A0A087XXY4_POEFO Loading...

Interleukin-12 subunit alpha

AlphaFold DB , UniProt , Accession A0A087XXY4, Species POEFO (Poecilia formosa, Amazon molly), Gene IL12A, Length 211 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	V	34.3	Very low	47.3	Very low	188 Å²	188	122.4 Å²	122.4	100%	1.139	73%	0.73	S	S	*	*				0	78.9	0	-172.7	0	0	0	0	105.8
2	W	36.8	Very low	48.9	Very low	231 Å²	231	117.1 Å²	117.1	88%	0.875	71%	0.71	S	S	*	*				71.5	110.9	101.2	-72.6	58.8	0	0	0	113.5
3	D	37.2	Very low	50.4	Low	123 Å²	123	112.2 Å²	112.2	66%	0.658	69%	0.69	S	S	*	*			trans	59	135.2	145.4	-57.3	-51.8	0	0	0	120.6
4	S	46.2	Very low	51.6	Low	104 Å²	104	112.4 Å²	112.4	73%	0.727	68%	0.683	S	S	*	*				-164	149	53.6	-61.2	0	0	0	0	113.9
5	P	47.5	Very low	52.6	Low	107 Å²	107	113.2 Å²	113.2	70%	0.695	68%	0.679	S	S	*	*			trans	-98.9	86.9	165.5	34.8	-24.7	0	0	0	110.5
6	A	48.6	Very low	53.5	Low	92 Å²	92	113.4 Å²	113.4	76%	0.76	67%	0.674	S	S	*	*			trans	-88.8	4.4	-173.4	0	0	0	0	0	115.5
7	G	48.7	Very low	54.3	Low	55 Å²	55	113.5 Å²	113.5	57%	0.567	67%	0.668	S	S	*	*	S	Bend	trans	-93.8	-32.5	-172.5	0	0	0	0	0	116.1
8	F	49.3	Very low	54.8	Low	186 Å²	186	111.7 Å²	111.7	82%	0.816	66%	0.655	S	S	*	*	H	α-helix	trans	-91.6	-23.2	-168.1	-71.1	-79.4	0	0	0	114.2	S10	F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 3.28Å
9	S	52.9	Low	55.4	Low	91 Å²	91	113.4 Å²	113.4	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-71.9	-25.4	-178.7	-167.1	0	0	0	0	113.1	A13	S9-A13 WeakPolarHBondContact O-CB 3.41Å; S9-A13 PolarHBondContact O-N 3.43Å; S9-A13 VanDerWaalsContact O-N 3.15Å
10	S	59.3	Low	55.8	Low	78 Å²	78	113.6 Å²	113.6	55%	0.545	66%	0.655	S	S	.	*	H	α-helix	trans	-72.6	-43.8	-175.3	-173.5	0	0	0	0	112.1	F8 A13 L14	F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 3.28Å; S10-A13 PolarHBondContact O-N 2.97Å; S10-L14 WeakPolarHBondContact O-CB 3.16Å; S10-L14 PolarHBondContact O-N 3.33Å
11	C	59.8	Low	55.9	Low	91 Å²	91	114 Å²	114	62%	0.615	66%	0.655	S	S	*	*	H	α-helix	trans	-68.3	-39.5	177.9	-70.4	0	0	0	0	112.6	A13 L14 M15	C11-A13 VanDerWaalsContact C-N 3.35Å; C11-L14 PolarHBondContact O-N 3.37Å; C11-M15 WeakPolarHBondContact O-CB 3.33Å; C11-M15 WeakPolarHBondContact O-CG 3.44Å; C11-M15 PolarHBondContact O-N 3.06Å
12	A	66.4	Low	56.8	Low	59 Å²	59	110.8 Å²	110.8	49%	0.488	63%	0.631	S	S	.	*	H	α-helix	trans	-64.8	-40.3	177.3	0	0	0	0	0	111.6	M15 L16	A12-M15 PolarHBondContact O-N 3.47Å; A12-L16 WeakPolarHBondContact O-CB 3.43Å; A12-L16 PolarHBondContact O-N 3.39Å
13	A	68.6	Low	57.2	Low	54 Å²	54	109.4 Å²	109.4	45%	0.446	63%	0.626	S	S	.	*	H	α-helix	trans	-66.3	-39.5	174.7	0	0	0	0	0	112.3	S9 S10 C11 L16 M17	S9-A13 WeakPolarHBondContact O-CB 3.41Å; S9-A13 PolarHBondContact O-N 3.43Å; S9-A13 VanDerWaalsContact O-N 3.15Å; S10-A13 PolarHBondContact O-N 2.97Å; C11-A13 VanDerWaalsContact C-N 3.35Å; A13-L16 PolarHBondContact O-N 3.15Å; A13-M17 WeakPolarHBondContact O-CB 3.5Å; A13-M17 VanDerWaalsContact O-CG 3.25Å; A13-M17 WeakPolarHBondContact O-CG 3.11Å; A13-M17 PolarHBondContact O-N 2.68Å
14	L	66.5	Low	57.8	Low	114 Å²	114	114.3 Å²	114.3	60%	0.597	64%	0.635	S	S	*	*	H	α-helix	trans	-65.8	-41	176.8	-141.9	95.8	0	0	0	111.9	S10 C11 M17 L18	S10-L14 WeakPolarHBondContact O-CB 3.16Å; S10-L14 PolarHBondContact O-N 3.33Å; C11-L14 PolarHBondContact O-N 3.37Å; L14-M17 PolarHBondContact O-N 3.44Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.11Å
15	M	67.6	Low	57.7	Low	125 Å²	125	113.1 Å²	113.1	62%	0.616	62%	0.624	S	S	*	*	H	α-helix	trans	-68.4	-38.9	176.6	-68.7	-68	-80.8	0	0	111.6	C11 A12 L18 M19	C11-M15 WeakPolarHBondContact O-CB 3.33Å; C11-M15 WeakPolarHBondContact O-CG 3.44Å; C11-M15 PolarHBondContact O-N 3.06Å; A12-M15 PolarHBondContact O-N 3.47Å; M15-L18 PolarHBondContact O-N 3.34Å; M15-L18 HydrophobicContact SD-CD1 4.46Å; M15-M19 VanDerWaalsContact O-CG 3.28Å; M15-M19 WeakPolarHBondContact O-CG 3.34Å; M15-M19 PolarHBondContact O-N 2.87Å
16	L	67.1	Low	57.5	Low	116 Å²	116	114 Å²	114	61%	0.607	63%	0.632	S	S	*	*	H	α-helix	trans	-62.7	-43.1	172.8	-122.4	92.2	0	0	0	111.5	A12 A13 M19 L20	A12-L16 WeakPolarHBondContact O-CB 3.43Å; A12-L16 PolarHBondContact O-N 3.39Å; A13-L16 PolarHBondContact O-N 3.15Å; L16-M19 PolarHBondContact O-N 3.32Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.21Å; L16-L20 PolarHBondContact O-N 2.97Å
17	M	65.6	Low	57.1	Low	115 Å²	115	113.7 Å²	113.7	57%	0.567	62%	0.621	S	S	*	*	H	α-helix	trans	-63.2	-41.3	177	-74.6	-71.3	-80.6	0	0	111.8	A13 L14 M19 L20 L21	A13-M17 WeakPolarHBondContact O-CB 3.5Å; A13-M17 VanDerWaalsContact O-CG 3.25Å; A13-M17 WeakPolarHBondContact O-CG 3.11Å; A13-M17 PolarHBondContact O-N 2.68Å; L14-M17 PolarHBondContact O-N 3.44Å; M17-M19 PolarHBondContact O-N 2.93Å; M17-L20 PolarHBondContact O-N 3.42Å; M17-L21 WeakPolarHBondContact O-CB 3.46Å; M17-L21 VanDerWaalsContact O-CD1 3.29Å; M17-L21 WeakPolarHBondContact O-CD1 3.44Å; M17-L21 VanDerWaalsContact O-CG 3.24Å; M17-L21 WeakPolarHBondContact O-CG 3.47Å; M17-L21 PolarHBondContact O-N 2.94Å
18	L	64.9	Low	56.9	Low	82 Å²	82	114.7 Å²	114.7	43%	0.429	63%	0.632	S	S	.	*	H	α-helix	trans	-64	-37.8	174.8	-79.6	159.9	0	0	0	112.5	L14 M15 N22	L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.11Å; M15-L18 PolarHBondContact O-N 3.34Å; M15-L18 HydrophobicContact SD-CD1 4.46Å; L18-N22 PolarHBondContact O-N 2.94Å; L18-N22 PolarHBondContact O-ND2 3.48Å
19	M	65.2	Low	56.4	Low	144 Å²	144	112 Å²	112	71%	0.709	63%	0.625	S	S	*	*	H	α-helix	trans	-70.7	-34.6	176.1	-66.5	-66.4	-91.5	0	0	112.1	M15 L16 M17 N22 W23	M15-M19 VanDerWaalsContact O-CG 3.28Å; M15-M19 WeakPolarHBondContact O-CG 3.34Å; M15-M19 PolarHBondContact O-N 2.87Å; L16-M19 PolarHBondContact O-N 3.32Å; M17-M19 PolarHBondContact O-N 2.93Å; M19-N22 PolarHBondContact O-N 3.39Å; M19-W23 PolarHBondContact O-N 3.02Å
20	L	63.1	Low	56	Low	117 Å²	117	113.3 Å²	113.3	61%	0.613	63%	0.631	S	S	*	*	H	α-helix	trans	-71.8	-35.5	174.8	-69.3	166.7	0	0	0	112.5	L16 M17 N22 W23	L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.21Å; L16-L20 PolarHBondContact O-N 2.97Å; M17-L20 PolarHBondContact O-N 3.42Å; L20-N22 VanDerWaalsContact C-N 3.29Å; L20-N22 PolarHBondContact O-N 2.95Å; L20-W23 PolarHBondContact O-N 3.19Å
21	L	59.3	Low	55.4	Low	123 Å²	123	113.2 Å²	113.2	64%	0.644	62%	0.624	S	S	*	*	H	α-helix	trans	-69.4	-26.1	175.7	-76.7	157.6	0	0	0	112.8	M17	M17-L21 WeakPolarHBondContact O-CB 3.46Å; M17-L21 VanDerWaalsContact O-CD1 3.29Å; M17-L21 WeakPolarHBondContact O-CD1 3.44Å; M17-L21 VanDerWaalsContact O-CG 3.24Å; M17-L21 WeakPolarHBondContact O-CG 3.47Å; M17-L21 PolarHBondContact O-N 2.94Å
22	N	52.7	Low	54.5	Low	120 Å²	120	114.5 Å²	114.5	64%	0.642	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	5.8	176.4	-70.9	-55.8	0	0	0	113.9	L18 M19 L20 R24	L18-N22 PolarHBondContact O-N 2.94Å; L18-N22 PolarHBondContact O-ND2 3.48Å; M19-N22 PolarHBondContact O-N 3.39Å; L20-N22 VanDerWaalsContact C-N 3.29Å; L20-N22 PolarHBondContact O-N 2.95Å; N22-R24 PolarHBondContact O-N 2.95Å
23	W	45.4	Very low	53.6	Low	202 Å²	202	115.9 Å²	115.9	77%	0.765	63%	0.63	S	S	*	*			trans	-73.1	34.8	167.3	-163.8	-86.7	0	0	0	112.1	M19 L20 T25	M19-W23 PolarHBondContact O-N 3.02Å; L20-W23 PolarHBondContact O-N 3.19Å; W23-T25 PolarHBondContact O-N 2.92Å
24	R	49.1	Very low	52.6	Low	225 Å²	225	116.4 Å²	116.4	85%	0.849	63%	0.629	S	S	*	*			trans	-72	84.5	159.5	-68.2	-86.5	179.7	153.1	-0.8	105.1	N22 S26	N22-R24 PolarHBondContact O-N 2.95Å; R24-S26 PolarHBondContact O-N 3.42Å
25	T	43.8	Very low	51.7	Low	80 Å²	80	117 Å²	117	49%	0.491	64%	0.64	S	S	.	*			trans	-51.8	111.9	159.2	53.7	0	0	0	0	105.2	W23 T27	W23-T25 PolarHBondContact O-N 2.92Å; T25-T27 PolarHBondContact O-N 3.41Å; T25-T27 WeakPolarHBondContact OG1-CG2 3.25Å
26	S	43	Very low	51.1	Low	125 Å²	125	114.2 Å²	114.2	87%	0.874	63%	0.631	S	S	*	*			trans	-67.1	70	164.8	173.9	0	0	0	0	106.6	R24 G28	R24-S26 PolarHBondContact O-N 3.42Å; S26-G28 PolarHBondContact O-N 3.37Å; S26-G28 VanDerWaalsContact O-N 3.12Å
27	T	41.6	Very low	50.7	Low	85 Å²	85	112.4 Å²	112.4	52%	0.521	63%	0.628	S	S	.	*			trans	-70.5	105.4	167.8	46.3	0	0	0	0	104.9	T25 L29	T25-T27 PolarHBondContact O-N 3.41Å; T25-T27 WeakPolarHBondContact OG1-CG2 3.25Å; T27-L29 PolarHBondContact O-N 3.18Å
28	G	43.9	Very low	50.5	Low	77 Å²	77	110.8 Å²	110.8	79%	0.794	63%	0.633	S	S	*	*			trans	-62.7	83.3	157.6	0	0	0	0	0	107.3	S26	S26-G28 PolarHBondContact O-N 3.37Å; S26-G28 VanDerWaalsContact O-N 3.12Å
29	L	38.6	Very low	50.7	Low	130 Å²	130	112.3 Å²	112.3	68%	0.681	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-61.2	134.5	172	-87.1	141.8	0	0	0	107.2	T27 L31	T27-L29 PolarHBondContact O-N 3.18Å; L29-L31 PolarHBondContact O-N 3.09Å
30	P	45.5	Very low	51.1	Low	118 Å²	118	107.4 Å²	107.4	77%	0.766	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-56.8	119.7	167	23	-29.2	0	0	0	107.4
31	L	46.4	Very low	51.9	Low	75 Å²	75	103.9 Å²	103.9	39%	0.393	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-56.2	133.7	177	-73.4	166	0	0	0	108.5	L29 L33	L29-L31 PolarHBondContact O-N 3.09Å; L31-L33 PolarHBondContact O-N 2.9Å
32	P	40.2	Very low	53.3	Low	118 Å²	118	102.5 Å²	102.5	77%	0.766	60%	0.6	S	S	*	*			trans	-55.9	115.4	171.8	-20.7	31.3	0	0	0	108.9
33	L	47.8	Very low	55	Low	89 Å²	89	97.7 Å²	97.7	47%	0.466	58%	0.575	S	S	.	*			trans	-83.1	128	179.1	-76	155.5	0	0	0	108.9	L31	L31-L33 PolarHBondContact O-N 2.9Å
