB 3.98Å; D341-K347 VanDerWaalsContact OD1-CD 3.29Å; D341-K347 WeakPolarHBondContact OD1-CD 3.4Å; D341-A348 VanDerWaalsContact O-CA 3.25Å; D341-A348 WeakPolarHBondContact O-CA 3.23Å; D341-A348 VanDerWaalsContact O-CB 3.29Å; D341-A348 WeakPolarHBondContact O-CB 3.37Å; D341-A348 PolarHBondContact O-N 3.16Å
342	V	98.2	Very high	96.8	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.4	-28.3	176.9	76	0	0	0	0	112.8	V87 T95 M99 M339 T340 L350 L361	V87-V342 HydrophobicContact CG1-CG2 3.87Å; T95-V342 HydrophobicContact CG2-CB 3.78Å; T95-V342 HydrophobicContact CG2-CG2 3.99Å; M99-V342 HydrophobicContact SD-CB 4.33Å; M99-V342 HydrophobicContact SD-CG2 3.97Å; M339-V342 HydrophobicContact CG-CG1 3.75Å; M339-V342 HydrophobicContact SD-CG1 3.98Å; T340-V342 VanDerWaalsContact C-N 3.35Å; T340-V342 PolarHBondContact O-N 3.15Å; V342-L350 HydrophobicContact CG2-CD2 4.26Å; V342-L361 HydrophobicContact CG2-CB 3.91Å; V342-L361 HydrophobicContact CG2-CD2 4.31Å; V342-L361 PolarHBondContact O-N 2.63Å
343	F	97.9	Very high	96.8	Very high	13 Å²	13	39.2 Å²	39.2	6%	0.057	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-92.9	2	-179	-57.4	-67.2	0	0	0	113.6	K331 L334 S335 M339 T340 D341 L361 V364	K331-F343 HydrophobicContact CB-CD1 4.14Å; K331-F343 HydrophobicContact CB-CE1 4.05Å; K331-F343 HydrophobicContact CD-CB 4.31Å; K331-F343 HydrophobicContact CD-CD1 4.1Å; K331-F343 HydrophobicContact CD-CG 4.32Å; K331-F343 HydrophobicContact CG-CB 4.26Å; K331-F343 HydrophobicContact CG-CD1 3.7Å; K331-F343 HydrophobicContact CG-CD2 4.32Å; K331-F343 HydrophobicContact CG-CE1 4.1Å; K331-F343 HydrophobicContact CG-CG 3.85Å; L334-F343 HydrophobicContact CB-CE2 3.88Å; L334-F343 HydrophobicContact CB-CZ 3.9Å; L334-F343 HydrophobicContact CD1-CZ 3.95Å; S335-F343 WeakPolarHBondContact OG-CD2 3.49Å; M339-F343 HydrophobicContact CB-CE2 4.45Å; M339-F343 HydrophobicContact CG-CE2 4.21Å; M339-F343 WeakPolarHBondContact O-CD2 3.32Å; M339-F343 WeakPolarHBondContact O-CE2 3.47Å; M339-F343 HydrophobicContact SD-CE2 4.21Å; M339-F343 HydrophobicContact SD-CZ 4.32Å; T340-F343 PolarHBondContact O-N 3.2Å; D341-F343 PolarHBondContact O-N 3.32Å; D341-F343 VanDerWaalsContact O-N 3.08Å; F343-L361 HydrophobicContact CD1-CB 4.09Å; F343-L361 HydrophobicContact CD1-CD2 4.38Å; F343-L361 HydrophobicContact CD1-CG 4.24Å; F343-L361 WeakPolarHBondContact CD1-O 3.44Å; F343-L361 HydrophobicContact CE1-CB 4.22Å; F343-L361 HydrophobicContact CE1-CD2 3.69Å; F343-L361 HydrophobicContact CE1-CG 3.94Å; F343-L361 HydrophobicContact CZ-CD2 4.31Å; F343-V364 HydrophobicContact CE1-CG2 3.85Å; F343-V364 HydrophobicContact CZ-CG2 4.36Å
344	C	96.4	Very high	96.6	Very high	52 Å²	52	38.5 Å²	38.5	35%	0.351	25%	0.245	S	C	.	.			trans	-117.3	115.6	-172.8	-177.5	0	0	0	0	111.4	D341 G346 K347 A348	D341-C344 PolarHBondContact O-N 3.41Å; C344-G346 PolarHBondContact O-N 3.11Å; C344-K347 HydrophobicContact CB-CB 4.13Å; C344-K347 HydrophobicContact CB-CG 4.45Å; C344-K347 PolarHBondContact O-N 2.77Å; C344-A348 WeakPolarHBondContact O-CB 3.36Å; C344-A348 PolarHBondContact O-N 2.92Å
345	A	93.6	Very high	96.3	Very high	62 Å²	62	45.6 Å²	45.6	51%	0.512	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-32.1	-177.2	0	0	0	0	0	114.8	F360	A345-F360 HydrophobicContact CB-CD1 3.47Å; A345-F360 VanDerWaalsContact CB-CD1 3.47Å; A345-F360 HydrophobicContact CB-CE1 3.54Å; A345-F360 HydrophobicContact CB-CG 3.99Å; A345-F360 HydrophobicContact CB-CZ 4.13Å
346	G	94.1	Very high	96	Very high	77 Å²	77	49.6 Å²	49.6	79%	0.794	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.7	-179.4	0	0	0	0	0	115.2	C344	C344-G346 PolarHBondContact O-N 3.11Å
347	K	97	Very high	95.6	Very high	133 Å²	133	44.3 Å²	44.3	58%	0.578	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	-26.3	-175.6	-62.9	-173	176.9	-173.7	0	114	D341 C344 D349	D341-K347 HydrophobicContact CB-CB 3.98Å; D341-K347 VanDerWaalsContact OD1-CD 3.29Å; D341-K347 WeakPolarHBondContact OD1-CD 3.4Å; C344-K347 HydrophobicContact CB-CB 4.13Å; C344-K347 HydrophobicContact CB-CG 4.45Å; C344-K347 PolarHBondContact O-N 2.77Å; K347-D349 PolarHBondContact O-N 2.73Å
348	A	97.9	Very high	95.2	Very high	18 Å²	18	45.1 Å²	45.1	15%	0.149	30%	0.299	C	S	.	.			trans	-58.8	120.3	-178.6	0	0	0	0	0	110.3	D341 C344 L359 F360	D341-A348 VanDerWaalsContact O-CA 3.25Å; D341-A348 WeakPolarHBondContact O-CA 3.23Å; D341-A348 VanDerWaalsContact O-CB 3.29Å; D341-A348 WeakPolarHBondContact O-CB 3.37Å; D341-A348 PolarHBondContact O-N 3.16Å; C344-A348 WeakPolarHBondContact O-CB 3.36Å; C344-A348 PolarHBondContact O-N 2.92Å; A348-L359 WeakPolarHBondContact CB-O 3.28Å; A348-F360 HydrophobicContact CB-CB 3.62Å
349	D	97.8	Very high	95.2	Very high	51 Å²	51	43.3 Å²	43.3	27%	0.273	28%	0.28	S	S	.	.			trans	-105.2	87.8	171.7	-171.9	-6	0	0	0	109	A91 K92 T95 K347 T351	A91-D349 CarbonylContact C-O 3.57Å; A91-D349 WeakPolarHBondContact CA-O 3.27Å; K92-D349 HydrophobicContact CB-CB 4.48Å; K92-D349 WeakPolarHBondContact CB-OD2 3.35Å; K92-D349 PolarHBondContact N-O 2.97Å; T95-D349 PolarHBondContact OG1-N 3.04Å; K347-D349 PolarHBondContact O-N 2.73Å; D349-T351 WeakPolarHBondContact OD1-CB 3.47Å; D349-T351 VanDerWaalsContact OD1-CG2 3.25Å; D349-T351 WeakPolarHBondContact OD1-CG2 3.39Å; D349-T351 PolarHBondContact OD1-N 3.14Å; D349-T351 PolarHBondContact OD1-OG1 2.88Å
350	L	97.3	Very high	95.2	Very high	4 Å²	4	45 Å²	45	2%	0.021	29%	0.288	C	S	.	.			trans	-108.1	30.7	173.3	-61.6	-179.6	0	0	0	111	V87 G90 A91 T95 L204 V342 G352 M353 N354 L359	V87-L350 HydrophobicContact CG1-CD2 4.11Å; G90-L350 CarbonylContact O-C 3.56Å; G90-L350 WeakPolarHBondContact O-CA 3.34Å; A91-L350 HydrophobicContact CB-CD2 4.02Å; T95-L350 HydrophobicContact CG2-CD2 4.32Å; L204-L350 HydrophobicContact CD2-CD1 3.91Å; V342-L350 HydrophobicContact CG2-CD2 4.26Å; L350-G352 PolarHBondContact O-N 2.85Å; L350-M353 HydrophobicContact CB-CG 4.36Å; L350-M353 HydrophobicContact CB-SD 4.24Å; L350-M353 HydrophobicContact CD1-SD 4.24Å; L350-M353 HydrophobicContact CD2-CE 4.02Å; L350-M353 HydrophobicContact CD2-SD 4.46Å; L350-M353 WeakPolarHBondContact O-CB 3.27Å; L350-M353 PolarHBondContact O-N 3.43Å; L350-N354 PolarHBondContact O-N 3.32Å; L350-L359 HydrophobicContact CB-CB 4.07Å; L350-L359 HydrophobicContact CD1-CB 4.13Å
351	T	97	Very high	95.2	Very high	58 Å²	58	42 Å²	42	36%	0.356	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.8	-179.5	53	0	0	0	0	113.2	D349 M353 N354	D349-T351 WeakPolarHBondContact OD1-CB 3.47Å; D349-T351 VanDerWaalsContact OD1-CG2 3.25Å; D349-T351 WeakPolarHBondContact OD1-CG2 3.39Å; D349-T351 PolarHBondContact OD1-N 3.14Å; D349-T351 PolarHBondContact OD1-OG1 2.88Å; T351-M353 PolarHBondContact O-N 3.41Å; T351-N354 WeakPolarHBondContact CA-O 3.38Å; T351-N354 CarbonylContact O-C 3.57Å
352	G	95.8	Very high	95.2	Very high	18 Å²	18	42.3 Å²	42.3	19%	0.186	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.5	168.9	0	0	0	0	0	114.4	G90 L350	G90-G352 WeakPolarHBondContact O-CA 3.44Å; G90-G352 PolarHBondContact O-N 3.45Å; L350-G352 PolarHBondContact O-N 2.85Å
