A0A060XSQ7_ONCMY Loading...

LRAT domain-containing protein

AlphaFold DB , UniProt , Accession A0A060XSQ7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110497454, Length 219 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	41.2	Very low	196 Å²	196	110.9 Å²	110.9	97%	0.966	56%	0.562	S	S	*	*				0	-38	0	-141.7	169.9	81	0	0	112.7	L5	M1-L5 VanDerWaalsContact O-CD1 3.29Å; M1-L5 WeakPolarHBondContact O-CD1 3.43Å
2	I	37.6	Very low	40.8	Very low	130 Å²	130	106.3 Å²	106.3	67%	0.667	54%	0.535	S	S	*	.	H	α-helix	trans	-67.3	-32.2	176.8	-65.5	165.7	0	0	0	112.9	L5 Q6	I2-L5 PolarHBondContact O-N 3.35Å; I2-Q6 HydrophobicContact CG2-CG 4.47Å; I2-Q6 WeakPolarHBondContact O-CG 3.38Å; I2-Q6 PolarHBondContact O-N 3.15Å
3	T	44.8	Very low	40.6	Very low	98 Å²	98	106.6 Å²	106.6	60%	0.601	54%	0.538	S	S	*	.	H	α-helix	trans	-70.9	-34.7	-175.8	42.8	0	0	0	0	114.7	L7	T3-L7 PolarHBondContact O-N 3.29Å
4	F	43.1	Very low	40	Very low	140 Å²	140	105.2 Å²	105.2	61%	0.614	55%	0.551	S	S	*	*	H	α-helix	trans	-73.3	-34.2	175.4	-169.6	-101.7	0	0	0	111.9	L7 L8	F4-L7 WeakPolarHBondContact O-CB 3.38Å; F4-L7 PolarHBondContact O-N 3.11Å; F4-L8 HydrophobicContact CD1-CD1 3.97Å; F4-L8 HydrophobicContact CE1-CD1 3.74Å; F4-L8 PolarHBondContact O-N 2.99Å; F4-L8 VanDerWaalsContact O-N 3.09Å
5	L	41.4	Very low	39.8	Very low	86 Å²	86	102.9 Å²	102.9	45%	0.45	55%	0.547	S	S	.	.	H	α-helix	trans	-69.1	-36.5	173.7	-91.1	101.1	0	0	0	112.6	M1 I2 L7 L8 S9	M1-L5 VanDerWaalsContact O-CD1 3.29Å; M1-L5 WeakPolarHBondContact O-CD1 3.43Å; I2-L5 PolarHBondContact O-N 3.35Å; L5-L7 VanDerWaalsContact C-N 3.32Å; L5-L8 PolarHBondContact O-N 3.04Å; L5-S9 WeakPolarHBondContact O-CB 3.4Å; L5-S9 PolarHBondContact O-N 3.39Å
6	Q	37.3	Very low	40	Very low	105 Å²	105	106.4 Å²	106.4	49%	0.491	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-38.8	173.1	-78.4	175.1	-40.4	0	0	111.5	I2 S9 L10	I2-Q6 HydrophobicContact CG2-CG 4.47Å; I2-Q6 WeakPolarHBondContact O-CG 3.38Å; I2-Q6 PolarHBondContact O-N 3.15Å; Q6-S9 WeakPolarHBondContact CA-OG 3.43Å; Q6-S9 PolarHBondContact O-N 3.24Å; Q6-S9 PolarHBondContact O-OG 3.41Å; Q6-L10 WeakPolarHBondContact O-CB 3.46Å; Q6-L10 VanDerWaalsContact O-CG 3.26Å; Q6-L10 WeakPolarHBondContact O-CG 3.36Å; Q6-L10 PolarHBondContact O-N 3.22Å
7	L	44.4	Very low	39.8	Very low	95 Å²	95	108.8 Å²	108.8	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-61	-47.3	173.4	-108.7	131.5	0	0	0	111.9	T3 F4 L5 S9 L10 F11	T3-L7 PolarHBondContact O-N 3.29Å; F4-L7 WeakPolarHBondContact O-CB 3.38Å; F4-L7 PolarHBondContact O-N 3.11Å; L5-L7 VanDerWaalsContact C-N 3.32Å; L7-S9 VanDerWaalsContact C-N 3.32Å; L7-S9 PolarHBondContact O-N 3.42Å; L7-L10 PolarHBondContact O-N 2.86Å; L7-F11 HydrophobicContact CD2-CD2 4.4Å; L7-F11 HydrophobicContact CD2-CE2 3.77Å; L7-F11 WeakPolarHBondContact O-CD2 3.35Å; L7-F11 PolarHBondContact O-N 3.03Å
8	L	43.9	Very low	40.3	Very low	80 Å²	80	109.2 Å²	109.2	42%	0.419	58%	0.578	S	S	.	*	H	α-helix	trans	-59.5	-42	172.6	-86.4	154.7	0	0	0	111.8	F4 L5 L10 F11 F12	F4-L8 HydrophobicContact CD1-CD1 3.97Å; F4-L8 HydrophobicContact CE1-CD1 3.74Å; F4-L8 PolarHBondContact O-N 2.99Å; F4-L8 VanDerWaalsContact O-N 3.09Å; L5-L8 PolarHBondContact O-N 3.04Å; L8-L10 VanDerWaalsContact C-N 3.35Å; L8-L10 PolarHBondContact O-N 2.79Å; L8-F11 PolarHBondContact O-N 3.45Å; L8-F12 WeakPolarHBondContact O-CD2 3.48Å; L8-F12 PolarHBondContact O-N 2.81Å
9	S	40	Very low	40.4	Very low	41 Å²	41	112.3 Å²	112.3	29%	0.287	59%	0.589	S	S	.	*	H	α-helix	trans	-64.6	-37.8	177.5	80.9	0	0	0	0	112.6	L5 Q6 L7 F12 I13	L5-S9 WeakPolarHBondContact O-CB 3.4Å; L5-S9 PolarHBondContact O-N 3.39Å; Q6-S9 WeakPolarHBondContact CA-OG 3.43Å; Q6-S9 PolarHBondContact O-N 3.24Å; Q6-S9 PolarHBondContact O-OG 3.41Å; L7-S9 VanDerWaalsContact C-N 3.32Å; L7-S9 PolarHBondContact O-N 3.42Å; S9-F12 PolarHBondContact O-N 3.47Å; S9-I13 WeakPolarHBondContact O-CB 3.44Å; S9-I13 WeakPolarHBondContact O-CD1 3.41Å; S9-I13 WeakPolarHBondContact O-CG1 3.43Å; S9-I13 PolarHBondContact O-N 2.71Å
10	L	37.1	Very low	40.3	Very low	114 Å²	114	113 Å²	113	60%	0.597	59%	0.589	S	S	*	*	H	α-helix	trans	-69.4	-36.9	178.7	-74	164.3	0	0	0	111.6	Q6 L7 L8 F12 A14	Q6-L10 WeakPolarHBondContact O-CB 3.46Å; Q6-L10 VanDerWaalsContact O-CG 3.26Å; Q6-L10 WeakPolarHBondContact O-CG 3.36Å; Q6-L10 PolarHBondContact O-N 3.22Å; L7-L10 PolarHBondContact O-N 2.86Å; L8-L10 VanDerWaalsContact C-N 3.35Å; L8-L10 PolarHBondContact O-N 2.79Å; L10-F12 VanDerWaalsContact C-N 3.28Å; L10-F12 PolarHBondContact O-N 3.45Å; L10-A14 PolarHBondContact O-N 3.5Å
11	F	40.8	Very low	40.8	Very low	135 Å²	135	115.3 Å²	115.3	59%	0.592	60%	0.602	S	S	*	*	H	α-helix	trans	-64.3	-32.1	174.1	-86.1	-69.3	0	0	0	113.1	L7 L8	L7-F11 HydrophobicContact CD2-CD2 4.4Å; L7-F11 HydrophobicContact CD2-CE2 3.77Å; L7-F11 WeakPolarHBondContact O-CD2 3.35Å; L7-F11 PolarHBondContact O-N 3.03Å; L8-F11 PolarHBondContact O-N 3.45Å
12	F	37.3	Very low	40.7	Very low	56 Å²	56	113.2 Å²	113.2	25%	0.246	59%	0.588	C	S	.	*	H	α-helix	trans	-87.3	-31.7	178.1	-85.3	-80.2	0	0	0	113.9	L8 S9 L10 A14 S15 L45 I86	L8-F12 WeakPolarHBondContact O-CD2 3.48Å; L8-F12 PolarHBondContact O-N 2.81Å; S9-F12 PolarHBondContact O-N 3.47Å; L10-F12 VanDerWaalsContact C-N 3.28Å; L10-F12 PolarHBondContact O-N 3.45Å; F12-A14 VanDerWaalsContact C-N 3.32Å; F12-S15 PolarHBondContact O-N 3Å; F12-L45 HydrophobicContact CE1-CD1 4.25Å; F12-L45 HydrophobicContact CE2-CD1 4.3Å; F12-L45 HydrophobicContact CZ-CD1 4.07Å; F12-I86 HydrophobicContact CB-CD1 3.31Å; F12-I86 HydrophobicContact CB-CG1 4.11Å; F12-I86 HydrophobicContact CD1-CD1 3.87Å; F12-I86 HydrophobicContact CD1-CG1 3.94Å; F12-I86 HydrophobicContact CD2-CD1 4.26Å; F12-I86 HydrophobicContact CD2-CG1 4.13Å; F12-I86 HydrophobicContact CE1-CG1 4.4Å; F12-I86 HydrophobicContact CG-CD1 3.57Å; F12-I86 HydrophobicContact CG-CG1 3.8Å
13	I	37.7	Very low	41.1	Very low	110 Å²	110	114.9 Å²	114.9	56%	0.564	60%	0.598	S	S	*	*	H	α-helix	trans	-70.6	-28.7	178.4	-70.5	163.9	0	0	0	111.6	S9 S15	S9-I13 WeakPolarHBondContact O-CB 3.44Å; S9-I13 WeakPolarHBondContact O-CD1 3.41Å; S9-I13 WeakPolarHBondContact O-CG1 3.43Å; S9-I13 PolarHBondContact O-N 2.71Å; I13-S15 PolarHBondContact O-N 2.99Å; I13-S15 VanDerWaalsContact O-N 3.15Å
14	A	32.4	Very low	41.4	Very low	87 Å²	87	115.1 Å²	115.1	72%	0.719	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-9.9	177.6	0	0	0	0	0	114.1	L10 F12 K16	L10-A14 PolarHBondContact O-N 3.5Å; F12-A14 VanDerWaalsContact C-N 3.32Å; A14-K16 PolarHBondContact O-N 3.13Å
15	S	36.3	Very low	41.7	Very low	70 Å²	70	114.8 Å²	114.8	49%	0.49	60%	0.595	S	S	.	*			trans	-93.2	71.6	176.8	-138.1	0	0	0	0	110	F12 I13	F12-S15 PolarHBondContact O-N 3Å; I13-S15 PolarHBondContact O-N 2.99Å; I13-S15 VanDerWaalsContact O-N 3.15Å
16	K	42.8	Very low	42.4	Very low	160 Å²	160	116.3 Å²	116.3	70%	0.696	61%	0.613	S	S	*	*			trans	-121.3	105.4	171.7	-155.2	-171.4	-173	-168.9	0	109.5	A14	A14-K16 PolarHBondContact O-N 3.13Å
17	V	37.3	Very low	43.8	Very low	146 Å²	146	119.5 Å²	119.5	89%	0.885	63%	0.625	S	S	*	*			trans	-141.2	123.2	140.2	179.4	0	0	0	0	106
18	D	48.4	Very low	45.1	Very low	116 Å²	116	117.6 Å²	117.6	62%	0.62	61%	0.612	S	S	*	*			trans	-71.4	174.8	176.7	-72.3	-58.1	0	0	0	111.9
19	E	42.5	Very low	47	Very low	168 Å²	168	118.2 Å²	118.2	79%	0.785	62%	0.615	S	S	*	*			trans	89.9	136.6	163.5	-58.4	-168	178.7	0	0	116.6
20	E	37.6	Very low	49.2	Very low	126 Å²	126	119.9 Å²	119.9	59%	0.589	62%	0.621	S	S	*	*			cis	-162.4	159.5	7.8	-124.8	177.5	-169.4	0	0	109	K22	E20-K22 PolarHBondContact O-N 3.03Å
21	D	52.2	Low	51.7	Low	162 Å²	162	118.7 Å²	118.7	87%	0.866	62%	0.622	S	S	*	*			trans	-76.4	105.9	176.6	-155.2	0.3	0	0	0	109.9
22	K	39.3	Very low	54.1	Low	153 Å²	153	117.7 Å²	117.7	67%	0.665	62%	0.622	S	S	*	*			trans	-147.7	108.7	168.4	-75.8	-169.8	-179.6	156.6	0	111.6	E20 K24	E20-K22 PolarHBondContact O-N 3.03Å; K22-K24 WeakPolarHBondContact O-CG 3.2Å; K22-K24 PolarHBondContact O-N 3.4Å
23	D	46.2	Very low	56.9	Low	164 Å²	164	116.4 Å²	116.4	88%	0.877	62%	0.616	S	S	*	*			trans	34.5	78.5	147.3	-144	8.9	0	0	0	115.6
24	K	51.8	Low	59.7	Low	103 Å²	103	118.4 Å²	118.4	45%	0.448	62%	0.621	S	S	.	*			trans	-106.2	5	-169.8	-76.9	-174.9	-178.7	164.7	0	115.7	K22 S26 A102	K22-K24 WeakPolarHBondContact O-CG 3.2Å; K22-K24 PolarHBondContact O-N 3.4Å; K24-S26 VanDerWaalsContact C-N 3.27Å; K24-S26 PolarHBondContact O-N 3.46Å; K24-A102 HydrophobicContact CB-CB 3.86Å; K24-A102 HydrophobicContact CD-CB 4.4Å
25	D	49.7	Very low	62.8	Low	133 Å²	133	117.6 Å²	117.6	71%	0.711	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-6.9	-168.4	-119.3	-2.7	0	0	0	114.5
26	S	54.5	Low	65.7	Low	119 Å²	119	114.3 Å²	114.3	83%	0.832	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	13.1	-172.3	89.6	0	0	0	0	117.2	K24	K24-S26 VanDerWaalsContact C-N 3.27Å; K24-S26 PolarHBondContact O-N 3.46Å
27	K	68.3	Low	68.4	Low	172 Å²	172	107.3 Å²	107.3	75%	0.748	55%	0.546	S	S	*	.	S	Bend	trans	-84.8	-22.8	-175.8	-164.5	175.5	178.4	-174.8	0	114.5
28	Y	71.3	Confident	71.3	Confident	54 Å²	54	100.4 Å²	100.4	21%	0.212	50%	0.504	C	S	.	.	S	Bend	trans	-102	122.9	-171.5	-63.3	-83.4	0	0	0	111.4	L30 L101 A102 A105 I110	Y28-L30 PolarHBondContact O-N 3.36Å; Y28-L30 VanDerWaalsContact O-N 3.08Å; Y28-L101 HydrophobicContact CD2-CB 4.24Å; Y28-L101 HydrophobicContact CG-CB 4.36Å; Y28-A102 HydrophobicContact CD2-CB 4.47Å; Y28-A102 HydrophobicContact CE2-CB 3.95Å; Y28-A105 HydrophobicContact CE1-CB 4.45Å; Y28-A105 WeakPolarHBondContact OH-CB 3.38Å; Y28-I110 HydrophobicContact CD1-CD1 4.26Å; Y28-I110 HydrophobicContact CE1-CD1 3.83Å; Y28-I110 HydrophobicContact CE1-CG1 4.33Å
29	D	84	Confident	73.6	Confident	93 Å²	93	94.9 Å²	94.9	50%	0.497	48%	0.475	S	S	.	.			trans	-70.7	101.2	166.7	-177.7	-2.7	0	0	0	109	S31 L32	D29-S31 PolarHBondContact O-N 2.95Å; D29-S31 VanDerWaalsContact O-N 3.13Å; D29-S31 VanDerWaalsContact OD1-CB 3.25Å; D29-S31 WeakPolarHBondContact OD1-CB 3.2Å; D29-S31 PolarHBondContact OD1-N 3.08Å; D29-S31 PolarHBondContact OD1-OG 3.45Å; D29-S31 PolarHBondContact OD2-OG 2.99Å; D29-S31 VanDerWaalsContact OD2-OG 3.1Å; D29-L32 HydrophobicContact CB-CD1 4.08Å; D29-L32 HydrophobicContact CB-CG 4.16Å; D29-L32 WeakPolarHBondContact O-CB 3.31Å; D29-L32 PolarHBondContact O-N 3.35Å
30	L	86.4	Confident	76.2	Confident	76 Å²	76	87.2 Å²	87.2	40%	0.398	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.6	-177.4	-62.1	-179.1	0	0	0	113	Y28 L32 Y33 N56 L101	Y28-L30 PolarHBondContact O-N 3.36Å; Y28-L30 VanDerWaalsContact O-N 3.08Å; L30-L32 PolarHBondContact O-N 3.1Å; L30-Y33 PolarHBondContact O-N 3.18Å; L30-N56 HydrophobicContact CD1-CB 4.41Å; L30-N56 HydrophobicContact CD2-CB 4.07Å; L30-L101 HydrophobicContact CD2-CD1 3.5Å; L30-L101 VanDerWaalsContact CD2-CD1 3.5Å
31	S	88.3	Confident	78.9	Confident	89 Å²	89	81.2 Å²	81.2	62%	0.622	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.6	178.2	74.7	0	0	0	0	113.2	D29 Y33	D29-S31 PolarHBondContact O-N 2.95Å; D29-S31 VanDerWaalsContact O-N 3.13Å; D29-S31 VanDerWaalsContact OD1-CB 3.25Å; D29-S31 WeakPolarHBondContact OD1-CB 3.2Å; D29-S31 PolarHBondContact OD1-N 3.08Å; D29-S31 PolarHBondContact OD1-OG 3.45Å; D29-S31 PolarHBondContact OD2-OG 2.99Å; D29-S31 VanDerWaalsContact OD2-OG 3.1Å; S31-Y33 VanDerWaalsContact C-N 3.28Å; S31-Y33 PolarHBondContact O-N 2.89Å
32	L	91.4	Very high	80.7	Confident	114 Å²	114	76.5 Å²	76.5	60%	0.597	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-77.9	-12	178.6	-58.8	178.9	0	0	0	113.5	D29 L30	D29-L32 HydrophobicContact CB-CD1 4.08Å; D29-L32 HydrophobicContact CB-CG 4.16Å; D29-L32 WeakPolarHBondContact O-CB 3.31Å; D29-L32 PolarHBondContact O-N 3.35Å; L30-L32 PolarHBondContact O-N 3.1Å
33	Y	95.7	Very high	82.9	Confident	29 Å²	29	72.5 Å²	72.5	11%	0.114	37%	0.37	C	S	.	.			trans	-116.3	130.7	-174.5	-54.6	-83.9	0	0	0	111.3	L30 S31 L39 L101 I110 V112	L30-Y33 PolarHBondContact O-N 3.18Å; S31-Y33 VanDerWaalsContact C-N 3.28Å; S31-Y33 PolarHBondContact O-N 2.89Å; Y33-L39 HydrophobicContact CD1-CD2 3.84Å; Y33-L39 HydrophobicContact CE1-CD2 4.12Å; Y33-L101 HydrophobicContact CD1-CD2 4.46Å; Y33-L101 HydrophobicContact CD2-CD1 3.98Å; Y33-L101 HydrophobicContact CE1-CD2 4.31Å; Y33-L101 HydrophobicContact CE2-CD1 4.03Å; Y33-L101 HydrophobicContact CG-CD1 4.46Å; Y33-I110 HydrophobicContact CE1-CB 4.49Å; Y33-I110 HydrophobicContact CE1-CD1 4.39Å; Y33-I110 HydrophobicContact CE1-CG2 4.14Å; Y33-V112 HydrophobicContact CD1-CG2 3.9Å; Y33-V112 HydrophobicContact CE1-CG2 3.67Å
34	K	97.2	Very high	84.3	Confident	153 Å²	153	70.7 Å²	70.7	67%	0.665	37%	0.365	S	S	*	.			trans	-109.8	141.4	176	-63	-177.9	-176.7	179.1	0	110.2	G36 D37 Y52	K34-G36 PolarHBondContact O-N 2.98Å; K34-D37 PolarHBondContact N-OD2 3.17Å; K34-D37 WeakPolarHBondContact O-CB 3.47Å; K34-D37 PolarHBondContact O-N 3.29Å; K34-Y52 WeakPolarHBondContact O-CD1 3.31Å
35	R	97.8	Very high	85.4	Confident	70 Å²	70	70.5 Å²	70.5	26%	0.264	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	129	177.3	179.3	170.6	165.8	88.4	2	109.6	L53 G126 D127 A130 E134	R35-L53 PolarHBondContact NH1-O 3.27Å; R35-G126 CarbonylContact O-C 3.06Å; R35-G126 WeakPolarHBondContact O-CA 3.19Å; R35-D127 WeakPolarHBondContact CD-OD1 3.23Å; R35-D127 IonicContact NE-OD1 3.79Å; R35-D127 PolarHBondContact NE-OD1 3Å; R35-A130 HydrophobicContact CG-CB 3.52Å; R35-E134 IonicContact CZ-OE1 3.11Å; R35-E134 IonicContact CZ-OE2 3.58Å; R35-E134 IonicContact NH1-OE1 3.02Å; R35-E134 PolarHBondContact NH1-OE1 3.07Å; R35-E134 IonicContact NH2-OE1 3.84Å; R35-E134 PolarHBondContact NH2-OE1 3.07Å; R35-E134 IonicContact NH2-OE2 2.77Å; R35-E134 PolarHBondContact NH2-OE2 3.49Å
36	G	97.9	Very high	86.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	-4.3	-173.3	0	0	0	0	0	115.1	K34 L38 Y52 G126 V129 R157	K34-G36 PolarHBondContact O-N 2.98Å; G36-L38 PolarHBondContact O-N 2.9Å; G36-Y52 PolarHBondContact N-O 2.93Å; G36-G126 WeakPolarHBondContact CA-O 3.34Å; G36-V129 WeakPolarHBondContact O-CG1 3.34Å; G36-R157 PolarHBondContact O-NH1 3.11Å
37	D	98.4	Very high	88.6	Confident	14 Å²	14	63.4 Å²	63.4	8%	0.075	32%	0.319	C	S	.	.			trans	-60.6	133.9	173.6	-78.1	-13.7	0	0	0	111.1	K34 L39 I51 Y52 V112 N113	K34-D37 PolarHBondContact N-OD2 3.17Å; K34-D37 WeakPolarHBondContact O-CB 3.47Å; K34-D37 PolarHBondContact O-N 3.29Å; D37-L39 HydrophobicContact CB-CD2 4.11Å; D37-I51 CarbonylContact O-C 3.6Å; D37-I51 WeakPolarHBondContact O-CA 3.43Å; D37-Y52 PolarHBondContact O-N 2.73Å; D37-V112 HydrophobicContact CB-CG1 3.89Å; D37-V112 WeakPolarHBondContact OD2-CG1 3.4Å; D37-N113 WeakPolarHBondContact CA-OD1 3.49Å; D37-N113 PolarHBondContact OD1-ND2 2.67Å
38	L	97.9	Very high	89.8	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.5	168.7	179.2	164.1	0	0	0	107.9	G36 E40 F49 I51 N113 M115 V153 R157 Y158	G36-L38 PolarHBondContact O-N 2.9Å; L38-E40 HydrophobicContact CD2-CG 3.47Å; L38-E40 VanDerWaalsContact CD2-CG 3.47Å; L38-F49 HydrophobicContact CD2-CD1 4.1Å; L38-I51 HydrophobicContact CB-CD1 4.07Å; L38-I51 HydrophobicContact CG-CD1 4.42Å; L38-N113 PolarHBondContact N-OD1 3.03Å; L38-N113 PolarHBondContact O-N 2.78Å; L38-M115 HydrophobicContact CD1-CB 4.25Å; L38-M115 HydrophobicContact CD1-CG 4.31Å; L38-M115 HydrophobicContact CD2-CG 4.28Å; L38-V153 HydrophobicContact CD1-CB 3.9Å; L38-V153 HydrophobicContact CD1-CG2 3.68Å; L38-V153 HydrophobicContact CG-CB 4.08Å; L38-V153 HydrophobicContact CG-CG2 4.06Å; L38-R157 VanDerWaalsContact CB-CD 3.48Å; L38-R157 HydrophobicContact CD1-CB 4.36Å; L38-Y158 HydrophobicContact CD1-CE2 4.01Å
39	L	98	Very high	91	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.7	-178.7	-52.4	-174.2	0	0	0	109.5	Y33 D37 F49 G50 Y52 V58 L101 F104 I110 L111 V112	Y33-L39 HydrophobicContact CD1-CD2 3.84Å; Y33-L39 HydrophobicContact CE1-CD2 4.12Å; D37-L39 HydrophobicContact CB-CD2 4.11Å; L39-F49 CarbonylContact O-C 3.55Å; L39-F49 WeakPolarHBondContact O-CA 3.49Å; L39-G50 PolarHBondContact N-O 2.97Å; L39-G50 PolarHBondContact O-N 3.32Å; L39-Y52 HydrophobicContact CD1-CD2 4.45Å; L39-V58 HydrophobicContact CD1-CG1 4.04Å; L39-V58 HydrophobicContact CD1-CG2 3.7Å; L39-L101 HydrophobicContact CD1-CD2 3.65Å; L39-F104 HydrophobicContact CB-CE1 3.56Å; L39-F104 HydrophobicContact CB-CZ 3.91Å; L39-F104 HydrophobicContact CD1-CD1 4.31Å; L39-F104 HydrophobicContact CD1-CE1 4.08Å; L39-I110 HydrophobicContact CB-CG2 3.82Å; L39-I110 HydrophobicContact CD1-CG2 4.29Å; L39-I110 HydrophobicContact CD2-CG2 3.97Å; L39-I110 HydrophobicContact CG-CG2 4.24Å; L39-L111 WeakPolarHBondContact CA-O 3.3Å; L39-V112 HydrophobicContact CD2-CG1 4.38Å; L39-V112 HydrophobicContact CD2-CG2 4Å