34	P	47.1	Very low	57.1	Low	65 Å²	65	88.7 Å²	88.7	42%	0.422	54%	0.544	S	S	.	.			trans	-55.5	153.1	155.1	-15.5	28.4	0	0	0	109.6	P36 S205	P34-P36 WeakPolarHBondContact O-CD 3.28Å; P34-S205 WeakPolarHBondContact CD-O 3.13Å
35	P	48	Very low	59.1	Low	127 Å²	127	80.9 Å²	80.9	83%	0.825	52%	0.523	S	S	*	.			trans	-55.3	112.8	175.1	21.3	-30.4	0	0	0	108.9
36	P	54	Low	61.6	Low	66 Å²	66	78.2 Å²	78.2	43%	0.429	51%	0.506	S	S	.	.			trans	-71.2	151.4	-176.9	-6.8	21.7	0	0	0	109	P34 S40 A41	P34-P36 WeakPolarHBondContact O-CD 3.28Å; P36-S40 WeakPolarHBondContact CA-OG 3.45Å; P36-S40 WeakPolarHBondContact CB-OG 3.49Å; P36-A41 HydrophobicContact CB-CB 4.05Å; P36-A41 HydrophobicContact CG-CB 4.15Å
37	S	59.2	Low	64.1	Low	78 Å²	78	72.8 Å²	72.8	55%	0.545	47%	0.467	S	S	.	.			trans	-56.6	148.8	159.8	69	0	0	0	0	109	N39 S40 A41	S37-N39 PolarHBondContact O-N 3.4Å; S37-S40 PolarHBondContact N-OG 3.45Å; S37-S40 PolarHBondContact O-N 2.93Å; S37-S40 PolarHBondContact O-OG 3.18Å; S37-S40 PolarHBondContact OG-N 2.88Å; S37-S40 PolarHBondContact OG-OG 3.27Å; S37-S40 VanDerWaalsContact OG-OG 3.09Å; S37-A41 PolarHBondContact O-N 2.91Å; S37-A41 VanDerWaalsContact O-N 3.09Å
38	A	60.8	Low	66.6	Low	81 Å²	81	74.3 Å²	74.3	67%	0.669	46%	0.463	S	S	*	.	H	α-helix	trans	-50.5	-38.7	-177.6	0	0	0	0	0	112.6	A41 Q42	A38-A41 PolarHBondContact O-N 2.83Å; A38-Q42 PolarHBondContact O-N 2.96Å; A38-Q42 VanDerWaalsContact O-N 3.07Å
39	N	69.9	Low	69.2	Low	113 Å²	113	72.4 Å²	72.4	60%	0.604	44%	0.438	S	S	*	.	H	α-helix	trans	-66.2	-42.4	177	-64.2	-2.2	0	0	0	112.4	S37 A41 Q42 C43	S37-N39 PolarHBondContact O-N 3.4Å; N39-A41 PolarHBondContact O-N 3.35Å; N39-Q42 PolarHBondContact O-N 3Å; N39-C43 WeakPolarHBondContact O-CB 3.3Å; N39-C43 PolarHBondContact O-N 3.36Å; N39-C43 PolarHBondContact O-SG 3.46Å
40	S	74.1	Confident	72	Confident	42 Å²	42	66.2 Å²	66.2	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-67.4	-35.3	178.2	63	0	0	0	0	113	P36 S37 C43 A44	P36-S40 WeakPolarHBondContact CA-OG 3.45Å; P36-S40 WeakPolarHBondContact CB-OG 3.49Å; S37-S40 PolarHBondContact N-OG 3.45Å; S37-S40 PolarHBondContact O-N 2.93Å; S37-S40 PolarHBondContact O-OG 3.18Å; S37-S40 PolarHBondContact OG-N 2.88Å; S37-S40 PolarHBondContact OG-OG 3.27Å; S37-S40 VanDerWaalsContact OG-OG 3.09Å; S40-C43 PolarHBondContact O-N 3.39Å; S40-A44 WeakPolarHBondContact O-CB 3.44Å; S40-A44 PolarHBondContact O-N 3.47Å
41	A	80.4	Confident	74.5	Confident	43 Å²	43	62.6 Å²	62.6	36%	0.355	38%	0.379	S	S	.	.	H	α-helix	trans	-66.8	-42	173.3	0	0	0	0	0	112.1	P36 S37 A38 N39 A44 S45	P36-A41 HydrophobicContact CB-CB 4.05Å; P36-A41 HydrophobicContact CG-CB 4.15Å; S37-A41 PolarHBondContact O-N 2.91Å; S37-A41 VanDerWaalsContact O-N 3.09Å; A38-A41 PolarHBondContact O-N 2.83Å; N39-A41 PolarHBondContact O-N 3.35Å; A41-A44 PolarHBondContact O-N 2.8Å; A41-S45 PolarHBondContact O-N 2.77Å
42	Q	87.3	Confident	76.9	Confident	94 Å²	94	65.8 Å²	65.8	44%	0.439	39%	0.386	S	S	.	.	H	α-helix	trans	-60.7	-46.1	175.2	-177.6	179.7	3.1	0	0	111.3	A38 N39 S45 L46	A38-Q42 PolarHBondContact O-N 2.96Å; A38-Q42 VanDerWaalsContact O-N 3.07Å; N39-Q42 PolarHBondContact O-N 3Å; Q42-S45 VanDerWaalsContact O-CB 3.32Å; Q42-S45 WeakPolarHBondContact O-CB 3.29Å; Q42-S45 PolarHBondContact O-N 3.38Å; Q42-S45 VanDerWaalsContact O-N 3.17Å; Q42-L46 HydrophobicContact CG-CD1 4.43Å; Q42-L46 PolarHBondContact O-N 3.28Å
43	C	88.9	Confident	79.7	Confident	18 Å²	18	61.3 Å²	61.3	12%	0.122	36%	0.357	C	S	.	.	H	α-helix	trans	-64.3	-44	178.3	-70	0	0	0	0	112.9	N39 S40 S45 L46 F47 C154	N39-C43 WeakPolarHBondContact O-CB 3.3Å; N39-C43 PolarHBondContact O-N 3.36Å; N39-C43 PolarHBondContact O-SG 3.46Å; S40-C43 PolarHBondContact O-N 3.39Å; C43-S45 PolarHBondContact O-N 2.97Å; C43-L46 PolarHBondContact O-N 2.89Å; C43-L46 VanDerWaalsContact O-N 3.16Å; C43-F47 HydrophobicContact CB-CE2 4.49Å; C43-F47 WeakPolarHBondContact O-CD2 3.42Å; C43-F47 PolarHBondContact O-N 3.32Å; C43-C154 WeakPolarHBondContact CA-SG 3.45Å; C43-C154 HydrophobicContact CB-CB 3.82Å; C43-C154 WeakPolarHBondContact CB-SG 3.42Å; C43-C154 WeakPolarHBondContact SG-CA 3.01Å; C43-C154 WeakPolarHBondContact SG-CB 3.38Å; C43-C154 CovalentContact SG-SG 2.03Å; C43-C154 PolarHBondContact SG-SG 3.04Å
44	A	89.4	Confident	82	Confident	14 Å²	14	57 Å²	57	12%	0.116	34%	0.335	C	S	.	.	H	α-helix	trans	-58.1	-37.6	173.3	0	0	0	0	0	112.1	S40 A41 R48 V201	S40-A44 WeakPolarHBondContact O-CB 3.44Å; S40-A44 PolarHBondContact O-N 3.47Å; A41-A44 PolarHBondContact O-N 2.8Å; A44-R48 WeakPolarHBondContact O-CG 3.46Å; A44-R48 PolarHBondContact O-N 3.5Å; A44-V201 HydrophobicContact CB-CG1 4.49Å
45	S	92.4	Very high	84.2	Confident	60 Å²	60	55.6 Å²	55.6	42%	0.42	33%	0.325	S	S	.	.	H	α-helix	trans	-64	-48.3	174	-170.6	0	0	0	0	112	A41 Q42 C43 F47 R48 S49	A41-S45 PolarHBondContact O-N 2.77Å; Q42-S45 VanDerWaalsContact O-CB 3.32Å; Q42-S45 WeakPolarHBondContact O-CB 3.29Å; Q42-S45 PolarHBondContact O-N 3.38Å; Q42-S45 VanDerWaalsContact O-N 3.17Å; C43-S45 PolarHBondContact O-N 2.97Å; S45-F47 VanDerWaalsContact C-N 3.35Å; S45-F47 PolarHBondContact O-N 3.5Å; S45-R48 WeakPolarHBondContact O-CB 3.44Å; S45-R48 PolarHBondContact O-N 2.79Å; S45-R48 VanDerWaalsContact O-N 3.16Å; S45-S49 PolarHBondContact O-N 3.28Å; S45-S49 PolarHBondContact O-OG 3.3Å
46	L	95.1	Very high	86.4	Confident	25 Å²	25	53.7 Å²	53.7	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-40.6	178.6	-73.1	172.2	0	0	0	112.4	Q42 C43 R48 S49 L50 V146 D149 L150 N153	Q42-L46 HydrophobicContact CG-CD1 4.43Å; Q42-L46 PolarHBondContact O-N 3.28Å; C43-L46 PolarHBondContact O-N 2.89Å; C43-L46 VanDerWaalsContact O-N 3.16Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 3.21Å; L46-S49 WeakPolarHBondContact O-CB 3.45Å; L46-S49 PolarHBondContact O-N 3.19Å; L46-L50 PolarHBondContact O-N 3.18Å; L46-V146 WeakPolarHBondContact O-CG1 3.25Å; L46-D149 HydrophobicContact CD1-CB 4.28Å; L46-D149 HydrophobicContact CD2-CB 4Å; L46-L150 HydrophobicContact CB-CD2 3.38Å; L46-L150 HydrophobicContact CB-CG 3.81Å; L46-L150 HydrophobicContact CD1-CD2 4.34Å; L46-L150 HydrophobicContact CG-CD2 4.5Å; L46-N153 HydrophobicContact CD1-CB 4.41Å
47	F	94.9	Very high	88.3	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.048	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-35.6	175.8	-77.6	-64.7	0	0	0	112.8	C43 S45 L50 L51 I111 M112 L115 L150 I197 N198 V201	C43-F47 HydrophobicContact CB-CE2 4.49Å; C43-F47 WeakPolarHBondContact O-CD2 3.42Å; C43-F47 PolarHBondContact O-N 3.32Å; S45-F47 VanDerWaalsContact C-N 3.35Å; S45-F47 PolarHBondContact O-N 3.5Å; F47-L50 WeakPolarHBondContact O-CB 3.42Å; F47-L50 PolarHBondContact O-N 3.47Å; F47-L51 PolarHBondContact O-N 2.81Å; F47-I111 HydrophobicContact CE1-CG2 3.85Å; F47-I111 HydrophobicContact CZ-CG2 4.03Å; F47-M112 HydrophobicContact CZ-CE 4Å; F47-L115 HydrophobicContact CE1-CD1 4.13Å; F47-L150 HydrophobicContact CD1-CD1 3.82Å; F47-L150 HydrophobicContact CD1-CD2 3.72Å; F47-L150 HydrophobicContact CD1-CG 4.45Å; F47-L150 HydrophobicContact CD2-CD2 3.79Å; F47-L150 HydrophobicContact CE1-CD1 3.99Å; F47-L150 HydrophobicContact CE1-CD2 3.74Å; F47-L150 HydrophobicContact CE1-CG 4.44Å; F47-L150 HydrophobicContact CE2-CD2 3.79Å; F47-L150 HydrophobicContact CG-CD1 4.49Å; F47-L150 HydrophobicContact CG-CD2 3.76Å; F47-L150 HydrophobicContact CZ-CD2 3.78Å; F47-I197 HydrophobicContact CD1-CG2 3.31Å; F47-I197 HydrophobicContact CE1-CG2 3.42Å; F47-I197 VanDerWaalsContact CE1-CG2 3.42Å; F47-I197 HydrophobicContact CG-CG2 4.14Å; F47-I197 HydrophobicContact CZ-CG2 4.34Å; F47-N198 PolarHBondContact O-ND2 2.95Å; F47-N198 PolarHBondContact O-OD1 2.88Å; F47-V201 HydrophobicContact CD1-CG2 4.48Å; F47-V201 HydrophobicContact CD2-CB 4.33Å; F47-V201 HydrophobicContact CD2-CG1 3.94Å; F47-V201 HydrophobicContact CD2-CG2 3.65Å; F47-V201 HydrophobicContact CE2-CG1 4.46Å; F47-V201 HydrophobicContact CE2-CG2 3.69Å; F47-V201 HydrophobicContact CG-CG2 4.07Å; F47-V201 HydrophobicContact CZ-CG2 4.13Å
48	R	95.8	Very high	89.8	Confident	117 Å²	117	49 Å²	49	44%	0.442	27%	0.273	S	S	.	.	H	α-helix	trans	-67.5	-41.1	172.2	-69.2	171.9	-172.1	137.2	-0.5	111.3	A44 S45 L46 L50 L51 R52 N198	A44-R48 WeakPolarHBondContact O-CG 3.46Å; A44-R48 PolarHBondContact O-N 3.5Å; S45-R48 WeakPolarHBondContact O-CB 3.44Å; S45-R48 PolarHBondContact O-N 2.79Å; S45-R48 VanDerWaalsContact O-N 3.16Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 3.21Å; R48-L50 VanDerWaalsContact C-N 3.28Å; R48-L50 PolarHBondContact O-N 3.05Å; R48-L51 PolarHBondContact O-N 3.1Å; R48-R52 WeakPolarHBondContact O-CG 3.46Å; R48-R52 PolarHBondContact O-N 3.47Å; R48-R52 VanDerWaalsContact O-N 3.1Å; R48-N198 WeakPolarHBondContact CA-OD1 3.21Å; R48-N198 PolarHBondContact N-OD1 2.89Å
49	S	97.6	Very high	91.2	Very high	37 Å²	37	52.4 Å²	52.4	26%	0.259	27%	0.273	S	S	.	.	H	α-helix	trans	-59.6	-41.1	174	-65.2	0	0	0	0	111.2	S45 L46 L51 R52 S53	S45-S49 PolarHBondContact O-N 3.28Å; S45-S49 PolarHBondContact O-OG 3.3Å; L46-S49 WeakPolarHBondContact O-CB 3.45Å; L46-S49 PolarHBondContact O-N 3.19Å; S49-L51 PolarHBondContact O-N 2.05Å; S49-R52 PolarHBondContact O-N 2.79Å; S49-S53 PolarHBondContact O-N 3.19Å; S49-S53 PolarHBondContact O-OG 3.27Å; S49-S53 VanDerWaalsContact O-OG 3.1Å