353	M	95.9	Very high	95	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-40.5	171.3	-53.3	-174.5	178.1	0	0	112.5	V87 F145 L146 F149 L204 L350 T351 L359	V87-M353 VanDerWaalsContact CA-CE 3.46Å; V87-M353 HydrophobicContact CB-CE 4.19Å; V87-M353 HydrophobicContact CG1-CE 3.95Å; V87-M353 WeakPolarHBondContact O-CE 3.49Å; F145-M353 CarbonylContact C-O 3.55Å; F145-M353 VanDerWaalsContact CA-O 3.31Å; F145-M353 WeakPolarHBondContact CA-O 3.26Å; F145-M353 HydrophobicContact CD1-CB 4.48Å; L146-M353 PolarHBondContact N-O 3.06Å; F149-M353 HydrophobicContact CD1-CB 4.34Å; F149-M353 HydrophobicContact CD1-CG 4.35Å; F149-M353 HydrophobicContact CD2-CB 4.46Å; F149-M353 HydrophobicContact CD2-CG 3.9Å; F149-M353 HydrophobicContact CE1-CB 4.44Å; F149-M353 HydrophobicContact CE1-CG 4.11Å; F149-M353 HydrophobicContact CE1-SD 4.34Å; F149-M353 HydrophobicContact CE2-CE 3.83Å; F149-M353 HydrophobicContact CE2-CG 3.64Å; F149-M353 HydrophobicContact CE2-SD 4.24Å; F149-M353 HydrophobicContact CG-CB 4.36Å; F149-M353 HydrophobicContact CG-CG 4.25Å; F149-M353 HydrophobicContact CZ-CE 3.74Å; F149-M353 HydrophobicContact CZ-CG 3.75Å; F149-M353 HydrophobicContact CZ-SD 3.88Å; L204-M353 HydrophobicContact CD2-CE 4.46Å; L204-M353 HydrophobicContact CD2-SD 3.98Å; L350-M353 HydrophobicContact CB-CG 4.36Å; L350-M353 HydrophobicContact CB-SD 4.24Å; L350-M353 HydrophobicContact CD1-SD 4.24Å; L350-M353 HydrophobicContact CD2-CE 4.02Å; L350-M353 HydrophobicContact CD2-SD 4.46Å; L350-M353 WeakPolarHBondContact O-CB 3.27Å; L350-M353 PolarHBondContact O-N 3.43Å; T351-M353 PolarHBondContact O-N 3.41Å; M353-L359 HydrophobicContact CB-CD1 4.03Å
354	N	93.4	Very high	94.9	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.027	27%	0.271	C	S	.	.			trans	-145	112.5	-174.6	176.2	33.9	0	0	0	109.5	K144 L350 T351 D356 G357 L359	K144-N354 PolarHBondContact N-OD1 3.2Å; K144-N354 PolarHBondContact O-OD1 3.06Å; K144-N354 VanDerWaalsContact O-OD1 3.07Å; L350-N354 PolarHBondContact O-N 3.32Å; T351-N354 WeakPolarHBondContact CA-O 3.38Å; T351-N354 CarbonylContact O-C 3.57Å; N354-D356 PolarHBondContact O-N 3.27Å; N354-D356 PolarHBondContact OD1-N 3.13Å; N354-G357 PolarHBondContact ND2-O 2.88Å; N354-G357 PolarHBondContact O-N 2.84Å; N354-G357 VanDerWaalsContact O-N 3.1Å; N354-L359 HydrophobicContact CB-CD1 3.44Å; N354-L359 VanDerWaalsContact CB-CD1 3.44Å; N354-L359 HydrophobicContact CB-CG 4.07Å
355	E	91.6	Very high	94.9	Very high	150 Å²	150	39.7 Å²	39.7	70%	0.701	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-32.4	-179	-84.4	171.9	-167.9	0	0	113	L146 G357	L146-E355 HydrophobicContact CD1-CG 4.21Å; L146-E355 HydrophobicContact CD2-CG 3.88Å; L146-E355 HydrophobicContact CG-CG 4.49Å; E355-G357 PolarHBondContact O-N 3.48Å; E355-G357 VanDerWaalsContact O-N 3.11Å
356	D	89.5	Confident	95.1	Very high	110 Å²	110	36.8 Å²	36.8	59%	0.588	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-8.6	-179.7	-68.2	-22.8	0	0	0	112.6	K144 N354	K144-D356 WeakPolarHBondContact CE-OD2 3.4Å; K144-D356 IonicContact NZ-OD1 2.69Å; K144-D356 IonicContact NZ-OD2 3.43Å; K144-D356 PolarHBondContact NZ-OD2 3.35Å; N354-D356 PolarHBondContact O-N 3.27Å; N354-D356 PolarHBondContact OD1-N 3.13Å
357	G	89.2	Confident	95.1	Very high	22 Å²	22	33.8 Å²	33.8	23%	0.227	20%	0.198	C	C	.	.			trans	70.1	-159.1	-178.4	0	0	0	0	0	113.4	N354 E355 L359	N354-G357 PolarHBondContact ND2-O 2.88Å; N354-G357 PolarHBondContact O-N 2.84Å; N354-G357 VanDerWaalsContact O-N 3.1Å; E355-G357 PolarHBondContact O-N 3.48Å; E355-G357 VanDerWaalsContact O-N 3.11Å; G357-L359 PolarHBondContact O-N 2.85Å; G357-L359 VanDerWaalsContact O-N 3.11Å
358	G	88.8	Confident	94.9	Very high	58 Å²	58	27.5 Å²	27.5	60%	0.598	17%	0.17	S	C	*	.			trans	71.9	1.5	175.5	0	0	0	0	0	116.1
359	L	95.4	Very high	94.4	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.01	17%	0.168	C	C	.	.			trans	-82.9	136.6	170.4	-75.7	-177.4	0	0	0	110.7	S143 F145 R203 A348 L350 M353 N354 G357	S143-L359 VanDerWaalsContact OG-CD2 3.29Å; S143-L359 WeakPolarHBondContact OG-CD2 3.48Å; F145-L359 HydrophobicContact CD1-CD1 4.4Å; F145-L359 HydrophobicContact CE1-CD1 3.67Å; F145-L359 HydrophobicContact CZ-CD1 4.38Å; R203-L359 HydrophobicContact CB-CD2 4.22Å; A348-L359 WeakPolarHBondContact CB-O 3.28Å; L350-L359 HydrophobicContact CB-CB 4.07Å; L350-L359 HydrophobicContact CD1-CB 4.13Å; M353-L359 HydrophobicContact CB-CD1 4.03Å; N354-L359 HydrophobicContact CB-CD1 3.44Å; N354-L359 VanDerWaalsContact CB-CD1 3.44Å; N354-L359 HydrophobicContact CB-CG 4.07Å; G357-L359 PolarHBondContact O-N 2.85Å; G357-L359 VanDerWaalsContact O-N 3.11Å
360	F	97.3	Very high	93.9	Very high	35 Å²	35	25.4 Å²	25.4	15%	0.154	16%	0.156	C	C	.	.			trans	-146	150.1	168.6	63.2	-81.8	0	0	0	108.3	R203 L204 A345 A348 S362	R203-F360 HydrophobicContact CB-CD1 4.24Å; R203-F360 HydrophobicContact CB-CE1 4.02Å; R203-F360 HydrophobicContact CB-CZ 4.46Å; R203-F360 HydrophobicContact CG-CD1 4.07Å; R203-F360 HydrophobicContact CG-CE1 3.47Å; R203-F360 VanDerWaalsContact CG-CE1 3.47Å; R203-F360 HydrophobicContact CG-CZ 4.02Å; L204-F360 WeakPolarHBondContact CB-O 3.36Å; A345-F360 HydrophobicContact CB-CD1 3.47Å; A345-F360 VanDerWaalsContact CB-CD1 3.47Å; A345-F360 HydrophobicContact CB-CE1 3.54Å; A345-F360 HydrophobicContact CB-CG 3.99Å; A345-F360 HydrophobicContact CB-CZ 4.13Å; A348-F360 HydrophobicContact CB-CB 3.62Å; F360-S362 WeakPolarHBondContact CE2-OG 3.42Å; F360-S362 PolarHBondContact O-N 2.89Å; F360-S362 VanDerWaalsContact O-N 3.11Å; F360-S362 PolarHBondContact O-OG 2.85Å
361	L	97.5	Very high	93.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	107.6	177.7	-170.1	57	0	0	0	108.5	M84 V87 L204 L206 V342 F343 V364	M84-L361 HydrophobicContact CE-CD2 3.8Å; M84-L361 HydrophobicContact SD-CD2 4Å; V87-L361 HydrophobicContact CG1-CD2 4.32Å; V87-L361 HydrophobicContact CG2-CD1 4.45Å; V87-L361 HydrophobicContact CG2-CD2 4.28Å; L204-L361 HydrophobicContact CB-CD1 4.49Å; L204-L361 HydrophobicContact CD2-CD1 4.05Å; L204-L361 HydrophobicContact CG-CD1 4.05Å; L206-L361 HydrophobicContact CB-CD1 3.94Å; V342-L361 HydrophobicContact CG2-CB 3.91Å; V342-L361 HydrophobicContact CG2-CD2 4.31Å; V342-L361 PolarHBondContact O-N 2.63Å; F343-L361 HydrophobicContact CD1-CB 4.09Å; F343-L361 HydrophobicContact CD1-CD2 4.38Å; F343-L361 HydrophobicContact CD1-CG 4.24Å; F343-L361 WeakPolarHBondContact CD1-O 3.44Å; F343-L361 HydrophobicContact CE1-CB 4.22Å; F343-L361 HydrophobicContact CE1-CD2 3.69Å; F343-L361 HydrophobicContact CE1-CG 3.94Å; F343-L361 HydrophobicContact CZ-CD2 4.31Å; L361-V364 HydrophobicContact CD1-CG2 4.22Å; L361-V364 HydrophobicContact CD2-CG2 3.39Å; L361-V364 HydrophobicContact CG-CG2 3.75Å
362	S	96.8	Very high	93.3	Very high	20 Å²	20	24.9 Å²	24.9	14%	0.14	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-36	-175.6	-53.8	0	0	0	0	111.8	R203 L204 F360	R203-S362 PolarHBondContact N-OG 3.11Å; L204-S362 PolarHBondContact N-OG 3.19Å; L204-S362 WeakPolarHBondContact O-CB 3.3Å; L204-S362 PolarHBondContact O-N 3.36Å; F360-S362 WeakPolarHBondContact CE2-OG 3.42Å; F360-S362 PolarHBondContact O-N 2.89Å; F360-S362 VanDerWaalsContact O-N 3.11Å; F360-S362 PolarHBondContact O-OG 2.85Å
