A0A096MG49_POEFO Loading...

Wolframin ER transmembrane glycoprotein

AlphaFold DB , UniProt , Accession A0A096MG49, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 663 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	49.8	Very low	42.9	Very low	213 Å²	213	137.5 Å²	137.5	100%	1.049	68%	0.675	S	S	*	*				0	-18.1	0	-157.7	162.6	175.4	0	0	113
2	T	44.7	Very low	42.7	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	67%	0.668	S	S	*	*	H	α-helix	trans	-86.9	-14.4	179.2	24.6	0	0	0	0	115.5
3	E	42.9	Very low	42.4	Very low	149 Å²	149	133.5 Å²	133.5	70%	0.696	66%	0.662	S	S	*	*	H	α-helix	trans	-87.1	-8.9	172.3	-89.2	-164.5	139.2	0	0	115.1
4	R	42.5	Very low	42.3	Very low	203 Å²	203	134.7 Å²	134.7	77%	0.766	66%	0.661	S	S	*	*	H	α-helix	trans	-90.5	-35.1	177.2	-160.5	170.6	-86.7	-170	-5.6	111.6	C6 R7 D8	R4-C6 PolarHBondContact O-N 3.38Å; R4-R7 PolarHBondContact O-N 3.47Å; R4-D8 PolarHBondContact O-N 3.18Å
5	M	41	Very low	42.3	Very low	133 Å²	133	136.1 Å²	136.1	66%	0.655	66%	0.663	S	S	*	*	H	α-helix	trans	-67.2	-32.9	172.9	-96.2	-173.6	-62	0	0	114.1	R7 F9	M5-R7 VanDerWaalsContact C-N 3.33Å; M5-R7 PolarHBondContact O-N 3.11Å; M5-F9 PolarHBondContact O-N 3.35Å
6	C	38.9	Very low	42.1	Very low	82 Å²	82	137.5 Å²	137.5	55%	0.554	66%	0.66	S	S	*	*	H	α-helix	trans	-76.1	-22	-178.1	-148.8	0	0	0	0	113	R4 I10	R4-C6 PolarHBondContact O-N 3.38Å; C6-I10 WeakPolarHBondContact O-CG1 3.44Å
7	R	41.8	Very low	42.2	Very low	170 Å²	170	138.2 Å²	138.2	64%	0.642	66%	0.66	S	S	*	*	H	α-helix	trans	-80.5	-34.7	175.9	-129.9	177.3	-61.5	-117.6	-3.5	111.9	R4 M5 S11	R4-R7 PolarHBondContact O-N 3.47Å; M5-R7 VanDerWaalsContact C-N 3.33Å; M5-R7 PolarHBondContact O-N 3.11Å; R7-S11 PolarHBondContact O-N 3.39Å
8	D	42.9	Very low	42.4	Very low	100 Å²	100	138.6 Å²	138.6	54%	0.535	66%	0.661	S	S	.	*	H	α-helix	trans	-75.6	-28.7	178.2	-65	-23.8	0	0	0	112.2	R4 S11 L12	R4-D8 PolarHBondContact O-N 3.18Å; D8-S11 PolarHBondContact O-N 2.88Å; D8-L12 PolarHBondContact O-N 3.5Å; D8-L12 VanDerWaalsContact O-N 3.14Å
9	F	40.4	Very low	42.5	Very low	146 Å²	146	134.9 Å²	134.9	64%	0.64	65%	0.648	S	S	*	*	H	α-helix	trans	-74.4	-30.4	176.1	-148.2	-97.2	0	0	0	113.6	M5 N13	M5-F9 PolarHBondContact O-N 3.35Å; F9-N13 PolarHBondContact O-N 3.26Å
10	I	44.6	Very low	42.8	Very low	120 Å²	120	134 Å²	134	62%	0.615	65%	0.646	S	S	*	*	H	α-helix	trans	-77.8	-28.9	174.8	-65.9	171.4	0	0	0	111.2	C6 K14	C6-I10 WeakPolarHBondContact O-CG1 3.44Å; I10-K14 PolarHBondContact O-N 2.93Å
11	S	42	Very low	42.9	Very low	76 Å²	76	132.4 Å²	132.4	53%	0.531	64%	0.641	S	S	.	*	H	α-helix	trans	-68.7	-39.2	171.9	177.5	0	0	0	0	112.4	R7 D8 F15	R7-S11 PolarHBondContact O-N 3.39Å; D8-S11 PolarHBondContact O-N 2.88Å; S11-F15 PolarHBondContact O-N 3.43Å
12	L	41	Very low	42.8	Very low	113 Å²	113	123.9 Å²	123.9	59%	0.592	61%	0.607	S	S	*	*	H	α-helix	trans	-71.8	-36.9	-178.1	-121.8	81.8	0	0	0	113.5	D8 K14 F15 Y16	D8-L12 PolarHBondContact O-N 3.5Å; D8-L12 VanDerWaalsContact O-N 3.14Å; L12-K14 VanDerWaalsContact C-N 3.35Å; L12-F15 PolarHBondContact O-N 2.9Å; L12-Y16 PolarHBondContact O-N 3.47Å; L12-Y16 VanDerWaalsContact O-N 3.13Å
13	N	38.8	Very low	42.8	Very low	109 Å²	109	122.9 Å²	122.9	58%	0.583	60%	0.597	S	S	*	*	H	α-helix	trans	-74	-25	177.8	-105.3	-21.9	0	0	0	113.3	F9 F17	F9-N13 PolarHBondContact O-N 3.26Å; N13-F17 WeakPolarHBondContact O-CB 3.34Å; N13-F17 PolarHBondContact O-N 3.12Å
14	K	40.4	Very low	42.8	Very low	151 Å²	151	124.7 Å²	124.7	66%	0.657	60%	0.599	S	S	*	*	H	α-helix	trans	-74	-31.5	173	-146	172.3	-173.4	179.4	0	111.7	I10 L12 Q18	I10-K14 PolarHBondContact O-N 2.93Å; L12-K14 VanDerWaalsContact C-N 3.35Å; K14-Q18 VanDerWaalsContact O-CB 3.29Å; K14-Q18 WeakPolarHBondContact O-CB 3.5Å; K14-Q18 PolarHBondContact O-N 3.14Å
15	F	42.3	Very low	42.8	Very low	156 Å²	156	121 Å²	121	68%	0.684	59%	0.591	S	S	*	*	H	α-helix	trans	-73.6	-41	175.3	-151.4	-96.8	0	0	0	112	S11 L12 T19	S11-F15 PolarHBondContact O-N 3.43Å; L12-F15 PolarHBondContact O-N 2.9Å; F15-T19 WeakPolarHBondContact O-CB 3.33Å; F15-T19 PolarHBondContact O-N 2.93Å; F15-T19 PolarHBondContact O-OG1 3.23Å
16	Y	40	Very low	42.8	Very low	158 Å²	158	118.4 Å²	118.4	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-67.7	-39.6	177.4	-104.4	-92.7	0	0	0	113.4	L12 T19 L20	L12-Y16 PolarHBondContact O-N 3.47Å; L12-Y16 VanDerWaalsContact O-N 3.13Å; Y16-T19 PolarHBondContact O-N 3.48Å; Y16-L20 HydrophobicContact CD1-CD1 4.27Å; Y16-L20 PolarHBondContact O-N 3.25Å
17	F	43.9	Very low	42.9	Very low	150 Å²	150	119 Å²	119	66%	0.658	58%	0.58	S	S	*	*	H	α-helix	trans	-71.6	-33.9	179.6	-155	-98.3	0	0	0	112.5	N13 L21	N13-F17 WeakPolarHBondContact O-CB 3.34Å; N13-F17 PolarHBondContact O-N 3.12Å; F17-L21 HydrophobicContact CE1-CD1 4.22Å; F17-L21 WeakPolarHBondContact O-CB 3.33Å; F17-L21 PolarHBondContact O-N 3.47Å
18	Q	45.1	Very low	42.8	Very low	144 Å²	144	113.9 Å²	113.9	67%	0.673	57%	0.571	S	S	*	*	H	α-helix	trans	-77.2	-25.2	177.2	-154.4	152.8	-4.7	0	0	112.3	K14 G22	K14-Q18 VanDerWaalsContact O-CB 3.29Å; K14-Q18 WeakPolarHBondContact O-CB 3.5Å; K14-Q18 PolarHBondContact O-N 3.14Å; Q18-G22 PolarHBondContact O-N 3.44Å; Q18-G22 VanDerWaalsContact O-N 3.17Å
19	T	44.8	Very low	42.6	Very low	69 Å²	69	115.1 Å²	115.1	42%	0.423	58%	0.577	S	S	.	*	H	α-helix	trans	-79.3	-36.4	172.9	-44.8	0	0	0	0	111.9	F15 Y16 L23	F15-T19 WeakPolarHBondContact O-CB 3.33Å; F15-T19 PolarHBondContact O-N 2.93Å; F15-T19 PolarHBondContact O-OG1 3.23Å; Y16-T19 PolarHBondContact O-N 3.48Å; T19-L23 WeakPolarHBondContact O-CB 3.21Å; T19-L23 PolarHBondContact O-N 3.23Å
20	L	48.3	Very low	42.6	Very low	117 Å²	117	116.9 Å²	116.9	61%	0.613	58%	0.584	S	S	*	*	H	α-helix	trans	-72.6	-36.6	174.3	-103.5	113.3	0	0	0	113.2	Y16 G22 L23 Y24	Y16-L20 HydrophobicContact CD1-CD1 4.27Å; Y16-L20 PolarHBondContact O-N 3.25Å; L20-G22 VanDerWaalsContact C-N 3.34Å; L20-L23 PolarHBondContact O-N 3.28Å; L20-Y24 WeakPolarHBondContact O-CB 3.42Å; L20-Y24 PolarHBondContact O-N 3.05Å
21	L	45.5	Very low	42.3	Very low	101 Å²	101	119.6 Å²	119.6	53%	0.529	59%	0.592	S	S	.	*	H	α-helix	trans	-69.2	-34.8	173.7	-135.3	84.2	0	0	0	111.4	F17 M25	F17-L21 HydrophobicContact CE1-CD1 4.22Å; F17-L21 WeakPolarHBondContact O-CB 3.33Å; F17-L21 PolarHBondContact O-N 3.47Å; L21-M25 WeakPolarHBondContact O-CB 3.49Å; L21-M25 PolarHBondContact O-N 3.48Å
22	G	47.5	Very low	42.2	Very low	33 Å²	33	119.7 Å²	119.7	34%	0.34	59%	0.593	S	S	.	*	H	α-helix	trans	-67.2	-39.5	171.3	0	0	0	0	0	113	Q18 L20 T26	Q18-G22 PolarHBondContact O-N 3.44Å; Q18-G22 VanDerWaalsContact O-N 3.17Å; L20-G22 VanDerWaalsContact C-N 3.34Å; G22-T26 WeakPolarHBondContact O-CB 3.29Å; G22-T26 WeakPolarHBondContact O-CG2 3.44Å; G22-T26 PolarHBondContact O-N 3.47Å; G22-T26 PolarHBondContact O-OG1 3.41Å
23	L	43.6	Very low	42	Very low	100 Å²	100	119.5 Å²	119.5	52%	0.524	60%	0.601	S	S	.	*	H	α-helix	trans	-68.1	-37.4	174.2	-121.4	87.1	0	0	0	111.9	T19 L20 T26 L27	T19-L23 WeakPolarHBondContact O-CB 3.21Å; T19-L23 PolarHBondContact O-N 3.23Å; L20-L23 PolarHBondContact O-N 3.28Å; L23-T26 VanDerWaalsContact CA-OG1 3.31Å; L23-T26 WeakPolarHBondContact CA-OG1 3.42Å; L23-T26 PolarHBondContact O-OG1 3.04Å; L23-L27 HydrophobicContact CD2-CD1 4.21Å; L23-L27 HydrophobicContact CG-CD1 4.26Å; L23-L27 VanDerWaalsContact O-CB 3.31Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 WeakPolarHBondContact O-CD1 3.36Å; L23-L27 PolarHBondContact O-N 3.04Å
24	Y	42.7	Very low	41.7	Very low	188 Å²	188	119.4 Å²	119.4	74%	0.737	61%	0.607	S	S	*	*	H	α-helix	trans	-70.7	-39.1	178.3	-148.2	-95.8	0	0	0	111.6	L20 S28	L20-Y24 WeakPolarHBondContact O-CB 3.42Å; L20-Y24 PolarHBondContact O-N 3.05Å; Y24-S28 WeakPolarHBondContact O-CB 3.46Å; Y24-S28 PolarHBondContact O-N 2.95Å; Y24-S28 PolarHBondContact O-OG 2.94Å
25	M	42.4	Very low	41.7	Very low	125 Å²	125	116.8 Å²	116.8	62%	0.616	61%	0.606	S	S	*	*	H	α-helix	trans	-68.1	-36.3	174.1	-114.2	-173.8	-126.2	0	0	112.9	L21 S28 L29	L21-M25 WeakPolarHBondContact O-CB 3.49Å; L21-M25 PolarHBondContact O-N 3.48Å; M25-S28 VanDerWaalsContact CA-OG 3.31Å; M25-S28 WeakPolarHBondContact CA-OG 3.43Å; M25-S28 PolarHBondContact O-OG 3.32Å; M25-L29 WeakPolarHBondContact O-CB 3.32Å; M25-L29 PolarHBondContact O-N 3.33Å; M25-L29 VanDerWaalsContact O-N 3.11Å
26	T	42.2	Very low	42	Very low	79 Å²	79	115.6 Å²	115.6	49%	0.485	61%	0.614	S	S	.	*	H	α-helix	trans	-76.3	-33.9	176.1	47.6	0	0	0	0	112.5	G22 L23 F30	G22-T26 WeakPolarHBondContact O-CB 3.29Å; G22-T26 WeakPolarHBondContact O-CG2 3.44Å; G22-T26 PolarHBondContact O-N 3.47Å; G22-T26 PolarHBondContact O-OG1 3.41Å; L23-T26 VanDerWaalsContact CA-OG1 3.31Å; L23-T26 WeakPolarHBondContact CA-OG1 3.42Å; L23-T26 PolarHBondContact O-OG1 3.04Å; T26-F30 WeakPolarHBondContact O-CB 3.35Å; T26-F30 PolarHBondContact O-N 3.23Å
27	L	39.8	Very low	41.9	Very low	93 Å²	93	116.6 Å²	116.6	49%	0.487	62%	0.624	S	S	.	*	H	α-helix	trans	-69.3	-34.5	169.7	-96.2	109.9	0	0	0	112.6	L23 F30 F31	L23-L27 HydrophobicContact CD2-CD1 4.21Å; L23-L27 HydrophobicContact CG-CD1 4.26Å; L23-L27 VanDerWaalsContact O-CB 3.31Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 WeakPolarHBondContact O-CD1 3.36Å; L23-L27 PolarHBondContact O-N 3.04Å; L27-F30 PolarHBondContact O-N 3.31Å; L27-F31 WeakPolarHBondContact O-CB 3.38Å; L27-F31 PolarHBondContact O-N 2.92Å
28	S	39.7	Very low	41.5	Very low	63 Å²	63	116.7 Å²	116.7	44%	0.441	63%	0.629	S	S	.	*	H	α-helix	trans	-73.8	-26.2	175.8	54.9	0	0	0	0	113.8	Y24 M25 S32	Y24-S28 WeakPolarHBondContact O-CB 3.46Å; Y24-S28 PolarHBondContact O-N 2.95Å; Y24-S28 PolarHBondContact O-OG 2.94Å; M25-S28 VanDerWaalsContact CA-OG 3.31Å; M25-S28 WeakPolarHBondContact CA-OG 3.43Å; M25-S28 PolarHBondContact O-OG 3.32Å; S28-S32 PolarHBondContact O-OG 3.02Å
29	L	39.7	Very low	41.5	Very low	127 Å²	127	118 Å²	118	67%	0.665	64%	0.639	S	S	*	*	H	α-helix	trans	-82.8	-25.2	171.4	-80.3	162.6	0	0	0	112.8	M25 S32	M25-L29 WeakPolarHBondContact O-CB 3.32Å; M25-L29 PolarHBondContact O-N 3.33Å; M25-L29 VanDerWaalsContact O-N 3.11Å; L29-S32 PolarHBondContact O-OG 3.47Å
30	F	40.6	Very low	41.6	Very low	183 Å²	183	122.1 Å²	122.1	80%	0.803	65%	0.654	S	S	*	*	H	α-helix	trans	-76.6	-27.7	171.3	-114.8	-94.8	0	0	0	113.2	T26 L27	T26-F30 WeakPolarHBondContact O-CB 3.35Å; T26-F30 PolarHBondContact O-N 3.23Å; L27-F30 PolarHBondContact O-N 3.31Å
31	F	38.7	Very low	41.4	Very low	176 Å²	176	125.5 Å²	125.5	77%	0.772	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-0.7	179.1	-101.5	-89.3	0	0	0	115.2	L27	L27-F31 WeakPolarHBondContact O-CB 3.38Å; L27-F31 PolarHBondContact O-N 2.92Å
32	S	39.1	Very low	41.3	Very low	78 Å²	78	126.2 Å²	126.2	55%	0.545	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.4	16.7	-176.2	35.4	0	0	0	0	114.9	S28 L29	S28-S32 PolarHBondContact O-OG 3.02Å; L29-S32 PolarHBondContact O-OG 3.47Å
33	S	37.9	Very low	41.4	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	69%	0.686	S	S	*	*			trans	-146.5	61.7	168	-69.4	0	0	0	0	111.9
34	C	31.4	Very low	42	Very low	107 Å²	107	132.4 Å²	132.4	72%	0.723	69%	0.691	S	S	*	*			trans	-110.9	102.8	158.8	-161.3	0	0	0	0	108.1
35	P	41	Very low	42.3	Very low	97 Å²	97	126 Å²	126	63%	0.63	68%	0.677	S	S	*	*			trans	-65.9	139.8	165.6	24.8	-29.2	0	0	0	109.4	Q37	P35-Q37 PolarHBondContact O-N 3.1Å
36	P	47	Very low	42.9	Very low	131 Å²	131	125.2 Å²	125.2	85%	0.851	68%	0.679	S	S	*	*	S	Bend	trans	-80.1	68.9	-176.3	33.9	-34.7	0	0	0	110.4
37	Q	38.7	Very low	43.7	Very low	178 Å²	178	124.9 Å²	124.9	83%	0.832	67%	0.673	S	S	*	*			trans	-146.8	54.8	173.4	-79.2	-174.5	-14	0	0	111	P35	P35-Q37 PolarHBondContact O-N 3.1Å
38	M	35.9	Very low	44.2	Very low	153 Å²	153	126.4 Å²	126.4	75%	0.754	68%	0.678	S	S	*	*			trans	-122.5	48	169.7	-84	-147.1	133.9	0	0	111.9
39	L	45.8	Very low	44.8	Very low	171 Å²	171	130.3 Å²	130.3	90%	0.895	69%	0.691	S	S	*	*	S	Bend	trans	-133.6	34.9	167.1	-153.7	83	0	0	0	111.9
40	Q	46.3	Very low	45.4	Very low	156 Å²	156	131 Å²	131	73%	0.729	69%	0.688	S	S	*	*	S	Bend	trans	-138.7	-16.3	179.9	-144.2	120.9	19.6	0	0	117.9
41	Y	44.3	Very low	46.2	Very low	188 Å²	188	128.3 Å²	128.3	74%	0.737	68%	0.679	S	S	*	*			trans	-148.7	106.2	177.4	-69.2	-77.7	0	0	0	113.9	L43	Y41-L43 PolarHBondContact O-N 3.3Å
42	P	42.1	Very low	46.9	Very low	116 Å²	116	126.9 Å²	126.9	75%	0.753	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-2.4	-178.3	29.1	-34.4	0	0	0	114.6
43	L	50.6	Low	47.6	Very low	127 Å²	127	128.8 Å²	128.8	67%	0.665	68%	0.678	S	S	*	*	H	α-helix	trans	-88.3	-21.2	-170.8	-138.2	140.4	0	0	0	113.2	Y41 I47	Y41-L43 PolarHBondContact O-N 3.3Å; L43-I47 HydrophobicContact CD2-CD1 3.99Å; L43-I47 WeakPolarHBondContact O-CD1 3.45Å; L43-I47 WeakPolarHBondContact O-CG1 3.48Å
44	H	56	Low	48.5	Very low	136 Å²	136	130.9 Å²	130.9	63%	0.63	67%	0.673	S	S	*	*	H	α-helix	trans	-79.3	-32.8	178.6	-91.5	-9	0	0	0	114	V46 I47 E48	H44-V46 VanDerWaalsContact C-N 3.29Å; H44-V46 PolarHBondContact O-N 2.84Å; H44-I47 PolarHBondContact O-N 2.92Å; H44-E48 PolarHBondContact O-N 3.47Å; H44-E48 VanDerWaalsContact O-N 3.16Å
45	A	49.8	Very low	49.6	Very low	54 Å²	54	129.6 Å²	129.6	45%	0.446	66%	0.659	S	S	.	*	H	α-helix	trans	-65.2	-31.7	177.6	0	0	0	0	0	113	M49	A45-M49 PolarHBondContact O-N 3.22Å
46	V	55.3	Low	50.5	Low	107 Å²	107	134.3 Å²	134.3	65%	0.648	66%	0.664	S	S	*	*	H	α-helix	trans	-75.4	-31.2	178.2	179.1	0	0	0	0	111.8	H44 K50	H44-V46 VanDerWaalsContact C-N 3.29Å; H44-V46 PolarHBondContact O-N 2.84Å; V46-K50 PolarHBondContact O-N 3.44Å
47	I	58.1	Low	50.6	Low	72 Å²	72	130.6 Å²	130.6	37%	0.369	65%	0.645	S	S	.	*	H	α-helix	trans	-73.6	-39	178.5	-66.9	169	0	0	0	110.6	L43 H44 K50 E51	L43-I47 HydrophobicContact CD2-CD1 3.99Å; L43-I47 WeakPolarHBondContact O-CD1 3.45Å; L43-I47 WeakPolarHBondContact O-CG1 3.48Å; H44-I47 PolarHBondContact O-N 2.92Å; I47-K50 WeakPolarHBondContact O-CB 3.4Å; I47-K50 PolarHBondContact O-N 3.2Å; I47-E51 PolarHBondContact O-N 3.27Å
48	E	51	Low	51.2	Low	125 Å²	125	125.1 Å²	125.1	58%	0.584	63%	0.626	S	S	*	*	H	α-helix	trans	-71.3	-33.7	179.7	-157.7	164.9	-167	0	0	112.3	H44 H52	H44-E48 PolarHBondContact O-N 3.47Å; H44-E48 VanDerWaalsContact O-N 3.16Å; E48-H52 PolarHBondContact O-N 3.3Å
49	M	52.3	Low	52.2	Low	145 Å²	145	125.6 Å²	125.6	71%	0.714	62%	0.62	S	S	*	*	H	α-helix	trans	-68.7	-37.1	172.5	-129.6	-160.4	-157.3	0	0	112.6	A45 L53	A45-M49 PolarHBondContact O-N 3.22Å; M49-L53 WeakPolarHBondContact O-CB 3.38Å; M49-L53 PolarHBondContact O-N 3.13Å; M49-L53 VanDerWaalsContact O-N 3.1Å
50	K	50.9	Low	52.5	Low	141 Å²	141	119.6 Å²	119.6	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-61.5	-43.3	175.8	162.1	-172.9	166.5	-175.1	0	111.3	V46 I47 L53 F54	V46-K50 PolarHBondContact O-N 3.44Å; I47-K50 WeakPolarHBondContact O-CB 3.4Å; I47-K50 PolarHBondContact O-N 3.2Å; K50-L53 PolarHBondContact O-N 3.36Å; K50-F54 WeakPolarHBondContact O-CB 3.4Å; K50-F54 PolarHBondContact O-N 2.61Å
51	E	57.8	Low	52.6	Low	128 Å²	128	113.6 Å²	113.6	60%	0.598	58%	0.575	S	S	*	*	H	α-helix	trans	-66.9	-42	-178.5	-74.2	-177.3	171.4	0	0	111.7	I47 L53 F54 D55	I47-E51 PolarHBondContact O-N 3.27Å; E51-L53 PolarHBondContact O-N 2.91Å; E51-F54 PolarHBondContact O-N 3.14Å; E51-D55 PolarHBondContact O-N 3.06Å
52	H	52.6	Low	53.2	Low	145 Å²	145	109 Å²	109	67%	0.671	57%	0.566	S	S	*	*	H	α-helix	trans	-65.4	-35.9	175.7	-96.9	-70.6	0	0	0	113.8	E48 W56	E48-H52 PolarHBondContact O-N 3.3Å; H52-W56 WeakPolarHBondContact O-CB 3.43Å; H52-W56 PolarHBondContact O-N 2.98Å; H52-W56 VanDerWaalsContact O-N 3.12Å
53	L	55.4	Low	53.7	Low	119 Å²	119	109.9 Å²	109.9	62%	0.623	56%	0.56	S	S	*	*	H	α-helix	trans	-72.7	-34	178.2	-148.1	137.5	0	0	0	111.4	M49 K50 E51 A57	M49-L53 WeakPolarHBondContact O-CB 3.38Å; M49-L53 PolarHBondContact O-N 3.13Å; M49-L53 VanDerWaalsContact O-N 3.1Å; K50-L53 PolarHBondContact O-N 3.36Å; E51-L53 PolarHBondContact O-N 2.91Å; L53-A57 VanDerWaalsContact O-CB 3.24Å; L53-A57 WeakPolarHBondContact O-CB 3.4Å; L53-A57 PolarHBondContact O-N 3.02Å
54	F	55.8	Low	53.6	Low	153 Å²	153	111.9 Å²	111.9	67%	0.671	56%	0.559	S	S	*	*	H	α-helix	trans	-67.8	-40.3	173.4	-129.8	-89.4	0	0	0	112.2	K50 E51 A57 S58	K50-F54 WeakPolarHBondContact O-CB 3.4Å; K50-F54 PolarHBondContact O-N 2.61Å; E51-F54 PolarHBondContact O-N 3.14Å; F54-A57 PolarHBondContact O-N 2.67Å; F54-S58 WeakPolarHBondContact O-CB 3.5Å; F54-S58 PolarHBondContact O-N 2.98Å
55	D	54.7	Low	53.4	Low	79 Å²	79	110.1 Å²	110.1	42%	0.422	55%	0.554	S	S	.	*	H	α-helix	trans	-72.2	-33.8	-178.7	-130.5	41.8	0	0	0	112.3	E51 R59	E51-D55 PolarHBondContact O-N 3.06Å; D55-R59 WeakPolarHBondContact O-CG 3.22Å; D55-R59 PolarHBondContact O-N 3.17Å; D55-R59 IonicContact OD2-CZ 2.57Å; D55-R59 IonicContact OD2-NE 3.6Å; D55-R59 IonicContact OD2-NH2 3.53Å; D55-R59 PolarHBondContact OD2-NH2 2.97Å
56	W	59.7	Low	53.4	Low	196 Å²	196	111.1 Å²	111.1	74%	0.742	56%	0.557	S	S	*	*	H	α-helix	trans	-71.7	-43.5	172.4	-173	83.1	0	0	0	112.2	H52 S58 R59 A60	H52-W56 WeakPolarHBondContact O-CB 3.43Å; H52-W56 PolarHBondContact O-N 2.98Å; H52-W56 VanDerWaalsContact O-N 3.12Å; W56-S58 VanDerWaalsContact C-N 3.33Å; W56-S58 PolarHBondContact O-N 3.43Å; W56-R59 PolarHBondContact O-N 2.88Å; W56-A60 WeakPolarHBondContact O-CB 3.31Å; W56-A60 PolarHBondContact O-N 3.38Å
57	A	49.2	Very low	53.3	Low	53 Å²	53	111 Å²	111	44%	0.438	56%	0.557	S	S	.	*	H	α-helix	trans	-64.8	-35.1	175.4	0	0	0	0	0	112.6	L53 F54 G61	L53-A57 VanDerWaalsContact O-CB 3.24Å; L53-A57 WeakPolarHBondContact O-CB 3.4Å; L53-A57 PolarHBondContact O-N 3.02Å; F54-A57 PolarHBondContact O-N 2.67Å; A57-G61 WeakPolarHBondContact O-CA 3.43Å; A57-G61 PolarHBondContact O-N 2.92Å
58	S	51.8	Low	52.9	Low	64 Å²	64	112.4 Å²	112.4	45%	0.448	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-47.3	175	173.1	0	0	0	0	112.1	F54 W56 G61 V62	F54-S58 WeakPolarHBondContact O-CB 3.5Å; F54-S58 PolarHBondContact O-N 2.98Å; W56-S58 VanDerWaalsContact C-N 3.33Å; W56-S58 PolarHBondContact O-N 3.43Å; S58-G61 PolarHBondContact O-N 2.91Å; S58-V62 VanDerWaalsContact O-CG2 3.31Å; S58-V62 WeakPolarHBondContact O-CG2 3.46Å; S58-V62 PolarHBondContact O-N 2.94Å
59	R	56	Low	52.8	Low	162 Å²	162	110.8 Å²	110.8	61%	0.611	56%	0.559	S	S	*	*	H	α-helix	trans	-67.7	-43.7	178.7	-69	175.8	-154.9	-137.7	5.7	112	D55 W56 V62 Q63	D55-R59 WeakPolarHBondContact O-CG 3.22Å; D55-R59 PolarHBondContact O-N 3.17Å; D55-R59 IonicContact OD2-CZ 2.57Å; D55-R59 IonicContact OD2-NE 3.6Å; D55-R59 IonicContact OD2-NH2 3.53Å; D55-R59 PolarHBondContact OD2-NH2 2.97Å; W56-R59 PolarHBondContact O-N 2.88Å; R59-V62 PolarHBondContact O-N 3.11Å; R59-Q63 PolarHBondContact O-N 3.42Å; R59-Q63 VanDerWaalsContact O-N 3.07Å
60	A	52.9	Low	52.7	Low	46 Å²	46	107 Å²	107	38%	0.38	55%	0.546	S	S	.	.	H	α-helix	trans	-65.8	-38.3	176.1	0	0	0	0	0	112.2	W56 W64	W56-A60 WeakPolarHBondContact O-CB 3.31Å; W56-A60 PolarHBondContact O-N 3.38Å; A60-W64 WeakPolarHBondContact O-CB 3.38Å; A60-W64 PolarHBondContact O-N 3.18Å
61	G	49.5	Very low	52.8	Low	29 Å²	29	104 Å²	104	30%	0.299	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-41.1	176.8	0	0	0	0	0	113.1	A57 S58 L65	A57-G61 WeakPolarHBondContact O-CA 3.43Å; A57-G61 PolarHBondContact O-N 2.92Å; S58-G61 PolarHBondContact O-N 2.91Å; G61-L65 WeakPolarHBondContact O-CB 3.38Å; G61-L65 PolarHBondContact O-N 3.43Å
62	V	55.6	Low	52.8	Low	92 Å²	92	105.6 Å²	105.6	56%	0.558	55%	0.546	S	S	*	.	H	α-helix	trans	-70.8	-39.6	177.1	172.4	0	0	0	0	111.8	S58 R59 L65 S66	S58-V62 VanDerWaalsContact O-CG2 3.31Å; S58-V62 WeakPolarHBondContact O-CG2 3.46Å; S58-V62 PolarHBondContact O-N 2.94Å; R59-V62 PolarHBondContact O-N 3.11Å; V62-L65 PolarHBondContact O-N 2.86Å; V62-S66 WeakPolarHBondContact O-CB 3.29Å; V62-S66 PolarHBondContact O-N 3.43Å; V62-S66 PolarHBondContact O-OG 3.2Å
63	Q	53.9	Low	52.8	Low	135 Å²	135	105.2 Å²	105.2	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-65.4	-41.9	174.3	-117	149.9	-34.4	0	0	111.4	R59 S66 T67	R59-Q63 PolarHBondContact O-N 3.42Å; R59-Q63 VanDerWaalsContact O-N 3.07Å; Q63-S66 PolarHBondContact O-N 2.94Å; Q63-S66 PolarHBondContact O-OG 3.41Å; Q63-T67 WeakPolarHBondContact O-CG2 3.37Å; Q63-T67 PolarHBondContact O-N 3.46Å; Q63-T67 PolarHBondContact O-OG1 3.49Å
64	W	48.3	Very low	53	Low	168 Å²	168	102.6 Å²	102.6	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-63.6	-41.8	174.5	-178.5	83.1	0	0	0	112.9	A60 S66 T67 L68	A60-W64 WeakPolarHBondContact O-CB 3.38Å; A60-W64 PolarHBondContact O-N 3.18Å; W64-S66 PolarHBondContact O-N 3.11Å; W64-T67 WeakPolarHBondContact CA-OG1 3.38Å; W64-T67 PolarHBondContact O-N 3.15Å; W64-T67 PolarHBondContact O-OG1 3.13Å; W64-L68 HydrophobicContact CD2-CD1 3.66Å; W64-L68 HydrophobicContact CE3-CD1 3.77Å; W64-L68 HydrophobicContact CG-CD1 4.49Å; W64-L68 HydrophobicContact CH2-CD1 3.37Å; W64-L68 HydrophobicContact CZ2-CD1 3.24Å; W64-L68 HydrophobicContact CZ3-CD1 3.63Å; W64-L68 PolarHBondContact O-N 3.01Å; W64-L68 VanDerWaalsContact O-N 3.1Å
65	L	50.7	Low	52.7	Low	100 Å²	100	100.2 Å²	100.2	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-39.4	174.1	-118.3	131	0	0	0	112.2	G61 V62 T67 L68 I69	G61-L65 WeakPolarHBondContact O-CB 3.38Å; G61-L65 PolarHBondContact O-N 3.43Å; V62-L65 PolarHBondContact O-N 2.86Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.97Å; L65-L68 PolarHBondContact O-N 3.4Å; L65-I69 PolarHBondContact O-N 3.5Å
66	S	49.7	Very low	52.5	Low	74 Å²	74	98.2 Å²	98.2	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-70.3	-25.1	177.5	75.5	0	0	0	0	113.4	V62 Q63 W64	V62-S66 WeakPolarHBondContact O-CB 3.29Å; V62-S66 PolarHBondContact O-N 3.43Å; V62-S66 PolarHBondContact O-OG 3.2Å; Q63-S66 PolarHBondContact O-N 2.94Å; Q63-S66 PolarHBondContact O-OG 3.41Å; W64-S66 PolarHBondContact O-N 3.11Å
67	T	53.6	Low	52.3	Low	105 Å²	105	92.7 Å²	92.7	64%	0.644	51%	0.507	S	S	*	.	H	α-helix	trans	-84.2	-23	174.8	51	0	0	0	0	113.8	Q63 W64 L65	Q63-T67 WeakPolarHBondContact O-CG2 3.37Å; Q63-T67 PolarHBondContact O-N 3.46Å; Q63-T67 PolarHBondContact O-OG1 3.49Å; W64-T67 WeakPolarHBondContact CA-OG1 3.38Å; W64-T67 PolarHBondContact O-N 3.15Å; W64-T67 PolarHBondContact O-OG1 3.13Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.97Å
68	L	49.1	Very low	52.5	Low	102 Å²	102	94 Å²	94	53%	0.534	51%	0.506	S	S	.	.	H	α-helix	trans	-81.4	-23.9	177.9	-99.5	158.9	0	0	0	113.6	W64 L65 P70	W64-L68 HydrophobicContact CD2-CD1 3.66Å; W64-L68 HydrophobicContact CE3-CD1 3.77Å; W64-L68 HydrophobicContact CG-CD1 4.49Å; W64-L68 HydrophobicContact CH2-CD1 3.37Å; W64-L68 HydrophobicContact CZ2-CD1 3.24Å; W64-L68 HydrophobicContact CZ3-CD1 3.63Å; W64-L68 PolarHBondContact O-N 3.01Å; W64-L68 VanDerWaalsContact O-N 3.1Å; L65-L68 PolarHBondContact O-N 3.4Å; L68-P70 VanDerWaalsContact O-CD 3.24Å; L68-P70 WeakPolarHBondContact O-CD 3.4Å
69	I	49	Very low	52.5	Low	90 Å²	90	96.9 Å²	96.9	46%	0.462	51%	0.51	S	S	.	.	S	Bend	trans	-103.4	99.9	173.9	-55.3	172.4	0	0	0	107.2	L65 T71	L65-I69 PolarHBondContact O-N 3.5Å; I69-T71 HydrophobicContact CB-CG2 4.36Å; I69-T71 HydrophobicContact CG2-CG2 3.69Å; I69-T71 PolarHBondContact O-N 3.18Å
70	P	49.8	Very low	52.3	Low	67 Å²	67	95.7 Å²	95.7	44%	0.435	51%	0.51	S	S	.	.			trans	-72	73.6	174.6	29.4	-33.3	0	0	0	109.5	L68 Q72 H73 V74	L68-P70 VanDerWaalsContact O-CD 3.24Å; L68-P70 WeakPolarHBondContact O-CD 3.4Å; P70-Q72 PolarHBondContact O-N 3.46Å; P70-Q72 VanDerWaalsContact O-N 3.14Å; P70-H73 HydrophobicContact CB-CB 4.07Å; P70-H73 PolarHBondContact O-N 2.97Å; P70-V74 WeakPolarHBondContact O-CG2 3.35Å; P70-V74 PolarHBondContact O-N 2.96Å
71	T	54.8	Low	52.2	Low	77 Å²	77	97.3 Å²	97.3	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-55.9	-31.4	-179.4	51.4	0	0	0	0	111.4	I69 N75	I69-T71 HydrophobicContact CB-CG2 4.36Å; I69-T71 HydrophobicContact CG2-CG2 3.69Å; I69-T71 PolarHBondContact O-N 3.18Å; T71-N75 WeakPolarHBondContact O-CB 3.31Å; T71-N75 PolarHBondContact O-N 3.44Å; T71-N75 PolarHBondContact O-ND2 2.83Å; T71-N75 PolarHBondContact O-OD1 3.11Å
72	Q	56.2	Low	52.5	Low	162 Å²	162	100 Å²	100	76%	0.757	52%	0.515	S	S	*	.	H	α-helix	trans	-69.4	-41.9	174.8	-64.3	-160.8	-16.9	0	0	113.2	P70 A76	P70-Q72 PolarHBondContact O-N 3.46Å; P70-Q72 VanDerWaalsContact O-N 3.14Å; Q72-A76 WeakPolarHBondContact O-CB 3.21Å; Q72-A76 PolarHBondContact O-N 2.92Å
73	H	53.3	Low	52.6	Low	136 Å²	136	99 Å²	99	63%	0.63	51%	0.506	S	S	*	.	H	α-helix	trans	-72	-35.7	176.6	-66.6	-66.2	0	0	0	111.7	P70 L77	P70-H73 HydrophobicContact CB-CB 4.07Å; P70-H73 PolarHBondContact O-N 2.97Å; H73-L77 VanDerWaalsContact O-CB 3.25Å; H73-L77 WeakPolarHBondContact O-CB 3.28Å; H73-L77 WeakPolarHBondContact O-CG 3.39Å; H73-L77 PolarHBondContact O-N 2.94Å
74	V	59.7	Low	52.5	Low	65 Å²	65	97.6 Å²	97.6	39%	0.394	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-44.6	174.7	175.7	0	0	0	0	110.8	P70 A76 L77 I78	P70-V74 WeakPolarHBondContact O-CG2 3.35Å; P70-V74 PolarHBondContact O-N 2.96Å; V74-A76 VanDerWaalsContact C-N 3.34Å; V74-A76 PolarHBondContact O-N 3.45Å; V74-L77 PolarHBondContact O-N 3.41Å; V74-I78 HydrophobicContact CG1-CD1 3.7Å; V74-I78 HydrophobicContact CG1-CG1 4.34Å; V74-I78 WeakPolarHBondContact O-CB 3.32Å; V74-I78 WeakPolarHBondContact O-CG1 3.42Å; V74-I78 PolarHBondContact O-N 3.33Å
75	N	49.5	Very low	52.7	Low	102 Å²	102	93.6 Å²	93.6	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-37.3	175.9	-69	-14.3	0	0	0	111.7	T71 F79	T71-N75 WeakPolarHBondContact O-CB 3.31Å; T71-N75 PolarHBondContact O-N 3.44Å; T71-N75 PolarHBondContact O-ND2 2.83Å; T71-N75 PolarHBondContact O-OD1 3.11Å; N75-F79 WeakPolarHBondContact O-CB 3.46Å; N75-F79 PolarHBondContact O-N 3.34Å
76	A	50.4	Low	53.1	Low	38 Å²	38	91.1 Å²	91.1	31%	0.314	49%	0.489	S	S	.	.	H	α-helix	trans	-66.9	-41.1	173	0	0	0	0	0	111.6	Q72 V74 F79 F80	Q72-A76 WeakPolarHBondContact O-CB 3.21Å; Q72-A76 PolarHBondContact O-N 2.92Å; V74-A76 VanDerWaalsContact C-N 3.34Å; V74-A76 PolarHBondContact O-N 3.45Å; A76-F79 PolarHBondContact O-N 2.82Å; A76-F80 HydrophobicContact CB-CD2 4.44Å; A76-F80 WeakPolarHBondContact O-CB 3.31Å; A76-F80 WeakPolarHBondContact O-CD2 3.46Å; A76-F80 PolarHBondContact O-N 2.98Å
77	L	54.6	Low	53.7	Low	79 Å²	79	91.5 Å²	91.5	41%	0.414	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-41.1	175.2	-88.3	162	0	0	0	112.3	H73 V74 F79 F80 F81 M472	H73-L77 VanDerWaalsContact O-CB 3.25Å; H73-L77 WeakPolarHBondContact O-CB 3.28Å; H73-L77 WeakPolarHBondContact O-CG 3.39Å; H73-L77 PolarHBondContact O-N 2.94Å; V74-L77 PolarHBondContact O-N 3.41Å; L77-F79 VanDerWaalsContact C-N 3.32Å; L77-F80 PolarHBondContact O-N 3.42Å; L77-F81 WeakPolarHBondContact O-CA 3.38Å; L77-F81 WeakPolarHBondContact O-CB 3.39Å; L77-F81 PolarHBondContact O-N 3.43Å; L77-M472 HydrophobicContact CD1-CE 3.43Å; L77-M472 VanDerWaalsContact CD1-CE 3.43Å; L77-M472 HydrophobicContact CD1-SD 4.41Å; L77-M472 HydrophobicContact CD2-CE 3.49Å; L77-M472 VanDerWaalsContact CD2-CE 3.49Å; L77-M472 HydrophobicContact CD2-SD 3.78Å; L77-M472 HydrophobicContact CG-CE 4.1Å
78	I	55.3	Low	54.2	Low	82 Å²	82	88.9 Å²	88.9	42%	0.421	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-42.8	172.8	-70	166.1	0	0	0	109.6	V74 F81 I82	V74-I78 HydrophobicContact CG1-CD1 3.7Å; V74-I78 HydrophobicContact CG1-CG1 4.34Å; V74-I78 WeakPolarHBondContact O-CB 3.32Å; V74-I78 WeakPolarHBondContact O-CG1 3.42Å; V74-I78 PolarHBondContact O-N 3.33Å; I78-F81 PolarHBondContact O-N 3.07Å; I78-I82 HydrophobicContact CG2-CD1 3.65Å; I78-I82 HydrophobicContact CG2-CG1 4.33Å; I78-I82 VanDerWaalsContact O-CB 3.3Å; I78-I82 WeakPolarHBondContact O-CB 3.31Å; I78-I82 WeakPolarHBondContact O-CD1 3.5Å; I78-I82 WeakPolarHBondContact O-CG1 3.41Å; I78-I82 PolarHBondContact O-N 2.89Å
79	F	51.6	Low	54.9	Low	123 Å²	123	88 Å²	88	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-47.8	176.9	179.8	-104.8	0	0	0	112.5	N75 A76 L77 F81 I82 I83	N75-F79 WeakPolarHBondContact O-CB 3.46Å; N75-F79 PolarHBondContact O-N 3.34Å; A76-F79 PolarHBondContact O-N 2.82Å; L77-F79 VanDerWaalsContact C-N 3.32Å; F79-F81 VanDerWaalsContact C-N 3.31Å; F79-F81 PolarHBondContact O-N 2.94Å; F79-I82 PolarHBondContact O-N 3.18Å; F79-I83 HydrophobicContact CD1-CD1 3.71Å; F79-I83 HydrophobicContact CD2-CD1 4.23Å; F79-I83 HydrophobicContact CE1-CD1 3.24Å; F79-I83 HydrophobicContact CE2-CD1 3.81Å; F79-I83 HydrophobicContact CG-CD1 4.2Å; F79-I83 HydrophobicContact CZ-CD1 3.31Å; F79-I83 HydrophobicContact CZ-CG1 4.44Å; F79-I83 WeakPolarHBondContact O-CB 3.4Å; F79-I83 WeakPolarHBondContact O-CG1 3.39Å; F79-I83 PolarHBondContact O-N 2.84Å
80	F	51.5	Low	55.8	Low	137 Å²	137	87.4 Å²	87.4	60%	0.601	47%	0.465	S	S	*	.	H	α-helix	trans	-64.7	-35.2	174.9	-79.6	-61.6	0	0	0	111.9	A76 L77 S84	A76-F80 HydrophobicContact CB-CD2 4.44Å; A76-F80 WeakPolarHBondContact O-CB 3.31Å; A76-F80 WeakPolarHBondContact O-CD2 3.46Å; A76-F80 PolarHBondContact O-N 2.98Å; L77-F80 PolarHBondContact O-N 3.42Å; F80-S84 WeakPolarHBondContact O-CB 3.48Å; F80-S84 PolarHBondContact O-N 3.34Å
81	F	51.3	Low	56.8	Low	81 Å²	81	85.9 Å²	85.9	36%	0.355	45%	0.452	S	S	.	.	H	α-helix	trans	-67.3	-45.8	174.6	170.3	-117.3	0	0	0	111.5	L77 I78 F79 S84 N85 V469	L77-F81 WeakPolarHBondContact O-CA 3.38Å; L77-F81 WeakPolarHBondContact O-CB 3.39Å; L77-F81 PolarHBondContact O-N 3.43Å; I78-F81 PolarHBondContact O-N 3.07Å; F79-F81 VanDerWaalsContact C-N 3.31Å; F79-F81 PolarHBondContact O-N 2.94Å; F81-S84 PolarHBondContact O-N 2.77Å; F81-N85 HydrophobicContact CE2-CB 4.49Å; F81-N85 WeakPolarHBondContact CE2-ND2 3.25Å; F81-N85 VanDerWaalsContact O-CB 3.28Å; F81-N85 WeakPolarHBondContact O-CB 3.36Å; F81-N85 PolarHBondContact O-N 3.32Å; F81-V469 HydrophobicContact CD2-CB 4.29Å; F81-V469 HydrophobicContact CD2-CG1 4.31Å; F81-V469 HydrophobicContact CD2-CG2 3.17Å; F81-V469 HydrophobicContact CE2-CB 3.85Å; F81-V469 HydrophobicContact CE2-CG1 3.89Å; F81-V469 HydrophobicContact CE2-CG2 3.08Å; F81-V469 HydrophobicContact CG-CG2 4.24Å; F81-V469 HydrophobicContact CZ-CB 4.44Å; F81-V469 HydrophobicContact CZ-CG1 4.06Å; F81-V469 HydrophobicContact CZ-CG2 4.08Å
82	I	55.3	Low	57.7	Low	85 Å²	85	82.8 Å²	82.8	44%	0.436	43%	0.434	S	S	.	.	H	α-helix	trans	-59	-49.3	174	-72.9	168.4	0	0	0	109.2	I78 F79 S84 N85 L86	I78-I82 HydrophobicContact CG2-CD1 3.65Å; I78-I82 HydrophobicContact CG2-CG1 4.33Å; I78-I82 VanDerWaalsContact O-CB 3.3Å; I78-I82 WeakPolarHBondContact O-CB 3.31Å; I78-I82 WeakPolarHBondContact O-CD1 3.5Å; I78-I82 WeakPolarHBondContact O-CG1 3.41Å; I78-I82 PolarHBondContact O-N 2.89Å; F79-I82 PolarHBondContact O-N 3.18Å; I82-S84 PolarHBondContact O-N 2.94Å; I82-N85 PolarHBondContact O-N 3.49Å; I82-L86 HydrophobicContact CG2-CD1 3.56Å; I82-L86 WeakPolarHBondContact O-CB 2.97Å; I82-L86 WeakPolarHBondContact O-CD1 3.2Å; I82-L86 PolarHBondContact O-N 3.05Å
83	I	56.9	Low	58.8	Low	72 Å²	72	77.7 Å²	77.7	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-43.3	178.7	-71.5	174.2	0	0	0	112.2	F79 N85 L86	F79-I83 HydrophobicContact CD1-CD1 3.71Å; F79-I83 HydrophobicContact CD2-CD1 4.23Å; F79-I83 HydrophobicContact CE1-CD1 3.24Å; F79-I83 HydrophobicContact CE2-CD1 3.81Å; F79-I83 HydrophobicContact CG-CD1 4.2Å; F79-I83 HydrophobicContact CZ-CD1 3.31Å; F79-I83 HydrophobicContact CZ-CG1 4.44Å; F79-I83 WeakPolarHBondContact O-CB 3.4Å; F79-I83 WeakPolarHBondContact O-CG1 3.39Å; F79-I83 PolarHBondContact O-N 2.84Å; I83-N85 PolarHBondContact O-N 2.97Å; I83-L86 PolarHBondContact O-N 3.3Å
84	S	52.2	Low	60.2	Low	105 Å²	105	74.1 Å²	74.1	73%	0.734	40%	0.398	S	S	*	.	H	α-helix	trans	-69	-22.7	-178.4	-176.9	0	0	0	0	112.9	F80 F81 I82	F80-S84 WeakPolarHBondContact O-CB 3.48Å; F80-S84 PolarHBondContact O-N 3.34Å; F81-S84 PolarHBondContact O-N 2.77Å; I82-S84 PolarHBondContact O-N 2.94Å
85	N	51.6	Low	61.4	Low	84 Å²	84	71.9 Å²	71.9	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-102.4	-11.4	179.5	-139.7	-18.1	0	0	0	112.2	F81 I82 I83 T87	F81-N85 HydrophobicContact CE2-CB 4.49Å; F81-N85 WeakPolarHBondContact CE2-ND2 3.25Å; F81-N85 VanDerWaalsContact O-CB 3.28Å; F81-N85 WeakPolarHBondContact O-CB 3.36Å; F81-N85 PolarHBondContact O-N 3.32Å; I82-N85 PolarHBondContact O-N 3.49Å; I83-N85 PolarHBondContact O-N 2.97Å; N85-T87 PolarHBondContact O-N 2.91Å
86	L	59.3	Low	63.2	Low	47 Å²	47	67.4 Å²	67.4	25%	0.246	36%	0.36	C	S	.	.			trans	-78.1	105.6	171.7	-103.2	86.3	0	0	0	110.1	I82 I83 L90 F91	I82-L86 HydrophobicContact CG2-CD1 3.56Å; I82-L86 WeakPolarHBondContact O-CB 2.97Å; I82-L86 WeakPolarHBondContact O-CD1 3.2Å; I82-L86 PolarHBondContact O-N 3.05Å; I83-L86 PolarHBondContact O-N 3.3Å; L86-L90 HydrophobicContact CD1-CD2 4.35Å; L86-L90 HydrophobicContact CD2-CD2 4.3Å; L86-L90 HydrophobicContact CG-CD2 3.83Å; L86-F91 HydrophobicContact CB-CD2 3.93Å; L86-F91 HydrophobicContact CB-CE2 3.43Å; L86-F91 VanDerWaalsContact CB-CE2 3.43Å; L86-F91 HydrophobicContact CB-CZ 3.95Å; L86-F91 HydrophobicContact CD2-CD1 3.65Å; L86-F91 HydrophobicContact CD2-CD2 3.83Å; L86-F91 HydrophobicContact CD2-CE1 3.28Å; L86-F91 HydrophobicContact CD2-CE2 3.45Å; L86-F91 VanDerWaalsContact CD2-CE2 3.45Å; L86-F91 HydrophobicContact CD2-CG 3.95Å; L86-F91 HydrophobicContact CD2-CZ 3.18Å; L86-F91 HydrophobicContact CG-CD2 4.42Å; L86-F91 HydrophobicContact CG-CE2 4.03Å; L86-F91 HydrophobicContact CG-CZ 4.14Å
87	T	62.8	Low	65.1	Low	82 Å²	82	66.3 Å²	66.3	50%	0.503	35%	0.349	S	S	.	.			trans	-68.2	150.1	171.2	60.1	0	0	0	0	110.6	N85 D89 L90 F91	N85-T87 PolarHBondContact O-N 2.91Å; T87-D89 PolarHBondContact O-N 2.9Å; T87-D89 VanDerWaalsContact O-N 3.08Å; T87-L90 PolarHBondContact O-N 3.32Å; T87-L90 PolarHBondContact OG1-N 2.86Å; T87-F91 PolarHBondContact O-N 3.06Å; T87-F91 VanDerWaalsContact O-N 3.15Å
88	V	64.7	Low	66.7	Low	51 Å²	51	66.3 Å²	66.3	31%	0.309	35%	0.348	S	S	.	.	H	α-helix	trans	-48.9	-36.3	170.5	177.9	0	0	0	0	110.5	F91 A92 Y400 F637	V88-F91 PolarHBondContact O-N 3.37Å; V88-A92 WeakPolarHBondContact O-CB 3.44Å; V88-A92 PolarHBondContact O-N 2.94Å; V88-Y400 HydrophobicContact CG1-CE1 4.35Å; V88-Y400 HydrophobicContact CG2-CE1 4.03Å; V88-Y400 VanDerWaalsContact CG2-OH 3.26Å; V88-Y400 WeakPolarHBondContact CG2-OH 3.42Å; V88-F637 HydrophobicContact CG1-CE2 4.38Å; V88-F637 HydrophobicContact CG1-CZ 4.11Å
89	D	64.1	Low	68.4	Low	82 Å²	82	62.7 Å²	62.7	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-35.8	-178.9	-65.9	-26.4	0	0	0	113.6	T87 F93 R635	T87-D89 PolarHBondContact O-N 2.9Å; T87-D89 VanDerWaalsContact O-N 3.08Å; D89-F93 WeakPolarHBondContact O-CB 3.49Å; D89-F93 PolarHBondContact O-N 3.14Å; D89-R635 IonicContact OD1-CZ 2.83Å; D89-R635 IonicContact OD1-NH1 3.22Å; D89-R635 PolarHBondContact OD1-NH1 3.24Å; D89-R635 IonicContact OD2-NH1 3.94Å
90	L	67.7	Low	70.5	Confident	78 Å²	78	56.8 Å²	56.8	41%	0.408	30%	0.304	S	S	.	.	H	α-helix	trans	-70	-43	174.2	-166	74.7	0	0	0	110.5	L86 T87 F93 V94	L86-L90 HydrophobicContact CD1-CD2 4.35Å; L86-L90 HydrophobicContact CD2-CD2 4.3Å; L86-L90 HydrophobicContact CG-CD2 3.83Å; T87-L90 PolarHBondContact O-N 3.32Å; T87-L90 PolarHBondContact OG1-N 2.86Å; L90-F93 PolarHBondContact O-N 3.19Å; L90-V94 HydrophobicContact CD1-CG2 4.06Å; L90-V94 HydrophobicContact CG-CG2 3.94Å; L90-V94 WeakPolarHBondContact O-CB 3.31Å; L90-V94 VanDerWaalsContact O-CG2 3.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.44Å; L90-V94 PolarHBondContact O-N 3.39Å
91	F	70.9	Confident	72.4	Confident	35 Å²	35	54 Å²	54	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-46.3	176.4	-85.4	-61.5	0	0	0	112.2	L86 T87 V88 F93 V94 I95	L86-F91 HydrophobicContact CB-CD2 3.93Å; L86-F91 HydrophobicContact CB-CE2 3.43Å; L86-F91 VanDerWaalsContact CB-CE2 3.43Å; L86-F91 HydrophobicContact CB-CZ 3.95Å; L86-F91 HydrophobicContact CD2-CD1 3.65Å; L86-F91 HydrophobicContact CD2-CD2 3.83Å; L86-F91 HydrophobicContact CD2-CE1 3.28Å; L86-F91 HydrophobicContact CD2-CE2 3.45Å; L86-F91 VanDerWaalsContact CD2-CE2 3.45Å; L86-F91 HydrophobicContact CD2-CG 3.95Å; L86-F91 HydrophobicContact CD2-CZ 3.18Å; L86-F91 HydrophobicContact CG-CD2 4.42Å; L86-F91 HydrophobicContact CG-CE2 4.03Å; L86-F91 HydrophobicContact CG-CZ 4.14Å; T87-F91 PolarHBondContact O-N 3.06Å; T87-F91 VanDerWaalsContact O-N 3.15Å; V88-F91 PolarHBondContact O-N 3.37Å; F91-F93 PolarHBondContact O-N 3.41Å; F91-V94 PolarHBondContact O-N 3.03Å; F91-I95 HydrophobicContact CB-CD1 4.05Å; F91-I95 HydrophobicContact CD1-CD1 3.49Å; F91-I95 VanDerWaalsContact CD1-CD1 3.49Å; F91-I95 HydrophobicContact CD1-CG1 4.1Å; F91-I95 HydrophobicContact CE1-CD1 4.31Å; F91-I95 HydrophobicContact CG-CD1 4.19Å; F91-I95 VanDerWaalsContact O-CB 3.28Å; F91-I95 WeakPolarHBondContact O-CB 3.4Å; F91-I95 WeakPolarHBondContact O-CG1 3.47Å; F91-I95 PolarHBondContact O-N 3.33Å
92	A	72	Confident	74.4	Confident	13 Å²	13	52.6 Å²	52.6	11%	0.107	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-27.5	177.7	0	0	0	0	0	113.1	V88 P96 F637	V88-A92 WeakPolarHBondContact O-CB 3.44Å; V88-A92 PolarHBondContact O-N 2.94Å; A92-P96 VanDerWaalsContact O-CD 3.26Å; A92-P96 WeakPolarHBondContact O-CD 3.37Å; A92-P96 WeakPolarHBondContact O-CG 3.38Å; A92-F637 HydrophobicContact CB-CE1 3.74Å; A92-F637 HydrophobicContact CB-CZ 3.94Å
93	F	79.4	Confident	76.3	Confident	54 Å²	54	48.6 Å²	48.6	24%	0.237	27%	0.266	C	S	.	.	H	α-helix	trans	-86.4	-48	177.3	170.9	-101.1	0	0	0	112.9	D89 L90 F91 L97 D173 W176	D89-F93 WeakPolarHBondContact O-CB 3.49Å; D89-F93 PolarHBondContact O-N 3.14Å; L90-F93 PolarHBondContact O-N 3.19Å; F91-F93 PolarHBondContact O-N 3.41Å; F93-L97 HydrophobicContact CD1-CD1 4.47Å; F93-L97 HydrophobicContact CD2-CD1 4.34Å; F93-L97 HydrophobicContact CE1-CD1 3.95Å; F93-L97 HydrophobicContact CE2-CD1 3.81Å; F93-L97 HydrophobicContact CZ-CD1 3.56Å; F93-L97 WeakPolarHBondContact O-CD1 3.48Å; F93-D173 HydrophobicContact CD2-CB 4.08Å; F93-D173 HydrophobicContact CE2-CB 3.71Å; F93-W176 AromaticContact CE2-CD1 3.55Å; F93-W176 HydrophobicContact CE2-CG 4.27Å; F93-W176 AromaticContact CE2-NE1 3.63Å; F93-W176 AromaticContact CZ-CD1 3.46Å; F93-W176 VanDerWaalsContact CZ-CD1 3.46Å; F93-W176 AromaticContact CZ-CD2 3.96Å; F93-W176 HydrophobicContact CZ-CD2 3.96Å; F93-W176 AromaticContact CZ-CE2 3.63Å; F93-W176 AromaticContact CZ-CG 3.85Å; F93-W176 HydrophobicContact CZ-CG 3.85Å; F93-W176 HydrophobicContact CZ-CZ2 4.29Å; F93-W176 AromaticContact CZ-NE1 3.31Å; F93-W176 VanDerWaalsContact CZ-NE1 3.31Å
94	V	82.6	Confident	78	Confident	62 Å²	62	45.6 Å²	45.6	38%	0.376	25%	0.25	S	C	.	.	H	α-helix	trans	-76.7	-40.5	-172.6	175.1	0	0	0	0	112.5	L90 F91 L97 L98	L90-V94 HydrophobicContact CD1-CG2 4.06Å; L90-V94 HydrophobicContact CG-CG2 3.94Å; L90-V94 WeakPolarHBondContact O-CB 3.31Å; L90-V94 VanDerWaalsContact O-CG2 3.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.44Å; L90-V94 PolarHBondContact O-N 3.39Å; F91-V94 PolarHBondContact O-N 3.03Å; V94-L97 PolarHBondContact O-N 3.2Å; V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 PolarHBondContact O-N 2.85Å
95	I	85.4	Confident	80	Confident	17 Å²	17	44.4 Å²	44.4	9%	0.087	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-50.3	-173.6	-71.3	171.2	0	0	0	112	F91 L97 L98 V99 V393 F397	F91-I95 HydrophobicContact CB-CD1 4.05Å; F91-I95 HydrophobicContact CD1-CD1 3.49Å; F91-I95 VanDerWaalsContact CD1-CD1 3.49Å; F91-I95 HydrophobicContact CD1-CG1 4.1Å; F91-I95 HydrophobicContact CE1-CD1 4.31Å; F91-I95 HydrophobicContact CG-CD1 4.19Å; F91-I95 VanDerWaalsContact O-CB 3.28Å; F91-I95 WeakPolarHBondContact O-CB 3.4Å; F91-I95 WeakPolarHBondContact O-CG1 3.47Å; F91-I95 PolarHBondContact O-N 3.33Å; I95-L97 VanDerWaalsContact C-N 3.29Å; I95-L97 PolarHBondContact O-N 3.26Å; I95-L98 PolarHBondContact O-N 3.31Å; I95-V99 HydrophobicContact CG2-CG2 4.24Å; I95-V99 WeakPolarHBondContact O-CG2 3.33Å; I95-V99 PolarHBondContact O-N 2.87Å; I95-V393 HydrophobicContact CG1-CG1 4.34Å; I95-V393 HydrophobicContact CG2-CG1 3.79Å; I95-F397 HydrophobicContact CD1-CB 4.06Å; I95-F397 HydrophobicContact CD1-CD2 3.38Å; I95-F397 HydrophobicContact CD1-CE2 4.11Å; I95-F397 HydrophobicContact CD1-CG 3.99Å; I95-F397 HydrophobicContact CG2-CB 4.4Å; I95-F397 HydrophobicContact CG2-CD2 4.49Å; I95-F397 HydrophobicContact CG2-CG 4.29Å
96	P	87.9	Confident	82	Confident	9 Å²	9	40.4 Å²	40.4	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-38.5	178.8	-24.7	35.6	0	0	0	112.8	A92 F100 V171 A172	A92-P96 VanDerWaalsContact O-CD 3.26Å; A92-P96 WeakPolarHBondContact O-CD 3.37Å; A92-P96 WeakPolarHBondContact O-CG 3.38Å; P96-F100 VanDerWaalsContact O-CB 3.25Å; P96-F100 WeakPolarHBondContact O-CB 3.44Å; P96-F100 PolarHBondContact O-N 3.47Å; P96-V171 HydrophobicContact CB-CB 4.14Å; P96-V171 HydrophobicContact CB-CG1 3.9Å; P96-V171 HydrophobicContact CG-CB 4.36Å; P96-V171 HydrophobicContact CG-CG1 3.57Å; P96-A172 HydrophobicContact CB-CB 4.05Å
97	L	89.1	Confident	83.7	Confident	15 Å²	15	38.2 Å²	38.2	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-45.7	176.2	-74.2	169	0	0	0	111.7	F93 V94 I95 F100 Y101 A172 W176 I177	F93-L97 HydrophobicContact CD1-CD1 4.47Å; F93-L97 HydrophobicContact CD2-CD1 4.34Å; F93-L97 HydrophobicContact CE1-CD1 3.95Å; F93-L97 HydrophobicContact CE2-CD1 3.81Å; F93-L97 HydrophobicContact CZ-CD1 3.56Å; F93-L97 WeakPolarHBondContact O-CD1 3.48Å; V94-L97 PolarHBondContact O-N 3.2Å; I95-L97 VanDerWaalsContact C-N 3.29Å; I95-L97 PolarHBondContact O-N 3.26Å; L97-F100 WeakPolarHBondContact O-CB 3.27Å; L97-F100 PolarHBondContact O-N 3.32Å; L97-Y101 HydrophobicContact CD2-CE2 4.38Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; L97-Y101 PolarHBondContact O-N 3.44Å; L97-A172 HydrophobicContact CD2-CB 3.91Å; L97-A172 HydrophobicContact CG-CB 4.23Å; L97-W176 HydrophobicContact CD1-CB 3.99Å; L97-W176 HydrophobicContact CD1-CG 4.3Å; L97-W176 HydrophobicContact CD2-CB 3.96Å; L97-I177 HydrophobicContact CD2-CD1 4.22Å; L97-I177 HydrophobicContact CD2-CG1 3.81Å
98	L	89.5	Confident	85.2	Confident	78 Å²	78	36 Å²	36	41%	0.408	19%	0.187	S	C	.	.	H	α-helix	trans	-64.1	-43.9	179	-176.9	137.9	0	0	0	111.5	V94 I95 F100 Y101 L102	V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 PolarHBondContact O-N 2.85Å; I95-L98 PolarHBondContact O-N 3.31Å; L98-F100 VanDerWaalsContact C-N 3.34Å; L98-F100 PolarHBondContact O-N 3.09Å; L98-Y101 PolarHBondContact O-N 3.2Å; L98-L102 HydrophobicContact CD2-CD1 3.49Å; L98-L102 VanDerWaalsContact CD2-CD1 3.49Å; L98-L102 HydrophobicContact CD2-CG 4.37Å; L98-L102 HydrophobicContact CG-CD1 3.98Å; L98-L102 HydrophobicContact CG-CG 4.41Å; L98-L102 VanDerWaalsContact O-CB 3.31Å; L98-L102 WeakPolarHBondContact O-CB 3.47Å; L98-L102 VanDerWaalsContact O-CG 3.27Å; L98-L102 WeakPolarHBondContact O-CG 3.36Å; L98-L102 PolarHBondContact O-N 3.36Å
99	V	91.6	Very high	86.5	Confident	6 Å²	6	35.7 Å²	35.7	4%	0.036	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-44.6	174.4	170.8	0	0	0	0	110.7	I95 S103 F164 I390 V393 I394	I95-V99 HydrophobicContact CG2-CG2 4.24Å; I95-V99 WeakPolarHBondContact O-CG2 3.33Å; I95-V99 PolarHBondContact O-N 2.87Å; V99-S103 WeakPolarHBondContact O-CB 3.39Å; V99-S103 PolarHBondContact O-N 2.88Å; V99-S103 PolarHBondContact O-OG 3.24Å; V99-F164 HydrophobicContact CG1-CB 4.28Å; V99-I390 HydrophobicContact CG1-CG2 3.86Å; V99-I390 HydrophobicContact CG2-CG2 4.34Å; V99-V393 HydrophobicContact CG2-CG1 4.42Å; V99-I394 HydrophobicContact CG1-CD1 4.12Å; V99-I394 HydrophobicContact CG2-CD1 4.37Å; V99-I394 HydrophobicContact CG2-CG1 4.07Å
100	F	94.1	Very high	87.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-51.7	177.7	174.5	-97.1	0	0	0	112.2	P96 L97 L98 S103 F104 V165 S168 F169 I177 L182 F293	P96-F100 VanDerWaalsContact O-CB 3.25Å; P96-F100 WeakPolarHBondContact O-CB 3.44Å; P96-F100 PolarHBondContact O-N 3.47Å; L97-F100 WeakPolarHBondContact O-CB 3.27Å; L97-F100 PolarHBondContact O-N 3.32Å; L98-F100 VanDerWaalsContact C-N 3.34Å; L98-F100 PolarHBondContact O-N 3.09Å; F100-S103 PolarHBondContact O-N 3.05Å; F100-S103 PolarHBondContact O-OG 3Å; F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.3Å; F100-F104 PolarHBondContact O-N 3.49Å; F100-V165 HydrophobicContact CD2-CG1 4.32Å; F100-V165 HydrophobicContact CE2-CG1 4.06Å; F100-S168 WeakPolarHBondContact CA-OG 3.38Å; F100-S168 WeakPolarHBondContact CB-OG 3.33Å; F100-F169 HydrophobicContact CD2-CB 4.24Å; F100-F169 HydrophobicContact CD2-CD2 4.36Å; F100-F169 HydrophobicContact CE2-CB 4.2Å; F100-F169 AromaticContact CE2-CD2 3.71Å; F100-F169 HydrophobicContact CE2-CD2 3.71Å; F100-F169 HydrophobicContact CE2-CG 4.42Å; F100-F169 HydrophobicContact CZ-CD2 4.25Å; F100-I177 HydrophobicContact CD1-CD1 4.08Å; F100-I177 HydrophobicContact CD1-CG1 4.32Å; F100-I177 HydrophobicContact CE1-CD1 4.1Å; F100-I177 HydrophobicContact CE1-CG1 4.22Å; F100-I177 HydrophobicContact CE1-CG2 3.72Å; F100-I177 HydrophobicContact CG-CD1 4.33Å; F100-I177 HydrophobicContact CZ-CD1 4.35Å; F100-I177 HydrophobicContact CZ-CG2 3.89Å; F100-L182 HydrophobicContact CE1-CD1 3.76Å; F100-L182 HydrophobicContact CZ-CD1 3.94Å; F100-F293 AromaticContact CE2-CZ 3.85Å; F100-F293 HydrophobicContact CE2-CZ 3.85Å; F100-F293 HydrophobicContact CZ-CZ 4.17Å
101	Y	92.9	Very high	89	Confident	77 Å²	77	28.5 Å²	28.5	30%	0.302	15%	0.145	S	C	.	.	H	α-helix	trans	-67.4	-43.2	-178.6	-76.6	-64	0	0	0	112.8	L97 L98 F104 I105 W176 P178	L97-Y101 HydrophobicContact CD2-CE2 4.38Å; L97-Y101 WeakPolarHBondContact O-CD2 3.47Å; L97-Y101 PolarHBondContact O-N 3.44Å; L98-Y101 PolarHBondContact O-N 3.2Å; Y101-F104 PolarHBondContact O-N 3.34Å; Y101-I105 WeakPolarHBondContact O-CB 3.35Å; Y101-I105 VanDerWaalsContact O-CG1 3.25Å; Y101-I105 WeakPolarHBondContact O-CG1 3.43Å; Y101-I105 PolarHBondContact O-N 2.88Å; Y101-W176 PolarHBondContact OH-O 3.18Å; Y101-P178 WeakPolarHBondContact OH-CD 3.13Å
102	L	92.1	Very high	90	Very high	53 Å²	53	30.8 Å²	30.8	28%	0.277	16%	0.158	S	C	.	.	H	α-helix	trans	-64	-41.6	177.9	-71.8	-179.4	0	0	0	111.7	L98 I105 A106 I386 I390	L98-L102 HydrophobicContact CD2-CD1 3.49Å; L98-L102 VanDerWaalsContact CD2-CD1 3.49Å; L98-L102 HydrophobicContact CD2-CG 4.37Å; L98-L102 HydrophobicContact CG-CD1 3.98Å; L98-L102 HydrophobicContact CG-CG 4.41Å; L98-L102 VanDerWaalsContact O-CB 3.31Å; L98-L102 WeakPolarHBondContact O-CB 3.47Å; L98-L102 VanDerWaalsContact O-CG 3.27Å; L98-L102 WeakPolarHBondContact O-CG 3.36Å; L98-L102 PolarHBondContact O-N 3.36Å; L102-I105 PolarHBondContact O-N 3.25Å; L102-A106 WeakPolarHBondContact O-CB 3.13Å; L102-A106 PolarHBondContact O-N 3.24Å; L102-I386 HydrophobicContact CB-CG2 3.96Å; L102-I390 HydrophobicContact CB-CD1 3.8Å; L102-I390 HydrophobicContact CB-CG1 3.99Å; L102-I390 HydrophobicContact CD1-CG1 4.27Å
103	S	94.7	Very high	90.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.8	-38	176.9	58.1	0	0	0	0	112.2	V99 F100 A106 M107 V165	V99-S103 WeakPolarHBondContact O-CB 3.39Å; V99-S103 PolarHBondContact O-N 2.88Å; V99-S103 PolarHBondContact O-OG 3.24Å; F100-S103 PolarHBondContact O-N 3.05Å; F100-S103 PolarHBondContact O-OG 3Å; S103-A106 PolarHBondContact O-N 3.39Å; S103-M107 WeakPolarHBondContact O-CB 2.97Å; S103-M107 PolarHBondContact O-N 2.93Å; S103-V165 WeakPolarHBondContact OG-CG2 3.2Å
104	F	94.4	Very high	91.4	Very high	9 Å²	9	31.8 Å²	31.8	4%	0.039	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-42.8	173.5	-175	-99.2	0	0	0	112.4	F100 Y101 M107 I108 V165 L182 V185 W290 F293	F100-F104 VanDerWaalsContact O-CB 3.28Å; F100-F104 WeakPolarHBondContact O-CB 3.3Å; F100-F104 PolarHBondContact O-N 3.49Å; Y101-F104 PolarHBondContact O-N 3.34Å; F104-M107 HydrophobicContact CD2-CE 3.85Å; F104-M107 HydrophobicContact CE2-CE 4.01Å; F104-M107 WeakPolarHBondContact O-CB 3.23Å; F104-M107 PolarHBondContact O-N 2.88Å; F104-I108 HydrophobicContact CD1-CD1 3.87Å; F104-I108 HydrophobicContact CE1-CD1 3.46Å; F104-I108 VanDerWaalsContact CE1-CD1 3.46Å; F104-I108 HydrophobicContact CE1-CG1 4.29Å; F104-I108 HydrophobicContact CZ-CD1 4.13Å; F104-I108 WeakPolarHBondContact O-CG1 3.44Å; F104-I108 PolarHBondContact O-N 2.96Å; F104-V165 HydrophobicContact CB-CG2 4.46Å; F104-L182 HydrophobicContact CD1-CD2 4.04Å; F104-L182 HydrophobicContact CE1-CD2 3.46Å; F104-L182 VanDerWaalsContact CE1-CD2 3.46Å; F104-L182 HydrophobicContact CE2-CD2 4.49Å; F104-L182 HydrophobicContact CZ-CB 4.41Å; F104-L182 HydrophobicContact CZ-CD2 3.73Å; F104-V185 HydrophobicContact CE1-CG1 4.27Å; F104-V185 HydrophobicContact CZ-CB 4.39Å; F104-V185 HydrophobicContact CZ-CG1 3.92Å; F104-W290 HydrophobicContact CE2-CH2 4.03Å; F104-W290 AromaticContact CE2-CZ3 3.75Å; F104-W290 HydrophobicContact CE2-CZ3 3.75Å; F104-W290 HydrophobicContact CZ-CH2 4.3Å; F104-W290 HydrophobicContact CZ-CZ3 4.15Å; F104-F293 AromaticContact CD2-CE1 3.86Å; F104-F293 HydrophobicContact CD2-CE1 3.86Å; F104-F293 HydrophobicContact CE2-CD1 4.44Å; F104-F293 AromaticContact CE2-CE1 3.81Å; F104-F293 HydrophobicContact CE2-CE1 3.81Å