50	L	97.8	Very high	92.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.5	-49	176.5	-179.4	66.3	0	0	0	111.7	L46 F47 R48 R52 S53 V54 L115 T143 V146 I147 L150 F190	L46-L50 PolarHBondContact O-N 3.18Å; F47-L50 WeakPolarHBondContact O-CB 3.42Å; F47-L50 PolarHBondContact O-N 3.47Å; R48-L50 VanDerWaalsContact C-N 3.28Å; R48-L50 PolarHBondContact O-N 3.05Å; L50-R52 VanDerWaalsContact C-N 3.29Å; L50-R52 PolarHBondContact O-N 3.49Å; L50-S53 PolarHBondContact O-N 3.09Å; L50-V54 HydrophobicContact CD1-CG2 4.15Å; L50-V54 HydrophobicContact CG-CG2 4.41Å; L50-V54 WeakPolarHBondContact O-CB 3.41Å; L50-V54 VanDerWaalsContact O-CG2 3.28Å; L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.27Å; L50-L115 HydrophobicContact CD2-CD2 3.62Å; L50-T143 HydrophobicContact CD1-CG2 4.26Å; L50-V146 HydrophobicContact CB-CG1 3.78Å; L50-V146 HydrophobicContact CD1-CG1 4.2Å; L50-I147 HydrophobicContact CD1-CG1 3.69Å; L50-L150 HydrophobicContact CB-CD1 3.98Å; L50-L150 HydrophobicContact CD2-CD1 3.77Å; L50-L150 HydrophobicContact CG-CD1 4.33Å; L50-F190 HydrophobicContact CD1-CE1 3.91Å; L50-F190 HydrophobicContact CD1-CZ 3.67Å; L50-F190 HydrophobicContact CD2-CE2 4.16Å; L50-F190 HydrophobicContact CD2-CZ 3.83Å; L50-F190 HydrophobicContact CG-CZ 4.07Å
51	L	97.8	Very high	92.6	Very high	42 Å²	42	52 Å²	52	22%	0.22	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-41.6	178.3	177	59.5	0	0	0	111.5	F47 R48 S49 T55 A194 I195	F47-L51 PolarHBondContact O-N 2.81Å; R48-L51 PolarHBondContact O-N 3.1Å; S49-L51 PolarHBondContact O-N 2.05Å; L51-T55 WeakPolarHBondContact O-CB 3.26Å; L51-T55 PolarHBondContact O-N 3.12Å; L51-T55 PolarHBondContact O-OG1 3.32Å; L51-A194 HydrophobicContact CB-CB 4.45Å; L51-A194 HydrophobicContact CD1-CB 4Å; L51-I195 HydrophobicContact CD1-CG1 3.68Å
52	R	97.5	Very high	92.9	Very high	142 Å²	142	51.6 Å²	51.6	54%	0.536	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-52.4	176	-67.7	-175.8	-165.7	102	-4	111.5	R48 S49 L50 V54 T55 D56	R48-R52 WeakPolarHBondContact O-CG 3.46Å; R48-R52 PolarHBondContact O-N 3.47Å; R48-R52 VanDerWaalsContact O-N 3.1Å; S49-R52 PolarHBondContact O-N 2.79Å; L50-R52 VanDerWaalsContact C-N 3.29Å; L50-R52 PolarHBondContact O-N 3.49Å; R52-V54 VanDerWaalsContact C-N 3.33Å; R52-V54 PolarHBondContact O-N 3.48Å; R52-T55 WeakPolarHBondContact O-CA 3.48Å; R52-T55 WeakPolarHBondContact O-CB 3.29Å; R52-T55 PolarHBondContact O-N 2.99Å; R52-D56 VanDerWaalsContact O-CG 3.31Å; R52-D56 PolarHBondContact O-N 3.5Å
53	S	97.2	Very high	92.9	Very high	23 Å²	23	47.1 Å²	47.1	16%	0.161	24%	0.236	C	C	.	.	H	α-helix	trans	-57.3	-44.8	-179.5	-59.2	0	0	0	0	112.2	S49 L50 T55 D56 V57 T143	S49-S53 PolarHBondContact O-N 3.19Å; S49-S53 PolarHBondContact O-OG 3.27Å; S49-S53 VanDerWaalsContact O-OG 3.1Å; L50-S53 PolarHBondContact O-N 3.09Å; S53-T55 VanDerWaalsContact C-N 3.33Å; S53-T55 PolarHBondContact O-N 3.34Å; S53-D56 PolarHBondContact O-N 2.88Å; S53-V57 WeakPolarHBondContact O-CG2 3.24Å; S53-V57 PolarHBondContact O-N 3.37Å; S53-T143 WeakPolarHBondContact CB-OG1 3.21Å
54	V	96.2	Very high	92.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-38.5	176.2	173.9	0	0	0	0	111.7	L50 R52 D56 V57 L58 T143 M187 F190 H191	L50-V54 HydrophobicContact CD1-CG2 4.15Å; L50-V54 HydrophobicContact CG-CG2 4.41Å; L50-V54 WeakPolarHBondContact O-CB 3.41Å; L50-V54 VanDerWaalsContact O-CG2 3.28Å; L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.27Å; R52-V54 VanDerWaalsContact C-N 3.33Å; R52-V54 PolarHBondContact O-N 3.48Å; V54-D56 VanDerWaalsContact C-N 3.34Å; V54-V57 PolarHBondContact O-N 3.41Å; V54-L58 PolarHBondContact O-N 3.45Å; V54-T143 HydrophobicContact CG2-CG2 3.8Å; V54-M187 HydrophobicContact CB-CE 4.37Å; V54-M187 HydrophobicContact CG1-CE 4.01Å; V54-M187 HydrophobicContact CG2-CE 4.06Å; V54-F190 HydrophobicContact CG1-CB 4.39Å; V54-F190 HydrophobicContact CG1-CD1 4.32Å; V54-F190 HydrophobicContact CG2-CD1 3.44Å; V54-F190 VanDerWaalsContact CG2-CD1 3.44Å; V54-F190 HydrophobicContact CG2-CE1 3.49Å; V54-F190 VanDerWaalsContact CG2-CE1 3.49Å; V54-F190 HydrophobicContact CG2-CG 4.17Å; V54-F190 HydrophobicContact CG2-CZ 4.3Å; V54-H191 HydrophobicContact CG1-CB 3.66Å
55	T	95.1	Very high	92	Very high	34 Å²	34	51 Å²	51	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-41.3	175.9	-57.6	0	0	0	0	111.4	L51 R52 S53 L58 K59 H191	L51-T55 WeakPolarHBondContact O-CB 3.26Å; L51-T55 PolarHBondContact O-N 3.12Å; L51-T55 PolarHBondContact O-OG1 3.32Å; R52-T55 WeakPolarHBondContact O-CA 3.48Å; R52-T55 WeakPolarHBondContact O-CB 3.29Å; R52-T55 PolarHBondContact O-N 2.99Å; S53-T55 VanDerWaalsContact C-N 3.33Å; S53-T55 PolarHBondContact O-N 3.34Å; T55-L58 PolarHBondContact O-N 3.23Å; T55-K59 HydrophobicContact CG2-CD 4.37Å; T55-K59 WeakPolarHBondContact O-CG 3.44Å; T55-K59 PolarHBondContact O-N 3.16Å; T55-H191 PolarHBondContact OG1-CE1 3.16Å; T55-H191 PolarHBondContact OG1-ND1 2.96Å
56	D	93.9	Very high	90.7	Very high	87 Å²	87	52.7 Å²	52.7	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-67.8	-37.2	-180	-65.1	-23.4	0	0	0	111.5	R52 S53 V54 L58 K59 S60	R52-D56 VanDerWaalsContact O-CG 3.31Å; R52-D56 PolarHBondContact O-N 3.5Å; S53-D56 PolarHBondContact O-N 2.88Å; V54-D56 VanDerWaalsContact C-N 3.34Å; D56-L58 VanDerWaalsContact C-N 3.3Å; D56-L58 PolarHBondContact O-N 3.47Å; D56-K59 PolarHBondContact O-N 2.44Å; D56-K59 IonicContact OD1-NZ 3.39Å; D56-S60 PolarHBondContact O-N 2.73Å
57	V	93.4	Very high	89.3	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-44.5	170.1	173.8	0	0	0	0	111.4	S53 V54 S60 L63 L139 L140 M187	S53-V57 WeakPolarHBondContact O-CG2 3.24Å; S53-V57 PolarHBondContact O-N 3.37Å; V54-V57 PolarHBondContact O-N 3.41Å; V57-S60 WeakPolarHBondContact O-CB 3.48Å; V57-S60 PolarHBondContact O-N 3.22Å; V57-L63 HydrophobicContact CG1-CD2 3.31Å; V57-L139 HydrophobicContact CB-CG 4.45Å; V57-L139 HydrophobicContact CG1-CD2 4.25Å; V57-L139 HydrophobicContact CG1-CG 4.39Å; V57-L139 HydrophobicContact CG2-CD1 4.46Å; V57-L139 HydrophobicContact CG2-CG 4.13Å; V57-L139 WeakPolarHBondContact CG2-O 3.37Å; V57-L140 HydrophobicContact CG1-CD2 3.95Å; V57-L140 HydrophobicContact CG2-CD2 4.19Å; V57-M187 HydrophobicContact CB-CE 4.17Å; V57-M187 HydrophobicContact CG1-CB 4.26Å; V57-M187 HydrophobicContact CG1-CE 3.97Å; V57-M187 HydrophobicContact CG1-CG 3.92Å; V57-M187 HydrophobicContact CG2-CE 4.25Å
58	L	91.5	Very high	87.5	Confident	45 Å²	45	57 Å²	57	24%	0.236	28%	0.284	C	S	.	.	H	α-helix	trans	-72.5	-26.1	-178.8	-70.6	-175	0	0	0	114.2	V54 T55 D56 S60 M187 R188 H191	V54-L58 PolarHBondContact O-N 3.45Å; T55-L58 PolarHBondContact O-N 3.23Å; D56-L58 VanDerWaalsContact C-N 3.3Å; D56-L58 PolarHBondContact O-N 3.47Å; L58-S60 VanDerWaalsContact C-N 3.31Å; L58-M187 HydrophobicContact CD2-CB 3.88Å; L58-R188 HydrophobicContact CD2-CG 3.73Å; L58-H191 HydrophobicContact CD1-CB 3.39Å
59	K	90.1	Very high	86	Confident	153 Å²	153	61.5 Å²	61.5	67%	0.665	31%	0.306	S	S	*	.	H	α-helix	trans	-75.9	-22.5	173.7	-72.6	172.3	179.8	167.7	0	112.6	T55 D56	T55-K59 HydrophobicContact CG2-CD 4.37Å; T55-K59 WeakPolarHBondContact O-CG 3.44Å; T55-K59 PolarHBondContact O-N 3.16Å; D56-K59 PolarHBondContact O-N 2.44Å; D56-K59 IonicContact OD1-NZ 3.39Å
60	S	87.3	Confident	84.4	Confident	25 Å²	25	60.8 Å²	60.8	18%	0.175	30%	0.301	C	S	.	.			trans	-71.1	137.3	-176.8	176.3	0	0	0	0	112.5	D56 V57 L58 D62 L139	D56-S60 PolarHBondContact O-N 2.73Å; V57-S60 WeakPolarHBondContact O-CB 3.48Å; V57-S60 PolarHBondContact O-N 3.22Å; L58-S60 VanDerWaalsContact C-N 3.31Å; S60-D62 VanDerWaalsContact C-N 3.25Å; S60-D62 PolarHBondContact O-N 3.3Å; S60-D62 PolarHBondContact OG-N 2.96Å; S60-D62 VanDerWaalsContact OG-N 3.1Å; S60-L139 WeakPolarHBondContact OG-CD2 3.25Å
61	E	84.6	Confident	82.9	Confident	120 Å²	120	66 Å²	66	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-74.8	-19.5	173.6	-59.4	-171.5	166.2	0	0	113.3	L63 F65 R180	E61-L63 VanDerWaalsContact C-N 3.34Å; E61-L63 PolarHBondContact O-N 3.08Å; E61-F65 HydrophobicContact CB-CB 3.54Å; E61-F65 HydrophobicContact CB-CD1 4.34Å; E61-F65 HydrophobicContact CB-CD2 4.23Å; E61-F65 HydrophobicContact CB-CG 3.85Å; E61-F65 HydrophobicContact CG-CB 3.88Å; E61-F65 HydrophobicContact CG-CD2 3.69Å; E61-F65 HydrophobicContact CG-CE2 4.28Å; E61-F65 HydrophobicContact CG-CG 3.85Å; E61-F65 VanDerWaalsContact O-CB 3.3Å; E61-F65 WeakPolarHBondContact O-CB 3.46Å; E61-F65 WeakPolarHBondContact OE1-CE2 3.1Å; E61-R180 PolarHBondContact O-NH2 3.39Å
62	D	86.9	Confident	81.9	Confident	35 Å²	35	69.5 Å²	69.5	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-77.9	-20.3	-173	-69.7	-58.7	0	0	0	112.9	S60 K132 K135 R180	S60-D62 VanDerWaalsContact C-N 3.25Å; S60-D62 PolarHBondContact O-N 3.3Å; S60-D62 PolarHBondContact OG-N 2.96Å; S60-D62 VanDerWaalsContact OG-N 3.1Å; D62-K132 IonicContact OD1-NZ 2.69Å; D62-K135 HydrophobicContact CB-CB 4.15Å; D62-K135 HydrophobicContact CB-CD 4.1Å; D62-K135 WeakPolarHBondContact OD1-CD 3.44Å; D62-K135 IonicContact OD1-NZ 3.88Å; D62-K135 PolarHBondContact OD1-NZ 2.79Å; D62-K135 VanDerWaalsContact OD2-CD 3.25Å; D62-K135 WeakPolarHBondContact OD2-CD 3.47Å; D62-K135 IonicContact OD2-NZ 3.6Å; D62-K135 PolarHBondContact OD2-NZ 3.01Å; D62-R180 VanDerWaalsContact C-NH2 3.28Å; D62-R180 VanDerWaalsContact O-CZ 3.28Å; D62-R180 PolarHBondContact O-NE 2.65Å; D62-R180 PolarHBondContact O-NH2 3.2Å