40	E	96.3	Very high	91.6	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.037	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.8	176.8	-47.7	175.9	-154.3	0	0	109.3	L38 T47 H48 F49 I110 L111 H114 M115	L38-E40 HydrophobicContact CD2-CG 3.47Å; L38-E40 VanDerWaalsContact CD2-CG 3.47Å; E40-T47 HydrophobicContact CB-CG2 3.79Å; E40-H48 CarbonylContact C-O 3.58Å; E40-H48 WeakPolarHBondContact CA-O 3.44Å; E40-F49 HydrophobicContact CB-CD1 4.39Å; E40-F49 HydrophobicContact CB-CE1 4.33Å; E40-F49 HydrophobicContact CG-CD1 3.76Å; E40-F49 HydrophobicContact CG-CE1 3.64Å; E40-I110 WeakPolarHBondContact O-CA 3.18Å; E40-L111 HydrophobicContact CB-CB 4.15Å; E40-L111 PolarHBondContact N-O 3.11Å; E40-L111 PolarHBondContact O-N 3.02Å; E40-H114 VanDerWaalsContact OE1-CB 3.25Å; E40-H114 WeakPolarHBondContact OE1-CB 3.31Å; E40-H114 IonicContact OE1-CG 2.87Å; E40-H114 IonicContact OE1-ND1 3.28Å; E40-H114 IonicContact OE2-CG 2.67Å; E40-H114 IonicContact OE2-ND1 3.45Å; E40-H114 PolarHBondContact OE2-ND1 2.77Å; E40-M115 WeakPolarHBondContact OE1-CG 3.4Å; E40-M115 PolarHBondContact OE1-N 3.29Å
41	V	93.9	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	108.6	178.5	-172.3	0	0	0	0	108.6	R43 H48 F104 A105 S108 I110	V41-R43 PolarHBondContact O-N 2.88Å; V41-H48 PolarHBondContact N-O 3.44Å; V41-H48 PolarHBondContact O-N 2.86Å; V41-F104 HydrophobicContact CB-CE1 4.43Å; V41-F104 HydrophobicContact CG2-CD1 3.73Å; V41-F104 HydrophobicContact CG2-CE1 3.16Å; V41-F104 HydrophobicContact CG2-CZ 3.68Å; V41-A105 WeakPolarHBondContact CG1-O 3.48Å; V41-S108 WeakPolarHBondContact CG1-OG 3.42Å; V41-I110 HydrophobicContact CG2-CG1 4.23Å
42	P	89.9	Confident	92.7	Very high	62 Å²	62	41.7 Å²	41.7	40%	0.403	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	128.5	175.3	-23.5	34.2	0	0	0	111.1	S108	P42-S108 PolarHBondContact O-OG 2.85Å
43	R	85.7	Confident	93	Very high	69 Å²	69	36.4 Å²	36.4	26%	0.26	18%	0.18	S	C	.	.			trans	-112.2	170.2	166.2	-48	-61	-173.3	-158.3	0.6	109	V41 L45 F46 H48 F104 A105	V41-R43 PolarHBondContact O-N 2.88Å; R43-L45 PolarHBondContact O-N 3.25Å; R43-L45 VanDerWaalsContact O-N 3.15Å; R43-F46 CarbonylContact C-O 3.5Å; R43-F46 WeakPolarHBondContact CA-O 3.46Å; R43-F46 HydrophobicContact CB-CD1 4.43Å; R43-F46 HydrophobicContact CB-CE1 4.39Å; R43-F46 WeakPolarHBondContact CB-O 3.24Å; R43-F46 HydrophobicContact CG-CD2 4.5Å; R43-F46 HydrophobicContact CG-CE2 4.16Å; R43-F46 HydrophobicContact CG-CZ 4.16Å; R43-F46 PolarHBondContact N-O 3.34Å; R43-H48 HydrophobicContact CG-CB 4.16Å; R43-F104 PolarHBondContact NH2-O 3.04Å; R43-A105 PolarHBondContact NH1-O 2.74Å
44	T	76.4	Confident	93	Very high	126 Å²	126	35.5 Å²	35.5	77%	0.773	18%	0.179	S	C	*	.	S	Bend	trans	-54.5	-36.6	-178.1	-42.6	0	0	0	0	113.5
45	L	73.7	Confident	92.9	Very high	99 Å²	99	34.8 Å²	34.8	52%	0.518	18%	0.182	S	C	.	.	S	Bend	trans	-118.1	-12.8	-173.6	-60.8	178.9	0	0	0	114.2	F12 R43	F12-L45 HydrophobicContact CE1-CD1 4.25Å; F12-L45 HydrophobicContact CE2-CD1 4.3Å; F12-L45 HydrophobicContact CZ-CD1 4.07Å; R43-L45 PolarHBondContact O-N 3.25Å; R43-L45 VanDerWaalsContact O-N 3.15Å
46	F	81.9	Confident	92.7	Very high	65 Å²	65	33 Å²	33	29%	0.285	18%	0.178	S	C	.	.	S	Bend	trans	-160.7	160.8	-176.1	64.7	-83.6	0	0	0	110.4	R43 H48 Q165	R43-F46 CarbonylContact C-O 3.5Å; R43-F46 WeakPolarHBondContact CA-O 3.46Å; R43-F46 HydrophobicContact CB-CD1 4.43Å; R43-F46 HydrophobicContact CB-CE1 4.39Å; R43-F46 WeakPolarHBondContact CB-O 3.24Å; R43-F46 HydrophobicContact CG-CD2 4.5Å; R43-F46 HydrophobicContact CG-CE2 4.16Å; R43-F46 HydrophobicContact CG-CZ 4.16Å; R43-F46 PolarHBondContact N-O 3.34Å; F46-H48 HydrophobicContact CD2-CB 4.47Å; F46-H48 HydrophobicContact CE2-CB 3.95Å; F46-Q165 VanDerWaalsContact CB-OE1 3.24Å
47	T	89.5	Confident	92.6	Very high	39 Å²	39	38 Å²	38	24%	0.239	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.9	165.9	-55.2	0	0	0	0	109.3	E40 F49 Q165	E40-T47 HydrophobicContact CB-CG2 3.79Å; T47-F49 HydrophobicContact CG2-CE1 4.16Å; T47-F49 HydrophobicContact CG2-CE2 4.03Å; T47-F49 HydrophobicContact CG2-CZ 3.8Å; T47-F49 VanDerWaalsContact O-CD2 3.28Å; T47-F49 WeakPolarHBondContact O-CD2 3.21Å; T47-F49 WeakPolarHBondContact O-CE2 3.34Å; T47-Q165 PolarHBondContact O-NE2 2.89Å
48	H	93.4	Very high	92.6	Very high	16 Å²	16	37.3 Å²	37.3	7%	0.074	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	143.5	172.8	-169.7	51.5	0	0	0	110.7	E40 V41 R43 F46 H60 I62 F104	E40-H48 CarbonylContact C-O 3.58Å; E40-H48 WeakPolarHBondContact CA-O 3.44Å; V41-H48 PolarHBondContact N-O 3.44Å; V41-H48 PolarHBondContact O-N 2.86Å; R43-H48 HydrophobicContact CG-CB 4.16Å; F46-H48 HydrophobicContact CD2-CB 4.47Å; F46-H48 HydrophobicContact CE2-CB 3.95Å; H48-H60 AromaticContact CD2-ND1 3.85Å; H48-H60 AromaticContact NE2-CG 3.58Å; H48-H60 AromaticContact NE2-ND1 3.06Å; H48-H60 PolarHBondContact NE2-ND1 2.95Å; H48-I62 VanDerWaalsContact CE1-CG2 3.49Å; H48-I62 WeakPolarHBondContact CE1-CG2 3.31Å; H48-F104 AromaticContact CD2-CE2 3.5Å; H48-F104 VanDerWaalsContact CD2-CE2 3.5Å; H48-F104 WeakPolarHBondContact CD2-CE2 3.46Å; H48-F104 AromaticContact NE2-CE2 3.85Å
49	F	96.8	Very high	92.6	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.6	-172.9	-63.4	-91.6	0	0	0	112.2	L38 L39 E40 T47 H60 M115 C149 E150 V153	L38-F49 HydrophobicContact CD2-CD1 4.1Å; L39-F49 CarbonylContact O-C 3.55Å; L39-F49 WeakPolarHBondContact O-CA 3.49Å; E40-F49 HydrophobicContact CB-CD1 4.39Å; E40-F49 HydrophobicContact CB-CE1 4.33Å; E40-F49 HydrophobicContact CG-CD1 3.76Å; E40-F49 HydrophobicContact CG-CE1 3.64Å; T47-F49 HydrophobicContact CG2-CE1 4.16Å; T47-F49 HydrophobicContact CG2-CE2 4.03Å; T47-F49 HydrophobicContact CG2-CZ 3.8Å; T47-F49 VanDerWaalsContact O-CD2 3.28Å; T47-F49 WeakPolarHBondContact O-CD2 3.21Å; T47-F49 WeakPolarHBondContact O-CE2 3.34Å; F49-H60 WeakPolarHBondContact O-CB 3.14Å; F49-M115 HydrophobicContact CE1-CG 4.43Å; F49-C149 HydrophobicContact CB-CB 4.46Å; F49-E150 HydrophobicContact CD2-CB 3.78Å; F49-E150 HydrophobicContact CD2-CG 4.11Å; F49-E150 HydrophobicContact CE1-CG 4.32Å; F49-E150 HydrophobicContact CE2-CB 3.7Å; F49-E150 HydrophobicContact CE2-CG 3.7Å; F49-E150 HydrophobicContact CG-CB 4.47Å; F49-E150 HydrophobicContact CZ-CB 4.34Å; F49-E150 HydrophobicContact CZ-CG 3.82Å; F49-V153 HydrophobicContact CB-CB 4.28Å; F49-V153 HydrophobicContact CB-CG1 3.66Å; F49-V153 HydrophobicContact CB-CG2 3.59Å; F49-V153 HydrophobicContact CD1-CG2 3.85Å; F49-V153 HydrophobicContact CG-CG2 3.89Å
50	G	97.8	Very high	92.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	167.2	173.7	0	0	0	0	0	112.7	L39 A59	L39-G50 PolarHBondContact N-O 2.97Å; L39-G50 PolarHBondContact O-N 3.32Å; G50-A59 CarbonylContact C-O 3.47Å; G50-A59 VanDerWaalsContact CA-O 3.23Å; G50-A59 WeakPolarHBondContact CA-O 3.46Å
51	I	98.6	Very high	92.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.2	172.5	-62.6	-55.6	0	0	0	108.7	D37 L38 L53 V58 A59 V129 A133 F152 V153 C156	D37-I51 CarbonylContact O-C 3.6Å; D37-I51 WeakPolarHBondContact O-CA 3.43Å; L38-I51 HydrophobicContact CB-CD1 4.07Å; L38-I51 HydrophobicContact CG-CD1 4.42Å; I51-L53 HydrophobicContact CG2-CD2 4.28Å; I51-L53 PolarHBondContact O-N 3.15Å; I51-V58 CarbonylContact O-C 3.57Å; I51-V58 WeakPolarHBondContact O-CA 3.36Å; I51-A59 PolarHBondContact N-O 3.49Å; I51-A59 PolarHBondContact O-N 2.81Å; I51-V129 HydrophobicContact CD1-CG1 3.88Å; I51-V129 HydrophobicContact CG1-CG1 4.31Å; I51-V129 HydrophobicContact CG2-CG1 3.9Å; I51-A133 HydrophobicContact CB-CB 3.95Å; I51-A133 HydrophobicContact CG1-CB 4.21Å; I51-A133 HydrophobicContact CG2-CB 3.99Å; I51-F152 HydrophobicContact CG1-CE1 4.34Å; I51-V153 HydrophobicContact CD1-CB 3.87Å; I51-V153 HydrophobicContact CD1-CG1 3.97Å; I51-V153 HydrophobicContact CG1-CB 4.36Å; I51-V153 HydrophobicContact CG1-CG1 4.04Å; I51-C156 HydrophobicContact CD1-CB 4.26Å; I51-C156 HydrophobicContact CG1-CB 3.97Å
52	Y	98.4	Very high	92.3	Very high	6 Å²	6	37.9 Å²	37.9	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	124.7	174.1	-170.7	-122.9	0	0	0	110.8	K34 G36 D37 L39 G54 N55 N56 R57 V58 L101	K34-Y52 WeakPolarHBondContact O-CD1 3.31Å; G36-Y52 PolarHBondContact N-O 2.93Å; D37-Y52 PolarHBondContact O-N 2.73Å; L39-Y52 HydrophobicContact CD1-CD2 4.45Å; Y52-G54 VanDerWaalsContact CE1-CA 3.43Å; Y52-N55 PolarHBondContact OH-N 3.24Å; Y52-N56 PolarHBondContact OH-N 3.24Å; Y52-R57 WeakPolarHBondContact CD2-O 3.12Å; Y52-V58 HydrophobicContact CD2-CG2 4.14Å; Y52-L101 HydrophobicContact CD2-CD1 4.47Å; Y52-L101 HydrophobicContact CD2-CD2 4.09Å; Y52-L101 HydrophobicContact CD2-CG 4.35Å; Y52-L101 HydrophobicContact CE2-CD1 3.79Å; Y52-L101 HydrophobicContact CE2-CD2 4.21Å; Y52-L101 HydrophobicContact CE2-CG 4.01Å
53	L	98	Very high	92.2	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	18%	0.181	C	C	.	.			trans	-96.3	1.5	179.6	-57	-174.3	0	0	0	112.8	R35 I51 R57 A59 V98 A130 A133 E134	R35-L53 PolarHBondContact NH1-O 3.27Å; I51-L53 HydrophobicContact CG2-CD2 4.28Å; I51-L53 PolarHBondContact O-N 3.15Å; L53-R57 HydrophobicContact CB-CB 4.08Å; L53-R57 PolarHBondContact N-O 2.66Å; L53-A59 HydrophobicContact CD1-CB 3.93Å; L53-A59 HydrophobicContact CD2-CB 4.03Å; L53-A59 HydrophobicContact CG-CB 4.01Å; L53-V98 HydrophobicContact CD1-CG1 4.25Å; L53-V98 HydrophobicContact CD1-CG2 3.77Å; L53-A130 HydrophobicContact CD2-CB 4.02Å; L53-A133 HydrophobicContact CD2-CB 4.03Å; L53-E134 HydrophobicContact CD1-CG 4.02Å; L53-E134 HydrophobicContact CD2-CG 4.05Å
54	G	95.6	Very high	92.3	Very high	10 Å²	10	32.3 Å²	32.3	10%	0.103	17%	0.169	C	C	.	.	S	Bend	trans	82.2	158.8	-169.9	0	0	0	0	0	112.8	Y52 R57	Y52-G54 VanDerWaalsContact CE1-CA 3.43Å; G54-R57 WeakPolarHBondContact O-CB 3.33Å; G54-R57 PolarHBondContact O-N 3.47Å; G54-R57 PolarHBondContact O-NE 3.01Å
55	N	94.2	Very high	92.7	Very high	137 Å²	137	27 Å²	27	73%	0.733	14%	0.136	S	C	*	.	S	Bend	trans	56.9	49.3	178	-54.4	-26.9	0	0	0	113.5	Y52 R57	Y52-N55 PolarHBondContact OH-N 3.24Å; N55-R57 PolarHBondContact O-N 2.78Å
56	N	94.8	Very high	93.1	Very high	34 Å²	34	24.2 Å²	24.2	18%	0.182	12%	0.121	C	C	.	.	S	Bend	trans	60.4	27.9	179.9	-166.7	26.7	0	0	0	114	L30 Y52 S100 L101	L30-N56 HydrophobicContact CD1-CB 4.41Å; L30-N56 HydrophobicContact CD2-CB 4.07Å; Y52-N56 PolarHBondContact OH-N 3.24Å; N56-S100 VanDerWaalsContact O-CA 3.31Å; N56-S100 WeakPolarHBondContact O-CA 3.49Å; N56-L101 WeakPolarHBondContact OD1-CB 3.45Å; N56-L101 WeakPolarHBondContact OD1-CG 3.33Å; N56-L101 PolarHBondContact OD1-N 2.88Å
57	R	96.2	Very high	93.1	Very high	104 Å²	104	22.8 Å²	22.8	39%	0.392	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.1	180	-63.7	-175.6	-55.1	159.9	8.4	111.4	Y52 L53 G54 N55 V98	Y52-R57 WeakPolarHBondContact CD2-O 3.12Å; L53-R57 HydrophobicContact CB-CB 4.08Å; L53-R57 PolarHBondContact N-O 2.66Å; G54-R57 WeakPolarHBondContact O-CB 3.33Å; G54-R57 PolarHBondContact O-N 3.47Å; G54-R57 PolarHBondContact O-NE 3.01Å; N55-R57 PolarHBondContact O-N 2.78Å; R57-V98 HydrophobicContact CB-CG1 3.72Å; R57-V98 HydrophobicContact CG-CG1 4.13Å
58	V	97.6	Very high	92.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121	176.8	-174.2	0	0	0	0	109.6	L39 I51 Y52 V98 D99 L101 F104	L39-V58 HydrophobicContact CD1-CG1 4.04Å; L39-V58 HydrophobicContact CD1-CG2 3.7Å; I51-V58 CarbonylContact O-C 3.57Å; I51-V58 WeakPolarHBondContact O-CA 3.36Å; Y52-V58 HydrophobicContact CD2-CG2 4.14Å; V58-V98 VanDerWaalsContact O-CA 3.31Å; V58-V98 WeakPolarHBondContact O-CA 3.48Å; V58-D99 PolarHBondContact N-O 3.45Å; V58-D99 PolarHBondContact O-N 2.85Å; V58-L101 HydrophobicContact CG2-CD2 3.58Å; V58-L101 HydrophobicContact CG2-CG 3.99Å; V58-F104 HydrophobicContact CB-CB 4.13Å; V58-F104 HydrophobicContact CB-CD2 4.28Å; V58-F104 HydrophobicContact CB-CG 4.09Å; V58-F104 HydrophobicContact CG1-CB 4.33Å; V58-F104 HydrophobicContact CG1-CD1 4.11Å; V58-F104 HydrophobicContact CG1-CD2 3.6Å; V58-F104 HydrophobicContact CG1-CE1 4.33Å; V58-F104 HydrophobicContact CG1-CE2 3.9Å; V58-F104 HydrophobicContact CG1-CG 3.74Å; V58-F104 HydrophobicContact CG1-CZ 4.26Å; V58-F104 HydrophobicContact CG2-CB 4.14Å; V58-F104 HydrophobicContact CG2-CD1 4.31Å; V58-F104 HydrophobicContact CG2-CG 4.19Å
59	A	97.8	Very high	92.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	126.4	167.2	0	0	0	0	0	109.6	G50 I51 L53 V96 R97 V98 A133 F152	G50-A59 CarbonylContact C-O 3.47Å; G50-A59 VanDerWaalsContact CA-O 3.23Å; G50-A59 WeakPolarHBondContact CA-O 3.46Å; I51-A59 PolarHBondContact N-O 3.49Å; I51-A59 PolarHBondContact O-N 2.81Å; L53-A59 HydrophobicContact CD1-CB 3.93Å; L53-A59 HydrophobicContact CD2-CB 4.03Å; L53-A59 HydrophobicContact CG-CB 4.01Å; A59-V96 HydrophobicContact CB-CG1 4.43Å; A59-R97 WeakPolarHBondContact CA-O 3.32Å; A59-V98 HydrophobicContact CB-CG2 4.4Å; A59-A133 HydrophobicContact CB-CB 3.95Å; A59-F152 HydrophobicContact CB-CZ 4.34Å
60	H	96.2	Very high	91.4	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.3	176.3	66.2	174	0	0	0	111	H48 F49 V96 R97 D99 F104	H48-H60 AromaticContact CD2-ND1 3.85Å; H48-H60 AromaticContact NE2-CG 3.58Å; H48-H60 AromaticContact NE2-ND1 3.06Å; H48-H60 PolarHBondContact NE2-ND1 2.95Å; F49-H60 WeakPolarHBondContact O-CB 3.14Å; H60-V96 WeakPolarHBondContact O-CA 3.26Å; H60-R97 VanDerWaalsContact CD2-CG 3.49Å; H60-R97 WeakPolarHBondContact CD2-CG 3.05Å; H60-R97 PolarHBondContact CD2-O 3.19Å; H60-R97 PolarHBondContact N-O 3.13Å; H60-R97 VanDerWaalsContact NE2-CG 3.3Å; H60-R97 WeakPolarHBondContact NE2-CG 3.21Å; H60-R97 PolarHBondContact O-N 3.26Å; H60-R97 VanDerWaalsContact O-N 3.1Å; H60-D99 IonicContact CE1-OD2 2.73Å; H60-D99 PolarHBondContact CE1-OD2 3.3Å; H60-D99 VanDerWaalsContact CE1-OD2 3.29Å; H60-D99 IonicContact NE2-OD2 3.37Å; H60-D99 PolarHBondContact NE2-OD2 3.43Å; H60-F104 HydrophobicContact CB-CD2 4.11Å; H60-F104 HydrophobicContact CB-CE2 3.95Å; H60-F104 AromaticContact ND1-CD2 3.4Å; H60-F104 WeakPolarHBondContact ND1-CD2 3.46Å; H60-F104 AromaticContact ND1-CE2 3.9Å
61	F	94.8	Very high	90.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.9	178.6	-176.7	-145	0	0	0	109.6	A94 V96 M140 Y142 Y147 N148 C149 F152	F61-A94 HydrophobicContact CD2-CB 4.07Å; F61-A94 HydrophobicContact CE2-CB 3.26Å; F61-A94 HydrophobicContact CZ-CB 3.67Å; F61-V96 HydrophobicContact CB-CG2 3.84Å; F61-V96 HydrophobicContact CD2-CG2 3.74Å; F61-V96 HydrophobicContact CG-CG2 4.03Å; F61-M140 HydrophobicContact CD2-CE 3.8Å; F61-M140 HydrophobicContact CE1-CE 4.36Å; F61-M140 HydrophobicContact CE2-CB 4.02Å; F61-M140 HydrophobicContact CE2-CE 3.54Å; F61-M140 HydrophobicContact CG-CE 4.32Å; F61-M140 HydrophobicContact CZ-CB 4.17Å; F61-M140 HydrophobicContact CZ-CE 3.87Å; F61-Y142 HydrophobicContact CD1-CD2 4.29Å; F61-Y142 HydrophobicContact CD1-CE2 4.2Å; F61-Y142 AromaticContact CE1-CD2 3.68Å; F61-Y142 HydrophobicContact CE1-CD2 3.68Å; F61-Y142 AromaticContact CE1-CE2 3.99Å; F61-Y142 HydrophobicContact CE1-CE2 3.99Å; F61-Y142 HydrophobicContact CE2-CD2 4.31Å; F61-Y142 AromaticContact CZ-CD2 3.69Å; F61-Y142 HydrophobicContact CZ-CD2 3.69Å; F61-Y142 HydrophobicContact CZ-CE2 4.4Å; F61-Y147 AromaticContact CE1-CD1 3.54Å; F61-Y147 HydrophobicContact CE1-CD1 3.54Å; F61-Y147 AromaticContact CE1-CE1 3.73Å; F61-Y147 HydrophobicContact CE1-CE1 3.73Å; F61-Y147 HydrophobicContact CE1-CG 4.36Å; F61-Y147 WeakPolarHBondContact CE1-O 3.25Å; F61-Y147 AromaticContact CZ-CD1 3.72Å; F61-Y147 HydrophobicContact CZ-CD1 3.72Å; F61-Y147 AromaticContact CZ-CE1 3.72Å; F61-Y147 HydrophobicContact CZ-CE1 3.72Å; F61-N148 WeakPolarHBondContact CD1-O 3.46Å; F61-C149 WeakPolarHBondContact O-CB 3.07Å; F61-F152 HydrophobicContact CB-CB 3.83Å; F61-F152 HydrophobicContact CB-CD1 3.94Å; F61-F152 HydrophobicContact CB-CD2 4.45Å; F61-F152 HydrophobicContact CB-CG 3.81Å; F61-F152 HydrophobicContact CD1-CB 4.12Å; F61-F152 HydrophobicContact CG-CB 4.35Å
62	I	91.1	Very high	90.1	Very high	11 Å²	11	46.9 Å²	46.9	6%	0.056	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.2	-177.2	62.5	161.2	0	0	0	111.9	H48 V80 L85 A94 S95 R97	H48-I62 VanDerWaalsContact CE1-CG2 3.49Å; H48-I62 WeakPolarHBondContact CE1-CG2 3.31Å; I62-V80 HydrophobicContact CD1-CB 4.07Å; I62-V80 HydrophobicContact CD1-CG2 3.4Å; I62-L85 HydrophobicContact CB-CD2 4.48Å; I62-A94 CarbonylContact O-C 3.55Å; I62-A94 VanDerWaalsContact O-CA 3.22Å; I62-A94 WeakPolarHBondContact O-CA 3.31Å; I62-A94 WeakPolarHBondContact O-CB 3.33Å; I62-S95 PolarHBondContact N-O 3.26Å; I62-S95 PolarHBondContact O-N 3.23Å; I62-R97 HydrophobicContact CD1-CG 4.27Å; I62-R97 HydrophobicContact CG1-CG 4.17Å