105	I	92.9	Very high	91.7	Very high	80 Å²	80	32.3 Å²	32.3	41%	0.41	16%	0.155	S	C	.	.	H	α-helix	trans	-64.6	-42.5	174.8	-68.6	165.2	0	0	0	110.7	Y101 L102 M107 I108 I109	Y101-I105 WeakPolarHBondContact O-CB 3.35Å; Y101-I105 VanDerWaalsContact O-CG1 3.25Å; Y101-I105 WeakPolarHBondContact O-CG1 3.43Å; Y101-I105 PolarHBondContact O-N 2.88Å; L102-I105 PolarHBondContact O-N 3.25Å; I105-M107 VanDerWaalsContact C-N 3.29Å; I105-M107 PolarHBondContact O-N 3.05Å; I105-I108 WeakPolarHBondContact O-CB 3.47Å; I105-I108 PolarHBondContact O-N 2.86Å; I105-I109 HydrophobicContact CG2-CD1 3.84Å; I105-I109 HydrophobicContact CG2-CG1 4.4Å; I105-I109 WeakPolarHBondContact O-CG1 3.36Å; I105-I109 PolarHBondContact O-N 3.35Å
106	A	93.5	Very high	91.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.2	-42.6	174.6	0	0	0	0	0	111.4	L102 S103 I108 I109 C110 S161 I386	L102-A106 WeakPolarHBondContact O-CB 3.13Å; L102-A106 PolarHBondContact O-N 3.24Å; S103-A106 PolarHBondContact O-N 3.39Å; A106-I108 VanDerWaalsContact C-N 3.35Å; A106-I108 PolarHBondContact O-N 3.3Å; A106-I109 PolarHBondContact O-N 3.48Å; A106-C110 WeakPolarHBondContact O-CB 3.35Å; A106-C110 PolarHBondContact O-N 3.49Å; A106-C110 PolarHBondContact O-SG 3.21Å; A106-S161 WeakPolarHBondContact CB-OG 3.43Å; A106-I386 HydrophobicContact CB-CG2 4.04Å
107	M	94.5	Very high	91.8	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-57.7	-44.9	175	-162.1	168.7	79.8	0	0	111.8	S103 F104 I105 T111 F158 V162 V165 W290 F293	S103-M107 WeakPolarHBondContact O-CB 2.97Å; S103-M107 PolarHBondContact O-N 2.93Å; F104-M107 HydrophobicContact CD2-CE 3.85Å; F104-M107 HydrophobicContact CE2-CE 4.01Å; F104-M107 WeakPolarHBondContact O-CB 3.23Å; F104-M107 PolarHBondContact O-N 2.88Å; I105-M107 VanDerWaalsContact C-N 3.29Å; I105-M107 PolarHBondContact O-N 3.05Å; M107-T111 WeakPolarHBondContact O-CG2 3.48Å; M107-T111 PolarHBondContact O-N 3.43Å; M107-T111 VanDerWaalsContact O-N 3.08Å; M107-T111 PolarHBondContact O-OG1 3.19Å; M107-F158 HydrophobicContact CG-CD2 3.75Å; M107-F158 HydrophobicContact CG-CE2 3.29Å; M107-F158 HydrophobicContact CG-CZ 4.1Å; M107-F158 HydrophobicContact SD-CE2 4.22Å; M107-F158 HydrophobicContact SD-CZ 4.49Å; M107-V162 HydrophobicContact CG-CG2 4.14Å; M107-V162 HydrophobicContact SD-CB 4.5Å; M107-V162 HydrophobicContact SD-CG2 3.52Å; M107-V162 VanDerWaalsContact SD-CG2 3.52Å; M107-V165 HydrophobicContact SD-CG2 4.42Å; M107-W290 HydrophobicContact CB-CZ2 4.22Å; M107-W290 HydrophobicContact CE-CD2 3.95Å; M107-W290 HydrophobicContact CE-CE3 3.57Å; M107-W290 HydrophobicContact CE-CH2 3.17Å; M107-W290 HydrophobicContact CE-CZ2 3.54Å; M107-W290 HydrophobicContact CE-CZ3 3.19Å; M107-W290 HydrophobicContact CG-CH2 4.17Å; M107-W290 HydrophobicContact CG-CZ2 3.64Å; M107-W290 HydrophobicContact SD-CH2 4.46Å; M107-W290 HydrophobicContact SD-CZ2 4.33Å; M107-F293 HydrophobicContact CE-CD1 3.99Å; M107-F293 HydrophobicContact CE-CE1 4.3Å
108	I	94.3	Very high	91.6	Very high	35 Å²	35	38.4 Å²	38.4	18%	0.179	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-52.8	173.8	-70.1	173.1	0	0	0	111.1	F104 I105 A106 C110 T111 L112 V185 F189 W290	F104-I108 HydrophobicContact CD1-CD1 3.87Å; F104-I108 HydrophobicContact CE1-CD1 3.46Å; F104-I108 VanDerWaalsContact CE1-CD1 3.46Å; F104-I108 HydrophobicContact CE1-CG1 4.29Å; F104-I108 HydrophobicContact CZ-CD1 4.13Å; F104-I108 WeakPolarHBondContact O-CG1 3.44Å; F104-I108 PolarHBondContact O-N 2.96Å; I105-I108 WeakPolarHBondContact O-CB 3.47Å; I105-I108 PolarHBondContact O-N 2.86Å; A106-I108 VanDerWaalsContact C-N 3.35Å; A106-I108 PolarHBondContact O-N 3.3Å; I108-C110 VanDerWaalsContact C-N 3.31Å; I108-C110 PolarHBondContact O-N 2.84Å; I108-T111 PolarHBondContact O-N 2.8Å; I108-T111 VanDerWaalsContact O-N 3.09Å; I108-T111 PolarHBondContact O-OG1 3.44Å; I108-L112 HydrophobicContact CG2-CD1 4.02Å; I108-L112 HydrophobicContact CG2-CG 4.46Å; I108-L112 WeakPolarHBondContact O-CG 3.41Å; I108-L112 PolarHBondContact O-N 3.21Å; I108-V185 HydrophobicContact CD1-CG1 4.17Å; I108-F189 HydrophobicContact CB-CE2 4.32Å; I108-F189 HydrophobicContact CB-CZ 4.22Å; I108-F189 HydrophobicContact CD1-CE2 4.01Å; I108-F189 HydrophobicContact CG1-CD2 4.16Å; I108-F189 HydrophobicContact CG1-CE2 3.66Å; I108-F189 HydrophobicContact CG1-CZ 4.07Å; I108-F189 HydrophobicContact CG2-CE1 4.16Å; I108-F189 HydrophobicContact CG2-CE2 3.95Å; I108-F189 HydrophobicContact CG2-CZ 3.47Å; I108-F189 VanDerWaalsContact CG2-CZ 3.47Å; I108-W290 HydrophobicContact CG1-CH2 3.84Å; I108-W290 HydrophobicContact CG1-CZ2 4.29Å
109	I	92.3	Very high	91.4	Very high	45 Å²	45	40.7 Å²	40.7	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-42.4	-177.2	-64.3	167.7	0	0	0	110.8	I105 A106 T111 L112 R113 V383 I386	I105-I109 HydrophobicContact CG2-CD1 3.84Å; I105-I109 HydrophobicContact CG2-CG1 4.4Å; I105-I109 WeakPolarHBondContact O-CG1 3.36Å; I105-I109 PolarHBondContact O-N 3.35Å; A106-I109 PolarHBondContact O-N 3.48Å; I109-T111 VanDerWaalsContact C-N 3.32Å; I109-T111 PolarHBondContact O-N 3.25Å; I109-L112 PolarHBondContact O-N 3.2Å; I109-R113 WeakPolarHBondContact O-CG 3.36Å; I109-R113 PolarHBondContact O-N 3.09Å; I109-V383 HydrophobicContact CB-CG2 3.97Å; I109-V383 HydrophobicContact CG2-CG2 3.48Å; I109-V383 VanDerWaalsContact CG2-CG2 3.48Å; I109-I386 HydrophobicContact CD1-CD1 4.26Å
110	C	91.9	Very high	91.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-44.9	174.4	-76.8	0	0	0	0	111.8	A106 I108 R113 I114 F158 V383	A106-C110 WeakPolarHBondContact O-CB 3.35Å; A106-C110 PolarHBondContact O-N 3.49Å; A106-C110 PolarHBondContact O-SG 3.21Å; I108-C110 VanDerWaalsContact C-N 3.31Å; I108-C110 PolarHBondContact O-N 2.84Å; C110-R113 WeakPolarHBondContact O-CB 3.47Å; C110-R113 PolarHBondContact O-N 3.23Å; C110-I114 VanDerWaalsContact O-CG1 3.25Å; C110-I114 WeakPolarHBondContact O-CG1 3.22Å; C110-I114 PolarHBondContact O-N 3.1Å; C110-F158 HydrophobicContact CB-CB 3.98Å; C110-F158 HydrophobicContact CB-CD2 4.19Å; C110-V383 WeakPolarHBondContact SG-CG1 3.21Å
111	T	93.1	Very high	90.6	Very high	8 Å²	8	46.6 Å²	46.6	5%	0.049	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-37.5	-178.7	61	0	0	0	0	113.5	M107 I108 I109 R113 I114 F115 F158 F189 V286 W290	M107-T111 WeakPolarHBondContact O-CG2 3.48Å; M107-T111 PolarHBondContact O-N 3.43Å; M107-T111 VanDerWaalsContact O-N 3.08Å; M107-T111 PolarHBondContact O-OG1 3.19Å; I108-T111 PolarHBondContact O-N 2.8Å; I108-T111 VanDerWaalsContact O-N 3.09Å; I108-T111 PolarHBondContact O-OG1 3.44Å; I109-T111 VanDerWaalsContact C-N 3.32Å; I109-T111 PolarHBondContact O-N 3.25Å; T111-R113 VanDerWaalsContact C-N 3.3Å; T111-R113 PolarHBondContact O-N 3.46Å; T111-I114 PolarHBondContact O-N 3.44Å; T111-F115 WeakPolarHBondContact O-CB 3.3Å; T111-F115 PolarHBondContact O-N 3.26Å; T111-F158 HydrophobicContact CG2-CD2 3.68Å; T111-F158 HydrophobicContact CG2-CE2 3.45Å; T111-F158 VanDerWaalsContact CG2-CE2 3.45Å; T111-F158 HydrophobicContact CG2-CZ 4.49Å; T111-F189 WeakPolarHBondContact OG1-CD1 3.31Å; T111-F189 WeakPolarHBondContact OG1-CE1 3.25Å; T111-V286 HydrophobicContact CG2-CG1 3.99Å; T111-W290 HydrophobicContact CG2-CZ2 4Å
112	L	91.9	Very high	90.3	Very high	83 Å²	83	48.1 Å²	48.1	44%	0.435	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-39.6	172.2	-66.7	174.2	0	0	0	111.2	I108 I109 F115 Q116 F189 L192	I108-L112 HydrophobicContact CG2-CD1 4.02Å; I108-L112 HydrophobicContact CG2-CG 4.46Å; I108-L112 WeakPolarHBondContact O-CG 3.41Å; I108-L112 PolarHBondContact O-N 3.21Å; I109-L112 PolarHBondContact O-N 3.2Å; L112-F115 PolarHBondContact O-N 2.89Å; L112-Q116 WeakPolarHBondContact O-CB 3.25Å; L112-Q116 PolarHBondContact O-N 3.24Å; L112-F189 HydrophobicContact CD2-CE1 3.92Å; L112-F189 HydrophobicContact CD2-CZ 4.48Å; L112-F189 HydrophobicContact CG-CE1 4.13Å; L112-L192 HydrophobicContact CD2-CD2 4.05Å
113	R	90.1	Very high	90	Very high	85 Å²	85	50.5 Å²	50.5	32%	0.321	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-39	173.9	-75.2	-173.3	170.9	-150.2	-6.8	112.6	I109 C110 T111 Q116 S117 Q154	I109-R113 WeakPolarHBondContact O-CG 3.36Å; I109-R113 PolarHBondContact O-N 3.09Å; C110-R113 WeakPolarHBondContact O-CB 3.47Å; C110-R113 PolarHBondContact O-N 3.23Å; T111-R113 VanDerWaalsContact C-N 3.3Å; T111-R113 PolarHBondContact O-N 3.46Å; R113-Q116 PolarHBondContact O-N 3.33Å; R113-S117 WeakPolarHBondContact O-CB 3.47Å; R113-S117 PolarHBondContact O-N 2.91Å; R113-Q154 HydrophobicContact CB-CG 4.35Å; R113-Q154 VanDerWaalsContact CD-OE1 3.28Å
114	I	89.8	Confident	89.7	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-62.6	-45.1	174.5	-71.2	162.8	0	0	0	110.2	C110 T111 S117 S118 Q154 Y155 F158 V286	C110-I114 VanDerWaalsContact O-CG1 3.25Å; C110-I114 WeakPolarHBondContact O-CG1 3.22Å; C110-I114 PolarHBondContact O-N 3.1Å; T111-I114 PolarHBondContact O-N 3.44Å; I114-S117 WeakPolarHBondContact O-CB 3.33Å; I114-S117 PolarHBondContact O-N 3.3Å; I114-S118 PolarHBondContact O-N 3.12Å; I114-Q154 HydrophobicContact CG1-CB 4.12Å; I114-Y155 HydrophobicContact CD1-CD1 3.75Å; I114-Y155 HydrophobicContact CD1-CE1 3.87Å; I114-Y155 HydrophobicContact CD1-CG 4.31Å; I114-Y155 HydrophobicContact CG1-CD1 4.22Å; I114-Y155 HydrophobicContact CG1-CE1 4.01Å; I114-Y155 HydrophobicContact CG2-CE1 3.7Å; I114-F158 HydrophobicContact CD1-CB 4.36Å; I114-V286 HydrophobicContact CD1-CG2 4.11Å
115	F	89.9	Confident	89.2	Confident	73 Å²	73	58.2 Å²	58.2	32%	0.32	28%	0.279	S	S	.	.	H	α-helix	trans	-63.5	-40.9	175.6	179.9	-98.5	0	0	0	112.5	T111 L112 S117 S118 K119 L192	T111-F115 WeakPolarHBondContact O-CB 3.3Å; T111-F115 PolarHBondContact O-N 3.26Å; L112-F115 PolarHBondContact O-N 2.89Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.12Å; F115-S118 PolarHBondContact O-N 3.37Å; F115-S118 PolarHBondContact O-OG 3.39Å; F115-K119 PolarHBondContact O-N 2.85Å; F115-K119 VanDerWaalsContact O-N 3.14Å; F115-L192 HydrophobicContact CD2-CD1 3.79Å; F115-L192 HydrophobicContact CD2-CG 4.25Å; F115-L192 HydrophobicContact CE2-CD1 3.79Å; F115-L192 HydrophobicContact CG-CD1 4.18Å; F115-L192 HydrophobicContact CG-CG 4.47Å; F115-L192 HydrophobicContact CZ-CD1 4.17Å
116	Q	89.1	Confident	89	Confident	130 Å²	130	56.8 Å²	56.8	61%	0.607	28%	0.279	S	S	*	.	H	α-helix	trans	-63	-42.9	174.1	-173.6	178.4	12.3	0	0	111.2	L112 R113 S118 K119 T120	L112-Q116 WeakPolarHBondContact O-CB 3.25Å; L112-Q116 PolarHBondContact O-N 3.24Å; R113-Q116 PolarHBondContact O-N 3.33Å; Q116-S118 VanDerWaalsContact C-N 3.34Å; Q116-S118 PolarHBondContact O-N 3.48Å; Q116-K119 PolarHBondContact O-N 3.5Å; Q116-T120 PolarHBondContact O-N 2.98Å; Q116-T120 PolarHBondContact O-OG1 2.91Å; Q116-T120 VanDerWaalsContact O-OG1 3.06Å
117	S	85.7	Confident	88.8	Confident	17 Å²	17	61.3 Å²	61.3	12%	0.119	30%	0.303	C	S	.	.	H	α-helix	trans	-63.5	-38.1	177.5	-177.6	0	0	0	0	112.1	R113 I114 F115 T120 W121 N151	R113-S117 WeakPolarHBondContact O-CB 3.47Å; R113-S117 PolarHBondContact O-N 2.91Å; I114-S117 WeakPolarHBondContact O-CB 3.33Å; I114-S117 PolarHBondContact O-N 3.3Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.12Å; S117-T120 PolarHBondContact O-N 2.57Å; S117-W121 WeakPolarHBondContact O-CB 3.3Å; S117-W121 PolarHBondContact O-N 3.14Å; S117-N151 PolarHBondContact OG-OD1 3.38Å
118	S	85.3	Confident	88.4	Confident	22 Å²	22	61.6 Å²	61.6	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-68.1	-39.2	178.4	72.3	0	0	0	0	111.6	I114 F115 Q116 W121 E122 S196	I114-S118 PolarHBondContact O-N 3.12Å; F115-S118 PolarHBondContact O-N 3.37Å; F115-S118 PolarHBondContact O-OG 3.39Å; Q116-S118 VanDerWaalsContact C-N 3.34Å; Q116-S118 PolarHBondContact O-N 3.48Å; S118-W121 VanDerWaalsContact O-CB 3.31Å; S118-W121 WeakPolarHBondContact O-CB 3.45Å; S118-W121 PolarHBondContact O-N 3.06Å; S118-E122 PolarHBondContact O-N 3.35Å; S118-E122 VanDerWaalsContact O-N 3.09Å; S118-S196 WeakPolarHBondContact CB-O 3.19Å; S118-S196 PolarHBondContact OG-O 3.43Å
119	K	86.5	Confident	88.1	Confident	127 Å²	127	63.2 Å²	63.2	55%	0.552	32%	0.319	S	S	*	.	H	α-helix	trans	-65.1	-40.9	173.4	-169.4	170.8	-173.6	173.6	0	112.2	F115 Q116 W121 E122 N123	F115-K119 PolarHBondContact O-N 2.85Å; F115-K119 VanDerWaalsContact O-N 3.14Å; Q116-K119 PolarHBondContact O-N 3.5Å; K119-W121 VanDerWaalsContact C-N 3.27Å; K119-W121 PolarHBondContact O-N 3.3Å; K119-E122 PolarHBondContact O-N 2.93Å; K119-N123 PolarHBondContact O-N 3.15Å
120	T	85.1	Confident	88	Confident	67 Å²	67	66.2 Å²	66.2	41%	0.411	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-36.1	173.5	-58.8	0	0	0	0	111.4	Q116 S117 N123 F124 F147	Q116-T120 PolarHBondContact O-N 2.98Å; Q116-T120 PolarHBondContact O-OG1 2.91Å; Q116-T120 VanDerWaalsContact O-OG1 3.06Å; S117-T120 PolarHBondContact O-N 2.57Å; T120-N123 PolarHBondContact O-N 3.37Å; T120-F124 WeakPolarHBondContact O-CB 3.36Å; T120-F124 PolarHBondContact O-N 3.45Å; T120-F147 HydrophobicContact CG2-CE2 4.28Å; T120-F147 HydrophobicContact CG2-CZ 4.14Å
121	W	83.6	Confident	87.9	Confident	63 Å²	63	69.9 Å²	69.9	24%	0.239	35%	0.354	C	S	.	.	H	α-helix	trans	-63	-41.2	175.3	176.7	-110.2	0	0	0	113	S117 S118 K119 N123 F124 K125 E144 F147	S117-W121 WeakPolarHBondContact O-CB 3.3Å; S117-W121 PolarHBondContact O-N 3.14Å; S118-W121 VanDerWaalsContact O-CB 3.31Å; S118-W121 WeakPolarHBondContact O-CB 3.45Å; S118-W121 PolarHBondContact O-N 3.06Å; K119-W121 VanDerWaalsContact C-N 3.27Å; K119-W121 PolarHBondContact O-N 3.3Å; W121-N123 VanDerWaalsContact C-N 3.35Å; W121-N123 PolarHBondContact O-N 2.95Å; W121-F124 AromaticContact CE3-CD1 3.89Å; W121-F124 HydrophobicContact CE3-CD1 3.89Å; W121-F124 AromaticContact CZ3-CD1 3.82Å; W121-F124 HydrophobicContact CZ3-CD1 3.82Å; W121-F124 HydrophobicContact CZ3-CE1 4.12Å; W121-F124 PolarHBondContact O-N 3.28Å; W121-K125 WeakPolarHBondContact O-CB 3.43Å; W121-K125 PolarHBondContact O-N 3.05Å; W121-E144 HydrophobicContact CH2-CB 3.61Å; W121-E144 HydrophobicContact CH2-CG 3.5Å; W121-E144 HydrophobicContact CZ2-CB 4.47Å; W121-E144 HydrophobicContact CZ2-CG 4.13Å; W121-E144 HydrophobicContact CZ3-CB 4.42Å; W121-E144 HydrophobicContact CZ3-CG 4.29Å; W121-F147 HydrophobicContact CB-CE1 3.88Å; W121-F147 HydrophobicContact CB-CZ 4.36Å; W121-F147 HydrophobicContact CD2-CD1 4.13Å; W121-F147 HydrophobicContact CD2-CE1 4.1Å; W121-F147 HydrophobicContact CE3-CB 4.33Å; W121-F147 AromaticContact CE3-CD1 3.09Å; W121-F147 HydrophobicContact CE3-CD1 3.09Å; W121-F147 AromaticContact CE3-CE1 3.36Å; W121-F147 HydrophobicContact CE3-CE1 3.36Å; W121-F147 AromaticContact CE3-CG 3.76Å; W121-F147 HydrophobicContact CE3-CG 3.76Å; W121-F147 HydrophobicContact CE3-CZ 4.22Å; W121-F147 HydrophobicContact CG-CE1 4.38Å; W121-F147 HydrophobicContact CZ3-CB 3.76Å; W121-F147 AromaticContact CZ3-CD1 3.35Å; W121-F147 HydrophobicContact CZ3-CD1 3.35Å; W121-F147 HydrophobicContact CZ3-CE1 4.11Å; W121-F147 AromaticContact CZ3-CG 3.71Å; W121-F147 HydrophobicContact CZ3-CG 3.71Å
122	E	85	Confident	87.7	Confident	108 Å²	108	72.1 Å²	72.1	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175.5	-69.1	-175	160	0	0	111.8	S118 K119 K125 A126	S118-E122 PolarHBondContact O-N 3.35Å; S118-E122 VanDerWaalsContact O-N 3.09Å; K119-E122 PolarHBondContact O-N 2.93Å; E122-K125 PolarHBondContact O-N 3.33Å; E122-A126 WeakPolarHBondContact O-CB 3.42Å; E122-A126 PolarHBondContact O-N 2.69Å
123	N	87.6	Confident	87.6	Confident	104 Å²	104	78.9 Å²	78.9	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-63.2	-43	175.4	-67.5	-22.8	0	0	0	111.7	K119 T120 W121 A126 L127	K119-N123 PolarHBondContact O-N 3.15Å; T120-N123 PolarHBondContact O-N 3.37Å; W121-N123 VanDerWaalsContact C-N 3.35Å; W121-N123 PolarHBondContact O-N 2.95Å; N123-A126 PolarHBondContact O-N 2.8Å; N123-L127 WeakPolarHBondContact O-CB 3.38Å; N123-L127 PolarHBondContact O-N 3.31Å
124	F	86.6	Confident	87.7	Confident	54 Å²	54	83.2 Å²	83.2	24%	0.237	41%	0.409	C	S	.	.	H	α-helix	trans	-61.6	-45.3	176.1	178.2	-101.8	0	0	0	111.1	T120 W121 A126 L127 T128 A143	T120-F124 WeakPolarHBondContact O-CB 3.36Å; T120-F124 PolarHBondContact O-N 3.45Å; W121-F124 AromaticContact CE3-CD1 3.89Å; W121-F124 HydrophobicContact CE3-CD1 3.89Å; W121-F124 AromaticContact CZ3-CD1 3.82Å; W121-F124 HydrophobicContact CZ3-CD1 3.82Å; W121-F124 HydrophobicContact CZ3-CE1 4.12Å; W121-F124 PolarHBondContact O-N 3.28Å; F124-A126 PolarHBondContact O-N 3.1Å; F124-L127 CarbonylContact O-C 3.59Å; F124-L127 WeakPolarHBondContact O-CB 3.27Å; F124-L127 PolarHBondContact O-N 2.85Å; F124-L127 VanDerWaalsContact O-N 3.11Å; F124-T128 HydrophobicContact CD1-CG2 4.47Å; F124-T128 HydrophobicContact CE1-CG2 3.85Å; F124-T128 HydrophobicContact CE2-CG2 4.14Å; F124-T128 HydrophobicContact CZ-CG2 3.66Å; F124-T128 PolarHBondContact O-N 3.09Å; F124-T128 PolarHBondContact O-OG1 3.23Å; F124-A143 HydrophobicContact CZ-CB 4.03Å
125	K	84.4	Confident	87.7	Confident	116 Å²	116	89.4 Å²	89.4	50%	0.504	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-42.3	178.3	-170.4	173.9	-177	177.4	0	112.1	W121 E122 L127 T128 S129	W121-K125 WeakPolarHBondContact O-CB 3.43Å; W121-K125 PolarHBondContact O-N 3.05Å; E122-K125 PolarHBondContact O-N 3.33Å; K125-L127 VanDerWaalsContact C-N 3.31Å; K125-T128 VanDerWaalsContact CA-OG1 3.28Å; K125-T128 WeakPolarHBondContact CA-OG1 3.17Å; K125-T128 PolarHBondContact O-N 2.87Å; K125-T128 PolarHBondContact O-OG1 2.97Å; K125-S129 WeakPolarHBondContact O-CB 3.37Å; K125-S129 PolarHBondContact O-N 2.93Å; K125-S129 PolarHBondContact O-OG 3.21Å
126	A	88.1	Confident	87.4	Confident	51 Å²	51	91.9 Å²	91.9	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-63.1	-37.7	173.8	0	0	0	0	0	111.9	E122 N123 F124 S129 L130	E122-A126 WeakPolarHBondContact O-CB 3.42Å; E122-A126 PolarHBondContact O-N 2.69Å; N123-A126 PolarHBondContact O-N 2.8Å; F124-A126 PolarHBondContact O-N 3.1Å; A126-S129 PolarHBondContact O-OG 2.97Å; A126-L130 VanDerWaalsContact O-CG 3.32Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.41Å
127	L	89.6	Confident	87.1	Confident	95 Å²	95	89.2 Å²	89.2	50%	0.497	47%	0.469	S	S	.	.	H	α-helix	trans	-67.4	-47.1	174.8	-179.6	65.5	0	0	0	111.8	N123 F124 K125 S129 L130 L131	N123-L127 WeakPolarHBondContact O-CB 3.38Å; N123-L127 PolarHBondContact O-N 3.31Å; F124-L127 CarbonylContact O-C 3.59Å; F124-L127 WeakPolarHBondContact O-CB 3.27Å; F124-L127 PolarHBondContact O-N 2.85Å; F124-L127 VanDerWaalsContact O-N 3.11Å; K125-L127 VanDerWaalsContact C-N 3.31Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 3.17Å; L127-L130 PolarHBondContact O-N 2.96Å; L127-L131 HydrophobicContact CD1-CD1 4.3Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.47Å
128	T	87	Confident	87	Confident	8 Å²	8	92.2 Å²	92.2	5%	0.049	48%	0.484	C	S	.	.	H	α-helix	trans	-63.9	-38.1	177.4	37.7	0	0	0	0	112.2	F124 K125 L130 L131 T132	F124-T128 HydrophobicContact CD1-CG2 4.47Å; F124-T128 HydrophobicContact CE1-CG2 3.85Å; F124-T128 HydrophobicContact CE2-CG2 4.14Å; F124-T128 HydrophobicContact CZ-CG2 3.66Å; F124-T128 PolarHBondContact O-N 3.09Å; F124-T128 PolarHBondContact O-OG1 3.23Å; K125-T128 VanDerWaalsContact CA-OG1 3.28Å; K125-T128 WeakPolarHBondContact CA-OG1 3.17Å; K125-T128 PolarHBondContact O-N 2.87Å; K125-T128 PolarHBondContact O-OG1 2.97Å; T128-L130 VanDerWaalsContact C-N 3.31Å; T128-L130 PolarHBondContact O-N 3.31Å; T128-L131 PolarHBondContact O-N 3.48Å; T128-T132 WeakPolarHBondContact O-CG2 3.38Å; T128-T132 PolarHBondContact O-N 3.01Å; T128-T132 PolarHBondContact O-OG1 2.89Å
129	S	87.1	Confident	86.9	Confident	69 Å²	69	95.9 Å²	95.9	48%	0.483	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-35.4	176.8	67.9	0	0	0	0	112	K125 A126 L127 T132	K125-S129 WeakPolarHBondContact O-CB 3.37Å; K125-S129 PolarHBondContact O-N 2.93Å; K125-S129 PolarHBondContact O-OG 3.21Å; A126-S129 PolarHBondContact O-OG 2.97Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 3.17Å; S129-T132 PolarHBondContact O-OG1 3.1Å
130	L	90.6	Very high	86.7	Confident	108 Å²	108	91.5 Å²	91.5	57%	0.565	49%	0.485	S	S	*	.	H	α-helix	trans	-66.3	-46.9	170.4	-70.2	172	0	0	0	111.5	A126 L127 T128 T132 R133 F134	A126-L130 VanDerWaalsContact O-CG 3.32Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.41Å; L127-L130 PolarHBondContact O-N 2.96Å; T128-L130 VanDerWaalsContact C-N 3.31Å; T128-L130 PolarHBondContact O-N 3.31Å; L130-T132 PolarHBondContact O-N 3.22Å; L130-R133 WeakPolarHBondContact O-CB 3.25Å; L130-R133 PolarHBondContact O-N 3.3Å; L130-R133 VanDerWaalsContact O-N 3.12Å; L130-F134 WeakPolarHBondContact O-CD2 3.47Å
131	L	90.1	Very high	86.3	Confident	77 Å²	77	94.4 Å²	94.4	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-61.4	-39.9	-179.5	-78	163.7	0	0	0	113	L127 T128 R133 F134 E135 L138	L127-L131 HydrophobicContact CD1-CD1 4.3Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.47Å; T128-L131 PolarHBondContact O-N 3.48Å; L131-R133 PolarHBondContact O-N 3.39Å; L131-R133 VanDerWaalsContact O-N 3.14Å; L131-F134 PolarHBondContact O-N 3.34Å; L131-E135 PolarHBondContact O-N 3.4Å; L131-L138 HydrophobicContact CB-CD2 4.22Å
132	T	88.8	Confident	86.3	Confident	54 Å²	54	96.1 Å²	96.1	33%	0.331	51%	0.505	S	S	.	.	H	α-helix	trans	-61.1	-22.8	176.7	53.1	0	0	0	0	113.7	T128 S129 L130 F134 V140	T128-T132 WeakPolarHBondContact O-CG2 3.38Å; T128-T132 PolarHBondContact O-N 3.01Å; T128-T132 PolarHBondContact O-OG1 2.89Å; S129-T132 PolarHBondContact O-OG1 3.1Å; L130-T132 PolarHBondContact O-N 3.22Å; T132-F134 VanDerWaalsContact C-N 3.35Å; T132-V140 HydrophobicContact CG2-CG2 3.34Å
133	R	90.7	Very high	86	Confident	225 Å²	225	92.6 Å²	92.6	85%	0.849	49%	0.494	S	S	*	.	H	α-helix	trans	-76	-25.6	174.6	-165	168.5	-176	167.2	0.7	112.5	L130 L131	L130-R133 WeakPolarHBondContact O-CB 3.25Å; L130-R133 PolarHBondContact O-N 3.3Å; L130-R133 VanDerWaalsContact O-N 3.12Å; L131-R133 PolarHBondContact O-N 3.39Å; L131-R133 VanDerWaalsContact O-N 3.14Å
134	F	90.6	Very high	85.6	Confident	176 Å²	176	90.4 Å²	90.4	77%	0.772	48%	0.481	S	S	*	.	H	α-helix	trans	-89.5	-37.7	175.8	-66.9	-79.3	0	0	0	112	L130 L131 T132	L130-F134 WeakPolarHBondContact O-CD2 3.47Å; L131-F134 PolarHBondContact O-N 3.34Å; T132-F134 VanDerWaalsContact C-N 3.35Å
135	E	90.8	Very high	85.2	Confident	133 Å²	133	89.2 Å²	89.2	62%	0.621	48%	0.478	S	S	*	.			trans	-133.2	93.7	-176.7	-165.3	105.7	-145.7	0	0	110.3	L131 G137 L138	L131-E135 PolarHBondContact O-N 3.4Å; E135-G137 PolarHBondContact O-N 3.19Å; E135-L138 PolarHBondContact O-N 3.47Å
136	P	82.8	Confident	85.1	Confident	125 Å²	125	88 Å²	88	81%	0.812	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-9	-175.3	26.8	-33.7	0	0	0	114.3
137	G	82.9	Confident	84.7	Confident	75 Å²	75	87.9 Å²	87.9	77%	0.773	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	3.8	177.6	0	0	0	0	0	115.1	E135 D139	E135-G137 PolarHBondContact O-N 3.19Å; G137-D139 PolarHBondContact O-N 3.48Å
138	L	83.4	Confident	83.9	Confident	80 Å²	80	84.7 Å²	84.7	42%	0.419	46%	0.457	S	S	.	.			trans	-71.9	125.9	-178.3	-168.5	73.1	0	0	0	111.1	L131 E135 V140	L131-L138 HydrophobicContact CB-CD2 4.22Å; E135-L138 PolarHBondContact O-N 3.47Å; L138-V140 WeakPolarHBondContact O-CG2 3.41Å; L138-V140 PolarHBondContact O-N 3.31Å
139	D	83.2	Confident	83.3	Confident	98 Å²	98	93 Å²	93	52%	0.524	49%	0.488	S	S	.	.			trans	-76	84.9	176.6	-171.6	-4.8	0	0	0	111.3	G137 E141 Q142 A143	G137-D139 PolarHBondContact O-N 3.48Å; D139-E141 VanDerWaalsContact C-N 3.28Å; D139-E141 PolarHBondContact O-N 2.62Å; D139-E141 PolarHBondContact OD1-N 3.32Å; D139-Q142 HydrophobicContact CB-CB 4.33Å; D139-Q142 PolarHBondContact OD1-N 3.4Å; D139-Q142 VanDerWaalsContact OD1-N 3.11Å; D139-Q142 WeakPolarHBondContact OD2-CB 3.48Å; D139-A143 PolarHBondContact O-N 3.1Å
140	V	81.8	Confident	82.9	Confident	35 Å²	35	95.6 Å²	95.6	21%	0.212	50%	0.496	C	S	.	.	H	α-helix	trans	-65.3	-33.3	179.2	-171.7	0	0	0	0	111.4	T132 L138 Q142 A143 E144	T132-V140 HydrophobicContact CG2-CG2 3.34Å; L138-V140 WeakPolarHBondContact O-CG2 3.41Å; L138-V140 PolarHBondContact O-N 3.31Å; V140-Q142 PolarHBondContact O-N 3Å; V140-A143 PolarHBondContact O-N 3.09Å; V140-E144 HydrophobicContact CG1-CG 4.21Å; V140-E144 WeakPolarHBondContact O-CB 3.5Å; V140-E144 WeakPolarHBondContact O-CG 3.32Å; V140-E144 PolarHBondContact O-N 3.3Å
141	E	78	Confident	82.5	Confident	128 Å²	128	92 Å²	92	60%	0.598	48%	0.478	S	S	*	.	H	α-helix	trans	-67.1	-40	-177.8	-66.8	-161.9	178.3	0	0	111.6	D139 T145 R275	D139-E141 VanDerWaalsContact C-N 3.28Å; D139-E141 PolarHBondContact O-N 2.62Å; D139-E141 PolarHBondContact OD1-N 3.32Å; E141-T145 WeakPolarHBondContact O-CG2 3.43Å; E141-T145 PolarHBondContact O-N 3.25Å; E141-T145 PolarHBondContact O-OG1 3.09Å; E141-R275 IonicContact OE2-NH1 2.68Å
142	Q	83.6	Confident	82.2	Confident	100 Å²	100	90.2 Å²	90.2	47%	0.467	47%	0.468	S	S	.	.	H	α-helix	trans	-67.5	-38	175.9	-170.9	62.9	25.9	0	0	112.2	D139 V140 T145 N146	D139-Q142 HydrophobicContact CB-CB 4.33Å; D139-Q142 PolarHBondContact OD1-N 3.4Å; D139-Q142 VanDerWaalsContact OD1-N 3.11Å; D139-Q142 WeakPolarHBondContact OD2-CB 3.48Å; V140-Q142 PolarHBondContact O-N 3Å; Q142-T145 WeakPolarHBondContact CA-OG1 3.34Å; Q142-T145 PolarHBondContact O-OG1 2.94Å; Q142-N146 PolarHBondContact NE2-OD1 2.92Å; Q142-N146 WeakPolarHBondContact O-CB 3.43Å; Q142-N146 PolarHBondContact O-N 3.26Å; Q142-N146 PolarHBondContact O-ND2 2.72Å
143	A	77.9	Confident	82	Confident	34 Å²	34	91 Å²	91	28%	0.281	47%	0.468	S	S	.	.	H	α-helix	trans	-67.9	-41.2	177.9	0	0	0	0	0	111.9	F124 D139 V140 F147	F124-A143 HydrophobicContact CZ-CB 4.03Å; D139-A143 PolarHBondContact O-N 3.1Å; V140-A143 PolarHBondContact O-N 3.09Å; A143-F147 PolarHBondContact O-N 3.48Å; A143-F147 VanDerWaalsContact O-N 3.1Å
144	E	79.4	Confident	81.9	Confident	58 Å²	58	81.3 Å²	81.3	27%	0.271	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-43	175.6	-78.1	-165.2	174.9	0	0	112.3	W121 V140 F147 G148	W121-E144 HydrophobicContact CH2-CB 3.61Å; W121-E144 HydrophobicContact CH2-CG 3.5Å; W121-E144 HydrophobicContact CZ2-CB 4.47Å; W121-E144 HydrophobicContact CZ2-CG 4.13Å; W121-E144 HydrophobicContact CZ3-CB 4.42Å; W121-E144 HydrophobicContact CZ3-CG 4.29Å; V140-E144 HydrophobicContact CG1-CG 4.21Å; V140-E144 WeakPolarHBondContact O-CB 3.5Å; V140-E144 WeakPolarHBondContact O-CG 3.32Å; V140-E144 PolarHBondContact O-N 3.3Å; E144-F147 PolarHBondContact O-N 2.87Å; E144-G148 PolarHBondContact O-N 2.79Å
145	T	77.9	Confident	81.8	Confident	29 Å²	29	74.6 Å²	74.6	18%	0.178	40%	0.402	C	S	.	.	H	α-helix	trans	-66.8	-45.1	178.4	49.3	0	0	0	0	111.8	E141 Q142 F147 G148 W149	E141-T145 WeakPolarHBondContact O-CG2 3.43Å; E141-T145 PolarHBondContact O-N 3.25Å; E141-T145 PolarHBondContact O-OG1 3.09Å; Q142-T145 WeakPolarHBondContact CA-OG1 3.34Å; Q142-T145 PolarHBondContact O-OG1 2.94Å; T145-F147 VanDerWaalsContact C-N 3.32Å; T145-F147 PolarHBondContact O-N 3.47Å; T145-G148 PolarHBondContact O-N 2.93Å; T145-G148 VanDerWaalsContact O-N 3.13Å; T145-W149 PolarHBondContact O-N 3.24Å
146	N	82.2	Confident	81.8	Confident	91 Å²	91	72.7 Å²	72.7	49%	0.487	40%	0.396	S	S	.	.	H	α-helix	trans	-59.2	-42.1	176.8	-75.5	-19.1	0	0	0	112.3	Q142 W149 N150	Q142-N146 PolarHBondContact NE2-OD1 2.92Å; Q142-N146 WeakPolarHBondContact O-CB 3.43Å; Q142-N146 PolarHBondContact O-N 3.26Å; Q142-N146 PolarHBondContact O-ND2 2.72Å; N146-W149 PolarHBondContact O-N 2.99Å; N146-N150 PolarHBondContact O-N 2.89Å
147	F	79.8	Confident	82.2	Confident	47 Å²	47	68.5 Å²	68.5	21%	0.206	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-39.2	175.5	-173.3	-85.1	0	0	0	112	T120 W121 A143 E144 T145 N150 N151	T120-F147 HydrophobicContact CG2-CE2 4.28Å; T120-F147 HydrophobicContact CG2-CZ 4.14Å; W121-F147 HydrophobicContact CB-CE1 3.88Å; W121-F147 HydrophobicContact CB-CZ 4.36Å; W121-F147 HydrophobicContact CD2-CD1 4.13Å; W121-F147 HydrophobicContact CD2-CE1 4.1Å; W121-F147 HydrophobicContact CE3-CB 4.33Å; W121-F147 AromaticContact CE3-CD1 3.09Å; W121-F147 HydrophobicContact CE3-CD1 3.09Å; W121-F147 AromaticContact CE3-CE1 3.36Å; W121-F147 HydrophobicContact CE3-CE1 3.36Å; W121-F147 AromaticContact CE3-CG 3.76Å; W121-F147 HydrophobicContact CE3-CG 3.76Å; W121-F147 HydrophobicContact CE3-CZ 4.22Å; W121-F147 HydrophobicContact CG-CE1 4.38Å; W121-F147 HydrophobicContact CZ3-CB 3.76Å; W121-F147 AromaticContact CZ3-CD1 3.35Å; W121-F147 HydrophobicContact CZ3-CD1 3.35Å; W121-F147 HydrophobicContact CZ3-CE1 4.11Å; W121-F147 AromaticContact CZ3-CG 3.71Å; W121-F147 HydrophobicContact CZ3-CG 3.71Å; A143-F147 PolarHBondContact O-N 3.48Å; A143-F147 VanDerWaalsContact O-N 3.1Å; E144-F147 PolarHBondContact O-N 2.87Å; T145-F147 VanDerWaalsContact C-N 3.32Å; T145-F147 PolarHBondContact O-N 3.47Å; F147-N150 PolarHBondContact O-N 3.42Å; F147-N151 WeakPolarHBondContact CD1-ND2 3.31Å; F147-N151 WeakPolarHBondContact CE1-ND2 3.22Å; F147-N151 WeakPolarHBondContact CZ-ND2 3.44Å; F147-N151 PolarHBondContact O-N 3.38Å; F147-N151 PolarHBondContact O-ND2 3.47Å
148	G	72.9	Confident	82.7	Confident	29 Å²	29	65 Å²	65	30%	0.299	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-46.6	175.4	0	0	0	0	0	112.8	E144 T145 N150 N151 L152	E144-G148 PolarHBondContact O-N 2.79Å; T145-G148 PolarHBondContact O-N 2.93Å; T145-G148 VanDerWaalsContact O-N 3.13Å; G148-N150 PolarHBondContact O-N 3.32Å; G148-N151 PolarHBondContact O-N 3.43Å; G148-L152 PolarHBondContact O-N 2.98Å
149	W	75.9	Confident	83.2	Confident	181 Å²	181	64.8 Å²	64.8	69%	0.686	33%	0.326	S	S	*	.	H	α-helix	trans	-62.3	-40.8	178.1	-81.3	106.4	0	0	0	113.1	T145 N146 N151 L152	T145-W149 PolarHBondContact O-N 3.24Å; N146-W149 PolarHBondContact O-N 2.99Å; W149-N151 VanDerWaalsContact C-N 3.3Å; W149-N151 PolarHBondContact O-N 2.84Å; W149-L152 HydrophobicContact CE3-CD2 4.1Å; W149-L152 HydrophobicContact CZ3-CD2 4.08Å; W149-L152 WeakPolarHBondContact O-CB 3.13Å; W149-L152 PolarHBondContact O-N 3.37Å
150	N	78	Confident	83.6	Confident	125 Å²	125	65.2 Å²	65.2	67%	0.668	32%	0.324	S	S	*	.	H	α-helix	trans	-66.9	-32.4	180	-165.2	45.4	0	0	0	112.6	N146 F147 G148	N146-N150 PolarHBondContact O-N 2.89Å; F147-N150 PolarHBondContact O-N 3.42Å; G148-N150 PolarHBondContact O-N 3.32Å
151	N	80.9	Confident	84.2	Confident	33 Å²	33	63.6 Å²	63.6	18%	0.176	31%	0.313	C	S	.	.	H	α-helix	trans	-91.1	-11.4	-179.7	-66.3	-59.2	0	0	0	113.9	S117 F147 G148 W149 E153 Q154 Y155	S117-N151 PolarHBondContact OG-OD1 3.38Å; F147-N151 WeakPolarHBondContact CD1-ND2 3.31Å; F147-N151 WeakPolarHBondContact CE1-ND2 3.22Å; F147-N151 WeakPolarHBondContact CZ-ND2 3.44Å; F147-N151 PolarHBondContact O-N 3.38Å; F147-N151 PolarHBondContact O-ND2 3.47Å; G148-N151 PolarHBondContact O-N 3.43Å; W149-N151 VanDerWaalsContact C-N 3.3Å; W149-N151 PolarHBondContact O-N 2.84Å; N151-E153 PolarHBondContact O-N 3.21Å; N151-Q154 PolarHBondContact O-N 3.2Å; N151-Y155 WeakPolarHBondContact O-CD2 3.29Å
152	L	83.8	Confident	84.9	Confident	39 Å²	39	57.8 Å²	57.8	20%	0.204	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-30.4	176	-171.2	65.8	0	0	0	112.3	G148 W149 Q154 Y155 L156 I282	G148-L152 PolarHBondContact O-N 2.98Å; W149-L152 HydrophobicContact CE3-CD2 4.1Å; W149-L152 HydrophobicContact CZ3-CD2 4.08Å; W149-L152 WeakPolarHBondContact O-CB 3.13Å; W149-L152 PolarHBondContact O-N 3.37Å; L152-Q154 VanDerWaalsContact C-N 3.26Å; L152-Q154 PolarHBondContact O-N 2.87Å; L152-Y155 WeakPolarHBondContact O-CB 3.07Å; L152-Y155 PolarHBondContact O-N 3.44Å; L152-Y155 VanDerWaalsContact O-N 3.09Å; L152-L156 PolarHBondContact O-N 3.19Å; L152-I282 HydrophobicContact CD1-CD1 3.85Å
153	E	85.7	Confident	85.3	Confident	71 Å²	71	57.8 Å²	57.8	33%	0.332	29%	0.285	S	S	.	.	H	α-helix	trans	-53.4	-41	180	-166.6	-171.4	-140.1	0	0	112.7	N151 Y155 L156 Y157 K384	N151-E153 PolarHBondContact O-N 3.21Å; E153-Y155 VanDerWaalsContact C-N 3.34Å; E153-Y155 PolarHBondContact O-N 2.75Å; E153-L156 PolarHBondContact O-N 2.8Å; E153-Y157 HydrophobicContact CG-CD2 4.2Å; E153-Y157 HydrophobicContact CG-CE2 3.44Å; E153-Y157 VanDerWaalsContact CG-CE2 3.44Å; E153-Y157 WeakPolarHBondContact O-CD2 3.41Å; E153-Y157 PolarHBondContact O-N 2.96Å; E153-Y157 VanDerWaalsContact O-N 3.12Å; E153-Y157 PolarHBondContact OE1-OH 2.98Å; E153-K384 WeakPolarHBondContact OE1-CE 3.39Å; E153-K384 IonicContact OE1-NZ 3.37Å; E153-K384 PolarHBondContact OE1-NZ 3.28Å; E153-K384 IonicContact OE2-NZ 3.94Å
154	Q	88.4	Confident	86	Confident	21 Å²	21	57.5 Å²	57.5	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-69.6	-32.4	-178.4	-58.5	-55.1	-47.4	0	0	112.4	R113 I114 N151 L152 Y157 F158	R113-Q154 HydrophobicContact CB-CG 4.35Å; R113-Q154 VanDerWaalsContact CD-OE1 3.28Å; I114-Q154 HydrophobicContact CG1-CB 4.12Å; N151-Q154 PolarHBondContact O-N 3.2Å; L152-Q154 VanDerWaalsContact C-N 3.26Å; L152-Q154 PolarHBondContact O-N 2.87Å; Q154-Y157 PolarHBondContact O-N 2.7Å; Q154-F158 PolarHBondContact O-N 3.49Å
155	Y	89.4	Confident	86.7	Confident	35 Å²	35	54.8 Å²	54.8	14%	0.137	27%	0.265	C	S	.	.	H	α-helix	trans	-68.5	-38.1	174.5	-64.4	-83.6	0	0	0	111.3	I114 N151 L152 E153 F158 I159 I282 P283 V286	I114-Y155 HydrophobicContact CD1-CD1 3.75Å; I114-Y155 HydrophobicContact CD1-CE1 3.87Å; I114-Y155 HydrophobicContact CD1-CG 4.31Å; I114-Y155 HydrophobicContact CG1-CD1 4.22Å; I114-Y155 HydrophobicContact CG1-CE1 4.01Å; I114-Y155 HydrophobicContact CG2-CE1 3.7Å; N151-Y155 WeakPolarHBondContact O-CD2 3.29Å; L152-Y155 WeakPolarHBondContact O-CB 3.07Å; L152-Y155 PolarHBondContact O-N 3.44Å; L152-Y155 VanDerWaalsContact O-N 3.09Å; E153-Y155 VanDerWaalsContact C-N 3.34Å; E153-Y155 PolarHBondContact O-N 2.75Å; Y155-F158 WeakPolarHBondContact O-CB 3.1Å; Y155-F158 PolarHBondContact O-N 3.06Å; Y155-I159 WeakPolarHBondContact O-CG1 3.3Å; Y155-I159 PolarHBondContact O-N 3.42Å; Y155-I282 HydrophobicContact CD1-CG2 3.61Å; Y155-I282 HydrophobicContact CD2-CG2 4.39Å; Y155-I282 HydrophobicContact CE1-CG2 4.34Å; Y155-I282 HydrophobicContact CG-CG2 3.63Å; Y155-P283 HydrophobicContact CE1-CB 4.31Å; Y155-P283 HydrophobicContact CE1-CG 4.25Å; Y155-V286 HydrophobicContact CD1-CG2 3.71Å; Y155-V286 HydrophobicContact CE1-CG2 3.97Å
156	L	89.9	Confident	87.4	Confident	92 Å²	92	53.4 Å²	53.4	48%	0.482	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-45.5	174.8	-65.5	176.5	0	0	0	111.3	L152 E153 F158 I159 F160	L152-L156 PolarHBondContact O-N 3.19Å; E153-L156 PolarHBondContact O-N 2.8Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 3.39Å; L156-I159 PolarHBondContact O-N 2.85Å; L156-F160 WeakPolarHBondContact O-CD2 3.32Å; L156-F160 PolarHBondContact O-N 3.38Å
157	Y	91.8	Very high	87.8	Confident	38 Å²	38	51.4 Å²	51.4	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-35.4	175.8	-63	-35.5	0	0	0	113.3	E153 Q154 S161 V383 K384 L387	E153-Y157 HydrophobicContact CG-CD2 4.2Å; E153-Y157 HydrophobicContact CG-CE2 3.44Å; E153-Y157 VanDerWaalsContact CG-CE2 3.44Å; E153-Y157 WeakPolarHBondContact O-CD2 3.41Å; E153-Y157 PolarHBondContact O-N 2.96Å; E153-Y157 VanDerWaalsContact O-N 3.12Å; E153-Y157 PolarHBondContact OE1-OH 2.98Å; Q154-Y157 PolarHBondContact O-N 2.7Å; Y157-S161 WeakPolarHBondContact O-CB 3.21Å; Y157-S161 PolarHBondContact O-N 2.64Å; Y157-S161 PolarHBondContact O-OG 3.06Å; Y157-V383 HydrophobicContact CD2-CG1 4.23Å; Y157-V383 HydrophobicContact CG-CG1 4.08Å; Y157-K384 HydrophobicContact CE1-CG 4.38Å; Y157-K384 HydrophobicContact CE2-CD 4.18Å; Y157-K384 HydrophobicContact CE2-CG 3.76Å; Y157-K384 VanDerWaalsContact OH-CD 3.23Å; Y157-K384 WeakPolarHBondContact OH-CD 3.49Å; Y157-K384 WeakPolarHBondContact OH-CE 3.34Å; Y157-K384 PolarHBondContact OH-NZ 2.92Å; Y157-K384 VanDerWaalsContact OH-NZ 3.12Å; Y157-L387 HydrophobicContact CD1-CD2 4.21Å
158	F	93.7	Very high	88.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-50.9	172.2	177.7	-94.9	0	0	0	111.1	M107 C110 T111 I114 Q154 Y155 L156 F160 S161 V162 V286 M289 W290	M107-F158 HydrophobicContact CG-CD2 3.75Å; M107-F158 HydrophobicContact CG-CE2 3.29Å; M107-F158 HydrophobicContact CG-CZ 4.1Å; M107-F158 HydrophobicContact SD-CE2 4.22Å; M107-F158 HydrophobicContact SD-CZ 4.49Å; C110-F158 HydrophobicContact CB-CB 3.98Å; C110-F158 HydrophobicContact CB-CD2 4.19Å; T111-F158 HydrophobicContact CG2-CD2 3.68Å; T111-F158 HydrophobicContact CG2-CE2 3.45Å; T111-F158 VanDerWaalsContact CG2-CE2 3.45Å; T111-F158 HydrophobicContact CG2-CZ 4.49Å; I114-F158 HydrophobicContact CD1-CB 4.36Å; Q154-F158 PolarHBondContact O-N 3.49Å; Y155-F158 WeakPolarHBondContact O-CB 3.1Å; Y155-F158 PolarHBondContact O-N 3.06Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 3.39Å; F158-F160 PolarHBondContact O-N 2.86Å; F158-S161 WeakPolarHBondContact O-CB 3.39Å; F158-S161 PolarHBondContact O-N 3.01Å; F158-S161 VanDerWaalsContact O-N 3.1Å; F158-V162 HydrophobicContact CD1-CG2 4.03Å; F158-V162 HydrophobicContact CE1-CG2 3.61Å; F158-V162 HydrophobicContact CE2-CG2 4.17Å; F158-V162 HydrophobicContact CG-CG2 4.48Å; F158-V162 HydrophobicContact CZ-CG2 3.69Å; F158-V162 VanDerWaalsContact O-CG2 3.27Å; F158-V162 WeakPolarHBondContact O-CG2 3.46Å; F158-V162 PolarHBondContact O-N 3.17Å; F158-V286 HydrophobicContact CD1-CB 4.47Å; F158-V286 HydrophobicContact CD1-CG1 4.4Å; F158-V286 HydrophobicContact CD1-CG2 3.92Å; F158-V286 HydrophobicContact CD2-CG1 4.39Å; F158-V286 HydrophobicContact CE1-CB 4.09Å; F158-V286 HydrophobicContact CE1-CG1 3.98Å; F158-V286 HydrophobicContact CE1-CG2 4.03Å; F158-V286 HydrophobicContact CE2-CG1 3.96Å; F158-V286 HydrophobicContact CG-CG2 4.43Å; F158-V286 HydrophobicContact CZ-CB 4.32Å; F158-V286 HydrophobicContact CZ-CG1 3.74Å; F158-M289 HydrophobicContact CE1-CB 3.94Å; F158-M289 HydrophobicContact CE1-CG 4.07Å; F158-M289 HydrophobicContact CZ-CB 4.06Å; F158-W290 AromaticContact CE2-CD1 3.98Å; F158-W290 AromaticContact CE2-NE1 3.36Å; F158-W290 AromaticContact CZ-CD1 3.84Å; F158-W290 AromaticContact CZ-NE1 3.71Å
159	I	92.3	Very high	89.2	Confident	76 Å²	76	48.2 Å²	48.2	39%	0.39	22%	0.223	S	C	.	.	H	α-helix	trans	-60.6	-42.8	179.5	-65.1	-65.2	0	0	0	111.7	Y155 L156 S161 V162 F163	Y155-I159 WeakPolarHBondContact O-CG1 3.3Å; Y155-I159 PolarHBondContact O-N 3.42Å; L156-I159 PolarHBondContact O-N 2.85Å; I159-S161 VanDerWaalsContact C-N 3.34Å; I159-S161 PolarHBondContact O-N 2.92Å; I159-V162 PolarHBondContact O-N 3.31Å; I159-F163 PolarHBondContact O-N 2.93Å
160	F	91.6	Very high	89.8	Confident	108 Å²	108	41.5 Å²	41.5	47%	0.474	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-38.4	174.5	-77.8	-63.4	0	0	0	112.7	L156 F158 F163 F164 L387	L156-F160 WeakPolarHBondContact O-CD2 3.32Å; L156-F160 PolarHBondContact O-N 3.38Å; F158-F160 PolarHBondContact O-N 2.86Å; F160-F163 WeakPolarHBondContact O-CB 3.23Å; F160-F163 PolarHBondContact O-N 3.03Å; F160-F164 WeakPolarHBondContact O-CD2 3.46Å; F160-F164 PolarHBondContact O-N 3.39Å; F160-L387 HydrophobicContact CB-CD1 4.05Å; F160-L387 HydrophobicContact CB-CD2 3.81Å; F160-L387 HydrophobicContact CD2-CD2 4.4Å; F160-L387 HydrophobicContact CG-CD2 4.25Å
161	S	94.1	Very high	90.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-44.3	176.5	-57.7	0	0	0	0	110.6	A106 Y157 F158 I159 F163 F164 V165	A106-S161 WeakPolarHBondContact CB-OG 3.43Å; Y157-S161 WeakPolarHBondContact O-CB 3.21Å; Y157-S161 PolarHBondContact O-N 2.64Å; Y157-S161 PolarHBondContact O-OG 3.06Å; F158-S161 WeakPolarHBondContact O-CB 3.39Å; F158-S161 PolarHBondContact O-N 3.01Å; F158-S161 VanDerWaalsContact O-N 3.1Å; I159-S161 VanDerWaalsContact C-N 3.34Å; I159-S161 PolarHBondContact O-N 2.92Å; S161-F163 VanDerWaalsContact C-N 3.33Å; S161-F163 PolarHBondContact O-N 2.92Å; S161-F164 PolarHBondContact O-N 2.89Å; S161-V165 WeakPolarHBondContact O-CG2 3.44Å; S161-V165 PolarHBondContact O-N 3.25Å
162	V	94	Very high	90.6	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-41.4	176.5	175.8	0	0	0	0	111.6	M107 F158 I159 F164 V165 I166 M289	M107-V162 HydrophobicContact CG-CG2 4.14Å; M107-V162 HydrophobicContact SD-CB 4.5Å; M107-V162 HydrophobicContact SD-CG2 3.52Å; M107-V162 VanDerWaalsContact SD-CG2 3.52Å; F158-V162 HydrophobicContact CD1-CG2 4.03Å; F158-V162 HydrophobicContact CE1-CG2 3.61Å; F158-V162 HydrophobicContact CE2-CG2 4.17Å; F158-V162 HydrophobicContact CG-CG2 4.48Å; F158-V162 HydrophobicContact CZ-CG2 3.69Å; F158-V162 VanDerWaalsContact O-CG2 3.27Å; F158-V162 WeakPolarHBondContact O-CG2 3.46Å; F158-V162 PolarHBondContact O-N 3.17Å; I159-V162 PolarHBondContact O-N 3.31Å; V162-F164 VanDerWaalsContact C-N 3.34Å; V162-F164 PolarHBondContact O-N 3.14Å; V162-V165 PolarHBondContact O-N 3.32Å; V162-I166 HydrophobicContact CG1-CD1 3.54Å; V162-I166 HydrophobicContact CG1-CG1 4.15Å; V162-I166 VanDerWaalsContact O-CG1 3.3Å; V162-I166 WeakPolarHBondContact O-CG1 3.21Å; V162-I166 PolarHBondContact O-N 3.24Å; V162-M289 HydrophobicContact CB-CE 4.42Å; V162-M289 HydrophobicContact CG1-CB 4.35Å; V162-M289 HydrophobicContact CG1-CE 3.21Å; V162-M289 HydrophobicContact CG1-CG 4.28Å; V162-M289 HydrophobicContact CG2-CB 4.25Å; V162-M289 HydrophobicContact CG2-CG 4.45Å
163	F	92.5	Very high	90.6	Very high	99 Å²	99	37.9 Å²	37.9	43%	0.434	19%	0.186	S	C	.	.	H	α-helix	trans	-54.1	-50.1	173.3	176.2	-91.1	0	0	0	111.1	I159 F160 S161 V165 I166 F167	I159-F163 PolarHBondContact O-N 2.93Å; F160-F163 WeakPolarHBondContact O-CB 3.23Å; F160-F163 PolarHBondContact O-N 3.03Å; S161-F163 VanDerWaalsContact C-N 3.33Å; S161-F163 PolarHBondContact O-N 2.92Å; F163-V165 PolarHBondContact O-N 3.24Å; F163-I166 PolarHBondContact O-N 2.65Å; F163-F167 HydrophobicContact CD1-CD2 4.28Å; F163-F167 AromaticContact CD2-CD2 3.93Å; F163-F167 HydrophobicContact CD2-CD2 3.93Å; F163-F167 AromaticContact CD2-CE2 3.65Å; F163-F167 HydrophobicContact CD2-CE2 3.65Å; F163-F167 HydrophobicContact CE1-CD2 4.04Å; F163-F167 HydrophobicContact CE1-CE2 4.27Å; F163-F167 AromaticContact CE2-CD2 3.7Å; F163-F167 HydrophobicContact CE2-CD2 3.7Å; F163-F167 AromaticContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CE2 3.16Å; F163-F167 AromaticContact CE2-CZ 3.99Å; F163-F167 HydrophobicContact CE2-CZ 3.99Å; F163-F167 HydrophobicContact CG-CD2 4.22Å; F163-F167 HydrophobicContact CG-CE2 4.39Å; F163-F167 AromaticContact CZ-CD2 3.73Å; F163-F167 HydrophobicContact CZ-CD2 3.73Å; F163-F167 AromaticContact CZ-CE2 3.51Å; F163-F167 HydrophobicContact CZ-CE2 3.51Å; F163-F167 HydrophobicContact CZ-CZ 4.18Å; F163-F167 WeakPolarHBondContact O-CD2 3.27Å; F163-F167 PolarHBondContact O-N 3.3Å; F163-F167 VanDerWaalsContact O-N 3.15Å
164	F	92.5	Very high	90.6	Very high	28 Å²	28	39.5 Å²	39.5	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-36.1	178.4	-69.2	-58.6	0	0	0	113.5	V99 F160 S161 V162 S168 L387 I390 I394	V99-F164 HydrophobicContact CG1-CB 4.28Å; F160-F164 WeakPolarHBondContact O-CD2 3.46Å; F160-F164 PolarHBondContact O-N 3.39Å; S161-F164 PolarHBondContact O-N 2.89Å; V162-F164 VanDerWaalsContact C-N 3.34Å; V162-F164 PolarHBondContact O-N 3.14Å; F164-S168 VanDerWaalsContact O-CB 3.25Å; F164-S168 WeakPolarHBondContact O-CB 3.31Å; F164-S168 PolarHBondContact O-N 3.18Å; F164-S168 PolarHBondContact O-OG 2.89Å; F164-L387 HydrophobicContact CD2-CD1 3.63Å; F164-L387 HydrophobicContact CE2-CD1 3.54Å; F164-L387 HydrophobicContact CE2-CG 4.13Å; F164-I390 HydrophobicContact CB-CG2 4.31Å; F164-I390 HydrophobicContact CD1-CG2 3.8Å; F164-I390 HydrophobicContact CD2-CG2 3.9Å; F164-I390 HydrophobicContact CE1-CG2 4.04Å; F164-I390 HydrophobicContact CE2-CG2 4.12Å; F164-I390 HydrophobicContact CG-CG2 3.74Å; F164-I390 HydrophobicContact CZ-CG2 4.18Å; F164-I394 HydrophobicContact CD1-CD1 3.36Å; F164-I394 HydrophobicContact CE1-CD1 3.3Å; F164-I394 HydrophobicContact CG-CD1 4.46Å; F164-I394 HydrophobicContact CZ-CD1 4.34Å
165	V	93.9	Very high	90.4	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-48.7	174.7	171.3	0	0	0	0	110.7	F100 S103 F104 M107 S161 V162 F163 F167 S168 F169 F293	F100-V165 HydrophobicContact CD2-CG1 4.32Å; F100-V165 HydrophobicContact CE2-CG1 4.06Å; S103-V165 WeakPolarHBondContact OG-CG2 3.2Å; F104-V165 HydrophobicContact CB-CG2 4.46Å; M107-V165 HydrophobicContact SD-CG2 4.42Å; S161-V165 WeakPolarHBondContact O-CG2 3.44Å; S161-V165 PolarHBondContact O-N 3.25Å; V162-V165 PolarHBondContact O-N 3.32Å; F163-V165 PolarHBondContact O-N 3.24Å; V165-F167 PolarHBondContact O-N 3.46Å; V165-S168 PolarHBondContact O-N 2.94Å; V165-S168 PolarHBondContact O-OG 3.38Å; V165-F169 WeakPolarHBondContact O-CB 3.12Å; V165-F169 PolarHBondContact O-N 2.84Å; V165-F293 HydrophobicContact CG1-CD2 4.06Å; V165-F293 HydrophobicContact CG1-CE1 3.98Å; V165-F293 HydrophobicContact CG1-CE2 3.37Å; V165-F293 HydrophobicContact CG1-CZ 3.34Å
166	I	92.3	Very high	90.2	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-63.7	-40.9	-176.5	-68	166.7	0	0	0	111.4	V162 F163 P170 M289 F647 A648 F651 F652	V162-I166 HydrophobicContact CG1-CD1 3.54Å; V162-I166 HydrophobicContact CG1-CG1 4.15Å; V162-I166 VanDerWaalsContact O-CG1 3.3Å; V162-I166 WeakPolarHBondContact O-CG1 3.21Å; V162-I166 PolarHBondContact O-N 3.24Å; F163-I166 PolarHBondContact O-N 2.65Å; I166-P170 WeakPolarHBondContact O-CD 3.47Å; I166-M289 HydrophobicContact CD1-CE 3.87Å; I166-F647 HydrophobicContact CG2-CD1 4.17Å; I166-F647 HydrophobicContact CG2-CE1 4.13Å; I166-F647 WeakPolarHBondContact O-CD1 3.31Å; I166-F647 WeakPolarHBondContact O-CE1 3.47Å; I166-A648 HydrophobicContact CG2-CB 3.73Å; I166-F651 HydrophobicContact CD1-CD1 3.46Å; I166-F651 VanDerWaalsContact CD1-CD1 3.46Å; I166-F651 HydrophobicContact CD1-CD2 4.43Å; I166-F651 HydrophobicContact CD1-CE1 3.51Å; I166-F651 HydrophobicContact CD1-CE2 4.43Å; I166-F651 HydrophobicContact CD1-CG 3.98Å; I166-F651 HydrophobicContact CD1-CZ 4.01Å; I166-F651 HydrophobicContact CG1-CD1 4.13Å; I166-F651 HydrophobicContact CG1-CD2 4.22Å; I166-F651 HydrophobicContact CG1-CE1 4.21Å; I166-F651 HydrophobicContact CG1-CE2 4.26Å; I166-F651 HydrophobicContact CG1-CG 4.17Å; I166-F651 HydrophobicContact CG1-CZ 4.26Å; I166-F651 HydrophobicContact CG2-CB 4.24Å; I166-F651 HydrophobicContact CG2-CG 4.29Å; I166-F652 HydrophobicContact CD1-CE1 4.48Å; I166-F652 HydrophobicContact CD1-CE2 3.86Å; I166-F652 HydrophobicContact CD1-CZ 3.65Å
167	F	89.6	Confident	90.2	Very high	49 Å²	49	49.7 Å²	49.7	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-75.8	-32.6	179.4	-84.8	-86	0	0	0	113.3	F163 V165 V171 A644 F645 A648	F163-F167 HydrophobicContact CD1-CD2 4.28Å; F163-F167 AromaticContact CD2-CD2 3.93Å; F163-F167 HydrophobicContact CD2-CD2 3.93Å; F163-F167 AromaticContact CD2-CE2 3.65Å; F163-F167 HydrophobicContact CD2-CE2 3.65Å; F163-F167 HydrophobicContact CE1-CD2 4.04Å; F163-F167 HydrophobicContact CE1-CE2 4.27Å; F163-F167 AromaticContact CE2-CD2 3.7Å; F163-F167 HydrophobicContact CE2-CD2 3.7Å; F163-F167 AromaticContact CE2-CE2 3.16Å; F163-F167 HydrophobicContact CE2-CE2 3.16Å; F163-F167 AromaticContact CE2-CZ 3.99Å; F163-F167 HydrophobicContact CE2-CZ 3.99Å; F163-F167 HydrophobicContact CG-CD2 4.22Å; F163-F167 HydrophobicContact CG-CE2 4.39Å; F163-F167 AromaticContact CZ-CD2 3.73Å; F163-F167 HydrophobicContact CZ-CD2 3.73Å; F163-F167 AromaticContact CZ-CE2 3.51Å; F163-F167 HydrophobicContact CZ-CE2 3.51Å; F163-F167 HydrophobicContact CZ-CZ 4.18Å; F163-F167 WeakPolarHBondContact O-CD2 3.27Å; F163-F167 PolarHBondContact O-N 3.3Å; F163-F167 VanDerWaalsContact O-N 3.15Å; V165-F167 PolarHBondContact O-N 3.46Å; F167-V171 WeakPolarHBondContact O-CG2 3.23Å; F167-A644 HydrophobicContact CD1-CB 4.46Å; F167-F645 AromaticContact CE1-CD1 3.6Å; F167-F645 HydrophobicContact CE1-CD1 3.6Å; F167-F645 AromaticContact CE1-CE1 3.58Å; F167-F645 HydrophobicContact CE1-CE1 3.58Å; F167-F645 HydrophobicContact CE1-CG 4.19Å; F167-F645 HydrophobicContact CE1-CZ 4.16Å; F167-F645 AromaticContact CZ-CD1 3.92Å; F167-F645 HydrophobicContact CZ-CD1 3.92Å; F167-F645 AromaticContact CZ-CE1 3.84Å; F167-F645 HydrophobicContact CZ-CE1 3.84Å; F167-A648 HydrophobicContact CD2-CB 4.49Å; F167-A648 HydrophobicContact CE1-CB 4.16Å; F167-A648 HydrophobicContact CE2-CB 3.95Å; F167-A648 HydrophobicContact CZ-CB 3.78Å