63	L	87.7	Confident	81	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-107.8	-43.1	174.8	-166.7	74.3	0	0	0	114.2	V57 E61 L67 Y125 L139 L140 R180 M183 M187	V57-L63 HydrophobicContact CG1-CD2 3.31Å; E61-L63 VanDerWaalsContact C-N 3.34Å; E61-L63 PolarHBondContact O-N 3.08Å; L63-L67 VanDerWaalsContact O-CD1 3.29Å; L63-L67 WeakPolarHBondContact O-CD1 3.3Å; L63-Y125 HydrophobicContact CD1-CE1 4.37Å; L63-L139 HydrophobicContact CB-CD2 3.61Å; L63-L140 HydrophobicContact CD1-CD1 4.42Å; L63-L140 HydrophobicContact CD2-CD2 4.11Å; L63-R180 HydrophobicContact CD1-CG 4.33Å; L63-R180 PolarHBondContact O-NE 3.32Å; L63-M183 HydrophobicContact CD1-CB 4.48Å; L63-M183 HydrophobicContact CD1-CG 4Å; L63-M183 HydrophobicContact CD2-CG 4.16Å; L63-M187 HydrophobicContact CD2-CG 3.89Å
64	C	83.9	Confident	80.2	Confident	6 Å²	6	68.3 Å²	68.3	4%	0.041	36%	0.356	C	S	.	.	H	α-helix	trans	-117.5	-10	-166.4	-85.2	0	0	0	0	116.1	L67 C184	C64-L67 PolarHBondContact O-N 2.84Å; C64-C184 WeakPolarHBondContact CA-SG 3.04Å; C64-C184 HydrophobicContact CB-CB 4.18Å; C64-C184 WeakPolarHBondContact CB-SG 3.43Å; C64-C184 WeakPolarHBondContact SG-CA 3.43Å; C64-C184 WeakPolarHBondContact SG-CB 3.37Å; C64-C184 CovalentContact SG-SG 2.05Å; C64-C184 PolarHBondContact SG-SG 3.46Å
65	F	74.6	Confident	79.6	Confident	109 Å²	109	71.2 Å²	71.2	48%	0.478	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	147.6	179.1	-178.6	-95.1	0	0	0	111.6	E61 L67	E61-F65 HydrophobicContact CB-CB 3.54Å; E61-F65 HydrophobicContact CB-CD1 4.34Å; E61-F65 HydrophobicContact CB-CD2 4.23Å; E61-F65 HydrophobicContact CB-CG 3.85Å; E61-F65 HydrophobicContact CG-CB 3.88Å; E61-F65 HydrophobicContact CG-CD2 3.69Å; E61-F65 HydrophobicContact CG-CE2 4.28Å; E61-F65 HydrophobicContact CG-CG 3.85Å; E61-F65 VanDerWaalsContact O-CB 3.3Å; E61-F65 WeakPolarHBondContact O-CB 3.46Å; E61-F65 WeakPolarHBondContact OE1-CE2 3.1Å; F65-L67 PolarHBondContact O-N 2.87Å
66	S	66.8	Low	79.1	Confident	94 Å²	94	71.1 Å²	71.1	66%	0.657	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	-5.7	-170.3	69.7	0	0	0	0	117.4	I68	S66-I68 PolarHBondContact O-N 2.89Å
67	L	65.8	Low	78.7	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.068	35%	0.353	C	S	.	.			trans	-86.2	16.2	177.1	-64.1	168.4	0	0	0	113.7	L63 C64 F65 K69 F177 R180 Q181 C184	L63-L67 VanDerWaalsContact O-CD1 3.29Å; L63-L67 WeakPolarHBondContact O-CD1 3.3Å; C64-L67 PolarHBondContact O-N 2.84Å; F65-L67 PolarHBondContact O-N 2.87Å; L67-K69 VanDerWaalsContact C-N 3.26Å; L67-K69 PolarHBondContact O-N 2.89Å; L67-F177 HydrophobicContact CD2-CE1 4.48Å; L67-F177 HydrophobicContact CD2-CE2 3.74Å; L67-F177 HydrophobicContact CD2-CZ 3.65Å; L67-R180 HydrophobicContact CD1-CG 4.11Å; L67-Q181 HydrophobicContact CD1-CB 4.45Å; L67-Q181 HydrophobicContact CD2-CB 4.02Å; L67-Q181 HydrophobicContact CD2-CG 4.09Å; L67-C184 HydrophobicContact CD1-CB 4.19Å
68	I	56.7	Low	78.3	Confident	115 Å²	115	71.6 Å²	71.6	59%	0.59	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	36.5	-162.6	-46	171	0	0	0	114	S66	S66-I68 PolarHBondContact O-N 2.89Å
69	K	63.8	Low	78.2	Confident	211 Å²	211	73.7 Å²	73.7	92%	0.917	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-8.9	174.2	-70.5	-170	-179.6	-178.2	0	114.8	L67	L67-K69 VanDerWaalsContact C-N 3.26Å; L67-K69 PolarHBondContact O-N 2.89Å
70	S	63.1	Low	78.2	Confident	21 Å²	21	66.5 Å²	66.5	15%	0.147	35%	0.354	C	S	.	.			trans	-105.2	125	-177.9	-167.5	0	0	0	0	111.6	E72 K185 R188	S70-E72 VanDerWaalsContact C-N 3.26Å; S70-E72 WeakPolarHBondContact OG-CB 3.37Å; S70-E72 PolarHBondContact OG-N 3.27Å; S70-K185 VanDerWaalsContact CB-CE 3.49Å; S70-K185 WeakPolarHBondContact OG-CE 3.29Å; S70-K185 PolarHBondContact OG-NZ 3.19Å; S70-R188 PolarHBondContact O-NH1 3.04Å
71	S	67.8	Low	78.4	Confident	110 Å²	110	68.3 Å²	68.3	77%	0.769	36%	0.364	S	S	*	.			trans	-82.2	-4.1	168.1	50.4	0	0	0	0	112.6	M73	S71-M73 PolarHBondContact O-N 3.4Å
72	E	76.2	Confident	78.6	Confident	116 Å²	116	68 Å²	68	54%	0.542	36%	0.358	S	S	.	.			trans	-68.8	128.7	179.8	-67.1	170.6	-168.9	0	0	110.9	S70 K185	S70-E72 VanDerWaalsContact C-N 3.26Å; S70-E72 WeakPolarHBondContact OG-CB 3.37Å; S70-E72 PolarHBondContact OG-N 3.27Å; E72-K185 HydrophobicContact CB-CD 4.19Å; E72-K185 IonicContact OE2-NZ 3.71Å; E72-K185 PolarHBondContact OE2-NZ 3.15Å
73	M	78.3	Confident	78.7	Confident	88 Å²	88	66.9 Å²	66.9	43%	0.433	35%	0.353	S	S	.	.			trans	-130.1	78.6	177.3	-63.3	-174.5	-168.7	0	0	107.5	S71 M75 R188 V192	S71-M73 PolarHBondContact O-N 3.4Å; M73-M75 PolarHBondContact O-N 3.41Å; M73-R188 HydrophobicContact CE-CB 4.33Å; M73-R188 HydrophobicContact CG-CB 3.82Å; M73-R188 HydrophobicContact SD-CB 4.09Å; M73-V192 HydrophobicContact SD-CG2 4.1Å
74	P	81.7	Confident	78.8	Confident	51 Å²	51	67.3 Å²	67.3	33%	0.331	36%	0.356	S	S	.	.			trans	-59.7	130.5	179.2	26	-33.1	0	0	0	109.2	K185 M186	P74-K185 HydrophobicContact CG-CB 4.15Å; P74-M186 HydrophobicContact CG-CG 3.96Å
75	M	82.1	Confident	78.9	Confident	61 Å²	61	68.7 Å²	68.7	30%	0.3	36%	0.364	S	S	.	.			trans	-124.6	155.9	174.5	-59.4	-178.9	128.4	0	0	108	M73 G189 V192 R193	M73-M75 PolarHBondContact O-N 3.41Å; M75-G189 WeakPolarHBondContact CE-O 3.44Å; M75-V192 HydrophobicContact CE-CB 3.68Å; M75-V192 HydrophobicContact CE-CG1 3.67Å; M75-R193 HydrophobicContact CE-CB 3.91Å
76	R	85.2	Confident	79.3	Confident	32 Å²	32	66.3 Å²	66.3	12%	0.121	36%	0.36	C	S	.	.	S	Bend	trans	-53.1	-61.4	177.3	-173.8	-174.8	75.1	95.4	2	112.3	E79 N110 D114 Y117 D167	R76-E79 IonicContact CZ-OE2 3.74Å; R76-E79 IonicContact NH1-OE2 2.98Å; R76-E79 IonicContact NH2-OE2 2.81Å; R76-E79 PolarHBondContact NH2-OE2 2.64Å; R76-E79 VanDerWaalsContact NH2-OE2 3.16Å; R76-N110 PolarHBondContact NH2-OD1 3.18Å; R76-D114 WeakPolarHBondContact CB-OD1 3.38Å; R76-D114 IonicContact CZ-OD1 2.96Å; R76-D114 IonicContact NE-OD1 3.47Å; R76-D114 PolarHBondContact NE-OD1 3.4Å; R76-D114 IonicContact NH2-OD1 3.98Å; R76-Y117 HydrophobicContact CB-CD1 3.97Å; R76-Y117 HydrophobicContact CB-CD2 3.9Å; R76-Y117 HydrophobicContact CB-CE1 4.35Å; R76-Y117 HydrophobicContact CB-CE2 4.28Å; R76-Y117 HydrophobicContact CB-CG 3.74Å; R76-Y117 HydrophobicContact CG-CD2 3.81Å; R76-Y117 HydrophobicContact CG-CE2 4.43Å; R76-Y117 HydrophobicContact CG-CG 3.94Å; R76-D167 HydrophobicContact CG-CB 4.19Å; R76-D167 IonicContact NH1-OD2 3.88Å; R76-D167 PolarHBondContact NH1-OD2 3.16Å
77	S	85.6	Confident	79.7	Confident	28 Å²	28	64.2 Å²	64.2	20%	0.196	35%	0.348	C	S	.	.			trans	-154.2	169.8	179.6	73.7	0	0	0	0	110.8	E79 R193	S77-E79 VanDerWaalsContact C-N 3.31Å; S77-E79 WeakPolarHBondContact OG-CB 3.34Å; S77-E79 WeakPolarHBondContact OG-CG 3.23Å; S77-E79 PolarHBondContact OG-N 3.05Å; S77-E79 PolarHBondContact OG-OE2 3.45Å; S77-R193 PolarHBondContact O-NH2 3.49Å
78	S	85.1	Confident	79.7	Confident	71 Å²	71	65.5 Å²	65.5	50%	0.497	36%	0.358	S	S	.	.	S	Bend	trans	-82.6	-9.5	169.5	57.3	0	0	0	0	112.8	T80 V81 W82	S78-T80 VanDerWaalsContact C-N 3.31Å; S78-T80 PolarHBondContact O-N 3Å; S78-V81 WeakPolarHBondContact O-CA 3.4Å; S78-V81 VanDerWaalsContact O-CB 3.31Å; S78-V81 WeakPolarHBondContact O-CB 3.48Å; S78-V81 PolarHBondContact O-N 3.01Å; S78-W82 VanDerWaalsContact O-CD1 3.23Å; S78-W82 PolarHBondContact O-N 3.42Å
79	E	89	Confident	79.6	Confident	89 Å²	89	63.9 Å²	63.9	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-41	-172.6	-59.7	168.3	142.1	0	0	112.6	R76 S77 V81 W82 A83 N110	R76-E79 IonicContact CZ-OE2 3.74Å; R76-E79 IonicContact NH1-OE2 2.98Å; R76-E79 IonicContact NH2-OE2 2.81Å; R76-E79 PolarHBondContact NH2-OE2 2.64Å; R76-E79 VanDerWaalsContact NH2-OE2 3.16Å; S77-E79 VanDerWaalsContact C-N 3.31Å; S77-E79 WeakPolarHBondContact OG-CB 3.34Å; S77-E79 WeakPolarHBondContact OG-CG 3.23Å; S77-E79 PolarHBondContact OG-N 3.05Å; S77-E79 PolarHBondContact OG-OE2 3.45Å; E79-V81 PolarHBondContact O-N 2.99Å; E79-W82 PolarHBondContact O-N 3.47Å; E79-W82 VanDerWaalsContact O-N 3.11Å; E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 3.15Å; E79-N110 PolarHBondContact OE2-OD1 3.17Å
80	T	90.9	Very high	79.1	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-30.3	177.5	-48	0	0	0	0	112	S78 C84 N110 I111 D114	S78-T80 VanDerWaalsContact C-N 3.31Å; S78-T80 PolarHBondContact O-N 3Å; T80-C84 WeakPolarHBondContact O-CB 3.33Å; T80-C84 PolarHBondContact O-N 2.98Å; T80-C84 PolarHBondContact O-SG 3.32Å; T80-N110 HydrophobicContact CG2-CB 4.42Å; T80-N110 PolarHBondContact OG1-O 3.34Å; T80-I111 HydrophobicContact CG2-CG1 3.9Å; T80-D114 WeakPolarHBondContact CB-OD2 3.49Å; T80-D114 WeakPolarHBondContact CG2-OD2 3.18Å; T80-D114 VanDerWaalsContact OG1-CG 3.22Å; T80-D114 PolarHBondContact OG1-OD1 3.49Å; T80-D114 PolarHBondContact OG1-OD2 3.23Å
81	V	90.8	Very high	78.5	Confident	63 Å²	63	69.1 Å²	69.1	38%	0.382	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-49.8	172.2	-174.7	0	0	0	0	109	S78 E79 T85	S78-V81 WeakPolarHBondContact O-CA 3.4Å; S78-V81 VanDerWaalsContact O-CB 3.31Å; S78-V81 WeakPolarHBondContact O-CB 3.48Å; S78-V81 PolarHBondContact O-N 3.01Å; E79-V81 PolarHBondContact O-N 2.99Å; V81-T85 WeakPolarHBondContact O-CB 3.49Å; V81-T85 PolarHBondContact O-N 3.33Å; V81-T85 PolarHBondContact O-OG1 3.42Å
82	W	87.6	Confident	77.9	Confident	115 Å²	115	67 Å²	67	44%	0.436	38%	0.378	S	S	.	.	H	α-helix	trans	-61.5	-54.5	-177.8	-70	113.4	0	0	0	112.7	S78 E79 C84 T85 M96 T98	S78-W82 VanDerWaalsContact O-CD1 3.23Å; S78-W82 PolarHBondContact O-N 3.42Å; E79-W82 PolarHBondContact O-N 3.47Å; E79-W82 VanDerWaalsContact O-N 3.11Å; W82-C84 VanDerWaalsContact C-N 3.28Å; W82-C84 PolarHBondContact O-N 3.5Å; W82-T85 PolarHBondContact O-N 3.13Å; W82-M96 HydrophobicContact CH2-CB 3.98Å; W82-M96 HydrophobicContact CH2-CE 4.17Å; W82-M96 HydrophobicContact CH2-CG 4.16Å; W82-M96 HydrophobicContact CH2-SD 3.17Å; W82-M96 WeakPolarHBondContact CH2-SD 3.32Å; W82-M96 HydrophobicContact CZ2-CE 4.44Å; W82-M96 HydrophobicContact CZ2-SD 3.61Å; W82-M96 HydrophobicContact CZ3-CB 3.85Å; W82-M96 HydrophobicContact CZ3-SD 3.95Å; W82-T98 HydrophobicContact CE3-CG2 3.57Å; W82-T98 HydrophobicContact CZ3-CG2 3.59Å