63	P	88.7	Confident	89.2	Confident	13 Å²	13	55.4 Å²	55.4	8%	0.084	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	136.8	166.3	29.3	-32.1	0	0	0	110.2	L85 V89 S93 Y142	P63-L85 HydrophobicContact CG-CB 4.27Å; P63-L85 HydrophobicContact CG-CD2 4.13Å; P63-L85 WeakPolarHBondContact O-CD2 3.22Å; P63-V89 HydrophobicContact CB-CG2 3.69Å; P63-V89 HydrophobicContact CG-CG2 3.67Å; P63-S93 WeakPolarHBondContact CA-O 3.36Å; P63-Y142 HydrophobicContact CB-CD1 4.2Å; P63-Y142 HydrophobicContact CB-CD2 4.37Å; P63-Y142 HydrophobicContact CB-CE1 4.4Å; P63-Y142 HydrophobicContact CB-CG 4.18Å; P63-Y142 HydrophobicContact CG-CE1 4.33Å; P63-Y142 HydrophobicContact CG-CE2 4.49Å
64	D	86.1	Confident	88.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.3	C	S	.	.			trans	-155.3	121.7	175.6	-176.7	13.6	0	0	0	109.2	L66 P67 V80 R84 S93	D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 WeakPolarHBondContact OD1-CB 3.23Å; D64-L66 PolarHBondContact OD1-N 3.02Å; D64-P67 WeakPolarHBondContact O-CD 3.14Å; D64-P67 WeakPolarHBondContact OD2-CD 3.27Å; D64-V80 HydrophobicContact CB-CG1 4.39Å; D64-R84 VanDerWaalsContact CG-NH2 3.27Å; D64-R84 IonicContact OD1-CZ 3.44Å; D64-R84 IonicContact OD1-NE 2.9Å; D64-R84 PolarHBondContact OD1-NE 2.91Å; D64-R84 IonicContact OD1-NH2 3.17Å; D64-R84 PolarHBondContact OD1-NH2 2.91Å; D64-R84 VanDerWaalsContact OD1-NH2 3.17Å; D64-R84 IonicContact OD2-CZ 3.67Å; D64-R84 IonicContact OD2-NE 3.92Å; D64-R84 IonicContact OD2-NH2 2.67Å; D64-R84 PolarHBondContact OD2-NH2 2.94Å; D64-S93 PolarHBondContact N-O 3.1Å
65	I	85.1	Confident	87.5	Confident	15 Å²	15	59.8 Å²	59.8	8%	0.077	31%	0.307	C	S	.	.	S	Bend	trans	-75.9	-24.1	178.8	-165.8	64.7	0	0	0	112.8	P67 V68 F69 R84 L87 A91	I65-P67 VanDerWaalsContact C-CD 3.49Å; I65-V68 HydrophobicContact CD1-CB 4.29Å; I65-V68 HydrophobicContact CD1-CG2 4Å; I65-V68 WeakPolarHBondContact O-CB 3.5Å; I65-V68 WeakPolarHBondContact O-CG2 3.4Å; I65-V68 PolarHBondContact O-N 2.94Å; I65-F69 HydrophobicContact CB-CE2 4.48Å; I65-F69 HydrophobicContact CD1-CE2 4.09Å; I65-F69 HydrophobicContact CD1-CZ 4.46Å; I65-F69 HydrophobicContact CG1-CD2 3.94Å; I65-F69 HydrophobicContact CG1-CE2 3.31Å; I65-F69 HydrophobicContact CG1-CZ 4.1Å; I65-F69 HydrophobicContact CG2-CE2 4.5Å; I65-R84 HydrophobicContact CG2-CB 4.29Å; I65-R84 HydrophobicContact CG2-CG 4.23Å; I65-R84 PolarHBondContact N-O 2.66Å; I65-L87 HydrophobicContact CB-CB 3.73Å; I65-L87 HydrophobicContact CD1-CB 4.44Å; I65-L87 HydrophobicContact CG1-CB 3.94Å; I65-L87 HydrophobicContact CG2-CB 3.8Å; I65-L87 HydrophobicContact CG2-CD1 4.26Å; I65-A91 HydrophobicContact CD1-CB 3.25Å
66	L	82.1	Confident	86.6	Confident	41 Å²	41	54.9 Å²	54.9	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-60.3	-39	-167.4	-165.9	62.3	0	0	0	113.8	D64 V68 F69 T70 A75 I76 R84	D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 WeakPolarHBondContact OD1-CB 3.23Å; D64-L66 PolarHBondContact OD1-N 3.02Å; L66-V68 PolarHBondContact O-N 3.49Å; L66-V68 VanDerWaalsContact O-N 3.13Å; L66-F69 PolarHBondContact O-N 2.99Å; L66-T70 HydrophobicContact CD1-CG2 3.76Å; L66-T70 HydrophobicContact CD2-CG2 4.39Å; L66-T70 HydrophobicContact CG-CG2 3.64Å; L66-T70 WeakPolarHBondContact O-CG2 3.45Å; L66-T70 PolarHBondContact O-N 3.17Å; L66-A75 HydrophobicContact CD2-CB 4.14Å; L66-A75 WeakPolarHBondContact CD2-O 3.49Å; L66-I76 HydrophobicContact CD2-CG1 4.41Å; L66-I76 HydrophobicContact CG-CG1 4.41Å; L66-R84 VanDerWaalsContact CD2-CZ 3.48Å
67	P	81.9	Confident	85.6	Confident	34 Å²	34	55.4 Å²	55.4	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-19.5	173.9	-25.5	35.9	0	0	0	115.1	D64 I65 F69 T70 I76	D64-P67 WeakPolarHBondContact O-CD 3.14Å; D64-P67 WeakPolarHBondContact OD2-CD 3.27Å; I65-P67 VanDerWaalsContact C-CD 3.49Å; P67-F69 VanDerWaalsContact C-N 3.34Å; P67-T70 WeakPolarHBondContact CA-O 3.49Å; P67-I76 HydrophobicContact CB-CD1 4.32Å; P67-I76 HydrophobicContact CG-CD1 4.16Å; P67-I76 HydrophobicContact CG-CG1 4.26Å; P67-I76 HydrophobicContact CG-CG2 4.13Å
68	V	81.4	Confident	84.7	Confident	80 Å²	80	57.6 Å²	57.6	49%	0.485	31%	0.307	S	S	.	.	H	α-helix	trans	-70.8	-33.4	174.2	-177.9	0	0	0	0	111.1	I65 L66 S93	I65-V68 HydrophobicContact CD1-CB 4.29Å; I65-V68 HydrophobicContact CD1-CG2 4Å; I65-V68 WeakPolarHBondContact O-CB 3.5Å; I65-V68 WeakPolarHBondContact O-CG2 3.4Å; I65-V68 PolarHBondContact O-N 2.94Å; L66-V68 PolarHBondContact O-N 3.49Å; L66-V68 VanDerWaalsContact O-N 3.13Å; V68-S93 VanDerWaalsContact CG2-OG 3.24Å; V68-S93 WeakPolarHBondContact CG2-OG 3.44Å
69	F	81.9	Confident	83.6	Confident	153 Å²	153	61.7 Å²	61.7	67%	0.671	33%	0.327	S	S	*	.	H	α-helix	trans	-103.4	-21.5	-173	-59.7	-59.3	0	0	0	113.9	I65 L66 P67	I65-F69 HydrophobicContact CB-CE2 4.48Å; I65-F69 HydrophobicContact CD1-CE2 4.09Å; I65-F69 HydrophobicContact CD1-CZ 4.46Å; I65-F69 HydrophobicContact CG1-CD2 3.94Å; I65-F69 HydrophobicContact CG1-CE2 3.31Å; I65-F69 HydrophobicContact CG1-CZ 4.1Å; I65-F69 HydrophobicContact CG2-CE2 4.5Å; L66-F69 PolarHBondContact O-N 2.99Å; P67-F69 VanDerWaalsContact C-N 3.34Å
70	T	82.1	Confident	82.6	Confident	48 Å²	48	62.3 Å²	62.3	29%	0.294	33%	0.331	S	S	.	.			trans	-146.9	150.2	-178.6	-175.7	0	0	0	0	112.1	L66 P67 N72	L66-T70 HydrophobicContact CD1-CG2 3.76Å; L66-T70 HydrophobicContact CD2-CG2 4.39Å; L66-T70 HydrophobicContact CG-CG2 3.64Å; L66-T70 WeakPolarHBondContact O-CG2 3.45Å; L66-T70 PolarHBondContact O-N 3.17Å; P67-T70 WeakPolarHBondContact CA-O 3.49Å; T70-N72 WeakPolarHBondContact OG1-CB 3.32Å; T70-N72 PolarHBondContact OG1-N 3.24Å; T70-N72 VanDerWaalsContact OG1-N 3.11Å
71	K	82.9	Confident	81.7	Confident	201 Å²	201	65.8 Å²	65.8	87%	0.874	35%	0.352	S	S	*	.			trans	-100.6	7.2	170.8	-62.6	-176.5	-179.4	179.5	0	112.5	K73	K71-K73 PolarHBondContact O-N 2.91Å
72	N	84.4	Confident	81	Confident	86 Å²	86	69.2 Å²	69.2	46%	0.46	37%	0.371	S	S	.	.			trans	-69.6	103.6	-179.3	-175.7	-20.1	0	0	0	110.5	T70 A74 A75 I76	T70-N72 WeakPolarHBondContact OG1-CB 3.32Å; T70-N72 PolarHBondContact OG1-N 3.24Å; T70-N72 VanDerWaalsContact OG1-N 3.11Å; N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 3.47Å; N72-A74 WeakPolarHBondContact OD1-CB 3.4Å; N72-A74 PolarHBondContact OD1-N 3.41Å; N72-A75 HydrophobicContact CB-CB 4.13Å; N72-A75 PolarHBondContact O-N 3.16Å; N72-A75 VanDerWaalsContact O-N 3.15Å; N72-A75 PolarHBondContact OD1-N 3.29Å; N72-I76 WeakPolarHBondContact O-CG1 3.42Å; N72-I76 PolarHBondContact O-N 3.5Å
73	K	80.9	Confident	80.3	Confident	184 Å²	184	73.8 Å²	73.8	80%	0.8	40%	0.396	S	S	*	.	H	α-helix	trans	-59.1	-34.5	-179.2	-66.7	-173.4	178.2	-177.9	0	113.3	K71 I76 G77	K71-K73 PolarHBondContact O-N 2.91Å; K73-I76 PolarHBondContact O-N 2.91Å; K73-G77 PolarHBondContact O-N 3.49Å
74	A	80.3	Confident	79.9	Confident	74 Å²	74	74.7 Å²	74.7	61%	0.612	40%	0.397	S	S	*	.	H	α-helix	trans	-68.5	-37.4	178.9	0	0	0	0	0	111.6	N72	N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 3.47Å; N72-A74 WeakPolarHBondContact OD1-CB 3.4Å; N72-A74 PolarHBondContact OD1-N 3.41Å
75	A	76.3	Confident	79.9	Confident	31 Å²	31	76.5 Å²	76.5	26%	0.256	41%	0.407	S	S	.	.	H	α-helix	trans	-72.6	-40.8	176.4	0	0	0	0	0	112	L66 N72 K78	L66-A75 HydrophobicContact CD2-CB 4.14Å; L66-A75 WeakPolarHBondContact CD2-O 3.49Å; N72-A75 HydrophobicContact CB-CB 4.13Å; N72-A75 PolarHBondContact O-N 3.16Å; N72-A75 VanDerWaalsContact O-N 3.15Å; N72-A75 PolarHBondContact OD1-N 3.29Å; A75-K78 PolarHBondContact O-N 2.86Å
76	I	76.8	Confident	79.7	Confident	35 Å²	35	77.3 Å²	77.3	18%	0.179	41%	0.411	C	S	.	.	H	α-helix	trans	-65.2	-42	177.1	-64.8	165.3	0	0	0	110.7	L66 P67 N72 K73 K78 R84 R97	L66-I76 HydrophobicContact CD2-CG1 4.41Å; L66-I76 HydrophobicContact CG-CG1 4.41Å; P67-I76 HydrophobicContact CB-CD1 4.32Å; P67-I76 HydrophobicContact CG-CD1 4.16Å; P67-I76 HydrophobicContact CG-CG1 4.26Å; P67-I76 HydrophobicContact CG-CG2 4.13Å; N72-I76 WeakPolarHBondContact O-CG1 3.42Å; N72-I76 PolarHBondContact O-N 3.5Å; K73-I76 PolarHBondContact O-N 2.91Å; I76-K78 PolarHBondContact O-N 2.78Å; I76-K78 VanDerWaalsContact O-O 3.12Å; I76-R84 PolarHBondContact O-NH2 2.97Å; I76-R97 PolarHBondContact O-NH1 3.07Å
77	G	72.2	Confident	79.8	Confident	45 Å²	45	79.6 Å²	79.6	46%	0.464	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-16.8	-179.5	0	0	0	0	0	114.5	K73 R97	K73-G77 PolarHBondContact O-N 3.49Å; G77-R97 PolarHBondContact O-NH2 3.02Å
78	K	78.5	Confident	79.9	Confident	149 Å²	149	78 Å²	78	65%	0.648	41%	0.412	S	S	*	.	S	Bend	trans	-65.9	149.7	170.8	-68.6	-173.6	179.3	-169.6	0	111.1	A75 I76 V80	A75-K78 PolarHBondContact O-N 2.86Å; I76-K78 PolarHBondContact O-N 2.78Å; I76-K78 VanDerWaalsContact O-O 3.12Å; K78-V80 PolarHBondContact O-N 2.86Å
79	M	73.6	Confident	80.1	Confident	87 Å²	87	76 Å²	76	43%	0.429	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-48.4	138.6	175.4	-163.9	-156.6	158.6	0	0	111.3	R84 Y106	M79-R84 PolarHBondContact O-NH1 3.06Å; M79-Y106 HydrophobicContact CE-CD1 4.37Å; M79-Y106 HydrophobicContact CE-CD2 3.06Å; M79-Y106 HydrophobicContact CE-CE1 4.36Å; M79-Y106 HydrophobicContact CE-CE2 3.07Å; M79-Y106 HydrophobicContact CE-CG 3.75Å; M79-Y106 HydrophobicContact SD-CD2 3.61Å; M79-Y106 HydrophobicContact SD-CE2 3.36Å; M79-Y106 WeakPolarHBondContact SD-CE2 3.37Å
80	V	76.3	Confident	80.2	Confident	13 Å²	13	73.7 Å²	73.7	8%	0.079	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-87.9	120	-174.6	-169.3	0	0	0	0	110.6	I62 D64 K78 R84 L85	I62-V80 HydrophobicContact CD1-CB 4.07Å; I62-V80 HydrophobicContact CD1-CG2 3.4Å; D64-V80 HydrophobicContact CB-CG1 4.39Å; K78-V80 PolarHBondContact O-N 2.86Å; V80-R84 HydrophobicContact CG1-CB 3.44Å; V80-R84 VanDerWaalsContact CG1-CB 3.44Å; V80-R84 HydrophobicContact CG1-CG 4.48Å; V80-L85 HydrophobicContact CB-CD2 4.01Å; V80-L85 HydrophobicContact CG1-CD2 3.55Å; V80-L85 HydrophobicContact CG1-CG 3.88Å
81	T	79.3	Confident	80.4	Confident	81 Å²	81	74 Å²	74	50%	0.497	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-71.6	156.3	175.2	60.9	0	0	0	0	111.8	N83 R84 L85	T81-N83 VanDerWaalsContact C-N 3.28Å; T81-N83 PolarHBondContact O-N 2.8Å; T81-R84 WeakPolarHBondContact O-CB 3.42Å; T81-R84 PolarHBondContact O-N 2.79Å; T81-R84 WeakPolarHBondContact OG1-CG 3.38Å; T81-R84 PolarHBondContact OG1-N 3.44Å; T81-L85 PolarHBondContact O-N 3.44Å; T81-L85 VanDerWaalsContact O-N 3.1Å
82	N	79.1	Confident	80.8	Confident	72 Å²	72	70.7 Å²	70.7	39%	0.385	39%	0.387	S	S	.	.	H	α-helix	trans	-50.5	-43.5	175.6	-68.9	-16.6	0	0	0	113.5	R84 L85 I86	N82-R84 VanDerWaalsContact C-N 3.32Å; N82-R84 PolarHBondContact O-N 3.47Å; N82-L85 WeakPolarHBondContact O-CB 3.39Å; N82-L85 PolarHBondContact O-N 2.82Å; N82-L85 VanDerWaalsContact O-N 3.17Å; N82-I86 VanDerWaalsContact O-CD1 3.31Å; N82-I86 WeakPolarHBondContact O-CD1 3.11Å; N82-I86 VanDerWaalsContact O-CG1 3.23Å; N82-I86 WeakPolarHBondContact O-CG1 3.23Å; N82-I86 PolarHBondContact O-N 3.1Å
83	N	75.9	Confident	81	Confident	108 Å²	108	67.6 Å²	67.6	58%	0.578	37%	0.372	S	S	*	.	H	α-helix	trans	-60.4	-41.5	178.9	-70.1	24.3	0	0	0	112.3	T81 I86 L87	T81-N83 VanDerWaalsContact C-N 3.28Å; T81-N83 PolarHBondContact O-N 2.8Å; N83-I86 PolarHBondContact O-N 3.17Å; N83-L87 WeakPolarHBondContact O-CB 3.44Å; N83-L87 VanDerWaalsContact O-CG 3.27Å; N83-L87 WeakPolarHBondContact O-CG 3.18Å; N83-L87 PolarHBondContact O-N 3.19Å
84	R	81.6	Confident	81.5	Confident	32 Å²	32	58.9 Å²	58.9	12%	0.121	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-39.9	176.2	-75.9	172.7	61.4	-175.3	3.7	111.9	D64 I65 L66 I76 M79 V80 T81 N82 G88	D64-R84 VanDerWaalsContact CG-NH2 3.27Å; D64-R84 IonicContact OD1-CZ 3.44Å; D64-R84 IonicContact OD1-NE 2.9Å; D64-R84 PolarHBondContact OD1-NE 2.91Å; D64-R84 IonicContact OD1-NH2 3.17Å; D64-R84 PolarHBondContact OD1-NH2 2.91Å; D64-R84 VanDerWaalsContact OD1-NH2 3.17Å; D64-R84 IonicContact OD2-CZ 3.67Å; D64-R84 IonicContact OD2-NE 3.92Å; D64-R84 IonicContact OD2-NH2 2.67Å; D64-R84 PolarHBondContact OD2-NH2 2.94Å; I65-R84 HydrophobicContact CG2-CB 4.29Å; I65-R84 HydrophobicContact CG2-CG 4.23Å; I65-R84 PolarHBondContact N-O 2.66Å; L66-R84 VanDerWaalsContact CD2-CZ 3.48Å; I76-R84 PolarHBondContact O-NH2 2.97Å; M79-R84 PolarHBondContact O-NH1 3.06Å; V80-R84 HydrophobicContact CG1-CB 3.44Å; V80-R84 VanDerWaalsContact CG1-CB 3.44Å; V80-R84 HydrophobicContact CG1-CG 4.48Å; T81-R84 WeakPolarHBondContact O-CB 3.42Å; T81-R84 PolarHBondContact O-N 2.79Å; T81-R84 WeakPolarHBondContact OG1-CG 3.38Å; T81-R84 PolarHBondContact OG1-N 3.44Å; N82-R84 VanDerWaalsContact C-N 3.32Å; N82-R84 PolarHBondContact O-N 3.47Å; R84-G88 PolarHBondContact O-N 3.25Å
85	L	84.5	Confident	82	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.199	31%	0.309	C	S	.	.	H	α-helix	trans	-61.4	-51.2	175.6	-62.1	176.5	0	0	0	110.6	I62 P63 V80 T81 N82 L87 G88 V89	I62-L85 HydrophobicContact CB-CD2 4.48Å; P63-L85 HydrophobicContact CG-CB 4.27Å; P63-L85 HydrophobicContact CG-CD2 4.13Å; P63-L85 WeakPolarHBondContact O-CD2 3.22Å; V80-L85 HydrophobicContact CB-CD2 4.01Å; V80-L85 HydrophobicContact CG1-CD2 3.55Å; V80-L85 HydrophobicContact CG1-CG 3.88Å; T81-L85 PolarHBondContact O-N 3.44Å; T81-L85 VanDerWaalsContact O-N 3.1Å; N82-L85 WeakPolarHBondContact O-CB 3.39Å; N82-L85 PolarHBondContact O-N 2.82Å; N82-L85 VanDerWaalsContact O-N 3.17Å; L85-L87 PolarHBondContact O-N 2.78Å; L85-G88 WeakPolarHBondContact O-CA 3.34Å; L85-G88 PolarHBondContact O-N 3.25Å; L85-G88 VanDerWaalsContact O-N 3.16Å; L85-V89 WeakPolarHBondContact O-CG2 3.13Å; L85-V89 PolarHBondContact O-N 2.87Å
86	I	82.7	Confident	82.9	Confident	32 Å²	32	54.5 Å²	54.5	16%	0.164	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-47.7	-177.3	-62.6	154.8	0	0	0	111	F12 N82 N83 G88 V89 I90	F12-I86 HydrophobicContact CB-CD1 3.31Å; F12-I86 HydrophobicContact CB-CG1 4.11Å; F12-I86 HydrophobicContact CD1-CD1 3.87Å; F12-I86 HydrophobicContact CD1-CG1 3.94Å; F12-I86 HydrophobicContact CD2-CD1 4.26Å; F12-I86 HydrophobicContact CD2-CG1 4.13Å; F12-I86 HydrophobicContact CE1-CG1 4.4Å; F12-I86 HydrophobicContact CG-CD1 3.57Å; F12-I86 HydrophobicContact CG-CG1 3.8Å; N82-I86 VanDerWaalsContact O-CD1 3.31Å; N82-I86 WeakPolarHBondContact O-CD1 3.11Å; N82-I86 VanDerWaalsContact O-CG1 3.23Å; N82-I86 WeakPolarHBondContact O-CG1 3.23Å; N82-I86 PolarHBondContact O-N 3.1Å; N83-I86 PolarHBondContact O-N 3.17Å; I86-G88 VanDerWaalsContact C-N 3.26Å; I86-G88 PolarHBondContact O-N 3.49Å; I86-V89 WeakPolarHBondContact O-CB 3.35Å; I86-V89 PolarHBondContact O-N 3.02Å; I86-I90 HydrophobicContact CG2-CD1 3.97Å; I86-I90 WeakPolarHBondContact O-CG1 3.37Å; I86-I90 PolarHBondContact O-N 3.46Å
87	L	82.3	Confident	83.6	Confident	88 Å²	88	54.1 Å²	54.1	46%	0.461	29%	0.294	S	S	.	.	H	α-helix	trans	-63.1	-37	176.9	-70.5	174.3	0	0	0	111.1	I65 N83 L85 V89 I90 A91	I65-L87 HydrophobicContact CB-CB 3.73Å; I65-L87 HydrophobicContact CD1-CB 4.44Å; I65-L87 HydrophobicContact CG1-CB 3.94Å; I65-L87 HydrophobicContact CG2-CB 3.8Å; I65-L87 HydrophobicContact CG2-CD1 4.26Å; N83-L87 WeakPolarHBondContact O-CB 3.44Å; N83-L87 VanDerWaalsContact O-CG 3.27Å; N83-L87 WeakPolarHBondContact O-CG 3.18Å; N83-L87 PolarHBondContact O-N 3.19Å; L85-L87 PolarHBondContact O-N 2.78Å; L87-V89 VanDerWaalsContact C-N 3.35Å; L87-I90 PolarHBondContact O-N 3.29Å; L87-A91 WeakPolarHBondContact O-CB 3.37Å; L87-A91 PolarHBondContact O-N 3.32Å
88	G	84.8	Confident	84.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-44.2	173.4	0	0	0	0	0	111.8	R84 L85 I86 A91 K92 S93	R84-G88 PolarHBondContact O-N 3.25Å; L85-G88 WeakPolarHBondContact O-CA 3.34Å; L85-G88 PolarHBondContact O-N 3.25Å; L85-G88 VanDerWaalsContact O-N 3.16Å; I86-G88 VanDerWaalsContact C-N 3.26Å; I86-G88 PolarHBondContact O-N 3.49Å; G88-A91 CarbonylContact O-C 3.59Å; G88-A91 PolarHBondContact O-N 2.93Å; G88-K92 CarbonylContact O-C 3.47Å; G88-K92 WeakPolarHBondContact O-CA 3.27Å; G88-K92 PolarHBondContact O-N 3.28Å; G88-S93 CarbonylContact C-O 3.58Å; G88-S93 WeakPolarHBondContact CA-O 3.48Å; G88-S93 PolarHBondContact O-N 3.02Å
89	V	85.4	Confident	85.4	Confident	40 Å²	40	48.5 Å²	48.5	24%	0.242	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-47.5	174.2	173.8	0	0	0	0	111.5	P63 L85 I86 L87 A91 K92 Y142 L144	P63-V89 HydrophobicContact CB-CG2 3.69Å; P63-V89 HydrophobicContact CG-CG2 3.67Å; L85-V89 WeakPolarHBondContact O-CG2 3.13Å; L85-V89 PolarHBondContact O-N 2.87Å; I86-V89 WeakPolarHBondContact O-CB 3.35Å; I86-V89 PolarHBondContact O-N 3.02Å; L87-V89 VanDerWaalsContact C-N 3.35Å; V89-A91 VanDerWaalsContact C-N 3.34Å; V89-A91 PolarHBondContact O-N 2.91Å; V89-K92 PolarHBondContact O-N 3.33Å; V89-Y142 HydrophobicContact CG2-CD1 3.97Å; V89-Y142 HydrophobicContact CG2-CE1 3.84Å; V89-L144 HydrophobicContact CG1-CD1 3.61Å; V89-L144 HydrophobicContact CG1-CD2 4.22Å; V89-L144 HydrophobicContact CG1-CG 3.72Å; V89-L144 HydrophobicContact CG2-CD2 4.36Å