168	S	91.3	Very high	90.1	Very high	8 Å²	8	50.5 Å²	50.5	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-80.5	-33.2	-178.6	58.4	0	0	0	0	113.4	F100 F164 V165 V171 A172	F100-S168 WeakPolarHBondContact CA-OG 3.38Å; F100-S168 WeakPolarHBondContact CB-OG 3.33Å; F164-S168 VanDerWaalsContact O-CB 3.25Å; F164-S168 WeakPolarHBondContact O-CB 3.31Å; F164-S168 PolarHBondContact O-N 3.18Å; F164-S168 PolarHBondContact O-OG 2.89Å; V165-S168 PolarHBondContact O-N 2.94Å; V165-S168 PolarHBondContact O-OG 3.38Å; S168-V171 PolarHBondContact O-N 3.36Å; S168-V171 VanDerWaalsContact O-N 3.16Å; S168-A172 WeakPolarHBondContact O-CB 3.27Å; S168-A172 PolarHBondContact O-N 3.48Å
169	F	91.1	Very high	89.9	Confident	1 Å²	1	51 Å²	51	0%	0.004	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-48.5	-179	-178.1	-103.5	0	0	0	115.4	F100 V165 V171 I177 V296 L297 N300 F647	F100-F169 HydrophobicContact CD2-CB 4.24Å; F100-F169 HydrophobicContact CD2-CD2 4.36Å; F100-F169 HydrophobicContact CE2-CB 4.2Å; F100-F169 AromaticContact CE2-CD2 3.71Å; F100-F169 HydrophobicContact CE2-CD2 3.71Å; F100-F169 HydrophobicContact CE2-CG 4.42Å; F100-F169 HydrophobicContact CZ-CD2 4.25Å; V165-F169 WeakPolarHBondContact O-CB 3.12Å; V165-F169 PolarHBondContact O-N 2.84Å; F169-V171 VanDerWaalsContact C-N 3.25Å; F169-V171 PolarHBondContact O-N 3.35Å; F169-I177 HydrophobicContact CD2-CD1 4.28Å; F169-V296 HydrophobicContact CD1-CG1 4.15Å; F169-V296 HydrophobicContact CE1-CG1 3.63Å; F169-V296 HydrophobicContact CZ-CG1 4.13Å; F169-L297 HydrophobicContact CD2-CD2 4.48Å; F169-L297 HydrophobicContact CE2-CD2 3.74Å; F169-L297 HydrophobicContact CZ-CD2 4.23Å; F169-N300 HydrophobicContact CZ-CB 4.41Å; F169-F647 HydrophobicContact CB-CE1 4.5Å; F169-F647 AromaticContact CD1-CE1 3.92Å; F169-F647 HydrophobicContact CD1-CE1 3.92Å; F169-F647 HydrophobicContact CD1-CE2 4.01Å; F169-F647 AromaticContact CD1-CZ 3.44Å; F169-F647 HydrophobicContact CD1-CZ 3.44Å; F169-F647 VanDerWaalsContact CD1-CZ 3.44Å; F169-F647 HydrophobicContact CE1-CE2 4.19Å; F169-F647 AromaticContact CE1-CZ 3.93Å; F169-F647 HydrophobicContact CE1-CZ 3.93Å
170	P	89.4	Confident	89.8	Confident	39 Å²	39	47.7 Å²	47.7	25%	0.253	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.9	179.6	29.1	-36.7	0	0	0	113.6	I166 A644 F647	I166-P170 WeakPolarHBondContact O-CD 3.47Å; P170-A644 HydrophobicContact CG-CB 3.9Å; P170-F647 HydrophobicContact CB-CB 3.89Å; P170-F647 HydrophobicContact CB-CD1 4.11Å; P170-F647 HydrophobicContact CB-CD2 4.39Å; P170-F647 HydrophobicContact CB-CG 3.86Å; P170-F647 HydrophobicContact CG-CB 3.92Å; P170-F647 HydrophobicContact CG-CD1 3.68Å; P170-F647 HydrophobicContact CG-CE1 4.46Å; P170-F647 HydrophobicContact CG-CG 3.89Å
171	V	86.5	Confident	89.7	Confident	52 Å²	52	44.7 Å²	44.7	32%	0.315	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-32.3	-179.3	-175.5	0	0	0	0	111.1	P96 F167 S168 F169 T640 A644	P96-V171 HydrophobicContact CB-CB 4.14Å; P96-V171 HydrophobicContact CB-CG1 3.9Å; P96-V171 HydrophobicContact CG-CB 4.36Å; P96-V171 HydrophobicContact CG-CG1 3.57Å; F167-V171 WeakPolarHBondContact O-CG2 3.23Å; S168-V171 PolarHBondContact O-N 3.36Å; S168-V171 VanDerWaalsContact O-N 3.16Å; F169-V171 VanDerWaalsContact C-N 3.25Å; F169-V171 PolarHBondContact O-N 3.35Å; V171-T640 HydrophobicContact CB-CG2 4.43Å; V171-T640 HydrophobicContact CG1-CG2 3.92Å; V171-T640 HydrophobicContact CG2-CG2 4.17Å; V171-A644 HydrophobicContact CG2-CB 3.83Å
172	A	87.9	Confident	89.6	Confident	7 Å²	7	45.5 Å²	45.5	6%	0.058	22%	0.217	C	C	.	.	S	Bend	trans	-72.2	148.1	-179.2	0	0	0	0	0	112.9	P96 L97 S168 K174 I177	P96-A172 HydrophobicContact CB-CB 4.05Å; L97-A172 HydrophobicContact CD2-CB 3.91Å; L97-A172 HydrophobicContact CG-CB 4.23Å; S168-A172 WeakPolarHBondContact O-CB 3.27Å; S168-A172 PolarHBondContact O-N 3.48Å; A172-K174 PolarHBondContact O-N 2.85Å; A172-I177 HydrophobicContact CB-CD1 3.73Å
173	D	84.9	Confident	89.5	Confident	63 Å²	63	45.1 Å²	45.1	34%	0.337	22%	0.215	S	C	.	.			trans	-71.1	114.4	175.6	-170.3	-25	0	0	0	110.4	F93 K175 W176	F93-D173 HydrophobicContact CD2-CB 4.08Å; F93-D173 HydrophobicContact CE2-CB 3.71Å; D173-K175 PolarHBondContact O-N 3.31Å; D173-K175 VanDerWaalsContact O-N 3.12Å; D173-K175 WeakPolarHBondContact OD1-CB 3.48Å; D173-K175 WeakPolarHBondContact OD1-CG 3.43Å; D173-K175 PolarHBondContact OD1-N 3.33Å; D173-W176 PolarHBondContact O-N 3.25Å; D173-W176 VanDerWaalsContact O-N 3.12Å
174	K	85.2	Confident	89.3	Confident	104 Å²	104	42 Å²	42	45%	0.452	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-59.9	-22.8	-178	-61.2	-177.4	-178.8	-175.7	0	113.5	A172 W176 I177 N300	A172-K174 PolarHBondContact O-N 2.85Å; K174-W176 PolarHBondContact O-N 2.91Å; K174-I177 PolarHBondContact O-N 2.98Å; K174-N300 PolarHBondContact NZ-OD1 3.01Å
175	K	84.1	Confident	89.3	Confident	189 Å²	189	42.2 Å²	42.2	82%	0.822	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-64.2	-28.2	177.9	-66.2	176.7	-178.7	176.2	0	112.6	D173	D173-K175 PolarHBondContact O-N 3.31Å; D173-K175 VanDerWaalsContact O-N 3.12Å; D173-K175 WeakPolarHBondContact OD1-CB 3.48Å; D173-K175 WeakPolarHBondContact OD1-CG 3.43Å; D173-K175 PolarHBondContact OD1-N 3.33Å
176	W	86.2	Confident	89.3	Confident	166 Å²	166	42.1 Å²	42.1	63%	0.629	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-95.5	-3.2	-178	-68.9	85	0	0	0	113.3	F93 L97 Y101 D173 K174	F93-W176 AromaticContact CE2-CD1 3.55Å; F93-W176 HydrophobicContact CE2-CG 4.27Å; F93-W176 AromaticContact CE2-NE1 3.63Å; F93-W176 AromaticContact CZ-CD1 3.46Å; F93-W176 VanDerWaalsContact CZ-CD1 3.46Å; F93-W176 AromaticContact CZ-CD2 3.96Å; F93-W176 HydrophobicContact CZ-CD2 3.96Å; F93-W176 AromaticContact CZ-CE2 3.63Å; F93-W176 AromaticContact CZ-CG 3.85Å; F93-W176 HydrophobicContact CZ-CG 3.85Å; F93-W176 HydrophobicContact CZ-CZ2 4.29Å; F93-W176 AromaticContact CZ-NE1 3.31Å; F93-W176 VanDerWaalsContact CZ-NE1 3.31Å; L97-W176 HydrophobicContact CD1-CB 3.99Å; L97-W176 HydrophobicContact CD1-CG 4.3Å; L97-W176 HydrophobicContact CD2-CB 3.96Å; Y101-W176 PolarHBondContact OH-O 3.18Å; D173-W176 PolarHBondContact O-N 3.25Å; D173-W176 VanDerWaalsContact O-N 3.12Å; K174-W176 PolarHBondContact O-N 2.91Å
177	I	89.2	Confident	89.3	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.036	23%	0.225	C	C	.	.	S	Bend	trans	-103.6	112.7	178.3	-60.2	177.4	0	0	0	108.4	L97 F100 F169 A172 K174 C179 L182	L97-I177 HydrophobicContact CD2-CD1 4.22Å; L97-I177 HydrophobicContact CD2-CG1 3.81Å; F100-I177 HydrophobicContact CD1-CD1 4.08Å; F100-I177 HydrophobicContact CD1-CG1 4.32Å; F100-I177 HydrophobicContact CE1-CD1 4.1Å; F100-I177 HydrophobicContact CE1-CG1 4.22Å; F100-I177 HydrophobicContact CE1-CG2 3.72Å; F100-I177 HydrophobicContact CG-CD1 4.33Å; F100-I177 HydrophobicContact CZ-CD1 4.35Å; F100-I177 HydrophobicContact CZ-CG2 3.89Å; F169-I177 HydrophobicContact CD2-CD1 4.28Å; A172-I177 HydrophobicContact CB-CD1 3.73Å; K174-I177 PolarHBondContact O-N 2.98Å; I177-C179 PolarHBondContact O-N 2.72Å; I177-C179 PolarHBondContact O-SG 3.4Å; I177-C179 VanDerWaalsContact O-SG 3.41Å; I177-L182 HydrophobicContact CG2-CD1 3.65Å
178	P	89.6	Confident	89.4	Confident	56 Å²	56	49.1 Å²	49.1	36%	0.364	24%	0.24	S	C	.	.			trans	-73.8	76.1	176	30.9	-33.3	0	0	0	110.1	Y101 S180 E181 L182	Y101-P178 WeakPolarHBondContact OH-CD 3.13Å; P178-S180 PolarHBondContact O-N 3.17Å; P178-E181 HydrophobicContact CB-CB 4.33Å; P178-E181 HydrophobicContact CB-CG 4.06Å; P178-E181 PolarHBondContact O-N 3.36Å; P178-L182 HydrophobicContact CG-CD1 4.34Å; P178-L182 HydrophobicContact CG-CG 4.29Å; P178-L182 WeakPolarHBondContact O-CG 3.43Å; P178-L182 PolarHBondContact O-N 3.41Å
179	C	90.1	Very high	89.6	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-35.2	-172.5	-64.2	0	0	0	0	112.6	I177 S183 L297	I177-C179 PolarHBondContact O-N 2.72Å; I177-C179 PolarHBondContact O-SG 3.4Å; I177-C179 VanDerWaalsContact O-SG 3.41Å; C179-S183 WeakPolarHBondContact O-CB 3.47Å; C179-S183 PolarHBondContact O-N 3.37Å; C179-L297 HydrophobicContact CB-CD2 4.39Å
180	S	90.3	Very high	89.7	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-42.7	179.3	62.2	0	0	0	0	113.1	P178 T184 T309	P178-S180 PolarHBondContact O-N 3.17Å; S180-T184 PolarHBondContact O-N 2.97Å; S180-T184 PolarHBondContact O-OG1 3.18Å; S180-T309 WeakPolarHBondContact OG-CG2 3.34Å
181	E	88.9	Confident	89.8	Confident	45 Å²	45	51.8 Å²	51.8	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-71.8	-43.2	179.5	-51	-64.1	164.4	0	0	110.6	P178 S183 T184 V185 T309 Y313	P178-E181 HydrophobicContact CB-CB 4.33Å; P178-E181 HydrophobicContact CB-CG 4.06Å; P178-E181 PolarHBondContact O-N 3.36Å; E181-S183 VanDerWaalsContact C-N 3.27Å; E181-S183 PolarHBondContact O-N 2.93Å; E181-T184 PolarHBondContact O-N 2.71Å; E181-T184 PolarHBondContact O-OG1 2.94Å; E181-V185 WeakPolarHBondContact O-CG2 3.42Å; E181-V185 PolarHBondContact O-N 2.87Å; E181-V185 VanDerWaalsContact O-N 3.08Å; E181-T309 HydrophobicContact CG-CG2 4Å; E181-T309 WeakPolarHBondContact OE1-CG2 3.5Å; E181-T309 WeakPolarHBondContact OE2-CB 3.49Å; E181-T309 WeakPolarHBondContact OE2-CG2 3.46Å; E181-Y313 WeakPolarHBondContact OE2-CE2 3.41Å
182	L	91.8	Very high	90.1	Very high	17 Å²	17	50.8 Å²	50.8	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-65.8	-33.4	178	-63.8	175.1	0	0	0	111.4	F100 F104 I177 P178 V185 A186 L297	F100-L182 HydrophobicContact CE1-CD1 3.76Å; F100-L182 HydrophobicContact CZ-CD1 3.94Å; F104-L182 HydrophobicContact CD1-CD2 4.04Å; F104-L182 HydrophobicContact CE1-CD2 3.46Å; F104-L182 VanDerWaalsContact CE1-CD2 3.46Å; F104-L182 HydrophobicContact CE2-CD2 4.49Å; F104-L182 HydrophobicContact CZ-CB 4.41Å; F104-L182 HydrophobicContact CZ-CD2 3.73Å; I177-L182 HydrophobicContact CG2-CD1 3.65Å; P178-L182 HydrophobicContact CG-CD1 4.34Å; P178-L182 HydrophobicContact CG-CG 4.29Å; P178-L182 WeakPolarHBondContact O-CG 3.43Å; P178-L182 PolarHBondContact O-N 3.41Å; L182-V185 PolarHBondContact O-N 3.44Å; L182-A186 WeakPolarHBondContact O-CB 3.32Å; L182-A186 PolarHBondContact O-N 3.43Å; L182-L297 HydrophobicContact CB-CD1 3.76Å
183	S	92.1	Very high	90.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-44.4	173.7	172.3	0	0	0	0	111.7	C179 E181 V185 A186 I187 L298	C179-S183 WeakPolarHBondContact O-CB 3.47Å; C179-S183 PolarHBondContact O-N 3.37Å; E181-S183 VanDerWaalsContact C-N 3.27Å; E181-S183 PolarHBondContact O-N 2.93Å; S183-V185 VanDerWaalsContact C-N 3.32Å; S183-V185 PolarHBondContact O-N 3.2Å; S183-A186 PolarHBondContact O-N 3.24Å; S183-I187 WeakPolarHBondContact O-CG1 3.43Å; S183-I187 PolarHBondContact O-N 3.46Å; S183-L298 VanDerWaalsContact OG-CD2 3.23Å; S183-L298 WeakPolarHBondContact OG-CD2 3.49Å; S183-L298 VanDerWaalsContact OG-CG 3.22Å; S183-L298 WeakPolarHBondContact OG-CG 3.26Å
184	T	88.7	Confident	90.6	Very high	32 Å²	32	50.6 Å²	50.6	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-38.2	177.8	43	0	0	0	0	111.8	S180 E181 I187 F188 Y313	S180-T184 PolarHBondContact O-N 2.97Å; S180-T184 PolarHBondContact O-OG1 3.18Å; E181-T184 PolarHBondContact O-N 2.71Å; E181-T184 PolarHBondContact O-OG1 2.94Å; T184-I187 PolarHBondContact O-N 2.89Å; T184-F188 PolarHBondContact O-N 3.25Å; T184-Y313 WeakPolarHBondContact OG1-CE2 3.48Å
185	V	92	Very high	90.8	Very high	33 Å²	33	53.7 Å²	53.7	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-42.2	173.1	174.3	0	0	0	0	110.8	F104 I108 E181 L182 S183 F188 F189	F104-V185 HydrophobicContact CE1-CG1 4.27Å; F104-V185 HydrophobicContact CZ-CB 4.39Å; F104-V185 HydrophobicContact CZ-CG1 3.92Å; I108-V185 HydrophobicContact CD1-CG1 4.17Å; E181-V185 WeakPolarHBondContact O-CG2 3.42Å; E181-V185 PolarHBondContact O-N 2.87Å; E181-V185 VanDerWaalsContact O-N 3.08Å; L182-V185 PolarHBondContact O-N 3.44Å; S183-V185 VanDerWaalsContact C-N 3.32Å; S183-V185 PolarHBondContact O-N 3.2Å; V185-F188 WeakPolarHBondContact O-CB 3.18Å; V185-F188 PolarHBondContact O-N 3.19Å; V185-F189 HydrophobicContact CG1-CD2 3.66Å; V185-F189 HydrophobicContact CG1-CE2 3.63Å; V185-F189 VanDerWaalsContact O-CD2 3.26Å; V185-F189 WeakPolarHBondContact O-CD2 3.49Å; V185-F189 PolarHBondContact O-N 3.4Å
186	A	94.3	Very high	91	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-41	177.7	0	0	0	0	0	112.7	L182 S183 F188 F189 T190 W290 L297	L182-A186 WeakPolarHBondContact O-CB 3.32Å; L182-A186 PolarHBondContact O-N 3.43Å; S183-A186 PolarHBondContact O-N 3.24Å; A186-F188 VanDerWaalsContact C-N 3.34Å; A186-F189 PolarHBondContact O-N 3.06Å; A186-T190 PolarHBondContact O-N 3.43Å; A186-T190 PolarHBondContact O-OG1 2.93Å; A186-W290 VanDerWaalsContact CA-CE3 3.49Å; A186-W290 HydrophobicContact CB-CE3 3.67Å; A186-W290 HydrophobicContact CB-CZ3 3.91Å; A186-L297 HydrophobicContact CB-CD1 4.46Å
187	I	92.3	Very high	91	Very high	73 Å²	73	38 Å²	38	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-61.8	-44.2	173.3	-66.4	165.1	0	0	0	110.3	S183 T184 F189 T190 V191	S183-I187 WeakPolarHBondContact O-CG1 3.43Å; S183-I187 PolarHBondContact O-N 3.46Å; T184-I187 PolarHBondContact O-N 2.89Å; I187-F189 PolarHBondContact O-N 3.06Å; I187-T190 WeakPolarHBondContact O-CB 3.43Å; I187-T190 PolarHBondContact O-N 2.92Å; I187-V191 PolarHBondContact O-N 3.31Å
188	F	92.6	Very high	90.7	Very high	123 Å²	123	39.6 Å²	39.6	54%	0.539	20%	0.202	S	C	.	.	H	α-helix	trans	-58.1	-46.4	175.9	171.8	-96.4	0	0	0	112.1	T184 V185 A186 T190 V191 L192	T184-F188 PolarHBondContact O-N 3.25Å; V185-F188 WeakPolarHBondContact O-CB 3.18Å; V185-F188 PolarHBondContact O-N 3.19Å; A186-F188 VanDerWaalsContact C-N 3.34Å; F188-T190 VanDerWaalsContact C-N 3.33Å; F188-T190 PolarHBondContact O-N 3.4Å; F188-V191 PolarHBondContact O-N 3.47Å; F188-L192 HydrophobicContact CE1-CD2 4.16Å; F188-L192 WeakPolarHBondContact O-CB 3.49Å; F188-L192 PolarHBondContact O-N 2.93Å
189	F	94.1	Very high	90.3	Very high	15 Å²	15	42 Å²	42	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-70.6	-25.9	177.3	-79.7	-70.8	0	0	0	113.6	I108 T111 L112 V185 A186 I187 L192 S193 W290	I108-F189 HydrophobicContact CB-CE2 4.32Å; I108-F189 HydrophobicContact CB-CZ 4.22Å; I108-F189 HydrophobicContact CD1-CE2 4.01Å; I108-F189 HydrophobicContact CG1-CD2 4.16Å; I108-F189 HydrophobicContact CG1-CE2 3.66Å; I108-F189 HydrophobicContact CG1-CZ 4.07Å; I108-F189 HydrophobicContact CG2-CE1 4.16Å; I108-F189 HydrophobicContact CG2-CE2 3.95Å; I108-F189 HydrophobicContact CG2-CZ 3.47Å; I108-F189 VanDerWaalsContact CG2-CZ 3.47Å; T111-F189 WeakPolarHBondContact OG1-CD1 3.31Å; T111-F189 WeakPolarHBondContact OG1-CE1 3.25Å; L112-F189 HydrophobicContact CD2-CE1 3.92Å; L112-F189 HydrophobicContact CD2-CZ 4.48Å; L112-F189 HydrophobicContact CG-CE1 4.13Å; V185-F189 HydrophobicContact CG1-CD2 3.66Å; V185-F189 HydrophobicContact CG1-CE2 3.63Å; V185-F189 VanDerWaalsContact O-CD2 3.26Å; V185-F189 WeakPolarHBondContact O-CD2 3.49Å; V185-F189 PolarHBondContact O-N 3.4Å; A186-F189 PolarHBondContact O-N 3.06Å; I187-F189 PolarHBondContact O-N 3.06Å; F189-L192 HydrophobicContact CD1-CD2 3.89Å; F189-L192 HydrophobicContact CE1-CD2 3.84Å; F189-S193 VanDerWaalsContact O-CB 3.26Å; F189-S193 WeakPolarHBondContact O-CB 3.32Å; F189-S193 PolarHBondContact O-N 3.01Å; F189-S193 PolarHBondContact O-OG 2.88Å; F189-W290 HydrophobicContact CB-CD2 3.63Å; F189-W290 HydrophobicContact CB-CE3 3.94Å; F189-W290 HydrophobicContact CB-CG 4.08Å; F189-W290 HydrophobicContact CB-CH2 4.08Å; F189-W290 HydrophobicContact CB-CZ2 3.8Å; F189-W290 HydrophobicContact CB-CZ3 4.14Å; F189-W290 HydrophobicContact CD1-CZ2 4.5Å; F189-W290 AromaticContact CD2-CH2 3.86Å; F189-W290 HydrophobicContact CD2-CH2 3.86Å; F189-W290 HydrophobicContact CD2-CZ2 4.12Å; F189-W290 HydrophobicContact CD2-CZ3 4.26Å; F189-W290 HydrophobicContact CG-CH2 4.08Å; F189-W290 AromaticContact CG-CZ2 3.89Å; F189-W290 HydrophobicContact CG-CZ2 3.89Å
190	T	93.6	Very high	89.7	Confident	16 Å²	16	44.2 Å²	44.2	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-46.5	169.1	-53.1	0	0	0	0	110.6	A186 I187 F188 S193 Y194 W290 C291	A186-T190 PolarHBondContact O-N 3.43Å; A186-T190 PolarHBondContact O-OG1 2.93Å; I187-T190 WeakPolarHBondContact O-CB 3.43Å; I187-T190 PolarHBondContact O-N 2.92Å; F188-T190 VanDerWaalsContact C-N 3.33Å; F188-T190 PolarHBondContact O-N 3.4Å; T190-S193 WeakPolarHBondContact CA-OG 3.4Å; T190-S193 PolarHBondContact O-OG 3.43Å; T190-Y194 PolarHBondContact O-N 3.41Å; T190-W290 WeakPolarHBondContact OG1-CB 3.41Å; T190-C291 HydrophobicContact CG2-CB 3.8Å; T190-C291 PolarHBondContact OG1-N 2.82Å
191	V	92.6	Very high	89.3	Confident	74 Å²	74	44 Å²	44	45%	0.448	24%	0.235	S	C	.	.	H	α-helix	trans	-66.4	-44.6	177.1	175.8	0	0	0	0	111	I187 F188 S193 Y194 Y195	I187-V191 PolarHBondContact O-N 3.31Å; F188-V191 PolarHBondContact O-N 3.47Å; V191-S193 PolarHBondContact O-N 3.44Å; V191-Y194 WeakPolarHBondContact O-CB 3.22Å; V191-Y194 PolarHBondContact O-N 2.73Å; V191-Y195 HydrophobicContact CG1-CD2 3.8Å; V191-Y195 HydrophobicContact CG1-CE2 3.51Å; V191-Y195 WeakPolarHBondContact O-CD2 3.29Å; V191-Y195 PolarHBondContact O-N 3.43Å; V191-Y195 VanDerWaalsContact O-N 3.1Å
192	L	92.1	Very high	89	Confident	31 Å²	31	42.7 Å²	42.7	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-41.3	179.2	-175.2	62.6	0	0	0	112.2	L112 F115 F188 F189 Y195 S196	L112-L192 HydrophobicContact CD2-CD2 4.05Å; F115-L192 HydrophobicContact CD2-CD1 3.79Å; F115-L192 HydrophobicContact CD2-CG 4.25Å; F115-L192 HydrophobicContact CE2-CD1 3.79Å; F115-L192 HydrophobicContact CG-CD1 4.18Å; F115-L192 HydrophobicContact CG-CG 4.47Å; F115-L192 HydrophobicContact CZ-CD1 4.17Å; F188-L192 HydrophobicContact CE1-CD2 4.16Å; F188-L192 WeakPolarHBondContact O-CB 3.49Å; F188-L192 PolarHBondContact O-N 2.93Å; F189-L192 HydrophobicContact CD1-CD2 3.89Å; F189-L192 HydrophobicContact CE1-CD2 3.84Å; L192-Y195 PolarHBondContact O-N 3.09Å; L192-S196 PolarHBondContact O-N 3.22Å; L192-S196 VanDerWaalsContact O-N 3.09Å
193	S	91.4	Very high	88.8	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-35.5	176.2	53.3	0	0	0	0	112	F189 T190 V191 Y195 S196 C287	F189-S193 VanDerWaalsContact O-CB 3.26Å; F189-S193 WeakPolarHBondContact O-CB 3.32Å; F189-S193 PolarHBondContact O-N 3.01Å; F189-S193 PolarHBondContact O-OG 2.88Å; T190-S193 WeakPolarHBondContact CA-OG 3.4Å; T190-S193 PolarHBondContact O-OG 3.43Å; V191-S193 PolarHBondContact O-N 3.44Å; S193-Y195 PolarHBondContact O-N 3.02Å; S193-S196 WeakPolarHBondContact O-CB 3.38Å; S193-S196 PolarHBondContact O-N 3.32Å; S193-S196 VanDerWaalsContact O-N 3.09Å; S193-S196 PolarHBondContact O-OG 3.28Å; S193-C287 PolarHBondContact OG-SG 2.9Å; S193-C287 VanDerWaalsContact OG-SG 3.4Å
194	Y	91.6	Very high	88.5	Confident	58 Å²	58	49.1 Å²	49.1	23%	0.227	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-43.6	171.8	174.3	-105.3	0	0	0	112.3	T190 V191 S196 L197 I209	T190-Y194 PolarHBondContact O-N 3.41Å; V191-Y194 WeakPolarHBondContact O-CB 3.22Å; V191-Y194 PolarHBondContact O-N 2.73Å; Y194-S196 PolarHBondContact O-N 3.08Å; Y194-L197 HydrophobicContact CD2-CD1 3.95Å; Y194-L197 WeakPolarHBondContact O-CB 3.47Å; Y194-L197 PolarHBondContact O-N 2.91Å; Y194-I209 HydrophobicContact CD2-CD1 3.39Å; Y194-I209 HydrophobicContact CE2-CD1 4.11Å; Y194-I209 HydrophobicContact CG-CD1 4.07Å
195	Y	89.8	Confident	88.4	Confident	170 Å²	170	47.6 Å²	47.6	67%	0.667	26%	0.258	S	S	*	.	H	α-helix	trans	-67.9	-19.7	175.2	-76.3	-67.4	0	0	0	113.6	V191 L192 S193 L197	V191-Y195 HydrophobicContact CG1-CD2 3.8Å; V191-Y195 HydrophobicContact CG1-CE2 3.51Å; V191-Y195 WeakPolarHBondContact O-CD2 3.29Å; V191-Y195 PolarHBondContact O-N 3.43Å; V191-Y195 VanDerWaalsContact O-N 3.1Å; L192-Y195 PolarHBondContact O-N 3.09Å; S193-Y195 PolarHBondContact O-N 3.02Å; Y195-L197 VanDerWaalsContact C-N 3.26Å; Y195-L197 PolarHBondContact O-N 3.29Å
196	S	88.1	Confident	88.3	Confident	13 Å²	13	53.7 Å²	53.7	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-74.6	-15.6	174.8	82.5	0	0	0	0	113.5	S118 L192 S193 Y194	S118-S196 WeakPolarHBondContact CB-O 3.19Å; S118-S196 PolarHBondContact OG-O 3.43Å; L192-S196 PolarHBondContact O-N 3.22Å; L192-S196 VanDerWaalsContact O-N 3.09Å; S193-S196 WeakPolarHBondContact O-CB 3.38Å; S193-S196 PolarHBondContact O-N 3.32Å; S193-S196 VanDerWaalsContact O-N 3.09Å; S193-S196 PolarHBondContact O-OG 3.28Å; Y194-S196 PolarHBondContact O-N 3.08Å
197	L	86.8	Confident	88.1	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.068	31%	0.306	C	S	.	.	S	Bend	trans	-73.1	141.3	-176.6	-69.9	161.9	0	0	0	111.7	Y194 Y195 A201 A205 P283	Y194-L197 HydrophobicContact CD2-CD1 3.95Å; Y194-L197 WeakPolarHBondContact O-CB 3.47Å; Y194-L197 PolarHBondContact O-N 2.91Å; Y195-L197 VanDerWaalsContact C-N 3.26Å; Y195-L197 PolarHBondContact O-N 3.29Å; L197-A201 HydrophobicContact CB-CB 4.26Å; L197-A201 HydrophobicContact CD2-CB 4.13Å; L197-A205 HydrophobicContact CD1-CB 3.62Å; L197-P283 HydrophobicContact CD2-CB 3.56Å
198	S	81.2	Confident	88.1	Confident	39 Å²	39	57.9 Å²	57.9	27%	0.273	29%	0.288	S	S	.	.			trans	-61	152.8	172.8	72.8	0	0	0	0	111.6	A200 A201 A202	S198-A200 VanDerWaalsContact C-N 3.25Å; S198-A200 PolarHBondContact O-N 2.93Å; S198-A200 VanDerWaalsContact O-N 3.14Å; S198-A201 CarbonylContact O-C 3.58Å; S198-A201 WeakPolarHBondContact O-CA 3.37Å; S198-A201 WeakPolarHBondContact O-CB 3.33Å; S198-A201 PolarHBondContact O-N 3.4Å; S198-A201 VanDerWaalsContact OG-CB 3.3Å; S198-A201 WeakPolarHBondContact OG-CB 3.27Å; S198-A201 PolarHBondContact OG-N 2.93Å; S198-A202 WeakPolarHBondContact O-CB 3.5Å; S198-A202 PolarHBondContact O-N 2.9Å
199	P	82.4	Confident	87.9	Confident	106 Å²	106	53.5 Å²	53.5	69%	0.688	27%	0.27	S	S	*	.	H	α-helix	trans	-57	-35.4	-176.8	-26.6	33.6	0	0	0	114.3	A203	P199-A203 PolarHBondContact O-N 3.37Å
200	A	77.9	Confident	87.8	Confident	56 Å²	56	59.9 Å²	59.9	46%	0.463	30%	0.298	S	S	.	.	H	α-helix	trans	-70.6	-39	175.5	0	0	0	0	0	111.9	S198 Y204 F280	S198-A200 VanDerWaalsContact C-N 3.25Å; S198-A200 PolarHBondContact O-N 2.93Å; S198-A200 VanDerWaalsContact O-N 3.14Å; A200-Y204 WeakPolarHBondContact O-CD2 3.29Å; A200-F280 HydrophobicContact CB-CE1 4.1Å
201	A	80.6	Confident	87.7	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-41	174.4	0	0	0	0	0	111.7	L197 S198 A203 Y204 A205 F280	L197-A201 HydrophobicContact CB-CB 4.26Å; L197-A201 HydrophobicContact CD2-CB 4.13Å; S198-A201 CarbonylContact O-C 3.58Å; S198-A201 WeakPolarHBondContact O-CA 3.37Å; S198-A201 WeakPolarHBondContact O-CB 3.33Å; S198-A201 PolarHBondContact O-N 3.4Å; S198-A201 VanDerWaalsContact OG-CB 3.3Å; S198-A201 WeakPolarHBondContact OG-CB 3.27Å; S198-A201 PolarHBondContact OG-N 2.93Å; A201-A203 PolarHBondContact O-N 3.31Å; A201-Y204 PolarHBondContact O-N 2.87Å; A201-A205 VanDerWaalsContact O-CB 3.27Å; A201-A205 WeakPolarHBondContact O-CB 3.48Å; A201-A205 PolarHBondContact O-N 3.4Å; A201-F280 HydrophobicContact CB-CD1 3.5Å; A201-F280 VanDerWaalsContact CB-CD1 3.5Å; A201-F280 HydrophobicContact CB-CE1 3.98Å
202	A	84.3	Confident	87.6	Confident	16 Å²	16	56.7 Å²	56.7	13%	0.132	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-32.8	-178.1	0	0	0	0	0	112.6	S198 R206	S198-A202 WeakPolarHBondContact O-CB 3.5Å; S198-A202 PolarHBondContact O-N 2.9Å; A202-R206 VanDerWaalsContact O-CB 3.22Å; A202-R206 WeakPolarHBondContact O-CB 3.38Å; A202-R206 PolarHBondContact O-N 2.95Å
203	A	86.3	Confident	87.5	Confident	53 Å²	53	58.5 Å²	58.5	44%	0.438	29%	0.29	S	S	.	.	H	α-helix	trans	-64.8	-44	177.3	0	0	0	0	0	112.7	P199 A201	P199-A203 PolarHBondContact O-N 3.37Å; A201-A203 PolarHBondContact O-N 3.31Å
204	Y	85.1	Confident	87.4	Confident	99 Å²	99	59.6 Å²	59.6	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-73.7	-44.2	175.6	-67.1	-78.9	0	0	0	111.2	A200 A201 R206 R207 A208 M268	A200-Y204 WeakPolarHBondContact O-CD2 3.29Å; A201-Y204 PolarHBondContact O-N 2.87Å; Y204-R206 VanDerWaalsContact C-N 3.31Å; Y204-R206 PolarHBondContact O-N 3.25Å; Y204-R207 PolarHBondContact O-N 2.92Å; Y204-A208 PolarHBondContact O-N 3.36Å; Y204-M268 HydrophobicContact CG-CG 4.43Å
205	A	87.8	Confident	87.2	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-36.8	178.6	0	0	0	0	0	112.5	L197 A201 R207 A208 I209 Y284	L197-A205 HydrophobicContact CD1-CB 3.62Å; A201-A205 VanDerWaalsContact O-CB 3.27Å; A201-A205 WeakPolarHBondContact O-CB 3.48Å; A201-A205 PolarHBondContact O-N 3.4Å; A205-R207 VanDerWaalsContact C-N 3.28Å; A205-R207 PolarHBondContact O-N 3.46Å; A205-A208 PolarHBondContact O-N 2.8Å; A205-A208 VanDerWaalsContact O-N 3.1Å; A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.34Å; A205-Y284 HydrophobicContact CB-CD2 3.8Å
206	R	90.7	Very high	87	Confident	161 Å²	161	49.5 Å²	49.5	61%	0.608	26%	0.261	S	S	*	.	H	α-helix	trans	-57	-42	177.3	-175	-173.2	-55.8	174.6	3	112.2	A202 Y204 F210	A202-R206 VanDerWaalsContact O-CB 3.22Å; A202-R206 WeakPolarHBondContact O-CB 3.38Å; A202-R206 PolarHBondContact O-N 2.95Å; Y204-R206 VanDerWaalsContact C-N 3.31Å; Y204-R206 PolarHBondContact O-N 3.25Å; R206-F210 WeakPolarHBondContact O-CB 3.48Å; R206-F210 PolarHBondContact O-N 3.02Å; R206-F210 VanDerWaalsContact O-N 3.09Å
207	R	89.8	Confident	86.9	Confident	161 Å²	161	54.1 Å²	54.1	61%	0.608	28%	0.284	S	S	*	.	H	α-helix	trans	-67	-42.2	177.3	-64	-178.5	-177.4	179	0.6	110.7	Y204 A205 I211 L264	Y204-R207 PolarHBondContact O-N 2.92Å; A205-R207 VanDerWaalsContact C-N 3.28Å; A205-R207 PolarHBondContact O-N 3.46Å; R207-I211 VanDerWaalsContact O-CG1 3.25Å; R207-I211 WeakPolarHBondContact O-CG1 3.13Å; R207-I211 PolarHBondContact O-N 3.01Å; R207-L264 HydrophobicContact CB-CD1 4.29Å
208	A	90.6	Very high	86.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-49.3	179.9	0	0	0	0	0	112.2	Y204 A205 F210 I211 E212 L261 L264 M268 Y284	Y204-A208 PolarHBondContact O-N 3.36Å; A205-A208 PolarHBondContact O-N 2.8Å; A205-A208 VanDerWaalsContact O-N 3.1Å; A208-F210 VanDerWaalsContact C-N 3.31Å; A208-F210 PolarHBondContact O-N 2.87Å; A208-I211 PolarHBondContact O-N 3.23Å; A208-E212 VanDerWaalsContact O-CB 3.31Å; A208-E212 WeakPolarHBondContact O-CB 3.42Å; A208-E212 PolarHBondContact O-N 2.98Å; A208-L261 HydrophobicContact CB-CD1 3.93Å; A208-L264 HydrophobicContact CB-CD1 4.05Å; A208-M268 HydrophobicContact CB-CE 4.4Å; A208-Y284 HydrophobicContact CB-CD2 4.26Å; A208-Y284 HydrophobicContact CB-CE1 4.35Å; A208-Y284 HydrophobicContact CB-CE2 3.45Å; A208-Y284 VanDerWaalsContact CB-CE2 3.45Å; A208-Y284 WeakPolarHBondContact CB-OH 3.42Å
209	I	90.4	Very high	86.5	Confident	30 Å²	30	53.5 Å²	53.5	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-41.2	176.2	-65.6	-179.8	0	0	0	111.1	Y194 A205 I211 E212 V213 Y284 C287	Y194-I209 HydrophobicContact CD2-CD1 3.39Å; Y194-I209 HydrophobicContact CE2-CD1 4.11Å; Y194-I209 HydrophobicContact CG-CD1 4.07Å; A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.34Å; I209-I211 VanDerWaalsContact C-N 3.34Å; I209-I211 PolarHBondContact O-N 2.84Å; I209-E212 PolarHBondContact O-N 3.41Å; I209-V213 HydrophobicContact CG2-CG2 4.06Å; I209-V213 WeakPolarHBondContact O-CB 3.3Å; I209-V213 VanDerWaalsContact O-CG2 3.27Å; I209-V213 WeakPolarHBondContact O-CG2 3.29Å; I209-V213 PolarHBondContact O-N 2.72Å; I209-Y284 HydrophobicContact CG1-CE2 3.8Å; I209-C287 HydrophobicContact CD1-CB 4.39Å
210	F	91.4	Very high	86.3	Confident	149 Å²	149	51.2 Å²	51.2	65%	0.654	26%	0.262	S	S	*	.	H	α-helix	trans	-61.2	-44.5	178.3	179.1	-95.6	0	0	0	111.8	R206 A208 A214	R206-F210 WeakPolarHBondContact O-CB 3.48Å; R206-F210 PolarHBondContact O-N 3.02Å; R206-F210 VanDerWaalsContact O-N 3.09Å; A208-F210 VanDerWaalsContact C-N 3.31Å; A208-F210 PolarHBondContact O-N 2.87Å; F210-A214 VanDerWaalsContact O-CB 3.23Å; F210-A214 WeakPolarHBondContact O-CB 3.17Å; F210-A214 PolarHBondContact O-N 3.04Å
211	I	90.2	Very high	86.4	Confident	22 Å²	22	49 Å²	49	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-42.7	178.5	-66.5	-68.6	0	0	0	111.1	R207 A208 I209 A214 S215 L257 Y260 L261	R207-I211 VanDerWaalsContact O-CG1 3.25Å; R207-I211 WeakPolarHBondContact O-CG1 3.13Å; R207-I211 PolarHBondContact O-N 3.01Å; A208-I211 PolarHBondContact O-N 3.23Å; I209-I211 VanDerWaalsContact C-N 3.34Å; I209-I211 PolarHBondContact O-N 2.84Å; I211-A214 PolarHBondContact O-N 3.39Å; I211-S215 PolarHBondContact O-N 2.83Å; I211-S215 PolarHBondContact O-OG 3.5Å; I211-S215 VanDerWaalsContact O-OG 3.14Å; I211-L257 HydrophobicContact CD1-CD2 4.08Å; I211-L257 HydrophobicContact CG2-CB 4.03Å; I211-L257 HydrophobicContact CG2-CD2 4.31Å; I211-L257 VanDerWaalsContact CG2-O 3.3Å; I211-L257 WeakPolarHBondContact CG2-O 3.44Å; I211-Y260 HydrophobicContact CD1-CD1 3.81Å; I211-Y260 HydrophobicContact CD1-CE1 3.92Å; I211-Y260 HydrophobicContact CG1-CD1 3.77Å; I211-Y260 HydrophobicContact CG1-CE1 3.82Å; I211-Y260 HydrophobicContact CG2-CD1 4.21Å; I211-L261 HydrophobicContact CG2-CB 4.38Å
212	E	91	Very high	85.9	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-49.7	177.3	-179.6	-179.6	178.4	0	0	112.1	A208 I209 A214 S215 N216 L261 Y284 F288 C291	A208-E212 VanDerWaalsContact O-CB 3.31Å; A208-E212 WeakPolarHBondContact O-CB 3.42Å; A208-E212 PolarHBondContact O-N 2.98Å; I209-E212 PolarHBondContact O-N 3.41Å; E212-A214 VanDerWaalsContact C-N 3.31Å; E212-A214 PolarHBondContact O-N 3.46Å; E212-S215 WeakPolarHBondContact CA-OG 3.27Å; E212-S215 PolarHBondContact O-N 3.45Å; E212-S215 PolarHBondContact O-OG 3.32Å; E212-N216 VanDerWaalsContact O-CB 3.32Å; E212-N216 WeakPolarHBondContact O-CB 3.06Å; E212-N216 VanDerWaalsContact O-CG 3.24Å; E212-N216 PolarHBondContact O-N 3.2Å; E212-N216 PolarHBondContact O-ND2 3.19Å; E212-L261 HydrophobicContact CB-CD1 4.43Å; E212-Y284 PolarHBondContact OE2-OH 2.75Å; E212-F288 HydrophobicContact CG-CD2 4.33Å; E212-F288 VanDerWaalsContact OE1-CA 3.27Å; E212-F288 WeakPolarHBondContact OE1-CA 3.2Å; E212-F288 WeakPolarHBondContact OE1-CD2 3.35Å; E212-C291 VanDerWaalsContact OE1-CB 3.23Å; E212-C291 WeakPolarHBondContact OE1-CB 3.28Å
213	V	90.3	Very high	85.2	Confident	70 Å²	70	57.7 Å²	57.7	42%	0.424	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-40.1	175.2	172.1	0	0	0	0	110.7	I209 N216 L217	I209-V213 HydrophobicContact CG2-CG2 4.06Å; I209-V213 WeakPolarHBondContact O-CB 3.3Å; I209-V213 VanDerWaalsContact O-CG2 3.27Å; I209-V213 WeakPolarHBondContact O-CG2 3.29Å; I209-V213 PolarHBondContact O-N 2.72Å; V213-N216 PolarHBondContact O-N 3.24Å; V213-L217 WeakPolarHBondContact O-CB 3.48Å; V213-L217 PolarHBondContact O-N 3.12Å
214	A	89.1	Confident	84.4	Confident	29 Å²	29	58.2 Å²	58.2	24%	0.24	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-44.6	176.6	0	0	0	0	0	112.1	F210 I211 E212 L217 C218 L257	F210-A214 VanDerWaalsContact O-CB 3.23Å; F210-A214 WeakPolarHBondContact O-CB 3.17Å; F210-A214 PolarHBondContact O-N 3.04Å; I211-A214 PolarHBondContact O-N 3.39Å; E212-A214 VanDerWaalsContact C-N 3.31Å; E212-A214 PolarHBondContact O-N 3.46Å; A214-L217 PolarHBondContact O-N 3.01Å; A214-C218 WeakPolarHBondContact O-CB 3.25Å; A214-C218 PolarHBondContact O-N 3.33Å; A214-C218 PolarHBondContact O-SG 3.24Å; A214-L257 HydrophobicContact CB-CD1 4.44Å
215	S	87.1	Confident	83.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.007	29%	0.285	C	S	.	.	H	α-helix	trans	-64.6	-40.7	176.8	51.2	0	0	0	0	112.2	I211 E212 C218 C219 Y258	I211-S215 PolarHBondContact O-N 2.83Å; I211-S215 PolarHBondContact O-OG 3.5Å; I211-S215 VanDerWaalsContact O-OG 3.14Å; E212-S215 WeakPolarHBondContact CA-OG 3.27Å; E212-S215 PolarHBondContact O-N 3.45Å; E212-S215 PolarHBondContact O-OG 3.32Å; S215-C218 WeakPolarHBondContact O-CB 3.44Å; S215-C218 PolarHBondContact O-N 3.1Å; S215-C219 PolarHBondContact O-N 3.43Å; S215-Y258 WeakPolarHBondContact OG-CE2 3.46Å
216	N	86.7	Confident	82.6	Confident	15 Å²	15	64.3 Å²	64.3	8%	0.08	32%	0.317	C	S	.	.	H	α-helix	trans	-71.5	-36.8	-179.5	-72	-18.4	0	0	0	112	E212 V213 C219 L220 E292 V295	E212-N216 VanDerWaalsContact O-CB 3.32Å; E212-N216 WeakPolarHBondContact O-CB 3.06Å; E212-N216 VanDerWaalsContact O-CG 3.24Å; E212-N216 PolarHBondContact O-N 3.2Å; E212-N216 PolarHBondContact O-ND2 3.19Å; V213-N216 PolarHBondContact O-N 3.24Å; N216-C219 WeakPolarHBondContact O-CB 3.34Å; N216-C219 PolarHBondContact O-N 3.19Å; N216-L220 WeakPolarHBondContact O-CB 3.33Å; N216-L220 PolarHBondContact O-N 2.84Å; N216-E292 PolarHBondContact ND2-OE1 2.91Å; N216-E292 PolarHBondContact OD1-OE1 3.34Å; N216-V295 HydrophobicContact CB-CG1 4.39Å; N216-V295 HydrophobicContact CB-CG2 3.73Å
217	L	85.3	Confident	81.4	Confident	111 Å²	111	63.7 Å²	63.7	58%	0.581	33%	0.325	S	S	*	.	H	α-helix	trans	-63.3	-43.3	171.7	-174.2	62.4	0	0	0	111.1	V213 A214 C219 L220 T221	V213-L217 WeakPolarHBondContact O-CB 3.48Å; V213-L217 PolarHBondContact O-N 3.12Å; A214-L217 PolarHBondContact O-N 3.01Å; L217-C219 VanDerWaalsContact C-N 3.3Å; L217-C219 PolarHBondContact O-N 2.83Å; L217-L220 PolarHBondContact O-N 2.8Å; L217-T221 VanDerWaalsContact O-CG2 3.29Å; L217-T221 WeakPolarHBondContact O-CG2 3.4Å; L217-T221 PolarHBondContact O-N 3.28Å
218	C	82.6	Confident	80.4	Confident	11 Å²	11	60.9 Å²	60.9	7%	0.074	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-40.4	173.6	-67.1	0	0	0	0	111.5	A214 S215 T221 L234 G235 P254	A214-C218 WeakPolarHBondContact O-CB 3.25Å; A214-C218 PolarHBondContact O-N 3.33Å; A214-C218 PolarHBondContact O-SG 3.24Å; S215-C218 WeakPolarHBondContact O-CB 3.44Å; S215-C218 PolarHBondContact O-N 3.1Å; C218-T221 PolarHBondContact O-N 3.34Å; C218-T221 PolarHBondContact O-OG1 3.16Å; C218-L234 HydrophobicContact CB-CB 4.31Å; C218-G235 WeakPolarHBondContact O-CA 3.31Å; C218-P254 HydrophobicContact CB-CG 3.77Å
219	C	76.7	Confident	79.4	Confident	27 Å²	27	66.1 Å²	66.1	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-41.4	174.8	-172.5	0	0	0	0	112	S215 N216 L217 T221 Q222	S215-C219 PolarHBondContact O-N 3.43Å; N216-C219 WeakPolarHBondContact O-CB 3.34Å; N216-C219 PolarHBondContact O-N 3.19Å; L217-C219 VanDerWaalsContact C-N 3.3Å; L217-C219 PolarHBondContact O-N 2.83Å; C219-T221 PolarHBondContact O-N 3.33Å; C219-Q222 WeakPolarHBondContact O-CB 3.45Å; C219-Q222 WeakPolarHBondContact O-CG 3.43Å; C219-Q222 PolarHBondContact O-N 2.9Å; C219-Q222 VanDerWaalsContact O-N 3.15Å
220	L	79.6	Confident	78.6	Confident	59 Å²	59	67.6 Å²	67.6	31%	0.309	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-25.9	178.4	-160.6	74.7	0	0	0	112.6	N216 L217 Q222 L223 Q299	N216-L220 WeakPolarHBondContact O-CB 3.33Å; N216-L220 PolarHBondContact O-N 2.84Å; L217-L220 PolarHBondContact O-N 2.8Å; L220-Q222 PolarHBondContact O-N 3.33Å; L220-Q222 VanDerWaalsContact O-N 3.07Å; L220-L223 HydrophobicContact CD1-CD1 4.28Å; L220-L223 PolarHBondContact O-N 3.42Å; L220-Q299 HydrophobicContact CD1-CG 4.4Å
221	T	78	Confident	77.4	Confident	8 Å²	8	64.4 Å²	64.4	5%	0.049	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-60.7	-17.7	175.5	69	0	0	0	0	113.8	L217 C218 C219 L223 L224 L231 G235	L217-T221 VanDerWaalsContact O-CG2 3.29Å; L217-T221 WeakPolarHBondContact O-CG2 3.4Å; L217-T221 PolarHBondContact O-N 3.28Å; C218-T221 PolarHBondContact O-N 3.34Å; C218-T221 PolarHBondContact O-OG1 3.16Å; C219-T221 PolarHBondContact O-N 3.33Å; T221-L223 PolarHBondContact O-N 3.46Å; T221-L224 HydrophobicContact CG2-CD1 4.36Å; T221-L224 PolarHBondContact O-N 3.38Å; T221-L231 WeakPolarHBondContact CB-O 3.48Å; T221-L231 HydrophobicContact CG2-CD2 4.35Å; T221-L231 HydrophobicContact CG2-CG 4.43Å; T221-L231 PolarHBondContact OG1-O 2.92Å; T221-G235 PolarHBondContact OG1-N 2.92Å
222	Q	71.1	Confident	76.5	Confident	96 Å²	96	68 Å²	68	45%	0.449	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-68	-20.7	173	-63.3	-179.1	-2.1	0	0	113.5	C219 L220 G235	C219-Q222 WeakPolarHBondContact O-CB 3.45Å; C219-Q222 WeakPolarHBondContact O-CG 3.43Å; C219-Q222 PolarHBondContact O-N 2.9Å; C219-Q222 VanDerWaalsContact O-N 3.15Å; L220-Q222 PolarHBondContact O-N 3.33Å; L220-Q222 VanDerWaalsContact O-N 3.07Å; Q222-G235 PolarHBondContact NE2-O 3.44Å
223	L	69.3	Low	75.7	Confident	107 Å²	107	74 Å²	74	56%	0.56	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-84.8	-5.6	177.2	-84.4	97.8	0	0	0	113.7	L220 T221 Q299	L220-L223 HydrophobicContact CD1-CD1 4.28Å; L220-L223 PolarHBondContact O-N 3.42Å; T221-L223 PolarHBondContact O-N 3.46Å; L223-Q299 HydrophobicContact CD1-CG 4.14Å
224	L	68.8	Low	74.9	Confident	64 Å²	64	74.1 Å²	74.1	34%	0.335	40%	0.401	S	S	.	.	S	Bend	trans	-76.7	151.3	-178.3	-77.7	156.2	0	0	0	112.3	T221 L231	T221-L224 HydrophobicContact CG2-CD1 4.36Å; T221-L224 PolarHBondContact O-N 3.38Å; L224-L231 HydrophobicContact CD1-CB 4.29Å; L224-L231 HydrophobicContact CD1-CD2 3.6Å
225	P	70.8	Confident	73.9	Confident	83 Å²	83	72.8 Å²	72.8	54%	0.539	39%	0.389	S	S	.	.			trans	-56.6	155.2	176.2	-19.9	30.3	0	0	0	112.8	D227 M228	P225-D227 PolarHBondContact O-N 3.31Å; P225-M228 PolarHBondContact O-N 3.03Å
226	E	64.4	Low	73.3	Confident	146 Å²	146	77.6 Å²	77.6	68%	0.682	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.8	-174.3	-57.2	-150	122	0	0	114.4	M228 R232	E226-M228 VanDerWaalsContact C-N 3.26Å; E226-M228 PolarHBondContact O-N 2.91Å; E226-R232 IonicContact OE1-NH1 3.55Å; E226-R232 PolarHBondContact OE1-NH1 3.25Å
227	D	65.6	Low	72.6	Confident	147 Å²	147	79.6 Å²	79.6	79%	0.786	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-17.2	-176	-56.4	-33.4	0	0	0	114	P225	P225-D227 PolarHBondContact O-N 3.31Å
228	M	69.8	Low	72.1	Confident	103 Å²	103	79.2 Å²	79.2	51%	0.507	42%	0.418	S	S	.	.			trans	-103	63.3	-178.8	-64	-132.4	81.3	0	0	112.9	P225 E226 G230 L231 R232	P225-M228 PolarHBondContact O-N 3.03Å; E226-M228 VanDerWaalsContact C-N 3.26Å; E226-M228 PolarHBondContact O-N 2.91Å; M228-G230 VanDerWaalsContact C-N 3.29Å; M228-G230 PolarHBondContact O-N 3.24Å; M228-L231 PolarHBondContact O-N 3.22Å; M228-R232 PolarHBondContact O-N 2.88Å
229	T	69.7	Low	71.8	Confident	110 Å²	110	82.3 Å²	82.3	68%	0.675	44%	0.437	S	S	*	.	H	α-helix	trans	-58.2	-35.6	-173.6	-21.5	0	0	0	0	113.8	R232 F233	T229-R232 PolarHBondContact O-N 2.77Å; T229-F233 PolarHBondContact O-N 2.85Å
230	G	72.4	Confident	72	Confident	60 Å²	60	84.9 Å²	84.9	62%	0.619	45%	0.452	S	S	*	.	H	α-helix	trans	-67.2	-40.7	-179.7	0	0	0	0	0	113.8	M228	M228-G230 VanDerWaalsContact C-N 3.29Å; M228-G230 PolarHBondContact O-N 3.24Å
231	L	68.1	Low	72.1	Confident	83 Å²	83	85 Å²	85	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-72.4	-35.7	177.3	-117.3	79.9	0	0	0	111.4	T221 L224 M228 F233 L234	T221-L231 WeakPolarHBondContact CB-O 3.48Å; T221-L231 HydrophobicContact CG2-CD2 4.35Å; T221-L231 HydrophobicContact CG2-CG 4.43Å; T221-L231 PolarHBondContact OG1-O 2.92Å; L224-L231 HydrophobicContact CD1-CB 4.29Å; L224-L231 HydrophobicContact CD1-CD2 3.6Å; M228-L231 PolarHBondContact O-N 3.22Å; L231-F233 PolarHBondContact O-N 3.37Å; L231-L234 PolarHBondContact O-N 3.45Å
232	R	71.4	Confident	72.3	Confident	97 Å²	97	89 Å²	89	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-25	179.4	-164.5	174.5	-178.6	-176.1	2.9	112.8	E226 M228 T229 L234 G235 H236	E226-R232 IonicContact OE1-NH1 3.55Å; E226-R232 PolarHBondContact OE1-NH1 3.25Å; M228-R232 PolarHBondContact O-N 2.88Å; T229-R232 PolarHBondContact O-N 2.77Å; R232-L234 VanDerWaalsContact C-N 3.26Å; R232-L234 PolarHBondContact O-N 3.35Å; R232-G235 PolarHBondContact O-N 3.09Å; R232-H236 PolarHBondContact O-N 2.82Å
233	F	73.5	Confident	72.7	Confident	127 Å²	127	89.8 Å²	89.8	56%	0.557	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-59.9	-34.5	176	-173.4	-98.7	0	0	0	112.6	T229 L231 G235 H236 F238	T229-F233 PolarHBondContact O-N 2.85Å; L231-F233 PolarHBondContact O-N 3.37Å; F233-G235 VanDerWaalsContact C-N 3.26Å; F233-G235 PolarHBondContact O-N 3.3Å; F233-H236 PolarHBondContact O-N 2.94Å; F233-F238 HydrophobicContact CE1-CZ 4.35Å; F233-F238 HydrophobicContact CE2-CE1 4.04Å; F233-F238 HydrophobicContact CE2-CZ 4.29Å; F233-F238 AromaticContact CZ-CE1 3.99Å; F233-F238 HydrophobicContact CZ-CE1 3.99Å; F233-F238 AromaticContact CZ-CZ 3.96Å; F233-F238 HydrophobicContact CZ-CZ 3.96Å
234	L	72.4	Confident	73	Confident	73 Å²	73	86.8 Å²	86.8	38%	0.382	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-65.9	-29.1	178.8	-75.4	96	0	0	0	112.9	C218 L231 R232	C218-L234 HydrophobicContact CB-CB 4.31Å; L231-L234 PolarHBondContact O-N 3.45Å; R232-L234 VanDerWaalsContact C-N 3.26Å; R232-L234 PolarHBondContact O-N 3.35Å
235	G	68.9	Low	73.3	Confident	0 Å²	0	91 Å²	91	0%	0	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-93.4	-3.5	178	0	0	0	0	0	114.5	C218 T221 Q222 R232 F233 T237	C218-G235 WeakPolarHBondContact O-CA 3.31Å; T221-G235 PolarHBondContact OG1-N 2.92Å; Q222-G235 PolarHBondContact NE2-O 3.44Å; R232-G235 PolarHBondContact O-N 3.09Å; F233-G235 VanDerWaalsContact C-N 3.26Å; F233-G235 PolarHBondContact O-N 3.3Å; G235-T237 PolarHBondContact O-N 3.32Å
236	H	74.6	Confident	73.4	Confident	102 Å²	102	90.6 Å²	90.6	47%	0.472	50%	0.5	S	S	.	.			trans	-70.2	132.6	-170.8	-159.9	-83.2	0	0	0	112.1	R232 F233 F238	R232-H236 PolarHBondContact O-N 2.82Å; F233-H236 PolarHBondContact O-N 2.94Å; H236-F238 PolarHBondContact O-N 3.3Å
237	T	72.9	Confident	74.2	Confident	57 Å²	57	85.7 Å²	85.7	35%	0.35	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	112.4	170.8	50.3	0	0	0	0	108.8	G235 K250	G235-T237 PolarHBondContact O-N 3.32Å; T237-K250 HydrophobicContact CG2-CD 4.49Å
238	F	73.7	Confident	75.1	Confident	104 Å²	104	79.5 Å²	79.5	46%	0.456	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-38.4	-175.7	-64.2	-80.4	0	0	0	112.3	F233 H236 L251 I253	F233-F238 HydrophobicContact CE1-CZ 4.35Å; F233-F238 HydrophobicContact CE2-CE1 4.04Å; F233-F238 HydrophobicContact CE2-CZ 4.29Å; F233-F238 AromaticContact CZ-CE1 3.99Å; F233-F238 HydrophobicContact CZ-CE1 3.99Å; F233-F238 AromaticContact CZ-CZ 3.96Å; F233-F238 HydrophobicContact CZ-CZ 3.96Å; H236-F238 PolarHBondContact O-N 3.3Å; F238-L251 PolarHBondContact N-O 3.3Å; F238-I253 HydrophobicContact CE2-CD1 4.1Å; F238-I253 HydrophobicContact CE2-CG1 3.99Å; F238-I253 HydrophobicContact CZ-CD1 4.21Å
239	T	76.3	Confident	75.7	Confident	75 Å²	75	76 Å²	76	46%	0.46	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	143.9	179.7	-113.1	0	0	0	0	110.9	V241 L251	T239-V241 HydrophobicContact CG2-CG2 3.61Å; T239-L251 HydrophobicContact CG2-CB 4.13Å; T239-L251 HydrophobicContact CG2-CD1 4.3Å; T239-L251 PolarHBondContact N-O 3.42Å; T239-L251 WeakPolarHBondContact O-CB 3.48Å; T239-L251 PolarHBondContact O-N 3Å
240	T	81	Confident	76.2	Confident	82 Å²	82	74.1 Å²	74.1	50%	0.503	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.1	173.5	55.9	0	0	0	0	108.9	L249 K250	T240-L249 CarbonylContact C-O 3.56Å; T240-L249 VanDerWaalsContact CA-O 3.31Å; T240-L249 WeakPolarHBondContact CA-O 3.22Å; T240-K250 HydrophobicContact CG2-CG 4.1Å
241	V	82.4	Confident	76.6	Confident	60 Å²	60	75.4 Å²	75.4	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	115.8	179.3	-176.6	0	0	0	0	108.7	T239 L243 L249	T239-V241 HydrophobicContact CG2-CG2 3.61Å; V241-L243 PolarHBondContact O-N 2.85Å; V241-L249 HydrophobicContact CB-CB 4.34Å; V241-L249 PolarHBondContact N-O 3.49Å; V241-L249 WeakPolarHBondContact O-CB 2.82Å; V241-L249 PolarHBondContact O-N 3.5Å
242	P	81.9	Confident	77.2	Confident	94 Å²	94	72 Å²	72	61%	0.61	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	120.1	173.6	28.4	-31.6	0	0	0	109.6
243	L	78.9	Confident	77.8	Confident	112 Å²	112	70 Å²	70	59%	0.586	38%	0.384	S	S	*	.			trans	-91.4	-6.2	177.1	-74.8	167.4	0	0	0	112.3	V241 V247 L249 L657	V241-L243 PolarHBondContact O-N 2.85Å; L243-V247 PolarHBondContact N-O 3.41Å; L243-L249 HydrophobicContact CD1-CB 3.76Å; L243-L249 HydrophobicContact CD1-CD1 4.15Å; L243-L249 HydrophobicContact CD1-CG 4.41Å; L243-L249 HydrophobicContact CG-CB 4.15Å; L243-L657 HydrophobicContact CD1-CD2 3.58Å
244	G	76.7	Confident	78.3	Confident	44 Å²	44	64.2 Å²	64.2	45%	0.454	36%	0.359	S	S	.	.	S	Bend	trans	175.2	-165.5	178	0	0	0	0	0	112.2	S246 V247	G244-S246 VanDerWaalsContact C-N 3.28Å; G244-S246 PolarHBondContact O-N 2.93Å; G244-V247 PolarHBondContact N-O 3.5Å
245	E	74.4	Confident	78.8	Confident	152 Å²	152	61.1 Å²	61.1	71%	0.71	34%	0.343	S	S	*	.	S	Bend	trans	-73.1	-15.3	-179	-64.4	-166.9	157.2	0	0	114.5
246	S	72.4	Confident	79.6	Confident	75 Å²	75	66.8 Å²	66.8	52%	0.524	37%	0.373	S	S	.	.	S	Bend	trans	-131	-5	-172.9	-50.8	0	0	0	0	115	G244 A659 E660	G244-S246 VanDerWaalsContact C-N 3.28Å; G244-S246 PolarHBondContact O-N 2.93Å; S246-A659 WeakPolarHBondContact O-CA 3.47Å; S246-E660 PolarHBondContact O-N 2.75Å
247	V	82.3	Confident	80.2	Confident	43 Å²	43	63.8 Å²	63.8	26%	0.261	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.1	-174.3	-176.8	0	0	0	0	110.6	L243 G244 F649 L657	L243-V247 PolarHBondContact N-O 3.41Å; G244-V247 PolarHBondContact N-O 3.5Å; V247-F649 HydrophobicContact CG1-CZ 4.3Å; V247-F649 HydrophobicContact CG2-CZ 4.35Å; V247-L657 HydrophobicContact CG1-CB 4.19Å; V247-L657 HydrophobicContact CG1-CD2 3.74Å; V247-L657 HydrophobicContact CG1-CG 4.42Å
248	V	84.3	Confident	80.9	Confident	16 Å²	16	61.2 Å²	61.2	10%	0.097	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.5	178.6	-177	0	0	0	0	109.7	S658 E660	V248-S658 PolarHBondContact N-O 2.98Å; V248-S658 PolarHBondContact O-N 3.41Å; V248-E660 HydrophobicContact CG2-CB 4.05Å; V248-E660 VanDerWaalsContact CG2-OE2 3.22Å; V248-E660 WeakPolarHBondContact CG2-OE2 3.4Å
249	L	80.8	Confident	81.5	Confident	31 Å²	31	60.1 Å²	60.1	16%	0.162	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.1	172.6	-172.3	81.2	0	0	0	109.2	T240 V241 L243 L251 F656 L657	T240-L249 CarbonylContact C-O 3.56Å; T240-L249 VanDerWaalsContact CA-O 3.31Å; T240-L249 WeakPolarHBondContact CA-O 3.22Å; V241-L249 HydrophobicContact CB-CB 4.34Å; V241-L249 PolarHBondContact N-O 3.49Å; V241-L249 WeakPolarHBondContact O-CB 2.82Å; V241-L249 PolarHBondContact O-N 3.5Å; L243-L249 HydrophobicContact CD1-CB 3.76Å; L243-L249 HydrophobicContact CD1-CD1 4.15Å; L243-L249 HydrophobicContact CD1-CG 4.41Å; L243-L249 HydrophobicContact CG-CB 4.15Å; L249-L251 HydrophobicContact CD2-CD1 4.25Å; L249-F656 HydrophobicContact CD1-CD2 4.16Å; L249-F656 HydrophobicContact CD1-CE2 3.91Å; L249-F656 HydrophobicContact CD1-CZ 4.18Å; L249-F656 VanDerWaalsContact CD1-O 3.29Å; L249-F656 WeakPolarHBondContact CD1-O 3.43Å; L249-L657 HydrophobicContact CB-CD2 4.44Å; L249-L657 HydrophobicContact CD1-CD2 3.74Å; L249-L657 HydrophobicContact CD1-CG 4.48Å
250	K	80.4	Confident	82.2	Confident	70 Å²	70	61.3 Å²	61.3	30%	0.304	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109	176.1	-62.8	-178.4	178.7	166.8	0	109.6	T237 T240 S252 C255 F656	T237-K250 HydrophobicContact CG2-CD 4.49Å; T240-K250 HydrophobicContact CG2-CG 4.1Å; K250-S252 PolarHBondContact O-N 2.92Å; K250-C255 WeakPolarHBondContact O-CB 3.17Å; K250-F656 PolarHBondContact N-O 3.1Å
251	L	80.9	Confident	82.6	Confident	87 Å²	87	57.5 Å²	57.5	46%	0.455	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	110.5	174.3	-116.3	125.3	0	0	0	109.3	F238 T239 L249	F238-L251 PolarHBondContact N-O 3.3Å; T239-L251 HydrophobicContact CG2-CB 4.13Å; T239-L251 HydrophobicContact CG2-CD1 4.3Å; T239-L251 PolarHBondContact N-O 3.42Å; T239-L251 WeakPolarHBondContact O-CB 3.48Å; T239-L251 PolarHBondContact O-N 3Å; L249-L251 HydrophobicContact CD2-CD1 4.25Å