83	A	89.9	Confident	76.9	Confident	10 Å²	10	67.5 Å²	67.5	8%	0.083	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-31	-177.3	0	0	0	0	0	113.1	E79 E106	E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 3.15Å; A83-E106 HydrophobicContact CB-CB 4.38Å; A83-E106 HydrophobicContact CB-CG 3.84Å
84	C	90.2	Very high	76	Confident	10 Å²	10	69.3 Å²	69.3	7%	0.068	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	4.7	-179.8	-61.6	0	0	0	0	114.2	T80 W82 P86 C107 A200	T80-C84 WeakPolarHBondContact O-CB 3.33Å; T80-C84 PolarHBondContact O-N 2.98Å; T80-C84 PolarHBondContact O-SG 3.32Å; W82-C84 VanDerWaalsContact C-N 3.28Å; W82-C84 PolarHBondContact O-N 3.5Å; C84-P86 WeakPolarHBondContact O-CD 3.22Å; C84-C107 VanDerWaalsContact CA-SG 3.53Å; C84-C107 HydrophobicContact CB-CB 4.01Å; C84-C107 WeakPolarHBondContact CB-SG 3.18Å; C84-C107 WeakPolarHBondContact SG-CA 3.33Å; C84-C107 WeakPolarHBondContact SG-CB 3.42Å; C84-C107 CovalentContact SG-SG 2.05Å; C84-C107 PolarHBondContact SG-SG 2.87Å; C84-A200 HydrophobicContact CB-CB 3.75Å
85	T	86.6	Confident	74.7	Confident	35 Å²	35	68.5 Å²	68.5	22%	0.215	41%	0.411	C	S	.	.	S	Bend	trans	-74.2	125.1	173.3	-68	0	0	0	0	108.5	V81 W82	V81-T85 WeakPolarHBondContact O-CB 3.49Å; V81-T85 PolarHBondContact O-N 3.33Å; V81-T85 PolarHBondContact O-OG1 3.42Å; W82-T85 PolarHBondContact O-N 3.13Å
86	P	82.1	Confident	73.5	Confident	59 Å²	59	71.8 Å²	71.8	38%	0.383	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-56.6	144.1	173.5	-24.1	34.3	0	0	0	110.9	C84 S88 Y203	C84-P86 WeakPolarHBondContact O-CD 3.22Å; P86-S88 PolarHBondContact O-N 3.16Å; P86-Y203 HydrophobicContact CB-CE1 3.99Å; P86-Y203 HydrophobicContact CB-CE2 4.29Å; P86-Y203 HydrophobicContact CG-CD1 4.24Å; P86-Y203 HydrophobicContact CG-CE1 4.07Å; P86-Y203 HydrophobicContact CG-CE2 4.36Å; P86-Y203 HydrophobicContact CG-CG 4.45Å
87	A	74.6	Confident	72	Confident	49 Å²	49	77 Å²	77	41%	0.405	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-55.7	126.6	171.5	0	0	0	0	0	108.9	A89 F102	A87-A89 PolarHBondContact O-N 2.98Å; A87-A89 VanDerWaalsContact O-N 3.11Å; A87-F102 HydrophobicContact CB-CB 4.49Å
88	S	66.3	Low	70.6	Confident	41 Å²	41	76.6 Å²	76.6	29%	0.287	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-62.1	117.5	-173.4	57	0	0	0	0	110.5	P86 Q90	P86-S88 PolarHBondContact O-N 3.16Å; S88-Q90 PolarHBondContact O-N 3.31Å
89	A	54.5	Low	69.3	Low	81 Å²	81	81.2 Å²	81.2	67%	0.669	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-61.5	132.5	149.4	0	0	0	0	0	106.2	A87 N91	A87-A89 PolarHBondContact O-N 2.98Å; A87-A89 VanDerWaalsContact O-N 3.11Å; A89-N91 PolarHBondContact O-N 3.15Å
90	Q	53.3	Low	68.2	Low	186 Å²	186	80.8 Å²	80.8	87%	0.869	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	4.7	-165	-63.2	-175.8	15.3	0	0	117.3	S88	S88-Q90 PolarHBondContact O-N 3.31Å
91	N	51.1	Low	67.6	Low	156 Å²	156	85.7 Å²	85.7	83%	0.834	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	14.8	-163.6	-64.1	-13.1	0	0	0	115.9	A89	A89-N91 PolarHBondContact O-N 3.15Å
92	S	54	Low	67.5	Low	66 Å²	66	84.2 Å²	84.2	46%	0.462	50%	0.502	S	S	.	.			trans	-109.1	112.3	176.2	69.5	0	0	0	0	112.3	C94 A95	S92-C94 PolarHBondContact O-N 3.35Å; S92-C94 VanDerWaalsContact O-N 3.13Å; S92-A95 PolarHBondContact O-N 3.48Å; S92-A95 VanDerWaalsContact OG-CB 3.25Å; S92-A95 WeakPolarHBondContact OG-CB 3.48Å
93	S	56.4	Low	67.5	Low	126 Å²	126	80.8 Å²	80.8	88%	0.881	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.9	-179.3	69.2	0	0	0	0	114.7
94	C	58.8	Low	67.5	Low	126 Å²	126	83.1 Å²	83.1	85%	0.851	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-7.7	-178.2	-63.1	0	0	0	0	113.5	S92	S92-C94 PolarHBondContact O-N 3.35Å; S92-C94 VanDerWaalsContact O-N 3.13Å
95	A	55.4	Low	67.4	Low	33 Å²	33	86.8 Å²	86.8	27%	0.273	52%	0.524	S	S	.	.	S	Bend	trans	-89.6	124.3	175.6	0	0	0	0	0	108.9	S92 L97	S92-A95 PolarHBondContact O-N 3.48Å; S92-A95 VanDerWaalsContact OG-CB 3.25Å; S92-A95 WeakPolarHBondContact OG-CB 3.48Å; A95-L97 PolarHBondContact O-N 3.37Å
96	M	55.9	Low	67.5	Low	131 Å²	131	89.9 Å²	89.9	65%	0.645	54%	0.536	S	S	*	.			trans	-57.1	125.2	162.6	-84.5	179.2	143	0	0	107.5	W82 T98	W82-M96 HydrophobicContact CH2-CB 3.98Å; W82-M96 HydrophobicContact CH2-CE 4.17Å; W82-M96 HydrophobicContact CH2-CG 4.16Å; W82-M96 HydrophobicContact CH2-SD 3.17Å; W82-M96 WeakPolarHBondContact CH2-SD 3.32Å; W82-M96 HydrophobicContact CZ2-CE 4.44Å; W82-M96 HydrophobicContact CZ2-SD 3.61Å; W82-M96 HydrophobicContact CZ3-CB 3.85Å; W82-M96 HydrophobicContact CZ3-SD 3.95Å; M96-T98 VanDerWaalsContact C-N 3.35Å; M96-T98 PolarHBondContact O-N 3.48Å
97	L	53.5	Low	68	Low	140 Å²	140	87 Å²	87	73%	0.733	52%	0.518	S	S	*	.			trans	-62.2	96.2	176.5	-75.4	160.9	0	0	0	108.6	A95	A95-L97 PolarHBondContact O-N 3.37Å
98	T	55.9	Low	68.7	Low	20 Å²	20	85.3 Å²	85.3	12%	0.123	50%	0.502	C	S	.	.			trans	-88.4	113.8	167.7	52.7	0	0	0	0	107.7	W82 M96 S100	W82-T98 HydrophobicContact CE3-CG2 3.57Å; W82-T98 HydrophobicContact CZ3-CG2 3.59Å; M96-T98 VanDerWaalsContact C-N 3.35Å; M96-T98 PolarHBondContact O-N 3.48Å; T98-S100 PolarHBondContact O-N 3.24Å; T98-S100 VanDerWaalsContact O-N 3.16Å
99	N	58.2	Low	69.8	Low	169 Å²	169	86 Å²	86	90%	0.904	50%	0.501	S	S	*	.			trans	-71.7	0.5	176.6	-68.1	-30.9	0	0	0	113.2
100	S	66.1	Low	71.6	Confident	79 Å²	79	82.4 Å²	82.4	55%	0.552	47%	0.471	S	S	*	.	S	Bend	trans	-94.6	146.2	178.2	57.5	0	0	0	0	111.8	T98	T98-S100 PolarHBondContact O-N 3.24Å; T98-S100 VanDerWaalsContact O-N 3.16Å
101	S	78.8	Confident	73.5	Confident	105 Å²	105	73.6 Å²	73.6	73%	0.734	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-66.7	152.7	168.2	52.4	0	0	0	0	111	S103	S101-S103 PolarHBondContact O-N 3.06Å
102	F	87.4	Confident	75.5	Confident	31 Å²	31	67.5 Å²	67.5	14%	0.136	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-67.4	131.3	175.2	174.1	-94.1	0	0	0	110.6	A87 E104 C107 Y203 I204 H209	A87-F102 HydrophobicContact CB-CB 4.49Å; F102-E104 HydrophobicContact CE1-CB 4.09Å; F102-C107 HydrophobicContact CE2-CB 4.22Å; F102-C107 HydrophobicContact CZ-CB 4.23Å; F102-Y203 HydrophobicContact CD1-CE1 4.23Å; F102-Y203 HydrophobicContact CD2-CE1 4.15Å; F102-Y203 HydrophobicContact CE1-CD1 4.42Å; F102-Y203 HydrophobicContact CE1-CE1 4.16Å; F102-Y203 HydrophobicContact CE2-CD1 4.14Å; F102-Y203 HydrophobicContact CE2-CE1 4.07Å; F102-Y203 HydrophobicContact CG-CE1 4.21Å; F102-Y203 HydrophobicContact CZ-CD1 4.02Å; F102-Y203 HydrophobicContact CZ-CE1 4.08Å; F102-I204 HydrophobicContact CE1-CG1 4.28Å; F102-I204 HydrophobicContact CZ-CD1 4.31Å; F102-I204 HydrophobicContact CZ-CG1 3.86Å; F102-H209 HydrophobicContact CD1-CB 3.43Å; F102-H209 VanDerWaalsContact CD1-CB 3.43Å; F102-H209 AromaticContact CD1-CG 3.86Å; F102-H209 HydrophobicContact CE1-CB 3.7Å; F102-H209 AromaticContact CE1-CD2 3.97Å; F102-H209 AromaticContact CE1-CG 3.69Å; F102-H209 HydrophobicContact CG-CB 4.29Å
103	S	89.4	Confident	77.3	Confident	43 Å²	43	68.9 Å²	68.9	30%	0.301	39%	0.391	S	S	.	.			trans	-113.9	108.4	176.3	175.3	0	0	0	0	110.1	S101 N105 E106 C107	S101-S103 PolarHBondContact O-N 3.06Å; S103-N105 VanDerWaalsContact C-N 3.28Å; S103-N105 PolarHBondContact O-N 2.74Å; S103-E106 PolarHBondContact O-N 3.28Å; S103-E106 WeakPolarHBondContact OG-CB 3.02Å; S103-E106 PolarHBondContact OG-N 3.43Å; S103-C107 WeakPolarHBondContact O-CB 3.49Å; S103-C107 PolarHBondContact O-N 2.92Å
104	E	88.3	Confident	79.1	Confident	59 Å²	59	62.9 Å²	62.9	28%	0.276	35%	0.349	S	S	.	.	H	α-helix	trans	-55.8	-45.5	177.3	-175.5	179.2	154.5	0	0	110.7	F102 C107 V108 I204 H209 R210	F102-E104 HydrophobicContact CE1-CB 4.09Å; E104-C107 PolarHBondContact O-N 2.97Å; E104-V108 WeakPolarHBondContact O-CG2 3.31Å; E104-V108 PolarHBondContact O-N 2.91Å; E104-I204 VanDerWaalsContact CD-CG2 3.5Å; E104-I204 HydrophobicContact CG-CD1 4.11Å; E104-I204 HydrophobicContact CG-CG1 4.13Å; E104-I204 HydrophobicContact CG-CG2 3.84Å; E104-I204 WeakPolarHBondContact OE1-CG2 3.5Å; E104-H209 IonicContact OE2-CE1 3.8Å; E104-H209 PolarHBondContact OE2-CE1 2.96Å; E104-H209 IonicContact OE2-NE2 3.16Å; E104-H209 PolarHBondContact OE2-NE2 3.09Å; E104-R210 IonicContact OE1-NH2 2.82Å; E104-R210 IonicContact OE2-CZ 2.98Å; E104-R210 IonicContact OE2-NE 3.41Å; E104-R210 IonicContact OE2-NH2 3.73Å; E104-R210 PolarHBondContact OE2-NH2 3.36Å
105	N	88.1	Confident	80.8	Confident	88 Å²	88	56.9 Å²	56.9	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-45.3	-179.7	-176.2	53.1	0	0	0	112.4	S103 V108 M109	S103-N105 VanDerWaalsContact C-N 3.28Å; S103-N105 PolarHBondContact O-N 2.74Å; N105-V108 PolarHBondContact O-N 2.74Å; N105-M109 WeakPolarHBondContact O-CB 3.48Å; N105-M109 PolarHBondContact O-N 3Å
106	E	89.8	Confident	82.6	Confident	99 Å²	99	56.1 Å²	56.1	46%	0.463	30%	0.303	S	S	.	.	H	α-helix	trans	-66.4	-39.8	179.9	-167.4	-177.4	170.1	0	0	111.7	A83 S103 N110	A83-E106 HydrophobicContact CB-CB 4.38Å; A83-E106 HydrophobicContact CB-CG 3.84Å; S103-E106 PolarHBondContact O-N 3.28Å; S103-E106 WeakPolarHBondContact OG-CB 3.02Å; S103-E106 PolarHBondContact OG-N 3.43Å; E106-N110 WeakPolarHBondContact O-CB 3.49Å; E106-N110 PolarHBondContact O-N 2.79Å; E106-N110 VanDerWaalsContact O-N 3.09Å; E106-N110 PolarHBondContact O-ND2 3.39Å