363	T	94.4	Very high	93.1	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	150.5	-179.4	-169.8	0	0	0	0	112	T197 V198 A205 L206 E329	T197-T363 HydrophobicContact CG2-CG2 4.46Å; V198-T363 HydrophobicContact CG1-CG2 4.27Å; A205-T363 HydrophobicContact CB-CG2 3.6Å; L206-T363 PolarHBondContact N-O 2.73Å; E329-T363 VanDerWaalsContact CD-OG1 3.23Å; E329-T363 WeakPolarHBondContact OE1-CA 3.28Å; E329-T363 PolarHBondContact OE1-OG1 2.93Å
364	V	96.9	Very high	93	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	94.4	173.2	-176.2	0	0	0	0	109	M84 L206 E329 L330 L334 F343 L361	M84-V364 HydrophobicContact SD-CG1 4.27Å; M84-V364 HydrophobicContact SD-CG2 4.11Å; L206-V364 HydrophobicContact CB-CG2 4.39Å; L206-V364 HydrophobicContact CD2-CG1 4.07Å; L206-V364 HydrophobicContact CG-CG1 4.49Å; L206-V364 WeakPolarHBondContact O-CA 3.18Å; E329-V364 PolarHBondContact OE2-N 3.45Å; L330-V364 HydrophobicContact CB-CB 4.07Å; L330-V364 HydrophobicContact CB-CG1 3.97Å; L330-V364 HydrophobicContact CD1-CG1 3.98Å; L330-V364 HydrophobicContact CG-CG1 4.36Å; L330-V364 PolarHBondContact N-O 2.89Å; L334-V364 HydrophobicContact CD1-CG1 4.45Å; L334-V364 HydrophobicContact CD1-CG2 4.47Å; F343-V364 HydrophobicContact CE1-CG2 3.85Å; F343-V364 HydrophobicContact CZ-CG2 4.36Å; L361-V364 HydrophobicContact CD1-CG2 4.22Å; L361-V364 HydrophobicContact CD2-CG2 3.39Å; L361-V364 HydrophobicContact CG-CG2 3.75Å
365	A	96.7	Very high	92.6	Very high	5 Å²	5	30.9 Å²	30.9	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.6	179.8	0	0	0	0	0	110.6	L192 L193 L206 V207 N208	L192-A365 HydrophobicContact CD1-CB 4.3Å; L192-A365 HydrophobicContact CD2-CB 4.32Å; L192-A365 HydrophobicContact CG-CB 4.11Å; L193-A365 HydrophobicContact CD2-CB 3.34Å; L206-A365 PolarHBondContact O-N 3.06Å; V207-A365 HydrophobicContact CG1-CB 4.49Å; N208-A365 PolarHBondContact N-O 3.04Å
366	H	96.4	Very high	90.7	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.7	173.6	179.6	62.3	0	0	0	111.2	S76 I80 N208 D327 Y328 L330	S76-H366 PolarHBondContact N-NE2 3.27Å; S76-H366 VanDerWaalsContact N-NE2 3.12Å; I80-H366 HydrophobicContact CD1-CB 4.37Å; I80-H366 HydrophobicContact CG1-CB 4.35Å; N208-H366 VanDerWaalsContact O-CA 3.26Å; N208-H366 WeakPolarHBondContact O-CA 3.29Å; N208-H366 PolarHBondContact O-ND1 2.89Å; N208-H366 PolarHBondContact OD1-CE1 3.2Å; N208-H366 PolarHBondContact OD1-ND1 3.31Å; D327-H366 CarbonylContact C-O 3.58Å; D327-H366 WeakPolarHBondContact CA-O 3.41Å; Y328-H366 AromaticContact CD2-CD2 3.97Å; Y328-H366 PolarHBondContact N-O 3.3Å; Y328-H366 PolarHBondContact O-N 2.95Å; L330-H366 HydrophobicContact CD1-CB 3.65Å; L330-H366 HydrophobicContact CG-CB 4.04Å
367	K	94.9	Very high	87.8	Confident	15 Å²	15	24.6 Å²	24.6	7%	0.065	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	131.8	168.7	-170.2	161.5	175.4	-179.9	0	110.8	I189 K190 L192 N208 A209 I210 E325 E326 D327	I189-K367 HydrophobicContact CG2-CB 4Å; I189-K367 HydrophobicContact CG2-CD 3.6Å; I189-K367 HydrophobicContact CG2-CG 3.79Å; K190-K367 PolarHBondContact O-NZ 2.59Å; L192-K367 HydrophobicContact CD1-CB 3.29Å; L192-K367 HydrophobicContact CD1-CD 4.28Å; L192-K367 HydrophobicContact CD1-CG 4.41Å; N208-K367 PolarHBondContact O-N 3.14Å; A209-K367 WeakPolarHBondContact CA-O 3.24Å; I210-K367 PolarHBondContact N-O 2.88Å; I210-K367 VanDerWaalsContact N-O 3.09Å; E325-K367 WeakPolarHBondContact OE1-CE 3.37Å; E325-K367 IonicContact OE1-NZ 2.81Å; E325-K367 PolarHBondContact OE1-NZ 2.99Å; E326-K367 WeakPolarHBondContact O-CA 3.37Å; D327-K367 HydrophobicContact CB-CB 4.24Å; D327-K367 HydrophobicContact CB-CD 3.83Å; D327-K367 HydrophobicContact CB-CG 3.97Å
368	A	91.7	Very high	85	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.8	-179.6	0	0	0	0	0	110.5	F74 I210 E325 E326	F74-A368 HydrophobicContact CD1-CB 3.64Å; F74-A368 HydrophobicContact CE1-CB 3.72Å; I210-A368 HydrophobicContact CG2-CB 4.12Å; E325-A368 WeakPolarHBondContact CA-O 3.41Å; E326-A368 PolarHBondContact N-O 3.45Å; E326-A368 VanDerWaalsContact N-O 3.14Å; E326-A368 PolarHBondContact O-N 3.41Å
369	F	88.4	Confident	82	Confident	24 Å²	24	33.7 Å²	33.7	11%	0.105	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.3	178.5	178.9	-80.9	0	0	0	111.1	I189 I210 Y211 K323 L324 E325 D371	I189-F369 HydrophobicContact CG1-CB 4.45Å; I210-F369 PolarHBondContact O-N 3.17Å; Y211-F369 HydrophobicContact CD2-CB 4.39Å; Y211-F369 AromaticContact CD2-CD1 3.57Å; Y211-F369 HydrophobicContact CD2-CD1 3.57Å; Y211-F369 HydrophobicContact CD2-CE1 4.29Å; Y211-F369 HydrophobicContact CD2-CG 4.34Å; Y211-F369 AromaticContact CE2-CD1 3.6Å; Y211-F369 HydrophobicContact CE2-CD1 3.6Å; Y211-F369 AromaticContact CE2-CE1 3.86Å; Y211-F369 HydrophobicContact CE2-CE1 3.86Å; K323-F369 HydrophobicContact CD-CZ 4.48Å; L324-F369 WeakPolarHBondContact O-CA 3.29Å; E325-F369 HydrophobicContact CB-CD2 3.87Å; E325-F369 HydrophobicContact CB-CE2 4.48Å; E325-F369 HydrophobicContact CG-CD2 4.03Å; F369-D371 HydrophobicContact CE1-CB 3.78Å; F369-D371 HydrophobicContact CZ-CB 4.16Å
370	V	87.8	Confident	78.9	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.2	169.5	64	0	0	0	0	111.4	F74 F322 K323 L324 V372	F74-V370 HydrophobicContact CD1-CB 4.35Å; F74-V370 HydrophobicContact CD1-CG1 3.87Å; F74-V370 HydrophobicContact CD2-CG1 3.94Å; F74-V370 HydrophobicContact CE1-CB 3.59Å; F74-V370 HydrophobicContact CE1-CG1 3.58Å; F74-V370 HydrophobicContact CE2-CB 4.04Å; F74-V370 HydrophobicContact CE2-CG1 3.65Å; F74-V370 HydrophobicContact CG-CG1 4.05Å; F74-V370 HydrophobicContact CZ-CB 3.4Å; F74-V370 VanDerWaalsContact CZ-CB 3.4Å; F74-V370 HydrophobicContact CZ-CG1 3.47Å; F74-V370 VanDerWaalsContact CZ-CG1 3.47Å; F74-V370 HydrophobicContact CZ-CG2 4.24Å; F322-V370 HydrophobicContact CE2-CG1 4.47Å; K323-V370 VanDerWaalsContact CA-O 3.29Å; K323-V370 WeakPolarHBondContact CA-O 3.37Å; L324-V370 HydrophobicContact CB-CG1 3.95Å; L324-V370 PolarHBondContact N-O 3.36Å; L324-V370 PolarHBondContact O-N 2.83Å; V370-V372 HydrophobicContact CG2-CG2 3.89Å
371	D	89.7	Confident	75.6	Confident	49 Å²	49	40.5 Å²	40.5	26%	0.262	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	105.3	175	-173.9	-15.7	0	0	0	108.5	K323 F369 N373	K323-D371 HydrophobicContact CD-CB 4.4Å; K323-D371 VanDerWaalsContact CE-CG 3.46Å; K323-D371 WeakPolarHBondContact CE-OD1 3.23Å; K323-D371 WeakPolarHBondContact CE-OD2 3.44Å; K323-D371 HydrophobicContact CG-CB 4.25Å; K323-D371 IonicContact NZ-OD1 2.67Å; K323-D371 IonicContact NZ-OD2 3.66Å; K323-D371 PolarHBondContact NZ-OD2 2.91Å; F369-D371 HydrophobicContact CE1-CB 3.78Å; F369-D371 HydrophobicContact CZ-CB 4.16Å; D371-N373 PolarHBondContact OD1-ND2 3.36Å