252	S	81.5	Confident	82.9	Confident	10 Å²	10	58.9 Å²	58.9	7%	0.07	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	160.7	-175.9	65.7	0	0	0	0	110.4	K250 P254 C255 L256	K250-S252 PolarHBondContact O-N 2.92Å; S252-P254 VanDerWaalsContact C-N 3.33Å; S252-C255 WeakPolarHBondContact O-CB 3.47Å; S252-C255 PolarHBondContact O-N 3.5Å; S252-C255 PolarHBondContact OG-N 3.33Å; S252-L256 PolarHBondContact O-N 2.83Å
253	I	83.5	Confident	83.4	Confident	57 Å²	57	61 Å²	61	29%	0.292	31%	0.314	S	S	.	.	H	α-helix	trans	-57	-43.4	173.3	-72.1	157.9	0	0	0	111.4	F238 C255 L256 L257	F238-I253 HydrophobicContact CE2-CD1 4.1Å; F238-I253 HydrophobicContact CE2-CG1 3.99Å; F238-I253 HydrophobicContact CZ-CD1 4.21Å; I253-C255 PolarHBondContact O-N 3.31Å; I253-L256 PolarHBondContact O-N 2.77Å; I253-L256 VanDerWaalsContact O-N 3.17Å; I253-L257 HydrophobicContact CG2-CD1 4.42Å; I253-L257 PolarHBondContact O-N 3.08Å
254	P	84.1	Confident	83.9	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.032	29%	0.289	C	S	.	.	H	α-helix	trans	-54.8	-33.1	171.4	-29.3	36.2	0	0	0	114.4	C218 S252 L257 Y258 P655	C218-P254 HydrophobicContact CB-CG 3.77Å; S252-P254 VanDerWaalsContact C-N 3.33Å; P254-L257 PolarHBondContact O-N 2.9Å; P254-Y258 WeakPolarHBondContact O-CB 3.33Å; P254-Y258 PolarHBondContact O-N 3.39Å; P254-P655 HydrophobicContact CB-CB 4.02Å; P254-P655 HydrophobicContact CB-CG 3.48Å; P254-P655 VanDerWaalsContact CB-CG 3.48Å
255	C	83.4	Confident	84.5	Confident	7 Å²	7	55.6 Å²	55.6	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-41.9	177.2	176.1	0	0	0	0	112.2	K250 S252 I253 Y258 I259	K250-C255 WeakPolarHBondContact O-CB 3.17Å; S252-C255 WeakPolarHBondContact O-CB 3.47Å; S252-C255 PolarHBondContact O-N 3.5Å; S252-C255 PolarHBondContact OG-N 3.33Å; I253-C255 PolarHBondContact O-N 3.31Å; C255-Y258 PolarHBondContact O-N 2.89Å; C255-I259 WeakPolarHBondContact O-CG1 3.32Å; C255-I259 PolarHBondContact O-N 3.18Å
256	L	85.7	Confident	85.3	Confident	119 Å²	119	53.9 Å²	53.9	62%	0.623	26%	0.264	S	S	*	.	H	α-helix	trans	-64.3	-41.1	174.8	-67.9	174.9	0	0	0	112.1	S252 I253 Y258 I259 Y260	S252-L256 PolarHBondContact O-N 2.83Å; I253-L256 PolarHBondContact O-N 2.77Å; I253-L256 VanDerWaalsContact O-N 3.17Å; L256-Y258 VanDerWaalsContact C-N 3.34Å; L256-I259 PolarHBondContact O-N 3.13Å; L256-Y260 PolarHBondContact O-N 3.37Å
257	L	87.3	Confident	86	Confident	39 Å²	39	52.2 Å²	52.2	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-41.4	175.6	-68.5	174.6	0	0	0	111.5	I211 A214 I253 P254 Y260 L261	I211-L257 HydrophobicContact CD1-CD2 4.08Å; I211-L257 HydrophobicContact CG2-CB 4.03Å; I211-L257 HydrophobicContact CG2-CD2 4.31Å; I211-L257 VanDerWaalsContact CG2-O 3.3Å; I211-L257 WeakPolarHBondContact CG2-O 3.44Å; A214-L257 HydrophobicContact CB-CD1 4.44Å; I253-L257 HydrophobicContact CG2-CD1 4.42Å; I253-L257 PolarHBondContact O-N 3.08Å; P254-L257 PolarHBondContact O-N 2.9Å; L257-Y260 WeakPolarHBondContact O-CB 3.2Å; L257-Y260 PolarHBondContact O-N 3.37Å; L257-L261 PolarHBondContact O-N 3.43Å
258	Y	86.4	Confident	86.3	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-37.4	175.6	-105.4	-104	0	0	0	113.2	S215 P254 C255 L256 Y260 L261 F262 E292 P655	S215-Y258 WeakPolarHBondContact OG-CE2 3.46Å; P254-Y258 WeakPolarHBondContact O-CB 3.33Å; P254-Y258 PolarHBondContact O-N 3.39Å; C255-Y258 PolarHBondContact O-N 2.89Å; L256-Y258 VanDerWaalsContact C-N 3.34Å; Y258-Y260 VanDerWaalsContact C-N 3.3Å; Y258-Y260 PolarHBondContact O-N 3.15Å; Y258-L261 HydrophobicContact CD1-CD2 4.45Å; Y258-L261 HydrophobicContact CE1-CD2 4.43Å; Y258-L261 VanDerWaalsContact O-CB 3.3Å; Y258-L261 WeakPolarHBondContact O-CB 3.42Å; Y258-L261 PolarHBondContact O-N 3.36Å; Y258-L261 VanDerWaalsContact O-N 3.15Å; Y258-F262 HydrophobicContact CD1-CE2 4.39Å; Y258-F262 WeakPolarHBondContact O-CD2 2.88Å; Y258-F262 PolarHBondContact O-N 3.1Å; Y258-E292 PolarHBondContact OH-OE1 2.93Å; Y258-E292 PolarHBondContact OH-OE2 3.4Å; Y258-P655 HydrophobicContact CD2-CG 3.82Å; Y258-P655 VanDerWaalsContact CE2-CD 3.43Å; Y258-P655 HydrophobicContact CE2-CG 4.23Å; Y258-P655 HydrophobicContact CG-CG 4.22Å
259	I	87.8	Confident	86.5	Confident	81 Å²	81	50.2 Å²	50.2	42%	0.415	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-42.2	172.3	-69.1	166	0	0	0	110.3	C255 L256 L261 F262 Y263 F656	C255-I259 WeakPolarHBondContact O-CG1 3.32Å; C255-I259 PolarHBondContact O-N 3.18Å; L256-I259 PolarHBondContact O-N 3.13Å; I259-L261 VanDerWaalsContact C-N 3.32Å; I259-F262 PolarHBondContact O-N 2.62Å; I259-Y263 PolarHBondContact O-N 2.92Å; I259-F656 HydrophobicContact CD1-CD2 4.24Å; I259-F656 HydrophobicContact CD1-CE2 4.14Å; I259-F656 HydrophobicContact CG1-CD2 4.06Å; I259-F656 HydrophobicContact CG1-CE2 4.15Å
260	Y	90.3	Very high	86.9	Confident	100 Å²	100	56.6 Å²	56.6	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-35.6	174.1	-176.9	-113	0	0	0	112.3	I211 L256 L257 Y258 Y263 L264	I211-Y260 HydrophobicContact CD1-CD1 3.81Å; I211-Y260 HydrophobicContact CD1-CE1 3.92Å; I211-Y260 HydrophobicContact CG1-CD1 3.77Å; I211-Y260 HydrophobicContact CG1-CE1 3.82Å; I211-Y260 HydrophobicContact CG2-CD1 4.21Å; L256-Y260 PolarHBondContact O-N 3.37Å; L257-Y260 WeakPolarHBondContact O-CB 3.2Å; L257-Y260 PolarHBondContact O-N 3.37Å; Y258-Y260 VanDerWaalsContact C-N 3.3Å; Y258-Y260 PolarHBondContact O-N 3.15Å; Y260-Y263 HydrophobicContact CD2-CD1 4.04Å; Y260-Y263 AromaticContact CE2-CD1 3.89Å; Y260-Y263 HydrophobicContact CE2-CD1 3.89Å; Y260-Y263 HydrophobicContact CE2-CE1 4.27Å; Y260-Y263 WeakPolarHBondContact O-CB 3.44Å; Y260-Y263 PolarHBondContact O-N 3.38Å; Y260-L264 HydrophobicContact CD1-CD1 4.16Å; Y260-L264 HydrophobicContact CD1-CG 4.49Å; Y260-L264 HydrophobicContact CE1-CD1 3.81Å; Y260-L264 HydrophobicContact CE1-CD2 4.43Å; Y260-L264 HydrophobicContact CE1-CG 4.17Å; Y260-L264 WeakPolarHBondContact O-CG 3.49Å; Y260-L264 PolarHBondContact O-N 3.02Å
261	L	89.8	Confident	87	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-45.6	172.6	-170.7	70.3	0	0	0	111.7	A208 I211 E212 L257 Y258 I259 Y263 L264 F265 F288	A208-L261 HydrophobicContact CB-CD1 3.93Å; I211-L261 HydrophobicContact CG2-CB 4.38Å; E212-L261 HydrophobicContact CB-CD1 4.43Å; L257-L261 PolarHBondContact O-N 3.43Å; Y258-L261 HydrophobicContact CD1-CD2 4.45Å; Y258-L261 HydrophobicContact CE1-CD2 4.43Å; Y258-L261 VanDerWaalsContact O-CB 3.3Å; Y258-L261 WeakPolarHBondContact O-CB 3.42Å; Y258-L261 PolarHBondContact O-N 3.36Å; Y258-L261 VanDerWaalsContact O-N 3.15Å; I259-L261 VanDerWaalsContact C-N 3.32Å; L261-Y263 VanDerWaalsContact C-N 3.31Å; L261-Y263 PolarHBondContact O-N 3.36Å; L261-L264 WeakPolarHBondContact O-CA 3.47Å; L261-L264 WeakPolarHBondContact O-CB 3.37Å; L261-L264 PolarHBondContact O-N 3.18Å; L261-F265 HydrophobicContact CD1-CE1 3.77Å; L261-F265 HydrophobicContact CD1-CZ 4.2Å; L261-F265 HydrophobicContact CD2-CE1 4.21Å; L261-F265 HydrophobicContact CD2-CZ 3.77Å; L261-F265 HydrophobicContact CG-CD1 4.42Å; L261-F265 HydrophobicContact CG-CE1 3.59Å; L261-F265 HydrophobicContact CG-CE2 4.43Å; L261-F265 HydrophobicContact CG-CZ 3.63Å; L261-F265 VanDerWaalsContact O-CD1 3.31Å; L261-F265 WeakPolarHBondContact O-CD1 3.35Å; L261-F265 PolarHBondContact O-N 2.99Å; L261-F288 HydrophobicContact CD2-CD2 4.26Å; L261-F288 HydrophobicContact CD2-CE2 3.85Å
262	F	89.3	Confident	86.9	Confident	88 Å²	88	59.6 Å²	59.6	39%	0.386	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-39	173.6	-80.5	-66.5	0	0	0	112.6	Y258 I259 L264 F265 F266	Y258-F262 HydrophobicContact CD1-CE2 4.39Å; Y258-F262 WeakPolarHBondContact O-CD2 2.88Å; Y258-F262 PolarHBondContact O-N 3.1Å; I259-F262 PolarHBondContact O-N 2.62Å; F262-L264 VanDerWaalsContact C-N 3.33Å; F262-L264 PolarHBondContact O-N 3.24Å; F262-F265 HydrophobicContact CD1-CD2 4.15Å; F262-F265 WeakPolarHBondContact O-CB 3.25Å; F262-F265 PolarHBondContact O-N 3.05Å; F262-F266 PolarHBondContact O-N 2.89Å
263	Y	90.9	Very high	86.8	Confident	140 Å²	140	62.1 Å²	62.1	55%	0.549	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-42.3	172	168.1	-97.6	0	0	0	111.8	I259 Y260 L261 F265 F266 S267	I259-Y263 PolarHBondContact O-N 2.92Å; Y260-Y263 HydrophobicContact CD2-CD1 4.04Å; Y260-Y263 AromaticContact CE2-CD1 3.89Å; Y260-Y263 HydrophobicContact CE2-CD1 3.89Å; Y260-Y263 HydrophobicContact CE2-CE1 4.27Å; Y260-Y263 WeakPolarHBondContact O-CB 3.44Å; Y260-Y263 PolarHBondContact O-N 3.38Å; L261-Y263 VanDerWaalsContact C-N 3.31Å; L261-Y263 PolarHBondContact O-N 3.36Å; Y263-F265 VanDerWaalsContact C-N 3.35Å; Y263-F265 PolarHBondContact O-N 2.78Å; Y263-F266 PolarHBondContact O-N 3.47Å; Y263-S267 WeakPolarHBondContact O-CB 3.43Å; Y263-S267 PolarHBondContact O-N 3.25Å
264	L	89.8	Confident	86.7	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.073	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-38.1	174.9	-66.8	176.1	0	0	0	112	R207 A208 Y260 L261 F262 S267 M268	R207-L264 HydrophobicContact CB-CD1 4.29Å; A208-L264 HydrophobicContact CB-CD1 4.05Å; Y260-L264 HydrophobicContact CD1-CD1 4.16Å; Y260-L264 HydrophobicContact CD1-CG 4.49Å; Y260-L264 HydrophobicContact CE1-CD1 3.81Å; Y260-L264 HydrophobicContact CE1-CD2 4.43Å; Y260-L264 HydrophobicContact CE1-CG 4.17Å; Y260-L264 WeakPolarHBondContact O-CG 3.49Å; Y260-L264 PolarHBondContact O-N 3.02Å; L261-L264 WeakPolarHBondContact O-CA 3.47Å; L261-L264 WeakPolarHBondContact O-CB 3.37Å; L261-L264 PolarHBondContact O-N 3.18Å; F262-L264 VanDerWaalsContact C-N 3.33Å; F262-L264 PolarHBondContact O-N 3.24Å; L264-S267 PolarHBondContact O-N 3.42Å; L264-M268 WeakPolarHBondContact O-CG 3.36Å; L264-M268 PolarHBondContact O-N 2.68Å
265	F	90.5	Very high	86.4	Confident	27 Å²	27	71.2 Å²	71.2	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-46.6	174.9	-66.6	-0.7	0	0	0	111.3	L261 F262 Y263 S267 M268 A269 L281 Y284 F288	L261-F265 HydrophobicContact CD1-CE1 3.77Å; L261-F265 HydrophobicContact CD1-CZ 4.2Å; L261-F265 HydrophobicContact CD2-CE1 4.21Å; L261-F265 HydrophobicContact CD2-CZ 3.77Å; L261-F265 HydrophobicContact CG-CD1 4.42Å; L261-F265 HydrophobicContact CG-CE1 3.59Å; L261-F265 HydrophobicContact CG-CE2 4.43Å; L261-F265 HydrophobicContact CG-CZ 3.63Å; L261-F265 VanDerWaalsContact O-CD1 3.31Å; L261-F265 WeakPolarHBondContact O-CD1 3.35Å; L261-F265 PolarHBondContact O-N 2.99Å; F262-F265 HydrophobicContact CD1-CD2 4.15Å; F262-F265 WeakPolarHBondContact O-CB 3.25Å; F262-F265 PolarHBondContact O-N 3.05Å; Y263-F265 VanDerWaalsContact C-N 3.35Å; Y263-F265 PolarHBondContact O-N 2.78Å; F265-S267 VanDerWaalsContact C-N 3.35Å; F265-S267 PolarHBondContact O-N 2.95Å; F265-M268 HydrophobicContact CD1-CE 3.67Å; F265-M268 HydrophobicContact CE1-CE 4.34Å; F265-M268 PolarHBondContact O-N 3.44Å; F265-A269 WeakPolarHBondContact O-CB 3.48Å; F265-A269 PolarHBondContact O-N 3.28Å; F265-L281 HydrophobicContact CB-CD1 3.83Å; F265-L281 HydrophobicContact CD1-CD1 4.2Å; F265-L281 HydrophobicContact CG-CD1 3.97Å; F265-Y284 HydrophobicContact CD1-CD1 4.3Å; F265-Y284 AromaticContact CD1-CE1 3.91Å; F265-Y284 HydrophobicContact CD1-CE1 3.91Å; F265-Y284 AromaticContact CE1-CD1 3.87Å; F265-Y284 HydrophobicContact CE1-CD1 3.87Å; F265-Y284 AromaticContact CE1-CE1 3.08Å; F265-Y284 HydrophobicContact CE1-CE1 3.08Å; F265-Y284 AromaticContact CE1-CZ 3.81Å; F265-Y284 AromaticContact CZ-CE1 3.64Å; F265-Y284 HydrophobicContact CZ-CE1 3.64Å; F265-F288 HydrophobicContact CZ-CD2 4.02Å; F265-F288 HydrophobicContact CZ-CE2 4.22Å; F265-F288 HydrophobicContact CZ-CG 4.42Å
266	F	89.6	Confident	86.3	Confident	116 Å²	116	71 Å²	71	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-42	176.9	-175.6	-101.9	0	0	0	111.9	F262 Y263 A269 R270	F262-F266 PolarHBondContact O-N 2.89Å; Y263-F266 PolarHBondContact O-N 3.47Å; F266-A269 PolarHBondContact O-N 3.18Å; F266-R270 WeakPolarHBondContact O-CB 3.3Å; F266-R270 PolarHBondContact O-N 2.99Å
267	S	88.5	Confident	86.2	Confident	41 Å²	41	67.6 Å²	67.6	29%	0.287	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-44.6	175.2	-174.5	0	0	0	0	111.7	Y263 L264 F265 T271	Y263-S267 WeakPolarHBondContact O-CB 3.43Å; Y263-S267 PolarHBondContact O-N 3.25Å; L264-S267 PolarHBondContact O-N 3.42Å; F265-S267 VanDerWaalsContact C-N 3.35Å; F265-S267 PolarHBondContact O-N 2.95Å; S267-T271 PolarHBondContact O-N 2.93Å; S267-T271 PolarHBondContact O-OG1 3.33Å
268	M	88.4	Confident	85.8	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.025	32%	0.319	C	S	.	.	H	α-helix	trans	-62.5	-43.9	177.1	-74.2	-173.3	-71.3	0	0	111.3	Y204 A208 L264 F265 T271 F280 L281 Y284	Y204-M268 HydrophobicContact CG-CG 4.43Å; A208-M268 HydrophobicContact CB-CE 4.4Å; L264-M268 WeakPolarHBondContact O-CG 3.36Å; L264-M268 PolarHBondContact O-N 2.68Å; F265-M268 HydrophobicContact CD1-CE 3.67Å; F265-M268 HydrophobicContact CE1-CE 4.34Å; F265-M268 PolarHBondContact O-N 3.44Å; M268-T271 WeakPolarHBondContact O-CB 3.02Å; M268-T271 PolarHBondContact O-N 3.48Å; M268-T271 PolarHBondContact O-OG1 3.26Å; M268-T271 VanDerWaalsContact O-OG1 3.05Å; M268-F280 HydrophobicContact CB-CB 4.35Å; M268-L281 HydrophobicContact CE-CD1 4.27Å; M268-Y284 HydrophobicContact CE-CD1 3.84Å; M268-Y284 HydrophobicContact CE-CE1 4.31Å; M268-Y284 HydrophobicContact CE-CG 4.02Å; M268-Y284 HydrophobicContact SD-CG 4.41Å
269	A	88.3	Confident	85.4	Confident	11 Å²	11	72 Å²	72	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-62	-47.2	178.5	0	0	0	0	0	112.4	F265 F266 T271 F274 L281	F265-A269 WeakPolarHBondContact O-CB 3.48Å; F265-A269 PolarHBondContact O-N 3.28Å; F266-A269 PolarHBondContact O-N 3.18Å; A269-T271 PolarHBondContact O-N 3.42Å; A269-F274 WeakPolarHBondContact O-CA 3.26Å; A269-L281 HydrophobicContact CB-CD2 4.31Å
270	R	89.3	Confident	85.2	Confident	166 Å²	166	69 Å²	69	63%	0.626	32%	0.32	S	S	*	.	H	α-helix	trans	-65.2	-21.3	-176.3	-166.6	177.5	-172	-176.1	4.1	113.5	F266 R272 G273	F266-R270 WeakPolarHBondContact O-CB 3.3Å; F266-R270 PolarHBondContact O-N 2.99Å; R270-R272 PolarHBondContact O-N 2.82Å; R270-G273 PolarHBondContact O-N 3.34Å
271	T	82.8	Confident	85.2	Confident	33 Å²	33	65.5 Å²	65.5	20%	0.202	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	134.2	-179.5	-44.9	0	0	0	0	111.1	S267 M268 A269 G273 G276 F280	S267-T271 PolarHBondContact O-N 2.93Å; S267-T271 PolarHBondContact O-OG1 3.33Å; M268-T271 WeakPolarHBondContact O-CB 3.02Å; M268-T271 PolarHBondContact O-N 3.48Å; M268-T271 PolarHBondContact O-OG1 3.26Å; M268-T271 VanDerWaalsContact O-OG1 3.05Å; A269-T271 PolarHBondContact O-N 3.42Å; T271-G273 VanDerWaalsContact C-N 3.3Å; T271-G273 PolarHBondContact O-N 2.9Å; T271-G276 WeakPolarHBondContact O-CA 3.42Å; T271-G276 PolarHBondContact O-N 3.49Å; T271-F280 HydrophobicContact CG2-CD2 4.43Å; T271-F280 HydrophobicContact CG2-CE2 4.05Å
272	R	78.4	Confident	85.1	Confident	187 Å²	187	67.4 Å²	67.4	71%	0.706	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	38.3	-178.1	-62.4	-176.4	177.8	-167.1	-4.1	114.3	R270 R275	R270-R272 PolarHBondContact O-N 2.82Å; R272-R275 HydrophobicContact CB-CB 4.32Å; R272-R275 WeakPolarHBondContact O-CB 3.34Å
273	G	77.9	Confident	85.1	Confident	62 Å²	62	64 Å²	64	64%	0.639	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	53.8	174.3	0	0	0	0	0	113.2	R270 T271 R275	R270-G273 PolarHBondContact O-N 3.34Å; T271-G273 VanDerWaalsContact C-N 3.3Å; T271-G273 PolarHBondContact O-N 2.9Å; G273-R275 PolarHBondContact O-N 2.92Å
274	F	82.4	Confident	85	Confident	125 Å²	125	57.4 Å²	57.4	55%	0.548	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	-8.9	-177.1	-70.2	-85.8	0	0	0	116.8	A269 G276 T277	A269-F274 WeakPolarHBondContact O-CA 3.26Å; F274-G276 PolarHBondContact O-N 3.48Å; F274-T277 WeakPolarHBondContact O-CB 3.37Å; F274-T277 PolarHBondContact O-N 2.97Å; F274-T277 VanDerWaalsContact O-N 3.11Å; F274-T277 PolarHBondContact O-OG1 2.96Å
275	R	77.9	Confident	85.1	Confident	129 Å²	129	58.9 Å²	58.9	49%	0.487	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.6	170	-65.8	-176.6	-179.9	-179.3	-0	112.6	E141 R272 G273 T277 Y278 C279	E141-R275 IonicContact OE2-NH1 2.68Å; R272-R275 HydrophobicContact CB-CB 4.32Å; R272-R275 WeakPolarHBondContact O-CB 3.34Å; G273-R275 PolarHBondContact O-N 2.92Å; R275-T277 PolarHBondContact O-N 2.65Å; R275-T277 VanDerWaalsContact O-N 3.15Å; R275-Y278 VanDerWaalsContact CA-CE1 3.49Å; R275-Y278 HydrophobicContact CB-CE1 3.88Å; R275-Y278 WeakPolarHBondContact CB-OH 3.25Å; R275-Y278 HydrophobicContact CG-CE1 4.15Å; R275-Y278 WeakPolarHBondContact CG-OH 3.14Å; R275-Y278 WeakPolarHBondContact O-CD1 3.47Å; R275-Y278 VanDerWaalsContact O-CE1 3.29Å; R275-Y278 WeakPolarHBondContact O-CE1 3.33Å; R275-Y278 PolarHBondContact O-N 3.47Å; R275-C279 PolarHBondContact O-N 2.92Å
276	G	80.3	Confident	85.2	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-16.9	173.5	0	0	0	0	0	114.9	T271 F274 F280 L281	T271-G276 WeakPolarHBondContact O-CA 3.42Å; T271-G276 PolarHBondContact O-N 3.49Å; F274-G276 PolarHBondContact O-N 3.48Å; G276-F280 WeakPolarHBondContact O-CA 3.34Å; G276-F280 VanDerWaalsContact O-CB 3.31Å; G276-F280 WeakPolarHBondContact O-CB 3.35Å; G276-F280 PolarHBondContact O-N 3.47Å; G276-L281 PolarHBondContact O-N 2.9Å
277	T	83.6	Confident	85.4	Confident	48 Å²	48	52.3 Å²	52.3	29%	0.294	26%	0.258	S	S	.	.	I	π-helix	trans	-59.8	-51	177	-47.9	0	0	0	0	111.5	F274 R275 L281 I282	F274-T277 WeakPolarHBondContact O-CB 3.37Å; F274-T277 PolarHBondContact O-N 2.97Å; F274-T277 VanDerWaalsContact O-N 3.11Å; F274-T277 PolarHBondContact O-OG1 2.96Å; R275-T277 PolarHBondContact O-N 2.65Å; R275-T277 VanDerWaalsContact O-N 3.15Å; T277-L281 HydrophobicContact CG2-CD2 4.22Å; T277-L281 WeakPolarHBondContact O-CB 3.37Å; T277-L281 PolarHBondContact O-N 3.38Å; T277-I282 WeakPolarHBondContact O-CG1 3.33Å; T277-I282 PolarHBondContact O-N 3.34Å
278	Y	79.4	Confident	85.6	Confident	82 Å²	82	51 Å²	51	32%	0.322	25%	0.247	S	C	.	.	I	π-helix	trans	-85.9	-28.3	-179.5	59.4	-94	0	0	0	113.1	R275 P283	R275-Y278 VanDerWaalsContact CA-CE1 3.49Å; R275-Y278 HydrophobicContact CB-CE1 3.88Å; R275-Y278 WeakPolarHBondContact CB-OH 3.25Å; R275-Y278 HydrophobicContact CG-CE1 4.15Å; R275-Y278 WeakPolarHBondContact CG-OH 3.14Å; R275-Y278 WeakPolarHBondContact O-CD1 3.47Å; R275-Y278 VanDerWaalsContact O-CE1 3.29Å; R275-Y278 WeakPolarHBondContact O-CE1 3.33Å; R275-Y278 PolarHBondContact O-N 3.47Å; Y278-P283 WeakPolarHBondContact O-CD 3.32Å
279	C	77.9	Confident	85.8	Confident	55 Å²	55	51.2 Å²	51.2	37%	0.372	25%	0.248	S	C	.	.	I	π-helix	trans	-79.5	-31.7	178.9	-67.9	0	0	0	0	114.5	R275	R275-C279 PolarHBondContact O-N 2.92Å
280	F	84.6	Confident	86.2	Confident	16 Å²	16	50.7 Å²	50.7	7%	0.07	24%	0.244	C	C	.	.	I	π-helix	trans	-123.5	-51.3	-171.2	-57.9	-63.4	0	0	0	112.5	A200 A201 M268 T271 G276 Y284	A200-F280 HydrophobicContact CB-CE1 4.1Å; A201-F280 HydrophobicContact CB-CD1 3.5Å; A201-F280 VanDerWaalsContact CB-CD1 3.5Å; A201-F280 HydrophobicContact CB-CE1 3.98Å; M268-F280 HydrophobicContact CB-CB 4.35Å; T271-F280 HydrophobicContact CG2-CD2 4.43Å; T271-F280 HydrophobicContact CG2-CE2 4.05Å; G276-F280 WeakPolarHBondContact O-CA 3.34Å; G276-F280 VanDerWaalsContact O-CB 3.31Å; G276-F280 WeakPolarHBondContact O-CB 3.35Å; G276-F280 PolarHBondContact O-N 3.47Å; F280-Y284 WeakPolarHBondContact O-CB 3.48Å; F280-Y284 PolarHBondContact O-N 3.21Å
281	L	88.9	Confident	86.3	Confident	27 Å²	27	43.3 Å²	43.3	14%	0.141	22%	0.218	C	C	.	.	I	π-helix	trans	-69.6	-53	-173.7	-177.9	68	0	0	0	112.2	F265 M268 A269 G276 T277 Y284 L285	F265-L281 HydrophobicContact CB-CD1 3.83Å; F265-L281 HydrophobicContact CD1-CD1 4.2Å; F265-L281 HydrophobicContact CG-CD1 3.97Å; M268-L281 HydrophobicContact CE-CD1 4.27Å; A269-L281 HydrophobicContact CB-CD2 4.31Å; G276-L281 PolarHBondContact O-N 2.9Å; T277-L281 HydrophobicContact CG2-CD2 4.22Å; T277-L281 WeakPolarHBondContact O-CB 3.37Å; T277-L281 PolarHBondContact O-N 3.38Å; L281-Y284 CarbonylContact O-C 3.58Å; L281-Y284 WeakPolarHBondContact O-CB 3.21Å; L281-Y284 PolarHBondContact O-N 2.97Å; L281-Y284 VanDerWaalsContact O-N 3.1Å; L281-L285 HydrophobicContact CD1-CG 4.43Å; L281-L285 HydrophobicContact CG-CD1 4.29Å; L281-L285 HydrophobicContact CG-CG 4.31Å; L281-L285 WeakPolarHBondContact O-CG 3.28Å; L281-L285 PolarHBondContact O-N 2.92Å
282	I	88.9	Confident	86.8	Confident	43 Å²	43	42.4 Å²	42.4	22%	0.221	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-46.4	-177.8	-68.9	175.7	0	0	0	112.4	L152 Y155 T277 Y284 L285 V286	L152-I282 HydrophobicContact CD1-CD1 3.85Å; Y155-I282 HydrophobicContact CD1-CG2 3.61Å; Y155-I282 HydrophobicContact CD2-CG2 4.39Å; Y155-I282 HydrophobicContact CE1-CG2 4.34Å; Y155-I282 HydrophobicContact CG-CG2 3.63Å; T277-I282 WeakPolarHBondContact O-CG1 3.33Å; T277-I282 PolarHBondContact O-N 3.34Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 2.77Å; I282-L285 WeakPolarHBondContact O-CB 3.27Å; I282-L285 PolarHBondContact O-N 3.43Å; I282-V286 PolarHBondContact O-N 3.14Å
283	P	88.3	Confident	87.5	Confident	16 Å²	16	33.8 Å²	33.8	10%	0.104	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-37.5	174	-26.7	36.8	0	0	0	113.7	Y155 L197 Y278 V286	Y155-P283 HydrophobicContact CE1-CB 4.31Å; Y155-P283 HydrophobicContact CE1-CG 4.25Å; L197-P283 HydrophobicContact CD2-CB 3.56Å; Y278-P283 WeakPolarHBondContact O-CD 3.32Å; P283-V286 WeakPolarHBondContact O-CB 3.25Å; P283-V286 PolarHBondContact O-N 3.44Å
284	Y	90	Very high	88.2	Confident	1 Å²	1	31.1 Å²	31.1	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-38	174.8	169.8	-90.2	0	0	0	111.9	A205 A208 I209 E212 F265 M268 F280 L281 I282 V286 C287 F288	A205-Y284 HydrophobicContact CB-CD2 3.8Å; A208-Y284 HydrophobicContact CB-CD2 4.26Å; A208-Y284 HydrophobicContact CB-CE1 4.35Å; A208-Y284 HydrophobicContact CB-CE2 3.45Å; A208-Y284 VanDerWaalsContact CB-CE2 3.45Å; A208-Y284 WeakPolarHBondContact CB-OH 3.42Å; I209-Y284 HydrophobicContact CG1-CE2 3.8Å; E212-Y284 PolarHBondContact OE2-OH 2.75Å; F265-Y284 HydrophobicContact CD1-CD1 4.3Å; F265-Y284 AromaticContact CD1-CE1 3.91Å; F265-Y284 HydrophobicContact CD1-CE1 3.91Å; F265-Y284 AromaticContact CE1-CD1 3.87Å; F265-Y284 HydrophobicContact CE1-CD1 3.87Å; F265-Y284 AromaticContact CE1-CE1 3.08Å; F265-Y284 HydrophobicContact CE1-CE1 3.08Å; F265-Y284 AromaticContact CE1-CZ 3.81Å; F265-Y284 AromaticContact CZ-CE1 3.64Å; F265-Y284 HydrophobicContact CZ-CE1 3.64Å; M268-Y284 HydrophobicContact CE-CD1 3.84Å; M268-Y284 HydrophobicContact CE-CE1 4.31Å; M268-Y284 HydrophobicContact CE-CG 4.02Å; M268-Y284 HydrophobicContact SD-CG 4.41Å; F280-Y284 WeakPolarHBondContact O-CB 3.48Å; F280-Y284 PolarHBondContact O-N 3.21Å; L281-Y284 CarbonylContact O-C 3.58Å; L281-Y284 WeakPolarHBondContact O-CB 3.21Å; L281-Y284 PolarHBondContact O-N 2.97Å; L281-Y284 VanDerWaalsContact O-N 3.1Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 2.77Å; Y284-V286 PolarHBondContact O-N 3.07Å; Y284-V286 VanDerWaalsContact O-N 3.17Å; Y284-C287 WeakPolarHBondContact O-CA 3.26Å; Y284-C287 VanDerWaalsContact O-CB 3.3Å; Y284-C287 WeakPolarHBondContact O-CB 3.48Å; Y284-C287 PolarHBondContact O-N 3.47Å; Y284-F288 HydrophobicContact CE1-CB 3.86Å; Y284-F288 HydrophobicContact CE1-CG 4.48Å; Y284-F288 PolarHBondContact O-N 3.26Å
285	L	91.4	Very high	88.6	Confident	45 Å²	45	25.9 Å²	25.9	24%	0.236	13%	0.129	C	C	.	.	H	α-helix	trans	-57.3	-32.4	177.2	-72	175.3	0	0	0	112	L281 I282 C287 F288 M289	L281-L285 HydrophobicContact CD1-CG 4.43Å; L281-L285 HydrophobicContact CG-CD1 4.29Å; L281-L285 HydrophobicContact CG-CG 4.31Å; L281-L285 WeakPolarHBondContact O-CG 3.28Å; L281-L285 PolarHBondContact O-N 2.92Å; I282-L285 WeakPolarHBondContact O-CB 3.27Å; I282-L285 PolarHBondContact O-N 3.43Å; L285-C287 VanDerWaalsContact C-N 3.33Å; L285-C287 PolarHBondContact O-N 3.3Å; L285-F288 HydrophobicContact CD2-CD1 4.5Å; L285-F288 PolarHBondContact O-N 2.95Å; L285-M289 VanDerWaalsContact O-CG 3.25Å; L285-M289 WeakPolarHBondContact O-CG 3.31Å; L285-M289 PolarHBondContact O-N 3.49Å
286	V	93	Very high	89.2	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.024	11%	0.11	C	C	.	.	H	α-helix	trans	-60.9	-44.5	173.8	-179.7	0	0	0	0	111.1	T111 I114 Y155 F158 I282 P283 Y284 W290	T111-V286 HydrophobicContact CG2-CG1 3.99Å; I114-V286 HydrophobicContact CD1-CG2 4.11Å; Y155-V286 HydrophobicContact CD1-CG2 3.71Å; Y155-V286 HydrophobicContact CE1-CG2 3.97Å; F158-V286 HydrophobicContact CD1-CB 4.47Å; F158-V286 HydrophobicContact CD1-CG1 4.4Å; F158-V286 HydrophobicContact CD1-CG2 3.92Å; F158-V286 HydrophobicContact CD2-CG1 4.39Å; F158-V286 HydrophobicContact CE1-CB 4.09Å; F158-V286 HydrophobicContact CE1-CG1 3.98Å; F158-V286 HydrophobicContact CE1-CG2 4.03Å; F158-V286 HydrophobicContact CE2-CG1 3.96Å; F158-V286 HydrophobicContact CG-CG2 4.43Å; F158-V286 HydrophobicContact CZ-CB 4.32Å; F158-V286 HydrophobicContact CZ-CG1 3.74Å; I282-V286 PolarHBondContact O-N 3.14Å; P283-V286 WeakPolarHBondContact O-CB 3.25Å; P283-V286 PolarHBondContact O-N 3.44Å; Y284-V286 PolarHBondContact O-N 3.07Å; Y284-V286 VanDerWaalsContact O-N 3.17Å; V286-W290 PolarHBondContact O-N 3.44Å
287	C	92.4	Very high	89.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.007	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-45.4	176.6	-54.5	0	0	0	0	110.6	S193 I209 Y284 L285 W290 C291	S193-C287 PolarHBondContact OG-SG 2.9Å; S193-C287 VanDerWaalsContact OG-SG 3.4Å; I209-C287 HydrophobicContact CD1-CB 4.39Å; Y284-C287 WeakPolarHBondContact O-CA 3.26Å; Y284-C287 VanDerWaalsContact O-CB 3.3Å; Y284-C287 WeakPolarHBondContact O-CB 3.48Å; Y284-C287 PolarHBondContact O-N 3.47Å; L285-C287 VanDerWaalsContact C-N 3.33Å; L285-C287 PolarHBondContact O-N 3.3Å; C287-W290 PolarHBondContact O-N 2.87Å; C287-C291 WeakPolarHBondContact O-CB 3.47Å; C287-C291 PolarHBondContact O-N 2.7Å
288	F	92.8	Very high	90	Very high	13 Å²	13	20.1 Å²	20.1	6%	0.057	11%	0.106	C	C	.	.	H	α-helix	trans	-57.7	-50.9	178.6	173.2	-96.5	0	0	0	111.7	E212 L261 F265 Y284 L285 W290 C291 E292	E212-F288 HydrophobicContact CG-CD2 4.33Å; E212-F288 VanDerWaalsContact OE1-CA 3.27Å; E212-F288 WeakPolarHBondContact OE1-CA 3.2Å; E212-F288 WeakPolarHBondContact OE1-CD2 3.35Å; L261-F288 HydrophobicContact CD2-CD2 4.26Å; L261-F288 HydrophobicContact CD2-CE2 3.85Å; F265-F288 HydrophobicContact CZ-CD2 4.02Å; F265-F288 HydrophobicContact CZ-CE2 4.22Å; F265-F288 HydrophobicContact CZ-CG 4.42Å; Y284-F288 HydrophobicContact CE1-CB 3.86Å; Y284-F288 HydrophobicContact CE1-CG 4.48Å; Y284-F288 PolarHBondContact O-N 3.26Å; L285-F288 HydrophobicContact CD2-CD1 4.5Å; L285-F288 PolarHBondContact O-N 2.95Å; F288-W290 VanDerWaalsContact C-N 3.32Å; F288-W290 PolarHBondContact O-N 2.84Å; F288-C291 PolarHBondContact O-N 3.07Å; F288-E292 HydrophobicContact CD1-CG 4.45Å; F288-E292 HydrophobicContact CD2-CG 4.16Å; F288-E292 HydrophobicContact CE1-CG 4.03Å; F288-E292 HydrophobicContact CE2-CG 3.7Å; F288-E292 HydrophobicContact CG-CG 4.49Å; F288-E292 HydrophobicContact CZ-CG 3.63Å; F288-E292 WeakPolarHBondContact O-CB 3.16Å; F288-E292 PolarHBondContact O-N 3.48Å
289	M	94.2	Very high	90.3	Very high	11 Å²	11	19.8 Å²	19.8	5%	0.054	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-37.5	-179.2	-62	-44.8	-77.7	0	0	112.5	F158 V162 I166 L285 F293 F651 F652	F158-M289 HydrophobicContact CE1-CB 3.94Å; F158-M289 HydrophobicContact CE1-CG 4.07Å; F158-M289 HydrophobicContact CZ-CB 4.06Å; V162-M289 HydrophobicContact CB-CE 4.42Å; V162-M289 HydrophobicContact CG1-CB 4.35Å; V162-M289 HydrophobicContact CG1-CE 3.21Å; V162-M289 HydrophobicContact CG1-CG 4.28Å; V162-M289 HydrophobicContact CG2-CB 4.25Å; V162-M289 HydrophobicContact CG2-CG 4.45Å; I166-M289 HydrophobicContact CD1-CE 3.87Å; L285-M289 VanDerWaalsContact O-CG 3.25Å; L285-M289 WeakPolarHBondContact O-CG 3.31Å; L285-M289 PolarHBondContact O-N 3.49Å; M289-F293 WeakPolarHBondContact O-CB 3.44Å; M289-F293 PolarHBondContact O-N 3.01Å; M289-F651 HydrophobicContact CE-CD1 4.31Å; M289-F651 HydrophobicContact CE-CE1 3.43Å; M289-F651 VanDerWaalsContact CE-CE1 3.43Å; M289-F651 HydrophobicContact CE-CZ 4.17Å; M289-F651 HydrophobicContact SD-CE1 4.4Å; M289-F652 HydrophobicContact CE-CD1 4.37Å; M289-F652 HydrophobicContact CE-CE1 3.42Å; M289-F652 VanDerWaalsContact CE-CE1 3.42Å; M289-F652 HydrophobicContact CE-CZ 3.81Å; M289-F652 HydrophobicContact SD-CE1 4.18Å
290	W	95.1	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-69	-39.4	175.9	-83.1	113.2	0	0	0	112.9	F104 M107 I108 T111 F158 A186 F189 T190 V286 C287 F288 S294	F104-W290 HydrophobicContact CE2-CH2 4.03Å; F104-W290 AromaticContact CE2-CZ3 3.75Å; F104-W290 HydrophobicContact CE2-CZ3 3.75Å; F104-W290 HydrophobicContact CZ-CH2 4.3Å; F104-W290 HydrophobicContact CZ-CZ3 4.15Å; M107-W290 HydrophobicContact CB-CZ2 4.22Å; M107-W290 HydrophobicContact CE-CD2 3.95Å; M107-W290 HydrophobicContact CE-CE3 3.57Å; M107-W290 HydrophobicContact CE-CH2 3.17Å; M107-W290 HydrophobicContact CE-CZ2 3.54Å; M107-W290 HydrophobicContact CE-CZ3 3.19Å; M107-W290 HydrophobicContact CG-CH2 4.17Å; M107-W290 HydrophobicContact CG-CZ2 3.64Å; M107-W290 HydrophobicContact SD-CH2 4.46Å; M107-W290 HydrophobicContact SD-CZ2 4.33Å; I108-W290 HydrophobicContact CG1-CH2 3.84Å; I108-W290 HydrophobicContact CG1-CZ2 4.29Å; T111-W290 HydrophobicContact CG2-CZ2 4Å; F158-W290 AromaticContact CE2-CD1 3.98Å; F158-W290 AromaticContact CE2-NE1 3.36Å; F158-W290 AromaticContact CZ-CD1 3.84Å; F158-W290 AromaticContact CZ-NE1 3.71Å; A186-W290 VanDerWaalsContact CA-CE3 3.49Å; A186-W290 HydrophobicContact CB-CE3 3.67Å; A186-W290 HydrophobicContact CB-CZ3 3.91Å; F189-W290 HydrophobicContact CB-CD2 3.63Å; F189-W290 HydrophobicContact CB-CE3 3.94Å; F189-W290 HydrophobicContact CB-CG 4.08Å; F189-W290 HydrophobicContact CB-CH2 4.08Å; F189-W290 HydrophobicContact CB-CZ2 3.8Å; F189-W290 HydrophobicContact CB-CZ3 4.14Å; F189-W290 HydrophobicContact CD1-CZ2 4.5Å; F189-W290 AromaticContact CD2-CH2 3.86Å; F189-W290 HydrophobicContact CD2-CH2 3.86Å; F189-W290 HydrophobicContact CD2-CZ2 4.12Å; F189-W290 HydrophobicContact CD2-CZ3 4.26Å; F189-W290 HydrophobicContact CG-CH2 4.08Å; F189-W290 AromaticContact CG-CZ2 3.89Å; F189-W290 HydrophobicContact CG-CZ2 3.89Å; T190-W290 WeakPolarHBondContact OG1-CB 3.41Å; V286-W290 PolarHBondContact O-N 3.44Å; C287-W290 PolarHBondContact O-N 2.87Å; F288-W290 VanDerWaalsContact C-N 3.32Å; F288-W290 PolarHBondContact O-N 2.84Å; W290-S294 WeakPolarHBondContact O-CB 3.02Å; W290-S294 PolarHBondContact O-N 2.88Å
291	C	93.2	Very high	90.9	Very high	11 Å²	11	20.7 Å²	20.7	7%	0.074	11%	0.112	C	C	.	.	H	α-helix	trans	-67.6	-50.4	179	-170	0	0	0	0	110.6	T190 E212 C287 F288 F293 S294 V295	T190-C291 HydrophobicContact CG2-CB 3.8Å; T190-C291 PolarHBondContact OG1-N 2.82Å; E212-C291 VanDerWaalsContact OE1-CB 3.23Å; E212-C291 WeakPolarHBondContact OE1-CB 3.28Å; C287-C291 WeakPolarHBondContact O-CB 3.47Å; C287-C291 PolarHBondContact O-N 2.7Å; F288-C291 PolarHBondContact O-N 3.07Å; C291-F293 VanDerWaalsContact C-N 3.35Å; C291-F293 PolarHBondContact O-N 3.26Å; C291-S294 WeakPolarHBondContact O-CB 3.22Å; C291-S294 PolarHBondContact O-N 2.85Å; C291-S294 VanDerWaalsContact O-N 3.1Å; C291-S294 PolarHBondContact O-OG 3.28Å; C291-V295 WeakPolarHBondContact O-CG2 3.37Å; C291-V295 PolarHBondContact O-N 3.45Å; C291-V295 VanDerWaalsContact O-N 3.13Å
292	E	92	Very high	90.7	Very high	13 Å²	13	22.9 Å²	22.9	6%	0.061	13%	0.129	C	C	.	.	H	α-helix	trans	-58.3	-45.6	176.1	-73.6	-55.3	141.6	0	0	112.2	N216 Y258 F288 S294 V295 V296 F651	N216-E292 PolarHBondContact ND2-OE1 2.91Å; N216-E292 PolarHBondContact OD1-OE1 3.34Å; Y258-E292 PolarHBondContact OH-OE1 2.93Å; Y258-E292 PolarHBondContact OH-OE2 3.4Å; F288-E292 HydrophobicContact CD1-CG 4.45Å; F288-E292 HydrophobicContact CD2-CG 4.16Å; F288-E292 HydrophobicContact CE1-CG 4.03Å; F288-E292 HydrophobicContact CE2-CG 3.7Å; F288-E292 HydrophobicContact CG-CG 4.49Å; F288-E292 HydrophobicContact CZ-CG 3.63Å; F288-E292 WeakPolarHBondContact O-CB 3.16Å; F288-E292 PolarHBondContact O-N 3.48Å; E292-S294 VanDerWaalsContact C-N 3.29Å; E292-S294 PolarHBondContact O-N 2.87Å; E292-V295 PolarHBondContact O-N 3.11Å; E292-V296 WeakPolarHBondContact O-CG2 3.17Å; E292-V296 PolarHBondContact O-N 2.92Å; E292-V296 VanDerWaalsContact O-N 3.1Å; E292-F651 HydrophobicContact CB-CE1 4.27Å; E292-F651 HydrophobicContact CB-CE2 4.32Å; E292-F651 HydrophobicContact CB-CZ 3.77Å
293	F	92.9	Very high	90.3	Very high	6 Å²	6	24.5 Å²	24.5	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-34.2	177.1	-171.3	-116.9	0	0	0	112.6	F100 F104 M107 V165 M289 C291 V295 V296 L297 F651	F100-F293 AromaticContact CE2-CZ 3.85Å; F100-F293 HydrophobicContact CE2-CZ 3.85Å; F100-F293 HydrophobicContact CZ-CZ 4.17Å; F104-F293 AromaticContact CD2-CE1 3.86Å; F104-F293 HydrophobicContact CD2-CE1 3.86Å; F104-F293 HydrophobicContact CE2-CD1 4.44Å; F104-F293 AromaticContact CE2-CE1 3.81Å; F104-F293 HydrophobicContact CE2-CE1 3.81Å; M107-F293 HydrophobicContact CE-CD1 3.99Å; M107-F293 HydrophobicContact CE-CE1 4.3Å; V165-F293 HydrophobicContact CG1-CD2 4.06Å; V165-F293 HydrophobicContact CG1-CE1 3.98Å; V165-F293 HydrophobicContact CG1-CE2 3.37Å; V165-F293 HydrophobicContact CG1-CZ 3.34Å; M289-F293 WeakPolarHBondContact O-CB 3.44Å; M289-F293 PolarHBondContact O-N 3.01Å; C291-F293 VanDerWaalsContact C-N 3.35Å; C291-F293 PolarHBondContact O-N 3.26Å; F293-V295 VanDerWaalsContact C-N 3.33Å; F293-V295 PolarHBondContact O-N 3.01Å; F293-V296 PolarHBondContact O-N 3.46Å; F293-L297 HydrophobicContact CD1-CD1 3.89Å; F293-L297 HydrophobicContact CD1-CG 4.43Å; F293-L297 HydrophobicContact CE1-CD1 3.5Å; F293-L297 HydrophobicContact CE1-CD2 4.44Å; F293-L297 HydrophobicContact CE1-CG 4.07Å; F293-L297 HydrophobicContact CE2-CD2 4.5Å; F293-L297 HydrophobicContact CE2-CG 4.39Å; F293-L297 HydrophobicContact CZ-CD1 3.93Å; F293-L297 HydrophobicContact CZ-CD2 4.03Å; F293-L297 HydrophobicContact CZ-CG 4.02Å; F293-L297 WeakPolarHBondContact O-CG 3.47Å; F293-L297 PolarHBondContact O-N 3.29Å; F293-F651 HydrophobicContact CB-CE2 4.33Å; F293-F651 HydrophobicContact CB-CZ 4.33Å; F293-F651 HydrophobicContact CD2-CE2 4.27Å
294	S	92.8	Very high	90.1	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-39.6	174.6	79.7	0	0	0	0	112.2	W290 C291 E292 L297 L298	W290-S294 WeakPolarHBondContact O-CB 3.02Å; W290-S294 PolarHBondContact O-N 2.88Å; C291-S294 WeakPolarHBondContact O-CB 3.22Å; C291-S294 PolarHBondContact O-N 2.85Å; C291-S294 VanDerWaalsContact O-N 3.1Å; C291-S294 PolarHBondContact O-OG 3.28Å; E292-S294 VanDerWaalsContact C-N 3.29Å; E292-S294 PolarHBondContact O-N 2.87Å; S294-L297 PolarHBondContact O-N 3.34Å; S294-L298 WeakPolarHBondContact O-CG 3.31Å; S294-L298 PolarHBondContact O-N 3.01Å
295	V	90.4	Very high	89.7	Confident	16 Å²	16	29.4 Å²	29.4	10%	0.097	18%	0.179	C	C	.	.	H	α-helix	trans	-67.7	-42.8	179.3	175.8	0	0	0	0	110.7	N216 C291 E292 F293 L297 L298 Q299	N216-V295 HydrophobicContact CB-CG1 4.39Å; N216-V295 HydrophobicContact CB-CG2 3.73Å; C291-V295 WeakPolarHBondContact O-CG2 3.37Å; C291-V295 PolarHBondContact O-N 3.45Å; C291-V295 VanDerWaalsContact O-N 3.13Å; E292-V295 PolarHBondContact O-N 3.11Å; F293-V295 VanDerWaalsContact C-N 3.33Å; F293-V295 PolarHBondContact O-N 3.01Å; V295-L297 VanDerWaalsContact C-N 3.29Å; V295-L297 PolarHBondContact O-N 3.49Å; V295-L298 WeakPolarHBondContact O-CB 3.41Å; V295-L298 PolarHBondContact O-N 3.02Å; V295-L298 VanDerWaalsContact O-N 3.16Å; V295-Q299 WeakPolarHBondContact O-CG 3.38Å; V295-Q299 PolarHBondContact O-N 3.46Å
296	V	90.8	Very high	89.4	Confident	16 Å²	16	30 Å²	30	10%	0.097	18%	0.182	C	C	.	.	H	α-helix	trans	-58.2	-41.6	173.9	167.1	0	0	0	0	111.7	F169 E292 F293 N300 F647 F651	F169-V296 HydrophobicContact CD1-CG1 4.15Å; F169-V296 HydrophobicContact CE1-CG1 3.63Å; F169-V296 HydrophobicContact CZ-CG1 4.13Å; E292-V296 WeakPolarHBondContact O-CG2 3.17Å; E292-V296 PolarHBondContact O-N 2.92Å; E292-V296 VanDerWaalsContact O-N 3.1Å; F293-V296 PolarHBondContact O-N 3.46Å; V296-N300 PolarHBondContact O-N 3.3Å; V296-N300 PolarHBondContact O-ND2 3.27Å; V296-F647 HydrophobicContact CG1-CE2 4.18Å; V296-F647 HydrophobicContact CG1-CZ 3.7Å; V296-F651 HydrophobicContact CG2-CD2 3.91Å; V296-F651 HydrophobicContact CG2-CE2 3.96Å
297	L	91.1	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.8	-39	176	-69.5	174.6	0	0	0	111.9	F169 C179 L182 A186 F293 S294 V295 N300 S301	F169-L297 HydrophobicContact CD2-CD2 4.48Å; F169-L297 HydrophobicContact CE2-CD2 3.74Å; F169-L297 HydrophobicContact CZ-CD2 4.23Å; C179-L297 HydrophobicContact CB-CD2 4.39Å; L182-L297 HydrophobicContact CB-CD1 3.76Å; A186-L297 HydrophobicContact CB-CD1 4.46Å; F293-L297 HydrophobicContact CD1-CD1 3.89Å; F293-L297 HydrophobicContact CD1-CG 4.43Å; F293-L297 HydrophobicContact CE1-CD1 3.5Å; F293-L297 HydrophobicContact CE1-CD2 4.44Å; F293-L297 HydrophobicContact CE1-CG 4.07Å; F293-L297 HydrophobicContact CE2-CD2 4.5Å; F293-L297 HydrophobicContact CE2-CG 4.39Å; F293-L297 HydrophobicContact CZ-CD1 3.93Å; F293-L297 HydrophobicContact CZ-CD2 4.03Å; F293-L297 HydrophobicContact CZ-CG 4.02Å; F293-L297 WeakPolarHBondContact O-CG 3.47Å; F293-L297 PolarHBondContact O-N 3.29Å; S294-L297 PolarHBondContact O-N 3.34Å; V295-L297 VanDerWaalsContact C-N 3.29Å; V295-L297 PolarHBondContact O-N 3.49Å; L297-N300 PolarHBondContact O-N 3.34Å; L297-S301 WeakPolarHBondContact O-CB 3.49Å; L297-S301 PolarHBondContact O-N 2.73Å; L297-S301 VanDerWaalsContact O-N 3.11Å
298	L	89.1	Confident	88.6	Confident	41 Å²	41	42.8 Å²	42.8	22%	0.215	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-45.4	175.3	-76.1	170.3	0	0	0	111.9	S183 S294 V295 N300 S301 L306	S183-L298 VanDerWaalsContact OG-CD2 3.23Å; S183-L298 WeakPolarHBondContact OG-CD2 3.49Å; S183-L298 VanDerWaalsContact OG-CG 3.22Å; S183-L298 WeakPolarHBondContact OG-CG 3.26Å; S294-L298 WeakPolarHBondContact O-CG 3.31Å; S294-L298 PolarHBondContact O-N 3.01Å; V295-L298 WeakPolarHBondContact O-CB 3.41Å; V295-L298 PolarHBondContact O-N 3.02Å; V295-L298 VanDerWaalsContact O-N 3.16Å; L298-N300 PolarHBondContact O-N 3.38Å; L298-S301 WeakPolarHBondContact O-CB 3.32Å; L298-S301 PolarHBondContact O-N 3.34Å; L298-S301 PolarHBondContact O-OG 2.63Å; L298-L306 HydrophobicContact CD2-CD1 3.65Å
299	Q	87.5	Confident	88.3	Confident	75 Å²	75	42.2 Å²	42.2	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-28	179	-73	177.3	-4.8	0	0	113.1	L220 L223 V295	L220-Q299 HydrophobicContact CD1-CG 4.4Å; L223-Q299 HydrophobicContact CD1-CG 4.14Å; V295-Q299 WeakPolarHBondContact O-CG 3.38Å; V295-Q299 PolarHBondContact O-N 3.46Å
300	N	87.1	Confident	87.8	Confident	58 Å²	58	45 Å²	45	31%	0.31	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	1.4	177.6	-67.5	-77.3	0	0	0	113.2	F169 K174 V296 L297 L298	F169-N300 HydrophobicContact CZ-CB 4.41Å; K174-N300 PolarHBondContact NZ-OD1 3.01Å; V296-N300 PolarHBondContact O-N 3.3Å; V296-N300 PolarHBondContact O-ND2 3.27Å; L297-N300 PolarHBondContact O-N 3.34Å; L298-N300 PolarHBondContact O-N 3.38Å
301	S	86.7	Confident	87.3	Confident	32 Å²	32	48.7 Å²	48.7	22%	0.224	28%	0.277	C	S	.	.	S	Bend	trans	-88	153.5	-178.7	76.1	0	0	0	0	112.1	L297 L298	L297-S301 WeakPolarHBondContact O-CB 3.49Å; L297-S301 PolarHBondContact O-N 2.73Å; L297-S301 VanDerWaalsContact O-N 3.11Å; L298-S301 WeakPolarHBondContact O-CB 3.32Å; L298-S301 PolarHBondContact O-N 3.34Å; L298-S301 PolarHBondContact O-OG 2.63Å
302	S	84.9	Confident	86.8	Confident	73 Å²	73	50.4 Å²	50.4	51%	0.51	29%	0.292	S	S	.	.			trans	-90.5	141.6	169.6	64.1	0	0	0	0	110.4	V304 G305 L306	S302-V304 PolarHBondContact O-N 3.37Å; S302-G305 WeakPolarHBondContact O-CA 3.18Å; S302-G305 PolarHBondContact O-N 3.31Å; S302-G305 PolarHBondContact OG-N 2.97Å; S302-G305 VanDerWaalsContact OG-N 3.15Å; S302-L306 PolarHBondContact O-N 3.29Å
303	A	81.4	Confident	86.4	Confident	76 Å²	76	54.3 Å²	54.3	63%	0.628	31%	0.306	S	S	*	.	H	α-helix	trans	-58	-37.7	176.8	0	0	0	0	0	112.1	G305 L306 I307	A303-G305 VanDerWaalsContact C-N 3.32Å; A303-G305 PolarHBondContact O-N 3.24Å; A303-L306 PolarHBondContact O-N 3.3Å; A303-I307 WeakPolarHBondContact O-CG1 3.11Å; A303-I307 PolarHBondContact O-N 3.26Å
304	V	83.4	Confident	85.8	Confident	117 Å²	117	60.1 Å²	60.1	71%	0.709	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-41.3	173.6	-179.7	0	0	0	0	111.2	S302 I307 R308	S302-V304 PolarHBondContact O-N 3.37Å; V304-I307 PolarHBondContact O-N 3.24Å; V304-R308 WeakPolarHBondContact O-CB 3.22Å; V304-R308 PolarHBondContact O-N 3.21Å
305	G	82.2	Confident	85.3	Confident	3 Å²	3	64.7 Å²	64.7	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-48.3	174.3	0	0	0	0	0	111.4	S302 A303 I307 R308 T309	S302-G305 WeakPolarHBondContact O-CA 3.18Å; S302-G305 PolarHBondContact O-N 3.31Å; S302-G305 PolarHBondContact OG-N 2.97Å; S302-G305 VanDerWaalsContact OG-N 3.15Å; A303-G305 VanDerWaalsContact C-N 3.32Å; A303-G305 PolarHBondContact O-N 3.24Å; G305-I307 PolarHBondContact O-N 3.07Å; G305-R308 WeakPolarHBondContact O-CB 3.24Å; G305-R308 PolarHBondContact O-N 3.19Å; G305-T309 WeakPolarHBondContact O-CG2 3.36Å; G305-T309 PolarHBondContact O-N 3.06Å
306	L	83.8	Confident	84.8	Confident	59 Å²	59	69.7 Å²	69.7	31%	0.309	38%	0.376	S	S	.	.	H	α-helix	trans	-61.8	-42.9	179.7	-157.4	93	0	0	0	113	L298 S302 A303 R308 T309 C310	L298-L306 HydrophobicContact CD2-CD1 3.65Å; S302-L306 PolarHBondContact O-N 3.29Å; A303-L306 PolarHBondContact O-N 3.3Å; L306-R308 VanDerWaalsContact C-N 3.32Å; L306-R308 PolarHBondContact O-N 2.87Å; L306-T309 PolarHBondContact O-N 3.4Å; L306-T309 PolarHBondContact O-OG1 3.43Å; L306-C310 WeakPolarHBondContact O-CB 3.45Å; L306-C310 PolarHBondContact O-N 3.42Å; L306-C310 PolarHBondContact O-SG 3.26Å; L306-C310 VanDerWaalsContact O-SG 3.34Å
307	I	85.3	Confident	84.2	Confident	115 Å²	115	74.8 Å²	74.8	59%	0.59	40%	0.402	S	S	*	.	H	α-helix	trans	-63.3	-44	176.4	-67	165.9	0	0	0	109.8	A303 V304 G305 T309 C310 V311	A303-I307 WeakPolarHBondContact O-CG1 3.11Å; A303-I307 PolarHBondContact O-N 3.26Å; V304-I307 PolarHBondContact O-N 3.24Å; G305-I307 PolarHBondContact O-N 3.07Å; I307-T309 PolarHBondContact O-N 3.48Å; I307-C310 PolarHBondContact O-N 2.83Å; I307-V311 HydrophobicContact CG2-CG2 4.44Å; I307-V311 WeakPolarHBondContact O-CB 3.43Å; I307-V311 VanDerWaalsContact O-CG2 3.27Å; I307-V311 WeakPolarHBondContact O-CG2 3.4Å; I307-V311 PolarHBondContact O-N 3.03Å
308	R	85.2	Confident	83.6	Confident	158 Å²	158	81.1 Å²	81.1	60%	0.596	43%	0.43	S	S	*	.	H	α-helix	trans	-61.1	-43.1	177.1	-177.7	-174.7	63.9	176.2	-1.6	111.8	V304 G305 L306 V311 A312	V304-R308 WeakPolarHBondContact O-CB 3.22Å; V304-R308 PolarHBondContact O-N 3.21Å; G305-R308 WeakPolarHBondContact O-CB 3.24Å; G305-R308 PolarHBondContact O-N 3.19Å; L306-R308 VanDerWaalsContact C-N 3.32Å; L306-R308 PolarHBondContact O-N 2.87Å; R308-V311 PolarHBondContact O-N 3.26Å; R308-A312 WeakPolarHBondContact O-CB 3.44Å; R308-A312 PolarHBondContact O-N 3.49Å
309	T	85.1	Confident	83	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-64.1	-48.3	179.4	73.4	0	0	0	0	110.4	S180 E181 G305 L306 I307 V311 A312 Y313	S180-T309 WeakPolarHBondContact OG-CG2 3.34Å; E181-T309 HydrophobicContact CG-CG2 4Å; E181-T309 WeakPolarHBondContact OE1-CG2 3.5Å; E181-T309 WeakPolarHBondContact OE2-CB 3.49Å; E181-T309 WeakPolarHBondContact OE2-CG2 3.46Å; G305-T309 WeakPolarHBondContact O-CG2 3.36Å; G305-T309 PolarHBondContact O-N 3.06Å; L306-T309 PolarHBondContact O-N 3.4Å; L306-T309 PolarHBondContact O-OG1 3.43Å; I307-T309 PolarHBondContact O-N 3.48Å; T309-V311 VanDerWaalsContact C-N 3.33Å; T309-V311 PolarHBondContact O-N 2.61Å; T309-A312 PolarHBondContact O-N 3.44Å; T309-A312 VanDerWaalsContact O-N 3.13Å; T309-Y313 WeakPolarHBondContact O-CD2 3.47Å; T309-Y313 PolarHBondContact O-N 2.98Å
310	C	83.7	Confident	82.5	Confident	69 Å²	69	81.8 Å²	81.8	47%	0.466	44%	0.443	S	S	.	.	H	α-helix	trans	-58.2	-45.8	179.5	-74.1	0	0	0	0	111.6	L306 I307 F314	L306-C310 WeakPolarHBondContact O-CB 3.45Å; L306-C310 PolarHBondContact O-N 3.42Å; L306-C310 PolarHBondContact O-SG 3.26Å; L306-C310 VanDerWaalsContact O-SG 3.34Å; I307-C310 PolarHBondContact O-N 2.83Å; C310-F314 VanDerWaalsContact O-CB 3.29Å; C310-F314 WeakPolarHBondContact O-CB 3.13Å; C310-F314 PolarHBondContact O-N 3.32Å
311	V	85.5	Confident	82.3	Confident	78 Å²	78	82 Å²	82	47%	0.473	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-44	176.1	173.2	0	0	0	0	110.9	I307 R308 T309 F314 L315	I307-V311 HydrophobicContact CG2-CG2 4.44Å; I307-V311 WeakPolarHBondContact O-CB 3.43Å; I307-V311 VanDerWaalsContact O-CG2 3.27Å; I307-V311 WeakPolarHBondContact O-CG2 3.4Å; I307-V311 PolarHBondContact O-N 3.03Å; R308-V311 PolarHBondContact O-N 3.26Å; T309-V311 VanDerWaalsContact C-N 3.33Å; T309-V311 PolarHBondContact O-N 2.61Å; V311-F314 PolarHBondContact O-N 3.3Å; V311-L315 HydrophobicContact CG1-CD1 3.76Å; V311-L315 HydrophobicContact CG1-CG 4.25Å; V311-L315 WeakPolarHBondContact O-CB 3.36Å; V311-L315 VanDerWaalsContact O-CG 3.28Å; V311-L315 WeakPolarHBondContact O-CG 3.34Å; V311-L315 PolarHBondContact O-N 3.33Å
312	A	82.8	Confident	82.1	Confident	47 Å²	47	83.5 Å²	83.5	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-62.9	-45.3	179.5	0	0	0	0	0	112.3	R308 T309 L315 F316	R308-A312 WeakPolarHBondContact O-CB 3.44Å; R308-A312 PolarHBondContact O-N 3.49Å; T309-A312 PolarHBondContact O-N 3.44Å; T309-A312 VanDerWaalsContact O-N 3.13Å; A312-L315 PolarHBondContact O-N 3.09Å; A312-F316 WeakPolarHBondContact O-CB 3.46Å; A312-F316 PolarHBondContact O-N 3.35Å
313	Y	82.4	Confident	81.9	Confident	95 Å²	95	85.2 Å²	85.2	37%	0.373	46%	0.464	S	S	.	.	H	α-helix	trans	-65.9	-41.4	176.3	-79.1	-67.1	0	0	0	112.2	E181 T184 T309 F316 L317	E181-Y313 WeakPolarHBondContact OE2-CE2 3.41Å; T184-Y313 WeakPolarHBondContact OG1-CE2 3.48Å; T309-Y313 WeakPolarHBondContact O-CD2 3.47Å; T309-Y313 PolarHBondContact O-N 2.98Å; Y313-F316 PolarHBondContact O-N 3.15Å; Y313-L317 WeakPolarHBondContact O-CG 3.49Å; Y313-L317 PolarHBondContact O-N 3.06Å
314	F	81.4	Confident	82.1	Confident	128 Å²	128	85.7 Å²	85.7	56%	0.561	46%	0.459	S	S	*	.	H	α-helix	trans	-60.5	-50.1	175.1	-174.8	-98.3	0	0	0	110.8	C310 V311 F316 L317 F318	C310-F314 VanDerWaalsContact O-CB 3.29Å; C310-F314 WeakPolarHBondContact O-CB 3.13Å; C310-F314 PolarHBondContact O-N 3.32Å; V311-F314 PolarHBondContact O-N 3.3Å; F314-F316 VanDerWaalsContact C-N 3.33Å; F314-F316 PolarHBondContact O-N 3.45Å; F314-L317 PolarHBondContact O-N 3.03Å; F314-F318 HydrophobicContact CD1-CD2 4.16Å; F314-F318 AromaticContact CD1-CE2 3.83Å; F314-F318 HydrophobicContact CD1-CE2 3.83Å; F314-F318 HydrophobicContact CD2-CE2 4.01Å; F314-F318 HydrophobicContact CE1-CD2 4.05Å; F314-F318 AromaticContact CE1-CE2 3.44Å; F314-F318 HydrophobicContact CE1-CE2 3.44Å; F314-F318 VanDerWaalsContact CE1-CE2 3.44Å; F314-F318 HydrophobicContact CE1-CZ 4.34Å; F314-F318 AromaticContact CE2-CE2 3.64Å; F314-F318 HydrophobicContact CE2-CE2 3.64Å; F314-F318 HydrophobicContact CE2-CZ 4.18Å; F314-F318 HydrophobicContact CG-CE2 4.11Å; F314-F318 HydrophobicContact CZ-CD2 4.38Å; F314-F318 AromaticContact CZ-CE2 3.35Å; F314-F318 HydrophobicContact CZ-CE2 3.35Å; F314-F318 AromaticContact CZ-CZ 3.9Å; F314-F318 HydrophobicContact CZ-CZ 3.9Å; F314-F318 WeakPolarHBondContact O-CD2 3.38Å; F314-F318 PolarHBondContact O-N 3.07Å
315	L	81.1	Confident	82.3	Confident	103 Å²	103	87 Å²	87	54%	0.539	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-38.6	175.9	-71	174.5	0	0	0	112.3	V311 A312 L317 F318 A319	V311-L315 HydrophobicContact CG1-CD1 3.76Å; V311-L315 HydrophobicContact CG1-CG 4.25Å; V311-L315 WeakPolarHBondContact O-CB 3.36Å; V311-L315 VanDerWaalsContact O-CG 3.28Å; V311-L315 WeakPolarHBondContact O-CG 3.34Å; V311-L315 PolarHBondContact O-N 3.33Å; A312-L315 PolarHBondContact O-N 3.09Å; L315-L317 VanDerWaalsContact C-N 3.34Å; L315-L317 PolarHBondContact O-N 2.94Å; L315-F318 PolarHBondContact O-N 3.07Å; L315-A319 VanDerWaalsContact O-CB 3.23Å; L315-A319 WeakPolarHBondContact O-CB 3.44Å; L315-A319 PolarHBondContact O-N 3.34Å