107	C	91.4	Very high	84.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-54.4	173.6	173.2	0	0	0	0	111	C84 F102 S103 E104 M109 N110 I111	C84-C107 VanDerWaalsContact CA-SG 3.53Å; C84-C107 HydrophobicContact CB-CB 4.01Å; C84-C107 WeakPolarHBondContact CB-SG 3.18Å; C84-C107 WeakPolarHBondContact SG-CA 3.33Å; C84-C107 WeakPolarHBondContact SG-CB 3.42Å; C84-C107 CovalentContact SG-SG 2.05Å; C84-C107 PolarHBondContact SG-SG 2.87Å; F102-C107 HydrophobicContact CE2-CB 4.22Å; F102-C107 HydrophobicContact CZ-CB 4.23Å; S103-C107 WeakPolarHBondContact O-CB 3.49Å; S103-C107 PolarHBondContact O-N 2.92Å; E104-C107 PolarHBondContact O-N 2.97Å; C107-M109 VanDerWaalsContact C-N 3.32Å; C107-M109 PolarHBondContact O-N 3.21Å; C107-N110 PolarHBondContact O-N 3.29Å; C107-I111 VanDerWaalsContact O-CG1 3.28Å; C107-I111 WeakPolarHBondContact O-CG1 3.25Å; C107-I111 PolarHBondContact O-N 3.31Å
108	V	90.6	Very high	86.3	Confident	13 Å²	13	44.6 Å²	44.6	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-42	-179.1	171.5	0	0	0	0	111.7	E104 N105 N110 I111 M112 L156 I204	E104-V108 WeakPolarHBondContact O-CG2 3.31Å; E104-V108 PolarHBondContact O-N 2.91Å; N105-V108 PolarHBondContact O-N 2.74Å; V108-N110 PolarHBondContact O-N 2.66Å; V108-I111 WeakPolarHBondContact O-CB 3.28Å; V108-I111 PolarHBondContact O-N 3.19Å; V108-M112 HydrophobicContact CG1-CE 4.49Å; V108-M112 HydrophobicContact CG1-CG 4.47Å; V108-M112 WeakPolarHBondContact O-CG 3.29Å; V108-M112 PolarHBondContact O-N 2.98Å; V108-L156 HydrophobicContact CG1-CB 4.24Å; V108-L156 HydrophobicContact CG1-CD1 4.16Å; V108-L156 HydrophobicContact CG2-CD1 4.25Å; V108-I204 HydrophobicContact CG2-CD1 3.96Å
109	M	90	Very high	88.2	Confident	56 Å²	56	45.6 Å²	45.6	28%	0.276	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-46	177.8	-172.2	-170.4	-49.7	0	0	111.8	N105 C107 M112 R113	N105-M109 WeakPolarHBondContact O-CB 3.48Å; N105-M109 PolarHBondContact O-N 3Å; C107-M109 VanDerWaalsContact C-N 3.32Å; C107-M109 PolarHBondContact O-N 3.21Å; M109-M112 PolarHBondContact O-N 3.25Å; M109-R113 WeakPolarHBondContact O-CG 3.45Å; M109-R113 PolarHBondContact O-N 3.01Å; M109-R113 PolarHBondContact SD-NH2 2.93Å
110	N	92	Very high	89.9	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-34.6	177.6	-79.7	-62.8	0	0	0	112.8	R76 E79 T80 E106 C107 V108 M112 R113 D114	R76-N110 PolarHBondContact NH2-OD1 3.18Å; E79-N110 PolarHBondContact OE2-OD1 3.17Å; T80-N110 HydrophobicContact CG2-CB 4.42Å; T80-N110 PolarHBondContact OG1-O 3.34Å; E106-N110 WeakPolarHBondContact O-CB 3.49Å; E106-N110 PolarHBondContact O-N 2.79Å; E106-N110 VanDerWaalsContact O-N 3.09Å; E106-N110 PolarHBondContact O-ND2 3.39Å; C107-N110 PolarHBondContact O-N 3.29Å; V108-N110 PolarHBondContact O-N 2.66Å; N110-M112 VanDerWaalsContact C-N 3.35Å; N110-R113 PolarHBondContact O-N 2.89Å; N110-R113 PolarHBondContact OD1-NH1 3.35Å; N110-D114 PolarHBondContact O-N 2.63Å
111	I	93.3	Very high	91.2	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-47.1	169.5	-66.7	172.8	0	0	0	110.4	F47 T80 C107 V108 R113 D114 L115 I197 A200 V201	F47-I111 HydrophobicContact CE1-CG2 3.85Å; F47-I111 HydrophobicContact CZ-CG2 4.03Å; T80-I111 HydrophobicContact CG2-CG1 3.9Å; C107-I111 VanDerWaalsContact O-CG1 3.28Å; C107-I111 WeakPolarHBondContact O-CG1 3.25Å; C107-I111 PolarHBondContact O-N 3.31Å; V108-I111 WeakPolarHBondContact O-CB 3.28Å; V108-I111 PolarHBondContact O-N 3.19Å; I111-R113 VanDerWaalsContact C-N 3.33Å; I111-R113 PolarHBondContact O-N 3.23Å; I111-D114 WeakPolarHBondContact O-CB 3.29Å; I111-D114 PolarHBondContact O-N 2.84Å; I111-L115 HydrophobicContact CG2-CD1 4.44Å; I111-L115 WeakPolarHBondContact O-CG 3.49Å; I111-L115 PolarHBondContact O-N 3.37Å; I111-I197 HydrophobicContact CD1-CG2 4.35Å; I111-I197 HydrophobicContact CG1-CG1 4.07Å; I111-I197 HydrophobicContact CG2-CD1 4.07Å; I111-I197 HydrophobicContact CG2-CG1 4.02Å; I111-I197 HydrophobicContact CG2-CG2 3.88Å; I111-A200 HydrophobicContact CD1-CB 4.22Å; I111-V201 HydrophobicContact CD1-CG2 4.46Å
112	M	91.9	Very high	92	Very high	27 Å²	27	30.6 Å²	30.6	13%	0.133	15%	0.153	C	C	.	.	H	α-helix	trans	-65.4	-35.1	-179.6	-68.4	-59.8	147.4	0	0	112.6	F47 V108 M109 N110 L115 A116 C154	F47-M112 HydrophobicContact CZ-CE 4Å; V108-M112 HydrophobicContact CG1-CE 4.49Å; V108-M112 HydrophobicContact CG1-CG 4.47Å; V108-M112 WeakPolarHBondContact O-CG 3.29Å; V108-M112 PolarHBondContact O-N 2.98Å; M109-M112 PolarHBondContact O-N 3.25Å; N110-M112 VanDerWaalsContact C-N 3.35Å; M112-L115 HydrophobicContact CE-CD1 4.26Å; M112-L115 PolarHBondContact O-N 3.36Å; M112-L115 HydrophobicContact SD-CD1 3.93Å; M112-A116 PolarHBondContact O-N 3.03Å; M112-C154 HydrophobicContact CE-CB 4.38Å; M112-C154 WeakPolarHBondContact CE-O 3.47Å
113	R	92.2	Very high	92.3	Very high	95 Å²	95	32 Å²	32	36%	0.358	16%	0.161	S	C	.	.	H	α-helix	trans	-66.7	-40	172.9	-67.2	179.7	-174.7	133.4	-2.6	112.4	M109 N110 I111 L115 A116 Y117	M109-R113 WeakPolarHBondContact O-CG 3.45Å; M109-R113 PolarHBondContact O-N 3.01Å; M109-R113 PolarHBondContact SD-NH2 2.93Å; N110-R113 PolarHBondContact O-N 2.89Å; N110-R113 PolarHBondContact OD1-NH1 3.35Å; I111-R113 VanDerWaalsContact C-N 3.33Å; I111-R113 PolarHBondContact O-N 3.23Å; R113-L115 VanDerWaalsContact C-N 3.34Å; R113-A116 PolarHBondContact O-N 3.38Å; R113-Y117 PolarHBondContact O-N 3.35Å
114	D	93.6	Very high	92.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-44.5	172.9	-77	-18.3	0	0	0	111.3	R76 T80 N110 I111 A116 Y117 Y118 R193	R76-D114 WeakPolarHBondContact CB-OD1 3.38Å; R76-D114 IonicContact CZ-OD1 2.96Å; R76-D114 IonicContact NE-OD1 3.47Å; R76-D114 PolarHBondContact NE-OD1 3.4Å; R76-D114 IonicContact NH2-OD1 3.98Å; T80-D114 WeakPolarHBondContact CB-OD2 3.49Å; T80-D114 WeakPolarHBondContact CG2-OD2 3.18Å; T80-D114 VanDerWaalsContact OG1-CG 3.22Å; T80-D114 PolarHBondContact OG1-OD1 3.49Å; T80-D114 PolarHBondContact OG1-OD2 3.23Å; N110-D114 PolarHBondContact O-N 2.63Å; I111-D114 WeakPolarHBondContact O-CB 3.29Å; I111-D114 PolarHBondContact O-N 2.84Å; D114-A116 VanDerWaalsContact C-N 3.33Å; D114-A116 PolarHBondContact O-N 3.02Å; D114-Y117 WeakPolarHBondContact O-CB 3.02Å; D114-Y117 PolarHBondContact O-N 2.7Å; D114-Y118 WeakPolarHBondContact O-CD2 3.45Å; D114-Y118 PolarHBondContact O-N 2.79Å; D114-R193 HydrophobicContact CB-CG 4.22Å; D114-R193 WeakPolarHBondContact OD2-CD 3.3Å; D114-R193 WeakPolarHBondContact OD2-CG 3.17Å; D114-R193 IonicContact OD2-CZ 3.18Å; D114-R193 IonicContact OD2-NE 3.6Å; D114-R193 PolarHBondContact OD2-NE 2.91Å
115	L	94.9	Very high	92.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-42.3	175.8	-68.3	-178.5	0	0	0	112	F47 L50 I111 M112 R113 Y118 Q119 I147 L150 R151 F190	F47-L115 HydrophobicContact CE1-CD1 4.13Å; L50-L115 HydrophobicContact CD2-CD2 3.62Å; I111-L115 HydrophobicContact CG2-CD1 4.44Å; I111-L115 WeakPolarHBondContact O-CG 3.49Å; I111-L115 PolarHBondContact O-N 3.37Å; M112-L115 HydrophobicContact CE-CD1 4.26Å; M112-L115 PolarHBondContact O-N 3.36Å; M112-L115 HydrophobicContact SD-CD1 3.93Å; R113-L115 VanDerWaalsContact C-N 3.34Å; L115-Y118 PolarHBondContact O-N 3.41Å; L115-Q119 VanDerWaalsContact O-CB 3.31Å; L115-Q119 WeakPolarHBondContact O-CB 3.34Å; L115-Q119 PolarHBondContact O-N 3.02Å; L115-I147 HydrophobicContact CB-CG2 4.1Å; L115-I147 HydrophobicContact CD2-CG2 4.42Å; L115-I147 WeakPolarHBondContact O-CG2 3.35Å; L115-L150 HydrophobicContact CD1-CB 3.88Å; L115-L150 HydrophobicContact CD1-CD1 4.2Å; L115-L150 HydrophobicContact CD2-CD1 4.3Å; L115-R151 HydrophobicContact CB-CG 4.05Å; L115-R151 HydrophobicContact CD1-CG 4.36Å; L115-F190 HydrophobicContact CD2-CE2 4.41Å; L115-F190 HydrophobicContact CD2-CZ 4.28Å
116	A	92.6	Very high	93.2	Very high	17 Å²	17	26.6 Å²	26.6	14%	0.14	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-43.6	175.7	0	0	0	0	0	112.1	M112 R113 D114 Q119 T120	M112-A116 PolarHBondContact O-N 3.03Å; R113-A116 PolarHBondContact O-N 3.38Å; D114-A116 VanDerWaalsContact C-N 3.33Å; D114-A116 PolarHBondContact O-N 3.02Å; A116-Q119 PolarHBondContact O-N 3.33Å; A116-T120 PolarHBondContact O-N 3.07Å; A116-T120 PolarHBondContact O-OG1 3.22Å
117	Y	93	Very high	93.4	Very high	29 Å²	29	28.7 Å²	28.7	11%	0.114	14%	0.142	C	C	.	.	H	α-helix	trans	-58.4	-50.8	176	171.7	-91.1	0	0	0	112.2	R76 R113 D114 T120 A121 D167 P169 M186	R76-Y117 HydrophobicContact CB-CD1 3.97Å; R76-Y117 HydrophobicContact CB-CD2 3.9Å; R76-Y117 HydrophobicContact CB-CE1 4.35Å; R76-Y117 HydrophobicContact CB-CE2 4.28Å; R76-Y117 HydrophobicContact CB-CG 3.74Å; R76-Y117 HydrophobicContact CG-CD2 3.81Å; R76-Y117 HydrophobicContact CG-CE2 4.43Å; R76-Y117 HydrophobicContact CG-CG 3.94Å; R113-Y117 PolarHBondContact O-N 3.35Å; D114-Y117 WeakPolarHBondContact O-CB 3.02Å; D114-Y117 PolarHBondContact O-N 2.7Å; Y117-T120 PolarHBondContact O-N 3.12Å; Y117-A121 PolarHBondContact O-N 2.94Å; Y117-D167 HydrophobicContact CD2-CB 4.42Å; Y117-D167 WeakPolarHBondContact CD2-O 3.05Å; Y117-D167 WeakPolarHBondContact CE2-O 3.35Å; Y117-P169 HydrophobicContact CE2-CB 3.97Å; Y117-P169 HydrophobicContact CE2-CG 4.27Å; Y117-M186 HydrophobicContact CD1-CE 4.48Å; Y117-M186 HydrophobicContact CE1-CE 3.54Å