372	V	91.4	Very high	72.5	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	110.3	-179.7	177.8	0	0	0	0	107.9	W216 M243 M273 L319 K321 F322 V370	W216-V372 HydrophobicContact CZ2-CG1 4.09Å; M243-V372 HydrophobicContact CE-CG1 4.1Å; M273-V372 HydrophobicContact CE-CG2 3.87Å; L319-V372 HydrophobicContact CD2-CG1 4.31Å; K321-V372 WeakPolarHBondContact CA-O 3.43Å; K321-V372 WeakPolarHBondContact CG-O 3.13Å; F322-V372 HydrophobicContact CD1-CB 4.15Å; F322-V372 HydrophobicContact CD1-CG1 4.28Å; F322-V372 HydrophobicContact CD2-CB 4.19Å; F322-V372 HydrophobicContact CD2-CG2 4.07Å; F322-V372 HydrophobicContact CE1-CB 3.95Å; F322-V372 HydrophobicContact CE1-CG1 3.88Å; F322-V372 HydrophobicContact CE1-CG2 4.03Å; F322-V372 HydrophobicContact CE2-CB 4.03Å; F322-V372 HydrophobicContact CE2-CG2 3.49Å; F322-V372 VanDerWaalsContact CE2-CG2 3.49Å; F322-V372 HydrophobicContact CG-CB 4.26Å; F322-V372 HydrophobicContact CZ-CB 3.91Å; F322-V372 HydrophobicContact CZ-CG1 4.16Å; F322-V372 HydrophobicContact CZ-CG2 3.47Å; F322-V372 VanDerWaalsContact CZ-CG2 3.47Å; F322-V372 PolarHBondContact N-O 2.83Å; F322-V372 VanDerWaalsContact N-O 3.08Å; F322-V372 PolarHBondContact O-N 3.11Å; V370-V372 HydrophobicContact CG2-CG2 3.89Å
373	N	91.9	Very high	69.4	Low	29 Å²	29	50.6 Å²	50.6	16%	0.155	32%	0.324	C	S	.	.			trans	-145.7	-166.5	-177	64.4	52.5	0	0	0	111.3	W216 K321 D371 E375	W216-N373 PolarHBondContact NE1-O 2.85Å; K321-N373 HydrophobicContact CD-CB 4.38Å; K321-N373 HydrophobicContact CG-CB 4.28Å; D371-N373 PolarHBondContact OD1-ND2 3.36Å; N373-E375 PolarHBondContact O-N 3.49Å; N373-E375 PolarHBondContact OD1-N 3.34Å; N373-E375 VanDerWaalsContact OD1-N 3.08Å
374	E	92.6	Very high	66.5	Low	25 Å²	25	55.7 Å²	55.7	12%	0.117	37%	0.366	C	S	.	.	S	Bend	trans	-78.1	-8	-171.4	-60.6	90.2	159.4	0	0	116.5	R219 F220 A222 T225 M243 K321	R219-E374 WeakPolarHBondContact CG-O 3.29Å; F220-E374 HydrophobicContact CB-CB 4.28Å; F220-E374 HydrophobicContact CB-CG 4.1Å; A222-E374 HydrophobicContact CB-CG 4.22Å; T225-E374 PolarHBondContact OG1-OE1 3.47Å; M243-E374 HydrophobicContact CG-CG 4.21Å; M243-E374 HydrophobicContact SD-CG 3.85Å; K321-E374 WeakPolarHBondContact CE-OE2 3.3Å; K321-E374 IonicContact NZ-OE1 2.75Å; K321-E374 PolarHBondContact NZ-OE1 2.99Å; K321-E374 IonicContact NZ-OE2 2.59Å; K321-E374 PolarHBondContact NZ-OE2 3.05Å
375	E	84.9	Confident	63.2	Low	95 Å²	95	58.4 Å²	58.4	44%	0.444	40%	0.395	S	S	.	.			trans	-77.7	165.7	-164.8	-67.7	-171.6	168.5	0	0	119.5	K213 W216 R219 N373	K213-E375 IonicContact NZ-OE2 2.78Å; W216-E375 PolarHBondContact N-O 2.95Å; R219-E375 VanDerWaalsContact NE-C 3.27Å; N373-E375 PolarHBondContact O-N 3.49Å; N373-E375 PolarHBondContact OD1-N 3.34Å; N373-E375 VanDerWaalsContact OD1-N 3.08Å
376	G	52.5	Low	60.2	Low	3 Å²	3	67.1 Å²	67.1	3%	0.031	44%	0.437	C	S	.	.	S	Bend	trans	117.5	99.4	-162.6	0	0	0	0	0	125	S215 R219	S215-G376 WeakPolarHBondContact OG-CA 3.27Å; S215-G376 PolarHBondContact OG-N 3.14Å; R219-G376 VanDerWaalsContact CD-C 3.44Å; R219-G376 WeakPolarHBondContact CD-O 3.48Å; R219-G376 WeakPolarHBondContact CG-O 3.4Å; R219-G376 VanDerWaalsContact CZ-CA 3.48Å; R219-G376 PolarHBondContact NE-O 3.17Å
377	T	28.3	Very low	57.2	Low	125 Å²	125	73 Å²	73	77%	0.767	47%	0.473	S	S	*	.			trans	-40.7	143.8	-154.1	-60	0	0	0	0	120.9	R219	R219-T377 VanDerWaalsContact NH1-CA 3.35Å
378	E	29.8	Very low	54.4	Low	172 Å²	172	77 Å²	77	80%	0.804	50%	0.502	S	S	*	.			trans	-44.1	129	-176.7	-147	-179.3	-158.6	0	0	115.8
379	A	27.5	Very low	51.8	Low	99 Å²	99	86.8 Å²	86.8	82%	0.818	55%	0.545	S	S	*	.			trans	-132.5	112.4	157.3	0	0	0	0	0	108.9
380	A	29	Very low	49.5	Very low	99 Å²	99	90.2 Å²	90.2	82%	0.818	57%	0.571	S	S	*	*			trans	-65.2	132.4	172.5	0	0	0	0	0	110.7
381	A	28.3	Very low	47.3	Very low	81 Å²	81	99.8 Å²	99.8	67%	0.669	62%	0.618	S	S	*	*			trans	-148.1	88.2	149.9	0	0	0	0	0	107.7	T383	A381-T383 PolarHBondContact O-N 2.71Å
382	A	31.5	Very low	45.5	Very low	104 Å²	104	103.6 Å²	103.6	86%	0.86	64%	0.638	S	S	*	*			trans	-64.2	111.2	154.6	0	0	0	0	0	107.4
383	T	32.9	Very low	44	Very low	128 Å²	128	112.7 Å²	112.7	79%	0.785	67%	0.672	S	S	*	*			trans	-119	79.6	157.6	-2.8	0	0	0	0	107.4	A381 G385	A381-T383 PolarHBondContact O-N 2.71Å; T383-G385 PolarHBondContact O-N 3.43Å
384	A	32.5	Very low	42.9	Very low	110 Å²	110	116.1 Å²	116.1	91%	0.909	69%	0.687	S	S	*	*			trans	-65.7	104.4	153	0	0	0	0	0	106.7
385	G	28.8	Very low	42.8	Very low	60 Å²	60	116.9 Å²	116.9	62%	0.619	69%	0.691	S	S	*	*			trans	-147.4	108.3	178.6	0	0	0	0	0	109.3	T383 V387	T383-G385 PolarHBondContact O-N 3.43Å; G385-V387 PolarHBondContact O-N 2.95Å
386	M	32.8	Very low	43.3	Very low	187 Å²	187	117.2 Å²	117.2	92%	0.921	69%	0.692	S	S	*	*			trans	-16.5	118	173	-69.2	159.8	49.8	0	0	115.5	S388	M386-S388 PolarHBondContact O-N 3.07Å
387	V	33.6	Very low	45.4	Very low	126 Å²	126	117 Å²	117	76%	0.764	69%	0.69	S	S	*	*			trans	-69.9	99.2	169.3	-176.5	0	0	0	0	108.7	G385	G385-V387 PolarHBondContact O-N 2.95Å
388	S	36.8	Very low	48.8	Very low	97 Å²	97	115.6 Å²	115.6	68%	0.678	67%	0.671	S	S	*	*			trans	-67.6	125.7	147.8	-88.3	0	0	0	0	107.1	M386 C390	M386-S388 PolarHBondContact O-N 3.07Å; S388-C390 PolarHBondContact O-N 3.25Å
389	F	37.4	Very low	52	Low	207 Å²	207	107.4 Å²	107.4	91%	0.908	63%	0.632	S	S	*	*			trans	-63.7	80	169.6	-83.5	-95.2	0	0	0	109.8
390	C	40	Very low	55.3	Low	95 Å²	95	103.2 Å²	103.2	64%	0.642	60%	0.597	S	S	*	*			trans	-98	138.3	155.4	-70.9	0	0	0	0	106.4	S388 L392	S388-C390 PolarHBondContact O-N 3.25Å; C390-L392 PolarHBondContact O-N 3.33Å
391	M	40.7	Very low	58.5	Low	203 Å²	203	99.3 Å²	99.3	100%	1	56%	0.561	S	S	*	*			trans	-64	79.4	171.6	-62.6	176.6	-166.6	0	0	108.7	R393	M391-R393 PolarHBondContact O-N 2.77Å
392	L	52.7	Low	61.7	Low	130 Å²	130	96.6 Å²	96.6	68%	0.681	54%	0.537	S	S	*	.			trans	-69.2	119.4	167.6	-84.9	158.1	0	0	0	106	C390 E394	C390-L392 PolarHBondContact O-N 3.33Å; L392-E394 PolarHBondContact O-N 2.89Å
393	R	59	Low	64.9	Low	192 Å²	192	91.7 Å²	91.7	73%	0.725	50%	0.496	S	S	*	.			trans	-70.6	98.8	173.1	-178.6	175.8	172	176.3	-3.2	106.9	T313 M391 E395	T313-R393 WeakPolarHBondContact CG2-O 3.46Å; M391-R393 PolarHBondContact O-N 2.77Å; R393-E395 IonicContact CZ-OE1 3.24Å; R393-E395 VanDerWaalsContact CZ-OE1 3.24Å; R393-E395 IonicContact NE-OE1 2.77Å; R393-E395 PolarHBondContact NE-OE1 2.93Å; R393-E395 IonicContact NH2-OE1 2.87Å; R393-E395 PolarHBondContact NH2-OE1 3.03Å
394	E	70.1	Confident	68	Low	101 Å²	101	85.7 Å²	85.7	47%	0.472	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-83.6	125.2	172.9	-66.6	176.7	-178.3	0	0	108.7	I316 L392	I316-E394 HydrophobicContact CD1-CB 4.24Å; I316-E394 WeakPolarHBondContact CD1-OE2 3.1Å; L392-E394 PolarHBondContact O-N 2.89Å
395	E	89.6	Confident	71.1	Confident	40 Å²	40	80.4 Å²	80.4	19%	0.187	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.3	174.2	-67.9	-70.1	170.4	0	0	109	T313 I315 I316 R393	T313-E395 HydrophobicContact CG2-CB 4.19Å; T313-E395 HydrophobicContact CG2-CG 3.82Å; I315-E395 WeakPolarHBondContact CA-O 3.41Å; I315-E395 HydrophobicContact CD1-CB 3.68Å; I315-E395 HydrophobicContact CD1-CG 4.43Å; I316-E395 PolarHBondContact N-O 3.39Å; R393-E395 IonicContact CZ-OE1 3.24Å; R393-E395 VanDerWaalsContact CZ-OE1 3.24Å; R393-E395 IonicContact NE-OE1 2.77Å; R393-E395 PolarHBondContact NE-OE1 2.93Å; R393-E395 IonicContact NH2-OE1 2.87Å; R393-E395 PolarHBondContact NH2-OE1 3.03Å
396	H	94.9	Very high	74.4	Confident	102 Å²	102	77.6 Å²	77.6	47%	0.472	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.3	-178.7	-73.2	-100.3	0	0	0	110.3	Q260	Q260-H396 PolarHBondContact NE2-O 3Å