316	F	80.3	Confident	82.5	Confident	121 Å²	121	88.6 Å²	88.6	53%	0.531	47%	0.472	S	S	.	.	H	α-helix	trans	-63.2	-38.9	177.8	-177	-99.9	0	0	0	112.2	A312 Y313 F314 F318 A319 L320	A312-F316 WeakPolarHBondContact O-CB 3.46Å; A312-F316 PolarHBondContact O-N 3.35Å; Y313-F316 PolarHBondContact O-N 3.15Å; F314-F316 VanDerWaalsContact C-N 3.33Å; F314-F316 PolarHBondContact O-N 3.45Å; F316-F318 PolarHBondContact O-N 3.43Å; F316-A319 PolarHBondContact O-N 3.29Å; F316-L320 HydrophobicContact CD1-CD1 4.42Å; F316-L320 HydrophobicContact CE1-CD1 3.51Å; F316-L320 HydrophobicContact CE2-CD1 4.29Å; F316-L320 HydrophobicContact CZ-CD1 3.44Å; F316-L320 VanDerWaalsContact CZ-CD1 3.44Å; F316-L320 VanDerWaalsContact O-CB 3.3Å; F316-L320 WeakPolarHBondContact O-CB 3.4Å; F316-L320 PolarHBondContact O-N 3.1Å
317	L	78.3	Confident	82.6	Confident	123 Å²	123	90.3 Å²	90.3	64%	0.644	48%	0.481	S	S	*	.	H	α-helix	trans	-60.5	-32.8	174.9	-75.4	168.4	0	0	0	112.7	Y313 F314 L315 P321	Y313-L317 WeakPolarHBondContact O-CG 3.49Å; Y313-L317 PolarHBondContact O-N 3.06Å; F314-L317 PolarHBondContact O-N 3.03Å; L315-L317 VanDerWaalsContact C-N 3.34Å; L315-L317 PolarHBondContact O-N 2.94Å; L317-P321 WeakPolarHBondContact O-CD 3.43Å; L317-P321 WeakPolarHBondContact O-CG 3.49Å
318	F	77.8	Confident	82.6	Confident	132 Å²	132	87.4 Å²	87.4	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-86.3	-34.1	174.6	-65.7	-74.9	0	0	0	113.2	F314 L315 F316 P321	F314-F318 HydrophobicContact CD1-CD2 4.16Å; F314-F318 AromaticContact CD1-CE2 3.83Å; F314-F318 HydrophobicContact CD1-CE2 3.83Å; F314-F318 HydrophobicContact CD2-CE2 4.01Å; F314-F318 HydrophobicContact CE1-CD2 4.05Å; F314-F318 AromaticContact CE1-CE2 3.44Å; F314-F318 HydrophobicContact CE1-CE2 3.44Å; F314-F318 VanDerWaalsContact CE1-CE2 3.44Å; F314-F318 HydrophobicContact CE1-CZ 4.34Å; F314-F318 AromaticContact CE2-CE2 3.64Å; F314-F318 HydrophobicContact CE2-CE2 3.64Å; F314-F318 HydrophobicContact CE2-CZ 4.18Å; F314-F318 HydrophobicContact CG-CE2 4.11Å; F314-F318 HydrophobicContact CZ-CD2 4.38Å; F314-F318 AromaticContact CZ-CE2 3.35Å; F314-F318 HydrophobicContact CZ-CE2 3.35Å; F314-F318 AromaticContact CZ-CZ 3.9Å; F314-F318 HydrophobicContact CZ-CZ 3.9Å; F314-F318 WeakPolarHBondContact O-CD2 3.38Å; F314-F318 PolarHBondContact O-N 3.07Å; L315-F318 PolarHBondContact O-N 3.07Å; F316-F318 PolarHBondContact O-N 3.43Å; F318-P321 WeakPolarHBondContact O-CD 3.37Å
319	A	76.7	Confident	82.8	Confident	50 Å²	50	84.7 Å²	84.7	41%	0.413	47%	0.471	S	S	.	.	H	α-helix	trans	-73.1	-33.7	-178.7	0	0	0	0	0	112.4	L315 F316 A322 L323	L315-A319 VanDerWaalsContact O-CB 3.23Å; L315-A319 WeakPolarHBondContact O-CB 3.44Å; L315-A319 PolarHBondContact O-N 3.34Å; F316-A319 PolarHBondContact O-N 3.29Å; A319-A322 PolarHBondContact O-N 2.8Å; A319-L323 WeakPolarHBondContact O-CB 3.34Å; A319-L323 PolarHBondContact O-N 3.45Å
320	L	78.5	Confident	82.8	Confident	81 Å²	81	90.4 Å²	90.4	42%	0.424	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-47	-177.4	-170.9	152.4	0	0	0	112.5	F316 A322 L323 V324	F316-L320 HydrophobicContact CD1-CD1 4.42Å; F316-L320 HydrophobicContact CE1-CD1 3.51Å; F316-L320 HydrophobicContact CE2-CD1 4.29Å; F316-L320 HydrophobicContact CZ-CD1 3.44Å; F316-L320 VanDerWaalsContact CZ-CD1 3.44Å; F316-L320 VanDerWaalsContact O-CB 3.3Å; F316-L320 WeakPolarHBondContact O-CB 3.4Å; F316-L320 PolarHBondContact O-N 3.1Å; L320-A322 PolarHBondContact O-N 3.24Å; L320-L323 PolarHBondContact O-N 2.92Å; L320-V324 HydrophobicContact CD2-CG2 4.16Å; L320-V324 VanDerWaalsContact O-CG2 3.29Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.16Å
321	P	81.2	Confident	82.9	Confident	62 Å²	62	92.2 Å²	92.2	40%	0.403	50%	0.503	S	S	.	.	H	α-helix	trans	-56.7	-48.3	169.9	-25.3	34.1	0	0	0	112.1	L317 F318 L323 V324 F325	L317-P321 WeakPolarHBondContact O-CD 3.43Å; L317-P321 WeakPolarHBondContact O-CG 3.49Å; F318-P321 WeakPolarHBondContact O-CD 3.37Å; P321-L323 VanDerWaalsContact C-N 3.31Å; P321-L323 PolarHBondContact O-N 3.16Å; P321-V324 PolarHBondContact O-N 3.36Å; P321-F325 WeakPolarHBondContact O-CD2 3.32Å; P321-F325 PolarHBondContact O-N 3.38Å
322	A	82.6	Confident	82.9	Confident	63 Å²	63	95.1 Å²	95.1	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-36.6	-179.6	0	0	0	0	0	112.9	A319 L320 G326	A319-A322 PolarHBondContact O-N 2.8Å; L320-A322 PolarHBondContact O-N 3.24Å; A322-G326 PolarHBondContact O-N 2.99Å
323	L	81.9	Confident	83.1	Confident	109 Å²	109	97.6 Å²	97.6	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-72.4	-39.3	177	-173.4	146.3	0	0	0	111.4	A319 L320 P321 G326 L327	A319-L323 WeakPolarHBondContact O-CB 3.34Å; A319-L323 PolarHBondContact O-N 3.45Å; L320-L323 PolarHBondContact O-N 2.92Å; P321-L323 VanDerWaalsContact C-N 3.31Å; P321-L323 PolarHBondContact O-N 3.16Å; L323-G326 PolarHBondContact O-N 2.82Å; L323-L327 HydrophobicContact CD2-CD1 3.54Å; L323-L327 HydrophobicContact CD2-CG 4.12Å; L323-L327 HydrophobicContact CG-CD1 4.47Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 VanDerWaalsContact O-CG 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.42Å; L323-L327 PolarHBondContact O-N 3Å
324	V	85.6	Confident	82.9	Confident	86 Å²	86	98.5 Å²	98.5	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-62.8	-45.6	172.3	171.1	0	0	0	0	110.6	L320 P321 A328	L320-V324 HydrophobicContact CD2-CG2 4.16Å; L320-V324 VanDerWaalsContact O-CG2 3.29Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.16Å; P321-V324 PolarHBondContact O-N 3.36Å; V324-A328 VanDerWaalsContact O-CB 3.26Å; V324-A328 WeakPolarHBondContact O-CB 3.34Å; V324-A328 PolarHBondContact O-N 2.85Å
325	F	86.8	Confident	82.5	Confident	144 Å²	144	96.9 Å²	96.9	63%	0.632	52%	0.52	S	S	*	.	H	α-helix	trans	-62.8	-43.2	174.1	-81.3	-70.6	0	0	0	111.9	P321 A328 I329	P321-F325 WeakPolarHBondContact O-CD2 3.32Å; P321-F325 PolarHBondContact O-N 3.38Å; F325-A328 PolarHBondContact O-N 3.29Å; F325-I329 WeakPolarHBondContact O-CB 3.33Å; F325-I329 VanDerWaalsContact O-CG1 3.22Å; F325-I329 WeakPolarHBondContact O-CG1 3.23Å; F325-I329 PolarHBondContact O-N 3.06Å
326	G	86.5	Confident	82.3	Confident	37 Å²	37	97.6 Å²	97.6	38%	0.381	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-44.5	177.9	0	0	0	0	0	112.8	A322 L323 I329 M330	A322-G326 PolarHBondContact O-N 2.99Å; L323-G326 PolarHBondContact O-N 2.82Å; G326-I329 PolarHBondContact O-N 3.46Å; G326-M330 VanDerWaalsContact O-CB 3.3Å; G326-M330 WeakPolarHBondContact O-CB 3.22Å; G326-M330 PolarHBondContact O-N 2.9Å
327	L	86.7	Confident	82.2	Confident	96 Å²	96	97.7 Å²	97.7	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-38.7	174.5	-72.4	179.2	0	0	0	111.8	L323 M330 L331	L323-L327 HydrophobicContact CD2-CD1 3.54Å; L323-L327 HydrophobicContact CD2-CG 4.12Å; L323-L327 HydrophobicContact CG-CD1 4.47Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 VanDerWaalsContact O-CG 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.42Å; L323-L327 PolarHBondContact O-N 3Å; L327-M330 PolarHBondContact O-N 2.82Å; L327-L331 WeakPolarHBondContact O-CB 3.38Å; L327-L331 PolarHBondContact O-N 3.11Å
328	A	85.3	Confident	81.5	Confident	54 Å²	54	98.8 Å²	98.8	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-43	175.1	0	0	0	0	0	111.8	V324 F325 L331 F332	V324-A328 VanDerWaalsContact O-CB 3.26Å; V324-A328 WeakPolarHBondContact O-CB 3.34Å; V324-A328 PolarHBondContact O-N 2.85Å; F325-A328 PolarHBondContact O-N 3.29Å; A328-L331 PolarHBondContact O-N 2.86Å; A328-F332 VanDerWaalsContact O-CB 3.3Å; A328-F332 WeakPolarHBondContact O-CB 3.29Å; A328-F332 PolarHBondContact O-N 2.81Å
329	I	88.3	Confident	80.5	Confident	100 Å²	100	99.7 Å²	99.7	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-45.3	175.7	-69.4	165.6	0	0	0	110.5	F325 G326 L331 F332 I333	F325-I329 WeakPolarHBondContact O-CB 3.33Å; F325-I329 VanDerWaalsContact O-CG1 3.22Å; F325-I329 WeakPolarHBondContact O-CG1 3.23Å; F325-I329 PolarHBondContact O-N 3.06Å; G326-I329 PolarHBondContact O-N 3.46Å; I329-L331 VanDerWaalsContact C-N 3.32Å; I329-L331 PolarHBondContact O-N 3.4Å; I329-F332 PolarHBondContact O-N 2.93Å; I329-I333 HydrophobicContact CG2-CD1 3.65Å; I329-I333 HydrophobicContact CG2-CG1 4.29Å; I329-I333 WeakPolarHBondContact O-CB 3.33Å; I329-I333 VanDerWaalsContact O-CG1 3.26Å; I329-I333 WeakPolarHBondContact O-CG1 3.4Å; I329-I333 PolarHBondContact O-N 2.92Å
330	M	86.6	Confident	80	Confident	120 Å²	120	103.2 Å²	103.2	59%	0.591	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-41.2	177.6	-166.3	-160	76.7	0	0	111.2	G326 L327 I333 Q334	G326-M330 VanDerWaalsContact O-CB 3.3Å; G326-M330 WeakPolarHBondContact O-CB 3.22Å; G326-M330 PolarHBondContact O-N 2.9Å; L327-M330 PolarHBondContact O-N 2.82Å; M330-I333 PolarHBondContact O-N 3.23Å; M330-Q334 VanDerWaalsContact O-CB 3.24Å; M330-Q334 WeakPolarHBondContact O-CB 3.14Å; M330-Q334 PolarHBondContact O-N 2.91Å
331	L	85.3	Confident	79.3	Confident	107 Å²	107	106.1 Å²	106.1	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-40	175.3	-171.9	139.7	0	0	0	111.3	L327 A328 I329 Q334 L335	L327-L331 WeakPolarHBondContact O-CB 3.38Å; L327-L331 PolarHBondContact O-N 3.11Å; A328-L331 PolarHBondContact O-N 2.86Å; I329-L331 VanDerWaalsContact C-N 3.32Å; I329-L331 PolarHBondContact O-N 3.4Å; L331-Q334 PolarHBondContact O-N 3.36Å; L331-L335 HydrophobicContact CD2-CD1 3.58Å; L331-L335 HydrophobicContact CD2-CG 4.24Å; L331-L335 WeakPolarHBondContact O-CB 3.28Å; L331-L335 VanDerWaalsContact O-CG 3.23Å; L331-L335 WeakPolarHBondContact O-CG 3.4Å; L331-L335 PolarHBondContact O-N 2.85Å
332	F	84.5	Confident	78.1	Confident	140 Å²	140	105.4 Å²	105.4	61%	0.614	53%	0.533	S	S	*	.	H	α-helix	trans	-64.7	-45.5	174.9	-173	-95.5	0	0	0	112.1	A328 I329 Q334 L335 F336	A328-F332 VanDerWaalsContact O-CB 3.3Å; A328-F332 WeakPolarHBondContact O-CB 3.29Å; A328-F332 PolarHBondContact O-N 2.81Å; I329-F332 PolarHBondContact O-N 2.93Å; F332-Q334 VanDerWaalsContact C-N 3.32Å; F332-Q334 PolarHBondContact O-N 3.22Å; F332-L335 PolarHBondContact O-N 3.23Å; F332-F336 VanDerWaalsContact O-CB 3.3Å; F332-F336 WeakPolarHBondContact O-CB 3.25Å; F332-F336 PolarHBondContact O-N 3.3Å
333	I	86.6	Confident	77.1	Confident	99 Å²	99	108 Å²	108	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-41.9	174.9	-68	167.2	0	0	0	110.3	I329 M330 F336 K337	I329-I333 HydrophobicContact CG2-CD1 3.65Å; I329-I333 HydrophobicContact CG2-CG1 4.29Å; I329-I333 WeakPolarHBondContact O-CB 3.33Å; I329-I333 VanDerWaalsContact O-CG1 3.26Å; I329-I333 WeakPolarHBondContact O-CG1 3.4Å; I329-I333 PolarHBondContact O-N 2.92Å; M330-I333 PolarHBondContact O-N 3.23Å; I333-F336 PolarHBondContact O-N 3.49Å; I333-K337 VanDerWaalsContact O-CB 3.22Å; I333-K337 WeakPolarHBondContact O-CB 3.42Å; I333-K337 PolarHBondContact O-N 3.03Å
334	Q	78.6	Confident	75.9	Confident	113 Å²	113	109.9 Å²	109.9	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-66.9	-40.3	178.1	-171.9	64.9	14.3	0	0	111.6	M330 L331 F332 F336 W338	M330-Q334 VanDerWaalsContact O-CB 3.24Å; M330-Q334 WeakPolarHBondContact O-CB 3.14Å; M330-Q334 PolarHBondContact O-N 2.91Å; L331-Q334 PolarHBondContact O-N 3.36Å; F332-Q334 VanDerWaalsContact C-N 3.32Å; F332-Q334 PolarHBondContact O-N 3.22Å; Q334-F336 VanDerWaalsContact C-N 3.35Å; Q334-W338 WeakPolarHBondContact O-CB 3.44Å; Q334-W338 PolarHBondContact O-N 2.92Å
335	L	73.6	Confident	74.5	Confident	95 Å²	95	110.6 Å²	110.6	50%	0.497	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-40.8	173.2	-75.4	174.2	0	0	0	111.5	L331 F332 F339	L331-L335 HydrophobicContact CD2-CD1 3.58Å; L331-L335 HydrophobicContact CD2-CG 4.24Å; L331-L335 WeakPolarHBondContact O-CB 3.28Å; L331-L335 VanDerWaalsContact O-CG 3.23Å; L331-L335 WeakPolarHBondContact O-CG 3.4Å; L331-L335 PolarHBondContact O-N 2.85Å; F332-L335 PolarHBondContact O-N 3.23Å; L335-F339 VanDerWaalsContact O-CB 3.26Å; L335-F339 WeakPolarHBondContact O-CB 3.48Å; L335-F339 PolarHBondContact O-N 2.91Å
336	F	76.6	Confident	73	Confident	118 Å²	118	109.2 Å²	109.2	52%	0.518	54%	0.543	S	S	.	.	H	α-helix	trans	-71.3	-41.3	179.6	-160.1	-99.1	0	0	0	112.1	F332 I333 Q334 F339 I340	F332-F336 VanDerWaalsContact O-CB 3.3Å; F332-F336 WeakPolarHBondContact O-CB 3.25Å; F332-F336 PolarHBondContact O-N 3.3Å; I333-F336 PolarHBondContact O-N 3.49Å; Q334-F336 VanDerWaalsContact C-N 3.35Å; F336-F339 PolarHBondContact O-N 3.34Å; F336-I340 HydrophobicContact CD1-CD1 3.77Å; F336-I340 HydrophobicContact CD1-CG1 4.46Å; F336-I340 HydrophobicContact CE1-CD1 3.44Å; F336-I340 VanDerWaalsContact CE1-CD1 3.44Å; F336-I340 HydrophobicContact CE1-CG1 4.34Å; F336-I340 HydrophobicContact CZ-CD1 4.24Å; F336-I340 WeakPolarHBondContact O-CG1 3.33Å; F336-I340 PolarHBondContact O-N 3.31Å
337	K	77.5	Confident	71.4	Confident	123 Å²	123	111.9 Å²	111.9	54%	0.535	55%	0.546	S	S	.	.	H	α-helix	trans	-63.4	-45.3	172.9	-173.9	179.4	177.2	-177.7	0	110.9	I333 F339 I340 E341	I333-K337 VanDerWaalsContact O-CB 3.22Å; I333-K337 WeakPolarHBondContact O-CB 3.42Å; I333-K337 PolarHBondContact O-N 3.03Å; K337-F339 VanDerWaalsContact C-N 3.3Å; K337-F339 PolarHBondContact O-N 3.47Å; K337-I340 PolarHBondContact O-N 3.3Å; K337-E341 WeakPolarHBondContact O-CB 3.06Å; K337-E341 PolarHBondContact O-N 3.49Å
338	W	63.4	Low	70.1	Confident	146 Å²	146	112.7 Å²	112.7	55%	0.553	55%	0.55	S	S	*	.	H	α-helix	trans	-58.8	-41.9	173.9	-174.5	72.1	0	0	0	111.5	Q334 E341 L342	Q334-W338 WeakPolarHBondContact O-CB 3.44Å; Q334-W338 PolarHBondContact O-N 2.92Å; W338-E341 PolarHBondContact O-N 3.08Å; W338-L342 HydrophobicContact CD2-CD1 3.71Å; W338-L342 HydrophobicContact CE3-CD1 3.61Å; W338-L342 HydrophobicContact CG-CD1 4.42Å; W338-L342 HydrophobicContact CH2-CD1 3.85Å; W338-L342 HydrophobicContact CZ2-CD1 3.94Å; W338-L342 HydrophobicContact CZ3-CD1 3.69Å; W338-L342 VanDerWaalsContact O-CD1 3.27Å; W338-L342 WeakPolarHBondContact O-CD1 3.38Å; W338-L342 WeakPolarHBondContact O-CG 3.17Å; W338-L342 PolarHBondContact O-N 2.96Å
339	F	58	Low	68.8	Low	151 Å²	151	114 Å²	114	66%	0.662	55%	0.552	S	S	*	*	H	α-helix	trans	-66.2	-35.6	177.5	-172.4	-100.3	0	0	0	114	L335 F336 K337	L335-F339 VanDerWaalsContact O-CB 3.26Å; L335-F339 WeakPolarHBondContact O-CB 3.48Å; L335-F339 PolarHBondContact O-N 2.91Å; F336-F339 PolarHBondContact O-N 3.34Å; K337-F339 VanDerWaalsContact C-N 3.3Å; K337-F339 PolarHBondContact O-N 3.47Å
340	I	66.3	Low	67.5	Low	123 Å²	123	112.5 Å²	112.5	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-76.9	-31.2	177.2	-70.7	-179.4	0	0	0	111.9	F336 K337 L342	F336-I340 HydrophobicContact CD1-CD1 3.77Å; F336-I340 HydrophobicContact CD1-CG1 4.46Å; F336-I340 HydrophobicContact CE1-CD1 3.44Å; F336-I340 VanDerWaalsContact CE1-CD1 3.44Å; F336-I340 HydrophobicContact CE1-CG1 4.34Å; F336-I340 HydrophobicContact CZ-CD1 4.24Å; F336-I340 WeakPolarHBondContact O-CG1 3.33Å; F336-I340 PolarHBondContact O-N 3.31Å; K337-I340 PolarHBondContact O-N 3.3Å; I340-L342 PolarHBondContact O-N 2.86Å
341	E	63.6	Low	66.1	Low	142 Å²	142	112.3 Å²	112.3	66%	0.664	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	3.1	-179.6	-155.8	162.7	-174.5	0	0	113	K337 W338 E343	K337-E341 WeakPolarHBondContact O-CB 3.06Å; K337-E341 PolarHBondContact O-N 3.49Å; W338-E341 PolarHBondContact O-N 3.08Å; E341-E343 PolarHBondContact O-N 3.35Å
342	L	55	Low	64.8	Low	48 Å²	48	110.7 Å²	110.7	25%	0.251	54%	0.543	S	S	.	.			trans	-88.7	96.7	-176.8	-99.8	157.5	0	0	0	112.2	W338 I340 M347	W338-L342 HydrophobicContact CD2-CD1 3.71Å; W338-L342 HydrophobicContact CE3-CD1 3.61Å; W338-L342 HydrophobicContact CG-CD1 4.42Å; W338-L342 HydrophobicContact CH2-CD1 3.85Å; W338-L342 HydrophobicContact CZ2-CD1 3.94Å; W338-L342 HydrophobicContact CZ3-CD1 3.69Å; W338-L342 VanDerWaalsContact O-CD1 3.27Å; W338-L342 WeakPolarHBondContact O-CD1 3.38Å; W338-L342 WeakPolarHBondContact O-CG 3.17Å; W338-L342 PolarHBondContact O-N 2.96Å; I340-L342 PolarHBondContact O-N 2.86Å; L342-M347 HydrophobicContact CD2-CB 3.84Å; L342-M347 HydrophobicContact CD2-CG 4.32Å
343	E	63.4	Low	63.6	Low	117 Å²	117	109 Å²	109	55%	0.547	54%	0.539	S	S	.	.			trans	-69.7	125.5	154.1	-68	170.5	154.9	0	0	108.5	E341 T345 K346	E341-E343 PolarHBondContact O-N 3.35Å; E343-T345 PolarHBondContact O-N 3.46Å; E343-K346 PolarHBondContact O-N 2.77Å; E343-K346 WeakPolarHBondContact OE2-CE 3.17Å; E343-K346 IonicContact OE2-NZ 2.81Å; E343-K346 PolarHBondContact OE2-NZ 3.49Å
344	L	56.3	Low	62.1	Low	148 Å²	148	108.1 Å²	108.1	78%	0.775	54%	0.541	S	S	*	.	H	α-helix	trans	-48.8	-24.8	-173.1	-78.9	162.7	0	0	0	115
345	T	56.4	Low	61	Low	101 Å²	101	104.8 Å²	104.8	62%	0.62	53%	0.533	S	S	*	.	H	α-helix	trans	-73.1	-28.4	178.7	46.6	0	0	0	0	113.8	E343	E343-T345 PolarHBondContact O-N 3.46Å
346	K	54.3	Low	60.2	Low	115 Å²	115	104.3 Å²	104.3	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-80.1	-19.7	179.1	-69.6	170.6	176.9	151.2	0	112.9	E343 T350	E343-K346 PolarHBondContact O-N 2.77Å; E343-K346 WeakPolarHBondContact OE2-CE 3.17Å; E343-K346 IonicContact OE2-NZ 2.81Å; E343-K346 PolarHBondContact OE2-NZ 3.49Å; K346-T350 WeakPolarHBondContact O-CB 3.41Å; K346-T350 PolarHBondContact O-N 2.85Å; K346-T350 PolarHBondContact O-OG1 3.27Å
347	M	53.5	Low	59	Low	93 Å²	93	102 Å²	102	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-68.7	-39	176.4	-165.8	-104.5	-108.1	0	0	112.1	L342 T350 L351	L342-M347 HydrophobicContact CD2-CB 3.84Å; L342-M347 HydrophobicContact CD2-CG 4.32Å; M347-T350 PolarHBondContact O-OG1 3.3Å; M347-L351 VanDerWaalsContact O-CB 3.22Å; M347-L351 WeakPolarHBondContact O-CB 3.11Å; M347-L351 PolarHBondContact O-N 2.88Å; M347-L351 VanDerWaalsContact O-N 3.1Å
348	I	58	Low	57.9	Low	113 Å²	113	100.4 Å²	100.4	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-71	-42.3	176.9	-63.6	172.6	0	0	0	110.5	L351 V352	I348-L351 PolarHBondContact O-N 3.48Å; I348-V352 HydrophobicContact CG2-CG2 4.47Å; I348-V352 WeakPolarHBondContact O-CB 3.45Å; I348-V352 VanDerWaalsContact O-CG2 3.24Å; I348-V352 WeakPolarHBondContact O-CG2 3.25Å; I348-V352 PolarHBondContact O-N 2.81Å
349	V	59.7	Low	57.4	Low	82 Å²	82	97.5 Å²	97.5	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-68.5	-39.8	-177.8	176.5	0	0	0	0	111.8	V352 I353	V349-V352 PolarHBondContact O-N 3.42Å; V349-I353 HydrophobicContact CG1-CD1 3.59Å; V349-I353 HydrophobicContact CG1-CG1 4.35Å; V349-I353 VanDerWaalsContact O-CB 3.27Å; V349-I353 WeakPolarHBondContact O-CB 3.24Å; V349-I353 WeakPolarHBondContact O-CG1 3.36Å; V349-I353 PolarHBondContact O-N 3.19Å
350	T	59.5	Low	57.1	Low	69 Å²	69	94.8 Å²	94.8	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-73	-33.7	175.5	46.7	0	0	0	0	112.7	K346 M347 I353 C354	K346-T350 WeakPolarHBondContact O-CB 3.41Å; K346-T350 PolarHBondContact O-N 2.85Å; K346-T350 PolarHBondContact O-OG1 3.27Å; M347-T350 PolarHBondContact O-OG1 3.3Å; T350-I353 PolarHBondContact O-N 2.82Å; T350-C354 WeakPolarHBondContact O-CB 3.36Å; T350-C354 PolarHBondContact O-N 2.91Å; T350-C354 PolarHBondContact O-SG 2.71Å; T350-C354 VanDerWaalsContact O-SG 3.39Å
351	L	57.9	Low	56.5	Low	115 Å²	115	99 Å²	99	60%	0.602	53%	0.526	S	S	*	.	H	α-helix	trans	-67.1	-37.4	173.1	-168	138.4	0	0	0	111.7	M347 I348 A355	M347-L351 VanDerWaalsContact O-CB 3.22Å; M347-L351 WeakPolarHBondContact O-CB 3.11Å; M347-L351 PolarHBondContact O-N 2.88Å; M347-L351 VanDerWaalsContact O-N 3.1Å; I348-L351 PolarHBondContact O-N 3.48Å; L351-A355 WeakPolarHBondContact O-CB 2.78Å; L351-A355 PolarHBondContact O-N 3.39Å
352	V	57.9	Low	55.9	Low	74 Å²	74	99.2 Å²	99.2	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-70	-45.6	172.9	171.9	0	0	0	0	111.3	I348 V349 C354 A355 I356	I348-V352 HydrophobicContact CG2-CG2 4.47Å; I348-V352 WeakPolarHBondContact O-CB 3.45Å; I348-V352 VanDerWaalsContact O-CG2 3.24Å; I348-V352 WeakPolarHBondContact O-CG2 3.25Å; I348-V352 PolarHBondContact O-N 2.81Å; V349-V352 PolarHBondContact O-N 3.42Å; V352-C354 VanDerWaalsContact C-N 3.31Å; V352-C354 PolarHBondContact O-N 3.01Å; V352-A355 PolarHBondContact O-N 3.39Å; V352-I356 HydrophobicContact CG1-CD1 3.88Å; V352-I356 WeakPolarHBondContact O-CD1 3.19Å; V352-I356 WeakPolarHBondContact O-CG1 3.38Å; V352-I356 PolarHBondContact O-N 2.88Å
353	I	60.3	Low	55.6	Low	103 Å²	103	107.4 Å²	107.4	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-68.9	-26.4	179	-70.6	171.7	0	0	0	112.5	V349 T350 P357	V349-I353 HydrophobicContact CG1-CD1 3.59Å; V349-I353 HydrophobicContact CG1-CG1 4.35Å; V349-I353 VanDerWaalsContact O-CB 3.27Å; V349-I353 WeakPolarHBondContact O-CB 3.24Å; V349-I353 WeakPolarHBondContact O-CG1 3.36Å; V349-I353 PolarHBondContact O-N 3.19Å; T350-I353 PolarHBondContact O-N 2.82Å; I353-P357 WeakPolarHBondContact O-CD 3.22Å; I353-P357 VanDerWaalsContact O-CG 3.31Å; I353-P357 WeakPolarHBondContact O-CG 3.44Å
354	C	53.8	Low	54.7	Low	82 Å²	82	105.6 Å²	105.6	55%	0.554	56%	0.556	S	S	*	*	H	α-helix	trans	-86.1	-29.1	171.8	-74.4	0	0	0	0	112.7	T350 V352 P357 V358	T350-C354 WeakPolarHBondContact O-CB 3.36Å; T350-C354 PolarHBondContact O-N 2.91Å; T350-C354 PolarHBondContact O-SG 2.71Å; T350-C354 VanDerWaalsContact O-SG 3.39Å; V352-C354 VanDerWaalsContact C-N 3.31Å; V352-C354 PolarHBondContact O-N 3.01Å; C354-P357 WeakPolarHBondContact O-CD 3.24Å; C354-V358 VanDerWaalsContact O-CG2 3.22Å; C354-V358 WeakPolarHBondContact O-CG2 3.43Å; C354-V358 PolarHBondContact O-N 2.83Å
355	A	55.4	Low	54.4	Low	43 Å²	43	109 Å²	109	36%	0.355	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-38.3	173.1	0	0	0	0	0	111.5	L351 V352 V358 T359	L351-A355 WeakPolarHBondContact O-CB 2.78Å; L351-A355 PolarHBondContact O-N 3.39Å; V352-A355 PolarHBondContact O-N 3.39Å; A355-V358 PolarHBondContact O-N 3.41Å; A355-T359 WeakPolarHBondContact O-CB 3.37Å; A355-T359 WeakPolarHBondContact O-CG2 3.31Å; A355-T359 PolarHBondContact O-N 3.47Å; A355-T359 PolarHBondContact O-OG1 3.1Å
356	I	57.1	Low	53.7	Low	84 Å²	84	113.3 Å²	113.3	43%	0.431	57%	0.569	S	S	.	*	H	α-helix	trans	-58.4	-49.8	-179.8	-71	162.7	0	0	0	114	V352 T359 L360	V352-I356 HydrophobicContact CG1-CD1 3.88Å; V352-I356 WeakPolarHBondContact O-CD1 3.19Å; V352-I356 WeakPolarHBondContact O-CG1 3.38Å; V352-I356 PolarHBondContact O-N 2.88Å; I356-T359 PolarHBondContact O-OG1 3.39Å; I356-T359 VanDerWaalsContact O-OG1 3.11Å; I356-L360 HydrophobicContact CG2-CD1 3.69Å; I356-L360 WeakPolarHBondContact O-CB 3.37Å; I356-L360 WeakPolarHBondContact O-CD1 3.2Å; I356-L360 WeakPolarHBondContact O-CG 3.29Å; I356-L360 PolarHBondContact O-N 3.48Å
357	P	52.3	Low	53.4	Low	70 Å²	70	112 Å²	112	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-73.1	-26.8	176.8	24.1	-30.2	0	0	0	112.6	I353 C354 R361	I353-P357 WeakPolarHBondContact O-CD 3.22Å; I353-P357 VanDerWaalsContact O-CG 3.31Å; I353-P357 WeakPolarHBondContact O-CG 3.44Å; C354-P357 WeakPolarHBondContact O-CD 3.24Å; P357-R361 WeakPolarHBondContact O-CB 3.49Å; P357-R361 PolarHBondContact O-N 2.94Å
358	V	54.2	Low	53.1	Low	89 Å²	89	111.1 Å²	111.1	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-72.8	-40.6	175	173	0	0	0	0	110.9	C354 A355 L362	C354-V358 VanDerWaalsContact O-CG2 3.22Å; C354-V358 WeakPolarHBondContact O-CG2 3.43Å; C354-V358 PolarHBondContact O-N 2.83Å; A355-V358 PolarHBondContact O-N 3.41Å; V358-L362 WeakPolarHBondContact O-CD1 3.25Å; V358-L362 PolarHBondContact O-N 3.4Å
359	T	53.5	Low	52.5	Low	86 Å²	86	110.1 Å²	110.1	53%	0.528	57%	0.573	S	S	.	*	H	α-helix	trans	-74.3	-38.1	174.5	57	0	0	0	0	112	A355 I356 R361 L362 W363	A355-T359 WeakPolarHBondContact O-CB 3.37Å; A355-T359 WeakPolarHBondContact O-CG2 3.31Å; A355-T359 PolarHBondContact O-N 3.47Å; A355-T359 PolarHBondContact O-OG1 3.1Å; I356-T359 PolarHBondContact O-OG1 3.39Å; I356-T359 VanDerWaalsContact O-OG1 3.11Å; T359-R361 VanDerWaalsContact C-N 3.35Å; T359-R361 PolarHBondContact O-N 2.85Å; T359-L362 PolarHBondContact O-N 3.1Å; T359-W363 VanDerWaalsContact O-CB 3.25Å; T359-W363 WeakPolarHBondContact O-CB 2.93Å; T359-W363 PolarHBondContact O-N 3.35Å
360	L	51.4	Low	51.9	Low	93 Å²	93	112.3 Å²	112.3	49%	0.487	58%	0.58	S	S	.	*	H	α-helix	trans	-64.7	-34.7	170.8	-85.2	161.9	0	0	0	112.7	I356 W363 T364	I356-L360 HydrophobicContact CG2-CD1 3.69Å; I356-L360 WeakPolarHBondContact O-CB 3.37Å; I356-L360 WeakPolarHBondContact O-CD1 3.2Å; I356-L360 WeakPolarHBondContact O-CG 3.29Å; I356-L360 PolarHBondContact O-N 3.48Å; L360-W363 PolarHBondContact O-N 3.34Å; L360-T364 WeakPolarHBondContact O-CB 3.34Å; L360-T364 WeakPolarHBondContact O-CG2 3.02Å; L360-T364 PolarHBondContact O-N 3.27Å; L360-T364 PolarHBondContact O-OG1 3.18Å
361	R	52.4	Low	51.4	Low	211 Å²	211	113.1 Å²	113.1	80%	0.796	58%	0.582	S	S	*	*	H	α-helix	trans	-72.7	-28.4	173.6	-177.8	-179.9	-96.7	-135.5	-1.5	112.4	P357 T359	P357-R361 WeakPolarHBondContact O-CB 3.49Å; P357-R361 PolarHBondContact O-N 2.94Å; T359-R361 VanDerWaalsContact C-N 3.35Å; T359-R361 PolarHBondContact O-N 2.85Å
362	L	52	Low	51.2	Low	147 Å²	147	111 Å²	111	77%	0.77	57%	0.571	S	S	*	*	H	α-helix	trans	-75.2	-33.3	168.8	-106.4	78.8	0	0	0	112.5	V358 T359	V358-L362 WeakPolarHBondContact O-CD1 3.25Å; V358-L362 PolarHBondContact O-N 3.4Å; T359-L362 PolarHBondContact O-N 3.1Å
363	W	47.4	Very low	50.9	Low	221 Å²	221	110.9 Å²	110.9	84%	0.837	57%	0.57	S	S	*	*	H	α-helix	trans	-82.8	-35.7	-176.6	-168.7	-77	0	0	0	113.2	T359 L360 R365	T359-W363 VanDerWaalsContact O-CB 3.25Å; T359-W363 WeakPolarHBondContact O-CB 2.93Å; T359-W363 PolarHBondContact O-N 3.35Å; L360-W363 PolarHBondContact O-N 3.34Å; W363-R365 PolarHBondContact O-N 3.26Å
364	T	46.1	Very low	50.4	Low	79 Å²	79	110.3 Å²	110.3	49%	0.485	57%	0.567	S	S	.	*			trans	-78.2	75.6	173.6	54.7	0	0	0	0	109.8	L360 F366	L360-T364 WeakPolarHBondContact O-CB 3.34Å; L360-T364 WeakPolarHBondContact O-CG2 3.02Å; L360-T364 PolarHBondContact O-N 3.27Å; L360-T364 PolarHBondContact O-OG1 3.18Å; T364-F366 PolarHBondContact O-N 3.48Å
365	R	48.9	Very low	50.4	Low	218 Å²	218	113.3 Å²	113.3	82%	0.823	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	55.7	167.4	-164.9	-151.3	-86.9	173.6	-7.2	110.8	W363	W363-R365 PolarHBondContact O-N 3.26Å
366	F	42.4	Very low	50.2	Low	193 Å²	193	114.2 Å²	114.2	85%	0.846	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	6.2	176.2	-117	-86.8	0	0	0	112.8	T364	T364-F366 PolarHBondContact O-N 3.48Å
367	S	47.7	Very low	50	Low	87 Å²	87	114.4 Å²	114.4	61%	0.608	57%	0.569	S	S	*	*			trans	-94.5	15.8	170.1	-174.7	0	0	0	0	113.7
368	M	46.2	Very low	49.9	Very low	74 Å²	74	116 Å²	116	37%	0.365	58%	0.577	S	S	.	*	H	α-helix	trans	-88.2	-6.9	-177.4	-71.8	-63.2	-80.7	0	0	114.3	L371 D372	M368-L371 HydrophobicContact SD-CD2 4.18Å; M368-D372 WeakPolarHBondContact CE-OD1 3.46Å; M368-D372 WeakPolarHBondContact CE-OD2 3.43Å; M368-D372 WeakPolarHBondContact O-CB 3.48Å; M368-D372 VanDerWaalsContact O-CG 3.23Å; M368-D372 PolarHBondContact O-N 2.72Å; M368-D372 VanDerWaalsContact O-OD2 3.11Å
369	S	47.3	Very low	50.2	Low	93 Å²	93	119.3 Å²	119.3	65%	0.65	59%	0.587	S	S	*	*	H	α-helix	trans	-72.8	-48.8	175.5	-178.7	0	0	0	0	112.7	V373	S369-V373 WeakPolarHBondContact O-CB 3.16Å; S369-V373 WeakPolarHBondContact O-CG2 3.46Å; S369-V373 PolarHBondContact O-N 3.07Å
370	I	46.7	Very low	50.5	Low	128 Å²	128	122.3 Å²	122.3	66%	0.656	59%	0.589	S	S	*	*	H	α-helix	trans	-76.2	-34.4	-179.7	-63.4	167.5	0	0	0	111.3	L374	I370-L374 HydrophobicContact CG2-CD1 3.97Å; I370-L374 VanDerWaalsContact O-CB 3.28Å; I370-L374 WeakPolarHBondContact O-CB 3.34Å; I370-L374 PolarHBondContact O-N 3.34Å
371	L	48.5	Very low	51.6	Low	86 Å²	86	118.5 Å²	118.5	45%	0.45	57%	0.572	S	S	.	*	H	α-helix	trans	-76.6	-35.5	179	-161.4	74.2	0	0	0	112.4	M368 L374 R375	M368-L371 HydrophobicContact SD-CD2 4.18Å; L371-L374 CarbonylContact O-C 3.48Å; L371-L374 PolarHBondContact O-N 3.38Å; L371-R375 WeakPolarHBondContact O-CB 3.27Å; L371-R375 PolarHBondContact O-N 2.9Å
372	D	53.6	Low	53	Low	70 Å²	70	111.3 Å²	111.3	37%	0.374	55%	0.552	S	S	.	*	H	α-helix	trans	-75.7	-30.9	173.3	-71	-32.9	0	0	0	112	M368 R375 S376	M368-D372 WeakPolarHBondContact CE-OD1 3.46Å; M368-D372 WeakPolarHBondContact CE-OD2 3.43Å; M368-D372 WeakPolarHBondContact O-CB 3.48Å; M368-D372 VanDerWaalsContact O-CG 3.23Å; M368-D372 PolarHBondContact O-N 2.72Å; M368-D372 VanDerWaalsContact O-OD2 3.11Å; D372-R375 PolarHBondContact O-N 3.07Å; D372-R375 IonicContact OD1-NH1 3.83Å; D372-S376 VanDerWaalsContact O-CB 3.22Å; D372-S376 WeakPolarHBondContact O-CB 3.34Å; D372-S376 PolarHBondContact O-N 3.38Å
373	V	52.3	Low	54.5	Low	72 Å²	72	104.3 Å²	104.3	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-55.3	163.3	168.8	0	0	0	0	108.5	S369 R375 S376 F377	S369-V373 WeakPolarHBondContact O-CB 3.16Å; S369-V373 WeakPolarHBondContact O-CG2 3.46Å; S369-V373 PolarHBondContact O-N 3.07Å; V373-R375 VanDerWaalsContact C-N 3.25Å; V373-R375 PolarHBondContact O-N 3.15Å; V373-S376 CarbonylContact O-C 3.59Å; V373-S376 WeakPolarHBondContact O-CA 3.12Å; V373-S376 VanDerWaalsContact O-CB 3.31Å; V373-S376 WeakPolarHBondContact O-CB 3.33Å; V373-S376 PolarHBondContact O-N 3.29Å; V373-F377 HydrophobicContact CG1-CD2 3.43Å; V373-F377 VanDerWaalsContact CG1-CD2 3.43Å; V373-F377 HydrophobicContact CG1-CE2 3.29Å; V373-F377 WeakPolarHBondContact O-CB 3.45Å; V373-F377 WeakPolarHBondContact O-CD2 3.36Å; V373-F377 PolarHBondContact O-N 3.18Å
374	L	48.5	Very low	56.3	Low	90 Å²	90	97 Å²	97	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-56.4	-33	175.6	-96.6	150.8	0	0	0	114	I370 L371 F377 T378	I370-L374 HydrophobicContact CG2-CD1 3.97Å; I370-L374 VanDerWaalsContact O-CB 3.28Å; I370-L374 WeakPolarHBondContact O-CB 3.34Å; I370-L374 PolarHBondContact O-N 3.34Å; L371-L374 CarbonylContact O-C 3.48Å; L371-L374 PolarHBondContact O-N 3.38Å; L374-F377 CarbonylContact O-C 3.52Å; L374-F377 VanDerWaalsContact O-CB 3.27Å; L374-F377 WeakPolarHBondContact O-CB 3.46Å; L374-F377 PolarHBondContact O-N 3.43Å; L374-T378 WeakPolarHBondContact O-CB 3.29Å; L374-T378 PolarHBondContact O-N 3.41Å; L374-T378 PolarHBondContact O-OG1 2.98Å
375	R	53.9	Low	58.1	Low	145 Å²	145	96.7 Å²	96.7	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-76.7	-35.4	178.3	-166.3	179.5	-101.9	165.6	-11.2	110.8	L371 D372 V373 T378 Q379	L371-R375 WeakPolarHBondContact O-CB 3.27Å; L371-R375 PolarHBondContact O-N 2.9Å; D372-R375 PolarHBondContact O-N 3.07Å; D372-R375 IonicContact OD1-NH1 3.83Å; V373-R375 VanDerWaalsContact C-N 3.25Å; V373-R375 PolarHBondContact O-N 3.15Å; R375-T378 PolarHBondContact O-N 3.3Å; R375-Q379 PolarHBondContact O-N 3.15Å
376	S	51.9	Low	59.9	Low	62 Å²	62	87.5 Å²	87.5	43%	0.434	45%	0.449	S	S	.	.	H	α-helix	trans	-64.9	-42.4	166.3	-176.9	0	0	0	0	111.4	D372 V373 T378 Q379 W380	D372-S376 VanDerWaalsContact O-CB 3.22Å; D372-S376 WeakPolarHBondContact O-CB 3.34Å; D372-S376 PolarHBondContact O-N 3.38Å; V373-S376 CarbonylContact O-C 3.59Å; V373-S376 WeakPolarHBondContact O-CA 3.12Å; V373-S376 VanDerWaalsContact O-CB 3.31Å; V373-S376 WeakPolarHBondContact O-CB 3.33Å; V373-S376 PolarHBondContact O-N 3.29Å; S376-T378 PolarHBondContact O-N 2.02Å; S376-Q379 PolarHBondContact O-N 2.78Å; S376-W380 PolarHBondContact O-N 3.22Å
377	F	52.6	Low	61.9	Low	89 Å²	89	79.4 Å²	79.4	39%	0.39	41%	0.414	S	S	.	.	H	α-helix	trans	-61.5	-23.7	169.4	-91.8	-91.3	0	0	0	113.3	V373 L374 F385	V373-F377 HydrophobicContact CG1-CD2 3.43Å; V373-F377 VanDerWaalsContact CG1-CD2 3.43Å; V373-F377 HydrophobicContact CG1-CE2 3.29Å; V373-F377 WeakPolarHBondContact O-CB 3.45Å; V373-F377 WeakPolarHBondContact O-CD2 3.36Å; V373-F377 PolarHBondContact O-N 3.18Å; L374-F377 CarbonylContact O-C 3.52Å; L374-F377 VanDerWaalsContact O-CB 3.27Å; L374-F377 WeakPolarHBondContact O-CB 3.46Å; L374-F377 PolarHBondContact O-N 3.43Å; F377-F385 HydrophobicContact CD1-CD1 4.11Å; F377-F385 AromaticContact CD1-CD2 3.76Å; F377-F385 HydrophobicContact CD1-CD2 3.76Å; F377-F385 HydrophobicContact CD1-CE1 4.12Å; F377-F385 AromaticContact CD1-CE2 3.77Å; F377-F385 HydrophobicContact CD1-CE2 3.77Å; F377-F385 AromaticContact CD1-CG 3.95Å; F377-F385 HydrophobicContact CD1-CG 3.95Å; F377-F385 AromaticContact CD1-CZ 3.98Å; F377-F385 HydrophobicContact CD1-CZ 3.98Å; F377-F385 AromaticContact CE1-CD1 3.92Å; F377-F385 HydrophobicContact CE1-CD1 3.92Å; F377-F385 AromaticContact CE1-CD2 3.67Å; F377-F385 HydrophobicContact CE1-CD2 3.67Å; F377-F385 AromaticContact CE1-CE1 3.46Å; F377-F385 HydrophobicContact CE1-CE1 3.46Å; F377-F385 VanDerWaalsContact CE1-CE1 3.46Å; F377-F385 AromaticContact CE1-CE2 3.18Å; F377-F385 HydrophobicContact CE1-CE2 3.18Å; F377-F385 HydrophobicContact CE1-CG 4.03Å; F377-F385 AromaticContact CE1-CZ 3.09Å; F377-F385 HydrophobicContact CE1-CZ 3.09Å; F377-F385 HydrophobicContact CZ-CE1 4.45Å; F377-F385 AromaticContact CZ-CE2 3.79Å; F377-F385 HydrophobicContact CZ-CE2 3.79Å; F377-F385 AromaticContact CZ-CZ 3.74Å; F377-F385 HydrophobicContact CZ-CZ 3.74Å
378	T	50.7	Low	63.8	Low	103 Å²	103	79 Å²	79	63%	0.632	41%	0.405	S	S	*	.	H	α-helix	trans	-91.7	-25.3	177.3	-52.3	0	0	0	0	111.6	L374 R375 S376 W380	L374-T378 WeakPolarHBondContact O-CB 3.29Å; L374-T378 PolarHBondContact O-N 3.41Å; L374-T378 PolarHBondContact O-OG1 2.98Å; R375-T378 PolarHBondContact O-N 3.3Å; S376-T378 PolarHBondContact O-N 2.02Å; T378-W380 VanDerWaalsContact C-N 3.34Å
379	Q	60.8	Low	65.6	Low	158 Å²	158	77.3 Å²	77.3	74%	0.738	40%	0.4	S	S	*	.	H	α-helix	trans	-66.2	-37.4	171.6	-81.2	-178.1	-19.3	0	0	111.7	R375 S376	R375-Q379 PolarHBondContact O-N 3.15Å; S376-Q379 PolarHBondContact O-N 2.78Å
380	W	58.5	Low	67.6	Low	150 Å²	150	72.9 Å²	72.9	57%	0.568	37%	0.369	S	S	*	.	S	Bend	trans	-85.5	110.5	170	-67.4	54.2	0	0	0	107.1	S376 T378	S376-W380 PolarHBondContact O-N 3.22Å; T378-W380 VanDerWaalsContact C-N 3.34Å
381	G	75.6	Confident	69.4	Low	12 Å²	12	69.1 Å²	69.1	12%	0.124	35%	0.354	C	S	.	.			trans	-48.1	139.1	-176.5	0	0	0	0	0	112	V383 K384 F385	G381-V383 PolarHBondContact O-N 2.83Å; G381-K384 WeakPolarHBondContact O-CA 3.26Å; G381-K384 WeakPolarHBondContact O-CB 3.2Å; G381-K384 PolarHBondContact O-N 3.46Å; G381-F385 PolarHBondContact O-N 3.28Å
382	P	81.5	Confident	71.1	Confident	60 Å²	60	70.7 Å²	70.7	39%	0.39	36%	0.361	S	S	.	.	H	α-helix	trans	-53.4	-34.5	-167.3	19.3	-33.8	0	0	0	113.4	F385 I386	P382-F385 PolarHBondContact O-N 2.82Å; P382-I386 VanDerWaalsContact O-CG1 3.29Å; P382-I386 WeakPolarHBondContact O-CG1 3.26Å; P382-I386 PolarHBondContact O-N 3.47Å
383	V	82.6	Confident	72.5	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-61.8	-42.7	174.9	178.9	0	0	0	0	112.4	I109 C110 Y157 G381 F385 I386 L387	I109-V383 HydrophobicContact CB-CG2 3.97Å; I109-V383 HydrophobicContact CG2-CG2 3.48Å; I109-V383 VanDerWaalsContact CG2-CG2 3.48Å; C110-V383 WeakPolarHBondContact SG-CG1 3.21Å; Y157-V383 HydrophobicContact CD2-CG1 4.23Å; Y157-V383 HydrophobicContact CG-CG1 4.08Å; G381-V383 PolarHBondContact O-N 2.83Å; V383-F385 VanDerWaalsContact C-N 3.29Å; V383-F385 PolarHBondContact O-N 2.97Å; V383-I386 PolarHBondContact O-N 2.98Å; V383-L387 WeakPolarHBondContact O-CB 3.37Å; V383-L387 PolarHBondContact O-N 2.81Å
384	K	86.1	Confident	73.9	Confident	67 Å²	67	68.8 Å²	68.8	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-41.7	179	-54	-166.9	-169.2	-157.6	0	110.6	E153 Y157 G381 L387 L388	E153-K384 WeakPolarHBondContact OE1-CE 3.39Å; E153-K384 IonicContact OE1-NZ 3.37Å; E153-K384 PolarHBondContact OE1-NZ 3.28Å; E153-K384 IonicContact OE2-NZ 3.94Å; Y157-K384 HydrophobicContact CE1-CG 4.38Å; Y157-K384 HydrophobicContact CE2-CD 4.18Å; Y157-K384 HydrophobicContact CE2-CG 3.76Å; Y157-K384 VanDerWaalsContact OH-CD 3.23Å; Y157-K384 WeakPolarHBondContact OH-CD 3.49Å; Y157-K384 WeakPolarHBondContact OH-CE 3.34Å; Y157-K384 PolarHBondContact OH-NZ 2.92Å; Y157-K384 VanDerWaalsContact OH-NZ 3.12Å; G381-K384 WeakPolarHBondContact O-CA 3.26Å; G381-K384 WeakPolarHBondContact O-CB 3.2Å; G381-K384 PolarHBondContact O-N 3.46Å; K384-L387 PolarHBondContact O-N 2.9Å; K384-L388 VanDerWaalsContact O-CB 3.32Å; K384-L388 WeakPolarHBondContact O-CB 3.31Å; K384-L388 PolarHBondContact O-N 2.9Å
385	F	83.3	Confident	75.5	Confident	72 Å²	72	69 Å²	69	32%	0.316	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-48.3	176.8	-179	-95.5	0	0	0	111.5	F377 G381 P382 V383 L387 L388 C389	F377-F385 HydrophobicContact CD1-CD1 4.11Å; F377-F385 AromaticContact CD1-CD2 3.76Å; F377-F385 HydrophobicContact CD1-CD2 3.76Å; F377-F385 HydrophobicContact CD1-CE1 4.12Å; F377-F385 AromaticContact CD1-CE2 3.77Å; F377-F385 HydrophobicContact CD1-CE2 3.77Å; F377-F385 AromaticContact CD1-CG 3.95Å; F377-F385 HydrophobicContact CD1-CG 3.95Å; F377-F385 AromaticContact CD1-CZ 3.98Å; F377-F385 HydrophobicContact CD1-CZ 3.98Å; F377-F385 AromaticContact CE1-CD1 3.92Å; F377-F385 HydrophobicContact CE1-CD1 3.92Å; F377-F385 AromaticContact CE1-CD2 3.67Å; F377-F385 HydrophobicContact CE1-CD2 3.67Å; F377-F385 AromaticContact CE1-CE1 3.46Å; F377-F385 HydrophobicContact CE1-CE1 3.46Å; F377-F385 VanDerWaalsContact CE1-CE1 3.46Å; F377-F385 AromaticContact CE1-CE2 3.18Å; F377-F385 HydrophobicContact CE1-CE2 3.18Å; F377-F385 HydrophobicContact CE1-CG 4.03Å; F377-F385 AromaticContact CE1-CZ 3.09Å; F377-F385 HydrophobicContact CE1-CZ 3.09Å; F377-F385 HydrophobicContact CZ-CE1 4.45Å; F377-F385 AromaticContact CZ-CE2 3.79Å; F377-F385 HydrophobicContact CZ-CE2 3.79Å; F377-F385 AromaticContact CZ-CZ 3.74Å; F377-F385 HydrophobicContact CZ-CZ 3.74Å; G381-F385 PolarHBondContact O-N 3.28Å; P382-F385 PolarHBondContact O-N 2.82Å; V383-F385 VanDerWaalsContact C-N 3.29Å; V383-F385 PolarHBondContact O-N 2.97Å; F385-L387 VanDerWaalsContact C-N 3.3Å; F385-L387 PolarHBondContact O-N 3.32Å; F385-L388 PolarHBondContact O-N 2.79Å; F385-C389 WeakPolarHBondContact CE1-SG 3.21Å; F385-C389 WeakPolarHBondContact CZ-SG 3.46Å; F385-C389 PolarHBondContact O-N 3.47Å; F385-C389 PolarHBondContact O-SG 3.27Å
386	I	87	Confident	76.7	Confident	25 Å²	25	67.8 Å²	67.8	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-57.1	-46	177.1	-67.6	164.8	0	0	0	110.7	L102 A106 I109 P382 V383 C389 I390	L102-I386 HydrophobicContact CB-CG2 3.96Å; A106-I386 HydrophobicContact CB-CG2 4.04Å; I109-I386 HydrophobicContact CD1-CD1 4.26Å; P382-I386 VanDerWaalsContact O-CG1 3.29Å; P382-I386 WeakPolarHBondContact O-CG1 3.26Å; P382-I386 PolarHBondContact O-N 3.47Å; V383-I386 PolarHBondContact O-N 2.98Å; I386-C389 WeakPolarHBondContact O-CB 3.37Å; I386-C389 PolarHBondContact O-N 3.22Å; I386-I390 HydrophobicContact CG2-CD1 3.76Å; I386-I390 HydrophobicContact CG2-CG1 4.42Å; I386-I390 VanDerWaalsContact O-CG1 3.29Å; I386-I390 WeakPolarHBondContact O-CG1 3.4Å; I386-I390 PolarHBondContact O-N 2.92Å
387	L	85.3	Confident	77.9	Confident	24 Å²	24	66.8 Å²	66.8	13%	0.126	34%	0.337	C	S	.	.	H	α-helix	trans	-66.2	-40.1	-179.2	-157.8	73.5	0	0	0	112.4	Y157 F160 F164 V383 K384 F385 I390 S391	Y157-L387 HydrophobicContact CD1-CD2 4.21Å; F160-L387 HydrophobicContact CB-CD1 4.05Å; F160-L387 HydrophobicContact CB-CD2 3.81Å; F160-L387 HydrophobicContact CD2-CD2 4.4Å; F160-L387 HydrophobicContact CG-CD2 4.25Å; F164-L387 HydrophobicContact CD2-CD1 3.63Å; F164-L387 HydrophobicContact CE2-CD1 3.54Å; F164-L387 HydrophobicContact CE2-CG 4.13Å; V383-L387 WeakPolarHBondContact O-CB 3.37Å; V383-L387 PolarHBondContact O-N 2.81Å; K384-L387 PolarHBondContact O-N 2.9Å; F385-L387 VanDerWaalsContact C-N 3.3Å; F385-L387 PolarHBondContact O-N 3.32Å; L387-I390 PolarHBondContact O-N 3.22Å; L387-S391 WeakPolarHBondContact O-CB 3.39Å; L387-S391 PolarHBondContact O-N 3.02Å
388	L	86.5	Confident	79	Confident	78 Å²	78	65.3 Å²	65.3	41%	0.408	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-44.4	174.1	-178.5	67.5	0	0	0	111.1	K384 F385 S391 M392	K384-L388 VanDerWaalsContact O-CB 3.32Å; K384-L388 WeakPolarHBondContact O-CB 3.31Å; K384-L388 PolarHBondContact O-N 2.9Å; F385-L388 PolarHBondContact O-N 2.79Å; L388-S391 PolarHBondContact O-N 3.11Å; L388-M392 WeakPolarHBondContact O-CG 3.38Å; L388-M392 PolarHBondContact O-N 3.12Å
389	C	84.9	Confident	80.1	Confident	39 Å²	39	64.3 Å²	64.3	26%	0.264	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-46.8	175.4	-76.8	0	0	0	0	112.2	F385 I386 S391 M392 V393	F385-C389 WeakPolarHBondContact CE1-SG 3.21Å; F385-C389 WeakPolarHBondContact CZ-SG 3.46Å; F385-C389 PolarHBondContact O-N 3.47Å; F385-C389 PolarHBondContact O-SG 3.27Å; I386-C389 WeakPolarHBondContact O-CB 3.37Å; I386-C389 PolarHBondContact O-N 3.22Å; C389-S391 VanDerWaalsContact C-N 3.31Å; C389-S391 PolarHBondContact O-N 3.21Å; C389-M392 PolarHBondContact O-N 3.12Å; C389-V393 WeakPolarHBondContact O-CB 3.5Å; C389-V393 VanDerWaalsContact O-CG2 3.27Å; C389-V393 WeakPolarHBondContact O-CG2 3.14Å; C389-V393 PolarHBondContact O-N 3.41Å
390	I	88.4	Confident	80.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.3	-46.6	176.7	-70.1	164.9	0	0	0	110.2	V99 L102 F164 I386 L387 M392 V393 I394	V99-I390 HydrophobicContact CG1-CG2 3.86Å; V99-I390 HydrophobicContact CG2-CG2 4.34Å; L102-I390 HydrophobicContact CB-CD1 3.8Å; L102-I390 HydrophobicContact CB-CG1 3.99Å; L102-I390 HydrophobicContact CD1-CG1 4.27Å; F164-I390 HydrophobicContact CB-CG2 4.31Å; F164-I390 HydrophobicContact CD1-CG2 3.8Å; F164-I390 HydrophobicContact CD2-CG2 3.9Å; F164-I390 HydrophobicContact CE1-CG2 4.04Å; F164-I390 HydrophobicContact CE2-CG2 4.12Å; F164-I390 HydrophobicContact CG-CG2 3.74Å; F164-I390 HydrophobicContact CZ-CG2 4.18Å; I386-I390 HydrophobicContact CG2-CD1 3.76Å; I386-I390 HydrophobicContact CG2-CG1 4.42Å; I386-I390 VanDerWaalsContact O-CG1 3.29Å; I386-I390 WeakPolarHBondContact O-CG1 3.4Å; I386-I390 PolarHBondContact O-N 2.92Å; L387-I390 PolarHBondContact O-N 3.22Å; I390-M392 PolarHBondContact O-N 2.88Å; I390-V393 PolarHBondContact O-N 3.42Å; I390-I394 HydrophobicContact CG2-CD1 3.58Å; I390-I394 HydrophobicContact CG2-CG1 4.37Å; I390-I394 WeakPolarHBondContact O-CB 3.08Å; I390-I394 VanDerWaalsContact O-CG1 3.29Å; I390-I394 WeakPolarHBondContact O-CG1 3.16Å; I390-I394 PolarHBondContact O-N 2.73Å
391	S	85.9	Confident	81.3	Confident	49 Å²	49	54 Å²	54	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-45	178.5	-179	0	0	0	0	112.1	L387 L388 C389 I394 L395	L387-S391 WeakPolarHBondContact O-CB 3.39Å; L387-S391 PolarHBondContact O-N 3.02Å; L388-S391 PolarHBondContact O-N 3.11Å; C389-S391 VanDerWaalsContact C-N 3.31Å; C389-S391 PolarHBondContact O-N 3.21Å; S391-I394 PolarHBondContact O-N 3.28Å; S391-L395 WeakPolarHBondContact O-CB 3.28Å; S391-L395 VanDerWaalsContact O-CG 3.32Å; S391-L395 WeakPolarHBondContact O-CG 3.03Å; S391-L395 PolarHBondContact O-N 2.79Å
392	M	82.3	Confident	81	Confident	119 Å²	119	62.2 Å²	62.2	59%	0.586	32%	0.316	S	S	*	.	H	α-helix	trans	-63.3	-42.3	176.9	-72	-63.5	-162.5	0	0	112.5	L388 C389 I390 L395 F396	L388-M392 WeakPolarHBondContact O-CG 3.38Å; L388-M392 PolarHBondContact O-N 3.12Å; C389-M392 PolarHBondContact O-N 3.12Å; I390-M392 PolarHBondContact O-N 2.88Å; M392-L395 PolarHBondContact O-N 3.18Å; M392-F396 WeakPolarHBondContact O-CB 3.15Å; M392-F396 PolarHBondContact O-N 3.34Å
393	V	83.9	Confident	80.2	Confident	45 Å²	45	66.2 Å²	66.2	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-42.9	178	169.9	0	0	0	0	111	I95 V99 C389 I390 F396 F397	I95-V393 HydrophobicContact CG1-CG1 4.34Å; I95-V393 HydrophobicContact CG2-CG1 3.79Å; V99-V393 HydrophobicContact CG2-CG1 4.42Å; C389-V393 WeakPolarHBondContact O-CB 3.5Å; C389-V393 VanDerWaalsContact O-CG2 3.27Å; C389-V393 WeakPolarHBondContact O-CG2 3.14Å; C389-V393 PolarHBondContact O-N 3.41Å; I390-V393 PolarHBondContact O-N 3.42Å; V393-F396 PolarHBondContact O-N 2.93Å; V393-F397 VanDerWaalsContact O-CB 3.32Å; V393-F397 WeakPolarHBondContact O-CB 3.3Å; V393-F397 PolarHBondContact O-N 3.4Å
394	I	82.1	Confident	79.2	Confident	57 Å²	57	68.7 Å²	68.7	29%	0.292	35%	0.35	S	S	.	.	H	α-helix	trans	-66.5	-42.6	177.7	-68.9	168.4	0	0	0	110.9	V99 F164 I390 S391 F397 S398	V99-I394 HydrophobicContact CG1-CD1 4.12Å; V99-I394 HydrophobicContact CG2-CD1 4.37Å; V99-I394 HydrophobicContact CG2-CG1 4.07Å; F164-I394 HydrophobicContact CD1-CD1 3.36Å; F164-I394 HydrophobicContact CE1-CD1 3.3Å; F164-I394 HydrophobicContact CG-CD1 4.46Å; F164-I394 HydrophobicContact CZ-CD1 4.34Å; I390-I394 HydrophobicContact CG2-CD1 3.58Å; I390-I394 HydrophobicContact CG2-CG1 4.37Å; I390-I394 WeakPolarHBondContact O-CB 3.08Å; I390-I394 VanDerWaalsContact O-CG1 3.29Å; I390-I394 WeakPolarHBondContact O-CG1 3.16Å; I390-I394 PolarHBondContact O-N 2.73Å; S391-I394 PolarHBondContact O-N 3.28Å; I394-F397 PolarHBondContact O-N 3.15Å; I394-S398 WeakPolarHBondContact O-CB 3.02Å; I394-S398 PolarHBondContact O-N 2.98Å; I394-S398 PolarHBondContact O-OG 3.49Å
395	L	81.7	Confident	78.1	Confident	93 Å²	93	70 Å²	70	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-48.7	176.2	-76.2	172	0	0	0	110.9	S391 M392 F397 S398 V399	S391-L395 WeakPolarHBondContact O-CB 3.28Å; S391-L395 VanDerWaalsContact O-CG 3.32Å; S391-L395 WeakPolarHBondContact O-CG 3.03Å; S391-L395 PolarHBondContact O-N 2.79Å; M392-L395 PolarHBondContact O-N 3.18Å; L395-F397 VanDerWaalsContact C-N 3.32Å; L395-F397 PolarHBondContact O-N 3.18Å; L395-S398 PolarHBondContact O-N 3.07Å; L395-S398 PolarHBondContact O-OG 2.82Å; L395-V399 WeakPolarHBondContact O-CG2 3.5Å; L395-V399 PolarHBondContact O-N 3.41Å
396	F	78.8	Confident	76.7	Confident	121 Å²	121	68.9 Å²	68.9	53%	0.531	37%	0.366	S	S	.	.	H	α-helix	trans	-57.8	-45.4	176.2	-179	-99.7	0	0	0	111.8	M392 V393 S398 V399 Y400	M392-F396 WeakPolarHBondContact O-CB 3.15Å; M392-F396 PolarHBondContact O-N 3.34Å; V393-F396 PolarHBondContact O-N 2.93Å; F396-S398 PolarHBondContact O-N 3.08Å; F396-V399 PolarHBondContact O-N 3.25Å; F396-Y400 WeakPolarHBondContact O-CB 3.3Å; F396-Y400 PolarHBondContact O-N 3.21Å
397	F	76.8	Confident	75.1	Confident	41 Å²	41	74.7 Å²	74.7	18%	0.18	39%	0.392	C	S	.	.	H	α-helix	trans	-62.5	-42.2	176.5	-175.5	-110.7	0	0	0	112.3	I95 V393 I394 L395 V399 Y400 V401 F637	I95-F397 HydrophobicContact CD1-CB 4.06Å; I95-F397 HydrophobicContact CD1-CD2 3.38Å; I95-F397 HydrophobicContact CD1-CE2 4.11Å; I95-F397 HydrophobicContact CD1-CG 3.99Å; I95-F397 HydrophobicContact CG2-CB 4.4Å; I95-F397 HydrophobicContact CG2-CD2 4.49Å; I95-F397 HydrophobicContact CG2-CG 4.29Å; V393-F397 VanDerWaalsContact O-CB 3.32Å; V393-F397 WeakPolarHBondContact O-CB 3.3Å; V393-F397 PolarHBondContact O-N 3.4Å; I394-F397 PolarHBondContact O-N 3.15Å; L395-F397 VanDerWaalsContact C-N 3.32Å; L395-F397 PolarHBondContact O-N 3.18Å; F397-V399 PolarHBondContact O-N 3.23Å; F397-Y400 PolarHBondContact O-N 2.71Å; F397-V401 HydrophobicContact CD1-CG2 4.05Å; F397-V401 HydrophobicContact CD2-CG2 4.07Å; F397-V401 HydrophobicContact CE1-CG2 3.67Å; F397-V401 HydrophobicContact CE2-CG2 3.71Å; F397-V401 HydrophobicContact CG-CG2 4.25Å; F397-V401 HydrophobicContact CZ-CG2 3.5Å; F397-V401 VanDerWaalsContact CZ-CG2 3.5Å; F397-V401 WeakPolarHBondContact O-CB 3.01Å; F397-V401 VanDerWaalsContact O-CG2 3.29Å; F397-V401 WeakPolarHBondContact O-CG2 3.46Å; F397-V401 PolarHBondContact O-N 2.69Å; F397-F637 HydrophobicContact CZ-CD1 4.23Å; F397-F637 AromaticContact CZ-CE1 3.84Å; F397-F637 HydrophobicContact CZ-CE1 3.84Å
398	S	75.5	Confident	73.8	Confident	57 Å²	57	80.6 Å²	80.6	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-41	179.4	72.2	0	0	0	0	112.3	I394 L395 F396 Y402	I394-S398 WeakPolarHBondContact O-CB 3.02Å; I394-S398 PolarHBondContact O-N 2.98Å; I394-S398 PolarHBondContact O-OG 3.49Å; L395-S398 PolarHBondContact O-N 3.07Å; L395-S398 PolarHBondContact O-OG 2.82Å; F396-S398 PolarHBondContact O-N 3.08Å; S398-Y402 VanDerWaalsContact O-CB 3.26Å; S398-Y402 WeakPolarHBondContact O-CB 3.49Å; S398-Y402 PolarHBondContact O-N 3.39Å
399	V	75.7	Confident	72.7	Confident	82 Å²	82	79.6 Å²	79.6	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-43.6	175.1	172.6	0	0	0	0	110.2	L395 F396 F397 Y402 H403	L395-V399 WeakPolarHBondContact O-CG2 3.5Å; L395-V399 PolarHBondContact O-N 3.41Å; F396-V399 PolarHBondContact O-N 3.25Å; F397-V399 PolarHBondContact O-N 3.23Å; V399-Y402 PolarHBondContact O-N 2.99Å; V399-H403 PolarHBondContact O-CD2 3.32Å; V399-H403 VanDerWaalsContact O-CD2 3.26Å; V399-H403 PolarHBondContact O-N 3.35Å