118	Y	95.2	Very high	93.5	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-71.7	-30.6	-179.6	-71.3	-68.8	0	0	0	112.7	D114 L115 A121 I122 F190 R193	D114-Y118 WeakPolarHBondContact O-CD2 3.45Å; D114-Y118 PolarHBondContact O-N 2.79Å; L115-Y118 PolarHBondContact O-N 3.41Å; Y118-A121 WeakPolarHBondContact O-CB 3.37Å; Y118-A121 PolarHBondContact O-N 3.33Å; Y118-I122 VanDerWaalsContact O-CG1 3.28Å; Y118-I122 WeakPolarHBondContact O-CG1 3.46Å; Y118-I122 PolarHBondContact O-N 3.18Å; Y118-F190 HydrophobicContact CD1-CB 3.69Å; Y118-F190 HydrophobicContact CD1-CD1 4.04Å; Y118-F190 HydrophobicContact CD1-CD2 4.04Å; Y118-F190 AromaticContact CD1-CG 3.67Å; Y118-F190 HydrophobicContact CD1-CG 3.67Å; Y118-F190 HydrophobicContact CD2-CB 4.33Å; Y118-F190 HydrophobicContact CD2-CD1 4.38Å; Y118-F190 AromaticContact CD2-CD2 3.17Å; Y118-F190 HydrophobicContact CD2-CD2 3.17Å; Y118-F190 AromaticContact CD2-CE2 3.39Å; Y118-F190 HydrophobicContact CD2-CE2 3.39Å; Y118-F190 AromaticContact CD2-CG 3.72Å; Y118-F190 HydrophobicContact CD2-CG 3.72Å; Y118-F190 HydrophobicContact CD2-CZ 4.09Å; Y118-F190 HydrophobicContact CE1-CB 3.41Å; Y118-F190 VanDerWaalsContact CE1-CB 3.41Å; Y118-F190 HydrophobicContact CE1-CD2 4.16Å; Y118-F190 AromaticContact CE1-CG 3.84Å; Y118-F190 HydrophobicContact CE1-CG 3.84Å; Y118-F190 HydrophobicContact CE2-CB 4.11Å; Y118-F190 AromaticContact CE2-CD2 3.33Å; Y118-F190 HydrophobicContact CE2-CD2 3.33Å; Y118-F190 AromaticContact CE2-CE2 3.96Å; Y118-F190 HydrophobicContact CE2-CE2 3.96Å; Y118-F190 AromaticContact CE2-CG 3.9Å; Y118-F190 HydrophobicContact CE2-CG 3.9Å; Y118-F190 HydrophobicContact CG-CB 4.15Å; Y118-F190 AromaticContact CG-CD1 3.92Å; Y118-F190 HydrophobicContact CG-CD1 3.92Å; Y118-F190 AromaticContact CG-CD2 3.57Å; Y118-F190 HydrophobicContact CG-CD2 3.57Å; Y118-F190 HydrophobicContact CG-CE1 4.18Å; Y118-F190 AromaticContact CG-CE2 3.83Å; Y118-F190 HydrophobicContact CG-CE2 3.83Å; Y118-F190 AromaticContact CG-CG 3.61Å; Y118-F190 HydrophobicContact CG-CG 3.61Å; Y118-F190 HydrophobicContact CG-CZ 4.11Å; Y118-F190 AromaticContact CZ-CD2 3.82Å; Y118-F190 AromaticContact CZ-CG 3.95Å; Y118-F190 WeakPolarHBondContact OH-CA 3.32Å; Y118-F190 PolarHBondContact OH-N 3.22Å; Y118-R193 HydrophobicContact CE2-CB 4.37Å; Y118-R193 HydrophobicContact CE2-CG 4.41Å
119	Q	95.2	Very high	93.6	Very high	40 Å²	40	32.1 Å²	32.1	19%	0.187	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-53.7	170.1	-177	177	-29.6	0	0	110.6	L115 A116 A121 I122 D123 L144 I147 R151	L115-Q119 VanDerWaalsContact O-CB 3.31Å; L115-Q119 WeakPolarHBondContact O-CB 3.34Å; L115-Q119 PolarHBondContact O-N 3.02Å; A116-Q119 PolarHBondContact O-N 3.33Å; Q119-A121 VanDerWaalsContact C-N 3.26Å; Q119-A121 PolarHBondContact O-N 3.32Å; Q119-I122 PolarHBondContact O-N 3.1Å; Q119-D123 VanDerWaalsContact O-CB 3.24Å; Q119-D123 WeakPolarHBondContact O-CB 3.37Å; Q119-D123 PolarHBondContact O-N 2.65Å; Q119-L144 HydrophobicContact CG-CD1 3.81Å; Q119-I147 HydrophobicContact CB-CG2 3.8Å; Q119-I147 HydrophobicContact CG-CG2 4.45Å; Q119-R151 VanDerWaalsContact CD-NH1 3.31Å
120	T	93.6	Very high	93.8	Very high	37 Å²	37	30.7 Å²	30.7	23%	0.227	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-39.2	179.1	-62.6	0	0	0	0	110.8	A116 Y117 T124 A168	A116-T120 PolarHBondContact O-N 3.07Å; A116-T120 PolarHBondContact O-OG1 3.22Å; Y117-T120 PolarHBondContact O-N 3.12Å; T120-T124 HydrophobicContact CG2-CG2 4.13Å; T120-T124 WeakPolarHBondContact O-CB 3.48Å; T120-T124 WeakPolarHBondContact O-CG2 3.46Å; T120-T124 PolarHBondContact O-N 3.19Å; T120-T124 PolarHBondContact O-OG1 3.44Å; T120-A168 HydrophobicContact CG2-CB 4.26Å
121	A	93.8	Very high	93.8	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-54	-56.7	174	0	0	0	0	0	112.3	Y117 Y118 Q119 T124 Y125 P169 W172 M183 M186	Y117-A121 PolarHBondContact O-N 2.94Å; Y118-A121 WeakPolarHBondContact O-CB 3.37Å; Y118-A121 PolarHBondContact O-N 3.33Å; Q119-A121 VanDerWaalsContact C-N 3.26Å; Q119-A121 PolarHBondContact O-N 3.32Å; A121-T124 PolarHBondContact O-OG1 2.86Å; A121-Y125 WeakPolarHBondContact O-CB 3.47Å; A121-Y125 PolarHBondContact O-N 3.37Å; A121-P169 VanDerWaalsContact CA-CG 3.46Å; A121-P169 HydrophobicContact CB-CB 4.36Å; A121-P169 HydrophobicContact CB-CG 3.55Å; A121-W172 VanDerWaalsContact O-CZ2 3.23Å; A121-W172 WeakPolarHBondContact O-CZ2 3.47Å; A121-M183 HydrophobicContact CB-CE 4.48Å; A121-M183 WeakPolarHBondContact O-CE 3.43Å; A121-M186 HydrophobicContact CB-CE 3.31Å; A121-M186 HydrophobicContact CB-SD 4.17Å
122	I	95.8	Very high	93.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-44.2	-173	-65	165.6	0	0	0	109.6	Y118 Q119 Y125 L126 L140 T143 L144 I147 M183 M187	Y118-I122 VanDerWaalsContact O-CG1 3.28Å; Y118-I122 WeakPolarHBondContact O-CG1 3.46Å; Y118-I122 PolarHBondContact O-N 3.18Å; Q119-I122 PolarHBondContact O-N 3.1Å; I122-Y125 PolarHBondContact O-N 3.1Å; I122-L126 HydrophobicContact CG2-CD1 3.92Å; I122-L126 HydrophobicContact CG2-CG 4.36Å; I122-L126 VanDerWaalsContact O-CG 3.25Å; I122-L126 WeakPolarHBondContact O-CG 3.25Å; I122-L126 PolarHBondContact O-N 2.95Å; I122-L140 HydrophobicContact CG2-CB 3.96Å; I122-T143 HydrophobicContact CD1-CG2 3.91Å; I122-L144 HydrophobicContact CB-CD1 4.37Å; I122-L144 HydrophobicContact CG2-CB 3.96Å; I122-L144 HydrophobicContact CG2-CD1 4.31Å; I122-L144 HydrophobicContact CG2-CD2 4.37Å; I122-L144 HydrophobicContact CG2-CG 4.45Å; I122-I147 HydrophobicContact CD1-CD1 3.8Å; I122-M183 HydrophobicContact CG1-CE 4.35Å; I122-M187 HydrophobicContact CD1-SD 4.23Å; I122-M187 HydrophobicContact CG1-SD 4.34Å
123	D	94.9	Very high	93.9	Very high	60 Å²	60	40 Å²	40	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-60.4	-51.9	-178.9	-172.8	70.2	0	0	0	112	Q119 Y125 L126 Q127	Q119-D123 VanDerWaalsContact O-CB 3.24Å; Q119-D123 WeakPolarHBondContact O-CB 3.37Å; Q119-D123 PolarHBondContact O-N 2.65Å; D123-Y125 VanDerWaalsContact C-N 3.31Å; D123-Y125 PolarHBondContact O-N 2.94Å; D123-L126 PolarHBondContact O-N 3.22Å; D123-Q127 WeakPolarHBondContact O-CG 3.44Å; D123-Q127 PolarHBondContact O-N 3.48Å; D123-Q127 PolarHBondContact OD2-NE2 3.44Å
124	T	94.3	Very high	94.1	Very high	45 Å²	45	42 Å²	42	28%	0.276	22%	0.219	S	C	.	.	H	α-helix	trans	-69.1	-29.9	-179.8	56.9	0	0	0	0	112.6	T120 A121 Q127 S128 W172	T120-T124 HydrophobicContact CG2-CG2 4.13Å; T120-T124 WeakPolarHBondContact O-CB 3.48Å; T120-T124 WeakPolarHBondContact O-CG2 3.46Å; T120-T124 PolarHBondContact O-N 3.19Å; T120-T124 PolarHBondContact O-OG1 3.44Å; A121-T124 PolarHBondContact O-OG1 2.86Å; T124-Q127 PolarHBondContact O-N 2.81Å; T124-S128 PolarHBondContact O-N 3.48Å; T124-W172 VanDerWaalsContact C-CD1 3.45Å; T124-W172 VanDerWaalsContact O-CD1 3.3Å; T124-W172 PolarHBondContact OG1-NE1 3.39Å
125	Y	94.8	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-44.9	173.9	175.8	-103.1	0	0	0	111.8	L63 A121 I122 D123 Q127 S128 L130 E136 L140 W172 N179 R180 M183	L63-Y125 HydrophobicContact CD1-CE1 4.37Å; A121-Y125 WeakPolarHBondContact O-CB 3.47Å; A121-Y125 PolarHBondContact O-N 3.37Å; I122-Y125 PolarHBondContact O-N 3.1Å; D123-Y125 VanDerWaalsContact C-N 3.31Å; D123-Y125 PolarHBondContact O-N 2.94Å; Y125-Q127 PolarHBondContact O-N 3.12Å; Y125-S128 WeakPolarHBondContact O-CA 3.28Å; Y125-S128 VanDerWaalsContact O-CB 3.29Å; Y125-S128 WeakPolarHBondContact O-CB 3.39Å; Y125-S128 PolarHBondContact O-N 3.26Å; Y125-S128 PolarHBondContact O-OG 3.4Å; Y125-L130 HydrophobicContact CD1-CD2 3.82Å; Y125-L130 HydrophobicContact CE1-CD2 3.42Å; Y125-L130 VanDerWaalsContact CE1-CD2 3.42Å; Y125-L130 HydrophobicContact CE2-CD2 4.24Å; Y125-L130 HydrophobicContact CG-CD2 4.38Å; Y125-L130 WeakPolarHBondContact O-CD2 3.47Å; Y125-E136 VanDerWaalsContact CE1-OE2 3.3Å; Y125-E136 WeakPolarHBondContact CE1-OE2 3.48Å; Y125-E136 PolarHBondContact OH-OE2 3.31Å; Y125-L140 HydrophobicContact CD1-CD1 3.56Å; Y125-L140 HydrophobicContact CE1-CD1 3.61Å; Y125-W172 HydrophobicContact CD2-CD2 4.01Å; Y125-W172 AromaticContact CD2-CE3 3.73Å; Y125-W172 HydrophobicContact CD2-CE3 3.73Å; Y125-W172 AromaticContact CD2-CH2 3.94Å; Y125-W172 HydrophobicContact CD2-CH2 3.94Å; Y125-W172 HydrophobicContact CD2-CZ2 4.23Å; Y125-W172 AromaticContact CD2-CZ3 3.66Å; Y125-W172 HydrophobicContact CD2-CZ3 3.66Å; Y125-W172 HydrophobicContact CE2-CE3 4.46Å; Y125-W172 HydrophobicContact CE2-CZ3 4.34Å; Y125-W172 HydrophobicContact CG-CH2 4.41Å; Y125-W172 HydrophobicContact CG-CZ2 4.41Å; Y125-N179 HydrophobicContact CD2-CB 4.43Å; Y125-N179 HydrophobicContact CE2-CB 3.92Å; Y125-R180 VanDerWaalsContact OH-CA 3.29Å; Y125-R180 WeakPolarHBondContact OH-CA 3.11Å; Y125-M183 HydrophobicContact CD1-CB 4.46Å; Y125-M183 HydrophobicContact CD1-CE 3.77Å; Y125-M183 HydrophobicContact CD1-CG 4Å; Y125-M183 HydrophobicContact CD2-CB 3.8Å; Y125-M183 HydrophobicContact CD2-CE 3.9Å; Y125-M183 HydrophobicContact CD2-CG 4.19Å; Y125-M183 HydrophobicContact CE1-CB 4.26Å; Y125-M183 HydrophobicContact CE1-CG 3.93Å; Y125-M183 HydrophobicContact CE2-CB 3.53Å; Y125-M183 HydrophobicContact CE2-CG 4.1Å; Y125-M183 HydrophobicContact CG-CB 4.24Å; Y125-M183 HydrophobicContact CG-CE 3.34Å; Y125-M183 HydrophobicContact CG-CG 4.12Å
126	L	95.4	Very high	94.1	Very high	33 Å²	33	46.8 Å²	46.8	17%	0.173	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-17.1	179.7	-69.7	176.5	0	0	0	113	I122 D123 L130 K137 L140 L144	I122-L126 HydrophobicContact CG2-CD1 3.92Å; I122-L126 HydrophobicContact CG2-CG 4.36Å; I122-L126 VanDerWaalsContact O-CG 3.25Å; I122-L126 WeakPolarHBondContact O-CG 3.25Å; I122-L126 PolarHBondContact O-N 2.95Å; D123-L126 PolarHBondContact O-N 3.22Å; L126-L130 HydrophobicContact CD2-CD1 4.36Å; L126-K137 HydrophobicContact CD2-CG 3.95Å; L126-L140 HydrophobicContact CD1-CB 4.39Å; L126-L140 HydrophobicContact CD2-CB 4.24Å; L126-L140 HydrophobicContact CD2-CD1 4.07Å; L126-L144 HydrophobicContact CD1-CD2 4.17Å