90	I	85.1	Confident	86.3	Confident	103 Å²	103	45.4 Å²	45.4	53%	0.528	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-44.4	-179.5	-67.9	167.9	0	0	0	110.7	I86 L87 K92	I86-I90 HydrophobicContact CG2-CD1 3.97Å; I86-I90 WeakPolarHBondContact O-CG1 3.37Å; I86-I90 PolarHBondContact O-N 3.46Å; L87-I90 PolarHBondContact O-N 3.29Å; I90-K92 PolarHBondContact O-N 3.48Å
91	A	86.6	Confident	87.1	Confident	55 Å²	55	44.8 Å²	44.8	46%	0.455	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.9	177.6	0	0	0	0	0	113.5	I65 L87 G88 V89 S93	I65-A91 HydrophobicContact CD1-CB 3.25Å; L87-A91 WeakPolarHBondContact O-CB 3.37Å; L87-A91 PolarHBondContact O-N 3.32Å; G88-A91 CarbonylContact O-C 3.59Å; G88-A91 PolarHBondContact O-N 2.93Å; V89-A91 VanDerWaalsContact C-N 3.34Å; V89-A91 PolarHBondContact O-N 2.91Å; A91-S93 PolarHBondContact O-N 3.41Å
92	K	89.4	Confident	87.7	Confident	131 Å²	131	41.2 Å²	41.2	57%	0.57	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	34.1	-172.2	-57.5	-177	177.6	179	0	113	G88 V89 I90 T141 Y142	G88-K92 CarbonylContact O-C 3.47Å; G88-K92 WeakPolarHBondContact O-CA 3.27Å; G88-K92 PolarHBondContact O-N 3.28Å; V89-K92 PolarHBondContact O-N 3.33Å; I90-K92 PolarHBondContact O-N 3.48Å; K92-T141 HydrophobicContact CB-CG2 3.89Å; K92-T141 CarbonylContact O-C 2.88Å; K92-T141 VanDerWaalsContact O-CA 3.29Å; K92-T141 WeakPolarHBondContact O-CA 3.28Å; K92-Y142 WeakPolarHBondContact CB-O 3.35Å; K92-Y142 PolarHBondContact O-N 3.35Å
93	S	88.9	Confident	88.2	Confident	21 Å²	21	41.4 Å²	41.4	15%	0.147	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.7	179.3	-163.6	0	0	0	0	110.5	P63 D64 V68 G88 A91	P63-S93 WeakPolarHBondContact CA-O 3.36Å; D64-S93 PolarHBondContact N-O 3.1Å; V68-S93 VanDerWaalsContact CG2-OG 3.24Å; V68-S93 WeakPolarHBondContact CG2-OG 3.44Å; G88-S93 CarbonylContact C-O 3.58Å; G88-S93 WeakPolarHBondContact CA-O 3.48Å; G88-S93 PolarHBondContact O-N 3.02Å; A91-S93 PolarHBondContact O-N 3.41Å
94	A	91.7	Very high	89	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	171.3	178.4	0	0	0	0	0	111.4	F61 I62 S139 M140 Y142	F61-A94 HydrophobicContact CD2-CB 4.07Å; F61-A94 HydrophobicContact CE2-CB 3.26Å; F61-A94 HydrophobicContact CZ-CB 3.67Å; I62-A94 CarbonylContact O-C 3.55Å; I62-A94 VanDerWaalsContact O-CA 3.22Å; I62-A94 WeakPolarHBondContact O-CA 3.31Å; I62-A94 WeakPolarHBondContact O-CB 3.33Å; A94-S139 CarbonylContact O-C 3.6Å; A94-S139 WeakPolarHBondContact O-CA 3.21Å; A94-M140 CarbonylContact C-O 3.47Å; A94-M140 PolarHBondContact N-O 3.23Å; A94-M140 PolarHBondContact O-N 3.41Å; A94-Y142 HydrophobicContact CB-CD2 3.55Å; A94-Y142 HydrophobicContact CB-CG 3.93Å
95	S	91.9	Very high	89.4	Confident	10 Å²	10	34.8 Å²	34.8	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	146.1	170.4	57.2	0	0	0	0	111.6	I62 G138	I62-S95 PolarHBondContact N-O 3.26Å; I62-S95 PolarHBondContact O-N 3.23Å; S95-G138 CarbonylContact C-O 3.47Å; S95-G138 WeakPolarHBondContact CA-O 3.4Å; S95-G138 WeakPolarHBondContact CB-O 3.39Å
96	V	94.4	Very high	89.6	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.4	159.1	174.3	0	0	0	0	107.1	A59 H60 F61 L136 M137 G138 M140 F152	A59-V96 HydrophobicContact CB-CG1 4.43Å; H60-V96 WeakPolarHBondContact O-CA 3.26Å; F61-V96 HydrophobicContact CB-CG2 3.84Å; F61-V96 HydrophobicContact CD2-CG2 3.74Å; F61-V96 HydrophobicContact CG-CG2 4.03Å; V96-L136 VanDerWaalsContact CB-O 3.27Å; V96-L136 WeakPolarHBondContact CB-O 3.44Å; V96-L136 HydrophobicContact CG2-CB 4.48Å; V96-L136 WeakPolarHBondContact CG2-O 3.46Å; V96-M137 HydrophobicContact CG1-CG 4.23Å; V96-G138 PolarHBondContact N-O 3.43Å; V96-G138 PolarHBondContact O-N 3.36Å; V96-M140 HydrophobicContact CG2-CE 3.44Å; V96-M140 VanDerWaalsContact CG2-CE 3.44Å; V96-F152 HydrophobicContact CG1-CE2 3.97Å; V96-F152 HydrophobicContact CG1-CZ 3.85Å; V96-F152 HydrophobicContact CG2-CD2 3.83Å; V96-F152 HydrophobicContact CG2-CE2 3.68Å; V96-F152 HydrophobicContact CG2-CG 4.46Å; V96-F152 HydrophobicContact CG2-CZ 4.19Å
97	R	92.4	Very high	89.7	Confident	27 Å²	27	41.1 Å²	41.1	10%	0.102	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	168.5	179.5	65.9	-178.9	-72.6	163	-7.8	109.8	A59 H60 I62 I76 G77 D99	A59-R97 WeakPolarHBondContact CA-O 3.32Å; H60-R97 VanDerWaalsContact CD2-CG 3.49Å; H60-R97 WeakPolarHBondContact CD2-CG 3.05Å; H60-R97 PolarHBondContact CD2-O 3.19Å; H60-R97 PolarHBondContact N-O 3.13Å; H60-R97 VanDerWaalsContact NE2-CG 3.3Å; H60-R97 WeakPolarHBondContact NE2-CG 3.21Å; H60-R97 PolarHBondContact O-N 3.26Å; H60-R97 VanDerWaalsContact O-N 3.1Å; I62-R97 HydrophobicContact CD1-CG 4.27Å; I62-R97 HydrophobicContact CG1-CG 4.17Å; I76-R97 PolarHBondContact O-NH1 3.07Å; G77-R97 PolarHBondContact O-NH2 3.02Å; R97-D99 IonicContact CZ-OD1 3.27Å; R97-D99 VanDerWaalsContact CZ-OD1 3.27Å; R97-D99 IonicContact CZ-OD2 3.6Å; R97-D99 IonicContact NE-OD1 3.9Å; R97-D99 PolarHBondContact NE-OD1 2.75Å; R97-D99 IonicContact NE-OD2 3.53Å; R97-D99 PolarHBondContact NE-OD2 3.21Å; R97-D99 VanDerWaalsContact NE-OD2 3.11Å; R97-D99 IonicContact NH2-OD1 3.18Å; R97-D99 PolarHBondContact NH2-OD1 2.9Å; R97-D99 IonicContact NH2-OD2 3.65Å
98	V	94.3	Very high	90	Very high	50 Å²	50	38.5 Å²	38.5	30%	0.303	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.6	178.5	180	0	0	0	0	108.9	L53 R57 V58 A59 M137	L53-V98 HydrophobicContact CD1-CG1 4.25Å; L53-V98 HydrophobicContact CD1-CG2 3.77Å; R57-V98 HydrophobicContact CB-CG1 3.72Å; R57-V98 HydrophobicContact CG-CG1 4.13Å; V58-V98 VanDerWaalsContact O-CA 3.31Å; V58-V98 WeakPolarHBondContact O-CA 3.48Å; A59-V98 HydrophobicContact CB-CG2 4.4Å; V98-M137 HydrophobicContact CG2-CG 4.47Å; V98-M137 HydrophobicContact CG2-SD 3.61Å
99	D	93.3	Very high	90.4	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.134	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	169.8	176.9	-69.6	-18.7	0	0	0	110	V58 H60 R97 D103	V58-D99 PolarHBondContact N-O 3.45Å; V58-D99 PolarHBondContact O-N 2.85Å; H60-D99 IonicContact CE1-OD2 2.73Å; H60-D99 PolarHBondContact CE1-OD2 3.3Å; H60-D99 VanDerWaalsContact CE1-OD2 3.29Å; H60-D99 IonicContact NE2-OD2 3.37Å; H60-D99 PolarHBondContact NE2-OD2 3.43Å; R97-D99 IonicContact CZ-OD1 3.27Å; R97-D99 VanDerWaalsContact CZ-OD1 3.27Å; R97-D99 IonicContact CZ-OD2 3.6Å; R97-D99 IonicContact NE-OD1 3.9Å; R97-D99 PolarHBondContact NE-OD1 2.75Å; R97-D99 IonicContact NE-OD2 3.53Å; R97-D99 PolarHBondContact NE-OD2 3.21Å; R97-D99 VanDerWaalsContact NE-OD2 3.11Å; R97-D99 IonicContact NH2-OD1 3.18Å; R97-D99 PolarHBondContact NH2-OD1 2.9Å; R97-D99 IonicContact NH2-OD2 3.65Å; D99-D103 HydrophobicContact CB-CB 4.14Å
100	S	93.5	Very high	90.8	Very high	23 Å²	23	44.5 Å²	44.5	16%	0.161	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	162.6	175.5	72.7	0	0	0	0	111.9	N56 A102 D103 F104	N56-S100 VanDerWaalsContact O-CA 3.31Å; N56-S100 WeakPolarHBondContact O-CA 3.49Å; S100-A102 PolarHBondContact O-N 3.38Å; S100-D103 PolarHBondContact O-N 2.86Å; S100-D103 WeakPolarHBondContact OG-CB 3.35Å; S100-D103 PolarHBondContact OG-N 3.06Å; S100-D103 PolarHBondContact OG-OD2 2.83Å; S100-F104 WeakPolarHBondContact O-CB 3.5Å; S100-F104 PolarHBondContact O-N 2.86Å
101	L	93.1	Very high	91.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-38.1	172	-78.6	162.6	0	0	0	111.5	Y28 L30 Y33 L39 Y52 N56 V58 F104 A105 I110	Y28-L101 HydrophobicContact CD2-CB 4.24Å; Y28-L101 HydrophobicContact CG-CB 4.36Å; L30-L101 HydrophobicContact CD2-CD1 3.5Å; L30-L101 VanDerWaalsContact CD2-CD1 3.5Å; Y33-L101 HydrophobicContact CD1-CD2 4.46Å; Y33-L101 HydrophobicContact CD2-CD1 3.98Å; Y33-L101 HydrophobicContact CE1-CD2 4.31Å; Y33-L101 HydrophobicContact CE2-CD1 4.03Å; Y33-L101 HydrophobicContact CG-CD1 4.46Å; L39-L101 HydrophobicContact CD1-CD2 3.65Å; Y52-L101 HydrophobicContact CD2-CD1 4.47Å; Y52-L101 HydrophobicContact CD2-CD2 4.09Å; Y52-L101 HydrophobicContact CD2-CG 4.35Å; Y52-L101 HydrophobicContact CE2-CD1 3.79Å; Y52-L101 HydrophobicContact CE2-CD2 4.21Å; Y52-L101 HydrophobicContact CE2-CG 4.01Å; N56-L101 WeakPolarHBondContact OD1-CB 3.45Å; N56-L101 WeakPolarHBondContact OD1-CG 3.33Å; N56-L101 PolarHBondContact OD1-N 2.88Å; V58-L101 HydrophobicContact CG2-CD2 3.58Å; V58-L101 HydrophobicContact CG2-CG 3.99Å; L101-F104 PolarHBondContact O-N 3.25Å; L101-A105 WeakPolarHBondContact O-CB 3.45Å; L101-A105 PolarHBondContact O-N 2.93Å; L101-I110 HydrophobicContact CD2-CD1 3.8Å
102	A	90.7	Very high	91.8	Very high	6 Å²	6	42 Å²	42	5%	0.05	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-44.5	-179.4	0	0	0	0	0	112.5	K24 Y28 S100 A105 Y106	K24-A102 HydrophobicContact CB-CB 3.86Å; K24-A102 HydrophobicContact CD-CB 4.4Å; Y28-A102 HydrophobicContact CD2-CB 4.47Å; Y28-A102 HydrophobicContact CE2-CB 3.95Å; S100-A102 PolarHBondContact O-N 3.38Å; A102-A105 PolarHBondContact O-N 3.32Å; A102-Y106 PolarHBondContact O-N 2.86Å
103	D	90	Very high	92.1	Very high	76 Å²	76	37.2 Å²	37.2	41%	0.406	21%	0.208	S	C	.	.	H	α-helix	trans	-67.5	-40.9	176.6	-64.4	-39.6	0	0	0	111.1	D99 S100 Y106	D99-D103 HydrophobicContact CB-CB 4.14Å; S100-D103 PolarHBondContact O-N 2.86Å; S100-D103 WeakPolarHBondContact OG-CB 3.35Å; S100-D103 PolarHBondContact OG-N 3.06Å; S100-D103 PolarHBondContact OG-OD2 2.83Å; D103-Y106 PolarHBondContact O-N 2.96Å
104	F	92.2	Very high	92.4	Very high	1 Å²	1	39.7 Å²	39.7	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-46.4	174.8	173.6	-101.5	0	0	0	111.8	L39 V41 R43 H48 V58 H60 S100 L101 I110	L39-F104 HydrophobicContact CB-CE1 3.56Å; L39-F104 HydrophobicContact CB-CZ 3.91Å; L39-F104 HydrophobicContact CD1-CD1 4.31Å; L39-F104 HydrophobicContact CD1-CE1 4.08Å; V41-F104 HydrophobicContact CB-CE1 4.43Å; V41-F104 HydrophobicContact CG2-CD1 3.73Å; V41-F104 HydrophobicContact CG2-CE1 3.16Å; V41-F104 HydrophobicContact CG2-CZ 3.68Å; R43-F104 PolarHBondContact NH2-O 3.04Å; H48-F104 AromaticContact CD2-CE2 3.5Å; H48-F104 VanDerWaalsContact CD2-CE2 3.5Å; H48-F104 WeakPolarHBondContact CD2-CE2 3.46Å; H48-F104 AromaticContact NE2-CE2 3.85Å; V58-F104 HydrophobicContact CB-CB 4.13Å; V58-F104 HydrophobicContact CB-CD2 4.28Å; V58-F104 HydrophobicContact CB-CG 4.09Å; V58-F104 HydrophobicContact CG1-CB 4.33Å; V58-F104 HydrophobicContact CG1-CD1 4.11Å; V58-F104 HydrophobicContact CG1-CD2 3.6Å; V58-F104 HydrophobicContact CG1-CE1 4.33Å; V58-F104 HydrophobicContact CG1-CE2 3.9Å; V58-F104 HydrophobicContact CG1-CG 3.74Å; V58-F104 HydrophobicContact CG1-CZ 4.26Å; V58-F104 HydrophobicContact CG2-CB 4.14Å; V58-F104 HydrophobicContact CG2-CD1 4.31Å; V58-F104 HydrophobicContact CG2-CG 4.19Å; H60-F104 HydrophobicContact CB-CD2 4.11Å; H60-F104 HydrophobicContact CB-CE2 3.95Å; H60-F104 AromaticContact ND1-CD2 3.4Å; H60-F104 WeakPolarHBondContact ND1-CD2 3.46Å; H60-F104 AromaticContact ND1-CE2 3.9Å; S100-F104 WeakPolarHBondContact O-CB 3.5Å; S100-F104 PolarHBondContact O-N 2.86Å; L101-F104 PolarHBondContact O-N 3.25Å; F104-I110 HydrophobicContact CD1-CD1 4.45Å
105	A	91.2	Very high	92.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.2	-34.8	-179.1	0	0	0	0	0	112.2	Y28 V41 R43 L101 A102 G107 S108 I110	Y28-A105 HydrophobicContact CE1-CB 4.45Å; Y28-A105 WeakPolarHBondContact OH-CB 3.38Å; V41-A105 WeakPolarHBondContact CG1-O 3.48Å; R43-A105 PolarHBondContact NH1-O 2.74Å; L101-A105 WeakPolarHBondContact O-CB 3.45Å; L101-A105 PolarHBondContact O-N 2.93Å; A102-A105 PolarHBondContact O-N 3.32Å; A105-G107 PolarHBondContact O-N 3.18Å; A105-S108 WeakPolarHBondContact O-CB 3.4Å; A105-S108 PolarHBondContact O-N 2.81Å; A105-I110 HydrophobicContact CB-CD1 3.9Å; A105-I110 HydrophobicContact CB-CG1 3.84Å
106	Y	87.5	Confident	92.5	Very high	140 Å²	140	42.4 Å²	42.4	55%	0.549	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	46.1	-176.4	-165.1	-113.1	0	0	0	112.4	M79 A102 D103 S108	M79-Y106 HydrophobicContact CE-CD1 4.37Å; M79-Y106 HydrophobicContact CE-CD2 3.06Å; M79-Y106 HydrophobicContact CE-CE1 4.36Å; M79-Y106 HydrophobicContact CE-CE2 3.07Å; M79-Y106 HydrophobicContact CE-CG 3.75Å; M79-Y106 HydrophobicContact SD-CD2 3.61Å; M79-Y106 HydrophobicContact SD-CE2 3.36Å; M79-Y106 WeakPolarHBondContact SD-CE2 3.37Å; A102-Y106 PolarHBondContact O-N 2.86Å; D103-Y106 PolarHBondContact O-N 2.96Å; Y106-S108 VanDerWaalsContact C-N 3.26Å; Y106-S108 PolarHBondContact O-N 2.84Å
107	G	85.9	Confident	92.3	Very high	63 Å²	63	50.9 Å²	50.9	65%	0.649	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-3.2	179.5	0	0	0	0	0	116.1	A105	A105-G107 PolarHBondContact O-N 3.18Å
108	S	88.3	Confident	92.1	Very high	32 Å²	32	54.5 Å²	54.5	22%	0.224	29%	0.288	C	S	.	.	S	Bend	trans	-88	158.1	175.2	177	0	0	0	0	112.1	V41 P42 A105 Y106	V41-S108 WeakPolarHBondContact CG1-OG 3.42Å; P42-S108 PolarHBondContact O-OG 2.85Å; A105-S108 WeakPolarHBondContact O-CB 3.4Å; A105-S108 PolarHBondContact O-N 2.81Å; Y106-S108 VanDerWaalsContact C-N 3.26Å; Y106-S108 PolarHBondContact O-N 2.84Å
109	E	91.8	Very high	91.7	Very high	150 Å²	150	53.2 Å²	53.2	70%	0.701	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-63.1	143	168.6	-172.2	175.6	-172.9	0	0	110.6
110	I	95	Very high	91.3	Very high	16 Å²	16	58.1 Å²	58.1	8%	0.082	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-104	119.3	176.6	-53.7	178.8	0	0	0	108.2	Y28 Y33 L39 E40 V41 L101 F104 A105	Y28-I110 HydrophobicContact CD1-CD1 4.26Å; Y28-I110 HydrophobicContact CE1-CD1 3.83Å; Y28-I110 HydrophobicContact CE1-CG1 4.33Å; Y33-I110 HydrophobicContact CE1-CB 4.49Å; Y33-I110 HydrophobicContact CE1-CD1 4.39Å; Y33-I110 HydrophobicContact CE1-CG2 4.14Å; L39-I110 HydrophobicContact CB-CG2 3.82Å; L39-I110 HydrophobicContact CD1-CG2 4.29Å; L39-I110 HydrophobicContact CD2-CG2 3.97Å; L39-I110 HydrophobicContact CG-CG2 4.24Å; E40-I110 WeakPolarHBondContact O-CA 3.18Å; V41-I110 HydrophobicContact CG2-CG1 4.23Å; L101-I110 HydrophobicContact CD2-CD1 3.8Å; F104-I110 HydrophobicContact CD1-CD1 4.45Å; A105-I110 HydrophobicContact CB-CD1 3.9Å; A105-I110 HydrophobicContact CB-CG1 3.84Å
111	L	95.5	Very high	91.1	Very high	54 Å²	54	61.3 Å²	61.3	28%	0.283	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132	170.5	-47.6	174.6	0	0	0	108.8	L39 E40 H114	L39-L111 WeakPolarHBondContact CA-O 3.3Å; E40-L111 HydrophobicContact CB-CB 4.15Å; E40-L111 PolarHBondContact N-O 3.11Å; E40-L111 PolarHBondContact O-N 3.02Å; L111-H114 HydrophobicContact CB-CB 4.32Å
112	V	96.9	Very high	91.2	Very high	53 Å²	53	65.4 Å²	65.4	32%	0.321	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.5	-177	-176.2	0	0	0	0	109.4	Y33 D37 L39 H114	Y33-V112 HydrophobicContact CD1-CG2 3.9Å; Y33-V112 HydrophobicContact CE1-CG2 3.67Å; D37-V112 HydrophobicContact CB-CG1 3.89Å; D37-V112 WeakPolarHBondContact OD2-CG1 3.4Å; L39-V112 HydrophobicContact CD2-CG1 4.38Å; L39-V112 HydrophobicContact CD2-CG2 4Å; V112-H114 PolarHBondContact O-N 3.43Å
113	N	96	Very high	91.4	Very high	29 Å²	29	67.7 Å²	67.7	16%	0.155	37%	0.37	C	S	.	.	S	Bend	trans	52.6	30.7	173.8	-61.9	-28.5	0	0	0	114.3	D37 L38 M115 D116 R157	D37-N113 WeakPolarHBondContact CA-OD1 3.49Å; D37-N113 PolarHBondContact OD1-ND2 2.67Å; L38-N113 PolarHBondContact N-OD1 3.03Å; L38-N113 PolarHBondContact O-N 2.78Å; N113-M115 VanDerWaalsContact C-N 3.29Å; N113-M115 PolarHBondContact O-N 3.47Å; N113-D116 WeakPolarHBondContact O-CB 3.37Å; N113-D116 PolarHBondContact O-N 2.93Å; N113-D116 VanDerWaalsContact O-N 3.08Å; N113-R157 VanDerWaalsContact CG-CZ 3.48Å; N113-R157 PolarHBondContact ND2-NH2 3.43Å; N113-R157 PolarHBondContact OD1-NH1 3.25Å; N113-R157 VanDerWaalsContact OD1-NH1 3.11Å; N113-R157 PolarHBondContact OD1-NH2 3.36Å
114	H	94.6	Very high	91.8	Very high	73 Å²	73	66.7 Å²	66.7	34%	0.338	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-64.6	-36.4	-179.2	163.7	-145	0	0	0	111.4	E40 L111 V112 D116 K117	E40-H114 VanDerWaalsContact OE1-CB 3.25Å; E40-H114 WeakPolarHBondContact OE1-CB 3.31Å; E40-H114 IonicContact OE1-CG 2.87Å; E40-H114 IonicContact OE1-ND1 3.28Å; E40-H114 IonicContact OE2-CG 2.67Å; E40-H114 IonicContact OE2-ND1 3.45Å; E40-H114 PolarHBondContact OE2-ND1 2.77Å; L111-H114 HydrophobicContact CB-CB 4.32Å; V112-H114 PolarHBondContact O-N 3.43Å; H114-D116 PolarHBondContact O-N 3.07Å; H114-D116 VanDerWaalsContact O-N 3.11Å; H114-K117 PolarHBondContact O-N 2.89Å; H114-K117 VanDerWaalsContact O-N 3.11Å