397	F	97.7	Very high	77.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	104.7	168.4	-172	-86.3	0	0	0	108.9	F251 Q260 L262 I275 L277 I315 I316 V317 H318 A399	F251-F397 HydrophobicContact CD2-CD2 4.36Å; F251-F397 HydrophobicContact CE2-CD2 4.09Å; Q260-F397 HydrophobicContact CB-CD2 3.87Å; Q260-F397 HydrophobicContact CB-CE2 3.79Å; L262-F397 HydrophobicContact CB-CD1 4.15Å; L262-F397 HydrophobicContact CB-CD2 3.77Å; L262-F397 HydrophobicContact CB-CE1 4Å; L262-F397 HydrophobicContact CB-CE2 3.61Å; L262-F397 HydrophobicContact CB-CG 4.03Å; L262-F397 HydrophobicContact CB-CZ 3.74Å; L262-F397 HydrophobicContact CD2-CB 4.38Å; L262-F397 HydrophobicContact CD2-CD1 3.56Å; L262-F397 HydrophobicContact CD2-CD2 4.48Å; L262-F397 HydrophobicContact CD2-CE1 3.89Å; L262-F397 HydrophobicContact CD2-CG 3.88Å; L262-F397 HydrophobicContact CD2-CZ 4.48Å; L262-F397 HydrophobicContact CG-CD1 4.47Å; L262-F397 HydrophobicContact CG-CG 4.46Å; I275-F397 HydrophobicContact CB-CE1 4.11Å; I275-F397 HydrophobicContact CB-CZ 3.72Å; I275-F397 HydrophobicContact CD1-CE1 4.22Å; I275-F397 HydrophobicContact CG2-CE1 3.93Å; I275-F397 HydrophobicContact CG2-CZ 3.58Å; L277-F397 HydrophobicContact CB-CE2 3.8Å; L277-F397 HydrophobicContact CB-CZ 3.68Å; L277-F397 HydrophobicContact CD2-CD2 4.43Å; L277-F397 HydrophobicContact CD2-CE1 4.28Å; L277-F397 HydrophobicContact CD2-CE2 4.12Å; L277-F397 HydrophobicContact CD2-CZ 4.03Å; L277-F397 HydrophobicContact CG-CZ 4.5Å; I315-F397 HydrophobicContact CG2-CB 3.82Å; I316-F397 PolarHBondContact O-N 2.97Å; V317-F397 CarbonylContact C-O 3.57Å; V317-F397 WeakPolarHBondContact CA-O 3.37Å; V317-F397 HydrophobicContact CG1-CD1 4.44Å; H318-F397 PolarHBondContact N-O 2.82Å; F397-A399 HydrophobicContact CE1-CB 4.04Å
398	R	98	Very high	80.3	Confident	94 Å²	94	63.8 Å²	63.8	36%	0.355	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	94.6	-175	-179.8	173.5	170.8	175.2	-3.3	111	L277 H318 D400	L277-R398 VanDerWaalsContact CD2-O 3.32Å; L277-R398 WeakPolarHBondContact CD2-O 3.31Å; H318-R398 HydrophobicContact CB-CB 4.31Å; H318-R398 HydrophobicContact CB-CG 4.01Å; R398-D400 HydrophobicContact CG-CB 3.9Å; R398-D400 IonicContact CZ-OD2 2.73Å; R398-D400 IonicContact NE-OD2 2.71Å; R398-D400 PolarHBondContact NE-OD2 2.84Å; R398-D400 IonicContact NH2-OD2 3.14Å; R398-D400 PolarHBondContact NH2-OD2 2.88Å; R398-D400 PolarHBondContact O-N 2.93Å
399	A	98	Very high	82.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.28	C	S	.	.			trans	-78.2	60.6	179.3	0	0	0	0	0	111.9	L277 H318 L319 P320 F397 F403	L277-A399 HydrophobicContact CD1-CB 4.32Å; L277-A399 HydrophobicContact CD2-CB 4.45Å; H318-A399 PolarHBondContact O-N 2.5Å; L319-A399 HydrophobicContact CD1-CB 4.31Å; P320-A399 WeakPolarHBondContact CD-O 3.37Å; F397-A399 HydrophobicContact CE1-CB 4.04Å; A399-F403 HydrophobicContact CB-CD1 3.82Å; A399-F403 HydrophobicContact CB-CE1 3.84Å
400	D	97.1	Very high	85.5	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.064	25%	0.246	C	C	.	.			trans	-102.1	20.8	-178.1	76.3	-16.1	0	0	0	114.1	F230 K231 M242 R398	F230-D400 CarbonylContact C-O 3.6Å; F230-D400 VanDerWaalsContact CA-O 3.28Å; F230-D400 WeakPolarHBondContact CA-O 3.49Å; F230-D400 VanDerWaalsContact CD2-C 3.43Å; K231-D400 PolarHBondContact N-O 3.24Å; M242-D400 HydrophobicContact CE-CB 3.93Å; R398-D400 HydrophobicContact CG-CB 3.9Å; R398-D400 IonicContact CZ-OD2 2.73Å; R398-D400 IonicContact NE-OD2 2.71Å; R398-D400 PolarHBondContact NE-OD2 2.84Å; R398-D400 IonicContact NH2-OD2 3.14Å; R398-D400 PolarHBondContact NH2-OD2 2.88Å; R398-D400 PolarHBondContact O-N 2.93Å
401	H	96.1	Very high	87.8	Confident	17 Å²	17	54 Å²	54	8%	0.079	25%	0.246	C	C	.	.	S	Bend	trans	-157.3	168.9	178.1	54.5	-82.7	0	0	0	109.2	F230 K231 L277 P278 L280 F403	F230-H401 VanDerWaalsContact CE2-N 3.34Å; F230-H401 WeakPolarHBondContact CE2-O 3.46Å; F230-H401 WeakPolarHBondContact CZ-O 3.36Å; K231-H401 HydrophobicContact CB-CB 4.23Å; L277-H401 WeakPolarHBondContact CD1-NE2 3.3Å; P278-H401 PolarHBondContact O-NE2 3.18Å; L280-H401 HydrophobicContact CD2-CB 3.59Å; L280-H401 HydrophobicContact CG-CB 4.35Å; H401-F403 VanDerWaalsContact O-CD1 3.3Å; H401-F403 WeakPolarHBondContact O-CD1 3.45Å; H401-F403 PolarHBondContact O-N 2.77Å
402	P	96.1	Very high	89.9	Confident	24 Å²	24	45.5 Å²	45.5	16%	0.156	21%	0.206	C	C	.	.			trans	-51	132.6	-173.4	-32.8	35.6	0	0	0	114.9	F230 K231 L288 F421	F230-P402 HydrophobicContact CE1-CG 4.44Å; K231-P402 WeakPolarHBondContact O-CD 3.29Å; L288-P402 HydrophobicContact CD2-CB 3.67Å; P402-F421 VanDerWaalsContact CA-O 3.23Å; P402-F421 WeakPolarHBondContact CA-O 3.32Å
403	F	97.4	Very high	91.6	Very high	1 Å²	1	43 Å²	43	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.2	-179.3	58.9	-99.2	0	0	0	111.8	F230 I275 L276 L277 L319 P320 F322 A399 H401 F405 R420 F421	F230-F403 HydrophobicContact CE2-CE1 4.23Å; I275-F403 HydrophobicContact CG2-CB 4.2Å; I275-F403 HydrophobicContact CG2-CD2 3.64Å; I275-F403 HydrophobicContact CG2-CE2 4.18Å; I275-F403 HydrophobicContact CG2-CG 3.96Å; L276-F403 WeakPolarHBondContact O-CB 3.05Å; L277-F403 HydrophobicContact CD1-CB 3.82Å; L277-F403 HydrophobicContact CD1-CD1 4.47Å; L319-F403 HydrophobicContact CD1-CZ 4.26Å; P320-F403 HydrophobicContact CG-CE1 3.79Å; P320-F403 HydrophobicContact CG-CZ 4.02Å; F322-F403 HydrophobicContact CE1-CE2 4.38Å; F322-F403 AromaticContact CE1-CZ 3.92Å; F322-F403 HydrophobicContact CE1-CZ 3.92Å; F322-F403 HydrophobicContact CZ-CZ 4.47Å; A399-F403 HydrophobicContact CB-CD1 3.82Å; A399-F403 HydrophobicContact CB-CE1 3.84Å; H401-F403 VanDerWaalsContact O-CD1 3.3Å; H401-F403 WeakPolarHBondContact O-CD1 3.45Å; H401-F403 PolarHBondContact O-N 2.77Å; F403-F405 HydrophobicContact CD2-CB 4.28Å; F403-F405 HydrophobicContact CD2-CD1 4.19Å; F403-F405 HydrophobicContact CE2-CB 4.26Å; F403-F405 AromaticContact CE2-CD1 3.86Å; F403-F405 HydrophobicContact CE2-CD1 3.86Å; F403-F405 HydrophobicContact CE2-CG 4.35Å; F403-R420 WeakPolarHBondContact O-CA 3.49Å; F403-F421 HydrophobicContact CD1-CB 4.47Å; F403-F421 HydrophobicContact CD1-CD1 4.33Å; F403-F421 HydrophobicContact CD2-CB 4.14Å; F403-F421 HydrophobicContact CE1-CB 3.99Å; F403-F421 AromaticContact CE1-CD1 3.51Å; F403-F421 HydrophobicContact CE1-CD1 3.51Å; F403-F421 HydrophobicContact CE1-CE1 4.37Å; F403-F421 HydrophobicContact CE1-CG 4.08Å; F403-F421 HydrophobicContact CE2-CB 3.63Å; F403-F421 HydrophobicContact CE2-CG 4.37Å; F403-F421 HydrophobicContact CZ-CB 3.53Å; F403-F421 AromaticContact CZ-CD1 3.66Å; F403-F421 HydrophobicContact CZ-CD1 3.66Å; F403-F421 AromaticContact CZ-CG 3.78Å; F403-F421 HydrophobicContact CZ-CG 3.78Å; F403-F421 PolarHBondContact N-O 3.04Å; F403-F421 PolarHBondContact O-N 2.71Å
404	L	98.1	Very high	93.1	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	150.4	166.2	-57.3	-177.6	0	0	0	109.4	F61 L276 L288 L291 E292 L295 G419 R420	F61-L404 HydrophobicContact CE1-CD2 4.25Å; F61-L404 HydrophobicContact CE2-CD2 4.48Å; F61-L404 HydrophobicContact CZ-CD2 3.64Å; L276-L404 HydrophobicContact CB-CB 4.17Å; L276-L404 PolarHBondContact N-O 3.43Å; L276-L404 PolarHBondContact O-N 3.39Å; L288-L404 HydrophobicContact CD1-CD2 3.93Å; L288-L404 HydrophobicContact CD1-CG 3.74Å; L288-L404 HydrophobicContact CG-CD2 4.38Å; L291-L404 HydrophobicContact CD2-CD1 3.81Å; L291-L404 HydrophobicContact CD2-CG 4.22Å; L291-L404 HydrophobicContact CG-CD1 4.01Å; E292-L404 HydrophobicContact CG-CD1 4Å; E292-L404 HydrophobicContact CG-CD2 4.17Å; L295-L404 HydrophobicContact CD1-CD1 3.49Å; L295-L404 VanDerWaalsContact CD1-CD1 3.49Å; L404-G419 WeakPolarHBondContact CA-O 3.33Å; L404-R420 HydrophobicContact CD2-CB 3.74Å; L404-R420 HydrophobicContact CD2-CG 3.98Å