400	Y	72.4	Confident	71.8	Confident	75 Å²	75	83.8 Å²	83.8	29%	0.294	43%	0.425	S	S	.	.	H	α-helix	trans	-62.9	-47.1	178	-175.3	-96.8	0	0	0	112.2	V88 F396 F397 H403 A404	V88-Y400 HydrophobicContact CG1-CE1 4.35Å; V88-Y400 HydrophobicContact CG2-CE1 4.03Å; V88-Y400 VanDerWaalsContact CG2-OH 3.26Å; V88-Y400 WeakPolarHBondContact CG2-OH 3.42Å; F396-Y400 WeakPolarHBondContact O-CB 3.3Å; F396-Y400 PolarHBondContact O-N 3.21Å; F397-Y400 PolarHBondContact O-N 2.71Å; Y400-H403 PolarHBondContact O-N 2.9Å; Y400-A404 VanDerWaalsContact O-CB 3.3Å; Y400-A404 WeakPolarHBondContact O-CB 3.13Å; Y400-A404 PolarHBondContact O-N 2.97Å
401	V	70.7	Confident	71.2	Confident	16 Å²	16	90.1 Å²	90.1	10%	0.097	46%	0.459	C	S	.	.	H	α-helix	trans	-63.4	-41.1	176.5	171.7	0	0	0	0	111	F397 H403 A404 E405 F637	F397-V401 HydrophobicContact CD1-CG2 4.05Å; F397-V401 HydrophobicContact CD2-CG2 4.07Å; F397-V401 HydrophobicContact CE1-CG2 3.67Å; F397-V401 HydrophobicContact CE2-CG2 3.71Å; F397-V401 HydrophobicContact CG-CG2 4.25Å; F397-V401 HydrophobicContact CZ-CG2 3.5Å; F397-V401 VanDerWaalsContact CZ-CG2 3.5Å; F397-V401 WeakPolarHBondContact O-CB 3.01Å; F397-V401 VanDerWaalsContact O-CG2 3.29Å; F397-V401 WeakPolarHBondContact O-CG2 3.46Å; F397-V401 PolarHBondContact O-N 2.69Å; V401-H403 VanDerWaalsContact C-N 3.28Å; V401-H403 PolarHBondContact O-N 3.34Å; V401-A404 PolarHBondContact O-N 3.18Å; V401-A404 VanDerWaalsContact O-N 3.11Å; V401-E405 HydrophobicContact CG1-CG 4.11Å; V401-E405 WeakPolarHBondContact O-CB 3.29Å; V401-E405 PolarHBondContact O-N 3.48Å; V401-F637 HydrophobicContact CG1-CB 3.87Å; V401-F637 HydrophobicContact CG1-CD1 4.34Å; V401-F637 HydrophobicContact CG1-CD2 4.1Å; V401-F637 HydrophobicContact CG1-CG 3.86Å; V401-F637 HydrophobicContact CG2-CD1 4.19Å; V401-F637 HydrophobicContact CG2-CE1 4.21Å; V401-F637 HydrophobicContact CG2-CG 4.45Å; V401-F637 HydrophobicContact CG2-CZ 4.47Å
402	Y	69.1	Low	70.7	Confident	185 Å²	185	89.4 Å²	89.4	73%	0.725	45%	0.454	S	S	*	.	H	α-helix	trans	-58.9	-40.3	175.5	179.3	-98.5	0	0	0	112.1	S398 V399	S398-Y402 VanDerWaalsContact O-CB 3.26Å; S398-Y402 WeakPolarHBondContact O-CB 3.49Å; S398-Y402 PolarHBondContact O-N 3.39Å; V399-Y402 PolarHBondContact O-N 2.99Å
403	H	65.7	Low	70.8	Confident	144 Å²	144	90.5 Å²	90.5	67%	0.667	47%	0.468	S	S	*	.	H	α-helix	trans	-72.9	-33	174.2	-81.8	-68.7	0	0	0	113.2	V399 Y400 V401	V399-H403 PolarHBondContact O-CD2 3.32Å; V399-H403 VanDerWaalsContact O-CD2 3.26Å; V399-H403 PolarHBondContact O-N 3.35Å; Y400-H403 PolarHBondContact O-N 2.9Å; V401-H403 VanDerWaalsContact C-N 3.28Å; V401-H403 PolarHBondContact O-N 3.34Å
404	A	62.3	Low	71	Confident	53 Å²	53	90.2 Å²	90.2	44%	0.438	47%	0.465	S	S	.	.	H	α-helix	trans	-80.3	-33.3	-177.2	0	0	0	0	0	113.9	Y400 V401 G406	Y400-A404 VanDerWaalsContact O-CB 3.3Å; Y400-A404 WeakPolarHBondContact O-CB 3.13Å; Y400-A404 PolarHBondContact O-N 2.97Å; V401-A404 PolarHBondContact O-N 3.18Å; V401-A404 VanDerWaalsContact O-N 3.11Å; A404-G406 PolarHBondContact O-N 3.47Å
405	E	61.5	Low	71.3	Confident	94 Å²	94	90.7 Å²	90.7	44%	0.439	47%	0.47	S	S	.	.	S	Bend	trans	-67.2	-20.8	-175.4	-93.5	-168.4	144.3	0	0	113.1	V401 F637 R638	V401-E405 HydrophobicContact CG1-CG 4.11Å; V401-E405 WeakPolarHBondContact O-CB 3.29Å; V401-E405 PolarHBondContact O-N 3.48Å; E405-F637 HydrophobicContact CG-CB 4.42Å; E405-F637 HydrophobicContact CG-CD2 4.16Å; E405-F637 VanDerWaalsContact OE1-CB 3.32Å; E405-F637 WeakPolarHBondContact OE1-CB 3.11Å; E405-R638 PolarHBondContact OE1-N 3.33Å
406	G	54.5	Low	71.5	Confident	49 Å²	49	88 Å²	88	51%	0.505	45%	0.454	S	S	.	.			trans	56	178.4	177.2	0	0	0	0	0	113.9	A404	A404-G406 PolarHBondContact O-N 3.47Å
407	Q	53.2	Low	71.8	Confident	148 Å²	148	86.2 Å²	86.2	69%	0.692	45%	0.449	S	S	*	.	S	Bend	trans	-57.9	140.9	-176.6	-68.8	-84.6	-39.4	0	0	112.5	V409	Q407-V409 PolarHBondContact O-N 3.29Å
408	K	57.3	Low	72.4	Confident	147 Å²	147	89.1 Å²	89.1	64%	0.639	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-48.4	126.9	177	-68.3	179.2	-178.5	175.6	0	110.4	Y410	K408-Y410 HydrophobicContact CB-CE2 4.37Å
409	V	63.8	Low	73	Confident	58 Å²	58	86.7 Å²	86.7	35%	0.352	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-85	122.6	179.1	-177.2	0	0	0	0	109.8	Q407 G445 R447 K598	Q407-V409 PolarHBondContact O-N 3.29Å; V409-G445 WeakPolarHBondContact CA-O 3.14Å; V409-R447 HydrophobicContact CG1-CB 3.5Å; V409-R447 HydrophobicContact CG1-CG 4.49Å; V409-K598 HydrophobicContact CG2-CD 4.28Å
410	Y	66.4	Low	73.5	Confident	126 Å²	126	83.8 Å²	83.8	49%	0.494	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.8	175.6	-59.9	-77.2	0	0	0	110.1	K408 S412 G445 H446 R447	K408-Y410 HydrophobicContact CB-CE2 4.37Å; Y410-S412 PolarHBondContact O-N 2.78Å; Y410-G445 PolarHBondContact N-O 3.38Å; Y410-H446 CarbonylContact O-C 3.55Å; Y410-H446 WeakPolarHBondContact O-CA 3.3Å; Y410-R447 PolarHBondContact O-N 3.23Å
411	N	76.2	Confident	74.2	Confident	134 Å²	134	87 Å²	87	72%	0.717	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.7	171	-70.1	-21.4	0	0	0	108.6
412	S	76	Confident	75.1	Confident	34 Å²	34	88.2 Å²	88.2	24%	0.238	46%	0.458	C	S	.	.			trans	-132.7	138.9	179.9	-69.2	0	0	0	0	111.5	Y410 L414 H446 R447	Y410-S412 PolarHBondContact O-N 2.78Å; S412-L414 PolarHBondContact O-N 3.32Å; S412-H446 PolarHBondContact OG-ND1 3.01Å; S412-R447 PolarHBondContact N-O 3.48Å
413	T	83.6	Confident	76	Confident	142 Å²	142	79.4 Å²	79.4	87%	0.871	42%	0.424	S	S	*	.			trans	-82.2	23.1	177.5	50.6	0	0	0	0	112.5	T415	T413-T415 PolarHBondContact O-N 3.3Å
414	L	87.6	Confident	77	Confident	39 Å²	39	72.8 Å²	72.8	20%	0.204	39%	0.394	C	S	.	.			trans	-68	118.5	-176.7	-175.9	70.8	0	0	0	110.2	S412 Q418 Y419 L443 V448 W450 L599	S412-L414 PolarHBondContact O-N 3.32Å; L414-Q418 HydrophobicContact CD1-CB 3.77Å; L414-Y419 HydrophobicContact CD2-CD2 4.16Å; L414-L443 HydrophobicContact CD2-CD1 4.15Å; L414-V448 HydrophobicContact CB-CG1 4.12Å; L414-W450 PolarHBondContact O-NE1 2.88Å; L414-L599 HydrophobicContact CD2-CD1 4.44Å
415	T	88.2	Confident	78	Confident	67 Å²	67	71.5 Å²	71.5	41%	0.411	38%	0.382	S	S	.	.			trans	-78.5	154.9	177.2	62.7	0	0	0	0	111.3	T413 N417 Q418 Y419	T413-T415 PolarHBondContact O-N 3.3Å; T415-N417 VanDerWaalsContact C-N 3.27Å; T415-N417 PolarHBondContact O-N 2.8Å; T415-Q418 PolarHBondContact O-N 3.24Å; T415-Q418 VanDerWaalsContact OG1-CD 3.23Å; T415-Q418 VanDerWaalsContact OG1-CG 3.28Å; T415-Q418 WeakPolarHBondContact OG1-CG 3.3Å; T415-Q418 PolarHBondContact OG1-N 2.92Å; T415-Q418 PolarHBondContact OG1-OE1 3.29Å; T415-Q418 VanDerWaalsContact OG1-OE1 3.04Å; T415-Y419 PolarHBondContact O-N 3.35Å; T415-Y419 VanDerWaalsContact O-N 3.09Å
416	W	85.9	Confident	79.1	Confident	36 Å²	36	70 Å²	70	14%	0.136	38%	0.38	C	S	.	.	H	α-helix	trans	-57.3	-41.1	176.6	170.8	-100.6	0	0	0	112.3	Q418 Y419 S420 W450 I557 I572	W416-Q418 VanDerWaalsContact C-N 3.32Å; W416-Q418 PolarHBondContact O-N 3.48Å; W416-Y419 AromaticContact CE3-CD1 3.83Å; W416-Y419 HydrophobicContact CE3-CD1 3.83Å; W416-Y419 HydrophobicContact CH2-CD1 4.19Å; W416-Y419 HydrophobicContact CH2-CE1 4.32Å; W416-Y419 AromaticContact CZ3-CD1 3.58Å; W416-Y419 HydrophobicContact CZ3-CD1 3.58Å; W416-Y419 AromaticContact CZ3-CE1 3.88Å; W416-Y419 HydrophobicContact CZ3-CE1 3.88Å; W416-Y419 CarbonylContact O-C 3.52Å; W416-Y419 WeakPolarHBondContact O-CB 3.19Å; W416-Y419 PolarHBondContact O-N 2.88Å; W416-Y419 VanDerWaalsContact O-N 3.14Å; W416-S420 WeakPolarHBondContact O-CB 3.37Å; W416-S420 PolarHBondContact O-N 3.4Å; W416-W450 HydrophobicContact CB-CD2 4.23Å; W416-W450 HydrophobicContact CB-CG 4.22Å; W416-W450 HydrophobicContact CE3-CD2 4.08Å; W416-W450 AromaticContact CE3-CE3 3.66Å; W416-W450 HydrophobicContact CE3-CE3 3.66Å; W416-W450 AromaticContact CE3-CH2 3.55Å; W416-W450 HydrophobicContact CE3-CH2 3.55Å; W416-W450 AromaticContact CE3-CZ2 3.98Å; W416-W450 HydrophobicContact CE3-CZ2 3.98Å; W416-W450 AromaticContact CE3-CZ3 3.39Å; W416-W450 HydrophobicContact CE3-CZ3 3.39Å; W416-W450 HydrophobicContact CZ3-CE3 4.16Å; W416-W450 AromaticContact CZ3-CH2 3.8Å; W416-W450 HydrophobicContact CZ3-CH2 3.8Å; W416-W450 AromaticContact CZ3-CZ3 3.54Å; W416-W450 HydrophobicContact CZ3-CZ3 3.54Å; W416-I557 HydrophobicContact CD2-CD1 3.25Å; W416-I557 HydrophobicContact CE3-CD1 3.88Å; W416-I557 HydrophobicContact CG-CD1 3.61Å; W416-I557 HydrophobicContact CG-CG2 4.08Å; W416-I557 HydrophobicContact CH2-CD1 3.78Å; W416-I557 HydrophobicContact CZ2-CD1 3.17Å; W416-I557 HydrophobicContact CZ3-CD1 4.12Å; W416-I572 HydrophobicContact CD2-CD1 4.27Å; W416-I572 HydrophobicContact CE3-CD1 3.67Å; W416-I572 HydrophobicContact CE3-CG1 4.36Å; W416-I572 HydrophobicContact CH2-CD1 3.81Å; W416-I572 HydrophobicContact CH2-CG1 3.56Å; W416-I572 HydrophobicContact CZ2-CD1 4.42Å; W416-I572 HydrophobicContact CZ2-CG1 4.29Å; W416-I572 HydrophobicContact CZ3-CD1 3.42Å; W416-I572 VanDerWaalsContact CZ3-CD1 3.42Å; W416-I572 HydrophobicContact CZ3-CG1 3.63Å
417	N	86	Confident	80.5	Confident	83 Å²	83	68 Å²	68	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-42.3	-178.1	-70.6	-23.2	0	0	0	111.7	T415 S420 Q421	T415-N417 VanDerWaalsContact C-N 3.27Å; T415-N417 PolarHBondContact O-N 2.8Å; N417-S420 PolarHBondContact O-N 2.75Å; N417-Q421 VanDerWaalsContact O-CG 3.31Å; N417-Q421 WeakPolarHBondContact O-CG 3.34Å; N417-Q421 PolarHBondContact O-N 3.35Å
418	Q	88.7	Confident	82	Confident	103 Å²	103	63.2 Å²	63.2	48%	0.481	34%	0.335	S	S	.	.	H	α-helix	trans	-64.4	-41.9	174.9	-71.6	166.9	-24.7	0	0	111.7	L414 T415 W416 A422	L414-Q418 HydrophobicContact CD1-CB 3.77Å; T415-Q418 PolarHBondContact O-N 3.24Å; T415-Q418 VanDerWaalsContact OG1-CD 3.23Å; T415-Q418 VanDerWaalsContact OG1-CG 3.28Å; T415-Q418 WeakPolarHBondContact OG1-CG 3.3Å; T415-Q418 PolarHBondContact OG1-N 2.92Å; T415-Q418 PolarHBondContact OG1-OE1 3.29Å; T415-Q418 VanDerWaalsContact OG1-OE1 3.04Å; W416-Q418 VanDerWaalsContact C-N 3.32Å; W416-Q418 PolarHBondContact O-N 3.48Å; Q418-A422 PolarHBondContact O-N 2.86Å
419	Y	88.5	Confident	83.3	Confident	5 Å²	5	64.3 Å²	64.3	2%	0.02	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-47.2	176	177.9	-97.4	0	0	0	112	L414 T415 W416 Q421 A422 C423 L443 W450 L599 F610	L414-Y419 HydrophobicContact CD2-CD2 4.16Å; T415-Y419 PolarHBondContact O-N 3.35Å; T415-Y419 VanDerWaalsContact O-N 3.09Å; W416-Y419 AromaticContact CE3-CD1 3.83Å; W416-Y419 HydrophobicContact CE3-CD1 3.83Å; W416-Y419 HydrophobicContact CH2-CD1 4.19Å; W416-Y419 HydrophobicContact CH2-CE1 4.32Å; W416-Y419 AromaticContact CZ3-CD1 3.58Å; W416-Y419 HydrophobicContact CZ3-CD1 3.58Å; W416-Y419 AromaticContact CZ3-CE1 3.88Å; W416-Y419 HydrophobicContact CZ3-CE1 3.88Å; W416-Y419 CarbonylContact O-C 3.52Å; W416-Y419 WeakPolarHBondContact O-CB 3.19Å; W416-Y419 PolarHBondContact O-N 2.88Å; W416-Y419 VanDerWaalsContact O-N 3.14Å; Y419-Q421 VanDerWaalsContact C-N 3.33Å; Y419-Q421 PolarHBondContact O-N 2.78Å; Y419-A422 PolarHBondContact O-N 3.32Å; Y419-A422 VanDerWaalsContact O-N 3.17Å; Y419-C423 HydrophobicContact CD1-CB 4.49Å; Y419-C423 HydrophobicContact CD2-CB 4.11Å; Y419-C423 HydrophobicContact CE1-CB 4.11Å; Y419-C423 HydrophobicContact CE2-CB 3.69Å; Y419-C423 HydrophobicContact CG-CB 4.49Å; Y419-C423 WeakPolarHBondContact O-CA 3.22Å; Y419-C423 WeakPolarHBondContact O-CB 3.42Å; Y419-C423 PolarHBondContact O-N 2.9Å; Y419-L443 HydrophobicContact CD2-CD1 4.06Å; Y419-L443 HydrophobicContact CE2-CD1 4.28Å; Y419-W450 AromaticContact CD1-CH2 3.91Å; Y419-W450 HydrophobicContact CD1-CH2 3.91Å; Y419-W450 HydrophobicContact CD1-CZ2 4.38Å; Y419-W450 HydrophobicContact CE1-CH2 4.36Å; Y419-W450 AromaticContact CG-CH2 3.99Å; Y419-W450 HydrophobicContact CG-CH2 3.99Å; Y419-W450 HydrophobicContact CG-CZ2 4.08Å; Y419-L599 HydrophobicContact CD2-CD1 4.36Å; Y419-L599 HydrophobicContact CE2-CD1 4.28Å; Y419-F610 HydrophobicContact CE1-CZ 4.23Å
420	S	85.8	Confident	84.5	Confident	21 Å²	21	65.7 Å²	65.7	15%	0.147	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-36.1	-178.2	-175.9	0	0	0	0	112.5	W416 N417 G424 P426	W416-S420 WeakPolarHBondContact O-CB 3.37Å; W416-S420 PolarHBondContact O-N 3.4Å; N417-S420 PolarHBondContact O-N 2.75Å; S420-G424 WeakPolarHBondContact O-CA 3.15Å; S420-G424 PolarHBondContact O-N 2.81Å; S420-P426 WeakPolarHBondContact O-CG 3.3Å
421	Q	88.3	Confident	85.4	Confident	144 Å²	144	66.2 Å²	66.2	67%	0.673	36%	0.359	S	S	*	.	H	α-helix	trans	-65.9	-38.7	173.8	-74.3	176	-2.6	0	0	112.6	N417 Y419	N417-Q421 VanDerWaalsContact O-CG 3.31Å; N417-Q421 WeakPolarHBondContact O-CG 3.34Å; N417-Q421 PolarHBondContact O-N 3.35Å; Y419-Q421 VanDerWaalsContact C-N 3.33Å; Y419-Q421 PolarHBondContact O-N 2.78Å
422	A	88.8	Confident	86	Confident	40 Å²	40	61.3 Å²	61.3	33%	0.331	34%	0.34	S	S	.	.	H	α-helix	trans	-85	-32.6	-177.6	0	0	0	0	0	113.8	Q418 Y419 A427	Q418-A422 PolarHBondContact O-N 2.86Å; Y419-A422 PolarHBondContact O-N 3.32Å; Y419-A422 VanDerWaalsContact O-N 3.17Å; A422-A427 VanDerWaalsContact O-CB 3.25Å; A422-A427 WeakPolarHBondContact O-CB 3.23Å
423	C	88.6	Confident	86.4	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.007	35%	0.347	C	S	.	.	H	α-helix	trans	-130.1	-4.6	-167.2	-64.5	0	0	0	0	114.5	Y419 W428 C440 G604	Y419-C423 HydrophobicContact CD1-CB 4.49Å; Y419-C423 HydrophobicContact CD2-CB 4.11Å; Y419-C423 HydrophobicContact CE1-CB 4.11Å; Y419-C423 HydrophobicContact CE2-CB 3.69Å; Y419-C423 HydrophobicContact CG-CB 4.49Å; Y419-C423 WeakPolarHBondContact O-CA 3.22Å; Y419-C423 WeakPolarHBondContact O-CB 3.42Å; Y419-C423 PolarHBondContact O-N 2.9Å; C423-W428 PolarHBondContact O-NE1 2.89Å; C423-C440 WeakPolarHBondContact CA-SG 3.43Å; C423-C440 HydrophobicContact CB-CB 4Å; C423-C440 WeakPolarHBondContact CB-SG 3.12Å; C423-C440 WeakPolarHBondContact SG-CB 3.26Å; C423-C440 CovalentContact SG-SG 2.02Å; C423-C440 PolarHBondContact SG-SG 3.07Å; C423-G604 VanDerWaalsContact O-CA 3.3Å; C423-G604 WeakPolarHBondContact O-CA 3.48Å
424	G	86.1	Confident	86.7	Confident	4 Å²	4	59.7 Å²	59.7	4%	0.041	33%	0.331	C	S	.	.	S	Bend	trans	-95.8	-162.7	-178.5	0	0	0	0	0	114.1	S420 A427 W428	S420-G424 WeakPolarHBondContact O-CA 3.15Å; S420-G424 PolarHBondContact O-N 2.81Å; G424-A427 WeakPolarHBondContact O-CB 3.37Å; G424-A427 PolarHBondContact O-N 3.47Å; G424-W428 PolarHBondContact O-N 3.36Å; G424-W428 PolarHBondContact O-NE1 3.47Å
425	P	83.5	Confident	86.7	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.175	35%	0.351	C	S	.	.	H	α-helix	trans	-45.8	-46.3	178.9	-26	32.8	0	0	0	116.3	A427 W428 E429	P425-A427 PolarHBondContact O-N 3.38Å; P425-W428 VanDerWaalsContact CA-CE3 3.48Å; P425-W428 HydrophobicContact CB-CE3 4.17Å; P425-W428 HydrophobicContact CB-CZ3 4.15Å; P425-W428 HydrophobicContact CG-CE3 4.21Å; P425-W428 HydrophobicContact CG-CH2 4.02Å; P425-W428 HydrophobicContact CG-CZ3 3.69Å; P425-W428 PolarHBondContact O-N 2.85Å; P425-W428 VanDerWaalsContact O-N 3.13Å; P425-E429 PolarHBondContact O-N 2.85Å
426	P	84.1	Confident	86.8	Confident	63 Å²	63	61.1 Å²	61.1	41%	0.409	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-28.4	-178.1	25.9	-35.9	0	0	0	113.3	S420 S430	S420-P426 WeakPolarHBondContact O-CG 3.3Å; P426-S430 PolarHBondContact O-N 3.05Å; P426-S430 PolarHBondContact O-OG 2.86Å
427	A	84.4	Confident	87	Confident	7 Å²	7	62.1 Å²	62.1	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-76.5	-36.6	175.7	0	0	0	0	0	111.7	A422 G424 P425 S430 K431 T436	A422-A427 VanDerWaalsContact O-CB 3.25Å; A422-A427 WeakPolarHBondContact O-CB 3.23Å; G424-A427 WeakPolarHBondContact O-CB 3.37Å; G424-A427 PolarHBondContact O-N 3.47Å; P425-A427 PolarHBondContact O-N 3.38Å; A427-S430 PolarHBondContact O-N 2.9Å; A427-S430 PolarHBondContact O-OG 3.04Å; A427-K431 PolarHBondContact O-N 3.18Å; A427-T436 HydrophobicContact CB-CG2 3.72Å; A427-T436 PolarHBondContact O-OG1 2.84Å
428	W	85.3	Confident	87.1	Confident	47 Å²	47	63.9 Å²	63.9	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-66.6	-40.3	177.9	-50.8	-23.1	0	0	0	112.2	C423 G424 P425 S430 G432 G604 A605 K606	C423-W428 PolarHBondContact O-NE1 2.89Å; G424-W428 PolarHBondContact O-N 3.36Å; G424-W428 PolarHBondContact O-NE1 3.47Å; P425-W428 VanDerWaalsContact CA-CE3 3.48Å; P425-W428 HydrophobicContact CB-CE3 4.17Å; P425-W428 HydrophobicContact CB-CZ3 4.15Å; P425-W428 HydrophobicContact CG-CE3 4.21Å; P425-W428 HydrophobicContact CG-CH2 4.02Å; P425-W428 HydrophobicContact CG-CZ3 3.69Å; P425-W428 PolarHBondContact O-N 2.85Å; P425-W428 VanDerWaalsContact O-N 3.13Å; W428-S430 VanDerWaalsContact C-N 3.32Å; W428-G432 WeakPolarHBondContact O-CA 3.35Å; W428-G432 PolarHBondContact O-N 3.22Å; W428-G604 PolarHBondContact NE1-O 2.71Å; W428-A605 WeakPolarHBondContact CH2-O 3.26Å; W428-A605 WeakPolarHBondContact CZ2-O 3.27Å; W428-K606 VanDerWaalsContact CH2-CA 3.49Å; W428-K606 HydrophobicContact CZ3-CB 4.3Å; W428-K606 HydrophobicContact CZ3-CG 4.22Å
429	E	84.4	Confident	87.2	Confident	170 Å²	170	65 Å²	65	79%	0.794	35%	0.35	S	S	*	.	H	α-helix	trans	-67.6	-32.9	179	-71.7	175.5	-173.2	0	0	112.1	P425	P425-E429 PolarHBondContact O-N 2.85Å
430	S	88.2	Confident	87.3	Confident	87 Å²	87	64.7 Å²	64.7	61%	0.608	35%	0.349	S	S	*	.	H	α-helix	trans	-88.6	-41.7	-176.9	55.6	0	0	0	0	114.6	P426 A427 W428	P426-S430 PolarHBondContact O-N 3.05Å; P426-S430 PolarHBondContact O-OG 2.86Å; A427-S430 PolarHBondContact O-N 2.9Å; A427-S430 PolarHBondContact O-OG 3.04Å; W428-S430 VanDerWaalsContact C-N 3.32Å
431	K	85.5	Confident	87.4	Confident	136 Å²	136	66.3 Å²	66.3	59%	0.591	36%	0.36	S	S	*	.	H	α-helix	trans	-115.9	-5.3	-173	-61.9	178.7	-176.8	176.4	0	113.8	A427 Q435	A427-K431 PolarHBondContact O-N 3.18Å; K431-Q435 PolarHBondContact O-OE1 3.06Å
432	G	87.8	Confident	87.4	Confident	32 Å²	32	66.4 Å²	66.4	33%	0.33	36%	0.36	S	S	.	.			trans	81.7	154.9	-171.8	0	0	0	0	0	113.2	W428 T436	W428-G432 WeakPolarHBondContact O-CA 3.35Å; W428-G432 PolarHBondContact O-N 3.22Å; G432-T436 WeakPolarHBondContact O-CB 3.49Å; G432-T436 PolarHBondContact O-N 3.41Å; G432-T436 PolarHBondContact O-OG1 3.14Å
433	M	86.3	Confident	87.3	Confident	76 Å²	76	66.6 Å²	66.6	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-65.4	-47.4	-172.5	-167.8	-174.6	-131.9	0	0	112.8	Q435 T436 Q437 A605 K606	M433-Q435 PolarHBondContact O-N 3.24Å; M433-T436 PolarHBondContact O-N 3.46Å; M433-Q437 WeakPolarHBondContact O-CG 3.19Å; M433-Q437 PolarHBondContact O-N 3.28Å; M433-A605 HydrophobicContact CE-CB 3.64Å; M433-K606 HydrophobicContact CE-CB 3.73Å
434	A	88.3	Confident	87.3	Confident	65 Å²	65	70.9 Å²	70.9	54%	0.537	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-42.2	-175.5	0	0	0	0	0	112.8	T436 Q437 I438	A434-T436 VanDerWaalsContact C-N 3.32Å; A434-T436 PolarHBondContact O-N 3.09Å; A434-Q437 PolarHBondContact O-N 3.38Å; A434-I438 WeakPolarHBondContact O-CG1 3.27Å; A434-I438 PolarHBondContact O-N 3.32Å; A434-I438 VanDerWaalsContact O-N 3.09Å
435	Q	89.1	Confident	87.1	Confident	133 Å²	133	70.7 Å²	70.7	62%	0.621	37%	0.374	S	S	*	.	H	α-helix	trans	-65.5	-38.7	176.3	-67.6	-174.2	-4	0	0	111.4	K431 M433 I438 F439	K431-Q435 PolarHBondContact O-OE1 3.06Å; M433-Q435 PolarHBondContact O-N 3.24Å; Q435-I438 PolarHBondContact O-N 3.28Å; Q435-F439 PolarHBondContact O-N 3.17Å
436	T	89.8	Confident	87.3	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.018	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-42.7	174.3	-55.7	0	0	0	0	111.3	A427 G432 M433 A434 I438 F439 C440	A427-T436 HydrophobicContact CB-CG2 3.72Å; A427-T436 PolarHBondContact O-OG1 2.84Å; G432-T436 WeakPolarHBondContact O-CB 3.49Å; G432-T436 PolarHBondContact O-N 3.41Å; G432-T436 PolarHBondContact O-OG1 3.14Å; M433-T436 PolarHBondContact O-N 3.46Å; A434-T436 VanDerWaalsContact C-N 3.32Å; A434-T436 PolarHBondContact O-N 3.09Å; T436-I438 PolarHBondContact O-N 3.26Å; T436-F439 PolarHBondContact O-N 3.05Å; T436-C440 VanDerWaalsContact O-CB 3.27Å; T436-C440 WeakPolarHBondContact O-CB 3.31Å; T436-C440 PolarHBondContact O-N 3.06Å; T436-C440 PolarHBondContact O-SG 3.3Å
437	Q	89.2	Confident	87.4	Confident	58 Å²	58	71.9 Å²	71.9	27%	0.271	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-42.4	177.1	-71.3	179	-14.7	0	0	112.6	M433 A434 C440 S441 L603 A605	M433-Q437 WeakPolarHBondContact O-CG 3.19Å; M433-Q437 PolarHBondContact O-N 3.28Å; A434-Q437 PolarHBondContact O-N 3.38Å; Q437-C440 PolarHBondContact O-N 3.13Å; Q437-S441 PolarHBondContact O-N 3.5Å; Q437-L603 WeakPolarHBondContact CA-O 3.32Å; Q437-L603 VanDerWaalsContact CG-O 3.29Å; Q437-L603 WeakPolarHBondContact CG-O 3.48Å; Q437-A605 VanDerWaalsContact NE2-CB 3.25Å
438	I	89.4	Confident	87.7	Confident	120 Å²	120	71.5 Å²	71.5	62%	0.615	37%	0.365	S	S	*	.	H	α-helix	trans	-62.4	-46.4	176.3	-65.4	166.6	0	0	0	110.2	A434 Q435 T436 S441	A434-I438 WeakPolarHBondContact O-CG1 3.27Å; A434-I438 PolarHBondContact O-N 3.32Å; A434-I438 VanDerWaalsContact O-N 3.09Å; Q435-I438 PolarHBondContact O-N 3.28Å; T436-I438 PolarHBondContact O-N 3.26Å; I438-S441 WeakPolarHBondContact O-CB 3.28Å; I438-S441 PolarHBondContact O-N 2.9Å; I438-S441 PolarHBondContact O-OG 3.17Å
439	F	90.8	Very high	87.9	Confident	125 Å²	125	73.1 Å²	73.1	55%	0.548	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-44.1	178	-178.8	-103.2	0	0	0	112.3	Q435 T436 S441 H442	Q435-F439 PolarHBondContact O-N 3.17Å; T436-F439 PolarHBondContact O-N 3.05Å; F439-S441 PolarHBondContact O-N 3.36Å; F439-H442 PolarHBondContact O-CD2 2.76Å; F439-H442 VanDerWaalsContact O-CD2 3.25Å; F439-H442 PolarHBondContact O-N 3.24Å
440	C	89.7	Confident	88.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-70.9	-17.1	-179.1	-65.8	0	0	0	0	113.3	C423 T436 Q437 H442 L443 L603	C423-C440 WeakPolarHBondContact CA-SG 3.43Å; C423-C440 HydrophobicContact CB-CB 4Å; C423-C440 WeakPolarHBondContact CB-SG 3.12Å; C423-C440 WeakPolarHBondContact SG-CB 3.26Å; C423-C440 CovalentContact SG-SG 2.02Å; C423-C440 PolarHBondContact SG-SG 3.07Å; T436-C440 VanDerWaalsContact O-CB 3.27Å; T436-C440 WeakPolarHBondContact O-CB 3.31Å; T436-C440 PolarHBondContact O-N 3.06Å; T436-C440 PolarHBondContact O-SG 3.3Å; Q437-C440 PolarHBondContact O-N 3.13Å; C440-H442 PolarHBondContact O-N 2.83Å; C440-H442 VanDerWaalsContact O-N 3.15Å; C440-L443 WeakPolarHBondContact O-CB 3.47Å; C440-L443 PolarHBondContact O-N 2.99Å; C440-L603 HydrophobicContact CB-CB 3.89Å; C440-L603 WeakPolarHBondContact O-CD1 3.41Å
441	S	87.8	Confident	88.3	Confident	54 Å²	54	64.7 Å²	64.7	38%	0.378	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-58	-24.5	173	76.5	0	0	0	0	113.1	Q437 I438 F439 L443 Q444	Q437-S441 PolarHBondContact O-N 3.5Å; I438-S441 WeakPolarHBondContact O-CB 3.28Å; I438-S441 PolarHBondContact O-N 2.9Å; I438-S441 PolarHBondContact O-OG 3.17Å; F439-S441 PolarHBondContact O-N 3.36Å; S441-L443 PolarHBondContact O-N 3.03Å; S441-Q444 WeakPolarHBondContact O-CB 3.35Å; S441-Q444 PolarHBondContact O-N 3.26Å
442	H	88.4	Confident	88.6	Confident	147 Å²	147	58.2 Å²	58.2	68%	0.681	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.6	-20.8	173.7	-69.5	-63.7	0	0	0	114	F439 C440 Q444	F439-H442 PolarHBondContact O-CD2 2.76Å; F439-H442 VanDerWaalsContact O-CD2 3.25Å; F439-H442 PolarHBondContact O-N 3.24Å; C440-H442 PolarHBondContact O-N 2.83Å; C440-H442 VanDerWaalsContact O-N 3.15Å; H442-Q444 VanDerWaalsContact C-N 3.29Å
443	L	87.6	Confident	88.7	Confident	43 Å²	43	63.2 Å²	63.2	23%	0.225	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-87.9	3.2	175.8	-62.4	174.7	0	0	0	112.6	L414 Y419 C440 S441 G445 H446 L599 L603	L414-L443 HydrophobicContact CD2-CD1 4.15Å; Y419-L443 HydrophobicContact CD2-CD1 4.06Å; Y419-L443 HydrophobicContact CE2-CD1 4.28Å; C440-L443 WeakPolarHBondContact O-CB 3.47Å; C440-L443 PolarHBondContact O-N 2.99Å; S441-L443 PolarHBondContact O-N 3.03Å; L443-G445 PolarHBondContact O-N 3.48Å; L443-H446 WeakPolarHBondContact O-CB 2.93Å; L443-H446 PolarHBondContact O-CD2 2.87Å; L443-H446 VanDerWaalsContact O-CD2 3.3Å; L443-H446 PolarHBondContact O-N 2.92Å; L443-L599 HydrophobicContact CB-CD1 4.17Å; L443-L603 HydrophobicContact CB-CD1 4.3Å
444	Q	87.2	Confident	89	Confident	91 Å²	91	59.8 Å²	59.8	43%	0.425	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	132.9	179.5	-168.5	175.7	1.3	0	0	111.2	S441 H442 L599 D600 L603	S441-Q444 WeakPolarHBondContact O-CB 3.35Å; S441-Q444 PolarHBondContact O-N 3.26Å; H442-Q444 VanDerWaalsContact C-N 3.29Å; Q444-L599 CarbonylContact C-O 3.56Å; Q444-L599 WeakPolarHBondContact CA-O 3.43Å; Q444-D600 PolarHBondContact NE2-OD1 2.97Å; Q444-L603 HydrophobicContact CB-CD1 4.13Å
445	G	82.6	Confident	89.1	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.01	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-6.6	-178	0	0	0	0	0	115	V409 Y410 L443 L599	V409-G445 WeakPolarHBondContact CA-O 3.14Å; Y410-G445 PolarHBondContact N-O 3.38Å; L443-G445 PolarHBondContact O-N 3.48Å; G445-L599 PolarHBondContact N-O 3.15Å
446	H	86.7	Confident	89.2	Confident	42 Å²	42	57.7 Å²	57.7	19%	0.194	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	133.8	173.8	-72.7	-110.5	0	0	0	111	Y410 S412 L443 L599	Y410-H446 CarbonylContact O-C 3.55Å; Y410-H446 WeakPolarHBondContact O-CA 3.3Å; S412-H446 PolarHBondContact OG-ND1 3.01Å; L443-H446 WeakPolarHBondContact O-CB 2.93Å; L443-H446 PolarHBondContact O-CD2 2.87Å; L443-H446 VanDerWaalsContact O-CD2 3.3Å; L443-H446 PolarHBondContact O-N 2.92Å; H446-L599 HydrophobicContact CB-CD1 4.25Å; H446-L599 PolarHBondContact O-N 2.68Å
447	R	87.1	Confident	89.4	Confident	72 Å²	72	59.5 Å²	59.5	27%	0.272	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124	170.6	-179.5	177.7	-72	173.9	-4.8	108.7	V409 Y410 S412 T597 E634	V409-R447 HydrophobicContact CG1-CB 3.5Å; V409-R447 HydrophobicContact CG1-CG 4.49Å; Y410-R447 PolarHBondContact O-N 3.23Å; S412-R447 PolarHBondContact N-O 3.48Å; R447-T597 WeakPolarHBondContact CA-O 3.09Å; R447-E634 IonicContact NH2-OE2 3.66Å; R447-E634 PolarHBondContact NH2-OE2 3.39Å
448	V	90	Very high	89.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	156.1	-178.7	-63.7	0	0	0	0	110	L414 W450 S596 T597 L599	L414-V448 HydrophobicContact CB-CG1 4.12Å; V448-W450 HydrophobicContact CB-CZ2 4.1Å; V448-W450 HydrophobicContact CG1-CZ2 4.34Å; V448-W450 HydrophobicContact CG2-CD2 4.02Å; V448-W450 HydrophobicContact CG2-CE3 4.26Å; V448-W450 HydrophobicContact CG2-CH2 3.92Å; V448-W450 HydrophobicContact CG2-CZ2 3.63Å; V448-W450 HydrophobicContact CG2-CZ3 4.2Å; V448-S596 VanDerWaalsContact O-CA 3.31Å; V448-S596 WeakPolarHBondContact O-CA 3.43Å; V448-S596 PolarHBondContact O-OG 3.47Å; V448-T597 HydrophobicContact CG2-CG2 3.64Å; V448-T597 PolarHBondContact N-O 3Å; V448-T597 PolarHBondContact O-N 2.78Å; V448-L599 HydrophobicContact CG1-CD1 4.11Å; V448-L599 HydrophobicContact CG1-CG 4.37Å; V448-L599 HydrophobicContact CG2-CD2 3.98Å; V448-L599 HydrophobicContact CG2-CG 4.12Å
449	T	90.7	Very high	89.7	Confident	80 Å²	80	61.9 Å²	61.9	49%	0.491	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.8	177	47.2	0	0	0	0	108.3	F595	T449-F595 WeakPolarHBondContact CA-O 3.31Å
450	W	90.8	Very high	89.7	Confident	11 Å²	11	58 Å²	58	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	159.5	-177.1	-62.8	-29.2	0	0	0	110.7	L414 W416 Y419 V448 I572 F595 T597 L599 F610	L414-W450 PolarHBondContact O-NE1 2.88Å; W416-W450 HydrophobicContact CB-CD2 4.23Å; W416-W450 HydrophobicContact CB-CG 4.22Å; W416-W450 HydrophobicContact CE3-CD2 4.08Å; W416-W450 AromaticContact CE3-CE3 3.66Å; W416-W450 HydrophobicContact CE3-CE3 3.66Å; W416-W450 AromaticContact CE3-CH2 3.55Å; W416-W450 HydrophobicContact CE3-CH2 3.55Å; W416-W450 AromaticContact CE3-CZ2 3.98Å; W416-W450 HydrophobicContact CE3-CZ2 3.98Å; W416-W450 AromaticContact CE3-CZ3 3.39Å; W416-W450 HydrophobicContact CE3-CZ3 3.39Å; W416-W450 HydrophobicContact CZ3-CE3 4.16Å; W416-W450 AromaticContact CZ3-CH2 3.8Å; W416-W450 HydrophobicContact CZ3-CH2 3.8Å; W416-W450 AromaticContact CZ3-CZ3 3.54Å; W416-W450 HydrophobicContact CZ3-CZ3 3.54Å; Y419-W450 AromaticContact CD1-CH2 3.91Å; Y419-W450 HydrophobicContact CD1-CH2 3.91Å; Y419-W450 HydrophobicContact CD1-CZ2 4.38Å; Y419-W450 HydrophobicContact CE1-CH2 4.36Å; Y419-W450 AromaticContact CG-CH2 3.99Å; Y419-W450 HydrophobicContact CG-CH2 3.99Å; Y419-W450 HydrophobicContact CG-CZ2 4.08Å; V448-W450 HydrophobicContact CB-CZ2 4.1Å; V448-W450 HydrophobicContact CG1-CZ2 4.34Å; V448-W450 HydrophobicContact CG2-CD2 4.02Å; V448-W450 HydrophobicContact CG2-CE3 4.26Å; V448-W450 HydrophobicContact CG2-CH2 3.92Å; V448-W450 HydrophobicContact CG2-CZ2 3.63Å; V448-W450 HydrophobicContact CG2-CZ3 4.2Å; W450-I572 HydrophobicContact CE3-CD1 3.87Å; W450-I572 HydrophobicContact CZ3-CD1 4.09Å; W450-F595 HydrophobicContact CB-CE1 4.15Å; W450-F595 HydrophobicContact CB-CE2 4.15Å; W450-F595 HydrophobicContact CB-CZ 3.77Å; W450-F595 AromaticContact CE3-CE2 3.95Å; W450-F595 HydrophobicContact CE3-CE2 3.95Å; W450-F595 HydrophobicContact CE3-CZ 4.07Å; W450-F595 PolarHBondContact N-O 2.95Å; W450-F595 WeakPolarHBondContact O-CD1 3.41Å; W450-F595 PolarHBondContact O-N 2.88Å; W450-T597 HydrophobicContact CE3-CG2 4.45Å; W450-T597 HydrophobicContact CZ3-CG2 4.4Å; W450-L599 HydrophobicContact CH2-CD2 3.8Å; W450-L599 HydrophobicContact CZ2-CD2 4.48Å; W450-L599 HydrophobicContact CZ3-CD2 4.41Å; W450-F610 HydrophobicContact CZ3-CE2 4.13Å
451	T	90.3	Very high	89.6	Confident	69 Å²	69	63.1 Å²	63.1	42%	0.423	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.8	176.4	53.1	0	0	0	0	109.8	V593 E594 L618	T451-V593 WeakPolarHBondContact CA-O 3.21Å; T451-E594 HydrophobicContact CG2-CB 4.23Å; T451-E594 HydrophobicContact CG2-CG 4.36Å; T451-L618 HydrophobicContact CG2-CD1 4.48Å
452	G	90.1	Very high	89.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	168.8	179.1	0	0	0	0	0	112.8	G556 V593	G452-G556 CarbonylContact C-O 3.2Å; G452-G556 VanDerWaalsContact CA-O 3.23Å; G452-G556 WeakPolarHBondContact CA-O 3.49Å; G452-V593 PolarHBondContact N-O 2.66Å; G452-V593 PolarHBondContact O-N 2.81Å
453	R	91.3	Very high	89.3	Confident	138 Å²	138	60.2 Å²	60.2	52%	0.521	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.9	171.6	-72.9	-179.8	-179.8	173.9	0.7	110.1	R455 G556 I558 N591 I592	R453-R455 PolarHBondContact O-N 2.61Å; R453-G556 PolarHBondContact N-O 3.5Å; R453-G556 PolarHBondContact O-N 3.33Å; R453-I558 HydrophobicContact CG-CD1 4.16Å; R453-I558 HydrophobicContact CG-CG1 3.85Å; R453-N591 CarbonylContact C-O 3.47Å; R453-N591 WeakPolarHBondContact CA-O 3.3Å; R453-I592 HydrophobicContact CG-CG1 4.48Å
454	F	91.4	Very high	89	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	123.6	172.9	179.5	-95.4	0	0	0	109.9	V457 V553 L587 K588 P589 G590 N591 V593	F454-V457 HydrophobicContact CE2-CB 4.17Å; F454-V457 HydrophobicContact CZ-CB 3.83Å; F454-V457 HydrophobicContact CZ-CG1 3.92Å; F454-V553 HydrophobicContact CD2-CG1 3.84Å; F454-V553 HydrophobicContact CE2-CG1 3.65Å; F454-L587 HydrophobicContact CD1-CB 4.02Å; F454-L587 HydrophobicContact CD2-CB 4.26Å; F454-L587 HydrophobicContact CD2-CD1 3.86Å; F454-L587 HydrophobicContact CE1-CB 3.82Å; F454-L587 HydrophobicContact CE2-CB 4.06Å; F454-L587 HydrophobicContact CE2-CD1 3.9Å; F454-L587 HydrophobicContact CG-CB 4.21Å; F454-L587 HydrophobicContact CG-CD1 4.4Å; F454-L587 HydrophobicContact CZ-CB 3.84Å; F454-K588 WeakPolarHBondContact CD1-O 3.41Å; F454-P589 WeakPolarHBondContact O-CA 3.38Å; F454-G590 PolarHBondContact O-N 3.08Å; F454-N591 PolarHBondContact N-O 2.96Å; F454-V593 HydrophobicContact CB-CG1 4.36Å; F454-V593 HydrophobicContact CB-CG2 4.39Å
455	R	90.9	Very high	88.7	Confident	67 Å²	67	56.2 Å²	56.2	25%	0.253	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-61.1	175.6	-69.8	-165.4	179.3	-96.2	4.6	111.1	R453 T554 E566 D571 P589	R453-R455 PolarHBondContact O-N 2.61Å; R455-T554 HydrophobicContact CB-CG2 4.4Å; R455-T554 WeakPolarHBondContact CB-O 3.4Å; R455-T554 PolarHBondContact N-O 3.04Å; R455-E566 IonicContact CZ-OE2 3.26Å; R455-E566 VanDerWaalsContact NH1-CD 3.29Å; R455-E566 IonicContact NH1-OE1 2.74Å; R455-E566 IonicContact NH1-OE2 3.92Å; R455-E566 PolarHBondContact NH1-OE2 2.97Å; R455-E566 IonicContact NH2-OE2 2.81Å; R455-D571 WeakPolarHBondContact CD-OD2 3.44Å; R455-D571 IonicContact CZ-OD1 2.8Å; R455-D571 IonicContact CZ-OD2 2.88Å; R455-D571 IonicContact NE-OD1 3.66Å; R455-D571 PolarHBondContact NE-OD1 2.86Å; R455-D571 IonicContact NE-OD2 3.91Å; R455-D571 PolarHBondContact NE-OD2 3.29Å; R455-D571 VanDerWaalsContact NE-OD2 3.15Å; R455-D571 IonicContact NH2-OD1 3.87Å; R455-P589 VanDerWaalsContact O-CB 3.29Å; R455-P589 WeakPolarHBondContact O-CB 3.36Å; R455-P589 WeakPolarHBondContact O-CG 3.44Å
456	H	92.2	Very high	88.4	Confident	87 Å²	87	57.7 Å²	57.7	40%	0.403	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	161.4	-179.6	61.1	-86.9	0	0	0	110.8	T554	H456-T554 PolarHBondContact CE1-OG1 3Å; H456-T554 VanDerWaalsContact CE1-OG1 3.31Å; H456-T554 PolarHBondContact NE2-OG1 3.36Å; H456-T554 VanDerWaalsContact NE2-OG1 3.12Å; H456-T554 PolarHBondContact O-N 3.04Å
457	V	92.9	Very high	88.3	Confident	41 Å²	41	58.2 Å²	58.2	25%	0.248	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.8	169.3	61.1	0	0	0	0	109	F454 F551 V553 L584	F454-V457 HydrophobicContact CE2-CB 4.17Å; F454-V457 HydrophobicContact CZ-CB 3.83Å; F454-V457 HydrophobicContact CZ-CG1 3.92Å; V457-F551 HydrophobicContact CG2-CB 3.83Å; V457-F551 HydrophobicContact CG2-CD1 3.73Å; V457-F551 HydrophobicContact CG2-CG 4.14Å; V457-V553 HydrophobicContact CB-CG2 4.35Å; V457-V553 HydrophobicContact CG2-CG2 3.83Å; V457-L584 HydrophobicContact CG2-CB 4.33Å; V457-L584 HydrophobicContact CG2-CD1 4.44Å
458	R	93.3	Very high	88.1	Confident	134 Å²	134	58.4 Å²	58.4	51%	0.506	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	158.9	170.7	68.5	-178.3	-171.5	174.8	-2.5	110.3	A460 F551 E552	R458-A460 PolarHBondContact O-N 2.99Å; R458-F551 CarbonylContact O-C 3.51Å; R458-F551 WeakPolarHBondContact O-CA 3.28Å; R458-E552 HydrophobicContact CG-CB 3.78Å; R458-E552 HydrophobicContact CG-CG 4.41Å; R458-E552 VanDerWaalsContact CZ-CD 3.46Å; R458-E552 IonicContact CZ-OE1 3.15Å; R458-E552 IonicContact CZ-OE2 3.58Å; R458-E552 PolarHBondContact N-O 3.37Å; R458-E552 IonicContact NE-OE1 3.42Å; R458-E552 PolarHBondContact NE-OE1 2.86Å; R458-E552 IonicContact NE-OE2 3.62Å; R458-E552 PolarHBondContact NE-OE2 3.2Å; R458-E552 IonicContact NH2-OE1 2.75Å; R458-E552 PolarHBondContact NH2-OE1 2.78Å; R458-E552 IonicContact NH2-OE2 2.72Å; R458-E552 PolarHBondContact NH2-OE2 3.06Å; R458-E552 PolarHBondContact O-N 2.68Å
459	I	92.6	Very high	87.5	Confident	94 Å²	94	60.6 Å²	60.6	48%	0.482	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	119.7	172.2	-60.1	170	0	0	0	107.2	T462 Y549 F551	I459-T462 WeakPolarHBondContact CG2-OG1 3.36Å; I459-Y549 HydrophobicContact CD1-CD1 3.96Å; I459-Y549 HydrophobicContact CD1-CE1 4.15Å; I459-Y549 HydrophobicContact CG1-CD1 4.41Å; I459-Y549 HydrophobicContact CG2-CD1 4.05Å; I459-F551 HydrophobicContact CG1-CD1 4.37Å; I459-F551 HydrophobicContact CG1-CE1 4.19Å
460	A	89.4	Confident	87	Confident	45 Å²	45	57.1 Å²	57.1	37%	0.372	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-47.2	176.3	0	0	0	0	0	110.9	R458 R550 E552 M575	R458-A460 PolarHBondContact O-N 2.99Å; A460-R550 HydrophobicContact CB-CB 4.41Å; A460-R550 WeakPolarHBondContact CB-O 3.2Å; A460-R550 PolarHBondContact N-O 3.48Å; A460-E552 HydrophobicContact CB-CB 3.97Å; A460-M575 HydrophobicContact CB-SD 4.17Å
461	E	88.9	Confident	86.6	Confident	106 Å²	106	61.1 Å²	61.1	50%	0.495	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145	-176.4	-170.3	171.4	-163.4	0	0	109.7	E463 R550	E461-E463 HydrophobicContact CG-CG 4.44Å; E461-R550 HydrophobicContact CB-CB 4.14Å; E461-R550 HydrophobicContact CB-CG 4.44Å; E461-R550 PolarHBondContact N-O 3.01Å; E461-R550 PolarHBondContact O-N 2.72Å; E461-R550 IonicContact OE2-NE 2.66Å
462	T	87.3	Confident	86	Confident	62 Å²	62	63.9 Å²	63.9	38%	0.38	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.3	173.6	-54.9	0	0	0	0	108.3	I459 D547 Y549	I459-T462 WeakPolarHBondContact CG2-OG1 3.36Å; T462-D547 HydrophobicContact CG2-CB 3.97Å; T462-D547 WeakPolarHBondContact CG2-OD2 2.97Å; T462-Y549 HydrophobicContact CG2-CD1 3.95Å; T462-Y549 HydrophobicContact CG2-CE1 3.8Å
463	E	81.9	Confident	85.5	Confident	79 Å²	79	66.9 Å²	66.9	37%	0.369	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.3	176.7	-65.5	176.6	-159.4	0	0	108.8	E461 S548 R550	E461-E463 HydrophobicContact CG-CG 4.44Å; E463-S548 PolarHBondContact N-O 3.27Å; E463-S548 PolarHBondContact O-N 2.64Å; E463-R550 IonicContact OE1-CZ 3.18Å; E463-R550 VanDerWaalsContact OE1-CZ 3.26Å; E463-R550 IonicContact OE1-NE 2.78Å; E463-R550 PolarHBondContact OE1-NE 2.65Å; E463-R550 IonicContact OE1-NH2 2.87Å; E463-R550 PolarHBondContact OE1-NH2 2.74Å
464	N	82.5	Confident	85.2	Confident	15 Å²	15	64.4 Å²	64.4	8%	0.08	35%	0.349	C	S	.	.			trans	-132.7	99.5	169.9	-174.6	-25.3	0	0	0	109.7	A466 Q467 S468 V543 D547	N464-A466 VanDerWaalsContact C-N 3.34Å; N464-A466 PolarHBondContact O-N 2.94Å; N464-A466 WeakPolarHBondContact OD1-CB 3.15Å; N464-A466 PolarHBondContact OD1-N 3.48Å; N464-Q467 HydrophobicContact CB-CB 3.9Å; N464-Q467 VanDerWaalsContact CG-CB 3.46Å; N464-Q467 PolarHBondContact O-N 3.31Å; N464-Q467 PolarHBondContact OD1-N 2.89Å; N464-S468 WeakPolarHBondContact O-CB 3Å; N464-S468 PolarHBondContact O-N 2.93Å; N464-S468 PolarHBondContact O-OG 3.23Å; N464-V543 PolarHBondContact ND2-O 3.34Å; N464-D547 WeakPolarHBondContact CB-OD1 3.41Å; N464-D547 PolarHBondContact ND2-OD1 2.78Å
465	G	79.1	Confident	84.8	Confident	34 Å²	34	69.2 Å²	69.2	35%	0.351	38%	0.379	S	S	.	.	H	α-helix	trans	-62.8	-39.2	179.5	0	0	0	0	0	112.7	S468 V469	G465-S468 PolarHBondContact O-N 3.43Å; G465-V469 WeakPolarHBondContact O-CG2 3.49Å; G465-V469 PolarHBondContact O-N 2.86Å
466	A	78	Confident	84.4	Confident	33 Å²	33	74.5 Å²	74.5	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-47.6	178.9	0	0	0	0	0	111.4	N464 S468 V469 I470 F546	N464-A466 VanDerWaalsContact C-N 3.34Å; N464-A466 PolarHBondContact O-N 2.94Å; N464-A466 WeakPolarHBondContact OD1-CB 3.15Å; N464-A466 PolarHBondContact OD1-N 3.48Å; A466-S468 VanDerWaalsContact C-N 3.32Å; A466-S468 PolarHBondContact O-N 3.01Å; A466-V469 PolarHBondContact O-N 3.5Å; A466-I470 WeakPolarHBondContact O-CB 3.2Å; A466-I470 WeakPolarHBondContact O-CD1 3.43Å; A466-I470 WeakPolarHBondContact O-CG1 3.47Å; A466-I470 PolarHBondContact O-N 3.49Å; A466-F546 HydrophobicContact CB-CB 4.33Å; A466-F546 HydrophobicContact CB-CD2 4.23Å; A466-F546 HydrophobicContact CB-CG 4.38Å
467	Q	82.8	Confident	83.8	Confident	52 Å²	52	73.9 Å²	73.9	24%	0.243	40%	0.403	C	S	.	.	H	α-helix	trans	-62.4	-39.7	177.2	-177.1	67	3.7	0	0	111.7	N464 V469 I470 N471 V543	N464-Q467 HydrophobicContact CB-CB 3.9Å; N464-Q467 VanDerWaalsContact CG-CB 3.46Å; N464-Q467 PolarHBondContact O-N 3.31Å; N464-Q467 PolarHBondContact OD1-N 2.89Å; Q467-V469 VanDerWaalsContact C-N 3.26Å; Q467-V469 PolarHBondContact O-N 2.83Å; Q467-I470 PolarHBondContact O-N 3.49Å; Q467-N471 PolarHBondContact NE2-OD1 3.23Å; Q467-N471 VanDerWaalsContact O-CB 3.28Å; Q467-N471 WeakPolarHBondContact O-CB 3.27Å; Q467-N471 PolarHBondContact O-N 3.48Å; Q467-N471 PolarHBondContact O-ND2 2.87Å; Q467-N471 PolarHBondContact O-OD1 3.02Å; Q467-V543 HydrophobicContact CB-CG2 3.87Å; Q467-V543 HydrophobicContact CG-CG2 4.47Å
468	S	83.2	Confident	83.4	Confident	77 Å²	77	72 Å²	72	54%	0.538	39%	0.391	S	S	.	.	H	α-helix	trans	-59.6	-37.8	178.7	-59.4	0	0	0	0	112.1	N464 G465 A466 M472	N464-S468 WeakPolarHBondContact O-CB 3Å; N464-S468 PolarHBondContact O-N 2.93Å; N464-S468 PolarHBondContact O-OG 3.23Å; G465-S468 PolarHBondContact O-N 3.43Å; A466-S468 VanDerWaalsContact C-N 3.32Å; A466-S468 PolarHBondContact O-N 3.01Å; S468-M472 PolarHBondContact O-N 2.88Å
469	V	76.9	Confident	83.1	Confident	45 Å²	45	67.8 Å²	67.8	27%	0.273	38%	0.379	S	S	.	.	H	α-helix	trans	-81.5	-39.2	-178.5	169.4	0	0	0	0	112.7	F81 G465 A466 Q467 N471 M472	F81-V469 HydrophobicContact CD2-CB 4.29Å; F81-V469 HydrophobicContact CD2-CG1 4.31Å; F81-V469 HydrophobicContact CD2-CG2 3.17Å; F81-V469 HydrophobicContact CE2-CB 3.85Å; F81-V469 HydrophobicContact CE2-CG1 3.89Å; F81-V469 HydrophobicContact CE2-CG2 3.08Å; F81-V469 HydrophobicContact CG-CG2 4.24Å; F81-V469 HydrophobicContact CZ-CB 4.44Å; F81-V469 HydrophobicContact CZ-CG1 4.06Å; F81-V469 HydrophobicContact CZ-CG2 4.08Å; G465-V469 WeakPolarHBondContact O-CG2 3.49Å; G465-V469 PolarHBondContact O-N 2.86Å; A466-V469 PolarHBondContact O-N 3.5Å; Q467-V469 VanDerWaalsContact C-N 3.26Å; Q467-V469 PolarHBondContact O-N 2.83Å; V469-N471 PolarHBondContact O-N 3.13Å; V469-M472 WeakPolarHBondContact O-CB 3.21Å; V469-M472 PolarHBondContact O-N 3.37Å; V469-M472 VanDerWaalsContact O-N 3.1Å
470	I	81.9	Confident	82.7	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.036	38%	0.384	C	S	.	.	H	α-helix	trans	-59.9	-39.3	170.8	-68.1	171.1	0	0	0	110.5	A466 Q467 M472 L473 G478 M481 R482 V543	A466-I470 WeakPolarHBondContact O-CB 3.2Å; A466-I470 WeakPolarHBondContact O-CD1 3.43Å; A466-I470 WeakPolarHBondContact O-CG1 3.47Å; A466-I470 PolarHBondContact O-N 3.49Å; Q467-I470 PolarHBondContact O-N 3.49Å; I470-M472 PolarHBondContact O-N 3.24Å; I470-L473 PolarHBondContact O-N 2.78Å; I470-G478 VanDerWaalsContact CG2-O 3.31Å; I470-G478 WeakPolarHBondContact CG2-O 3.36Å; I470-M481 HydrophobicContact CD1-CB 4.49Å; I470-M481 HydrophobicContact CG1-CB 4.23Å; I470-M481 HydrophobicContact CG1-CE 3.73Å; I470-R482 HydrophobicContact CD1-CG 4.07Å; I470-R482 HydrophobicContact CG2-CG 3.38Å; I470-V543 HydrophobicContact CD1-CG1 3.95Å; I470-V543 HydrophobicContact CD1-CG2 4.18Å
471	N	81.1	Confident	82.3	Confident	95 Å²	95	70.4 Å²	70.4	51%	0.508	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.8	177	-73.6	-8.1	0	0	0	113.5	Q467 V469 R482	Q467-N471 PolarHBondContact NE2-OD1 3.23Å; Q467-N471 VanDerWaalsContact O-CB 3.28Å; Q467-N471 WeakPolarHBondContact O-CB 3.27Å; Q467-N471 PolarHBondContact O-N 3.48Å; Q467-N471 PolarHBondContact O-ND2 2.87Å; Q467-N471 PolarHBondContact O-OD1 3.02Å; V469-N471 PolarHBondContact O-N 3.13Å; N471-R482 PolarHBondContact OD1-NH2 3.33Å
472	M	79.2	Confident	82.2	Confident	128 Å²	128	66 Å²	66	63%	0.631	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-20.7	177.4	-166	172.9	-171.5	0	0	112.7	L77 S468 V469 I470	L77-M472 HydrophobicContact CD1-CE 3.43Å; L77-M472 VanDerWaalsContact CD1-CE 3.43Å; L77-M472 HydrophobicContact CD1-SD 4.41Å; L77-M472 HydrophobicContact CD2-CE 3.49Å; L77-M472 VanDerWaalsContact CD2-CE 3.49Å; L77-M472 HydrophobicContact CD2-SD 3.78Å; L77-M472 HydrophobicContact CG-CE 4.1Å; S468-M472 PolarHBondContact O-N 2.88Å; V469-M472 WeakPolarHBondContact O-CB 3.21Å; V469-M472 PolarHBondContact O-N 3.37Å; V469-M472 VanDerWaalsContact O-N 3.1Å; I470-M472 PolarHBondContact O-N 3.24Å
473	L	78.7	Confident	82.2	Confident	63 Å²	63	65.5 Å²	65.5	33%	0.33	35%	0.353	S	S	.	.	S	Bend	trans	-83.2	156.2	-178.9	-71.1	159.7	0	0	0	111.7	I470 I477 M481	I470-L473 PolarHBondContact O-N 2.78Å; L473-I477 HydrophobicContact CB-CB 4.49Å; L473-I477 HydrophobicContact CB-CG2 4.43Å; L473-I477 HydrophobicContact CD1-CG2 4.21Å; L473-I477 HydrophobicContact CD2-CG2 4.4Å; L473-M481 HydrophobicContact CD1-CE 3.09Å; L473-M481 HydrophobicContact CD1-SD 4.05Å
474	P	85.2	Confident	82.4	Confident	85 Å²	85	66.1 Å²	66.1	55%	0.552	36%	0.358	S	S	*	.			trans	-54	143.6	171.4	-23.6	33	0	0	0	111.4	F476 I477 G478	P474-F476 PolarHBondContact O-N 3.42Å; P474-I477 PolarHBondContact O-N 3.45Å; P474-G478 PolarHBondContact O-N 2.79Å
475	V	82.8	Confident	82.4	Confident	104 Å²	104	72.5 Å²	72.5	63%	0.63	38%	0.382	S	S	*	.	H	α-helix	trans	-48.2	-42.3	-171.6	-177.9	0	0	0	0	112.9	G478 D479	V475-G478 PolarHBondContact O-N 2.77Å; V475-D479 WeakPolarHBondContact O-CB 3.28Å; V475-D479 PolarHBondContact O-N 2.78Å
476	F	82.8	Confident	82.7	Confident	178 Å²	178	71.8 Å²	71.8	78%	0.781	37%	0.374	S	S	*	.	H	α-helix	trans	-61.6	-47.7	178.7	178.9	-100.7	0	0	0	113.5	P474 W480	P474-F476 PolarHBondContact O-N 3.42Å; F476-W480 PolarHBondContact O-N 3.44Å
477	I	80.3	Confident	83.1	Confident	75 Å²	75	74.6 Å²	74.6	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-71.9	-39.5	178.8	-60.1	175	0	0	0	109.7	L473 P474 W480 M481	L473-I477 HydrophobicContact CB-CB 4.49Å; L473-I477 HydrophobicContact CB-CG2 4.43Å; L473-I477 HydrophobicContact CD1-CG2 4.21Å; L473-I477 HydrophobicContact CD2-CG2 4.4Å; P474-I477 PolarHBondContact O-N 3.45Å; I477-W480 PolarHBondContact O-N 2.81Å; I477-M481 HydrophobicContact CG2-CG 4.37Å; I477-M481 WeakPolarHBondContact O-CG 3.29Å; I477-M481 PolarHBondContact O-N 3.22Å
478	G	83.4	Confident	83.2	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-57.1	-52.7	176.1	0	0	0	0	0	111.8	I470 P474 V475 W480 M481 R482	I470-G478 VanDerWaalsContact CG2-O 3.31Å; I470-G478 WeakPolarHBondContact CG2-O 3.36Å; P474-G478 PolarHBondContact O-N 2.79Å; V475-G478 PolarHBondContact O-N 2.77Å; G478-W480 PolarHBondContact O-N 2.83Å; G478-M481 PolarHBondContact O-N 3.41Å; G478-R482 WeakPolarHBondContact O-CG 3.08Å; G478-R482 PolarHBondContact O-N 2.78Å
479	D	86.4	Confident	83.3	Confident	47 Å²	47	74.8 Å²	74.8	25%	0.251	38%	0.38	S	S	.	.	H	α-helix	trans	-65.6	-38	-178.8	-71.8	-21	0	0	0	112.7	V475 R482 C483 H539	V475-D479 WeakPolarHBondContact O-CB 3.28Å; V475-D479 PolarHBondContact O-N 2.78Å; D479-R482 PolarHBondContact O-N 3.33Å; D479-R482 IonicContact OD1-CZ 3.99Å; D479-R482 IonicContact OD1-NH1 2.64Å; D479-R482 PolarHBondContact OD1-NH1 2.86Å; D479-C483 PolarHBondContact O-N 2.85Å; D479-C483 VanDerWaalsContact O-N 3.1Å; D479-C483 PolarHBondContact O-SG 3.29Å; D479-H539 IonicContact OD1-CE1 3.93Å; D479-H539 PolarHBondContact OD1-CE1 3.47Å; D479-H539 IonicContact OD1-CG 2.74Å; D479-H539 IonicContact OD1-ND1 2.65Å; D479-H539 PolarHBondContact OD1-ND1 2.92Å; D479-H539 IonicContact OD2-ND1 3.06Å
480	W	85.2	Confident	83.5	Confident	155 Å²	155	74 Å²	74	59%	0.587	38%	0.376	S	S	*	.	H	α-helix	trans	-60.1	-46.9	171.9	179.7	81.1	0	0	0	111.7	F476 I477 G478 C483 L484	F476-W480 PolarHBondContact O-N 3.44Å; I477-W480 PolarHBondContact O-N 2.81Å; G478-W480 PolarHBondContact O-N 2.83Å; W480-C483 PolarHBondContact O-N 2.98Å; W480-L484 HydrophobicContact CH2-CD2 3.54Å; W480-L484 HydrophobicContact CZ2-CD2 3.97Å; W480-L484 HydrophobicContact CZ3-CD2 3.87Å; W480-L484 WeakPolarHBondContact O-CB 3.19Å; W480-L484 PolarHBondContact O-N 3.04Å
481	M	81.3	Confident	83.3	Confident	39 Å²	39	83.1 Å²	83.1	19%	0.192	42%	0.415	C	S	.	.	H	α-helix	trans	-68	-34.1	177.4	-68.7	-152.4	-34.2	0	0	113.1	I470 L473 I477 G478 C483 L484 Y485	I470-M481 HydrophobicContact CD1-CB 4.49Å; I470-M481 HydrophobicContact CG1-CB 4.23Å; I470-M481 HydrophobicContact CG1-CE 3.73Å; L473-M481 HydrophobicContact CD1-CE 3.09Å; L473-M481 HydrophobicContact CD1-SD 4.05Å; I477-M481 HydrophobicContact CG2-CG 4.37Å; I477-M481 WeakPolarHBondContact O-CG 3.29Å; I477-M481 PolarHBondContact O-N 3.22Å; G478-M481 PolarHBondContact O-N 3.41Å; M481-C483 VanDerWaalsContact C-N 3.27Å; M481-C483 PolarHBondContact O-N 3.47Å; M481-L484 PolarHBondContact O-N 2.85Å; M481-Y485 PolarHBondContact O-N 3.3Å
482	R	85.9	Confident	83	Confident	13 Å²	13	80.4 Å²	80.4	5%	0.049	40%	0.403	C	S	.	.	H	α-helix	trans	-59.9	-38.6	172.7	-72.7	-176.6	-172.4	93.8	6.3	111.4	I470 N471 G478 D479 G486 C541	I470-R482 HydrophobicContact CD1-CG 4.07Å; I470-R482 HydrophobicContact CG2-CG 3.38Å; N471-R482 PolarHBondContact OD1-NH2 3.33Å; G478-R482 WeakPolarHBondContact O-CG 3.08Å; G478-R482 PolarHBondContact O-N 2.78Å; D479-R482 PolarHBondContact O-N 3.33Å; D479-R482 IonicContact OD1-CZ 3.99Å; D479-R482 IonicContact OD1-NH1 2.64Å; D479-R482 PolarHBondContact OD1-NH1 2.86Å; R482-G486 WeakPolarHBondContact O-CA 3.23Å; R482-G486 PolarHBondContact O-N 3.49Å; R482-C541 HydrophobicContact CB-CB 4.33Å