115	M	91.6	Very high	92	Very high	15 Å²	15	74 Å²	74	7%	0.074	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-55.8	-22.4	170.8	-71.6	-53.2	-64.8	0	0	115.5	L38 E40 F49 N113 K117 L118 C119 M154 Y158	L38-M115 HydrophobicContact CD1-CB 4.25Å; L38-M115 HydrophobicContact CD1-CG 4.31Å; L38-M115 HydrophobicContact CD2-CG 4.28Å; E40-M115 WeakPolarHBondContact OE1-CG 3.4Å; E40-M115 PolarHBondContact OE1-N 3.29Å; F49-M115 HydrophobicContact CE1-CG 4.43Å; N113-M115 VanDerWaalsContact C-N 3.29Å; N113-M115 PolarHBondContact O-N 3.47Å; M115-K117 PolarHBondContact O-N 3.14Å; M115-L118 HydrophobicContact CE-CB 4.43Å; M115-L118 PolarHBondContact O-N 3.48Å; M115-L118 HydrophobicContact SD-CD1 3.95Å; M115-C119 WeakPolarHBondContact O-CB 3.34Å; M115-C119 PolarHBondContact O-N 2.95Å; M115-M154 HydrophobicContact CE-CE 4.18Å; M115-M154 HydrophobicContact CE-SD 3.92Å; M115-M154 HydrophobicContact CG-SD 4.37Å; M115-Y158 HydrophobicContact CB-CE2 4.11Å; M115-Y158 VanDerWaalsContact CB-OH 3.26Å; M115-Y158 WeakPolarHBondContact CB-OH 3.48Å
116	D	93.9	Very high	92.3	Very high	54 Å²	54	75.1 Å²	75.1	29%	0.289	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-63.5	-26.8	177.4	-72.1	-2.7	0	0	0	112.2	N113 H114 L118 R157 Y158	N113-D116 WeakPolarHBondContact O-CB 3.37Å; N113-D116 PolarHBondContact O-N 2.93Å; N113-D116 VanDerWaalsContact O-N 3.08Å; H114-D116 PolarHBondContact O-N 3.07Å; H114-D116 VanDerWaalsContact O-N 3.11Å; D116-L118 VanDerWaalsContact C-N 3.31Å; D116-R157 IonicContact OD1-CZ 3.34Å; D116-R157 IonicContact OD1-NE 2.93Å; D116-R157 PolarHBondContact OD1-NE 2.73Å; D116-R157 IonicContact OD1-NH2 2.91Å; D116-R157 PolarHBondContact OD1-NH2 3.47Å; D116-R157 IonicContact OD2-CZ 4Å; D116-R157 IonicContact OD2-NE 3.17Å; D116-R157 IonicContact OD2-NH2 2.78Å; D116-R157 PolarHBondContact OD2-NH2 3.03Å; D116-Y158 PolarHBondContact N-OH 2.55Å; D116-Y158 VanDerWaalsContact N-OH 3.1Å; D116-Y158 WeakPolarHBondContact OD1-CE1 3.49Å; D116-Y158 VanDerWaalsContact OD1-CZ 3.31Å; D116-Y158 PolarHBondContact OD1-OH 3.2Å
117	K	90.4	Very high	92.8	Very high	182 Å²	182	73.2 Å²	73.2	79%	0.791	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-80.1	-18.3	178.3	-59.6	177.7	-177.4	174.3	0	112.5	H114 M115	H114-K117 PolarHBondContact O-N 2.89Å; H114-K117 VanDerWaalsContact O-N 3.11Å; M115-K117 PolarHBondContact O-N 3.14Å
118	L	88	Confident	93.4	Very high	103 Å²	103	72.5 Å²	72.5	54%	0.539	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-31.6	-173	-56.7	179.1	0	0	0	111.8	M115 D116	M115-L118 HydrophobicContact CE-CB 4.43Å; M115-L118 PolarHBondContact O-N 3.48Å; M115-L118 HydrophobicContact SD-CD1 3.95Å; D116-L118 VanDerWaalsContact C-N 3.31Å
119	C	85.9	Confident	93.9	Very high	22 Å²	22	71 Å²	71	15%	0.149	38%	0.379	C	S	.	.			trans	-83.6	129.5	-179.9	-160.6	0	0	0	0	110.8	M115 Q121 Y158	M115-C119 WeakPolarHBondContact O-CB 3.34Å; M115-C119 PolarHBondContact O-N 2.95Å; C119-Q121 VanDerWaalsContact C-N 3.26Å; C119-Q121 PolarHBondContact O-N 3.28Å; C119-Y158 HydrophobicContact CB-CD1 4.33Å; C119-Y158 HydrophobicContact CB-CE1 4.1Å
120	S	85.8	Confident	94.2	Very high	128 Å²	128	63.9 Å²	63.9	90%	0.895	35%	0.346	S	S	*	.	S	Bend	trans	-74.9	-18.1	173.2	-49.8	0	0	0	0	113
121	Q	89.9	Confident	94.3	Very high	91 Å²	91	69.1 Å²	69.1	43%	0.425	37%	0.365	S	S	.	.	S	Bend	trans	-81.8	128.9	176.4	-178	68.7	30.6	0	0	109.4	C119 Y158 M160	C119-Q121 VanDerWaalsContact C-N 3.26Å; C119-Q121 PolarHBondContact O-N 3.28Å; Q121-Y158 WeakPolarHBondContact O-CD1 3.29Å; Q121-M160 HydrophobicContact CB-CE 3.33Å; Q121-M160 HydrophobicContact CG-CE 3.75Å
122	P	93.4	Very high	94.4	Very high	85 Å²	85	69.2 Å²	69.2	55%	0.552	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-63.1	144.8	175.1	25.8	-34.7	0	0	0	111.2
123	P	96.4	Very high	94.5	Very high	54 Å²	54	66.7 Å²	66.7	35%	0.351	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-65.7	150	173.8	29.8	-34.9	0	0	0	110.6	R157 Y158	P123-R157 HydrophobicContact CB-CG 3.86Å; P123-Y158 HydrophobicContact CB-CD1 4.23Å; P123-Y158 HydrophobicContact CB-CE1 3.93Å
124	L	97.3	Very high	94.6	Very high	55 Å²	55	67.8 Å²	67.8	29%	0.288	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-74.2	162.8	169.7	-60.1	169.5	0	0	0	110.3	G126 E128 V129 R157	L124-G126 PolarHBondContact O-N 3.46Å; L124-E128 HydrophobicContact CD1-CG 4.5Å; L124-V129 HydrophobicContact CB-CG2 3.88Å; L124-V129 WeakPolarHBondContact O-CG2 3.33Å; L124-R157 WeakPolarHBondContact CB-O 3.5Å; L124-R157 WeakPolarHBondContact CG-O 3.29Å; L124-R157 PolarHBondContact N-O 3.08Å
125	E	97.6	Very high	94.7	Very high	155 Å²	155	72.1 Å²	72.1	72%	0.724	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-55.2	135.7	174.6	-67.3	-58	128.8	0	0	111.7	D127 E128 V129	E125-D127 VanDerWaalsContact C-N 3.28Å; E125-D127 PolarHBondContact O-N 3.3Å; E125-D127 VanDerWaalsContact O-N 3.14Å; E125-E128 HydrophobicContact CB-CB 4.44Å; E125-E128 WeakPolarHBondContact O-CA 3.29Å; E125-E128 WeakPolarHBondContact O-CB 3.42Å; E125-E128 PolarHBondContact O-N 2.85Å; E125-V129 WeakPolarHBondContact O-CG2 3.39Å; E125-V129 PolarHBondContact O-N 3.29Å
126	G	97.2	Very high	94.9	Very high	23 Å²	23	73.4 Å²	73.4	24%	0.237	38%	0.375	C	S	.	.	H	α-helix	trans	-55.3	-38.8	-170.2	0	0	0	0	0	114.3	R35 G36 L124 E128 V129 A130	R35-G126 CarbonylContact O-C 3.06Å; R35-G126 WeakPolarHBondContact O-CA 3.19Å; G36-G126 WeakPolarHBondContact CA-O 3.34Å; L124-G126 PolarHBondContact O-N 3.46Å; G126-E128 VanDerWaalsContact C-N 3.34Å; G126-E128 PolarHBondContact O-N 3.26Å; G126-V129 WeakPolarHBondContact O-CB 3.41Å; G126-V129 PolarHBondContact O-N 3.1Å; G126-A130 PolarHBondContact O-N 2.73Å
127	D	97.7	Very high	94.8	Very high	101 Å²	101	75.7 Å²	75.7	54%	0.54	39%	0.385	S	S	.	.	H	α-helix	trans	-68.2	-32.3	175.6	-83	-42.3	0	0	0	113.4	R35 E125 R131	R35-D127 WeakPolarHBondContact CD-OD1 3.23Å; R35-D127 IonicContact NE-OD1 3.79Å; R35-D127 PolarHBondContact NE-OD1 3Å; E125-D127 VanDerWaalsContact C-N 3.28Å; E125-D127 PolarHBondContact O-N 3.3Å; E125-D127 VanDerWaalsContact O-N 3.14Å; D127-R131 WeakPolarHBondContact O-CB 3.17Å; D127-R131 WeakPolarHBondContact O-CG 3.18Å; D127-R131 PolarHBondContact O-N 3.39Å; D127-R131 PolarHBondContact O-NE 2.97Å
128	E	98	Very high	94.8	Very high	48 Å²	48	68.6 Å²	68.6	22%	0.224	36%	0.364	C	S	.	.	H	α-helix	trans	-68.3	-42.9	172.1	177.3	57.8	-165.9	0	0	110.9	L124 E125 G126 A130 R131 R132	L124-E128 HydrophobicContact CD1-CG 4.5Å; E125-E128 HydrophobicContact CB-CB 4.44Å; E125-E128 WeakPolarHBondContact O-CA 3.29Å; E125-E128 WeakPolarHBondContact O-CB 3.42Å; E125-E128 PolarHBondContact O-N 2.85Å; G126-E128 VanDerWaalsContact C-N 3.34Å; G126-E128 PolarHBondContact O-N 3.26Å; E128-A130 PolarHBondContact O-N 3.21Å; E128-R131 PolarHBondContact O-N 3.09Å; E128-R131 IonicContact OE2-CZ 2.77Å; E128-R131 IonicContact OE2-NE 3.29Å; E128-R131 IonicContact OE2-NH2 2.88Å; E128-R131 PolarHBondContact OE2-NH2 2.78Å; E128-R132 WeakPolarHBondContact O-CG 3.28Å; E128-R132 PolarHBondContact O-N 3.15Å; E128-R132 IonicContact OE1-CZ 3.71Å; E128-R132 IonicContact OE1-NE 3.55Å; E128-R132 PolarHBondContact OE1-NE 3.41Å; E128-R132 IonicContact OE1-NH2 3.59Å
129	V	98.4	Very high	94.8	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-58.3	-49.3	176.3	-179.3	0	0	0	0	111.2	G36 I51 L124 E125 G126 R132 A133 C156 R157	G36-V129 WeakPolarHBondContact O-CG1 3.34Å; I51-V129 HydrophobicContact CD1-CG1 3.88Å; I51-V129 HydrophobicContact CG1-CG1 4.31Å; I51-V129 HydrophobicContact CG2-CG1 3.9Å; L124-V129 HydrophobicContact CB-CG2 3.88Å; L124-V129 WeakPolarHBondContact O-CG2 3.33Å; E125-V129 WeakPolarHBondContact O-CG2 3.39Å; E125-V129 PolarHBondContact O-N 3.29Å; G126-V129 WeakPolarHBondContact O-CB 3.41Å; G126-V129 PolarHBondContact O-N 3.1Å; V129-R132 PolarHBondContact O-N 3.03Å; V129-A133 PolarHBondContact O-N 3.39Å; V129-A133 VanDerWaalsContact O-N 3.1Å; V129-C156 HydrophobicContact CG1-CB 4.04Å; V129-R157 HydrophobicContact CG1-CB 4.07Å; V129-R157 HydrophobicContact CG2-CB 4.41Å; V129-R157 HydrophobicContact CG2-CG 4.38Å
130	A	98.2	Very high	94.9	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-65.4	-40.6	179.6	0	0	0	0	0	112.3	R35 L53 G126 E128 R132 A133 E134	R35-A130 HydrophobicContact CG-CB 3.52Å; L53-A130 HydrophobicContact CD2-CB 4.02Å; G126-A130 PolarHBondContact O-N 2.73Å; E128-A130 PolarHBondContact O-N 3.21Å; A130-R132 VanDerWaalsContact C-N 3.31Å; A130-R132 PolarHBondContact O-N 3.39Å; A130-A133 PolarHBondContact O-N 3.03Å; A130-E134 WeakPolarHBondContact O-CG 3.37Å; A130-E134 PolarHBondContact O-N 3.18Å
131	R	98.1	Very high	95.1	Very high	127 Å²	127	67.8 Å²	67.8	48%	0.479	36%	0.358	S	S	.	.	H	α-helix	trans	-62.5	-37.1	175.4	-78.4	-176.7	-58.9	174.3	5.8	112.4	D127 E128 E134 K135	D127-R131 WeakPolarHBondContact O-CB 3.17Å; D127-R131 WeakPolarHBondContact O-CG 3.18Å; D127-R131 PolarHBondContact O-N 3.39Å; D127-R131 PolarHBondContact O-NE 2.97Å; E128-R131 PolarHBondContact O-N 3.09Å; E128-R131 IonicContact OE2-CZ 2.77Å; E128-R131 IonicContact OE2-NE 3.29Å; E128-R131 IonicContact OE2-NH2 2.88Å; E128-R131 PolarHBondContact OE2-NH2 2.78Å; R131-E134 PolarHBondContact O-N 3.03Å; R131-K135 VanDerWaalsContact O-CG 3.31Å; R131-K135 WeakPolarHBondContact O-CG 3.48Å; R131-K135 PolarHBondContact O-N 2.84Å
132	R	98	Very high	94.9	Very high	55 Å²	55	64.1 Å²	64.1	21%	0.208	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-45.2	174.3	-73.6	174.6	178.5	-151.4	3.1	111.4	E128 V129 A130 E134 K135 L136 Y155 C156	E128-R132 WeakPolarHBondContact O-CG 3.28Å; E128-R132 PolarHBondContact O-N 3.15Å; E128-R132 IonicContact OE1-CZ 3.71Å; E128-R132 IonicContact OE1-NE 3.55Å; E128-R132 PolarHBondContact OE1-NE 3.41Å; E128-R132 IonicContact OE1-NH2 3.59Å; V129-R132 PolarHBondContact O-N 3.03Å; A130-R132 VanDerWaalsContact C-N 3.31Å; A130-R132 PolarHBondContact O-N 3.39Å; R132-E134 VanDerWaalsContact C-N 3.34Å; R132-E134 PolarHBondContact O-N 2.82Å; R132-K135 PolarHBondContact O-N 2.82Å; R132-L136 WeakPolarHBondContact O-CG 3.25Å; R132-L136 PolarHBondContact O-N 2.99Å; R132-Y155 PolarHBondContact NH1-O 3.11Å; R132-C156 HydrophobicContact CB-CB 4.28Å; R132-C156 WeakPolarHBondContact CD-O 3.15Å
133	A	97.6	Very high	94.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-43	176.7	0	0	0	0	0	111.9	I51 L53 A59 V129 A130 K135 L136 F152	I51-A133 HydrophobicContact CB-CB 3.95Å; I51-A133 HydrophobicContact CG1-CB 4.21Å; I51-A133 HydrophobicContact CG2-CB 3.99Å; L53-A133 HydrophobicContact CD2-CB 4.03Å; A59-A133 HydrophobicContact CB-CB 3.95Å; V129-A133 PolarHBondContact O-N 3.39Å; V129-A133 VanDerWaalsContact O-N 3.1Å; A130-A133 PolarHBondContact O-N 3.03Å; A133-K135 PolarHBondContact O-N 3.15Å; A133-L136 PolarHBondContact O-N 3.18Å; A133-F152 HydrophobicContact CB-CE2 4.48Å; A133-F152 HydrophobicContact CB-CZ 3.87Å
134	E	97.8	Very high	93.7	Very high	52 Å²	52	63.8 Å²	63.8	24%	0.243	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-40.3	176.6	-73.3	165.1	168.9	0	0	112.3	R35 L53 A130 R131 R132 L136 M137	R35-E134 IonicContact CZ-OE1 3.11Å; R35-E134 IonicContact CZ-OE2 3.58Å; R35-E134 IonicContact NH1-OE1 3.02Å; R35-E134 PolarHBondContact NH1-OE1 3.07Å; R35-E134 IonicContact NH2-OE1 3.84Å; R35-E134 PolarHBondContact NH2-OE1 3.07Å; R35-E134 IonicContact NH2-OE2 2.77Å; R35-E134 PolarHBondContact NH2-OE2 3.49Å; L53-E134 HydrophobicContact CD1-CG 4.02Å; L53-E134 HydrophobicContact CD2-CG 4.05Å; A130-E134 WeakPolarHBondContact O-CG 3.37Å; A130-E134 PolarHBondContact O-N 3.18Å; R131-E134 PolarHBondContact O-N 3.03Å; R132-E134 VanDerWaalsContact C-N 3.34Å; R132-E134 PolarHBondContact O-N 2.82Å; E134-L136 PolarHBondContact O-N 3.44Å; E134-M137 HydrophobicContact CB-CE 4.35Å; E134-M137 WeakPolarHBondContact O-CB 3.29Å; E134-M137 VanDerWaalsContact O-CE 3.31Å; E134-M137 WeakPolarHBondContact O-CE 3.48Å; E134-M137 WeakPolarHBondContact O-CG 3.47Å; E134-M137 PolarHBondContact O-N 3.46Å
135	K	97	Very high	92.8	Very high	165 Å²	165	64.2 Å²	64.2	72%	0.717	34%	0.336	S	S	*	.	H	α-helix	trans	-64.9	-25.9	177.1	-77.4	174.8	-179.1	178.6	0	113.7	R131 R132 A133	R131-K135 VanDerWaalsContact O-CG 3.31Å; R131-K135 WeakPolarHBondContact O-CG 3.48Å; R131-K135 PolarHBondContact O-N 2.84Å; R132-K135 PolarHBondContact O-N 2.82Å; A133-K135 PolarHBondContact O-N 3.15Å
136	L	95.4	Very high	91.9	Very high	42 Å²	42	66.4 Å²	66.4	22%	0.22	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	2.3	-178.4	-68.1	175.3	0	0	0	113.2	V96 R132 A133 E134 F152 Y155	V96-L136 VanDerWaalsContact CB-O 3.27Å; V96-L136 WeakPolarHBondContact CB-O 3.44Å; V96-L136 HydrophobicContact CG2-CB 4.48Å; V96-L136 WeakPolarHBondContact CG2-O 3.46Å; R132-L136 WeakPolarHBondContact O-CG 3.25Å; R132-L136 PolarHBondContact O-N 2.99Å; A133-L136 PolarHBondContact O-N 3.18Å; E134-L136 PolarHBondContact O-N 3.44Å; L136-F152 HydrophobicContact CB-CD2 4.47Å; L136-F152 HydrophobicContact CB-CE2 3.95Å; L136-F152 HydrophobicContact CD1-CD2 3.87Å; L136-F152 HydrophobicContact CD1-CE2 3.85Å; L136-Y155 HydrophobicContact CD1-CD1 3.75Å; L136-Y155 HydrophobicContact CD1-CE1 3.85Å
137	M	93.6	Very high	91.5	Very high	101 Å²	101	69.2 Å²	69.2	50%	0.498	34%	0.342	S	S	.	.			trans	-58.5	138.5	176	-71.9	-169.6	-62.1	0	0	112	V96 V98 E134	V96-M137 HydrophobicContact CG1-CG 4.23Å; V98-M137 HydrophobicContact CG2-CG 4.47Å; V98-M137 HydrophobicContact CG2-SD 3.61Å; E134-M137 HydrophobicContact CB-CE 4.35Å; E134-M137 WeakPolarHBondContact O-CB 3.29Å; E134-M137 VanDerWaalsContact O-CE 3.31Å; E134-M137 WeakPolarHBondContact O-CE 3.48Å; E134-M137 WeakPolarHBondContact O-CG 3.47Å; E134-M137 PolarHBondContact O-N 3.46Å
138	G	89.1	Confident	91.1	Very high	34 Å²	34	64.7 Å²	64.7	35%	0.351	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	120.3	-174	178.6	0	0	0	0	0	113.4	S95 V96	S95-G138 CarbonylContact C-O 3.47Å; S95-G138 WeakPolarHBondContact CA-O 3.4Å; S95-G138 WeakPolarHBondContact CB-O 3.39Å; V96-G138 PolarHBondContact N-O 3.43Å; V96-G138 PolarHBondContact O-N 3.36Å
139	S	88.6	Confident	91	Very high	93 Å²	93	62.6 Å²	62.6	65%	0.65	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.8	-174.8	-59.8	0	0	0	0	112.1	A94	A94-S139 CarbonylContact O-C 3.6Å; A94-S139 WeakPolarHBondContact O-CA 3.21Å
140	M	88.6	Confident	90.8	Very high	43 Å²	43	62.9 Å²	62.9	21%	0.212	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	163.3	178.4	-59	-168.3	-60.1	0	0	110.8	F61 A94 V96 Y147	F61-M140 HydrophobicContact CD2-CE 3.8Å; F61-M140 HydrophobicContact CE1-CE 4.36Å; F61-M140 HydrophobicContact CE2-CB 4.02Å; F61-M140 HydrophobicContact CE2-CE 3.54Å; F61-M140 HydrophobicContact CG-CE 4.32Å; F61-M140 HydrophobicContact CZ-CB 4.17Å; F61-M140 HydrophobicContact CZ-CE 3.87Å; A94-M140 CarbonylContact C-O 3.47Å; A94-M140 PolarHBondContact N-O 3.23Å; A94-M140 PolarHBondContact O-N 3.41Å; V96-M140 HydrophobicContact CG2-CE 3.44Å; V96-M140 VanDerWaalsContact CG2-CE 3.44Å; M140-Y147 HydrophobicContact CB-CE1 4.2Å; M140-Y147 HydrophobicContact CE-CE1 3.75Å; M140-Y147 WeakPolarHBondContact CE-OH 3.36Å; M140-Y147 HydrophobicContact SD-CE1 4.03Å; M140-Y147 PolarHBondContact SD-OH 2.9Å
141	T	88.7	Confident	90.7	Very high	99 Å²	99	63.6 Å²	63.6	61%	0.607	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.6	176.4	-57.9	0	0	0	0	110	K92 Y147	K92-T141 HydrophobicContact CB-CG2 3.89Å; K92-T141 CarbonylContact O-C 2.88Å; K92-T141 VanDerWaalsContact O-CA 3.29Å; K92-T141 WeakPolarHBondContact O-CA 3.28Å; T141-Y147 VanDerWaalsContact O-CD1 3.23Å; T141-Y147 WeakPolarHBondContact O-CD1 3.33Å
142	Y	87.1	Confident	90.6	Very high	15 Å²	15	57.7 Å²	57.7	6%	0.059	29%	0.29	C	S	.	.			trans	-90.6	141.9	179.4	-160.1	-104.4	0	0	0	112.5	F61 P63 V89 K92 A94 L144 N148	F61-Y142 HydrophobicContact CD1-CD2 4.29Å; F61-Y142 HydrophobicContact CD1-CE2 4.2Å; F61-Y142 AromaticContact CE1-CD2 3.68Å; F61-Y142 HydrophobicContact CE1-CD2 3.68Å; F61-Y142 AromaticContact CE1-CE2 3.99Å; F61-Y142 HydrophobicContact CE1-CE2 3.99Å; F61-Y142 HydrophobicContact CE2-CD2 4.31Å; F61-Y142 AromaticContact CZ-CD2 3.69Å; F61-Y142 HydrophobicContact CZ-CD2 3.69Å; F61-Y142 HydrophobicContact CZ-CE2 4.4Å; P63-Y142 HydrophobicContact CB-CD1 4.2Å; P63-Y142 HydrophobicContact CB-CD2 4.37Å; P63-Y142 HydrophobicContact CB-CE1 4.4Å; P63-Y142 HydrophobicContact CB-CG 4.18Å; P63-Y142 HydrophobicContact CG-CE1 4.33Å; P63-Y142 HydrophobicContact CG-CE2 4.49Å; V89-Y142 HydrophobicContact CG2-CD1 3.97Å; V89-Y142 HydrophobicContact CG2-CE1 3.84Å; K92-Y142 WeakPolarHBondContact CB-O 3.35Å; K92-Y142 PolarHBondContact O-N 3.35Å; A94-Y142 HydrophobicContact CB-CD2 3.55Å; A94-Y142 HydrophobicContact CB-CG 3.93Å; Y142-L144 HydrophobicContact CE1-CD2 3.75Å; Y142-L144 HydrophobicContact CE1-CG 4.12Å; Y142-N148 HydrophobicContact CE2-CB 4.2Å; Y142-N148 WeakPolarHBondContact OH-CB 3.18Å