405	F	97.9	Very high	94.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	156	171.7	70.7	-81.1	0	0	0	110.7	F74 M273 F274 I275 F322 L324 F403 G419 F421	F74-F405 AromaticContact CD2-CE2 3.91Å; F74-F405 HydrophobicContact CD2-CE2 3.91Å; F74-F405 AromaticContact CD2-CZ 3.61Å; F74-F405 HydrophobicContact CD2-CZ 3.61Å; F74-F405 AromaticContact CE2-CE2 3.74Å; F74-F405 HydrophobicContact CE2-CE2 3.74Å; F74-F405 AromaticContact CE2-CZ 3.94Å; F74-F405 HydrophobicContact CE2-CZ 3.94Å; M273-F405 HydrophobicContact CE-CD2 4.06Å; M273-F405 HydrophobicContact CE-CE2 4.39Å; M273-F405 HydrophobicContact SD-CD2 4.38Å; F274-F405 CarbonylContact O-C 3.59Å; F274-F405 WeakPolarHBondContact O-CA 3.35Å; F274-F405 WeakPolarHBondContact O-CB 3.44Å; I275-F405 HydrophobicContact CG1-CB 4.39Å; F322-F405 HydrophobicContact CE2-CE1 4.33Å; F322-F405 HydrophobicContact CE2-CZ 4.06Å; F322-F405 HydrophobicContact CZ-CE1 4.3Å; F322-F405 HydrophobicContact CZ-CZ 4.26Å; L324-F405 HydrophobicContact CD1-CE1 4Å; L324-F405 HydrophobicContact CD1-CZ 3.86Å; F403-F405 HydrophobicContact CD2-CB 4.28Å; F403-F405 HydrophobicContact CD2-CD1 4.19Å; F403-F405 HydrophobicContact CE2-CB 4.26Å; F403-F405 AromaticContact CE2-CD1 3.86Å; F403-F405 HydrophobicContact CE2-CD1 3.86Å; F403-F405 HydrophobicContact CE2-CG 4.35Å; F405-G419 PolarHBondContact N-O 3.11Å; F405-G419 PolarHBondContact O-N 2.93Å; F405-F421 HydrophobicContact CE1-CB 4.39Å
406	F	97.8	Very high	94.4	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	153.4	173.4	67.7	-90.9	0	0	0	111.2	M273 F274 L276 L300 T304 R408 I415 F417 F418	M273-F406 CarbonylContact C-O 3.42Å; M273-F406 WeakPolarHBondContact CA-O 3.44Å; F274-F406 HydrophobicContact CB-CD1 3.78Å; F274-F406 HydrophobicContact CB-CD2 4.24Å; F274-F406 HydrophobicContact CB-CE1 3.33Å; F274-F406 HydrophobicContact CB-CE2 3.86Å; F274-F406 HydrophobicContact CB-CG 4.21Å; F274-F406 HydrophobicContact CB-CZ 3.4Å; F274-F406 VanDerWaalsContact CB-CZ 3.4Å; F274-F406 HydrophobicContact CD1-CZ 4.26Å; F274-F406 AromaticContact CD2-CD2 3.97Å; F274-F406 HydrophobicContact CD2-CD2 3.97Å; F274-F406 HydrophobicContact CD2-CE1 4.36Å; F274-F406 AromaticContact CD2-CE2 3.3Å; F274-F406 HydrophobicContact CD2-CE2 3.3Å; F274-F406 AromaticContact CD2-CZ 3.55Å; F274-F406 HydrophobicContact CD2-CZ 3.55Å; F274-F406 HydrophobicContact CE2-CE2 4.1Å; F274-F406 HydrophobicContact CE2-CZ 4.45Å; F274-F406 HydrophobicContact CG-CD2 4.46Å; F274-F406 AromaticContact CG-CE1 3.95Å; F274-F406 HydrophobicContact CG-CE1 3.95Å; F274-F406 AromaticContact CG-CE2 3.73Å; F274-F406 HydrophobicContact CG-CE2 3.73Å; F274-F406 AromaticContact CG-CZ 3.45Å; F274-F406 HydrophobicContact CG-CZ 3.45Å; F274-F406 VanDerWaalsContact CG-CZ 3.45Å; F274-F406 PolarHBondContact N-O 2.82Å; F274-F406 PolarHBondContact O-N 2.95Å; L276-F406 HydrophobicContact CD1-CD1 4.09Å; L276-F406 HydrophobicContact CD1-CE1 3.64Å; L300-F406 HydrophobicContact CD1-CD1 4.22Å; L300-F406 HydrophobicContact CD1-CE1 3.44Å; L300-F406 VanDerWaalsContact CD1-CE1 3.44Å; L300-F406 HydrophobicContact CD1-CZ 3.86Å; L300-F406 HydrophobicContact CD2-CE1 4.27Å; L300-F406 HydrophobicContact CD2-CZ 4.24Å; L300-F406 HydrophobicContact CG-CE1 4.08Å; L300-F406 HydrophobicContact CG-CZ 4.03Å; T304-F406 HydrophobicContact CG2-CE1 4.19Å; T304-F406 HydrophobicContact CG2-CZ 3.79Å; F406-R408 HydrophobicContact CD2-CB 4.05Å; F406-R408 HydrophobicContact CE2-CB 3.91Å; F406-I415 HydrophobicContact CB-CG2 4.25Å; F406-I415 HydrophobicContact CD2-CG1 4.49Å; F406-F417 CarbonylContact C-O 3.59Å; F406-F417 WeakPolarHBondContact CA-O 3.24Å; F406-F417 WeakPolarHBondContact CB-O 3.43Å; F406-F418 HydrophobicContact CB-CD2 3.44Å; F406-F418 VanDerWaalsContact CB-CD2 3.44Å; F406-F418 HydrophobicContact CB-CE2 3.9Å; F406-F418 HydrophobicContact CB-CG 4.23Å; F406-F418 HydrophobicContact CD1-CD2 4.44Å; F406-F418 HydrophobicContact CD1-CE2 4.05Å; F406-F418 HydrophobicContact CG-CD2 4.15Å; F406-F418 HydrophobicContact CG-CE2 4.21Å
407	I	95.9	Very high	94.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.6	174.4	-59.6	171.3	0	0	0	107.3	F212 Y266 L271 S272 M273 L416 F417	F212-I407 HydrophobicContact CD1-CD1 3.73Å; F212-I407 HydrophobicContact CE1-CD1 3.67Å; F212-I407 HydrophobicContact CZ-CD1 4.48Å; Y266-I407 HydrophobicContact CE2-CG2 4.13Å; L271-I407 HydrophobicContact CB-CG2 4.38Å; L271-I407 HydrophobicContact CD1-CG2 4.35Å; S272-I407 WeakPolarHBondContact O-CA 3.3Å; M273-I407 HydrophobicContact CB-CG1 4.34Å; M273-I407 HydrophobicContact CE-CD1 3.99Å; M273-I407 HydrophobicContact CE-CG1 4.01Å; M273-I407 HydrophobicContact CG-CG1 4.44Å; I407-L416 WeakPolarHBondContact O-CB 3.36Å; I407-L416 PolarHBondContact O-N 2.8Å; I407-F417 HydrophobicContact CB-CB 4.19Å; I407-F417 HydrophobicContact CB-CD2 4.1Å; I407-F417 HydrophobicContact CD1-CB 4.38Å; I407-F417 HydrophobicContact CD1-CD2 4.08Å; I407-F417 HydrophobicContact CD1-CG 4.48Å; I407-F417 HydrophobicContact CG1-CB 4.44Å; I407-F417 HydrophobicContact CG2-CD2 4.5Å; I407-F417 PolarHBondContact N-O 2.93Å; I407-F417 PolarHBondContact O-N 2.55Å
408	R	94.4	Very high	94.4	Very high	23 Å²	23	22.6 Å²	22.6	9%	0.087	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	139.5	-176.5	-178.4	170	69.9	-171	-0.9	110.4	L271 S272 F274 T304 F406 K413 S414	L271-R408 VanDerWaalsContact CA-O 3.26Å; L271-R408 WeakPolarHBondContact CA-O 3.48Å; S272-R408 PolarHBondContact N-O 2.86Å; S272-R408 PolarHBondContact O-N 3.08Å; F274-R408 HydrophobicContact CD2-CB 4.31Å; F274-R408 HydrophobicContact CE2-CB 4.09Å; T304-R408 PolarHBondContact O-NH2 3.22Å; T304-R408 PolarHBondContact OG1-NH1 3.47Å; F406-R408 HydrophobicContact CD2-CB 4.05Å; F406-R408 HydrophobicContact CE2-CB 3.91Å; R408-K413 WeakPolarHBondContact CD-O 3.35Å; R408-S414 WeakPolarHBondContact CA-O 3.46Å
409	H	91.8	Very high	94.3	Very high	8 Å²	8	18.1 Å²	18.1	4%	0.037	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	113.3	163.7	178.8	-126.2	0	0	0	109.3	E270 L271 K411 T412 K413 S414 L416	E270-H409 PolarHBondContact O-CD2 2.86Å; E270-H409 VanDerWaalsContact O-CD2 3.32Å; L271-H409 VanDerWaalsContact CD2-CA 3.5Å; L271-H409 HydrophobicContact CD2-CB 3.72Å; H409-K411 PolarHBondContact O-N 3.26Å; H409-T412 WeakPolarHBondContact ND1-CG2 3.33Å; H409-T412 PolarHBondContact ND1-OG1 2.92Å; H409-T412 PolarHBondContact O-N 2.79Å; H409-K413 WeakPolarHBondContact O-CA 3.39Å; H409-K413 PolarHBondContact O-N 2.77Å; H409-S414 PolarHBondContact N-O 3.03Å; H409-S414 PolarHBondContact O-N 3.14Å; H409-L416 HydrophobicContact CB-CD1 4.32Å; H409-L416 HydrophobicContact CB-CD2 4.27Å; H409-L416 HydrophobicContact CB-CG 4.26Å
410	N	91.4	Very high	94.3	Very high	38 Å²	38	18.3 Å²	18.3	20%	0.203	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-36.8	-165.3	-70.8	-28	0	0	0	112.5	Q269 E270 S272	Q269-N410 PolarHBondContact O-ND2 3.36Å; E270-N410 PolarHBondContact O-N 3.31Å; S272-N410 PolarHBondContact OG-ND2 3.15Å