483	C	86.9	Confident	82.3	Confident	51 Å²	51	81.4 Å²	81.4	35%	0.345	41%	0.412	S	S	.	.	H	α-helix	trans	-79.8	-32	177.5	-64.9	0	0	0	0	113.1	D479 W480 M481 C541	D479-C483 PolarHBondContact O-N 2.85Å; D479-C483 VanDerWaalsContact O-N 3.1Å; D479-C483 PolarHBondContact O-SG 3.29Å; W480-C483 PolarHBondContact O-N 2.98Å; M481-C483 VanDerWaalsContact C-N 3.27Å; M481-C483 PolarHBondContact O-N 3.47Å; C483-C541 WeakPolarHBondContact CA-SG 3.44Å; C483-C541 HydrophobicContact CB-CB 3.84Å; C483-C541 WeakPolarHBondContact CB-SG 3.45Å; C483-C541 WeakPolarHBondContact SG-CB 3.41Å; C483-C541 CovalentContact SG-SG 2.04Å; C483-C541 PolarHBondContact SG-SG 3.43Å
484	L	86.9	Confident	81.2	Confident	93 Å²	93	85.9 Å²	85.9	49%	0.487	44%	0.435	S	S	.	.	H	α-helix	trans	-68.6	-43.8	179.3	-175.8	68.9	0	0	0	112.1	W480 M481	W480-L484 HydrophobicContact CH2-CD2 3.54Å; W480-L484 HydrophobicContact CZ2-CD2 3.97Å; W480-L484 HydrophobicContact CZ3-CD2 3.87Å; W480-L484 WeakPolarHBondContact O-CB 3.19Å; W480-L484 PolarHBondContact O-N 3.04Å; M481-L484 PolarHBondContact O-N 2.85Å
485	Y	82.7	Confident	79.5	Confident	149 Å²	149	89.8 Å²	89.8	58%	0.584	44%	0.443	S	S	*	.	H	α-helix	trans	-102	-15.9	-176.8	-68.7	-73.3	0	0	0	113.8	M481 F546	M481-Y485 PolarHBondContact O-N 3.3Å; Y485-F546 WeakPolarHBondContact O-CE2 3.45Å
486	G	85.2	Confident	77.5	Confident	18 Å²	18	91 Å²	91	19%	0.186	45%	0.446	C	S	.	.	S	Bend	trans	-101.2	-165	-178.9	0	0	0	0	0	113.6	R482 H542	R482-G486 WeakPolarHBondContact O-CA 3.23Å; R482-G486 PolarHBondContact O-N 3.49Å; G486-H542 CarbonylContact C-O 3.58Å; G486-H542 WeakPolarHBondContact CA-O 3.39Å
487	E	86.3	Confident	75.6	Confident	93 Å²	93	89.7 Å²	89.7	44%	0.435	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	149.4	179.7	-70.1	167.2	-173.3	0	0	109.1	C541 H542	E487-C541 CarbonylContact O-C 3.56Å; E487-C541 VanDerWaalsContact O-CA 3.22Å; E487-C541 WeakPolarHBondContact O-CA 3.43Å; E487-H542 PolarHBondContact N-O 2.91Å; E487-H542 PolarHBondContact O-N 3.37Å; E487-H542 IonicContact OE2-CE1 3.34Å
488	T	85.7	Confident	73.8	Confident	100 Å²	100	90.7 Å²	90.7	61%	0.613	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.1	178.2	62.3	0	0	0	0	109.8
489	Y	83.9	Confident	71.6	Confident	32 Å²	32	98.3 Å²	98.3	13%	0.125	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-64	137.7	171.1	-74.9	-80.2	0	0	0	109.8	I533 K534 A537 H539 T540 H542	Y489-I533 HydrophobicContact CE1-CG2 4.44Å; Y489-K534 HydrophobicContact CD1-CB 4.24Å; Y489-K534 HydrophobicContact CG-CB 4.25Å; Y489-K534 HydrophobicContact CG-CG 4.09Å; Y489-K534 PolarHBondContact O-NZ 3.4Å; Y489-K534 VanDerWaalsContact O-NZ 3.12Å; Y489-A537 HydrophobicContact CE2-CB 3.84Å; Y489-H539 WeakPolarHBondContact CD2-O 3.3Å; Y489-H539 WeakPolarHBondContact CE2-O 3.26Å; Y489-T540 WeakPolarHBondContact CD2-O 3.46Å; Y489-T540 PolarHBondContact N-O 3.42Å; Y489-H542 AromaticContact CD1-CD2 3.73Å; Y489-H542 AromaticContact CE1-CD2 3.52Å; Y489-H542 HydrophobicContact CE2-CB 4.05Å; Y489-H542 AromaticContact CE2-CD2 3.91Å; Y489-H542 AromaticContact CZ-CD2 3.61Å
490	P	82.6	Confident	69.4	Low	30 Å²	30	100.8 Å²	100.8	20%	0.195	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-56.3	152	-178.8	22.8	-32.6	0	0	0	111.4	C492 E527 L530 K534	P490-C492 PolarHBondContact O-N 3.4Å; P490-E527 HydrophobicContact CB-CG 4.35Å; P490-L530 HydrophobicContact CG-CB 3.87Å; P490-K534 VanDerWaalsContact O-CD 3.25Å; P490-K534 WeakPolarHBondContact O-CD 3.24Å; P490-K534 PolarHBondContact O-NZ 3.38Å
491	K	77.2	Confident	67.6	Low	197 Å²	197	100 Å²	100	86%	0.857	54%	0.537	S	S	*	.			trans	-76.8	98.4	178.2	-69.1	-176.4	-178.1	178.7	0	108.9	D493	K491-D493 PolarHBondContact O-N 3.26Å
492	C	74.4	Confident	65.7	Low	38 Å²	38	103.3 Å²	103.3	26%	0.257	56%	0.563	S	S	.	*			trans	-66.5	112.6	169.4	-66.7	0	0	0	0	111.6	P490 L494 C531	P490-C492 PolarHBondContact O-N 3.4Å; C492-L494 PolarHBondContact O-N 2.77Å; C492-C531 WeakPolarHBondContact CA-SG 3.34Å; C492-C531 HydrophobicContact CB-CB 4.25Å; C492-C531 WeakPolarHBondContact CB-SG 3.3Å; C492-C531 VanDerWaalsContact SG-C 3.55Å; C492-C531 WeakPolarHBondContact SG-CA 3.43Å; C492-C531 WeakPolarHBondContact SG-CB 3.18Å; C492-C531 PolarHBondContact SG-O 3.22Å; C492-C531 CovalentContact SG-SG 2.01Å; C492-C531 PolarHBondContact SG-SG 3.3Å
493	D	65.5	Low	63.5	Low	150 Å²	150	106.7 Å²	106.7	80%	0.802	59%	0.586	S	S	*	*			trans	-77.5	112.8	159.6	-69	-27.1	0	0	0	107.7	K491 K495	K491-D493 PolarHBondContact O-N 3.26Å; D493-K495 VanDerWaalsContact C-N 3.26Å; D493-K495 PolarHBondContact O-N 3Å
494	L	54.3	Low	61.3	Low	156 Å²	156	109.1 Å²	109.1	82%	0.817	61%	0.609	S	S	*	*			trans	-63.5	87	171.1	-99	132.4	0	0	0	109	C492 N496	C492-L494 PolarHBondContact O-N 2.77Å; L494-N496 PolarHBondContact O-N 2.96Å
495	K	50.7	Low	58.9	Low	168 Å²	168	110.6 Å²	110.6	73%	0.73	62%	0.622	S	S	*	*			trans	-80.1	111.6	154.9	-97.3	-173.8	173	-170.1	0	107.1	D493 T497	D493-K495 VanDerWaalsContact C-N 3.26Å; D493-K495 PolarHBondContact O-N 3Å; K495-T497 PolarHBondContact O-N 3.2Å
496	N	40.7	Very low	56.7	Low	128 Å²	128	110.9 Å²	110.9	68%	0.684	63%	0.628	S	S	*	*			trans	-36.2	132	177.5	-68.9	-21.5	0	0	0	112.8	L494 S498	L494-N496 PolarHBondContact O-N 2.96Å; N496-S498 PolarHBondContact O-N 2.82Å
497	T	42.9	Very low	54.3	Low	151 Å²	151	119 Å²	119	93%	0.926	66%	0.659	S	S	*	*	S	Bend	trans	-65.3	45.5	175.8	-32.8	0	0	0	0	113.2	K495	K495-T497 PolarHBondContact O-N 3.2Å
498	S	40.8	Very low	51.9	Low	97 Å²	97	118.1 Å²	118.1	68%	0.678	67%	0.667	S	S	*	*	S	Bend	trans	-152.2	45.4	178.3	68.1	0	0	0	0	112.6	N496	N496-S498 PolarHBondContact O-N 2.82Å
499	Q	39.2	Very low	49.7	Very low	160 Å²	160	120.3 Å²	120.3	75%	0.748	68%	0.675	S	S	*	*			trans	-163.6	56.1	153.5	-134.6	165.2	-1.2	0	0	111.9	N501	Q499-N501 PolarHBondContact O-N 3.48Å
500	A	40.1	Very low	47.6	Very low	98 Å²	98	123.8 Å²	123.8	81%	0.81	70%	0.704	S	S	*	*			trans	-77.8	77.3	160.3	0	0	0	0	0	108.2
501	N	45.9	Very low	45.4	Very low	140 Å²	140	127.8 Å²	127.8	75%	0.749	73%	0.733	S	S	*	*	S	Bend	trans	177.9	116.9	153.6	-88	-15.2	0	0	0	105.6	Q499	Q499-N501 PolarHBondContact O-N 3.48Å
502	S	41.7	Very low	43.6	Very low	108 Å²	108	126.4 Å²	126.4	76%	0.755	73%	0.734	S	S	*	*	S	Bend	trans	84.4	85.4	-175.6	-27.7	0	0	0	0	113.9
503	T	40.9	Very low	42	Very low	84 Å²	84	129.8 Å²	129.8	52%	0.515	76%	0.758	S	S	.	*			trans	176.3	13.2	145.3	32	0	0	0	0	112.7	V505	T503-V505 VanDerWaalsContact C-N 3.29Å
504	A	38.8	Very low	40.8	Very low	101 Å²	101	125.3 Å²	125.3	84%	0.835	75%	0.747	S	S	*	*	S	Bend	trans	-77	-14.8	165.4	0	0	0	0	0	113.1
505	V	38.1	Very low	40.3	Very low	125 Å²	125	124.3 Å²	124.3	76%	0.758	75%	0.75	S	S	*	*	S	Bend	trans	-92.8	-18.7	-177.6	179.7	0	0	0	0	112.8	T503	T503-V505 VanDerWaalsContact C-N 3.29Å
506	E	36.2	Very low	40.1	Very low	154 Å²	154	120.7 Å²	120.7	72%	0.72	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-9.9	-166.9	-142.8	162.6	-164.2	0	0	114.6
507	K	34.3	Very low	41.1	Very low	190 Å²	190	117.3 Å²	117.3	83%	0.826	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	11.5	172.2	-104.6	-175.3	-179.8	-173.8	0	114.2
508	A	36.4	Very low	42	Very low	73 Å²	73	115.7 Å²	115.7	60%	0.603	71%	0.714	S	S	*	*	S	Bend	trans	-93.6	-13.3	174.3	0	0	0	0	0	113.6
509	N	39.4	Very low	43	Very low	147 Å²	147	115.3 Å²	115.3	79%	0.786	71%	0.707	S	S	*	*	S	Bend	trans	-110	9.7	-167.4	-72.5	-1.7	0	0	0	115.8
510	S	40.3	Very low	44.5	Very low	105 Å²	105	110.5 Å²	110.5	73%	0.734	69%	0.689	S	S	*	*	S	Bend	trans	-142.3	52.9	177.7	75	0	0	0	0	114.3
511	S	36.6	Very low	45.7	Very low	114 Å²	114	110.6 Å²	110.6	80%	0.797	68%	0.675	S	S	*	*	S	Bend	trans	-164.5	131.8	143.8	51.7	0	0	0	0	110.4
512	L	38.6	Very low	46.8	Very low	167 Å²	167	107.8 Å²	107.8	87%	0.874	66%	0.659	S	S	*	*			trans	-67.8	125.3	-166.5	-161.4	73.5	0	0	0	112.8
513	S	39.8	Very low	48.2	Very low	109 Å²	109	108.4 Å²	108.4	76%	0.762	65%	0.648	S	S	*	*			trans	50.9	102.5	145	69.5	0	0	0	0	121.2
514	G	40.3	Very low	49.5	Very low	57 Å²	57	109.9 Å²	109.9	59%	0.588	65%	0.651	S	S	*	*			trans	-167	144.7	146.1	0	0	0	0	0	108.8	V516	G514-V516 PolarHBondContact O-N 3.12Å
515	P	44.8	Very low	51.1	Low	134 Å²	134	110.6 Å²	110.6	87%	0.87	64%	0.637	S	S	*	*			trans	-62.9	110.9	174	26.9	-30.4	0	0	0	107.2	S517	P515-S517 PolarHBondContact O-N 2.82Å
516	V	47.5	Very low	52.8	Low	92 Å²	92	109.8 Å²	109.8	56%	0.558	62%	0.624	S	S	*	*			trans	-60.4	109.6	173.9	-178.2	0	0	0	0	106.1	G514 T520 L521	G514-V516 PolarHBondContact O-N 3.12Å; V516-T520 HydrophobicContact CG1-CG2 4.11Å; V516-L521 HydrophobicContact CG1-CD2 4.08Å; V516-L521 HydrophobicContact CG1-CG 3.87Å
517	S	60.9	Low	54.7	Low	58 Å²	58	107.3 Å²	107.3	41%	0.406	61%	0.613	S	S	.	*			trans	-61.5	144.5	-177.3	76.5	0	0	0	0	109.4	P515 V519 T520 L521	P515-S517 PolarHBondContact O-N 2.82Å; S517-V519 PolarHBondContact O-N 2.89Å; S517-T520 WeakPolarHBondContact O-CA 3.22Å; S517-T520 WeakPolarHBondContact O-CB 3.3Å; S517-T520 PolarHBondContact O-N 2.84Å; S517-T520 PolarHBondContact OG-N 3.4Å; S517-T520 PolarHBondContact OG-OG1 2.76Å; S517-L521 PolarHBondContact O-N 2.86Å
518	L	61.3	Low	56.7	Low	117 Å²	117	104.7 Å²	104.7	61%	0.613	60%	0.603	S	S	*	*	H	α-helix	trans	-48.4	-33.9	175	-167.2	87.2	0	0	0	111.8	L521 I522	L518-L521 PolarHBondContact O-N 2.74Å; L518-I522 HydrophobicContact CD2-CD1 4.15Å; L518-I522 HydrophobicContact CG-CD1 4.07Å; L518-I522 VanDerWaalsContact O-CG1 3.29Å; L518-I522 WeakPolarHBondContact O-CG1 3.37Å; L518-I522 PolarHBondContact O-N 3.15Å
519	V	62.1	Low	58.8	Low	89 Å²	89	106.3 Å²	106.3	54%	0.539	60%	0.599	S	S	.	*	H	α-helix	trans	-64.8	-36.8	177.1	-177.7	0	0	0	0	112.3	S517 K523	S517-V519 PolarHBondContact O-N 2.89Å; V519-K523 WeakPolarHBondContact O-CB 3.11Å; V519-K523 WeakPolarHBondContact O-CG 3.45Å; V519-K523 PolarHBondContact O-N 2.79Å; V519-K523 VanDerWaalsContact O-N 3.09Å
520	T	69.8	Low	60.8	Low	59 Å²	59	102.1 Å²	102.1	36%	0.362	58%	0.576	S	S	.	*	H	α-helix	trans	-71.1	-37.8	177.2	-46.5	0	0	0	0	111.2	V516 S517 M524	V516-T520 HydrophobicContact CG1-CG2 4.11Å; S517-T520 WeakPolarHBondContact O-CA 3.22Å; S517-T520 WeakPolarHBondContact O-CB 3.3Å; S517-T520 PolarHBondContact O-N 2.84Å; S517-T520 PolarHBondContact OG-N 3.4Å; S517-T520 PolarHBondContact OG-OG1 2.76Å; T520-M524 WeakPolarHBondContact O-CG 3.37Å; T520-M524 PolarHBondContact O-N 2.61Å
521	L	66.8	Low	62.8	Low	99 Å²	99	98.8 Å²	98.8	52%	0.518	55%	0.552	S	S	.	*	H	α-helix	trans	-68.4	-42.7	176.5	-72.1	172.1	0	0	0	112.3	V516 S517 L518 K523 M524 Q525	V516-L521 HydrophobicContact CG1-CD2 4.08Å; V516-L521 HydrophobicContact CG1-CG 3.87Å; S517-L521 PolarHBondContact O-N 2.86Å; L518-L521 PolarHBondContact O-N 2.74Å; L521-K523 VanDerWaalsContact C-N 3.34Å; L521-K523 PolarHBondContact O-N 2.84Å; L521-M524 PolarHBondContact O-N 3.04Å; L521-Q525 PolarHBondContact O-N 2.83Å
522	I	69.3	Low	64.9	Low	81 Å²	81	99.9 Å²	99.9	42%	0.415	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-43.5	175.9	-67.2	164.8	0	0	0	110.4	L518 M524 Q525 E526	L518-I522 HydrophobicContact CD2-CD1 4.15Å; L518-I522 HydrophobicContact CG-CD1 4.07Å; L518-I522 VanDerWaalsContact O-CG1 3.29Å; L518-I522 WeakPolarHBondContact O-CG1 3.37Å; L518-I522 PolarHBondContact O-N 3.15Å; I522-M524 PolarHBondContact O-N 2.81Å; I522-Q525 PolarHBondContact O-N 2.85Å; I522-E526 HydrophobicContact CG2-CG 4.42Å; I522-E526 WeakPolarHBondContact O-CG 3.38Å; I522-E526 PolarHBondContact O-N 3.05Å
523	K	70.4	Confident	67	Low	122 Å²	122	96.2 Å²	96.2	53%	0.53	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-41.2	175.5	-79.9	-176.4	175.3	-171.2	0	113	V519 L521 Q525 E526 E527	V519-K523 WeakPolarHBondContact O-CB 3.11Å; V519-K523 WeakPolarHBondContact O-CG 3.45Å; V519-K523 PolarHBondContact O-N 2.79Å; V519-K523 VanDerWaalsContact O-N 3.09Å; L521-K523 VanDerWaalsContact C-N 3.34Å; L521-K523 PolarHBondContact O-N 2.84Å; K523-Q525 VanDerWaalsContact C-N 3.33Å; K523-Q525 PolarHBondContact O-N 2.8Å; K523-E526 PolarHBondContact O-N 3.42Å; K523-E527 WeakPolarHBondContact O-CB 3.44Å; K523-E527 VanDerWaalsContact O-CG 3.28Å; K523-E527 WeakPolarHBondContact O-CG 3.5Å; K523-E527 PolarHBondContact O-N 2.8Å
524	M	67.3	Low	69	Low	115 Å²	115	93.9 Å²	93.9	57%	0.567	50%	0.501	S	S	*	.	H	α-helix	trans	-64.7	-37.6	176.9	-76.9	-174.1	155.9	0	0	112.2	T520 L521 I522 E528	T520-M524 WeakPolarHBondContact O-CG 3.37Å; T520-M524 PolarHBondContact O-N 2.61Å; L521-M524 PolarHBondContact O-N 3.04Å; I522-M524 PolarHBondContact O-N 2.81Å; M524-E528 PolarHBondContact O-N 3.42Å
525	Q	72.8	Confident	70.7	Confident	116 Å²	116	95.6 Å²	95.6	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-68.1	-44.2	175	-174.1	177.9	-19.2	0	0	112	L521 I522 K523 E527 E528 E529	L521-Q525 PolarHBondContact O-N 2.83Å; I522-Q525 PolarHBondContact O-N 2.85Å; K523-Q525 VanDerWaalsContact C-N 3.33Å; K523-Q525 PolarHBondContact O-N 2.8Å; Q525-E527 VanDerWaalsContact C-N 3.32Å; Q525-E527 PolarHBondContact O-N 3.04Å; Q525-E528 PolarHBondContact O-N 3.48Å; Q525-E529 PolarHBondContact O-N 3.48Å; Q525-E529 VanDerWaalsContact O-N 3.13Å
526	E	73.8	Confident	72.4	Confident	107 Å²	107	96.4 Å²	96.4	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-39.5	175.3	-74.2	178	165.7	0	0	111.9	I522 K523 E528 E529 L530	I522-E526 HydrophobicContact CG2-CG 4.42Å; I522-E526 WeakPolarHBondContact O-CG 3.38Å; I522-E526 PolarHBondContact O-N 3.05Å; K523-E526 PolarHBondContact O-N 3.42Å; E526-E528 PolarHBondContact O-N 3.33Å; E526-E529 PolarHBondContact O-N 3.27Å; E526-L530 VanDerWaalsContact O-CB 3.31Å; E526-L530 WeakPolarHBondContact O-CB 3.44Å; E526-L530 WeakPolarHBondContact O-CD1 3.45Å; E526-L530 WeakPolarHBondContact O-CG 3.46Å; E526-L530 PolarHBondContact O-N 2.99Å
527	E	76.1	Confident	73.9	Confident	103 Å²	103	93.4 Å²	93.4	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-37.1	176.7	-77.9	177.3	179.3	0	0	112.6	P490 K523 Q525 C531	P490-E527 HydrophobicContact CB-CG 4.35Å; K523-E527 WeakPolarHBondContact O-CB 3.44Å; K523-E527 VanDerWaalsContact O-CG 3.28Å; K523-E527 WeakPolarHBondContact O-CG 3.5Å; K523-E527 PolarHBondContact O-N 2.8Å; Q525-E527 VanDerWaalsContact C-N 3.32Å; Q525-E527 PolarHBondContact O-N 3.04Å; E527-C531 WeakPolarHBondContact O-CB 3.31Å; E527-C531 PolarHBondContact O-N 3.23Å
528	E	77.6	Confident	74.7	Confident	134 Å²	134	100.3 Å²	100.3	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-69.5	-40.5	177.5	-169.4	171.1	-172.7	0	0	112.1	M524 Q525 E526 C531 Q532	M524-E528 PolarHBondContact O-N 3.42Å; Q525-E528 PolarHBondContact O-N 3.48Å; E526-E528 PolarHBondContact O-N 3.33Å; E528-C531 WeakPolarHBondContact O-CB 3.45Å; E528-C531 PolarHBondContact O-N 3.42Å; E528-Q532 PolarHBondContact O-N 3.38Å
529	E	80.5	Confident	75.6	Confident	107 Å²	107	98.1 Å²	98.1	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-67.9	-44.6	175.2	-69.1	-179.9	-174.5	0	0	111.9	Q525 E526 C531 Q532 I533	Q525-E529 PolarHBondContact O-N 3.48Å; Q525-E529 VanDerWaalsContact O-N 3.13Å; E526-E529 PolarHBondContact O-N 3.27Å; E529-C531 PolarHBondContact O-N 3.31Å; E529-Q532 PolarHBondContact O-N 2.87Å; E529-I533 PolarHBondContact O-N 3.45Å
530	L	80.7	Confident	76.5	Confident	59 Å²	59	98.4 Å²	98.4	31%	0.309	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-28.4	174.9	-75	169.2	0	0	0	112.1	P490 E526 I533 K534	P490-L530 HydrophobicContact CG-CB 3.87Å; E526-L530 VanDerWaalsContact O-CB 3.31Å; E526-L530 WeakPolarHBondContact O-CB 3.44Å; E526-L530 WeakPolarHBondContact O-CD1 3.45Å; E526-L530 WeakPolarHBondContact O-CG 3.46Å; E526-L530 PolarHBondContact O-N 2.99Å; L530-I533 PolarHBondContact O-N 3.1Å; L530-K534 PolarHBondContact O-N 2.74Å
531	C	81.6	Confident	77.3	Confident	35 Å²	35	95.9 Å²	95.9	24%	0.236	49%	0.487	C	S	.	.	H	α-helix	trans	-69.4	-40.3	179	-179.3	0	0	0	0	113	C492 E527 E528 E529 I533 K534	C492-C531 WeakPolarHBondContact CA-SG 3.34Å; C492-C531 HydrophobicContact CB-CB 4.25Å; C492-C531 WeakPolarHBondContact CB-SG 3.3Å; C492-C531 VanDerWaalsContact SG-C 3.55Å; C492-C531 WeakPolarHBondContact SG-CA 3.43Å; C492-C531 WeakPolarHBondContact SG-CB 3.18Å; C492-C531 PolarHBondContact SG-O 3.22Å; C492-C531 CovalentContact SG-SG 2.01Å; C492-C531 PolarHBondContact SG-SG 3.3Å; E527-C531 WeakPolarHBondContact O-CB 3.31Å; E527-C531 PolarHBondContact O-N 3.23Å; E528-C531 WeakPolarHBondContact O-CB 3.45Å; E528-C531 PolarHBondContact O-N 3.42Å; E529-C531 PolarHBondContact O-N 3.31Å; C531-I533 VanDerWaalsContact C-N 3.26Å; C531-I533 PolarHBondContact O-N 3.39Å; C531-K534 WeakPolarHBondContact O-CB 3.34Å; C531-K534 PolarHBondContact O-N 2.96Å
532	Q	81.8	Confident	78.3	Confident	138 Å²	138	92.2 Å²	92.2	65%	0.645	47%	0.468	S	S	*	.	H	α-helix	trans	-61.5	-38.5	173.9	-63.4	179.6	8.4	0	0	111.3	E528 E529	E528-Q532 PolarHBondContact O-N 3.38Å; E529-Q532 PolarHBondContact O-N 2.87Å
533	I	82.6	Confident	79.2	Confident	89 Å²	89	88.5 Å²	88.5	46%	0.456	45%	0.448	S	S	.	.	H	α-helix	trans	-72.6	-34.5	179.7	-61.2	170.9	0	0	0	111.3	Y489 E529 L530 C531 A535 L536 A537	Y489-I533 HydrophobicContact CE1-CG2 4.44Å; E529-I533 PolarHBondContact O-N 3.45Å; L530-I533 PolarHBondContact O-N 3.1Å; C531-I533 VanDerWaalsContact C-N 3.26Å; C531-I533 PolarHBondContact O-N 3.39Å; I533-A535 VanDerWaalsContact C-N 3.25Å; I533-A535 PolarHBondContact O-N 3.04Å; I533-L536 CarbonylContact O-C 3.57Å; I533-L536 WeakPolarHBondContact O-CA 3.27Å; I533-L536 WeakPolarHBondContact O-CB 3.43Å; I533-L536 PolarHBondContact O-N 2.87Å; I533-A537 PolarHBondContact O-N 2.96Å
534	K	80.4	Confident	80	Confident	60 Å²	60	88.1 Å²	88.1	26%	0.261	45%	0.447	S	S	.	.	H	α-helix	trans	-56.6	-38.2	179.4	-173.7	-177.8	-168.4	166.8	0	112.8	Y489 P490 L530 C531 L536 A537	Y489-K534 HydrophobicContact CD1-CB 4.24Å; Y489-K534 HydrophobicContact CG-CB 4.25Å; Y489-K534 HydrophobicContact CG-CG 4.09Å; Y489-K534 PolarHBondContact O-NZ 3.4Å; Y489-K534 VanDerWaalsContact O-NZ 3.12Å; P490-K534 VanDerWaalsContact O-CD 3.25Å; P490-K534 WeakPolarHBondContact O-CD 3.24Å; P490-K534 PolarHBondContact O-NZ 3.38Å; L530-K534 PolarHBondContact O-N 2.74Å; C531-K534 WeakPolarHBondContact O-CB 3.34Å; C531-K534 PolarHBondContact O-N 2.96Å; K534-L536 PolarHBondContact O-N 2.89Å; K534-A537 PolarHBondContact O-N 2.76Å
535	A	76	Confident	80.7	Confident	94 Å²	94	91.7 Å²	91.7	78%	0.777	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.5	177.8	0	0	0	0	0	112.8	I533	I533-A535 VanDerWaalsContact C-N 3.25Å; I533-A535 PolarHBondContact O-N 3.04Å
536	L	80.7	Confident	81.1	Confident	150 Å²	150	91.1 Å²	91.1	79%	0.785	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-24.7	178.7	-58.5	172.5	0	0	0	112.2	I533 K534	I533-L536 CarbonylContact O-C 3.57Å; I533-L536 WeakPolarHBondContact O-CA 3.27Å; I533-L536 WeakPolarHBondContact O-CB 3.43Å; I533-L536 PolarHBondContact O-N 2.87Å; K534-L536 PolarHBondContact O-N 2.89Å
537	A	78.8	Confident	81.5	Confident	30 Å²	30	86.6 Å²	86.6	25%	0.248	43%	0.429	C	S	.	.			trans	-75.6	124.5	179.3	0	0	0	0	0	111	Y489 I533 K534 H539	Y489-A537 HydrophobicContact CE2-CB 3.84Å; I533-A537 PolarHBondContact O-N 2.96Å; K534-A537 PolarHBondContact O-N 2.76Å; A537-H539 PolarHBondContact O-N 2.93Å
538	K	77.6	Confident	82	Confident	202 Å²	202	83.9 Å²	83.9	88%	0.878	42%	0.421	S	S	*	.	S	Bend	trans	-74.5	-8.8	177.5	-66.6	-177.7	179.3	179.2	0	114.3
539	H	81	Confident	82.4	Confident	71 Å²	71	79.5 Å²	79.5	33%	0.329	40%	0.399	S	S	.	.	S	Bend	trans	-116	148.3	-175.8	-56.7	-77.5	0	0	0	110.9	D479 Y489 A537	D479-H539 IonicContact OD1-CE1 3.93Å; D479-H539 PolarHBondContact OD1-CE1 3.47Å; D479-H539 IonicContact OD1-CG 2.74Å; D479-H539 IonicContact OD1-ND1 2.65Å; D479-H539 PolarHBondContact OD1-ND1 2.92Å; D479-H539 IonicContact OD2-ND1 3.06Å; Y489-H539 WeakPolarHBondContact CD2-O 3.3Å; Y489-H539 WeakPolarHBondContact CE2-O 3.26Å; A537-H539 PolarHBondContact O-N 2.93Å
540	T	81.6	Confident	82.9	Confident	95 Å²	95	80.4 Å²	80.4	58%	0.583	40%	0.398	S	S	*	.	S	Bend	trans	-79.4	-23.8	179.8	50.6	0	0	0	0	113.8	Y489	Y489-T540 WeakPolarHBondContact CD2-O 3.46Å; Y489-T540 PolarHBondContact N-O 3.42Å
541	C	86.4	Confident	83.4	Confident	7 Å²	7	77.9 Å²	77.9	5%	0.047	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.3	-177.3	-51.7	0	0	0	0	111.4	R482 C483 E487	R482-C541 HydrophobicContact CB-CB 4.33Å; C483-C541 WeakPolarHBondContact CA-SG 3.44Å; C483-C541 HydrophobicContact CB-CB 3.84Å; C483-C541 WeakPolarHBondContact CB-SG 3.45Å; C483-C541 WeakPolarHBondContact SG-CB 3.41Å; C483-C541 CovalentContact SG-SG 2.04Å; C483-C541 PolarHBondContact SG-SG 3.43Å; E487-C541 CarbonylContact O-C 3.56Å; E487-C541 VanDerWaalsContact O-CA 3.22Å; E487-C541 WeakPolarHBondContact O-CA 3.43Å
542	H	87	Confident	84	Confident	22 Å²	22	77 Å²	77	10%	0.102	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.3	179.5	66.1	64.2	0	0	0	112.5	G486 E487 Y489 K544	G486-H542 CarbonylContact C-O 3.58Å; G486-H542 WeakPolarHBondContact CA-O 3.39Å; E487-H542 PolarHBondContact N-O 2.91Å; E487-H542 PolarHBondContact O-N 3.37Å; E487-H542 IonicContact OE2-CE1 3.34Å; Y489-H542 AromaticContact CD1-CD2 3.73Å; Y489-H542 AromaticContact CE1-CD2 3.52Å; Y489-H542 HydrophobicContact CE2-CB 4.05Å; Y489-H542 AromaticContact CE2-CD2 3.91Å; Y489-H542 AromaticContact CZ-CD2 3.61Å; H542-K544 HydrophobicContact CB-CG 4.16Å
543	V	88.4	Confident	84.6	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.012	35%	0.347	C	S	.	.			trans	-107.1	29.9	177.5	-71.5	0	0	0	0	112.4	N464 Q467 I470 R545 F546	N464-V543 PolarHBondContact ND2-O 3.34Å; Q467-V543 HydrophobicContact CB-CG2 3.87Å; Q467-V543 HydrophobicContact CG-CG2 4.47Å; I470-V543 HydrophobicContact CD1-CG1 3.95Å; I470-V543 HydrophobicContact CD1-CG2 4.18Å; V543-R545 PolarHBondContact O-N 2.98Å; V543-R545 VanDerWaalsContact O-N 3.13Å; V543-F546 HydrophobicContact CB-CD2 4.19Å; V543-F546 PolarHBondContact O-N 3.12Å; V543-F546 VanDerWaalsContact O-N 3.08Å
544	K	86.6	Confident	85	Confident	114 Å²	114	66.8 Å²	66.8	50%	0.496	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.4	-19.7	-177.7	-72.1	-63.9	-169.6	-177.3	0	114.8	H542 F546 D547	H542-K544 HydrophobicContact CB-CG 4.16Å; K544-F546 PolarHBondContact O-N 3.06Å; K544-D547 WeakPolarHBondContact CD-OD2 3.38Å; K544-D547 WeakPolarHBondContact CE-OD2 3.49Å; K544-D547 IonicContact NZ-OD1 3.86Å; K544-D547 IonicContact NZ-OD2 3.88Å; K544-D547 PolarHBondContact NZ-OD2 2.91Å; K544-D547 WeakPolarHBondContact O-CB 3.49Å; K544-D547 PolarHBondContact O-N 3.31Å
545	R	82.9	Confident	85.5	Confident	191 Å²	191	63.9 Å²	63.9	72%	0.721	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-57.7	-27.1	171.9	-176.4	174.3	173.8	-174.6	-1.4	113.3	V543	V543-R545 PolarHBondContact O-N 2.98Å; V543-R545 VanDerWaalsContact O-N 3.13Å
546	F	80.3	Confident	86.1	Confident	103 Å²	103	59.7 Å²	59.7	45%	0.452	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-95.6	10.3	178.2	-56.7	-75.4	0	0	0	113.5	A466 Y485 V543 K544 S548	A466-F546 HydrophobicContact CB-CB 4.33Å; A466-F546 HydrophobicContact CB-CD2 4.23Å; A466-F546 HydrophobicContact CB-CG 4.38Å; Y485-F546 WeakPolarHBondContact O-CE2 3.45Å; V543-F546 HydrophobicContact CB-CD2 4.19Å; V543-F546 PolarHBondContact O-N 3.12Å; V543-F546 VanDerWaalsContact O-N 3.08Å; K544-F546 PolarHBondContact O-N 3.06Å; F546-S548 PolarHBondContact O-N 2.94Å
547	D	83.9	Confident	86.2	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.07	26%	0.255	C	S	.	.			trans	-69.9	126.9	175.1	-77.1	16.3	0	0	0	110.3	T462 N464 K544 Y549	T462-D547 HydrophobicContact CG2-CB 3.97Å; T462-D547 WeakPolarHBondContact CG2-OD2 2.97Å; N464-D547 WeakPolarHBondContact CB-OD1 3.41Å; N464-D547 PolarHBondContact ND2-OD1 2.78Å; K544-D547 WeakPolarHBondContact CD-OD2 3.38Å; K544-D547 WeakPolarHBondContact CE-OD2 3.49Å; K544-D547 IonicContact NZ-OD1 3.86Å; K544-D547 IonicContact NZ-OD2 3.88Å; K544-D547 PolarHBondContact NZ-OD2 2.91Å; K544-D547 WeakPolarHBondContact O-CB 3.49Å; K544-D547 PolarHBondContact O-N 3.31Å; D547-Y549 HydrophobicContact CB-CE1 4.18Å; D547-Y549 HydrophobicContact CB-CE2 3.99Å
548	S	85	Confident	86.3	Confident	45 Å²	45	56.1 Å²	56.1	32%	0.315	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.6	167.2	-175.3	0	0	0	0	108.9	E463 F546 N578	E463-S548 PolarHBondContact N-O 3.27Å; E463-S548 PolarHBondContact O-N 2.64Å; F546-S548 PolarHBondContact O-N 2.94Å; S548-N578 WeakPolarHBondContact OG-CB 3.49Å
549	Y	87.5	Confident	85.9	Confident	42 Å²	42	51.8 Å²	51.8	17%	0.165	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.5	-176.5	-57.3	-79.4	0	0	0	111.4	I459 T462 D547 F551 N578	I459-Y549 HydrophobicContact CD1-CD1 3.96Å; I459-Y549 HydrophobicContact CD1-CE1 4.15Å; I459-Y549 HydrophobicContact CG1-CD1 4.41Å; I459-Y549 HydrophobicContact CG2-CD1 4.05Å; T462-Y549 HydrophobicContact CG2-CD1 3.95Å; T462-Y549 HydrophobicContact CG2-CE1 3.8Å; D547-Y549 HydrophobicContact CB-CE1 4.18Å; D547-Y549 HydrophobicContact CB-CE2 3.99Å; Y549-F551 HydrophobicContact CD2-CZ 4.43Å; Y549-F551 HydrophobicContact CG-CZ 4.17Å; Y549-N578 PolarHBondContact N-OD1 3.42Å; Y549-N578 WeakPolarHBondContact O-CA 3.38Å; Y549-N578 WeakPolarHBondContact O-CB 3.14Å; Y549-N578 PolarHBondContact O-N 3.2Å
550	R	90	Very high	84.7	Confident	126 Å²	126	55.9 Å²	55.9	48%	0.475	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.6	159.7	-64	-172	-177.8	-137.7	2.5	108.3	A460 E461 E463 A576	A460-R550 HydrophobicContact CB-CB 4.41Å; A460-R550 WeakPolarHBondContact CB-O 3.2Å; A460-R550 PolarHBondContact N-O 3.48Å; E461-R550 HydrophobicContact CB-CB 4.14Å; E461-R550 HydrophobicContact CB-CG 4.44Å; E461-R550 PolarHBondContact N-O 3.01Å; E461-R550 PolarHBondContact O-N 2.72Å; E461-R550 IonicContact OE2-NE 2.66Å; E463-R550 IonicContact OE1-CZ 3.18Å; E463-R550 VanDerWaalsContact OE1-CZ 3.26Å; E463-R550 IonicContact OE1-NE 2.78Å; E463-R550 PolarHBondContact OE1-NE 2.65Å; E463-R550 IonicContact OE1-NH2 2.87Å; E463-R550 PolarHBondContact OE1-NH2 2.74Å; R550-A576 CarbonylContact C-O 3.5Å; R550-A576 WeakPolarHBondContact CA-O 3.43Å
551	F	92.3	Very high	83.4	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139	-179.6	-61.3	-84	0	0	0	110.2	V457 R458 I459 Y549 V553 M575 A576 R581 L584	V457-F551 HydrophobicContact CG2-CB 3.83Å; V457-F551 HydrophobicContact CG2-CD1 3.73Å; V457-F551 HydrophobicContact CG2-CG 4.14Å; R458-F551 CarbonylContact O-C 3.51Å; R458-F551 WeakPolarHBondContact O-CA 3.28Å; I459-F551 HydrophobicContact CG1-CD1 4.37Å; I459-F551 HydrophobicContact CG1-CE1 4.19Å; Y549-F551 HydrophobicContact CD2-CZ 4.43Å; Y549-F551 HydrophobicContact CG-CZ 4.17Å; F551-V553 HydrophobicContact CB-CG2 4.33Å; F551-M575 CarbonylContact O-C 3.56Å; F551-M575 WeakPolarHBondContact O-CA 3.42Å; F551-A576 HydrophobicContact CB-CB 4.24Å; F551-A576 PolarHBondContact N-O 3.35Å; F551-A576 PolarHBondContact O-N 2.83Å; F551-R581 HydrophobicContact CE2-CB 3.74Å; F551-R581 HydrophobicContact CE2-CG 4.24Å; F551-R581 HydrophobicContact CZ-CB 3.84Å; F551-R581 HydrophobicContact CZ-CG 3.81Å; F551-L584 HydrophobicContact CB-CD1 3.71Å; F551-L584 HydrophobicContact CD2-CD1 3.93Å; F551-L584 HydrophobicContact CG-CD1 3.83Å
552	E	93.9	Very high	81.3	Confident	18 Å²	18	58.9 Å²	58.9	8%	0.084	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115	165.7	-174.5	179.5	160.8	0	0	108.1	R458 A460 I573 M575	R458-E552 HydrophobicContact CG-CB 3.78Å; R458-E552 HydrophobicContact CG-CG 4.41Å; R458-E552 VanDerWaalsContact CZ-CD 3.46Å; R458-E552 IonicContact CZ-OE1 3.15Å; R458-E552 IonicContact CZ-OE2 3.58Å; R458-E552 PolarHBondContact N-O 3.37Å; R458-E552 IonicContact NE-OE1 3.42Å; R458-E552 PolarHBondContact NE-OE1 2.86Å; R458-E552 IonicContact NE-OE2 3.62Å; R458-E552 PolarHBondContact NE-OE2 3.2Å; R458-E552 IonicContact NH2-OE1 2.75Å; R458-E552 PolarHBondContact NH2-OE1 2.78Å; R458-E552 IonicContact NH2-OE2 2.72Å; R458-E552 PolarHBondContact NH2-OE2 3.06Å; R458-E552 PolarHBondContact O-N 2.68Å; A460-E552 HydrophobicContact CB-CB 3.97Å; E552-I573 HydrophobicContact CG-CG2 3.34Å; E552-I573 WeakPolarHBondContact OE1-CG2 3.45Å; E552-M575 HydrophobicContact CB-CE 4.37Å; E552-M575 HydrophobicContact CB-SD 4.08Å; E552-M575 HydrophobicContact CG-CE 3.95Å; E552-M575 HydrophobicContact CG-SD 4.16Å
553	V	92.9	Very high	79.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122	-174.8	179.5	0	0	0	0	108.2	F454 V457 F551 V555 L574 A576 L584	F454-V553 HydrophobicContact CD2-CG1 3.84Å; F454-V553 HydrophobicContact CE2-CG1 3.65Å; V457-V553 HydrophobicContact CB-CG2 4.35Å; V457-V553 HydrophobicContact CG2-CG2 3.83Å; F551-V553 HydrophobicContact CB-CG2 4.33Å; V553-V555 HydrophobicContact CG1-CG2 3.97Å; V553-L574 HydrophobicContact CB-CB 4.21Å; V553-L574 PolarHBondContact N-O 2.81Å; V553-L574 PolarHBondContact O-N 2.68Å; V553-A576 HydrophobicContact CG2-CB 4.41Å; V553-L584 HydrophobicContact CG1-CD2 4.42Å; V553-L584 HydrophobicContact CG2-CD1 3.71Å; V553-L584 HydrophobicContact CG2-CD2 3.64Å; V553-L584 HydrophobicContact CG2-CG 4.28Å
554	T	91.7	Very high	77.3	Confident	11 Å²	11	66.6 Å²	66.6	7%	0.067	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.5	178.3	-53.1	0	0	0	0	109.2	R455 H456 D571 I572	R455-T554 HydrophobicContact CB-CG2 4.4Å; R455-T554 WeakPolarHBondContact CB-O 3.4Å; R455-T554 PolarHBondContact N-O 3.04Å; H456-T554 PolarHBondContact CE1-OG1 3Å; H456-T554 VanDerWaalsContact CE1-OG1 3.31Å; H456-T554 PolarHBondContact NE2-OG1 3.36Å; H456-T554 VanDerWaalsContact NE2-OG1 3.12Å; H456-T554 PolarHBondContact O-N 3.04Å; T554-D571 HydrophobicContact CG2-CB 3.79Å; T554-I572 WeakPolarHBondContact CA-O 3.42Å
555	V	90.5	Very high	75.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.1	179.7	-174.5	0	0	0	0	109.5	V553 I572 L574 V593 F595	V553-V555 HydrophobicContact CG1-CG2 3.97Å; V555-I572 PolarHBondContact N-O 3.05Å; V555-I572 PolarHBondContact O-N 3.18Å; V555-L574 HydrophobicContact CB-CD1 4.49Å; V555-L574 HydrophobicContact CG2-CD1 3.69Å; V555-V593 HydrophobicContact CG1-CG2 4.28Å; V555-V593 HydrophobicContact CG2-CG2 4.49Å; V555-F595 HydrophobicContact CB-CE1 4.36Å; V555-F595 HydrophobicContact CG1-CD1 4.34Å; V555-F595 HydrophobicContact CG1-CE1 3.79Å
556	G	88.8	Confident	74.2	Confident	6 Å²	6	63.2 Å²	63.2	6%	0.062	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	148.8	170.4	0	0	0	0	0	110.1	G452 R453 D571	G452-G556 CarbonylContact C-O 3.2Å; G452-G556 VanDerWaalsContact CA-O 3.23Å; G452-G556 WeakPolarHBondContact CA-O 3.49Å; R453-G556 PolarHBondContact N-O 3.5Å; R453-G556 PolarHBondContact O-N 3.33Å; G556-D571 WeakPolarHBondContact CA-OD1 3.18Å
557	I	84.3	Confident	73.4	Confident	45 Å²	45	62.3 Å²	62.3	23%	0.231	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.3	-170.5	-58.9	169.7	0	0	0	110.4	W416 Q559 I572	W416-I557 HydrophobicContact CD2-CD1 3.25Å; W416-I557 HydrophobicContact CE3-CD1 3.88Å; W416-I557 HydrophobicContact CG-CD1 3.61Å; W416-I557 HydrophobicContact CG-CG2 4.08Å; W416-I557 HydrophobicContact CH2-CD1 3.78Å; W416-I557 HydrophobicContact CZ2-CD1 3.17Å; W416-I557 HydrophobicContact CZ3-CD1 4.12Å; I557-Q559 PolarHBondContact O-N 2.77Å; I557-I572 HydrophobicContact CD1-CD1 3.37Å; I557-I572 HydrophobicContact CD1-CG1 3.77Å; I557-I572 HydrophobicContact CG1-CD1 3.79Å; I557-I572 HydrophobicContact CG1-CG1 4.3Å
558	I	78.9	Confident	72.6	Confident	59 Å²	59	65.3 Å²	65.3	30%	0.303	40%	0.401	S	S	.	.			trans	-82.5	113.5	178.2	-57.8	165.3	0	0	0	107.3	R453 I592	R453-I558 HydrophobicContact CG-CD1 4.16Å; R453-I558 HydrophobicContact CG-CG1 3.85Å; I558-I592 HydrophobicContact CD1-CD1 4.43Å; I558-I592 HydrophobicContact CD1-CG1 4.26Å; I558-I592 HydrophobicContact CD1-CG2 3.84Å
559	Q	69.5	Low	71.6	Confident	111 Å²	111	65.2 Å²	65.2	52%	0.519	40%	0.404	S	S	.	.			trans	-104.1	126.3	176.3	-152.8	167.8	14.2	0	0	109.1	I557 G561	I557-Q559 PolarHBondContact O-N 2.77Å; Q559-G561 PolarHBondContact O-N 2.8Å
560	D	56.4	Low	70.9	Confident	157 Å²	157	68.9 Å²	68.9	84%	0.84	42%	0.417	S	S	*	.	S	Bend	trans	-70.7	109.7	175.6	-72.2	-31.4	0	0	0	109.3
561	G	54	Low	70.5	Confident	71 Å²	71	64 Å²	64	73%	0.732	40%	0.4	S	S	*	.	S	Bend	trans	83.3	73.3	169.3	0	0	0	0	0	115.6	Q559	Q559-G561 PolarHBondContact O-N 2.8Å
562	S	43.6	Very low	70.3	Confident	95 Å²	95	63.7 Å²	63.7	66%	0.664	40%	0.399	S	S	*	.				173.2	140.8	128.5	54.3	0	0	0	0	109.7	G564	S562-G564 PolarHBondContact O-N 3.38Å
563	S	46.3	Very low	70.1	Confident	133 Å²	133	64.2 Å²	64.2	93%	0.93	40%	0.402	S	S	*	.			trans	-67.8	60.9	164.2	52.7	0	0	0	0	110.4
564	G	44.6	Very low	70	Confident	52 Å²	52	64.2 Å²	64.2	54%	0.536	40%	0.402	S	S	.	.			trans	-84.7	139.9	170	0	0	0	0	0	109.7	S562	S562-G564 PolarHBondContact O-N 3.38Å
565	A	48.8	Very low	70	Confident	86 Å²	86	67 Å²	67	71%	0.711	42%	0.415	S	S	*	.			trans	-47	141.4	179.6	0	0	0	0	0	112	D567	A565-D567 VanDerWaalsContact C-N 3.28Å; A565-D567 PolarHBondContact O-N 3.45Å
566	E	56.1	Low	70	Confident	148 Å²	148	67.2 Å²	67.2	69%	0.692	42%	0.417	S	S	*	.			trans	-64.6	84.6	177.8	-70.1	-169.6	161.8	0	0	110.9	R455 A568	R455-E566 IonicContact CZ-OE2 3.26Å; R455-E566 VanDerWaalsContact NH1-CD 3.29Å; R455-E566 IonicContact NH1-OE1 2.74Å; R455-E566 IonicContact NH1-OE2 3.92Å; R455-E566 PolarHBondContact NH1-OE2 2.97Å; R455-E566 IonicContact NH2-OE2 2.81Å; E566-A568 PolarHBondContact O-N 3.04Å; E566-A568 VanDerWaalsContact O-N 3.08Å
567	D	62.8	Low	69.9	Low	84 Å²	84	68.3 Å²	68.3	45%	0.449	42%	0.423	S	S	.	.			trans	-71.8	102.1	175.4	-74.4	-25.9	0	0	0	109.6	A565 A569 R570	A565-D567 VanDerWaalsContact C-N 3.28Å; A565-D567 PolarHBondContact O-N 3.45Å; D567-A569 PolarHBondContact O-N 3.05Å; D567-R570 HydrophobicContact CB-CG 4.26Å; D567-R570 PolarHBondContact O-N 2.67Å; D567-R570 IonicContact OD2-NE 3.86Å; D567-R570 IonicContact OD2-NH2 2.61Å
568	A	66.7	Low	70	Confident	76 Å²	76	68.6 Å²	68.6	63%	0.628	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-54.9	-16.9	173.9	0	0	0	0	0	113.5	E566 R570 D571	E566-A568 PolarHBondContact O-N 3.04Å; E566-A568 VanDerWaalsContact O-N 3.08Å; A568-R570 PolarHBondContact O-N 3.08Å; A568-D571 PolarHBondContact O-N 3.13Å
569	A	64.5	Low	70.2	Confident	44 Å²	44	68.9 Å²	68.9	36%	0.364	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-72.2	-9.5	174.2	0	0	0	0	0	114.3	D567	D567-A569 PolarHBondContact O-N 3.05Å
570	R	72.8	Confident	71	Confident	119 Å²	119	63.6 Å²	63.6	45%	0.449	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-105.8	-1.8	177.2	-60.9	-175.8	-173.9	-177.8	4.4	113.3	D567 A568	D567-R570 HydrophobicContact CB-CG 4.26Å; D567-R570 PolarHBondContact O-N 2.67Å; D567-R570 IonicContact OD2-NE 3.86Å; D567-R570 IonicContact OD2-NH2 2.61Å; A568-R570 PolarHBondContact O-N 3.08Å
571	D	81.6	Confident	72.5	Confident	22 Å²	22	61.6 Å²	61.6	12%	0.118	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-69.8	141.8	179.1	-71.4	-23.1	0	0	0	110.6	R455 T554 G556 A568	R455-D571 WeakPolarHBondContact CD-OD2 3.44Å; R455-D571 IonicContact CZ-OD1 2.8Å; R455-D571 IonicContact CZ-OD2 2.88Å; R455-D571 IonicContact NE-OD1 3.66Å; R455-D571 PolarHBondContact NE-OD1 2.86Å; R455-D571 IonicContact NE-OD2 3.91Å; R455-D571 PolarHBondContact NE-OD2 3.29Å; R455-D571 VanDerWaalsContact NE-OD2 3.15Å; R455-D571 IonicContact NH2-OD1 3.87Å; T554-D571 HydrophobicContact CG2-CB 3.79Å; G556-D571 WeakPolarHBondContact CA-OD1 3.18Å; A568-D571 PolarHBondContact O-N 3.13Å
572	I	86.9	Confident	73.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	132.8	175.2	-61	166.3	0	0	0	108.7	W416 W450 T554 V555 I557 L574 F595 F610	W416-I572 HydrophobicContact CD2-CD1 4.27Å; W416-I572 HydrophobicContact CE3-CD1 3.67Å; W416-I572 HydrophobicContact CE3-CG1 4.36Å; W416-I572 HydrophobicContact CH2-CD1 3.81Å; W416-I572 HydrophobicContact CH2-CG1 3.56Å; W416-I572 HydrophobicContact CZ2-CD1 4.42Å; W416-I572 HydrophobicContact CZ2-CG1 4.29Å; W416-I572 HydrophobicContact CZ3-CD1 3.42Å; W416-I572 VanDerWaalsContact CZ3-CD1 3.42Å; W416-I572 HydrophobicContact CZ3-CG1 3.63Å; W450-I572 HydrophobicContact CE3-CD1 3.87Å; W450-I572 HydrophobicContact CZ3-CD1 4.09Å; T554-I572 WeakPolarHBondContact CA-O 3.42Å; V555-I572 PolarHBondContact N-O 3.05Å; V555-I572 PolarHBondContact O-N 3.18Å; I557-I572 HydrophobicContact CD1-CD1 3.37Å; I557-I572 HydrophobicContact CD1-CG1 3.77Å; I557-I572 HydrophobicContact CG1-CD1 3.79Å; I557-I572 HydrophobicContact CG1-CG1 4.3Å; I572-L574 HydrophobicContact CG2-CD2 3.66Å; I572-L574 HydrophobicContact CG2-CG 4.01Å; I572-F595 HydrophobicContact CD1-CZ 3.84Å; I572-F610 HydrophobicContact CG2-CD2 3.57Å; I572-F610 HydrophobicContact CG2-CE2 3.84Å
573	I	90.4	Very high	75.9	Confident	29 Å²	29	61.8 Å²	61.8	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.9	172.3	-59.5	179.9	0	0	0	108.5	E552 M575 A607 A609 F610	E552-I573 HydrophobicContact CG-CG2 3.34Å; E552-I573 WeakPolarHBondContact OE1-CG2 3.45Å; I573-M575 HydrophobicContact CG2-CE 4.12Å; I573-A607 HydrophobicContact CD1-CB 3.62Å; I573-A607 HydrophobicContact CG1-CB 4.3Å; I573-A609 HydrophobicContact CB-CB 4.47Å; I573-A609 HydrophobicContact CG2-CB 4.17Å; I573-A609 CarbonylContact O-C 3.4Å; I573-A609 WeakPolarHBondContact O-CA 3.32Å; I573-F610 PolarHBondContact O-N 2.92Å
574	L	91.8	Very high	77.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.1	178.1	-57.6	173	0	0	0	109.7	V553 V555 I572 F595 F610 L612	V553-L574 HydrophobicContact CB-CB 4.21Å; V553-L574 PolarHBondContact N-O 2.81Å; V553-L574 PolarHBondContact O-N 2.68Å; V555-L574 HydrophobicContact CB-CD1 4.49Å; V555-L574 HydrophobicContact CG2-CD1 3.69Å; I572-L574 HydrophobicContact CG2-CD2 3.66Å; I572-L574 HydrophobicContact CG2-CG 4.01Å; L574-F595 HydrophobicContact CD1-CB 4.3Å; L574-F595 HydrophobicContact CD1-CD1 4.2Å; L574-F595 HydrophobicContact CD1-CD2 3.48Å; L574-F595 VanDerWaalsContact CD1-CD2 3.48Å; L574-F595 HydrophobicContact CD1-CE1 4.43Å; L574-F595 HydrophobicContact CD1-CE2 3.74Å; L574-F595 HydrophobicContact CD1-CG 3.73Å; L574-F595 HydrophobicContact CD1-CZ 4.21Å; L574-F595 HydrophobicContact CD2-CD2 4.05Å; L574-F595 HydrophobicContact CD2-CE2 3.89Å; L574-F595 HydrophobicContact CG-CD2 4.43Å; L574-F595 HydrophobicContact CG-CE2 4.4Å; L574-F610 CarbonylContact C-O 3.46Å; L574-F610 VanDerWaalsContact CA-O 3.3Å; L574-F610 WeakPolarHBondContact CA-O 3.45Å; L574-F610 HydrophobicContact CD2-CB 4.05Å; L574-F610 HydrophobicContact CD2-CD2 4.31Å; L574-L612 HydrophobicContact CD1-CD1 3.97Å
575	M	90.9	Very high	80	Confident	70 Å²	70	57.8 Å²	57.8	35%	0.345	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.1	173.8	-64.7	-64.6	177.2	0	0	109.1	A460 F551 E552 I573 A609 F610 L612	A460-M575 HydrophobicContact CB-SD 4.17Å; F551-M575 CarbonylContact O-C 3.56Å; F551-M575 WeakPolarHBondContact O-CA 3.42Å; E552-M575 HydrophobicContact CB-CE 4.37Å; E552-M575 HydrophobicContact CB-SD 4.08Å; E552-M575 HydrophobicContact CG-CE 3.95Å; E552-M575 HydrophobicContact CG-SD 4.16Å; I573-M575 HydrophobicContact CG2-CE 4.12Å; M575-A609 HydrophobicContact CE-CB 3.94Å; M575-A609 HydrophobicContact CG-CB 4.14Å; M575-F610 PolarHBondContact N-O 3.42Å; M575-L612 PolarHBondContact O-N 2.04Å
576	A	89.8	Confident	81.7	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.033	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.7	-178.3	0	0	0	0	0	111.6	R550 F551 V553 F580 L584 L612	R550-A576 CarbonylContact C-O 3.5Å; R550-A576 WeakPolarHBondContact CA-O 3.43Å; F551-A576 HydrophobicContact CB-CB 4.24Å; F551-A576 PolarHBondContact N-O 3.35Å; F551-A576 PolarHBondContact O-N 2.83Å; V553-A576 HydrophobicContact CG2-CB 4.41Å; A576-F580 HydrophobicContact CB-CB 4.27Å; A576-F580 HydrophobicContact CB-CD2 3.95Å; A576-F580 HydrophobicContact CB-CG 4.35Å; A576-L584 HydrophobicContact CB-CD1 3.69Å; A576-L612 HydrophobicContact CB-CB 3.91Å; A576-L612 HydrophobicContact CB-CD2 3.57Å; A576-L612 HydrophobicContact CB-CG 4.38Å
577	S	86.9	Confident	83.2	Confident	29 Å²	29	52 Å²	52	20%	0.203	27%	0.272	C	S	.	.			trans	-75.5	166.9	175.2	52.2	0	0	0	0	112.1	E579 F580	S577-E579 WeakPolarHBondContact CB-OE1 3.24Å; S577-E579 PolarHBondContact O-N 2.92Å; S577-E579 VanDerWaalsContact OG-CD 3.27Å; S577-E579 WeakPolarHBondContact OG-CG 3.47Å; S577-E579 PolarHBondContact OG-OE1 3.45Å; S577-F580 PolarHBondContact O-N 3.4Å
578	N	85.9	Confident	84.5	Confident	52 Å²	52	55.2 Å²	55.2	28%	0.278	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-57.1	-23.4	-179.8	-167.7	39.7	0	0	0	113.6	S548 Y549 F580 R581	S548-N578 WeakPolarHBondContact OG-CB 3.49Å; Y549-N578 PolarHBondContact N-OD1 3.42Å; Y549-N578 WeakPolarHBondContact O-CA 3.38Å; Y549-N578 WeakPolarHBondContact O-CB 3.14Å; Y549-N578 PolarHBondContact O-N 3.2Å; N578-F580 PolarHBondContact O-N 3.45Å; N578-R581 WeakPolarHBondContact O-CB 3.46Å; N578-R581 PolarHBondContact O-N 3.32Å
579	E	84.3	Confident	85.6	Confident	65 Å²	65	56.4 Å²	56.4	30%	0.304	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-50.1	-40.9	174.3	-51.2	168.9	-116.6	0	0	111.4	S577 R581 Q630 K632 I633	S577-E579 WeakPolarHBondContact CB-OE1 3.24Å; S577-E579 PolarHBondContact O-N 2.92Å; S577-E579 VanDerWaalsContact OG-CD 3.27Å; S577-E579 WeakPolarHBondContact OG-CG 3.47Å; S577-E579 PolarHBondContact OG-OE1 3.45Å; E579-R581 VanDerWaalsContact C-N 3.27Å; E579-R581 PolarHBondContact O-N 2.86Å; E579-Q630 PolarHBondContact O-NE2 3.33Å; E579-K632 WeakPolarHBondContact OE1-CE 3.48Å; E579-K632 VanDerWaalsContact OE1-CG 3.27Å; E579-K632 WeakPolarHBondContact OE1-CG 3.43Å; E579-K632 WeakPolarHBondContact OE2-CA 3.35Å; E579-I633 PolarHBondContact OE2-N 3.26Å
580	F	85.5	Confident	86.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-82	-0.3	-175.6	-62.4	-77.7	0	0	0	113.9	A576 S577 N578 Q582 V583 L584 L612 I615 Q630 K632	A576-F580 HydrophobicContact CB-CB 4.27Å; A576-F580 HydrophobicContact CB-CD2 3.95Å; A576-F580 HydrophobicContact CB-CG 4.35Å; S577-F580 PolarHBondContact O-N 3.4Å; N578-F580 PolarHBondContact O-N 3.45Å; F580-Q582 VanDerWaalsContact C-N 3.32Å; F580-Q582 PolarHBondContact O-N 3.23Å; F580-V583 PolarHBondContact O-N 3.17Å; F580-V583 VanDerWaalsContact O-N 3.15Å; F580-L584 HydrophobicContact CB-CD1 3.65Å; F580-L584 HydrophobicContact CB-CG 3.91Å; F580-L584 WeakPolarHBondContact O-CB 3.18Å; F580-L584 WeakPolarHBondContact O-CG 3.46Å; F580-L584 PolarHBondContact O-N 2.85Å; F580-L612 HydrophobicContact CD1-CD2 4.13Å; F580-L612 HydrophobicContact CD2-CD2 4.2Å; F580-L612 HydrophobicContact CE1-CD2 4.27Å; F580-L612 HydrophobicContact CE2-CD2 4.33Å; F580-L612 HydrophobicContact CE2-CG 4.43Å; F580-L612 HydrophobicContact CG-CD2 4.08Å; F580-L612 HydrophobicContact CZ-CD2 4.36Å; F580-L612 HydrophobicContact CZ-CG 4.33Å; F580-I615 HydrophobicContact CD1-CG2 3.86Å; F580-I615 HydrophobicContact CE1-CG2 4.17Å; F580-Q630 HydrophobicContact CD1-CB 4.22Å; F580-Q630 HydrophobicContact CD1-CG 3.99Å; F580-Q630 HydrophobicContact CE1-CB 4.25Å; F580-Q630 HydrophobicContact CE1-CG 4.09Å; F580-K632 HydrophobicContact CE2-CB 4.16Å; F580-K632 HydrophobicContact CE2-CG 4.37Å; F580-K632 HydrophobicContact CZ-CB 3.92Å
581	R	87.4	Confident	87.4	Confident	115 Å²	115	52 Å²	52	43%	0.434	27%	0.273	S	S	.	.	H	α-helix	trans	-50.3	-48.7	-174.6	176.4	174.3	176	-146	-2.8	112.9	F551 N578 E579 V583 L585	F551-R581 HydrophobicContact CE2-CB 3.74Å; F551-R581 HydrophobicContact CE2-CG 4.24Å; F551-R581 HydrophobicContact CZ-CB 3.84Å; F551-R581 HydrophobicContact CZ-CG 3.81Å; N578-R581 WeakPolarHBondContact O-CB 3.46Å; N578-R581 PolarHBondContact O-N 3.32Å; E579-R581 VanDerWaalsContact C-N 3.27Å; E579-R581 PolarHBondContact O-N 2.86Å; R581-V583 PolarHBondContact O-N 2.82Å; R581-L585 HydrophobicContact CG-CD1 3.67Å; R581-L585 HydrophobicContact CG-CG 4.35Å; R581-L585 WeakPolarHBondContact O-CB 3.49Å; R581-L585 VanDerWaalsContact O-CG 3.23Å; R581-L585 WeakPolarHBondContact O-CG 3.34Å; R581-L585 PolarHBondContact O-N 2.78Å; R581-L585 VanDerWaalsContact O-N 3.1Å
582	Q	84.6	Confident	87.8	Confident	152 Å²	152	53.6 Å²	53.6	71%	0.71	28%	0.28	S	S	*	.	H	α-helix	trans	-65.1	-39.3	-175.8	-70.8	-176.1	-26	0	0	112.4	F580 N586	F580-Q582 VanDerWaalsContact C-N 3.32Å; F580-Q582 PolarHBondContact O-N 3.23Å; Q582-N586 VanDerWaalsContact O-CG 3.28Å; Q582-N586 PolarHBondContact O-ND2 3.4Å
583	V	85.5	Confident	88	Confident	18 Å²	18	53.6 Å²	53.6	11%	0.109	28%	0.28	C	S	.	.	H	α-helix	trans	-75.6	-45.9	179.7	174.2	0	0	0	0	110.6	F580 R581 L585 N586 L587 I615 L625 Q630	F580-V583 PolarHBondContact O-N 3.17Å; F580-V583 VanDerWaalsContact O-N 3.15Å; R581-V583 PolarHBondContact O-N 2.82Å; V583-L585 PolarHBondContact O-N 3.42Å; V583-N586 PolarHBondContact O-N 2.78Å; V583-N586 VanDerWaalsContact O-N 3.13Å; V583-L587 WeakPolarHBondContact O-CG 3.32Å; V583-L587 PolarHBondContact O-N 2.69Å; V583-I615 HydrophobicContact CG1-CG2 4.09Å; V583-L625 HydrophobicContact CB-CD2 4.42Å; V583-L625 HydrophobicContact CG1-CD2 4.27Å; V583-L625 HydrophobicContact CG2-CD2 3.66Å; V583-Q630 VanDerWaalsContact CB-OE1 3.3Å; V583-Q630 HydrophobicContact CG2-CB 4.14Å
584	L	88.5	Confident	88	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-36.5	-176.1	-67.1	176.2	0	0	0	113.4	V457 F551 V553 A576 F580 N586 L587 I615	V457-L584 HydrophobicContact CG2-CB 4.33Å; V457-L584 HydrophobicContact CG2-CD1 4.44Å; F551-L584 HydrophobicContact CB-CD1 3.71Å; F551-L584 HydrophobicContact CD2-CD1 3.93Å; F551-L584 HydrophobicContact CG-CD1 3.83Å; V553-L584 HydrophobicContact CG1-CD2 4.42Å; V553-L584 HydrophobicContact CG2-CD1 3.71Å; V553-L584 HydrophobicContact CG2-CD2 3.64Å; V553-L584 HydrophobicContact CG2-CG 4.28Å; A576-L584 HydrophobicContact CB-CD1 3.69Å; F580-L584 HydrophobicContact CB-CD1 3.65Å; F580-L584 HydrophobicContact CB-CG 3.91Å; F580-L584 WeakPolarHBondContact O-CB 3.18Å; F580-L584 WeakPolarHBondContact O-CG 3.46Å; F580-L584 PolarHBondContact O-N 2.85Å; L584-N586 PolarHBondContact O-N 2.89Å; L584-L587 HydrophobicContact CD2-CD1 4.05Å; L584-L587 PolarHBondContact O-N 2.62Å; L584-I615 HydrophobicContact CD2-CD1 4.06Å
585	L	87.3	Confident	88	Confident	100 Å²	100	55.5 Å²	55.5	52%	0.524	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.8	177	-68.3	176.8	0	0	0	113.2	R581 V583	R581-L585 HydrophobicContact CG-CD1 3.67Å; R581-L585 HydrophobicContact CG-CG 4.35Å; R581-L585 WeakPolarHBondContact O-CB 3.49Å; R581-L585 VanDerWaalsContact O-CG 3.23Å; R581-L585 WeakPolarHBondContact O-CG 3.34Å; R581-L585 PolarHBondContact O-N 2.78Å; R581-L585 VanDerWaalsContact O-N 3.1Å; V583-L585 PolarHBondContact O-N 3.42Å
586	N	86.3	Confident	87.9	Confident	99 Å²	99	52.6 Å²	52.6	53%	0.529	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-12.7	179.7	-70.6	-16.9	0	0	0	113.3	Q582 V583 L584	Q582-N586 VanDerWaalsContact O-CG 3.28Å; Q582-N586 PolarHBondContact O-ND2 3.4Å; V583-N586 PolarHBondContact O-N 2.78Å; V583-N586 VanDerWaalsContact O-N 3.13Å; L584-N586 PolarHBondContact O-N 2.89Å
587	L	87.3	Confident	87.9	Confident	14 Å²	14	52.4 Å²	52.4	7%	0.073	27%	0.274	C	S	.	.			trans	-74.1	138.4	177.1	-71.7	173.2	0	0	0	111.1	F454 V583 L584 V593 I615 C617	F454-L587 HydrophobicContact CD1-CB 4.02Å; F454-L587 HydrophobicContact CD2-CB 4.26Å; F454-L587 HydrophobicContact CD2-CD1 3.86Å; F454-L587 HydrophobicContact CE1-CB 3.82Å; F454-L587 HydrophobicContact CE2-CB 4.06Å; F454-L587 HydrophobicContact CE2-CD1 3.9Å; F454-L587 HydrophobicContact CG-CB 4.21Å; F454-L587 HydrophobicContact CG-CD1 4.4Å; F454-L587 HydrophobicContact CZ-CB 3.84Å; V583-L587 WeakPolarHBondContact O-CG 3.32Å; V583-L587 PolarHBondContact O-N 2.69Å; L584-L587 HydrophobicContact CD2-CD1 4.05Å; L584-L587 PolarHBondContact O-N 2.62Å; L587-V593 HydrophobicContact CD1-CG1 4.17Å; L587-V593 HydrophobicContact CD2-CG1 3.99Å; L587-I615 HydrophobicContact CD1-CD1 3.86Å; L587-C617 HydrophobicContact CD2-CB 3.99Å
588	K	89	Confident	87.9	Confident	150 Å²	150	52 Å²	52	65%	0.652	27%	0.269	S	S	*	.			trans	-105.3	147.2	176.5	-63.7	-177	-179.1	179.6	0	110.9	F454 G590 N591	F454-K588 WeakPolarHBondContact CD1-O 3.41Å; K588-G590 PolarHBondContact O-N 2.93Å; K588-N591 WeakPolarHBondContact CB-OD1 3.43Å; K588-N591 PolarHBondContact N-OD1 3.15Å; K588-N591 WeakPolarHBondContact O-CB 3.46Å; K588-N591 PolarHBondContact O-N 2.72Å; K588-N591 VanDerWaalsContact O-N 3.11Å; K588-N591 PolarHBondContact O-OD1 3.08Å