143	S	84.1	Confident	90.6	Very high	35 Å²	35	55 Å²	55	25%	0.245	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-142.8	118.2	168.5	175.9	0	0	0	0	110.5	L145 W146 Y147 N148	S143-L145 PolarHBondContact O-N 3.41Å; S143-L145 VanDerWaalsContact O-N 3.13Å; S143-W146 PolarHBondContact O-N 2.77Å; S143-W146 PolarHBondContact OG-N 3.35Å; S143-Y147 PolarHBondContact N-O 3.21Å; S143-Y147 CarbonylContact O-C 3.49Å; S143-Y147 PolarHBondContact O-N 3.21Å; S143-N148 PolarHBondContact O-N 3.11Å
144	L	80.1	Confident	90.5	Very high	97 Å²	97	55 Å²	55	51%	0.508	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-37.7	179.7	-76	171.5	0	0	0	113.1	V89 Y142 N148 T166	V89-L144 HydrophobicContact CG1-CD1 3.61Å; V89-L144 HydrophobicContact CG1-CD2 4.22Å; V89-L144 HydrophobicContact CG1-CG 3.72Å; V89-L144 HydrophobicContact CG2-CD2 4.36Å; Y142-L144 HydrophobicContact CE1-CD2 3.75Å; Y142-L144 HydrophobicContact CE1-CG 4.12Å; L144-N148 PolarHBondContact O-ND2 2.67Å; L144-T166 PolarHBondContact O-OG1 3.28Å
145	L	78.7	Confident	90.5	Very high	64 Å²	64	57.5 Å²	57.5	34%	0.335	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-14.1	-174.1	-59	178.8	0	0	0	114.4	S143 T166 F169	S143-L145 PolarHBondContact O-N 3.41Å; S143-L145 VanDerWaalsContact O-N 3.13Å; L145-T166 HydrophobicContact CB-CG2 4.07Å; L145-T166 HydrophobicContact CD2-CG2 3.77Å; L145-T166 WeakPolarHBondContact O-CG2 3.35Å; L145-F169 HydrophobicContact CD2-CD1 3.97Å; L145-F169 HydrophobicContact CD2-CE1 4.18Å
146	W	79	Confident	90.5	Very high	201 Å²	201	49.7 Å²	49.7	76%	0.761	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134	-23.6	-168.2	-55.6	111.9	0	0	0	114.1	S143	S143-W146 PolarHBondContact O-N 2.77Å; S143-W146 PolarHBondContact OG-N 3.35Å
147	Y	87.1	Confident	90.6	Very high	82 Å²	82	48.3 Å²	48.3	32%	0.322	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-155.7	77.2	-174.6	-159.4	-108.6	0	0	0	109.1	F61 M140 T141 S143	F61-Y147 AromaticContact CE1-CD1 3.54Å; F61-Y147 HydrophobicContact CE1-CD1 3.54Å; F61-Y147 AromaticContact CE1-CE1 3.73Å; F61-Y147 HydrophobicContact CE1-CE1 3.73Å; F61-Y147 HydrophobicContact CE1-CG 4.36Å; F61-Y147 WeakPolarHBondContact CE1-O 3.25Å; F61-Y147 AromaticContact CZ-CD1 3.72Å; F61-Y147 HydrophobicContact CZ-CD1 3.72Å; F61-Y147 AromaticContact CZ-CE1 3.72Å; F61-Y147 HydrophobicContact CZ-CE1 3.72Å; M140-Y147 HydrophobicContact CB-CE1 4.2Å; M140-Y147 HydrophobicContact CE-CE1 3.75Å; M140-Y147 WeakPolarHBondContact CE-OH 3.36Å; M140-Y147 HydrophobicContact SD-CE1 4.03Å; M140-Y147 PolarHBondContact SD-OH 2.9Å; T141-Y147 VanDerWaalsContact O-CD1 3.23Å; T141-Y147 WeakPolarHBondContact O-CD1 3.33Å; S143-Y147 PolarHBondContact N-O 3.21Å; S143-Y147 CarbonylContact O-C 3.49Å; S143-Y147 PolarHBondContact O-N 3.21Å
148	N	90.9	Very high	90.7	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.032	22%	0.224	C	C	.	.	S	Bend	trans	-120.8	-175	-177.3	69	25	0	0	0	110.6	F61 Y142 S143 L144 E150 H151 F152 S163 T166	F61-N148 WeakPolarHBondContact CD1-O 3.46Å; Y142-N148 HydrophobicContact CE2-CB 4.2Å; Y142-N148 WeakPolarHBondContact OH-CB 3.18Å; S143-N148 PolarHBondContact O-N 3.11Å; L144-N148 PolarHBondContact O-ND2 2.67Å; N148-E150 VanDerWaalsContact C-N 3.33Å; N148-E150 PolarHBondContact O-N 3Å; N148-E150 WeakPolarHBondContact OD1-CB 3.42Å; N148-E150 PolarHBondContact OD1-N 3.19Å; N148-H151 PolarHBondContact N-ND1 3.37Å; N148-H151 PolarHBondContact ND2-ND1 3.43Å; N148-H151 PolarHBondContact O-N 3.27Å; N148-H151 PolarHBondContact OD1-N 3.31Å; N148-H151 VanDerWaalsContact OD1-N 3.15Å; N148-H151 PolarHBondContact OD1-ND1 3.45Å; N148-F152 PolarHBondContact O-N 3.13Å; N148-S163 PolarHBondContact ND2-OG 2.91Å; N148-T166 PolarHBondContact ND2-OG1 2.96Å
149	C	94.2	Very high	91	Very high	4 Å²	4	44.1 Å²	44.1	3%	0.027	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-37	-178.9	56	0	0	0	0	114.6	F49 F61 F152 V153	F49-C149 HydrophobicContact CB-CB 4.46Å; F61-C149 WeakPolarHBondContact O-CB 3.07Å; C149-F152 WeakPolarHBondContact O-CB 3.36Å; C149-F152 PolarHBondContact O-N 3.24Å; C149-V153 PolarHBondContact O-N 3.26Å
150	E	95.1	Very high	91.2	Very high	5 Å²	5	42.2 Å²	42.2	2%	0.023	21%	0.208	C	C	.	.	H	α-helix	trans	-68	-45.2	178.6	-165.6	-179.8	177.1	0	0	110.9	F49 N148 F152 V153 M154 S163 Y164 Q165	F49-E150 HydrophobicContact CD2-CB 3.78Å; F49-E150 HydrophobicContact CD2-CG 4.11Å; F49-E150 HydrophobicContact CE1-CG 4.32Å; F49-E150 HydrophobicContact CE2-CB 3.7Å; F49-E150 HydrophobicContact CE2-CG 3.7Å; F49-E150 HydrophobicContact CG-CB 4.47Å; F49-E150 HydrophobicContact CZ-CB 4.34Å; F49-E150 HydrophobicContact CZ-CG 3.82Å; N148-E150 VanDerWaalsContact C-N 3.33Å; N148-E150 PolarHBondContact O-N 3Å; N148-E150 WeakPolarHBondContact OD1-CB 3.42Å; N148-E150 PolarHBondContact OD1-N 3.19Å; E150-F152 PolarHBondContact O-N 2.91Å; E150-V153 VanDerWaalsContact O-CG2 3.28Å; E150-V153 WeakPolarHBondContact O-CG2 3.45Å; E150-V153 PolarHBondContact O-N 3.07Å; E150-M154 HydrophobicContact CG-CG 4.21Å; E150-M154 WeakPolarHBondContact O-CB 3.45Å; E150-M154 WeakPolarHBondContact O-CG 3.47Å; E150-M154 PolarHBondContact O-N 2.91Å; E150-S163 VanDerWaalsContact CD-CA 3.48Å; E150-S163 VanDerWaalsContact OE2-CA 3.29Å; E150-S163 WeakPolarHBondContact OE2-CA 3.37Å; E150-S163 VanDerWaalsContact OE2-CB 3.29Å; E150-S163 WeakPolarHBondContact OE2-CB 3.39Å; E150-S163 PolarHBondContact OE2-OG 3.1Å; E150-Y164 VanDerWaalsContact CD-N 3.28Å; E150-Y164 WeakPolarHBondContact OE1-CB 3.49Å; E150-Y164 PolarHBondContact OE1-N 2.84Å; E150-Y164 PolarHBondContact OE2-N 3.48Å; E150-Q165 VanDerWaalsContact OE2-CB 3.25Å; E150-Q165 WeakPolarHBondContact OE2-CB 3.5Å; E150-Q165 PolarHBondContact OE2-N 3.5Å
151	H	95.3	Very high	91.2	Very high	15 Å²	15	43.1 Å²	43.1	7%	0.069	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-40.4	175.9	-66.3	90.4	0	0	0	112	N148 Y155 A161 S163	N148-H151 PolarHBondContact N-ND1 3.37Å; N148-H151 PolarHBondContact ND2-ND1 3.43Å; N148-H151 PolarHBondContact O-N 3.27Å; N148-H151 PolarHBondContact OD1-N 3.31Å; N148-H151 VanDerWaalsContact OD1-N 3.15Å; N148-H151 PolarHBondContact OD1-ND1 3.45Å; H151-Y155 WeakPolarHBondContact O-CB 3.26Å; H151-Y155 PolarHBondContact O-N 3.46Å; H151-A161 PolarHBondContact CD2-O 3.4Å; H151-S163 WeakPolarHBondContact CE1-CB 3.44Å; H151-S163 WeakPolarHBondContact ND1-CB 3.37Å
152	F	96.8	Very high	91.2	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-51.8	177.8	162	-102.5	0	0	0	111.9	I51 A59 F61 V96 A133 L136 N148 C149 E150 Y155 C156	I51-F152 HydrophobicContact CG1-CE1 4.34Å; A59-F152 HydrophobicContact CB-CZ 4.34Å; F61-F152 HydrophobicContact CB-CB 3.83Å; F61-F152 HydrophobicContact CB-CD1 3.94Å; F61-F152 HydrophobicContact CB-CD2 4.45Å; F61-F152 HydrophobicContact CB-CG 3.81Å; F61-F152 HydrophobicContact CD1-CB 4.12Å; F61-F152 HydrophobicContact CG-CB 4.35Å; V96-F152 HydrophobicContact CG1-CE2 3.97Å; V96-F152 HydrophobicContact CG1-CZ 3.85Å; V96-F152 HydrophobicContact CG2-CD2 3.83Å; V96-F152 HydrophobicContact CG2-CE2 3.68Å; V96-F152 HydrophobicContact CG2-CG 4.46Å; V96-F152 HydrophobicContact CG2-CZ 4.19Å; A133-F152 HydrophobicContact CB-CE2 4.48Å; A133-F152 HydrophobicContact CB-CZ 3.87Å; L136-F152 HydrophobicContact CB-CD2 4.47Å; L136-F152 HydrophobicContact CB-CE2 3.95Å; L136-F152 HydrophobicContact CD1-CD2 3.87Å; L136-F152 HydrophobicContact CD1-CE2 3.85Å; N148-F152 PolarHBondContact O-N 3.13Å; C149-F152 WeakPolarHBondContact O-CB 3.36Å; C149-F152 PolarHBondContact O-N 3.24Å; E150-F152 PolarHBondContact O-N 2.91Å; F152-Y155 PolarHBondContact O-N 3.43Å; F152-C156 PolarHBondContact O-N 3.25Å; F152-C156 VanDerWaalsContact O-N 3.07Å; F152-C156 PolarHBondContact O-SG 2.85Å
153	V	97.3	Very high	91.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.6	-34.7	-178.6	-60.2	0	0	0	0	112.2	L38 F49 I51 C149 E150 Y155 C156 R157	L38-V153 HydrophobicContact CD1-CB 3.9Å; L38-V153 HydrophobicContact CD1-CG2 3.68Å; L38-V153 HydrophobicContact CG-CB 4.08Å; L38-V153 HydrophobicContact CG-CG2 4.06Å; F49-V153 HydrophobicContact CB-CB 4.28Å; F49-V153 HydrophobicContact CB-CG1 3.66Å; F49-V153 HydrophobicContact CB-CG2 3.59Å; F49-V153 HydrophobicContact CD1-CG2 3.85Å; F49-V153 HydrophobicContact CG-CG2 3.89Å; I51-V153 HydrophobicContact CD1-CB 3.87Å; I51-V153 HydrophobicContact CD1-CG1 3.97Å; I51-V153 HydrophobicContact CG1-CB 4.36Å; I51-V153 HydrophobicContact CG1-CG1 4.04Å; C149-V153 PolarHBondContact O-N 3.26Å; E150-V153 VanDerWaalsContact O-CG2 3.28Å; E150-V153 WeakPolarHBondContact O-CG2 3.45Å; E150-V153 PolarHBondContact O-N 3.07Å; V153-Y155 VanDerWaalsContact C-N 3.31Å; V153-Y155 PolarHBondContact O-N 2.92Å; V153-C156 PolarHBondContact O-N 3.19Å; V153-R157 WeakPolarHBondContact O-CB 3.29Å; V153-R157 PolarHBondContact O-N 2.8Å
154	M	96.6	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-39.3	177	-69.6	-59.6	-67.6	0	0	110.9	M115 E150 Y158 G159 M160 I162	M115-M154 HydrophobicContact CE-CE 4.18Å; M115-M154 HydrophobicContact CE-SD 3.92Å; M115-M154 HydrophobicContact CG-SD 4.37Å; E150-M154 HydrophobicContact CG-CG 4.21Å; E150-M154 WeakPolarHBondContact O-CB 3.45Å; E150-M154 WeakPolarHBondContact O-CG 3.47Å; E150-M154 PolarHBondContact O-N 2.91Å; M154-Y158 HydrophobicContact CE-CD2 3.4Å; M154-Y158 VanDerWaalsContact CE-CD2 3.4Å; M154-Y158 HydrophobicContact CE-CE2 3.76Å; M154-Y158 HydrophobicContact CE-CG 4.25Å; M154-Y158 WeakPolarHBondContact O-CA 3.25Å; M154-Y158 PolarHBondContact O-N 3.13Å; M154-Y158 HydrophobicContact SD-CD2 3.5Å; M154-Y158 WeakPolarHBondContact SD-CD2 3.33Å; M154-Y158 HydrophobicContact SD-CE2 3.44Å; M154-Y158 WeakPolarHBondContact SD-CE2 3.39Å; M154-G159 PolarHBondContact O-N 3.28Å; M154-M160 CarbonylContact C-O 3.59Å; M154-M160 WeakPolarHBondContact CB-O 3.37Å; M154-M160 HydrophobicContact CE-CG 4.27Å; M154-M160 HydrophobicContact CE-SD 4.11Å; M154-M160 PolarHBondContact O-N 2.87Å; M154-I162 HydrophobicContact CE-CD1 3.93Å; M154-I162 HydrophobicContact CE-CG1 3.77Å; M154-I162 HydrophobicContact CG-CG1 4.39Å; M154-I162 WeakPolarHBondContact CG-O 3.33Å
155	Y	96.8	Very high	91.9	Very high	104 Å²	104	45.5 Å²	45.5	41%	0.408	22%	0.219	S	C	.	.	H	α-helix	trans	-66	-43.1	175.3	171.9	-96.2	0	0	0	111.4	R132 L136 H151 F152 V153 G159 M160	R132-Y155 PolarHBondContact NH1-O 3.11Å; L136-Y155 HydrophobicContact CD1-CD1 3.75Å; L136-Y155 HydrophobicContact CD1-CE1 3.85Å; H151-Y155 WeakPolarHBondContact O-CB 3.26Å; H151-Y155 PolarHBondContact O-N 3.46Å; F152-Y155 PolarHBondContact O-N 3.43Å; V153-Y155 VanDerWaalsContact C-N 3.31Å; V153-Y155 PolarHBondContact O-N 2.92Å; Y155-G159 VanDerWaalsContact O-CA 3.26Å; Y155-G159 WeakPolarHBondContact O-CA 3.3Å; Y155-G159 PolarHBondContact O-N 3.11Å; Y155-G159 VanDerWaalsContact O-N 3.13Å; Y155-M160 VanDerWaalsContact CA-O 3.29Å; Y155-M160 WeakPolarHBondContact CA-O 3.35Å; Y155-M160 PolarHBondContact N-O 3.4Å
156	C	97.6	Very high	92.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-47.7	179.1	-65.2	0	0	0	0	111.5	I51 V129 R132 F152 V153	I51-C156 HydrophobicContact CD1-CB 4.26Å; I51-C156 HydrophobicContact CG1-CB 3.97Å; V129-C156 HydrophobicContact CG1-CB 4.04Å; R132-C156 HydrophobicContact CB-CB 4.28Å; R132-C156 WeakPolarHBondContact CD-O 3.15Å; F152-C156 PolarHBondContact O-N 3.25Å; F152-C156 VanDerWaalsContact O-N 3.07Å; F152-C156 PolarHBondContact O-SG 2.85Å; V153-C156 PolarHBondContact O-N 3.19Å
157	R	97.6	Very high	92.7	Very high	14 Å²	14	40.3 Å²	40.3	5%	0.053	20%	0.198	C	C	.	.	H	α-helix	trans	-84.9	-40.4	-171.7	-173.7	166.6	-176.5	87.9	0.2	114.3	G36 L38 N113 D116 P123 L124 V129 V153	G36-R157 PolarHBondContact O-NH1 3.11Å; L38-R157 VanDerWaalsContact CB-CD 3.48Å; L38-R157 HydrophobicContact CD1-CB 4.36Å; N113-R157 VanDerWaalsContact CG-CZ 3.48Å; N113-R157 PolarHBondContact ND2-NH2 3.43Å; N113-R157 PolarHBondContact OD1-NH1 3.25Å; N113-R157 VanDerWaalsContact OD1-NH1 3.11Å; N113-R157 PolarHBondContact OD1-NH2 3.36Å; D116-R157 IonicContact OD1-CZ 3.34Å; D116-R157 IonicContact OD1-NE 2.93Å; D116-R157 PolarHBondContact OD1-NE 2.73Å; D116-R157 IonicContact OD1-NH2 2.91Å; D116-R157 PolarHBondContact OD1-NH2 3.47Å; D116-R157 IonicContact OD2-CZ 4Å; D116-R157 IonicContact OD2-NE 3.17Å; D116-R157 IonicContact OD2-NH2 2.78Å; D116-R157 PolarHBondContact OD2-NH2 3.03Å; P123-R157 HydrophobicContact CB-CG 3.86Å; L124-R157 WeakPolarHBondContact CB-O 3.5Å; L124-R157 WeakPolarHBondContact CG-O 3.29Å; L124-R157 PolarHBondContact N-O 3.08Å; V129-R157 HydrophobicContact CG1-CB 4.07Å; V129-R157 HydrophobicContact CG2-CB 4.41Å; V129-R157 HydrophobicContact CG2-CG 4.38Å; V153-R157 WeakPolarHBondContact O-CB 3.29Å; V153-R157 PolarHBondContact O-N 2.8Å
158	Y	96.5	Very high	92.7	Very high	6 Å²	6	39.6 Å²	39.6	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-117.1	-6	-172.5	-50.6	-76.7	0	0	0	113.1	L38 M115 D116 C119 Q121 P123 M154 M160	L38-Y158 HydrophobicContact CD1-CE2 4.01Å; M115-Y158 HydrophobicContact CB-CE2 4.11Å; M115-Y158 VanDerWaalsContact CB-OH 3.26Å; M115-Y158 WeakPolarHBondContact CB-OH 3.48Å; D116-Y158 PolarHBondContact N-OH 2.55Å; D116-Y158 VanDerWaalsContact N-OH 3.1Å; D116-Y158 WeakPolarHBondContact OD1-CE1 3.49Å; D116-Y158 VanDerWaalsContact OD1-CZ 3.31Å; D116-Y158 PolarHBondContact OD1-OH 3.2Å; C119-Y158 HydrophobicContact CB-CD1 4.33Å; C119-Y158 HydrophobicContact CB-CE1 4.1Å; Q121-Y158 WeakPolarHBondContact O-CD1 3.29Å; P123-Y158 HydrophobicContact CB-CD1 4.23Å; P123-Y158 HydrophobicContact CB-CE1 3.93Å; M154-Y158 HydrophobicContact CE-CD2 3.4Å; M154-Y158 VanDerWaalsContact CE-CD2 3.4Å; M154-Y158 HydrophobicContact CE-CE2 3.76Å; M154-Y158 HydrophobicContact CE-CG 4.25Å; M154-Y158 WeakPolarHBondContact O-CA 3.25Å; M154-Y158 PolarHBondContact O-N 3.13Å; M154-Y158 HydrophobicContact SD-CD2 3.5Å; M154-Y158 WeakPolarHBondContact SD-CD2 3.33Å; M154-Y158 HydrophobicContact SD-CE2 3.44Å; M154-Y158 WeakPolarHBondContact SD-CE2 3.39Å; Y158-M160 VanDerWaalsContact C-N 3.29Å; Y158-M160 PolarHBondContact O-N 2.81Å
159	G	95.1	Very high	92.5	Very high	40 Å²	40	44.8 Å²	44.8	41%	0.412	22%	0.22	S	C	.	.	S	Bend	trans	74.5	15.6	-177.6	0	0	0	0	0	114.5	M154 Y155	M154-G159 PolarHBondContact O-N 3.28Å; Y155-G159 VanDerWaalsContact O-CA 3.26Å; Y155-G159 WeakPolarHBondContact O-CA 3.3Å; Y155-G159 PolarHBondContact O-N 3.11Å; Y155-G159 VanDerWaalsContact O-N 3.13Å
160	M	92.9	Very high	92.1	Very high	53 Å²	53	47.3 Å²	47.3	26%	0.261	24%	0.237	S	C	.	.			trans	-125.6	141.9	178.4	59.3	174.6	66.4	0	0	111.4	Q121 M154 Y155 Y158 I162	Q121-M160 HydrophobicContact CB-CE 3.33Å; Q121-M160 HydrophobicContact CG-CE 3.75Å; M154-M160 CarbonylContact C-O 3.59Å; M154-M160 WeakPolarHBondContact CB-O 3.37Å; M154-M160 HydrophobicContact CE-CG 4.27Å; M154-M160 HydrophobicContact CE-SD 4.11Å; M154-M160 PolarHBondContact O-N 2.87Å; Y155-M160 VanDerWaalsContact CA-O 3.29Å; Y155-M160 WeakPolarHBondContact CA-O 3.35Å; Y155-M160 PolarHBondContact N-O 3.4Å; Y158-M160 VanDerWaalsContact C-N 3.29Å; Y158-M160 PolarHBondContact O-N 2.81Å; M160-I162 HydrophobicContact CG-CD1 4.47Å; M160-I162 HydrophobicContact CG-CG1 4.14Å; M160-I162 PolarHBondContact O-N 2.54Å; M160-I162 HydrophobicContact SD-CD1 3.46Å; M160-I162 WeakPolarHBondContact SD-CD1 3.26Å; M160-I162 HydrophobicContact SD-CG1 3.77Å
161	A	87.8	Confident	91.7	Very high	63 Å²	63	50.1 Å²	50.1	52%	0.521	25%	0.252	S	S	.	.			trans	-101.4	80.3	176.7	0	0	0	0	0	109.8	H151	H151-A161 PolarHBondContact CD2-O 3.4Å
162	I	89.9	Confident	91.3	Very high	87 Å²	87	53 Å²	53	45%	0.446	27%	0.271	S	S	.	.			trans	-121.5	156.7	174.7	64.5	169	0	0	0	110.7	M154 M160	M154-I162 HydrophobicContact CE-CD1 3.93Å; M154-I162 HydrophobicContact CE-CG1 3.77Å; M154-I162 HydrophobicContact CG-CG1 4.39Å; M154-I162 WeakPolarHBondContact CG-O 3.33Å; M160-I162 HydrophobicContact CG-CD1 4.47Å; M160-I162 HydrophobicContact CG-CG1 4.14Å; M160-I162 PolarHBondContact O-N 2.54Å; M160-I162 HydrophobicContact SD-CD1 3.46Å; M160-I162 WeakPolarHBondContact SD-CD1 3.26Å; M160-I162 HydrophobicContact SD-CG1 3.77Å
163	S	90.4	Very high	90.7	Very high	11 Å²	11	55.1 Å²	55.1	8%	0.077	28%	0.284	C	S	.	.			trans	-135.3	112.1	172.9	168.8	0	0	0	0	110.1	N148 E150 H151 Q165 T166 Y167	N148-S163 PolarHBondContact ND2-OG 2.91Å; E150-S163 VanDerWaalsContact CD-CA 3.48Å; E150-S163 VanDerWaalsContact OE2-CA 3.29Å; E150-S163 WeakPolarHBondContact OE2-CA 3.37Å; E150-S163 VanDerWaalsContact OE2-CB 3.29Å; E150-S163 WeakPolarHBondContact OE2-CB 3.39Å; E150-S163 PolarHBondContact OE2-OG 3.1Å; H151-S163 WeakPolarHBondContact CE1-CB 3.44Å; H151-S163 WeakPolarHBondContact ND1-CB 3.37Å; S163-Q165 VanDerWaalsContact C-N 3.33Å; S163-T166 WeakPolarHBondContact CB-OG1 3.35Å; S163-T166 PolarHBondContact O-N 3.45Å; S163-T166 VanDerWaalsContact OG-CB 3.3Å; S163-T166 WeakPolarHBondContact OG-CB 3.18Å; S163-T166 PolarHBondContact OG-N 2.87Å; S163-T166 VanDerWaalsContact OG-N 3.11Å; S163-T166 PolarHBondContact OG-OG1 3.41Å; S163-Y167 PolarHBondContact O-N 3.29Å; S163-Y167 VanDerWaalsContact O-N 3.1Å