411	K	88.3	Confident	94.3	Very high	148 Å²	148	17.9 Å²	17.9	64%	0.643	8%	0.084	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-45.7	178.3	-178.8	-170.5	176.3	-156.5	0	112.4	D121 H409	D121-K411 IonicContact OD1-NZ 3.83Å; D121-K411 PolarHBondContact OD1-NZ 2.82Å; D121-K411 IonicContact OD2-NZ 3.36Å; D121-K411 PolarHBondContact OD2-NZ 2.64Å; H409-K411 PolarHBondContact O-N 3.26Å
412	T	85.6	Confident	94.2	Very high	24 Å²	24	17.5 Å²	17.5	15%	0.147	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-2.2	-177.1	66.1	0	0	0	0	112.9	V50 L118 H409 S414	V50-T412 WeakPolarHBondContact CG2-O 3.38Å; L118-T412 HydrophobicContact CD1-CG2 3.79Å; H409-T412 WeakPolarHBondContact ND1-CG2 3.33Å; H409-T412 PolarHBondContact ND1-OG1 2.92Å; H409-T412 PolarHBondContact O-N 2.79Å; T412-S414 WeakPolarHBondContact CB-OG 3.15Å; T412-S414 PolarHBondContact O-N 3.32Å; T412-S414 PolarHBondContact O-OG 2.83Å; T412-S414 WeakPolarHBondContact OG1-CB 3.4Å; T412-S414 PolarHBondContact OG1-N 3.35Å; T412-S414 PolarHBondContact OG1-OG 3.04Å
413	K	89.4	Confident	94	Very high	77 Å²	77	17.2 Å²	17.2	34%	0.335	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	13.6	-171	-67	-175	170.5	-162.9	0	115.1	V50 D301 R408 H409	V50-K413 HydrophobicContact CG1-CB 3.43Å; V50-K413 VanDerWaalsContact CG1-CB 3.43Å; V50-K413 HydrophobicContact CG1-CD 4.39Å; V50-K413 HydrophobicContact CG2-CB 4.35Å; D301-K413 VanDerWaalsContact CG-NZ 3.35Å; D301-K413 WeakPolarHBondContact OD1-CD 3.24Å; D301-K413 WeakPolarHBondContact OD1-CE 3.23Å; D301-K413 IonicContact OD1-NZ 2.68Å; D301-K413 PolarHBondContact OD1-NZ 3.41Å; D301-K413 IonicContact OD2-NZ 3.56Å; D301-K413 PolarHBondContact OD2-NZ 2.86Å; D301-K413 VanDerWaalsContact OD2-NZ 3.14Å; R408-K413 WeakPolarHBondContact CD-O 3.35Å; H409-K413 WeakPolarHBondContact O-CA 3.39Å; H409-K413 PolarHBondContact O-N 2.77Å
414	S	89.3	Confident	93.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.1	-177.5	-48.5	0	0	0	0	111.3	R408 H409 T412 L416	R408-S414 WeakPolarHBondContact CA-O 3.46Å; H409-S414 PolarHBondContact N-O 3.03Å; H409-S414 PolarHBondContact O-N 3.14Å; T412-S414 WeakPolarHBondContact CB-OG 3.15Å; T412-S414 PolarHBondContact O-N 3.32Å; T412-S414 PolarHBondContact O-OG 2.83Å; T412-S414 WeakPolarHBondContact OG1-CB 3.4Å; T412-S414 PolarHBondContact OG1-N 3.35Å; T412-S414 PolarHBondContact OG1-OG 3.04Å; S414-L416 PolarHBondContact O-N 3.13Å
415	I	94.2	Very high	93.3	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.015	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	103	174.9	-58.9	177.9	0	0	0	108.3	N53 A54 A57 L78 L300 F406 F417 F418	N53-I415 PolarHBondContact OD1-N 3.05Å; N53-I415 PolarHBondContact OD1-O 3.1Å; A54-I415 HydrophobicContact CB-CD1 4.07Å; A57-I415 HydrophobicContact CB-CB 4.48Å; A57-I415 HydrophobicContact CB-CD1 4.08Å; A57-I415 HydrophobicContact CB-CG2 4.43Å; L78-I415 WeakPolarHBondContact CB-O 3.35Å; L300-I415 HydrophobicContact CD2-CD1 3.58Å; F406-I415 HydrophobicContact CB-CG2 4.25Å; F406-I415 HydrophobicContact CD2-CG1 4.49Å; I415-F417 WeakPolarHBondContact CG2-O 3.47Å; I415-F418 HydrophobicContact CD1-CD2 4.36Å; I415-F418 HydrophobicContact CG2-CB 4.06Å; I415-F418 HydrophobicContact CG2-CD2 3.93Å; I415-F418 HydrophobicContact CG2-CG 4.49Å
416	L	92.8	Very high	93.1	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-44.9	176.6	-59.9	-172	0	0	0	110.9	S76 L78 I122 L271 I407 H409 S414	S76-L416 VanDerWaalsContact CA-O 3.24Å; S76-L416 WeakPolarHBondContact CA-O 3.46Å; S76-L416 VanDerWaalsContact CB-O 3.26Å; S76-L416 WeakPolarHBondContact CB-O 3.19Å; S76-L416 PolarHBondContact OG-O 3.29Å; L78-L416 HydrophobicContact CD2-CD2 3.41Å; L78-L416 VanDerWaalsContact CD2-CD2 3.41Å; I122-L416 HydrophobicContact CD1-CD2 3.71Å; I122-L416 HydrophobicContact CG1-CD2 4.45Å; I122-L416 HydrophobicContact CG2-CD2 4.28Å; L271-L416 HydrophobicContact CD1-CD1 4.05Å; L271-L416 HydrophobicContact CD2-CD1 3.47Å; L271-L416 VanDerWaalsContact CD2-CD1 3.47Å; L271-L416 HydrophobicContact CG-CD1 4.42Å; I407-L416 WeakPolarHBondContact O-CB 3.36Å; I407-L416 PolarHBondContact O-N 2.8Å; H409-L416 HydrophobicContact CB-CD1 4.32Å; H409-L416 HydrophobicContact CB-CD2 4.27Å; H409-L416 HydrophobicContact CB-CG 4.26Å; S414-L416 PolarHBondContact O-N 3.13Å
417	F	95.4	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.8	-178.9	-62.3	-87.1	0	0	0	110.1	F74 V75 L131 I210 F212 F406 I407 I415	F74-F417 AromaticContact CE1-CD1 3.69Å; F74-F417 HydrophobicContact CE1-CD1 3.69Å; F74-F417 HydrophobicContact CE1-CE1 4.04Å; F74-F417 HydrophobicContact CE2-CB 3.65Å; F74-F417 AromaticContact CE2-CD1 3.91Å; F74-F417 HydrophobicContact CE2-CD1 3.91Å; F74-F417 HydrophobicContact CE2-CG 4.05Å; F74-F417 HydrophobicContact CZ-CB 3.77Å; F74-F417 AromaticContact CZ-CD1 3.17Å; F74-F417 HydrophobicContact CZ-CD1 3.17Å; F74-F417 AromaticContact CZ-CE1 3.84Å; F74-F417 HydrophobicContact CZ-CE1 3.84Å; F74-F417 AromaticContact CZ-CG 3.61Å; F74-F417 HydrophobicContact CZ-CG 3.61Å; V75-F417 WeakPolarHBondContact O-CA 3.29Å; L131-F417 HydrophobicContact CD1-CE2 3.79Å; L131-F417 HydrophobicContact CD1-CZ 3.88Å; I210-F417 HydrophobicContact CD1-CE1 4.19Å; I210-F417 HydrophobicContact CD1-CE2 4.49Å; I210-F417 HydrophobicContact CD1-CZ 3.74Å; I210-F417 HydrophobicContact CG1-CE1 4.19Å; I210-F417 HydrophobicContact CG1-CZ 3.81Å; I210-F417 HydrophobicContact CG2-CE1 3.91Å; I210-F417 HydrophobicContact CG2-CZ 4.41Å; F212-F417 HydrophobicContact CB-CD2 4.4Å; F212-F417 HydrophobicContact CB-CE1 4.45Å; F212-F417 HydrophobicContact CB-CE2 3.44Å; F212-F417 VanDerWaalsContact CB-CE2 3.44Å; F212-F417 HydrophobicContact CB-CZ 3.46Å; F212-F417 VanDerWaalsContact CB-CZ 3.46Å; F212-F417 HydrophobicContact CD2-CE2 4.35Å; F212-F417 AromaticContact CG-CE2 3.89Å; F212-F417 HydrophobicContact CG-CE2 3.89Å; F212-F417 HydrophobicContact CG-CZ 4.4Å; F406-F417 CarbonylContact C-O 3.59Å; F406-F417 WeakPolarHBondContact CA-O 3.24Å; F406-F417 WeakPolarHBondContact CB-O 3.43Å; I407-F417 HydrophobicContact CB-CB 4.19Å; I407-F417 HydrophobicContact CB-CD2 4.1Å; I407-F417 HydrophobicContact CD1-CB 4.38Å; I407-F417 HydrophobicContact CD1-CD2 4.08Å; I407-F417 HydrophobicContact CD1-CG 4.48Å; I407-F417 HydrophobicContact CG1-CB 4.44Å; I407-F417 HydrophobicContact CG2-CD2 4.5Å; I407-F417 PolarHBondContact N-O 2.93Å; I407-F417 PolarHBondContact O-N 2.55Å; I415-F417 WeakPolarHBondContact CG2-O 3.47Å