589	P	89.6	Confident	87.9	Confident	101 Å²	101	49.6 Å²	49.6	66%	0.656	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	130.1	170.8	-26.1	34.6	0	0	0	111.2	F454 R455	F454-P589 WeakPolarHBondContact O-CA 3.38Å; R455-P589 VanDerWaalsContact O-CB 3.29Å; R455-P589 WeakPolarHBondContact O-CB 3.36Å; R455-P589 WeakPolarHBondContact O-CG 3.44Å
590	G	86.4	Confident	87.7	Confident	45 Å²	45	49 Å²	49	46%	0.464	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-14.2	-177.6	0	0	0	0	0	115	F454 K588	F454-G590 PolarHBondContact O-N 3.08Å; K588-G590 PolarHBondContact O-N 2.93Å
591	N	89.3	Confident	87.3	Confident	27 Å²	27	51.3 Å²	51.3	14%	0.144	28%	0.278	C	S	.	.			trans	-63.5	142	177.8	-75.2	140	0	0	0	112.6	R453 F454 K588 D619	R453-N591 CarbonylContact C-O 3.47Å; R453-N591 WeakPolarHBondContact CA-O 3.3Å; F454-N591 PolarHBondContact N-O 2.96Å; K588-N591 WeakPolarHBondContact CB-OD1 3.43Å; K588-N591 PolarHBondContact N-OD1 3.15Å; K588-N591 WeakPolarHBondContact O-CB 3.46Å; K588-N591 PolarHBondContact O-N 2.72Å; K588-N591 VanDerWaalsContact O-N 3.11Å; K588-N591 PolarHBondContact O-OD1 3.08Å; N591-D619 VanDerWaalsContact CA-OD2 3.31Å; N591-D619 WeakPolarHBondContact CA-OD2 3.31Å; N591-D619 WeakPolarHBondContact CB-OD1 3.46Å; N591-D619 PolarHBondContact ND2-OD1 3.11Å; N591-D619 PolarHBondContact ND2-OD2 2.81Å
592	I	90.1	Very high	87	Confident	54 Å²	54	55.9 Å²	55.9	28%	0.277	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.8	176.8	-57.1	176.9	0	0	0	108.8	R453 I558 L618 D619	R453-I592 HydrophobicContact CG-CG1 4.48Å; I558-I592 HydrophobicContact CD1-CD1 4.43Å; I558-I592 HydrophobicContact CD1-CG1 4.26Å; I558-I592 HydrophobicContact CD1-CG2 3.84Å; I592-L618 HydrophobicContact CG2-CB 4.36Å; I592-L618 HydrophobicContact CG2-CD1 4.05Å; I592-L618 PolarHBondContact O-N 3.31Å; I592-D619 HydrophobicContact CB-CB 4.47Å; I592-D619 PolarHBondContact N-OD1 2.84Å; I592-D619 PolarHBondContact N-OD2 3.35Å
593	V	91	Very high	87	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.2	-179.3	-63.1	0	0	0	0	110.9	T451 G452 F454 V555 L587 F595 I615 H616 C617	T451-V593 WeakPolarHBondContact CA-O 3.21Å; G452-V593 PolarHBondContact N-O 2.66Å; G452-V593 PolarHBondContact O-N 2.81Å; F454-V593 HydrophobicContact CB-CG1 4.36Å; F454-V593 HydrophobicContact CB-CG2 4.39Å; V555-V593 HydrophobicContact CG1-CG2 4.28Å; V555-V593 HydrophobicContact CG2-CG2 4.49Å; L587-V593 HydrophobicContact CD1-CG1 4.17Å; L587-V593 HydrophobicContact CD2-CG1 3.99Å; V593-F595 HydrophobicContact CG2-CD1 4.45Å; V593-I615 HydrophobicContact CB-CD1 4.28Å; V593-I615 HydrophobicContact CB-CG1 4.16Å; V593-I615 HydrophobicContact CG1-CD1 4.33Å; V593-I615 HydrophobicContact CG1-CG1 4.44Å; V593-I615 HydrophobicContact CG2-CD1 4.44Å; V593-H616 CarbonylContact C-O 3.56Å; V593-H616 VanDerWaalsContact CA-O 3.32Å; V593-H616 WeakPolarHBondContact CA-O 3.03Å; V593-C617 HydrophobicContact CG1-CB 4.45Å
594	E	91.3	Very high	86.7	Confident	68 Å²	68	48.1 Å²	48.1	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.1	162	179.9	-173.8	-119.6	0	0	107.8	T451 I615 H616 L618	T451-E594 HydrophobicContact CG2-CB 4.23Å; T451-E594 HydrophobicContact CG2-CG 4.36Å; E594-I615 CarbonylContact O-C 3.57Å; E594-I615 WeakPolarHBondContact O-CA 3.37Å; E594-H616 HydrophobicContact CB-CB 4.33Å; E594-H616 PolarHBondContact N-O 3.26Å; E594-H616 PolarHBondContact O-N 2.8Å; E594-H616 IonicContact OE2-CD2 3.9Å; E594-L618 HydrophobicContact CB-CD1 4.35Å; E594-L618 HydrophobicContact CB-CD2 4.47Å; E594-L618 HydrophobicContact CB-CG 4.39Å
595	F	90.8	Very high	86.3	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.7	179.1	63.9	-86.6	0	0	0	111.3	T449 W450 V555 I572 L574 V593 T597 L612 A614 I615	T449-F595 WeakPolarHBondContact CA-O 3.31Å; W450-F595 HydrophobicContact CB-CE1 4.15Å; W450-F595 HydrophobicContact CB-CE2 4.15Å; W450-F595 HydrophobicContact CB-CZ 3.77Å; W450-F595 AromaticContact CE3-CE2 3.95Å; W450-F595 HydrophobicContact CE3-CE2 3.95Å; W450-F595 HydrophobicContact CE3-CZ 4.07Å; W450-F595 PolarHBondContact N-O 2.95Å; W450-F595 WeakPolarHBondContact O-CD1 3.41Å; W450-F595 PolarHBondContact O-N 2.88Å; V555-F595 HydrophobicContact CB-CE1 4.36Å; V555-F595 HydrophobicContact CG1-CD1 4.34Å; V555-F595 HydrophobicContact CG1-CE1 3.79Å; I572-F595 HydrophobicContact CD1-CZ 3.84Å; L574-F595 HydrophobicContact CD1-CB 4.3Å; L574-F595 HydrophobicContact CD1-CD1 4.2Å; L574-F595 HydrophobicContact CD1-CD2 3.48Å; L574-F595 VanDerWaalsContact CD1-CD2 3.48Å; L574-F595 HydrophobicContact CD1-CE1 4.43Å; L574-F595 HydrophobicContact CD1-CE2 3.74Å; L574-F595 HydrophobicContact CD1-CG 3.73Å; L574-F595 HydrophobicContact CD1-CZ 4.21Å; L574-F595 HydrophobicContact CD2-CD2 4.05Å; L574-F595 HydrophobicContact CD2-CE2 3.89Å; L574-F595 HydrophobicContact CG-CD2 4.43Å; L574-F595 HydrophobicContact CG-CE2 4.4Å; V593-F595 HydrophobicContact CG2-CD1 4.45Å; F595-T597 HydrophobicContact CD2-CG2 4.37Å; F595-T597 HydrophobicContact CE2-CG2 4.19Å; F595-L612 HydrophobicContact CB-CD1 3.86Å; F595-A614 CarbonylContact C-O 3.52Å; F595-A614 VanDerWaalsContact CA-O 3.24Å; F595-A614 WeakPolarHBondContact CA-O 3.2Å; F595-I615 HydrophobicContact CB-CG1 4.47Å
596	S	89.7	Confident	85.8	Confident	10 Å²	10	50.7 Å²	50.7	7%	0.07	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.6	170.3	-169.6	0	0	0	0	109.6	V448 K613 A614	V448-S596 VanDerWaalsContact O-CA 3.31Å; V448-S596 WeakPolarHBondContact O-CA 3.43Å; V448-S596 PolarHBondContact O-OG 3.47Å; S596-K613 WeakPolarHBondContact O-CA 3.47Å; S596-K613 WeakPolarHBondContact O-CB 3.37Å; S596-K613 PolarHBondContact O-N 3.1Å; S596-A614 PolarHBondContact N-O 2.91Å; S596-A614 PolarHBondContact O-N 3.13Å; S596-A614 VanDerWaalsContact O-N 3.12Å
597	T	89.2	Confident	85.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	155.2	179.2	-172.7	0	0	0	0	111.2	R447 V448 W450 F595 F610 E611	R447-T597 WeakPolarHBondContact CA-O 3.09Å; V448-T597 HydrophobicContact CG2-CG2 3.64Å; V448-T597 PolarHBondContact N-O 3Å; V448-T597 PolarHBondContact O-N 2.78Å; W450-T597 HydrophobicContact CE3-CG2 4.45Å; W450-T597 HydrophobicContact CZ3-CG2 4.4Å; F595-T597 HydrophobicContact CD2-CG2 4.37Å; F595-T597 HydrophobicContact CE2-CG2 4.19Å; T597-F610 HydrophobicContact CG2-CB 4.32Å; T597-F610 WeakPolarHBondContact OG1-CB 3.37Å; T597-E611 WeakPolarHBondContact CA-O 3.44Å; T597-E611 WeakPolarHBondContact CB-O 3.23Å; T597-E611 PolarHBondContact OG1-O 3.41Å
598	K	87.5	Confident	84.7	Confident	21 Å²	21	48.6 Å²	48.6	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126	169.6	-175.3	-172.7	177.8	-166.6	0	107.6	V409 D600 E611 K613	V409-K598 HydrophobicContact CG2-CD 4.28Å; K598-D600 HydrophobicContact CD-CB 4.49Å; K598-D600 HydrophobicContact CG-CB 4.49Å; K598-D600 IonicContact NZ-OD2 2.81Å; K598-D600 PolarHBondContact NZ-OD2 3.1Å; K598-D600 PolarHBondContact O-N 3.46Å; K598-E611 PolarHBondContact N-O 3.27Å; K598-K613 HydrophobicContact CB-CG 4.38Å
599	L	85.8	Confident	84.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.254	C	S	.	.			trans	-70.2	95.5	172.8	-61	-177	0	0	0	108.5	L414 Y419 L443 Q444 G445 H446 V448 W450 L603 F610	L414-L599 HydrophobicContact CD2-CD1 4.44Å; Y419-L599 HydrophobicContact CD2-CD1 4.36Å; Y419-L599 HydrophobicContact CE2-CD1 4.28Å; L443-L599 HydrophobicContact CB-CD1 4.17Å; Q444-L599 CarbonylContact C-O 3.56Å; Q444-L599 WeakPolarHBondContact CA-O 3.43Å; G445-L599 PolarHBondContact N-O 3.15Å; H446-L599 HydrophobicContact CB-CD1 4.25Å; H446-L599 PolarHBondContact O-N 2.68Å; V448-L599 HydrophobicContact CG1-CD1 4.11Å; V448-L599 HydrophobicContact CG1-CG 4.37Å; V448-L599 HydrophobicContact CG2-CD2 3.98Å; V448-L599 HydrophobicContact CG2-CG 4.12Å; W450-L599 HydrophobicContact CH2-CD2 3.8Å; W450-L599 HydrophobicContact CZ2-CD2 4.48Å; W450-L599 HydrophobicContact CZ3-CD2 4.41Å; L599-L603 HydrophobicContact CB-CD1 4.32Å; L599-L603 HydrophobicContact CB-CD2 4.01Å; L599-F610 HydrophobicContact CD2-CD1 4.12Å; L599-F610 HydrophobicContact CD2-CE1 3.78Å; L599-F610 HydrophobicContact CD2-CZ 4.04Å
600	D	80.1	Confident	84.4	Confident	54 Å²	54	39 Å²	39	29%	0.289	22%	0.223	S	C	.	.			trans	-137.5	150.8	178.4	-145	-19.9	0	0	0	109.5	Q444 K598	Q444-D600 PolarHBondContact NE2-OD1 2.97Å; K598-D600 HydrophobicContact CD-CB 4.49Å; K598-D600 HydrophobicContact CG-CB 4.49Å; K598-D600 IonicContact NZ-OD2 2.81Å; K598-D600 PolarHBondContact NZ-OD2 3.1Å; K598-D600 PolarHBondContact O-N 3.46Å
601	G	77.1	Confident	84.5	Confident	48 Å²	48	39.8 Å²	39.8	50%	0.495	21%	0.214	S	C	.	.	S	Bend	trans	93	-151.5	-177.2	0	0	0	0	0	115.2	L603	G601-L603 VanDerWaalsContact C-N 3.28Å; G601-L603 PolarHBondContact O-N 3.22Å
602	R	80	Confident	84.5	Confident	211 Å²	211	38.6 Å²	38.6	80%	0.796	21%	0.208	S	C	*	.	S	Bend	trans	-80	70.9	-173.7	-61.6	-177.4	-172	176	2.5	111.4	G604 A605	R602-G604 PolarHBondContact O-N 3.2Å; R602-A605 PolarHBondContact O-N 2.75Å
603	L	85.3	Confident	84.3	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	131.6	175.4	-53.9	-176.9	0	0	0	109.8	Q437 C440 L443 Q444 L599 G601 F610	Q437-L603 WeakPolarHBondContact CA-O 3.32Å; Q437-L603 VanDerWaalsContact CG-O 3.29Å; Q437-L603 WeakPolarHBondContact CG-O 3.48Å; C440-L603 HydrophobicContact CB-CB 3.89Å; C440-L603 WeakPolarHBondContact O-CD1 3.41Å; L443-L603 HydrophobicContact CB-CD1 4.3Å; Q444-L603 HydrophobicContact CB-CD1 4.13Å; L599-L603 HydrophobicContact CB-CD1 4.32Å; L599-L603 HydrophobicContact CB-CD2 4.01Å; G601-L603 VanDerWaalsContact C-N 3.28Å; G601-L603 PolarHBondContact O-N 3.22Å; L603-F610 HydrophobicContact CD2-CD1 4.27Å; L603-F610 HydrophobicContact CD2-CE1 3.56Å
604	G	79.4	Confident	84.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	10.7	-170.2	0	0	0	0	0	115.2	C423 W428 R602	C423-G604 VanDerWaalsContact O-CA 3.3Å; C423-G604 WeakPolarHBondContact O-CA 3.48Å; W428-G604 PolarHBondContact NE1-O 2.71Å; R602-G604 PolarHBondContact O-N 3.2Å
605	A	81	Confident	84.1	Confident	18 Å²	18	33.8 Å²	33.8	15%	0.149	19%	0.185	C	C	.	.			trans	-48	144.1	158.8	0	0	0	0	0	114.6	W428 M433 Q437 R602 A607 P608	W428-A605 WeakPolarHBondContact CH2-O 3.26Å; W428-A605 WeakPolarHBondContact CZ2-O 3.27Å; M433-A605 HydrophobicContact CE-CB 3.64Å; Q437-A605 VanDerWaalsContact NE2-CB 3.25Å; R602-A605 PolarHBondContact O-N 2.75Å; A605-A607 PolarHBondContact O-N 2.82Å; A605-P608 WeakPolarHBondContact O-CD 3.49Å
606	K	76.5	Confident	84	Confident	137 Å²	137	36.3 Å²	36.3	60%	0.596	20%	0.197	S	C	*	.	S	Bend	trans	-59.7	-27.6	165.2	-172.3	174.4	179.1	179	0	111.8	W428 M433	W428-K606 VanDerWaalsContact CH2-CA 3.49Å; W428-K606 HydrophobicContact CZ3-CB 4.3Å; W428-K606 HydrophobicContact CZ3-CG 4.22Å; M433-K606 HydrophobicContact CE-CB 3.73Å
607	A	73.1	Confident	83.9	Confident	53 Å²	53	36.6 Å²	36.6	44%	0.438	20%	0.199	S	C	.	.	S	Bend	trans	-145.5	91.8	168.1	0	0	0	0	0	107.8	I573 A605 A609	I573-A607 HydrophobicContact CD1-CB 3.62Å; I573-A607 HydrophobicContact CG1-CB 4.3Å; A605-A607 PolarHBondContact O-N 2.82Å; A607-A609 PolarHBondContact O-N 2.79Å
608	P	76.4	Confident	83.7	Confident	17 Å²	17	41.1 Å²	41.1	11%	0.11	22%	0.222	C	C	.	.			trans	-73.5	128.6	179.5	30.6	-31.1	0	0	0	109.2	A605 F610	A605-P608 WeakPolarHBondContact O-CD 3.49Å; P608-F610 HydrophobicContact CB-CD1 4.45Å; P608-F610 HydrophobicContact CB-CE1 3.74Å; P608-F610 HydrophobicContact CB-CE2 3.99Å; P608-F610 HydrophobicContact CB-CZ 3.48Å; P608-F610 VanDerWaalsContact CB-CZ 3.48Å; P608-F610 HydrophobicContact CG-CE1 4.18Å; P608-F610 HydrophobicContact CG-CE2 3.61Å; P608-F610 HydrophobicContact CG-CZ 3.39Å
609	A	84.6	Confident	83.6	Confident	48 Å²	48	43.6 Å²	43.6	40%	0.397	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	111.6	173.1	0	0	0	0	0	108.8	I573 M575 A607	I573-A609 HydrophobicContact CB-CB 4.47Å; I573-A609 HydrophobicContact CG2-CB 4.17Å; I573-A609 CarbonylContact O-C 3.4Å; I573-A609 WeakPolarHBondContact O-CA 3.32Å; M575-A609 HydrophobicContact CE-CB 3.94Å; M575-A609 HydrophobicContact CG-CB 4.14Å; A607-A609 PolarHBondContact O-N 2.79Å
610	F	88.4	Confident	83.4	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	152.7	177.8	-50.2	-66	0	0	0	111.8	Y419 W450 I572 I573 L574 M575 T597 L599 L603 P608	Y419-F610 HydrophobicContact CE1-CZ 4.23Å; W450-F610 HydrophobicContact CZ3-CE2 4.13Å; I572-F610 HydrophobicContact CG2-CD2 3.57Å; I572-F610 HydrophobicContact CG2-CE2 3.84Å; I573-F610 PolarHBondContact O-N 2.92Å; L574-F610 CarbonylContact C-O 3.46Å; L574-F610 VanDerWaalsContact CA-O 3.3Å; L574-F610 WeakPolarHBondContact CA-O 3.45Å; L574-F610 HydrophobicContact CD2-CB 4.05Å; L574-F610 HydrophobicContact CD2-CD2 4.31Å; M575-F610 PolarHBondContact N-O 3.42Å; T597-F610 HydrophobicContact CG2-CB 4.32Å; T597-F610 WeakPolarHBondContact OG1-CB 3.37Å; L599-F610 HydrophobicContact CD2-CD1 4.12Å; L599-F610 HydrophobicContact CD2-CE1 3.78Å; L599-F610 HydrophobicContact CD2-CZ 4.04Å; L603-F610 HydrophobicContact CD2-CD1 4.27Å; L603-F610 HydrophobicContact CD2-CE1 3.56Å; P608-F610 HydrophobicContact CB-CD1 4.45Å; P608-F610 HydrophobicContact CB-CE1 3.74Å; P608-F610 HydrophobicContact CB-CE2 3.99Å; P608-F610 HydrophobicContact CB-CZ 3.48Å; P608-F610 VanDerWaalsContact CB-CZ 3.48Å; P608-F610 HydrophobicContact CG-CE1 4.18Å; P608-F610 HydrophobicContact CG-CE2 3.61Å; P608-F610 HydrophobicContact CG-CZ 3.39Å
611	E	88.1	Confident	82.8	Confident	61 Å²	61	46.5 Å²	46.5	29%	0.285	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.4	178	-161.2	-166.2	156.5	0	0	110.9	T597 K598 K613 K632	T597-E611 WeakPolarHBondContact CA-O 3.44Å; T597-E611 WeakPolarHBondContact CB-O 3.23Å; T597-E611 PolarHBondContact OG1-O 3.41Å; K598-E611 PolarHBondContact N-O 3.27Å; E611-K613 PolarHBondContact O-N 3.25Å; E611-K613 IonicContact OE1-NZ 3.56Å; E611-K613 PolarHBondContact OE1-NZ 3.04Å; E611-K613 WeakPolarHBondContact OE2-CE 3.23Å; E611-K613 IonicContact OE2-NZ 3.53Å; E611-K613 PolarHBondContact OE2-NZ 3.46Å; E611-K632 IonicContact OE1-NZ 3.59Å; E611-K632 PolarHBondContact OE1-NZ 2.8Å
612	L	88.4	Confident	81.9	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	125.1	176.9	-171.7	69	0	0	0	110.4	L574 M575 A576 F580 F595 A614 I615	L574-L612 HydrophobicContact CD1-CD1 3.97Å; M575-L612 PolarHBondContact O-N 2.04Å; A576-L612 HydrophobicContact CB-CB 3.91Å; A576-L612 HydrophobicContact CB-CD2 3.57Å; A576-L612 HydrophobicContact CB-CG 4.38Å; F580-L612 HydrophobicContact CD1-CD2 4.13Å; F580-L612 HydrophobicContact CD2-CD2 4.2Å; F580-L612 HydrophobicContact CE1-CD2 4.27Å; F580-L612 HydrophobicContact CE2-CD2 4.33Å; F580-L612 HydrophobicContact CE2-CG 4.43Å; F580-L612 HydrophobicContact CG-CD2 4.08Å; F580-L612 HydrophobicContact CZ-CD2 4.36Å; F580-L612 HydrophobicContact CZ-CG 4.33Å; F595-L612 HydrophobicContact CB-CD1 3.86Å; L612-A614 WeakPolarHBondContact CD1-O 3.08Å; L612-I615 HydrophobicContact CD1-CB 4.36Å; L612-I615 HydrophobicContact CD2-CB 4.18Å; L612-I615 HydrophobicContact CD2-CG2 4.24Å
613	K	87.7	Confident	80.4	Confident	12 Å²	12	44.1 Å²	44.1	5%	0.052	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-32.7	177.6	-61.4	-58.7	-177.5	-178.2	0	113	S596 K598 E611 K632 E634	S596-K613 WeakPolarHBondContact O-CA 3.47Å; S596-K613 WeakPolarHBondContact O-CB 3.37Å; S596-K613 PolarHBondContact O-N 3.1Å; K598-K613 HydrophobicContact CB-CG 4.38Å; E611-K613 PolarHBondContact O-N 3.25Å; E611-K613 IonicContact OE1-NZ 3.56Å; E611-K613 PolarHBondContact OE1-NZ 3.04Å; E611-K613 WeakPolarHBondContact OE2-CE 3.23Å; E611-K613 IonicContact OE2-NZ 3.53Å; E611-K613 PolarHBondContact OE2-NZ 3.46Å; K613-K632 HydrophobicContact CD-CD 4.07Å; K613-K632 WeakPolarHBondContact O-CB 3.39Å; K613-K632 PolarHBondContact O-N 2.91Å; K613-E634 VanDerWaalsContact CD-OE1 3.3Å; K613-E634 WeakPolarHBondContact CD-OE1 3.03Å; K613-E634 WeakPolarHBondContact CE-OE1 3.48Å; K613-E634 IonicContact NZ-OE1 2.93Å; K613-E634 PolarHBondContact NZ-OE1 3.26Å
614	A	87.8	Confident	78.7	Confident	6 Å²	6	53.3 Å²	53.3	5%	0.05	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	152	171.2	0	0	0	0	0	110.1	F595 S596 L612 Q630 V631	F595-A614 CarbonylContact C-O 3.52Å; F595-A614 VanDerWaalsContact CA-O 3.24Å; F595-A614 WeakPolarHBondContact CA-O 3.2Å; S596-A614 PolarHBondContact N-O 2.91Å; S596-A614 PolarHBondContact O-N 3.13Å; S596-A614 VanDerWaalsContact O-N 3.12Å; L612-A614 WeakPolarHBondContact CD1-O 3.08Å; A614-Q630 CarbonylContact C-O 3.51Å; A614-Q630 WeakPolarHBondContact CA-O 3.47Å; A614-Q630 WeakPolarHBondContact CB-O 2.95Å; A614-V631 HydrophobicContact CB-CB 4.44Å; A614-V631 HydrophobicContact CB-CG1 4.43Å; A614-V631 HydrophobicContact CB-CG2 4.08Å
615	I	88.9	Confident	77.4	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.015	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.3	171.2	-167.7	166.3	0	0	0	109.7	F580 V583 L584 L587 V593 E594 F595 L612 Q630	F580-I615 HydrophobicContact CD1-CG2 3.86Å; F580-I615 HydrophobicContact CE1-CG2 4.17Å; V583-I615 HydrophobicContact CG1-CG2 4.09Å; L584-I615 HydrophobicContact CD2-CD1 4.06Å; L587-I615 HydrophobicContact CD1-CD1 3.86Å; V593-I615 HydrophobicContact CB-CD1 4.28Å; V593-I615 HydrophobicContact CB-CG1 4.16Å; V593-I615 HydrophobicContact CG1-CD1 4.33Å; V593-I615 HydrophobicContact CG1-CG1 4.44Å; V593-I615 HydrophobicContact CG2-CD1 4.44Å; E594-I615 CarbonylContact O-C 3.57Å; E594-I615 WeakPolarHBondContact O-CA 3.37Å; F595-I615 HydrophobicContact CB-CG1 4.47Å; L612-I615 HydrophobicContact CD1-CB 4.36Å; L612-I615 HydrophobicContact CD2-CB 4.18Å; L612-I615 HydrophobicContact CD2-CG2 4.24Å; I615-Q630 PolarHBondContact N-O 3.06Å; I615-Q630 PolarHBondContact O-N 2.83Å
616	H	88.3	Confident	75.7	Confident	54 Å²	54	62.5 Å²	62.5	25%	0.25	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.8	179.3	179.5	40.9	0	0	0	108.2	V593 E594 G628 R629	V593-H616 CarbonylContact C-O 3.56Å; V593-H616 VanDerWaalsContact CA-O 3.32Å; V593-H616 WeakPolarHBondContact CA-O 3.03Å; E594-H616 HydrophobicContact CB-CB 4.33Å; E594-H616 PolarHBondContact N-O 3.26Å; E594-H616 PolarHBondContact O-N 2.8Å; E594-H616 IonicContact OE2-CD2 3.9Å; H616-G628 PolarHBondContact CE1-O 3.41Å; H616-G628 PolarHBondContact ND1-O 3.26Å; H616-R629 HydrophobicContact CB-CB 4.4Å; H616-R629 HydrophobicContact CB-CG 4.38Å
617	C	87.5	Confident	74.5	Confident	16 Å²	16	57.8 Å²	57.8	11%	0.108	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.9	174.4	-170.8	0	0	0	0	109.8	L587 V593 D619 C620	L587-C617 HydrophobicContact CD2-CB 3.99Å; V593-C617 HydrophobicContact CG1-CB 4.45Å; C617-D619 PolarHBondContact SG-OD1 3.3Å; C617-C620 HydrophobicContact CB-CB 3.68Å; C617-C620 WeakPolarHBondContact CB-SG 3.48Å; C617-C620 WeakPolarHBondContact SG-CB 3.06Å; C617-C620 PolarHBondContact SG-N 3.15Å; C617-C620 CovalentContact SG-SG 2.02Å; C617-C620 PolarHBondContact SG-SG 3.31Å
618	L	85.9	Confident	73.7	Confident	95 Å²	95	57.5 Å²	57.5	50%	0.497	35%	0.353	S	S	.	.	S	Bend	trans	-89.7	-26	-177.5	-62.8	179.5	0	0	0	112.6	T451 I592 E594	T451-L618 HydrophobicContact CG2-CD1 4.48Å; I592-L618 HydrophobicContact CG2-CB 4.36Å; I592-L618 HydrophobicContact CG2-CD1 4.05Å; I592-L618 PolarHBondContact O-N 3.31Å; E594-L618 HydrophobicContact CB-CD1 4.35Å; E594-L618 HydrophobicContact CB-CD2 4.47Å; E594-L618 HydrophobicContact CB-CG 4.39Å
619	D	85.4	Confident	73.2	Confident	73 Å²	73	64 Å²	64	39%	0.39	38%	0.375	S	S	.	.	S	Bend	trans	-118.1	10	-172.4	68.7	-27.4	0	0	0	113.9	N591 I592 C617	N591-D619 VanDerWaalsContact CA-OD2 3.31Å; N591-D619 WeakPolarHBondContact CA-OD2 3.31Å; N591-D619 WeakPolarHBondContact CB-OD1 3.46Å; N591-D619 PolarHBondContact ND2-OD1 3.11Å; N591-D619 PolarHBondContact ND2-OD2 2.81Å; I592-D619 HydrophobicContact CB-CB 4.47Å; I592-D619 PolarHBondContact N-OD1 2.84Å; I592-D619 PolarHBondContact N-OD2 3.35Å; C617-D619 PolarHBondContact SG-OD1 3.3Å
620	C	81.3	Confident	72.5	Confident	37 Å²	37	63.8 Å²	63.8	25%	0.25	37%	0.366	C	S	.	.	S	Bend	trans	-80.8	143.7	179	-69.4	0	0	0	0	112.6	C617 S622 L625	C617-C620 HydrophobicContact CB-CB 3.68Å; C617-C620 WeakPolarHBondContact CB-SG 3.48Å; C617-C620 WeakPolarHBondContact SG-CB 3.06Å; C617-C620 PolarHBondContact SG-N 3.15Å; C617-C620 CovalentContact SG-SG 2.02Å; C617-C620 PolarHBondContact SG-SG 3.31Å; C620-S622 PolarHBondContact O-N 2.02Å; C620-L625 HydrophobicContact CB-CD1 4.17Å
621	A	68.4	Low	71.9	Confident	79 Å²	79	67.4 Å²	67.4	65%	0.653	39%	0.388	S	S	*	.			trans	-65.3	122.4	172.2	0	0	0	0	0	110.9	S623	A621-S623 PolarHBondContact O-N 2.9Å
622	S	57	Low	71.1	Confident	114 Å²	114	66.9 Å²	66.9	80%	0.797	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-1.9	-167.2	51.8	0	0	0	0	116.5	C620 W624	C620-S622 PolarHBondContact O-N 2.02Å; S622-W624 PolarHBondContact O-N 3.46Å
623	S	48.9	Very low	69.7	Low	95 Å²	95	73.3 Å²	73.3	66%	0.664	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.5	-169.9	54.1	0	0	0	0	115.6	A621	A621-S623 PolarHBondContact O-N 2.9Å
624	W	49.2	Very low	68.5	Low	198 Å²	198	76.4 Å²	76.4	75%	0.75	43%	0.432	S	S	*	.	S	Bend	trans	-121.4	-3	-174.9	-64.5	87.2	0	0	0	115.1	S622	S622-W624 PolarHBondContact O-N 3.46Å
625	L	51.8	Low	67.3	Low	49 Å²	49	81.5 Å²	81.5	26%	0.257	45%	0.45	S	S	.	.			trans	-108.9	93.5	-179.4	-76.9	156.8	0	0	0	109.5	V583 C620 G627	V583-L625 HydrophobicContact CB-CD2 4.42Å; V583-L625 HydrophobicContact CG1-CD2 4.27Å; V583-L625 HydrophobicContact CG2-CD2 3.66Å; C620-L625 HydrophobicContact CB-CD1 4.17Å; L625-G627 PolarHBondContact O-N 3.38Å
626	T	45.3	Very low	66.3	Low	163 Å²	163	85.1 Å²	85.1	100%	1	47%	0.47	S	S	*	.	S	Bend	trans	-67.2	18.3	170.5	10.2	0	0	0	0	114
627	G	51.3	Low	65.5	Low	37 Å²	37	83.9 Å²	83.9	38%	0.381	46%	0.464	S	S	.	.			trans	-165.3	96.8	175.6	0	0	0	0	0	109.2	L625 R629	L625-G627 PolarHBondContact O-N 3.38Å; G627-R629 PolarHBondContact O-N 3.07Å; G627-R629 VanDerWaalsContact O-N 3.08Å
628	G	57.3	Low	64.8	Low	47 Å²	47	91.6 Å²	91.6	49%	0.485	49%	0.491	S	S	.	.	S	Bend	trans	-50.6	-37.2	-177.4	0	0	0	0	0	112.5	H616	H616-G628 PolarHBondContact CE1-O 3.41Å; H616-G628 PolarHBondContact ND1-O 3.26Å
629	R	65.5	Low	64.3	Low	153 Å²	153	92.4 Å²	92.4	58%	0.577	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.2	178.3	179.1	177.2	176	172.9	1.9	109.9	H616 G627 V631	H616-R629 HydrophobicContact CB-CB 4.4Å; H616-R629 HydrophobicContact CB-CG 4.38Å; G627-R629 PolarHBondContact O-N 3.07Å; G627-R629 VanDerWaalsContact O-N 3.08Å; R629-V631 HydrophobicContact CG-CG2 4Å
630	Q	70.6	Confident	64	Low	44 Å²	44	91 Å²	91	21%	0.206	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.4	173	-163	170.7	19.7	0	0	109.4	E579 F580 V583 A614 I615	E579-Q630 PolarHBondContact O-NE2 3.33Å; F580-Q630 HydrophobicContact CD1-CB 4.22Å; F580-Q630 HydrophobicContact CD1-CG 3.99Å; F580-Q630 HydrophobicContact CE1-CB 4.25Å; F580-Q630 HydrophobicContact CE1-CG 4.09Å; V583-Q630 VanDerWaalsContact CB-OE1 3.3Å; V583-Q630 HydrophobicContact CG2-CB 4.14Å; A614-Q630 CarbonylContact C-O 3.51Å; A614-Q630 WeakPolarHBondContact CA-O 3.47Å; A614-Q630 WeakPolarHBondContact CB-O 2.95Å; I615-Q630 PolarHBondContact N-O 3.06Å; I615-Q630 PolarHBondContact O-N 2.83Å
631	V	74.5	Confident	63.9	Low	79 Å²	79	92.7 Å²	92.7	48%	0.479	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.9	-179.7	-173.6	0	0	0	0	108.1	A614 R629 I633	A614-V631 HydrophobicContact CB-CB 4.44Å; A614-V631 HydrophobicContact CB-CG1 4.43Å; A614-V631 HydrophobicContact CB-CG2 4.08Å; R629-V631 HydrophobicContact CG-CG2 4Å; V631-I633 PolarHBondContact O-N 3.05Å
632	K	71.4	Confident	64.6	Low	50 Å²	50	92.1 Å²	92.1	22%	0.217	48%	0.479	C	S	.	.			trans	-58.8	129.4	171.2	-164.1	-174.5	-177.2	-171.9	0	108.9	E579 F580 E611 K613 E634	E579-K632 WeakPolarHBondContact OE1-CE 3.48Å; E579-K632 VanDerWaalsContact OE1-CG 3.27Å; E579-K632 WeakPolarHBondContact OE1-CG 3.43Å; E579-K632 WeakPolarHBondContact OE2-CA 3.35Å; F580-K632 HydrophobicContact CE2-CB 4.16Å; F580-K632 HydrophobicContact CE2-CG 4.37Å; F580-K632 HydrophobicContact CZ-CB 3.92Å; E611-K632 IonicContact OE1-NZ 3.59Å; E611-K632 PolarHBondContact OE1-NZ 2.8Å; K613-K632 HydrophobicContact CD-CD 4.07Å; K613-K632 WeakPolarHBondContact O-CB 3.39Å; K613-K632 PolarHBondContact O-N 2.91Å; K632-E634 HydrophobicContact CD-CG 4.28Å; K632-E634 HydrophobicContact CG-CG 4.48Å; K632-E634 PolarHBondContact O-N 3.45Å
633	I	59.5	Low	65.9	Low	135 Å²	135	93.4 Å²	93.4	69%	0.692	47%	0.466	S	S	*	.			trans	-75.3	92.7	177.3	-57.4	174.6	0	0	0	107.9	E579 V631	E579-I633 PolarHBondContact OE2-N 3.26Å; V631-I633 PolarHBondContact O-N 3.05Å
634	E	62.5	Low	67.7	Low	77 Å²	77	89.1 Å²	89.1	36%	0.36	44%	0.436	S	S	.	.			trans	-95.9	124.8	170.7	-69.7	-177.9	158.9	0	0	109.6	R447 K613 K632 D636	R447-E634 IonicContact NH2-OE2 3.66Å; R447-E634 PolarHBondContact NH2-OE2 3.39Å; K613-E634 VanDerWaalsContact CD-OE1 3.3Å; K613-E634 WeakPolarHBondContact CD-OE1 3.03Å; K613-E634 WeakPolarHBondContact CE-OE1 3.48Å; K613-E634 IonicContact NZ-OE1 2.93Å; K613-E634 PolarHBondContact NZ-OE1 3.26Å; K632-E634 HydrophobicContact CD-CG 4.28Å; K632-E634 HydrophobicContact CG-CG 4.48Å; K632-E634 PolarHBondContact O-N 3.45Å; E634-D636 PolarHBondContact O-N 2.94Å
635	R	62.6	Low	69.4	Low	114 Å²	114	85.6 Å²	85.6	43%	0.43	43%	0.427	S	S	.	.			trans	-79.3	113.2	169.9	-80.5	-172.5	167.3	105.1	-8.5	109.5	D89 F637	D89-R635 IonicContact OD1-CZ 2.83Å; D89-R635 IonicContact OD1-NH1 3.22Å; D89-R635 PolarHBondContact OD1-NH1 3.24Å; D89-R635 IonicContact OD2-NH1 3.94Å; R635-F637 HydrophobicContact CB-CE2 4.15Å; R635-F637 HydrophobicContact CB-CZ 4.3Å; R635-F637 WeakPolarHBondContact O-CD2 3.39Å; R635-F637 PolarHBondContact O-N 3.49Å
636	D	68.7	Low	71.1	Confident	79 Å²	79	86.8 Å²	86.8	42%	0.422	43%	0.43	S	S	.	.			trans	-72.5	86.7	169.8	-72.4	-32.5	0	0	0	110.2	E634 R638 R639 T640	E634-D636 PolarHBondContact O-N 2.94Å; D636-R638 VanDerWaalsContact C-N 3.31Å; D636-R638 PolarHBondContact O-N 2.97Å; D636-R639 HydrophobicContact CB-CB 3.66Å; D636-R639 PolarHBondContact O-N 2.88Å; D636-R639 IonicContact OD2-CZ 3.78Å; D636-R639 IonicContact OD2-NE 3.75Å; D636-R639 IonicContact OD2-NH1 2.92Å; D636-R639 PolarHBondContact OD2-NH1 3.39Å; D636-T640 PolarHBondContact O-N 3.31Å; D636-T640 VanDerWaalsContact O-N 3.07Å; D636-T640 PolarHBondContact O-OG1 3.46Å
637	F	70.4	Confident	73.2	Confident	28 Å²	28	81.3 Å²	81.3	12%	0.123	39%	0.392	C	S	.	.	H	α-helix	trans	-61.7	-40.8	176.1	-65.8	-83.9	0	0	0	111	V88 A92 F397 V401 E405 R635 R639 T640 T641	V88-F637 HydrophobicContact CG1-CE2 4.38Å; V88-F637 HydrophobicContact CG1-CZ 4.11Å; A92-F637 HydrophobicContact CB-CE1 3.74Å; A92-F637 HydrophobicContact CB-CZ 3.94Å; F397-F637 HydrophobicContact CZ-CD1 4.23Å; F397-F637 AromaticContact CZ-CE1 3.84Å; F397-F637 HydrophobicContact CZ-CE1 3.84Å; V401-F637 HydrophobicContact CG1-CB 3.87Å; V401-F637 HydrophobicContact CG1-CD1 4.34Å; V401-F637 HydrophobicContact CG1-CD2 4.1Å; V401-F637 HydrophobicContact CG1-CG 3.86Å; V401-F637 HydrophobicContact CG2-CD1 4.19Å; V401-F637 HydrophobicContact CG2-CE1 4.21Å; V401-F637 HydrophobicContact CG2-CG 4.45Å; V401-F637 HydrophobicContact CG2-CZ 4.47Å; E405-F637 HydrophobicContact CG-CB 4.42Å; E405-F637 HydrophobicContact CG-CD2 4.16Å; E405-F637 VanDerWaalsContact OE1-CB 3.32Å; E405-F637 WeakPolarHBondContact OE1-CB 3.11Å; R635-F637 HydrophobicContact CB-CE2 4.15Å; R635-F637 HydrophobicContact CB-CZ 4.3Å; R635-F637 WeakPolarHBondContact O-CD2 3.39Å; R635-F637 PolarHBondContact O-N 3.49Å; F637-R639 PolarHBondContact O-N 3.39Å; F637-T640 CarbonylContact O-C 3.56Å; F637-T640 WeakPolarHBondContact O-CA 3.29Å; F637-T640 WeakPolarHBondContact O-CB 3.02Å; F637-T640 PolarHBondContact O-N 3.07Å; F637-T641 PolarHBondContact O-N 3.28Å; F637-T641 PolarHBondContact O-OG1 3.35Å; F637-T641 VanDerWaalsContact O-OG1 3.08Å
638	R	72.9	Confident	74.9	Confident	178 Å²	178	79.9 Å²	79.9	67%	0.672	38%	0.377	S	S	*	.	H	α-helix	trans	-51.5	-49.6	172.8	-170.2	178.9	79.3	-173	5.1	113.6	E405 D636 T640 T641 V642	E405-R638 PolarHBondContact OE1-N 3.33Å; D636-R638 VanDerWaalsContact C-N 3.31Å; D636-R638 PolarHBondContact O-N 2.97Å; R638-T640 VanDerWaalsContact C-N 3.29Å; R638-T640 PolarHBondContact O-N 2.95Å; R638-T641 PolarHBondContact O-N 3.25Å; R638-V642 WeakPolarHBondContact O-CG2 3.41Å; R638-V642 PolarHBondContact O-N 3.33Å
639	R	76.4	Confident	76.3	Confident	111 Å²	111	80.4 Å²	80.4	42%	0.419	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-37.5	179.4	-177.1	178.6	-84.5	162.5	-17.2	110.9	D636 F637 V642 R643	D636-R639 HydrophobicContact CB-CB 3.66Å; D636-R639 PolarHBondContact O-N 2.88Å; D636-R639 IonicContact OD2-CZ 3.78Å; D636-R639 IonicContact OD2-NE 3.75Å; D636-R639 IonicContact OD2-NH1 2.92Å; D636-R639 PolarHBondContact OD2-NH1 3.39Å; F637-R639 PolarHBondContact O-N 3.39Å; R639-V642 PolarHBondContact O-N 2.82Å; R639-R643 WeakPolarHBondContact O-CG 3.22Å; R639-R643 PolarHBondContact O-N 2.91Å
640	T	78.5	Confident	77.3	Confident	43 Å²	43	74.6 Å²	74.6	26%	0.264	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-44	176.8	-53.4	0	0	0	0	111.4	V171 D636 F637 R638 R643 A644	V171-T640 HydrophobicContact CB-CG2 4.43Å; V171-T640 HydrophobicContact CG1-CG2 3.92Å; V171-T640 HydrophobicContact CG2-CG2 4.17Å; D636-T640 PolarHBondContact O-N 3.31Å; D636-T640 VanDerWaalsContact O-N 3.07Å; D636-T640 PolarHBondContact O-OG1 3.46Å; F637-T640 CarbonylContact O-C 3.56Å; F637-T640 WeakPolarHBondContact O-CA 3.29Å; F637-T640 WeakPolarHBondContact O-CB 3.02Å; F637-T640 PolarHBondContact O-N 3.07Å; R638-T640 VanDerWaalsContact C-N 3.29Å; R638-T640 PolarHBondContact O-N 2.95Å; T640-R643 WeakPolarHBondContact O-CB 3.47Å; T640-R643 PolarHBondContact O-N 3.13Å; T640-A644 PolarHBondContact O-N 2.77Å
641	T	80.2	Confident	78.1	Confident	73 Å²	73	73 Å²	73	45%	0.448	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-44.7	175.2	-58.8	0	0	0	0	112.1	F637 R638 R643 A644 F645	F637-T641 PolarHBondContact O-N 3.28Å; F637-T641 PolarHBondContact O-OG1 3.35Å; F637-T641 VanDerWaalsContact O-OG1 3.08Å; R638-T641 PolarHBondContact O-N 3.25Å; T641-R643 VanDerWaalsContact C-N 3.31Å; T641-R643 PolarHBondContact O-N 3.12Å; T641-A644 WeakPolarHBondContact O-CB 3.41Å; T641-A644 PolarHBondContact O-N 3.26Å; T641-A644 VanDerWaalsContact O-N 3.1Å; T641-F645 HydrophobicContact CG2-CD2 3.73Å; T641-F645 HydrophobicContact CG2-CE2 3.5Å; T641-F645 VanDerWaalsContact CG2-CE2 3.5Å; T641-F645 VanDerWaalsContact O-CD2 3.25Å; T641-F645 WeakPolarHBondContact O-CD2 3.41Å; T641-F645 PolarHBondContact O-N 3.02Å
642	V	82.7	Confident	78.5	Confident	67 Å²	67	73.1 Å²	73.1	41%	0.406	33%	0.333	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175.8	173.2	0	0	0	0	111.3	R638 R639 A644 F645 K646 I661	R638-V642 WeakPolarHBondContact O-CG2 3.41Å; R638-V642 PolarHBondContact O-N 3.33Å; R639-V642 PolarHBondContact O-N 2.82Å; V642-A644 VanDerWaalsContact C-N 3.34Å; V642-A644 PolarHBondContact O-N 3.09Å; V642-F645 PolarHBondContact O-N 3.01Å; V642-K646 WeakPolarHBondContact O-CB 3.48Å; V642-K646 PolarHBondContact O-N 3.41Å; V642-I661 HydrophobicContact CG1-CD1 4.02Å; V642-I661 HydrophobicContact CG1-CG1 4.14Å; V642-I661 HydrophobicContact CG1-CG2 4.06Å
643	R	84.1	Confident	79	Confident	141 Å²	141	74.5 Å²	74.5	53%	0.532	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-38.8	173	-72.6	175.1	-170.5	162.7	-0.5	112.4	R639 T640 T641 K646 F647 I661	R639-R643 WeakPolarHBondContact O-CG 3.22Å; R639-R643 PolarHBondContact O-N 2.91Å; T640-R643 WeakPolarHBondContact O-CB 3.47Å; T640-R643 PolarHBondContact O-N 3.13Å; T641-R643 VanDerWaalsContact C-N 3.31Å; T641-R643 PolarHBondContact O-N 3.12Å; R643-K646 PolarHBondContact O-N 3.49Å; R643-F647 WeakPolarHBondContact O-CB 3.48Å; R643-F647 PolarHBondContact O-N 3.02Å; R643-I661 HydrophobicContact CG-CD1 4.11Å
644	A	85.6	Confident	79.9	Confident	5 Å²	5	70 Å²	70	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-43.3	176.7	0	0	0	0	0	111.9	F167 P170 V171 T640 T641 V642 F647 A648	F167-A644 HydrophobicContact CD1-CB 4.46Å; P170-A644 HydrophobicContact CG-CB 3.9Å; V171-A644 HydrophobicContact CG2-CB 3.83Å; T640-A644 PolarHBondContact O-N 2.77Å; T641-A644 WeakPolarHBondContact O-CB 3.41Å; T641-A644 PolarHBondContact O-N 3.26Å; T641-A644 VanDerWaalsContact O-N 3.1Å; V642-A644 VanDerWaalsContact C-N 3.34Å; V642-A644 PolarHBondContact O-N 3.09Å; A644-F647 PolarHBondContact O-N 3.45Å; A644-A648 WeakPolarHBondContact O-CB 3.49Å; A644-A648 PolarHBondContact O-N 3.27Å
645	F	86	Confident	80.4	Confident	125 Å²	125	67.2 Å²	67.2	55%	0.548	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-42.5	173.3	-82.4	-68.7	0	0	0	112.5	F167 T641 V642 F647 A648 F649	F167-F645 AromaticContact CE1-CD1 3.6Å; F167-F645 HydrophobicContact CE1-CD1 3.6Å; F167-F645 AromaticContact CE1-CE1 3.58Å; F167-F645 HydrophobicContact CE1-CE1 3.58Å; F167-F645 HydrophobicContact CE1-CG 4.19Å; F167-F645 HydrophobicContact CE1-CZ 4.16Å; F167-F645 AromaticContact CZ-CD1 3.92Å; F167-F645 HydrophobicContact CZ-CD1 3.92Å; F167-F645 AromaticContact CZ-CE1 3.84Å; F167-F645 HydrophobicContact CZ-CE1 3.84Å; T641-F645 HydrophobicContact CG2-CD2 3.73Å; T641-F645 HydrophobicContact CG2-CE2 3.5Å; T641-F645 VanDerWaalsContact CG2-CE2 3.5Å; T641-F645 VanDerWaalsContact O-CD2 3.25Å; T641-F645 WeakPolarHBondContact O-CD2 3.41Å; T641-F645 PolarHBondContact O-N 3.02Å; V642-F645 PolarHBondContact O-N 3.01Å; F645-F647 VanDerWaalsContact C-N 3.34Å; F645-F647 PolarHBondContact O-N 3.29Å; F645-A648 PolarHBondContact O-N 3.44Å; F645-F649 WeakPolarHBondContact O-CB 3.29Å; F645-F649 PolarHBondContact O-N 3.5Å
646	K	88.1	Confident	81.1	Confident	74 Å²	74	64.7 Å²	64.7	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-59.8	-46.7	175.3	-170.3	-137.7	-178.4	-158.9	0	111.1	V642 R643 F649 D650 A659 I661	V642-K646 WeakPolarHBondContact O-CB 3.48Å; V642-K646 PolarHBondContact O-N 3.41Å; R643-K646 PolarHBondContact O-N 3.49Å; K646-F649 PolarHBondContact O-N 3.25Å; K646-D650 IonicContact NZ-OD2 3.91Å; K646-D650 WeakPolarHBondContact CE-OD2 3.43Å; K646-D650 PolarHBondContact O-N 2.01Å; K646-D650 WeakPolarHBondContact O-CB 3.33Å; K646-A659 HydrophobicContact CB-CB 4.47Å; K646-A659 WeakPolarHBondContact CE-O 3.35Å; K646-A659 HydrophobicContact CG-CB 3.69Å; K646-I661 HydrophobicContact CB-CD1 3.75Å; K646-I661 HydrophobicContact CB-CG1 4.01Å; K646-I661 HydrophobicContact CD-CD1 3.64Å; K646-I661 HydrophobicContact CD-CG1 3.86Å; K646-I661 HydrophobicContact CG-CD1 3.93Å; K646-I661 HydrophobicContact CG-CG1 3.87Å
647	F	88.6	Confident	81.7	Confident	48 Å²	48	62.3 Å²	62.3	21%	0.211	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-44.1	176.5	177.8	-92.4	0	0	0	112	I166 F169 P170 V296 R643 A644 F645 F649 D650 F651	I166-F647 HydrophobicContact CG2-CD1 4.17Å; I166-F647 HydrophobicContact CG2-CE1 4.13Å; I166-F647 WeakPolarHBondContact O-CD1 3.31Å; I166-F647 WeakPolarHBondContact O-CE1 3.47Å; F169-F647 HydrophobicContact CB-CE1 4.5Å; F169-F647 AromaticContact CD1-CE1 3.92Å; F169-F647 HydrophobicContact CD1-CE1 3.92Å; F169-F647 HydrophobicContact CD1-CE2 4.01Å; F169-F647 AromaticContact CD1-CZ 3.44Å; F169-F647 HydrophobicContact CD1-CZ 3.44Å; F169-F647 VanDerWaalsContact CD1-CZ 3.44Å; F169-F647 HydrophobicContact CE1-CE2 4.19Å; F169-F647 AromaticContact CE1-CZ 3.93Å; F169-F647 HydrophobicContact CE1-CZ 3.93Å; P170-F647 HydrophobicContact CB-CB 3.89Å; P170-F647 HydrophobicContact CB-CD1 4.11Å; P170-F647 HydrophobicContact CB-CD2 4.39Å; P170-F647 HydrophobicContact CB-CG 3.86Å; P170-F647 HydrophobicContact CG-CB 3.92Å; P170-F647 HydrophobicContact CG-CD1 3.68Å; P170-F647 HydrophobicContact CG-CE1 4.46Å; P170-F647 HydrophobicContact CG-CG 3.89Å; V296-F647 HydrophobicContact CG1-CE2 4.18Å; V296-F647 HydrophobicContact CG1-CZ 3.7Å; R643-F647 WeakPolarHBondContact O-CB 3.48Å; R643-F647 PolarHBondContact O-N 3.02Å; A644-F647 PolarHBondContact O-N 3.45Å; F645-F647 VanDerWaalsContact C-N 3.34Å; F645-F647 PolarHBondContact O-N 3.29Å; F647-F649 VanDerWaalsContact C-N 3.35Å; F647-F649 PolarHBondContact O-N 3.35Å; F647-D650 PolarHBondContact O-N 3.34Å; F647-F651 PolarHBondContact O-N 3.3Å; F647-F651 WeakPolarHBondContact O-CB 3.21Å
648	A	87.6	Confident	82.2	Confident	7 Å²	7	61.5 Å²	61.5	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-41.5	176.5	0	0	0	0	0	112	I166 F167 A644 F645 F651 F652	I166-A648 HydrophobicContact CG2-CB 3.73Å; F167-A648 HydrophobicContact CD2-CB 4.49Å; F167-A648 HydrophobicContact CE1-CB 4.16Å; F167-A648 HydrophobicContact CE2-CB 3.95Å; F167-A648 HydrophobicContact CZ-CB 3.78Å; A644-A648 WeakPolarHBondContact O-CB 3.49Å; A644-A648 PolarHBondContact O-N 3.27Å; F645-A648 PolarHBondContact O-N 3.44Å; A648-F651 WeakPolarHBondContact O-CB 3.25Å; A648-F651 PolarHBondContact O-N 3.01Å; A648-F652 WeakPolarHBondContact O-CD2 3.28Å; A648-F652 PolarHBondContact O-N 2.92Å
649	F	87	Confident	82.6	Confident	58 Å²	58	53.8 Å²	53.8	25%	0.254	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-49.2	174.9	-175.3	-86.3	0	0	0	111.5	V247 F645 K646 F647 F651 F652 F653 L657 A659	V247-F649 HydrophobicContact CG1-CZ 4.3Å; V247-F649 HydrophobicContact CG2-CZ 4.35Å; F645-F649 WeakPolarHBondContact O-CB 3.29Å; F645-F649 PolarHBondContact O-N 3.5Å; K646-F649 PolarHBondContact O-N 3.25Å; F647-F649 VanDerWaalsContact C-N 3.35Å; F647-F649 PolarHBondContact O-N 3.35Å; F649-F651 PolarHBondContact O-N 3.32Å; F649-F652 PolarHBondContact O-N 3.18Å; F649-F653 HydrophobicContact CE2-CE2 3.77Å; F649-F653 HydrophobicContact CE2-CG 4.35Å; F649-F653 AromaticContact CG-CD2 3.94Å; F649-F653 HydrophobicContact CG-CD2 3.94Å; F649-F653 HydrophobicContact CZ-CB 4.36Å; F649-F653 AromaticContact CZ-CD2 3.84Å; F649-F653 HydrophobicContact CZ-CD2 3.84Å; F649-F653 HydrophobicContact CZ-CE2 4.44Å; F649-F653 HydrophobicContact CZ-CG 4.22Å; F649-F653 WeakPolarHBondContact O-CD2 3.4Å; F649-F653 PolarHBondContact O-N 3.01Å; F649-F653 AromaticContact CD2-CD2 3.61Å; F649-F653 AromaticContact CE2-CE2 3.77Å; F649-F653 HydrophobicContact CD1-CD2 4.19Å; F649-F653 HydrophobicContact CD2-CD2 3.61Å; F649-F653 AromaticContact CD2-CE2 3.82Å; F649-F653 HydrophobicContact CD2-CE2 3.82Å; F649-F653 HydrophobicContact CE1-CB 4.16Å; F649-F653 HydrophobicContact CE1-CD2 4.15Å; F649-F653 HydrophobicContact CE1-CG 4.45Å; F649-F653 AromaticContact CE2-CD2 3.55Å; F649-F653 HydrophobicContact CE2-CD2 3.55Å; F649-L657 HydrophobicContact CE1-CB 3.93Å; F649-L657 HydrophobicContact CZ-CB 4.11Å; F649-L657 HydrophobicContact CZ-CD1 4.48Å; F649-A659 HydrophobicContact CB-CB 4.24Å; F649-A659 HydrophobicContact CD1-CB 3.59Å; F649-A659 HydrophobicContact CE1-CB 4.22Å; F649-A659 HydrophobicContact CG-CB 4.06Å
650	D	86.4	Confident	82.7	Confident	30 Å²	30	53.4 Å²	53.4	16%	0.16	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-35.4	177.5	-71.3	-24.4	0	0	0	110.8	K646 F647 F652 S654 S658 A659	K646-D650 IonicContact NZ-OD2 3.91Å; K646-D650 WeakPolarHBondContact CE-OD2 3.43Å; K646-D650 PolarHBondContact O-N 2.01Å; K646-D650 WeakPolarHBondContact O-CB 3.33Å; F647-D650 PolarHBondContact O-N 3.34Å; D650-F652 PolarHBondContact O-N 3.38Å; D650-S654 WeakPolarHBondContact O-CB 3.19Å; D650-S654 PolarHBondContact O-N 2.85Å; D650-S654 WeakPolarHBondContact O-CA 3.33Å; D650-S658 WeakPolarHBondContact OD1-CA 3.06Å; D650-S658 WeakPolarHBondContact OD1-CB 3.37Å; D650-S658 PolarHBondContact OD1-OG 3.48Å; D650-A659 PolarHBondContact OD1-N 2.96Å
651	F	86.6	Confident	82.4	Confident	11 Å²	11	54.1 Å²	54.1	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-42.4	177	-175.9	-80.2	0	0	0	113.1	I166 M289 E292 F293 V296 F647 A648 F649	I166-F651 HydrophobicContact CD1-CD1 3.46Å; I166-F651 VanDerWaalsContact CD1-CD1 3.46Å; I166-F651 HydrophobicContact CD1-CD2 4.43Å; I166-F651 HydrophobicContact CD1-CE1 3.51Å; I166-F651 HydrophobicContact CD1-CE2 4.43Å; I166-F651 HydrophobicContact CD1-CG 3.98Å; I166-F651 HydrophobicContact CD1-CZ 4.01Å; I166-F651 HydrophobicContact CG1-CD1 4.13Å; I166-F651 HydrophobicContact CG1-CD2 4.22Å; I166-F651 HydrophobicContact CG1-CE1 4.21Å; I166-F651 HydrophobicContact CG1-CE2 4.26Å; I166-F651 HydrophobicContact CG1-CG 4.17Å; I166-F651 HydrophobicContact CG1-CZ 4.26Å; I166-F651 HydrophobicContact CG2-CB 4.24Å; I166-F651 HydrophobicContact CG2-CG 4.29Å; M289-F651 HydrophobicContact CE-CD1 4.31Å; M289-F651 HydrophobicContact CE-CE1 3.43Å; M289-F651 VanDerWaalsContact CE-CE1 3.43Å; M289-F651 HydrophobicContact CE-CZ 4.17Å; M289-F651 HydrophobicContact SD-CE1 4.4Å; E292-F651 HydrophobicContact CB-CE1 4.27Å; E292-F651 HydrophobicContact CB-CE2 4.32Å; E292-F651 HydrophobicContact CB-CZ 3.77Å; F293-F651 HydrophobicContact CB-CE2 4.33Å; F293-F651 HydrophobicContact CB-CZ 4.33Å; F293-F651 HydrophobicContact CD2-CE2 4.27Å; V296-F651 HydrophobicContact CG2-CD2 3.91Å; V296-F651 HydrophobicContact CG2-CE2 3.96Å; F647-F651 PolarHBondContact O-N 3.3Å; F647-F651 WeakPolarHBondContact O-CB 3.21Å; A648-F651 WeakPolarHBondContact O-CB 3.25Å; A648-F651 PolarHBondContact O-N 3.01Å; F649-F651 PolarHBondContact O-N 3.32Å
652	F	82.7	Confident	81.3	Confident	81 Å²	81	59.6 Å²	59.6	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-87.4	-28.3	-176.7	-73.4	-72.4	0	0	0	113.9	I166 M289 A648 F649 D650	I166-F652 HydrophobicContact CD1-CE1 4.48Å; I166-F652 HydrophobicContact CD1-CE2 3.86Å; I166-F652 HydrophobicContact CD1-CZ 3.65Å; M289-F652 HydrophobicContact CE-CD1 4.37Å; M289-F652 HydrophobicContact CE-CE1 3.42Å; M289-F652 VanDerWaalsContact CE-CE1 3.42Å; M289-F652 HydrophobicContact CE-CZ 3.81Å; M289-F652 HydrophobicContact SD-CE1 4.18Å; A648-F652 WeakPolarHBondContact O-CD2 3.28Å; A648-F652 PolarHBondContact O-N 2.92Å; F649-F652 PolarHBondContact O-N 3.18Å; D650-F652 PolarHBondContact O-N 3.38Å
653	F	81.4	Confident	79.7	Confident	80 Å²	80	64.3 Å²	64.3	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-116.3	-15.4	-169.4	-60.4	-74.3	0	0	0	114.7	F649 F656 L657	F649-F653 HydrophobicContact CE2-CE2 3.77Å; F649-F653 HydrophobicContact CE2-CG 4.35Å; F649-F653 AromaticContact CG-CD2 3.94Å; F649-F653 HydrophobicContact CG-CD2 3.94Å; F649-F653 HydrophobicContact CZ-CB 4.36Å; F649-F653 AromaticContact CZ-CD2 3.84Å; F649-F653 HydrophobicContact CZ-CD2 3.84Å; F649-F653 HydrophobicContact CZ-CE2 4.44Å; F649-F653 HydrophobicContact CZ-CG 4.22Å; F649-F653 WeakPolarHBondContact O-CD2 3.4Å; F649-F653 PolarHBondContact O-N 3.01Å; F649-F653 AromaticContact CD2-CD2 3.61Å; F649-F653 AromaticContact CE2-CE2 3.77Å; F649-F653 HydrophobicContact CD1-CD2 4.19Å; F649-F653 HydrophobicContact CD2-CD2 3.61Å; F649-F653 AromaticContact CD2-CE2 3.82Å; F649-F653 HydrophobicContact CD2-CE2 3.82Å; F649-F653 HydrophobicContact CE1-CB 4.16Å; F649-F653 HydrophobicContact CE1-CD2 4.15Å; F649-F653 HydrophobicContact CE1-CG 4.45Å; F649-F653 AromaticContact CE2-CD2 3.55Å; F649-F653 HydrophobicContact CE2-CD2 3.55Å; F653-F656 WeakPolarHBondContact O-CB 3.45Å; F653-F656 PolarHBondContact O-N 2.93Å; F653-F656 WeakPolarHBondContact O-CA 2.81Å; F653-F656 CarbonylContact O-C 3.6Å; F653-L657 CarbonylContact C-O 3.56Å; F653-L657 HydrophobicContact CB-CB 3.99Å; F653-L657 PolarHBondContact O-N 3.43Å
654	S	78.4	Confident	79.5	Confident	41 Å²	41	60.5 Å²	60.5	29%	0.287	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	141.8	172.4	-176.8	0	0	0	0	109.5	D650 L657	D650-S654 WeakPolarHBondContact O-CB 3.19Å; D650-S654 PolarHBondContact O-N 2.85Å; D650-S654 WeakPolarHBondContact O-CA 3.33Å; S654-L657 WeakPolarHBondContact CA-O 2.89Å; S654-L657 PolarHBondContact N-O 2.82Å
655	P	73.5	Confident	79.2	Confident	17 Å²	17	63.4 Å²	63.4	11%	0.11	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	2.5	5.7	34.2	-33.4	0	0	0	115	P254 Y258	P254-P655 HydrophobicContact CB-CB 4.02Å; P254-P655 HydrophobicContact CB-CG 3.48Å; P254-P655 VanDerWaalsContact CB-CG 3.48Å; Y258-P655 HydrophobicContact CD2-CG 3.82Å; Y258-P655 VanDerWaalsContact CE2-CD 3.43Å; Y258-P655 HydrophobicContact CE2-CG 4.23Å; Y258-P655 HydrophobicContact CG-CG 4.22Å
656	F	76.8	Confident	78.8	Confident	62 Å²	62	60 Å²	60	27%	0.272	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-56.7	-178.6	176.5	-111.8	0	0	0	111.8	L249 K250 I259 F653	L249-F656 HydrophobicContact CD1-CD2 4.16Å; L249-F656 HydrophobicContact CD1-CE2 3.91Å; L249-F656 HydrophobicContact CD1-CZ 4.18Å; L249-F656 VanDerWaalsContact CD1-O 3.29Å; L249-F656 WeakPolarHBondContact CD1-O 3.43Å; K250-F656 PolarHBondContact N-O 3.1Å; I259-F656 HydrophobicContact CD1-CD2 4.24Å; I259-F656 HydrophobicContact CD1-CE2 4.14Å; I259-F656 HydrophobicContact CG1-CD2 4.06Å; I259-F656 HydrophobicContact CG1-CE2 4.15Å; F653-F656 WeakPolarHBondContact O-CB 3.45Å; F653-F656 PolarHBondContact O-N 2.93Å; F653-F656 WeakPolarHBondContact O-CA 2.81Å; F653-F656 CarbonylContact O-C 3.6Å
657	L	81.1	Confident	78.2	Confident	29 Å²	29	59.2 Å²	59.2	15%	0.152	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.5	175.1	-60.6	160.1	0	0	0	110.2	L243 V247 L249 F649 F653 S654	L243-L657 HydrophobicContact CD1-CD2 3.58Å; V247-L657 HydrophobicContact CG1-CB 4.19Å; V247-L657 HydrophobicContact CG1-CD2 3.74Å; V247-L657 HydrophobicContact CG1-CG 4.42Å; L249-L657 HydrophobicContact CB-CD2 4.44Å; L249-L657 HydrophobicContact CD1-CD2 3.74Å; L249-L657 HydrophobicContact CD1-CG 4.48Å; F649-L657 HydrophobicContact CE1-CB 3.93Å; F649-L657 HydrophobicContact CZ-CB 4.11Å; F649-L657 HydrophobicContact CZ-CD1 4.48Å; F653-L657 CarbonylContact C-O 3.56Å; F653-L657 HydrophobicContact CB-CB 3.99Å; F653-L657 PolarHBondContact O-N 3.43Å; S654-L657 WeakPolarHBondContact CA-O 2.89Å; S654-L657 PolarHBondContact N-O 2.82Å
658	S	81.1	Confident	77.6	Confident	10 Å²	10	59.9 Å²	59.9	7%	0.07	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.2	170.7	-172.9	0	0	0	0	110	V248 D650	V248-S658 PolarHBondContact N-O 2.98Å; V248-S658 PolarHBondContact O-N 3.41Å; D650-S658 WeakPolarHBondContact OD1-CA 3.06Å; D650-S658 WeakPolarHBondContact OD1-CB 3.37Å; D650-S658 PolarHBondContact OD1-OG 3.48Å
659	A	81.8	Confident	76.9	Confident	17 Å²	17	63.4 Å²	63.4	14%	0.14	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	137.3	175.4	0	0	0	0	0	110	S246 K646 F649 D650	S246-A659 WeakPolarHBondContact O-CA 3.47Å; K646-A659 HydrophobicContact CB-CB 4.47Å; K646-A659 WeakPolarHBondContact CE-O 3.35Å; K646-A659 HydrophobicContact CG-CB 3.69Å; F649-A659 HydrophobicContact CB-CB 4.24Å; F649-A659 HydrophobicContact CD1-CB 3.59Å; F649-A659 HydrophobicContact CE1-CB 4.22Å; F649-A659 HydrophobicContact CG-CB 4.06Å; D650-A659 PolarHBondContact OD1-N 2.96Å
660	E	78.9	Confident	76.2	Confident	102 Å²	102	63.8 Å²	63.8	48%	0.477	32%	0.318	S	S	.	.			trans	-110.5	124.7	174.5	-168.8	172.5	-167.9	0	0	109.7	S246 V248	S246-E660 PolarHBondContact O-N 2.75Å; V248-E660 HydrophobicContact CG2-CB 4.05Å; V248-E660 VanDerWaalsContact CG2-OE2 3.22Å; V248-E660 WeakPolarHBondContact CG2-OE2 3.4Å
661	I	70.7	Confident	75.4	Confident	59 Å²	59	66.4 Å²	66.4	30%	0.303	33%	0.33	S	S	.	.			trans	-94.2	109	175	-54.7	171.7	0	0	0	107.3	V642 R643 K646 T663	V642-I661 HydrophobicContact CG1-CD1 4.02Å; V642-I661 HydrophobicContact CG1-CG1 4.14Å; V642-I661 HydrophobicContact CG1-CG2 4.06Å; R643-I661 HydrophobicContact CG-CD1 4.11Å; K646-I661 HydrophobicContact CB-CD1 3.75Å; K646-I661 HydrophobicContact CB-CG1 4.01Å; K646-I661 HydrophobicContact CD-CD1 3.64Å; K646-I661 HydrophobicContact CD-CG1 3.86Å; K646-I661 HydrophobicContact CG-CD1 3.93Å; K646-I661 HydrophobicContact CG-CG1 3.87Å; I661-T663 HydrophobicContact CG2-CG2 3.89Å; I661-T663 PolarHBondContact O-N 3.03Å
662	R	59.1	Low	74.5	Confident	188 Å²	188	71 Å²	71	71%	0.709	35%	0.354	S	S	*	.			trans	-77.9	107.9	160.5	-74.5	-176.1	179	-176.5	0.6	108.1
663	T	48.2	Very low	73.7	Confident	166 Å²	166	70.1 Å²	70.1	100%	1.018	35%	0.354	S	S	*	.			trans	-84.9	0	175.7	49.9	0	0	0	0	112.6	I661	I661-T663 HydrophobicContact CG2-CG2 3.89Å; I661-T663 PolarHBondContact O-N 3.03Å

Retrieved 663 of 663 residues in 783.4 ms (Link to these results)

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