164	Y	88.6	Confident	90.3	Very high	135 Å²	135	61.7 Å²	61.7	53%	0.529	31%	0.309	S	S	.	.	H	α-helix	trans	-67.3	-38.1	176.8	-176	-100.1	0	0	0	110.9	E150 T166 Y167 Q168	E150-Y164 VanDerWaalsContact CD-N 3.28Å; E150-Y164 WeakPolarHBondContact OE1-CB 3.49Å; E150-Y164 PolarHBondContact OE1-N 2.84Å; E150-Y164 PolarHBondContact OE2-N 3.48Å; Y164-T166 VanDerWaalsContact C-N 3.32Å; Y164-T166 PolarHBondContact O-N 2.85Å; Y164-Y167 WeakPolarHBondContact O-CB 3.49Å; Y164-Y167 PolarHBondContact O-N 3.47Å; Y164-Q168 HydrophobicContact CD1-CG 3.93Å; Y164-Q168 HydrophobicContact CE1-CG 3.53Å; Y164-Q168 HydrophobicContact CE2-CG 4.42Å; Y164-Q168 WeakPolarHBondContact O-CG 3.42Å; Y164-Q168 PolarHBondContact O-N 3.4Å; Y164-Q168 PolarHBondContact OH-NE2 3.37Å
165	Q	85.8	Confident	89.8	Confident	63 Å²	63	69.9 Å²	69.9	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-42.1	178.2	-164.9	-173.2	100.4	0	0	111.5	F46 T47 E150 S163 Y167 Q168 F169	F46-Q165 VanDerWaalsContact CB-OE1 3.24Å; T47-Q165 PolarHBondContact O-NE2 2.89Å; E150-Q165 VanDerWaalsContact OE2-CB 3.25Å; E150-Q165 WeakPolarHBondContact OE2-CB 3.5Å; E150-Q165 PolarHBondContact OE2-N 3.5Å; S163-Q165 VanDerWaalsContact C-N 3.33Å; Q165-Y167 VanDerWaalsContact C-N 3.35Å; Q165-Q168 PolarHBondContact O-N 3.49Å; Q165-F169 WeakPolarHBondContact O-CB 3.49Å; Q165-F169 PolarHBondContact O-N 3.24Å
166	T	87.2	Confident	89.3	Confident	18 Å²	18	70 Å²	70	11%	0.11	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-45	174.2	-60.1	0	0	0	0	111.1	L144 L145 N148 S163 Y164 Q168 F169 C170	L144-T166 PolarHBondContact O-OG1 3.28Å; L145-T166 HydrophobicContact CB-CG2 4.07Å; L145-T166 HydrophobicContact CD2-CG2 3.77Å; L145-T166 WeakPolarHBondContact O-CG2 3.35Å; N148-T166 PolarHBondContact ND2-OG1 2.96Å; S163-T166 WeakPolarHBondContact CB-OG1 3.35Å; S163-T166 PolarHBondContact O-N 3.45Å; S163-T166 VanDerWaalsContact OG-CB 3.3Å; S163-T166 WeakPolarHBondContact OG-CB 3.18Å; S163-T166 PolarHBondContact OG-N 2.87Å; S163-T166 VanDerWaalsContact OG-N 3.11Å; S163-T166 PolarHBondContact OG-OG1 3.41Å; Y164-T166 VanDerWaalsContact C-N 3.32Å; Y164-T166 PolarHBondContact O-N 2.85Å; T166-Q168 PolarHBondContact O-N 3.18Å; T166-F169 PolarHBondContact O-N 2.9Å; T166-C170 WeakPolarHBondContact O-CB 3.46Å; T166-C170 PolarHBondContact O-N 2.93Å; T166-C170 PolarHBondContact O-SG 3.1Å; T166-C170 VanDerWaalsContact O-SG 3.37Å
167	Y	88.2	Confident	88.8	Confident	138 Å²	138	74.2 Å²	74.2	54%	0.541	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-48.1	178.5	179.2	-105.3	0	0	0	111.6	S163 Y164 Q165 F169 C170 L171	S163-Y167 PolarHBondContact O-N 3.29Å; S163-Y167 VanDerWaalsContact O-N 3.1Å; Y164-Y167 WeakPolarHBondContact O-CB 3.49Å; Y164-Y167 PolarHBondContact O-N 3.47Å; Q165-Y167 VanDerWaalsContact C-N 3.35Å; Y167-F169 PolarHBondContact O-N 3.3Å; Y167-C170 PolarHBondContact O-N 3.18Å; Y167-L171 HydrophobicContact CD1-CD1 3.94Å; Y167-L171 HydrophobicContact CD1-CG 4.44Å; Y167-L171 HydrophobicContact CE1-CD1 3.35Å; Y167-L171 HydrophobicContact CE1-CG 4.09Å; Y167-L171 HydrophobicContact CE2-CD1 4.41Å; Y167-L171 HydrophobicContact CE2-CD2 4.48Å; Y167-L171 HydrophobicContact CE2-CG 4.35Å; Y167-L171 WeakPolarHBondContact O-CG 3.41Å; Y167-L171 PolarHBondContact O-N 2.92Å
168	Q	86.5	Confident	88.5	Confident	67 Å²	67	75 Å²	75	31%	0.313	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-39.8	177	-68.7	-58.2	-26.4	0	0	112.8	Y164 Q165 T166 L171 T172	Y164-Q168 HydrophobicContact CD1-CG 3.93Å; Y164-Q168 HydrophobicContact CE1-CG 3.53Å; Y164-Q168 HydrophobicContact CE2-CG 4.42Å; Y164-Q168 WeakPolarHBondContact O-CG 3.42Å; Y164-Q168 PolarHBondContact O-N 3.4Å; Y164-Q168 PolarHBondContact OH-NE2 3.37Å; Q165-Q168 PolarHBondContact O-N 3.49Å; T166-Q168 PolarHBondContact O-N 3.18Å; Q168-L171 PolarHBondContact O-N 3.03Å; Q168-T172 WeakPolarHBondContact O-CB 3.41Å; Q168-T172 PolarHBondContact O-N 3.21Å; Q168-T172 PolarHBondContact O-OG1 3.5Å
169	F	86.3	Confident	88.3	Confident	115 Å²	115	76 Å²	76	50%	0.504	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-50.1	174.2	174.9	-98.1	0	0	0	111.1	L145 Q165 T166 Y167 L171 T172 V173	L145-F169 HydrophobicContact CD2-CD1 3.97Å; L145-F169 HydrophobicContact CD2-CE1 4.18Å; Q165-F169 WeakPolarHBondContact O-CB 3.49Å; Q165-F169 PolarHBondContact O-N 3.24Å; T166-F169 PolarHBondContact O-N 2.9Å; Y167-F169 PolarHBondContact O-N 3.3Å; F169-L171 VanDerWaalsContact C-N 3.34Å; F169-L171 PolarHBondContact O-N 3.47Å; F169-T172 PolarHBondContact O-N 2.9Å; F169-V173 HydrophobicContact CD1-CG2 4.22Å; F169-V173 HydrophobicContact CD2-CG2 4.32Å; F169-V173 HydrophobicContact CE1-CG2 3.79Å; F169-V173 HydrophobicContact CE2-CG2 3.89Å; F169-V173 HydrophobicContact CG-CG2 4.47Å; F169-V173 HydrophobicContact CZ-CG2 3.61Å; F169-V173 WeakPolarHBondContact O-CB 3.44Å; F169-V173 WeakPolarHBondContact O-CG2 3.46Å; F169-V173 PolarHBondContact O-N 3.27Å
170	C	86.4	Confident	88.1	Confident	56 Å²	56	81.7 Å²	81.7	38%	0.378	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-40.6	178.2	-72.9	0	0	0	0	112.2	T166 Y167 R174	T166-C170 WeakPolarHBondContact O-CB 3.46Å; T166-C170 PolarHBondContact O-N 2.93Å; T166-C170 PolarHBondContact O-SG 3.1Å; T166-C170 VanDerWaalsContact O-SG 3.37Å; Y167-C170 PolarHBondContact O-N 3.18Å; C170-R174 VanDerWaalsContact O-CB 3.23Å; C170-R174 WeakPolarHBondContact O-CB 3.34Å; C170-R174 PolarHBondContact O-N 3.46Å
171	L	87.3	Confident	88.1	Confident	64 Å²	64	85.2 Å²	85.2	34%	0.335	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-43.3	174.6	-74.6	-175.9	0	0	0	112.2	Y167 Q168 F169 R174 K175	Y167-L171 HydrophobicContact CD1-CD1 3.94Å; Y167-L171 HydrophobicContact CD1-CG 4.44Å; Y167-L171 HydrophobicContact CE1-CD1 3.35Å; Y167-L171 HydrophobicContact CE1-CG 4.09Å; Y167-L171 HydrophobicContact CE2-CD1 4.41Å; Y167-L171 HydrophobicContact CE2-CD2 4.48Å; Y167-L171 HydrophobicContact CE2-CG 4.35Å; Y167-L171 WeakPolarHBondContact O-CG 3.41Å; Y167-L171 PolarHBondContact O-N 2.92Å; Q168-L171 PolarHBondContact O-N 3.03Å; F169-L171 VanDerWaalsContact C-N 3.34Å; F169-L171 PolarHBondContact O-N 3.47Å; L171-R174 PolarHBondContact O-N 3.04Å; L171-K175 WeakPolarHBondContact O-CB 3.46Å; L171-K175 PolarHBondContact O-N 3.35Å
172	T	85.6	Confident	88.3	Confident	75 Å²	75	84.1 Å²	84.1	46%	0.46	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-47.7	178.5	-59	0	0	0	0	110.7	Q168 F169 R174 K175 I176	Q168-T172 WeakPolarHBondContact O-CB 3.41Å; Q168-T172 PolarHBondContact O-N 3.21Å; Q168-T172 PolarHBondContact O-OG1 3.5Å; F169-T172 PolarHBondContact O-N 2.9Å; T172-R174 VanDerWaalsContact C-N 3.34Å; T172-R174 PolarHBondContact O-N 3.35Å; T172-K175 PolarHBondContact O-N 3.46Å; T172-I176 HydrophobicContact CG2-CD1 4.01Å; T172-I176 WeakPolarHBondContact O-CG1 3.37Å; T172-I176 PolarHBondContact O-N 3.4Å
173	V	84.9	Confident	88.4	Confident	49 Å²	49	80.3 Å²	80.3	30%	0.297	38%	0.381	S	S	.	.	H	α-helix	trans	-59.5	-45.2	175.5	170.2	0	0	0	0	110.9	F169 K175 I176 I177	F169-V173 HydrophobicContact CD1-CG2 4.22Å; F169-V173 HydrophobicContact CD2-CG2 4.32Å; F169-V173 HydrophobicContact CE1-CG2 3.79Å; F169-V173 HydrophobicContact CE2-CG2 3.89Å; F169-V173 HydrophobicContact CG-CG2 4.47Å; F169-V173 HydrophobicContact CZ-CG2 3.61Å; F169-V173 WeakPolarHBondContact O-CB 3.44Å; F169-V173 WeakPolarHBondContact O-CG2 3.46Å; F169-V173 PolarHBondContact O-N 3.27Å; V173-K175 PolarHBondContact O-N 2.84Å; V173-I176 PolarHBondContact O-N 3.27Å; V173-I177 HydrophobicContact CG1-CD1 3.45Å; V173-I177 VanDerWaalsContact CG1-CD1 3.45Å; V173-I177 HydrophobicContact CG1-CG1 4.14Å; V173-I177 WeakPolarHBondContact O-CB 3.34Å; V173-I177 WeakPolarHBondContact O-CG1 3.4Å; V173-I177 PolarHBondContact O-N 3.46Å
174	R	87.6	Confident	88.6	Confident	138 Å²	138	87.3 Å²	87.3	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-47.1	175.2	-177.1	-174.5	120.8	88.2	8.5	111.1	C170 L171 T172 I176 I177 C178 A218	C170-R174 VanDerWaalsContact O-CB 3.23Å; C170-R174 WeakPolarHBondContact O-CB 3.34Å; C170-R174 PolarHBondContact O-N 3.46Å; L171-R174 PolarHBondContact O-N 3.04Å; T172-R174 VanDerWaalsContact C-N 3.34Å; T172-R174 PolarHBondContact O-N 3.35Å; R174-I176 VanDerWaalsContact C-N 3.29Å; R174-I176 PolarHBondContact O-N 2.96Å; R174-I177 PolarHBondContact O-N 3.21Å; R174-C178 HydrophobicContact CG-CB 4.45Å; R174-C178 WeakPolarHBondContact O-CA 3.32Å; R174-C178 WeakPolarHBondContact O-CB 3.43Å; R174-C178 PolarHBondContact O-N 2.74Å; R174-A218 PolarHBondContact NH1-O 2.69Å
175	K	87.8	Confident	88.9	Confident	171 Å²	171	84.7 Å²	84.7	74%	0.743	40%	0.402	S	S	*	.	H	α-helix	trans	-63.3	-35.4	179.9	-173.7	177.1	-179.3	179.4	0	112.5	L171 T172 V173	L171-K175 WeakPolarHBondContact O-CB 3.46Å; L171-K175 PolarHBondContact O-N 3.35Å; T172-K175 PolarHBondContact O-N 3.46Å; V173-K175 PolarHBondContact O-N 2.84Å
176	I	85.5	Confident	89.3	Confident	106 Å²	106	83.9 Å²	83.9	54%	0.544	40%	0.401	S	S	.	.	H	α-helix	trans	-71.2	-57.9	175.7	-66.7	167	0	0	0	109.5	T172 V173 R174 S179 N182	T172-I176 HydrophobicContact CG2-CD1 4.01Å; T172-I176 WeakPolarHBondContact O-CG1 3.37Å; T172-I176 PolarHBondContact O-N 3.4Å; V173-I176 PolarHBondContact O-N 3.27Å; R174-I176 VanDerWaalsContact C-N 3.29Å; R174-I176 PolarHBondContact O-N 2.96Å; I176-S179 PolarHBondContact O-OG 2.84Å; I176-S179 VanDerWaalsContact O-OG 3.09Å; I176-N182 PolarHBondContact O-ND2 3.49Å
177	I	87.3	Confident	89.6	Confident	90 Å²	90	84.5 Å²	84.5	46%	0.462	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-53.6	-174.5	-65.5	178	0	0	0	111.1	V173 R174 S179 N182	V173-I177 HydrophobicContact CG1-CD1 3.45Å; V173-I177 VanDerWaalsContact CG1-CD1 3.45Å; V173-I177 HydrophobicContact CG1-CG1 4.14Å; V173-I177 WeakPolarHBondContact O-CB 3.34Å; V173-I177 WeakPolarHBondContact O-CG1 3.4Å; V173-I177 PolarHBondContact O-N 3.46Å; R174-I177 PolarHBondContact O-N 3.21Å; I177-S179 PolarHBondContact O-N 2.77Å; I177-N182 VanDerWaalsContact O-CB 3.27Å; I177-N182 WeakPolarHBondContact O-CB 3.37Å; I177-N182 PolarHBondContact O-ND2 3.47Å
178	C	90.2	Very high	90	Very high	30 Å²	30	83.8 Å²	83.8	20%	0.203	41%	0.412	C	S	.	.	S	Bend	trans	-85	66.3	178.1	-54.1	0	0	0	0	110.1	R174 A218 S219	R174-C178 HydrophobicContact CG-CB 4.45Å; R174-C178 WeakPolarHBondContact O-CA 3.32Å; R174-C178 WeakPolarHBondContact O-CB 3.43Å; R174-C178 PolarHBondContact O-N 2.74Å; C178-A218 HydrophobicContact CB-CB 4Å; C178-S219 WeakPolarHBondContact O-CA 3.2Å; C178-S219 PolarHBondContact O-OG 2.87Å; C178-S219 VanDerWaalsContact O-OG 3.1Å
179	S	92.8	Very high	90.4	Very high	27 Å²	27	84.4 Å²	84.4	19%	0.189	42%	0.424	C	S	.	.			trans	-116.9	149.8	169.3	65.7	0	0	0	0	110.5	I176 I177 M181 N182 A183 S219	I176-S179 PolarHBondContact O-OG 2.84Å; I176-S179 VanDerWaalsContact O-OG 3.09Å; I177-S179 PolarHBondContact O-N 2.77Å; S179-M181 PolarHBondContact O-N 2.9Å; S179-N182 PolarHBondContact O-N 3.36Å; S179-N182 PolarHBondContact OG-N 3.26Å; S179-N182 PolarHBondContact OG-ND2 3.39Å; S179-A183 PolarHBondContact O-N 3.09Å; S179-S219 VanDerWaalsContact C-OG 3.24Å; S179-S219 WeakPolarHBondContact CA-OG 3.35Å; S179-S219 PolarHBondContact N-OG 3.45Å
180	R	91.3	Very high	90.7	Very high	159 Å²	159	79.5 Å²	79.5	60%	0.6	41%	0.406	S	S	*	.	H	α-helix	trans	-54.2	-38.4	176.1	-69	-173.2	176.6	-172.6	-1.1	112.2	A183 Y184	R180-A183 WeakPolarHBondContact O-CB 3.39Å; R180-A183 PolarHBondContact O-N 3.01Å; R180-Y184 HydrophobicContact CB-CE2 4.38Å; R180-Y184 WeakPolarHBondContact O-CD2 3.23Å; R180-Y184 PolarHBondContact O-N 3Å
181	M	92.6	Very high	91	Very high	127 Å²	127	80.3 Å²	80.3	63%	0.626	41%	0.409	S	S	*	.	H	α-helix	trans	-59.7	-46.6	175.9	-175	178.4	70.3	0	0	111.6	S179 A183 Y184 L185	S179-M181 PolarHBondContact O-N 2.9Å; M181-A183 VanDerWaalsContact C-N 3.34Å; M181-A183 PolarHBondContact O-N 3.48Å; M181-Y184 PolarHBondContact O-N 2.99Å; M181-L185 HydrophobicContact CG-CD1 4.04Å; M181-L185 WeakPolarHBondContact O-CG 3.43Å; M181-L185 PolarHBondContact O-N 3.45Å
182	N	91.8	Very high	91.3	Very high	41 Å²	41	79 Å²	79	22%	0.219	41%	0.411	C	S	.	.	H	α-helix	trans	-68.7	-31.6	177.5	-77.3	-14.4	0	0	0	112.9	I176 I177 S179 L185 T186 I215	I176-N182 PolarHBondContact O-ND2 3.49Å; I177-N182 VanDerWaalsContact O-CB 3.27Å; I177-N182 WeakPolarHBondContact O-CB 3.37Å; I177-N182 PolarHBondContact O-ND2 3.47Å; S179-N182 PolarHBondContact O-N 3.36Å; S179-N182 PolarHBondContact OG-N 3.26Å; S179-N182 PolarHBondContact OG-ND2 3.39Å; N182-L185 PolarHBondContact O-N 2.98Å; N182-T186 WeakPolarHBondContact O-CB 3.35Å; N182-T186 VanDerWaalsContact O-CG2 3.3Å; N182-T186 WeakPolarHBondContact O-CG2 3.36Å; N182-T186 PolarHBondContact O-N 3.49Å; N182-T186 PolarHBondContact O-OG1 3.36Å; N182-I215 HydrophobicContact CB-CG2 4.44Å
183	A	93.6	Very high	91.5	Very high	6 Å²	6	79 Å²	79	5%	0.05	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-46.1	170.7	0	0	0	0	0	111.4	S179 R180 M181 T186 A187 P212 I215 W216	S179-A183 PolarHBondContact O-N 3.09Å; R180-A183 WeakPolarHBondContact O-CB 3.39Å; R180-A183 PolarHBondContact O-N 3.01Å; M181-A183 VanDerWaalsContact C-N 3.34Å; M181-A183 PolarHBondContact O-N 3.48Å; A183-T186 PolarHBondContact O-OG1 3.18Å; A183-A187 WeakPolarHBondContact O-CB 3.37Å; A183-A187 PolarHBondContact O-N 2.91Å; A183-P212 VanDerWaalsContact O-CB 3.23Å; A183-P212 WeakPolarHBondContact O-CB 3.37Å; A183-I215 HydrophobicContact CB-CB 4.2Å; A183-I215 HydrophobicContact CB-CG2 3.82Å; A183-W216 HydrophobicContact CB-CB 3.88Å
184	Y	94.2	Very high	91.9	Very high	159 Å²	159	77.6 Å²	77.6	62%	0.624	40%	0.402	S	S	*	.	H	α-helix	trans	-66.5	-42.9	176.5	-68	-59.1	0	0	0	112.9	R180 M181 T186 A187 L188	R180-Y184 HydrophobicContact CB-CE2 4.38Å; R180-Y184 WeakPolarHBondContact O-CD2 3.23Å; R180-Y184 PolarHBondContact O-N 3Å; M181-Y184 PolarHBondContact O-N 2.99Å; Y184-T186 PolarHBondContact O-N 3.37Å; Y184-A187 PolarHBondContact O-N 2.9Å; Y184-L188 WeakPolarHBondContact O-CB 3.3Å; Y184-L188 PolarHBondContact O-N 3.14Å
185	L	94.7	Very high	92.1	Very high	80 Å²	80	77.3 Å²	77.3	42%	0.419	41%	0.41	S	S	.	.	H	α-helix	trans	-62.4	-42.7	177.4	-73	170.3	0	0	0	111.7	M181 N182 L188 C189	M181-L185 HydrophobicContact CG-CD1 4.04Å; M181-L185 WeakPolarHBondContact O-CG 3.43Å; M181-L185 PolarHBondContact O-N 3.45Å; N182-L185 PolarHBondContact O-N 2.98Å; L185-L188 PolarHBondContact O-N 3.24Å; L185-C189 WeakPolarHBondContact O-CB 3.27Å; L185-C189 PolarHBondContact O-N 3.44Å; L185-C189 PolarHBondContact O-SG 3.45Å
186	T	93.9	Very high	92.3	Very high	45 Å²	45	78.8 Å²	78.8	28%	0.276	41%	0.412	S	S	.	.	H	α-helix	trans	-67.5	-36.2	177.3	49.3	0	0	0	0	112.3	N182 A183 Y184 G190 V211 I215	N182-T186 WeakPolarHBondContact O-CB 3.35Å; N182-T186 VanDerWaalsContact O-CG2 3.3Å; N182-T186 WeakPolarHBondContact O-CG2 3.36Å; N182-T186 PolarHBondContact O-N 3.49Å; N182-T186 PolarHBondContact O-OG1 3.36Å; A183-T186 PolarHBondContact O-OG1 3.18Å; Y184-T186 PolarHBondContact O-N 3.37Å; T186-G190 PolarHBondContact O-N 3.48Å; T186-V211 HydrophobicContact CG2-CG1 4.49Å; T186-I215 HydrophobicContact CG2-CD1 3.83Å
187	A	94.4	Very high	92.6	Very high	31 Å²	31	77.9 Å²	77.9	26%	0.256	41%	0.408	S	S	.	.	H	α-helix	trans	-62.3	-48.3	171.4	0	0	0	0	0	111.4	A183 Y184 C189 G190 T191 P212	A183-A187 WeakPolarHBondContact O-CB 3.37Å; A183-A187 PolarHBondContact O-N 2.91Å; Y184-A187 PolarHBondContact O-N 2.9Å; A187-C189 PolarHBondContact O-N 2.88Å; A187-G190 PolarHBondContact O-N 2.88Å; A187-T191 PolarHBondContact O-N 3.27Å; A187-T191 PolarHBondContact O-OG1 2.88Å; A187-T191 VanDerWaalsContact O-OG1 3.14Å; A187-P212 HydrophobicContact CB-CB 3.74Å; A187-P212 HydrophobicContact CB-CG 3.93Å
188	L	95.8	Very high	92.7	Very high	123 Å²	123	77 Å²	77	64%	0.644	42%	0.422	S	S	*	.	H	α-helix	trans	-60.8	-47.1	179.4	-177.2	65.7	0	0	0	111.8	Y184 L185 T191 G192	Y184-L188 WeakPolarHBondContact O-CB 3.3Å; Y184-L188 PolarHBondContact O-N 3.14Å; L185-L188 PolarHBondContact O-N 3.24Å; L188-T191 PolarHBondContact O-N 2.9Å; L188-G192 PolarHBondContact O-N 3.34Å
189	C	94.4	Very high	92.5	Very high	81 Å²	81	77.9 Å²	77.9	55%	0.547	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-41.7	176.5	-71.5	0	0	0	0	112	L185 A187 G192 T193	L185-C189 WeakPolarHBondContact O-CB 3.27Å; L185-C189 PolarHBondContact O-N 3.44Å; L185-C189 PolarHBondContact O-SG 3.45Å; A187-C189 PolarHBondContact O-N 2.88Å; C189-G192 PolarHBondContact O-N 3.03Å; C189-T193 WeakPolarHBondContact O-CB 3.46Å; C189-T193 PolarHBondContact O-N 2.73Å; C189-T193 PolarHBondContact O-OG1 3.04Å