418	F	97.4	Very high	92.6	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	137.8	175	-156.6	-88.2	0	0	0	108.7	L58 F61 V75 P77 L295 L300 F406 I415	L58-F418 HydrophobicContact CD2-CE1 4.47Å; L58-F418 HydrophobicContact CD2-CE2 4.12Å; L58-F418 HydrophobicContact CD2-CZ 3.86Å; F61-F418 HydrophobicContact CB-CD1 4.03Å; F61-F418 HydrophobicContact CB-CE1 4.28Å; F61-F418 HydrophobicContact CD1-CD1 4.27Å; F61-F418 AromaticContact CD1-CE1 3.82Å; F61-F418 HydrophobicContact CD1-CE1 3.82Å; F61-F418 AromaticContact CD2-CD1 3.39Å; F61-F418 HydrophobicContact CD2-CD1 3.39Å; F61-F418 AromaticContact CD2-CE1 3.73Å; F61-F418 HydrophobicContact CD2-CE1 3.73Å; F61-F418 HydrophobicContact CE1-CE1 4.08Å; F61-F418 AromaticContact CE2-CD1 3.86Å; F61-F418 HydrophobicContact CE2-CD1 3.86Å; F61-F418 AromaticContact CE2-CE1 3.95Å; F61-F418 HydrophobicContact CE2-CE1 3.95Å; F61-F418 AromaticContact CG-CD1 3.6Å; F61-F418 HydrophobicContact CG-CD1 3.6Å; F61-F418 AromaticContact CG-CE1 3.64Å; F61-F418 HydrophobicContact CG-CE1 3.64Å; F61-F418 HydrophobicContact CZ-CE1 4.14Å; V75-F418 HydrophobicContact CG1-CB 4.5Å; V75-F418 WeakPolarHBondContact CG1-O 3.2Å; V75-F418 PolarHBondContact N-O 3.28Å; V75-F418 PolarHBondContact O-N 3.48Å; P77-F418 HydrophobicContact CG-CB 4.12Å; L295-F418 HydrophobicContact CD1-CZ 4.24Å; L300-F418 HydrophobicContact CD2-CE2 4.44Å; F406-F418 HydrophobicContact CB-CD2 3.44Å; F406-F418 VanDerWaalsContact CB-CD2 3.44Å; F406-F418 HydrophobicContact CB-CE2 3.9Å; F406-F418 HydrophobicContact CB-CG 4.23Å; F406-F418 HydrophobicContact CD1-CD2 4.44Å; F406-F418 HydrophobicContact CD1-CE2 4.05Å; F406-F418 HydrophobicContact CG-CD2 4.15Å; F406-F418 HydrophobicContact CG-CE2 4.21Å; I415-F418 HydrophobicContact CD1-CD2 4.36Å; I415-F418 HydrophobicContact CG2-CB 4.06Å; I415-F418 HydrophobicContact CG2-CD2 3.93Å; I415-F418 HydrophobicContact CG2-CG 4.49Å
419	G	96.4	Very high	92.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	165.7	-174.4	0	0	0	0	0	114.8	I73 L404 F405	I73-G419 CarbonylContact O-C 3.46Å; I73-G419 WeakPolarHBondContact O-CA 3.29Å; L404-G419 WeakPolarHBondContact CA-O 3.33Å; F405-G419 PolarHBondContact N-O 3.11Å; F405-G419 PolarHBondContact O-N 2.93Å
420	R	97.3	Very high	92.6	Very high	5 Å²	5	27.9 Å²	27.9	2%	0.019	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.3	171.2	175.6	174.2	65.2	-160.7	1.2	108.2	F61 S65 N68 P69 R71 N72 I73 L288 E292 F403 L404 S422	F61-R420 HydrophobicContact CE2-CB 4.15Å; F61-R420 HydrophobicContact CZ-CB 4.09Å; S65-R420 PolarHBondContact OG-NH1 3.14Å; N68-R420 PolarHBondContact O-NH2 3.33Å; P69-R420 PolarHBondContact O-NH1 3.13Å; P69-R420 PolarHBondContact O-NH2 2.96Å; R71-R420 PolarHBondContact O-NE 2.9Å; R71-R420 PolarHBondContact O-NH2 3.11Å; N72-R420 VanDerWaalsContact CA-O 3.29Å; N72-R420 WeakPolarHBondContact CA-O 3.31Å; I73-R420 HydrophobicContact CB-CB 4.26Å; I73-R420 VanDerWaalsContact CD1-NH2 3.31Å; I73-R420 PolarHBondContact N-O 3.18Å; I73-R420 PolarHBondContact O-N 3.39Å; L288-R420 VanDerWaalsContact CD2-CD 3.45Å; L288-R420 HydrophobicContact CD2-CG 3.9Å; E292-R420 VanDerWaalsContact OE1-CD 3.23Å; E292-R420 WeakPolarHBondContact OE1-CD 2.97Å; E292-R420 IonicContact OE1-CZ 3.8Å; E292-R420 IonicContact OE1-NE 4Å; E292-R420 IonicContact OE1-NH1 2.8Å; E292-R420 PolarHBondContact OE1-NH1 3.16Å; E292-R420 IonicContact OE2-NH1 2.77Å; E292-R420 PolarHBondContact OE2-NH1 3.03Å; F403-R420 WeakPolarHBondContact O-CA 3.49Å; L404-R420 HydrophobicContact CD2-CB 3.74Å; L404-R420 HydrophobicContact CD2-CG 3.98Å; R420-S422 VanDerWaalsContact CD-OG 3.29Å; R420-S422 WeakPolarHBondContact CD-OG 3.35Å; R420-S422 WeakPolarHBondContact CG-OG 3.1Å; R420-S422 PolarHBondContact NE-OG 3.35Å
421	F	96.6	Very high	92.6	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.009	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	100.7	169.4	-173.1	-101	0	0	0	108.5	F230 P320 F322 L324 P402 F403 F405 S423 P424	F230-F421 HydrophobicContact CD2-CE1 4.09Å; F230-F421 HydrophobicContact CE1-CD1 4.48Å; F230-F421 HydrophobicContact CE1-CE1 4.24Å; F230-F421 AromaticContact CE2-CD1 3.72Å; F230-F421 HydrophobicContact CE2-CD1 3.72Å; F230-F421 AromaticContact CE2-CE1 3.53Å; F230-F421 HydrophobicContact CE2-CE1 3.53Å; F230-F421 AromaticContact CZ-CD1 3.58Å; F230-F421 HydrophobicContact CZ-CD1 3.58Å; F230-F421 AromaticContact CZ-CE1 3.6Å; F230-F421 HydrophobicContact CZ-CE1 3.6Å; P320-F421 HydrophobicContact CB-CE1 4.27Å; P320-F421 HydrophobicContact CB-CZ 4.49Å; P320-F421 HydrophobicContact CG-CD1 4.29Å; P320-F421 HydrophobicContact CG-CE1 3.9Å; P320-F421 HydrophobicContact CG-CZ 4.5Å; F322-F421 HydrophobicContact CB-CD2 4.18Å; F322-F421 HydrophobicContact CB-CE2 3.46Å; F322-F421 VanDerWaalsContact CB-CE2 3.46Å; F322-F421 HydrophobicContact CB-CZ 3.94Å; F322-F421 HydrophobicContact CD1-CD2 4.17Å; F322-F421 HydrophobicContact CD1-CE2 4.11Å; F322-F421 HydrophobicContact CD1-CZ 4.41Å; F322-F421 HydrophobicContact CD2-CD2 4.06Å; F322-F421 HydrophobicContact CD2-CE2 4.2Å; F322-F421 HydrophobicContact CE2-CD2 4.46Å; F322-F421 AromaticContact CG-CD2 3.89Å; F322-F421 HydrophobicContact CG-CD2 3.89Å; F322-F421 AromaticContact CG-CE2 3.68Å; F322-F421 HydrophobicContact CG-CE2 3.68Å; F322-F421 HydrophobicContact CG-CZ 4.32Å; L324-F421 HydrophobicContact CD1-CD2 4.43Å; L324-F421 HydrophobicContact CD2-CD2 4.27Å; P402-F421 VanDerWaalsContact CA-O 3.23Å; P402-F421 WeakPolarHBondContact CA-O 3.32Å; F403-F421 HydrophobicContact CD1-CB 4.47Å; F403-F421 HydrophobicContact CD1-CD1 4.33Å; F403-F421 HydrophobicContact CD2-CB 4.14Å; F403-F421 HydrophobicContact CE1-CB 3.99Å; F403-F421 AromaticContact CE1-CD1 3.51Å; F403-F421 HydrophobicContact CE1-CD1 3.51Å; F403-F421 HydrophobicContact CE1-CE1 4.37Å; F403-F421 HydrophobicContact CE1-CG 4.08Å; F403-F421 HydrophobicContact CE2-CB 3.63Å; F403-F421 HydrophobicContact CE2-CG 4.37Å; F403-F421 HydrophobicContact CZ-CB 3.53Å; F403-F421 AromaticContact CZ-CD1 3.66Å; F403-F421 HydrophobicContact CZ-CD1 3.66Å; F403-F421 AromaticContact CZ-CG 3.78Å; F403-F421 HydrophobicContact CZ-CG 3.78Å; F403-F421 PolarHBondContact N-O 3.04Å; F403-F421 PolarHBondContact O-N 2.71Å; F405-F421 HydrophobicContact CE1-CB 4.39Å; F421-S423 WeakPolarHBondContact CE2-O 3.36Å; F421-P424 VanDerWaalsContact CZ-CA 3.5Å; F421-P424 HydrophobicContact CZ-CB 3.99Å
422	S	94.5	Very high	93	Very high	9 Å²	9	17.8 Å²	17.8	6%	0.063	10%	0.102	C	C	.	.			trans	-95.2	-32.8	179.8	-61.7	0	0	0	0	112.6	R71 N72 F230 R420	R71-S422 PolarHBondContact O-OG 3.42Å; N72-S422 PolarHBondContact OD1-N 2.9Å; F230-S422 WeakPolarHBondContact CE1-O 3.16Å; R420-S422 VanDerWaalsContact CD-OG 3.29Å; R420-S422 WeakPolarHBondContact CD-OG 3.35Å; R420-S422 WeakPolarHBondContact CG-OG 3.1Å; R420-S422 PolarHBondContact NE-OG 3.35Å
423	S	91.9	Very high	93.6	Very high	19 Å²	19	17.3 Å²	17.3	13%	0.133	10%	0.098	C	C	.	.			trans	-152.1	145.6	179.5	172	0	0	0	0	110.4	N72 K238 F421	N72-S423 PolarHBondContact ND2-O 2.87Å; N72-S423 PolarHBondContact OD1-N 2.77Å; N72-S423 PolarHBondContact OD1-O 2.76Å; K238-S423 PolarHBondContact NZ-OG 2.57Å; F421-S423 WeakPolarHBondContact CE2-O 3.36Å
424	P	87.9	Confident	94	Very high	90 Å²	90	11.9 Å²	11.9	58%	0.584	8%	0.076	S	C	*	.			trans	-64.4	0	164.6	32.9	-39.8	0	0	0	113.1	K238 V240 F421	K238-P424 HydrophobicContact CB-CG 3.79Å; K238-P424 HydrophobicContact CD-CG 3.92Å; V240-P424 HydrophobicContact CG1-CB 3.42Å; V240-P424 VanDerWaalsContact CG1-CB 3.42Å; V240-P424 HydrophobicContact CG1-CG 3.43Å; V240-P424 VanDerWaalsContact CG1-CG 3.43Å; F421-P424 VanDerWaalsContact CZ-CA 3.5Å; F421-P424 HydrophobicContact CZ-CB 3.99Å

Retrieved 424 of 424 residues in 408.1 ms (Link to these results)

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