190	G	92.9	Very high	92.3	Very high	12 Å²	12	82.4 Å²	82.4	12%	0.124	45%	0.454	C	S	.	.	H	α-helix	trans	-62	-49.9	176.6	0	0	0	0	0	111.8	T186 A187 G192 T193 V194 T208	T186-G190 PolarHBondContact O-N 3.48Å; A187-G190 PolarHBondContact O-N 2.88Å; G190-G192 PolarHBondContact O-N 2.88Å; G190-T193 WeakPolarHBondContact O-CB 3.48Å; G190-T193 PolarHBondContact O-N 2.98Å; G190-V194 WeakPolarHBondContact O-CG2 3.29Å; G190-V194 PolarHBondContact O-N 3.27Å; G190-T208 VanDerWaalsContact C-CG2 3.45Å
191	T	92.8	Very high	92.3	Very high	73 Å²	73	77.6 Å²	77.6	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-59.5	-45.8	175.2	-60.4	0	0	0	0	111.7	A187 L188 T193 V194 L195	A187-T191 PolarHBondContact O-N 3.27Å; A187-T191 PolarHBondContact O-OG1 2.88Å; A187-T191 VanDerWaalsContact O-OG1 3.14Å; L188-T191 PolarHBondContact O-N 2.9Å; T191-T193 VanDerWaalsContact C-N 3.28Å; T191-T193 PolarHBondContact O-N 2.97Å; T191-V194 PolarHBondContact O-N 3.49Å; T191-L195 HydrophobicContact CG2-CD1 4.13Å; T191-L195 HydrophobicContact CG2-CG 4.47Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.1Å
192	G	92.9	Very high	92	Very high	36 Å²	36	78.2 Å²	78.2	37%	0.371	45%	0.448	S	S	.	.	H	α-helix	trans	-59.2	-38.3	176.3	0	0	0	0	0	112.9	L188 C189 G190 L195 Y196	L188-G192 PolarHBondContact O-N 3.34Å; C189-G192 PolarHBondContact O-N 3.03Å; G190-G192 PolarHBondContact O-N 2.88Å; G192-L195 PolarHBondContact O-N 3.29Å; G192-Y196 VanDerWaalsContact O-CB 3.32Å; G192-Y196 WeakPolarHBondContact O-CB 3.49Å; G192-Y196 PolarHBondContact O-N 3.29Å
193	T	90.6	Very high	91.8	Very high	74 Å²	74	82.9 Å²	82.9	45%	0.454	47%	0.472	S	S	.	.	H	α-helix	trans	-66.6	-43.9	176.6	-55.8	0	0	0	0	111.7	C189 G190 T191 L195 Y196 L197	C189-T193 WeakPolarHBondContact O-CB 3.46Å; C189-T193 PolarHBondContact O-N 2.73Å; C189-T193 PolarHBondContact O-OG1 3.04Å; G190-T193 WeakPolarHBondContact O-CB 3.48Å; G190-T193 PolarHBondContact O-N 2.98Å; T191-T193 VanDerWaalsContact C-N 3.28Å; T191-T193 PolarHBondContact O-N 2.97Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3.01Å; T193-Y196 PolarHBondContact O-N 3.31Å; T193-L197 HydrophobicContact CG2-CD1 4.04Å; T193-L197 WeakPolarHBondContact O-CG 3.19Å; T193-L197 PolarHBondContact O-N 3.23Å
194	V	92.6	Very high	91.6	Very high	21 Å²	21	84.6 Å²	84.6	13%	0.127	48%	0.48	C	S	.	.	H	α-helix	trans	-61.9	-43.2	176.6	173.4	0	0	0	0	110.9	G190 T191 G198 V200 N204	G190-V194 WeakPolarHBondContact O-CG2 3.29Å; G190-V194 PolarHBondContact O-N 3.27Å; T191-V194 PolarHBondContact O-N 3.49Å; V194-G198 PolarHBondContact O-N 3.35Å; V194-V200 HydrophobicContact CG1-CG2 4.14Å; V194-N204 HydrophobicContact CG2-CB 4.16Å
195	L	91.8	Very high	91.3	Very high	132 Å²	132	78.7 Å²	78.7	69%	0.691	46%	0.461	S	S	*	.	H	α-helix	trans	-64.5	-44.5	176.9	-69.2	174.2	0	0	0	112	T191 G192 T193 L197 G198	T191-L195 HydrophobicContact CG2-CD1 4.13Å; T191-L195 HydrophobicContact CG2-CG 4.47Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.1Å; G192-L195 PolarHBondContact O-N 3.29Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3.01Å; L195-L197 PolarHBondContact O-N 3.45Å; L195-G198 PolarHBondContact O-N 2.68Å; L195-G198 VanDerWaalsContact O-N 3.14Å
196	Y	92.2	Very high	91.2	Very high	201 Å²	201	78 Å²	78	79%	0.788	46%	0.459	S	S	*	.	H	α-helix	trans	-61.3	-42.1	179.3	174.8	-101	0	0	0	112.6	G192 T193 G198	G192-Y196 VanDerWaalsContact O-CB 3.32Å; G192-Y196 WeakPolarHBondContact O-CB 3.49Å; G192-Y196 PolarHBondContact O-N 3.29Å; T193-Y196 PolarHBondContact O-N 3.31Å; Y196-G198 PolarHBondContact O-N 3.43Å
197	L	91.5	Very high	91	Very high	87 Å²	87	78.7 Å²	78.7	46%	0.455	47%	0.465	S	S	.	.	H	α-helix	trans	-73.3	-13.9	178.8	-67.9	173.6	0	0	0	112.9	T193 L195 S199 N204	T193-L197 HydrophobicContact CG2-CD1 4.04Å; T193-L197 WeakPolarHBondContact O-CG 3.19Å; T193-L197 PolarHBondContact O-N 3.23Å; L195-L197 PolarHBondContact O-N 3.45Å; L197-S199 PolarHBondContact O-N 2.95Å; L197-N204 WeakPolarHBondContact CD1-ND2 3.24Å
198	G	88.8	Confident	91	Very high	72 Å²	72	78.4 Å²	78.4	74%	0.742	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	12.6	-179.8	0	0	0	0	0	114.3	V194 L195 Y196	V194-G198 PolarHBondContact O-N 3.35Å; L195-G198 PolarHBondContact O-N 2.68Å; L195-G198 VanDerWaalsContact O-N 3.14Å; Y196-G198 PolarHBondContact O-N 3.43Å
199	S	86.3	Confident	90.8	Very high	48 Å²	48	78.5 Å²	78.5	34%	0.336	46%	0.461	S	S	.	.			trans	-133.2	125.9	-174.3	74.6	0	0	0	0	110.7	L197	L197-S199 PolarHBondContact O-N 2.95Å
200	V	88.4	Confident	90.8	Very high	122 Å²	122	79.1 Å²	79.1	74%	0.739	46%	0.458	S	S	*	.			trans	-98.8	95.7	176.7	-176.1	0	0	0	0	108	V194 T205	V194-V200 HydrophobicContact CG1-CG2 4.14Å; V200-T205 HydrophobicContact CG1-CG2 3.42Å; V200-T205 VanDerWaalsContact CG1-CG2 3.42Å
201	T	91.3	Very high	90.8	Very high	58 Å²	58	81.6 Å²	81.6	36%	0.356	47%	0.471	S	S	.	.			trans	-115.3	153.2	176.8	64	0	0	0	0	110.2	L203 N204 T205	T201-L203 PolarHBondContact O-N 3.4Å; T201-N204 PolarHBondContact O-N 3.48Å; T201-T205 PolarHBondContact O-N 2.92Å; T201-T205 PolarHBondContact O-OG1 3.01Å
202	L	87.5	Confident	90.9	Very high	141 Å²	141	78.8 Å²	78.8	74%	0.738	45%	0.454	S	S	*	.	H	α-helix	trans	-53.1	-36.6	174.5	-75.9	167.7	0	0	0	112.2	N204 T205 V206	L202-N204 VanDerWaalsContact C-N 3.26Å; L202-N204 PolarHBondContact O-N 3.26Å; L202-T205 WeakPolarHBondContact CA-OG1 3.26Å; L202-V206 HydrophobicContact CD2-CG2 4.16Å; L202-V206 WeakPolarHBondContact O-CB 3.28Å; L202-V206 WeakPolarHBondContact O-CG2 3.28Å; L202-V206 PolarHBondContact O-N 3.05Å; L202-V206 VanDerWaalsContact O-N 3.09Å
203	L	88.1	Confident	90.9	Very high	139 Å²	139	82.4 Å²	82.4	73%	0.728	46%	0.459	S	S	*	.	H	α-helix	trans	-61.6	-32.3	180	-175.4	62	0	0	0	113	T201 P207	T201-L203 PolarHBondContact O-N 3.4Å; L203-P207 WeakPolarHBondContact O-CD 3.34Å; L203-P207 WeakPolarHBondContact O-CG 3.33Å
204	N	88.5	Confident	91.1	Very high	41 Å²	41	82.6 Å²	82.6	22%	0.219	46%	0.461	C	S	.	.	H	α-helix	trans	-100.1	-35.6	-177.5	-63.1	-17.6	0	0	0	112.1	V194 L197 T201 L202 T208	V194-N204 HydrophobicContact CG2-CB 4.16Å; L197-N204 WeakPolarHBondContact CD1-ND2 3.24Å; T201-N204 PolarHBondContact O-N 3.48Å; L202-N204 VanDerWaalsContact C-N 3.26Å; L202-N204 PolarHBondContact O-N 3.26Å; N204-T208 VanDerWaalsContact O-CB 3.29Å; N204-T208 WeakPolarHBondContact O-CB 3.21Å; N204-T208 PolarHBondContact O-N 3.09Å; N204-T208 PolarHBondContact O-OG1 2.9Å
205	T	87.9	Confident	91.1	Very high	36 Å²	36	82.7 Å²	82.7	22%	0.221	46%	0.46	C	S	.	.	H	α-helix	trans	-72.9	-39.3	-179.5	52.8	0	0	0	0	112.7	V200 T201 L202 T208 L209	V200-T205 HydrophobicContact CG1-CG2 3.42Å; V200-T205 VanDerWaalsContact CG1-CG2 3.42Å; T201-T205 PolarHBondContact O-N 2.92Å; T201-T205 PolarHBondContact O-OG1 3.01Å; L202-T205 WeakPolarHBondContact CA-OG1 3.26Å; T205-T208 PolarHBondContact O-N 2.88Å; T205-L209 PolarHBondContact O-N 3.32Å; T205-L209 VanDerWaalsContact O-N 3.12Å
206	V	91.6	Very high	91.2	Very high	64 Å²	64	82 Å²	82	39%	0.388	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-50.1	-177.9	171.4	0	0	0	0	111.4	L202 T208 L209 L210	L202-V206 HydrophobicContact CD2-CG2 4.16Å; L202-V206 WeakPolarHBondContact O-CB 3.28Å; L202-V206 WeakPolarHBondContact O-CG2 3.28Å; L202-V206 PolarHBondContact O-N 3.05Å; L202-V206 VanDerWaalsContact O-N 3.09Å; V206-T208 VanDerWaalsContact C-N 3.33Å; V206-T208 PolarHBondContact O-N 2.79Å; V206-L209 PolarHBondContact O-N 3.49Å; V206-L210 HydrophobicContact CG1-CD1 3.44Å; V206-L210 VanDerWaalsContact CG1-CD1 3.44Å; V206-L210 HydrophobicContact CG1-CG 4.1Å; V206-L210 WeakPolarHBondContact O-CB 3.04Å; V206-L210 WeakPolarHBondContact O-CG 3.2Å; V206-L210 PolarHBondContact O-N 3.3Å
207	P	91.6	Very high	91.2	Very high	61 Å²	61	78.1 Å²	78.1	40%	0.396	44%	0.439	S	S	.	.	H	α-helix	trans	-63.4	-37	174.3	-23.6	35.7	0	0	0	113.1	L203 L209 L210 V211	L203-P207 WeakPolarHBondContact O-CD 3.34Å; L203-P207 WeakPolarHBondContact O-CG 3.33Å; P207-L209 PolarHBondContact O-N 2.94Å; P207-L210 PolarHBondContact O-N 3.18Å; P207-V211 HydrophobicContact CB-CG2 4.33Å; P207-V211 VanDerWaalsContact O-CB 3.24Å; P207-V211 WeakPolarHBondContact O-CB 2.99Å; P207-V211 VanDerWaalsContact O-CG2 3.28Å; P207-V211 WeakPolarHBondContact O-CG2 3.39Å; P207-V211 PolarHBondContact O-N 2.92Å
208	T	92.6	Very high	91	Very high	24 Å²	24	75.6 Å²	75.6	15%	0.147	43%	0.43	C	S	.	.	H	α-helix	trans	-60.1	-29.6	178.6	-65.1	0	0	0	0	112.6	G190 N204 T205 V206 P212	G190-T208 VanDerWaalsContact C-CG2 3.45Å; N204-T208 VanDerWaalsContact O-CB 3.29Å; N204-T208 WeakPolarHBondContact O-CB 3.21Å; N204-T208 PolarHBondContact O-N 3.09Å; N204-T208 PolarHBondContact O-OG1 2.9Å; T205-T208 PolarHBondContact O-N 2.88Å; V206-T208 VanDerWaalsContact C-N 3.33Å; V206-T208 PolarHBondContact O-N 2.79Å; T208-P212 WeakPolarHBondContact O-CD 3.49Å; T208-P212 WeakPolarHBondContact O-CG 3.48Å
209	L	92.3	Very high	90.7	Very high	125 Å²	125	75.4 Å²	75.4	65%	0.654	42%	0.418	S	S	*	.	H	α-helix	trans	-93.4	-46	175.6	-64.2	175.6	0	0	0	112.2	T205 V206 P207 P212 F213	T205-L209 PolarHBondContact O-N 3.32Å; T205-L209 VanDerWaalsContact O-N 3.12Å; V206-L209 PolarHBondContact O-N 3.49Å; P207-L209 PolarHBondContact O-N 2.94Å; L209-P212 WeakPolarHBondContact O-CD 3.45Å; L209-P212 WeakPolarHBondContact O-CG 3.23Å; L209-F213 WeakPolarHBondContact O-CB 3.21Å; L209-F213 PolarHBondContact O-N 3.06Å
210	L	94.2	Very high	91	Very high	94 Å²	94	76.8 Å²	76.8	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-71.4	-39	-173.1	-71.1	-177.7	0	0	0	113.1	V206 P207 F213 T214	V206-L210 HydrophobicContact CG1-CD1 3.44Å; V206-L210 VanDerWaalsContact CG1-CD1 3.44Å; V206-L210 HydrophobicContact CG1-CG 4.1Å; V206-L210 WeakPolarHBondContact O-CB 3.04Å; V206-L210 WeakPolarHBondContact O-CG 3.2Å; V206-L210 PolarHBondContact O-N 3.3Å; P207-L210 PolarHBondContact O-N 3.18Å; L210-F213 PolarHBondContact O-N 3.3Å; L210-T214 WeakPolarHBondContact O-CB 3Å; L210-T214 WeakPolarHBondContact O-CG2 3.16Å; L210-T214 PolarHBondContact O-N 3.12Å; L210-T214 PolarHBondContact O-OG1 2.85Å
211	V	93.2	Very high	91.1	Very high	65 Å²	65	74.4 Å²	74.4	39%	0.394	41%	0.405	S	S	.	.	H	α-helix	trans	-63.3	-54.8	-179.2	175.3	0	0	0	0	111.7	T186 P207 F213 T214 I215	T186-V211 HydrophobicContact CG2-CG1 4.49Å; P207-V211 HydrophobicContact CB-CG2 4.33Å; P207-V211 VanDerWaalsContact O-CB 3.24Å; P207-V211 WeakPolarHBondContact O-CB 2.99Å; P207-V211 VanDerWaalsContact O-CG2 3.28Å; P207-V211 WeakPolarHBondContact O-CG2 3.39Å; P207-V211 PolarHBondContact O-N 2.92Å; V211-F213 VanDerWaalsContact C-N 3.32Å; V211-F213 PolarHBondContact O-N 3.28Å; V211-T214 PolarHBondContact O-N 3.19Å; V211-T214 PolarHBondContact O-OG1 3.14Å; V211-I215 HydrophobicContact CG1-CD1 3.82Å; V211-I215 VanDerWaalsContact O-CG1 3.26Å; V211-I215 WeakPolarHBondContact O-CG1 3.26Å; V211-I215 PolarHBondContact O-N 2.62Å
212	P	94.3	Very high	91.1	Very high	14 Å²	14	75.3 Å²	75.3	9%	0.091	41%	0.408	C	S	.	.	H	α-helix	trans	-65.7	-34.9	178	25.5	-34.5	0	0	0	112.6	A183 A187 T208 L209 I215 W216	A183-P212 VanDerWaalsContact O-CB 3.23Å; A183-P212 WeakPolarHBondContact O-CB 3.37Å; A187-P212 HydrophobicContact CB-CB 3.74Å; A187-P212 HydrophobicContact CB-CG 3.93Å; T208-P212 WeakPolarHBondContact O-CD 3.49Å; T208-P212 WeakPolarHBondContact O-CG 3.48Å; L209-P212 WeakPolarHBondContact O-CD 3.45Å; L209-P212 WeakPolarHBondContact O-CG 3.23Å; P212-I215 PolarHBondContact O-N 3.5Å; P212-W216 VanDerWaalsContact O-CB 3.26Å; P212-W216 WeakPolarHBondContact O-CB 3.46Å; P212-W216 PolarHBondContact O-N 3.19Å
213	F	94.4	Very high	91.3	Very high	112 Å²	112	71.4 Å²	71.4	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-46.4	175.5	175.4	-103.5	0	0	0	112	L209 L210 V211 W216 M217	L209-F213 WeakPolarHBondContact O-CB 3.21Å; L209-F213 PolarHBondContact O-N 3.06Å; L210-F213 PolarHBondContact O-N 3.3Å; V211-F213 VanDerWaalsContact C-N 3.32Å; V211-F213 PolarHBondContact O-N 3.28Å; F213-W216 HydrophobicContact CD2-CE3 4.24Å; F213-W216 HydrophobicContact CE2-CE3 4.25Å; F213-W216 HydrophobicContact CE2-CZ3 4.18Å; F213-W216 PolarHBondContact O-N 3.34Å; F213-M217 HydrophobicContact CD1-CG 4.26Å; F213-M217 HydrophobicContact CD2-CG 4.28Å; F213-M217 HydrophobicContact CE1-CG 3.81Å; F213-M217 HydrophobicContact CE2-CG 3.83Å; F213-M217 HydrophobicContact CE2-SD 4.13Å; F213-M217 HydrophobicContact CG-CG 4.48Å; F213-M217 HydrophobicContact CZ-CG 3.58Å; F213-M217 HydrophobicContact CZ-SD 3.99Å; F213-M217 WeakPolarHBondContact O-CB 3.4Å; F213-M217 VanDerWaalsContact O-CG 3.31Å; F213-M217 WeakPolarHBondContact O-CG 3.49Å; F213-M217 PolarHBondContact O-N 3Å
214	T	92.9	Very high	91.5	Very high	78 Å²	78	67.2 Å²	67.2	48%	0.479	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-39	178.8	51.9	0	0	0	0	112.1	L210 V211 M217 A218	L210-T214 WeakPolarHBondContact O-CB 3Å; L210-T214 WeakPolarHBondContact O-CG2 3.16Å; L210-T214 PolarHBondContact O-N 3.12Å; L210-T214 PolarHBondContact O-OG1 2.85Å; V211-T214 PolarHBondContact O-N 3.19Å; V211-T214 PolarHBondContact O-OG1 3.14Å; T214-M217 PolarHBondContact O-N 3.47Å; T214-A218 VanDerWaalsContact O-CB 3.28Å; T214-A218 WeakPolarHBondContact O-CB 3.31Å; T214-A218 PolarHBondContact O-N 2.84Å
215	I	92.8	Very high	91.7	Very high	22 Å²	22	68.9 Å²	68.9	11%	0.113	38%	0.377	C	S	.	.	H	α-helix	trans	-61.5	-47.4	172.6	-67	170.9	0	0	0	110	N182 A183 T186 V211 P212 A218 S219	N182-I215 HydrophobicContact CB-CG2 4.44Å; A183-I215 HydrophobicContact CB-CB 4.2Å; A183-I215 HydrophobicContact CB-CG2 3.82Å; T186-I215 HydrophobicContact CG2-CD1 3.83Å; V211-I215 HydrophobicContact CG1-CD1 3.82Å; V211-I215 VanDerWaalsContact O-CG1 3.26Å; V211-I215 WeakPolarHBondContact O-CG1 3.26Å; V211-I215 PolarHBondContact O-N 2.62Å; P212-I215 PolarHBondContact O-N 3.5Å; I215-A218 CarbonylContact O-C 3.6Å; I215-A218 PolarHBondContact O-N 3.2Å; I215-S219 WeakPolarHBondContact O-CB 3.47Å; I215-S219 PolarHBondContact O-N 2.86Å; I215-S219 PolarHBondContact O-OG 3.05Å
216	W	93.9	Very high	92	Very high	119 Å²	119	71.3 Å²	71.3	45%	0.451	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-44.7	178	176.7	77.6	0	0	0	112.4	A183 P212 F213 A218 S219	A183-W216 HydrophobicContact CB-CB 3.88Å; P212-W216 VanDerWaalsContact O-CB 3.26Å; P212-W216 WeakPolarHBondContact O-CB 3.46Å; P212-W216 PolarHBondContact O-N 3.19Å; F213-W216 HydrophobicContact CD2-CE3 4.24Å; F213-W216 HydrophobicContact CE2-CE3 4.25Å; F213-W216 HydrophobicContact CE2-CZ3 4.18Å; F213-W216 PolarHBondContact O-N 3.34Å; W216-A218 PolarHBondContact O-N 3.32Å; W216-S219 WeakPolarHBondContact O-CB 3.2Å; W216-S219 PolarHBondContact O-N 3.17Å
217	M	92.1	Very high	92	Very high	118 Å²	118	71.8 Å²	71.8	58%	0.581	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-31.3	175.2	-76.9	-61.8	-58.5	0	0	112.8	F213 T214	F213-M217 HydrophobicContact CD1-CG 4.26Å; F213-M217 HydrophobicContact CD2-CG 4.28Å; F213-M217 HydrophobicContact CE1-CG 3.81Å; F213-M217 HydrophobicContact CE2-CG 3.83Å; F213-M217 HydrophobicContact CE2-SD 4.13Å; F213-M217 HydrophobicContact CG-CG 4.48Å; F213-M217 HydrophobicContact CZ-CG 3.58Å; F213-M217 HydrophobicContact CZ-SD 3.99Å; F213-M217 WeakPolarHBondContact O-CB 3.4Å; F213-M217 VanDerWaalsContact O-CG 3.31Å; F213-M217 WeakPolarHBondContact O-CG 3.49Å; F213-M217 PolarHBondContact O-N 3Å; T214-M217 PolarHBondContact O-N 3.47Å
218	A	87.6	Confident	92	Very high	34 Å²	34	72.8 Å²	72.8	28%	0.281	39%	0.387	S	S	.	.	H	α-helix	trans	-86.9	-8.6	179.3	0	0	0	0	0	114.2	R174 C178 T214 I215 W216	R174-A218 PolarHBondContact NH1-O 2.69Å; C178-A218 HydrophobicContact CB-CB 4Å; T214-A218 VanDerWaalsContact O-CB 3.28Å; T214-A218 WeakPolarHBondContact O-CB 3.31Å; T214-A218 PolarHBondContact O-N 2.84Å; I215-A218 CarbonylContact O-C 3.6Å; I215-A218 PolarHBondContact O-N 3.2Å; W216-A218 PolarHBondContact O-N 3.32Å
219	S	83.8	Confident	92	Very high	68 Å²	68	77.2 Å²	77.2	48%	0.476	41%	0.409	S	S	.	.			trans	-90.4	0	-176.2	-60.7	0	0	0	0	112.5	C178 S179 I215 W216	C178-S219 WeakPolarHBondContact O-CA 3.2Å; C178-S219 PolarHBondContact O-OG 2.87Å; C178-S219 VanDerWaalsContact O-OG 3.1Å; S179-S219 VanDerWaalsContact C-OG 3.24Å; S179-S219 WeakPolarHBondContact CA-OG 3.35Å; S179-S219 PolarHBondContact N-OG 3.45Å; I215-S219 WeakPolarHBondContact O-CB 3.47Å; I215-S219 PolarHBondContact O-N 2.86Å; I215-S219 PolarHBondContact O-OG 3.05Å; W216-S219 WeakPolarHBondContact O-CB 3.2Å; W216-S219 PolarHBondContact O-N 3.17Å

Retrieved 219 of 219 residues in 681.5 ms (Link to these results)

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