127	Q	93.4	Very high	94.3	Very high	142 Å²	142	50.6 Å²	50.6	66%	0.664	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.3	171.7	-62.7	171.5	29.8	0	0	113.2	D123 T124 Y125	D123-Q127 WeakPolarHBondContact O-CG 3.44Å; D123-Q127 PolarHBondContact O-N 3.48Å; D123-Q127 PolarHBondContact OD2-NE2 3.44Å; T124-Q127 PolarHBondContact O-N 2.81Å; Y125-Q127 PolarHBondContact O-N 3.12Å
128	S	92.9	Very high	94.4	Very high	18 Å²	18	54.3 Å²	54.3	13%	0.126	28%	0.279	C	S	.	.	S	Bend	trans	-84.5	171.4	178.8	82.1	0	0	0	0	112.1	T124 Y125 L130	T124-S128 PolarHBondContact O-N 3.48Å; Y125-S128 WeakPolarHBondContact O-CA 3.28Å; Y125-S128 VanDerWaalsContact O-CB 3.29Å; Y125-S128 WeakPolarHBondContact O-CB 3.39Å; Y125-S128 PolarHBondContact O-N 3.26Å; Y125-S128 PolarHBondContact O-OG 3.4Å; S128-L130 PolarHBondContact O-N 2.97Å; S128-L130 VanDerWaalsContact O-N 3.08Å
129	P	93.9	Very high	94.4	Very high	68 Å²	68	55.8 Å²	55.8	44%	0.442	29%	0.287	S	S	.	.			trans	-60	112.1	170.1	-24	35.7	0	0	0	111.7	S176	P129-S176 WeakPolarHBondContact O-CA 3.49Å; P129-S176 WeakPolarHBondContact O-CB 3.46Å
130	L	94.1	Very high	94.5	Very high	25 Å²	25	53.9 Å²	53.9	13%	0.131	28%	0.278	C	S	.	.			trans	-93.1	153.1	179	-60	178.8	0	0	0	111.7	Y125 L126 S128 P133 K137	Y125-L130 HydrophobicContact CD1-CD2 3.82Å; Y125-L130 HydrophobicContact CE1-CD2 3.42Å; Y125-L130 VanDerWaalsContact CE1-CD2 3.42Å; Y125-L130 HydrophobicContact CE2-CD2 4.24Å; Y125-L130 HydrophobicContact CG-CD2 4.38Å; Y125-L130 WeakPolarHBondContact O-CD2 3.47Å; L126-L130 HydrophobicContact CD2-CD1 4.36Å; S128-L130 PolarHBondContact O-N 2.97Å; S128-L130 VanDerWaalsContact O-N 3.08Å; L130-P133 HydrophobicContact CB-CB 4.25Å; L130-P133 HydrophobicContact CB-CG 4.03Å; L130-P133 HydrophobicContact CD1-CB 4.15Å; L130-K137 HydrophobicContact CD1-CG 4.17Å
131	H	91.5	Very high	94.7	Very high	90 Å²	90	53.6 Å²	53.6	42%	0.417	28%	0.282	S	S	.	.	S	Bend	trans	-80.7	-43.4	178.4	177.3	64.4	0	0	0	111.5	E136	H131-E136 WeakPolarHBondContact CA-OE1 3.42Å; H131-E136 WeakPolarHBondContact CB-OE1 3.26Å; H131-E136 PolarHBondContact N-OE1 3.08Å
132	K	92.2	Very high	94.8	Very high	84 Å²	84	57 Å²	57	37%	0.365	30%	0.304	S	S	.	.	S	Bend	trans	-134	80.5	174.8	-67.3	-178.7	-171.2	176.4	0	109.2	D62 E134 K135 E136	D62-K132 IonicContact OD1-NZ 2.69Å; K132-E134 PolarHBondContact O-N 3.34Å; K132-K135 HydrophobicContact CB-CB 4.15Å; K132-K135 HydrophobicContact CB-CG 4.38Å; K132-K135 HydrophobicContact CD-CD 4.09Å; K132-K135 PolarHBondContact O-N 3.38Å; K132-K135 VanDerWaalsContact O-N 3.15Å; K132-E136 PolarHBondContact N-OE1 3.06Å; K132-E136 WeakPolarHBondContact O-CG 3.32Å; K132-E136 PolarHBondContact O-N 2.87Å
133	P	94.4	Very high	94.9	Very high	56 Å²	56	57.1 Å²	57.1	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-49.8	-51.2	-168.4	-26.8	30.3	0	0	0	114.7	L130 K135 E136 K137	L130-P133 HydrophobicContact CB-CB 4.25Å; L130-P133 HydrophobicContact CB-CG 4.03Å; L130-P133 HydrophobicContact CD1-CB 4.15Å; P133-K135 PolarHBondContact O-N 3.1Å; P133-E136 PolarHBondContact O-N 2.62Å; P133-K137 VanDerWaalsContact O-CB 3.29Å; P133-K137 WeakPolarHBondContact O-CB 3.42Å; P133-K137 WeakPolarHBondContact O-CD 3.45Å; P133-K137 WeakPolarHBondContact O-CG 3.48Å; P133-K137 PolarHBondContact O-N 2.88Å
134	E	95.8	Very high	95	Very high	136 Å²	136	55.1 Å²	55.1	64%	0.636	29%	0.294	S	S	*	.	H	α-helix	trans	-60.9	-47.9	-177.9	-62.7	-50.5	126	0	0	112	K132 E136 K137 T138	K132-E134 PolarHBondContact O-N 3.34Å; E134-E136 PolarHBondContact O-N 3.23Å; E134-K137 PolarHBondContact O-N 3.46Å; E134-T138 WeakPolarHBondContact O-CB 3.16Å; E134-T138 PolarHBondContact O-N 3.42Å; E134-T138 PolarHBondContact O-OG1 3.26Å
135	K	94.7	Very high	95.2	Very high	101 Å²	101	54.1 Å²	54.1	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-43.3	-177.7	-62.2	-156.3	179	-164.6	0	112.4	D62 K132 P133 T138 L139	D62-K135 HydrophobicContact CB-CB 4.15Å; D62-K135 HydrophobicContact CB-CD 4.1Å; D62-K135 WeakPolarHBondContact OD1-CD 3.44Å; D62-K135 IonicContact OD1-NZ 3.88Å; D62-K135 PolarHBondContact OD1-NZ 2.79Å; D62-K135 VanDerWaalsContact OD2-CD 3.25Å; D62-K135 WeakPolarHBondContact OD2-CD 3.47Å; D62-K135 IonicContact OD2-NZ 3.6Å; D62-K135 PolarHBondContact OD2-NZ 3.01Å; K132-K135 HydrophobicContact CB-CB 4.15Å; K132-K135 HydrophobicContact CB-CG 4.38Å; K132-K135 HydrophobicContact CD-CD 4.09Å; K132-K135 PolarHBondContact O-N 3.38Å; K132-K135 VanDerWaalsContact O-N 3.15Å; P133-K135 PolarHBondContact O-N 3.1Å; K135-T138 PolarHBondContact O-N 2.93Å; K135-L139 VanDerWaalsContact O-CB 3.22Å; K135-L139 WeakPolarHBondContact O-CB 2.94Å; K135-L139 PolarHBondContact O-N 2.59Å
136	E	94.8	Very high	95.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-70	-38.4	-178.2	-66.1	-178.8	-122.6	0	0	111.8	Y125 H131 K132 P133 E134 L139 L140	Y125-E136 VanDerWaalsContact CE1-OE2 3.3Å; Y125-E136 WeakPolarHBondContact CE1-OE2 3.48Å; Y125-E136 PolarHBondContact OH-OE2 3.31Å; H131-E136 WeakPolarHBondContact CA-OE1 3.42Å; H131-E136 WeakPolarHBondContact CB-OE1 3.26Å; H131-E136 PolarHBondContact N-OE1 3.08Å; K132-E136 PolarHBondContact N-OE1 3.06Å; K132-E136 WeakPolarHBondContact O-CG 3.32Å; K132-E136 PolarHBondContact O-N 2.87Å; P133-E136 PolarHBondContact O-N 2.62Å; E134-E136 PolarHBondContact O-N 3.23Å; E136-L139 PolarHBondContact O-N 2.97Å; E136-L140 WeakPolarHBondContact O-CB 3.38Å; E136-L140 PolarHBondContact O-N 2.87Å
137	K	96.1	Very high	95.4	Very high	97 Å²	97	53.5 Å²	53.5	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-62.6	-48.5	172.4	-74.6	171.9	-178.1	-179.5	0	111.8	L126 L130 P133 E134 L139 G141	L126-K137 HydrophobicContact CD2-CG 3.95Å; L130-K137 HydrophobicContact CD1-CG 4.17Å; P133-K137 VanDerWaalsContact O-CB 3.29Å; P133-K137 WeakPolarHBondContact O-CB 3.42Å; P133-K137 WeakPolarHBondContact O-CD 3.45Å; P133-K137 WeakPolarHBondContact O-CG 3.48Å; P133-K137 PolarHBondContact O-N 2.88Å; E134-K137 PolarHBondContact O-N 3.46Å; K137-L139 PolarHBondContact O-N 3.38Å; K137-G141 WeakPolarHBondContact O-CA 3.16Å; K137-G141 PolarHBondContact O-N 3.39Å
138	T	95.9	Very high	95.5	Very high	106 Å²	106	50.9 Å²	50.9	65%	0.65	28%	0.278	S	S	*	.	H	α-helix	trans	-60.5	-35.2	176.7	-60	0	0	0	0	111.9	E134 K135 P142	E134-T138 WeakPolarHBondContact O-CB 3.16Å; E134-T138 PolarHBondContact O-N 3.42Å; E134-T138 PolarHBondContact O-OG1 3.26Å; K135-T138 PolarHBondContact O-N 2.93Å; T138-P142 WeakPolarHBondContact O-CD 3.37Å
139	L	95.2	Very high	95.5	Very high	33 Å²	33	53.5 Å²	53.5	17%	0.173	29%	0.29	C	S	.	.	H	α-helix	trans	-75.9	-44.8	-178.5	-173.2	67.2	0	0	0	113.2	V57 S60 L63 K135 E136 K137	V57-L139 HydrophobicContact CB-CG 4.45Å; V57-L139 HydrophobicContact CG1-CD2 4.25Å; V57-L139 HydrophobicContact CG1-CG 4.39Å; V57-L139 HydrophobicContact CG2-CD1 4.46Å; V57-L139 HydrophobicContact CG2-CG 4.13Å; V57-L139 WeakPolarHBondContact CG2-O 3.37Å; S60-L139 WeakPolarHBondContact OG-CD2 3.25Å; L63-L139 HydrophobicContact CB-CD2 3.61Å; K135-L139 VanDerWaalsContact O-CB 3.22Å; K135-L139 WeakPolarHBondContact O-CB 2.94Å; K135-L139 PolarHBondContact O-N 2.59Å; E136-L139 PolarHBondContact O-N 2.97Å; K137-L139 PolarHBondContact O-N 3.38Å
140	L	96.7	Very high	95.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-87.6	-26.1	-175.4	-71.5	170.9	0	0	0	113.3	V57 L63 I122 Y125 L126 E136 T143 L144 M183 M187	V57-L140 HydrophobicContact CG1-CD2 3.95Å; V57-L140 HydrophobicContact CG2-CD2 4.19Å; L63-L140 HydrophobicContact CD1-CD1 4.42Å; L63-L140 HydrophobicContact CD2-CD2 4.11Å; I122-L140 HydrophobicContact CG2-CB 3.96Å; Y125-L140 HydrophobicContact CD1-CD1 3.56Å; Y125-L140 HydrophobicContact CE1-CD1 3.61Å; L126-L140 HydrophobicContact CD1-CB 4.39Å; L126-L140 HydrophobicContact CD2-CB 4.24Å; L126-L140 HydrophobicContact CD2-CD1 4.07Å; E136-L140 WeakPolarHBondContact O-CB 3.38Å; E136-L140 PolarHBondContact O-N 2.87Å; L140-T143 WeakPolarHBondContact O-CB 3.49Å; L140-T143 PolarHBondContact O-N 3.39Å; L140-T143 VanDerWaalsContact O-N 3.1Å; L140-L144 PolarHBondContact O-N 3.26Å; L140-M183 HydrophobicContact CD1-CG 4.2Å; L140-M187 HydrophobicContact CD2-CE 4.39Å; L140-M187 HydrophobicContact CD2-CG 4.32Å; L140-M187 HydrophobicContact CD2-SD 4.05Å
141	G	97	Very high	95.3	Very high	30 Å²	30	52.2 Å²	52.2	31%	0.309	28%	0.275	S	S	.	.	H	α-helix	trans	-52.4	-48.7	-179.2	0	0	0	0	0	114.1	K137 T143 L144 G145	K137-G141 WeakPolarHBondContact O-CA 3.16Å; K137-G141 PolarHBondContact O-N 3.39Å; G141-T143 VanDerWaalsContact C-N 3.32Å; G141-T143 PolarHBondContact O-N 2.89Å; G141-L144 PolarHBondContact O-N 3.48Å; G141-G145 PolarHBondContact O-N 3.47Å
142	P	96.9	Very high	95.3	Very high	74 Å²	74	56.1 Å²	56.1	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-41.3	176.3	-26.7	35.5	0	0	0	113.2	T138 G145 V146	T138-P142 WeakPolarHBondContact O-CD 3.37Å; P142-G145 PolarHBondContact O-N 3.3Å; P142-V146 WeakPolarHBondContact O-CG2 3.34Å; P142-V146 PolarHBondContact O-N 3Å
143	T	97.7	Very high	95	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.3	-59.8	0	0	0	0	110.9	L50 S53 V54 I122 L140 G141 G145 V146 I147 M187 F190	L50-T143 HydrophobicContact CD1-CG2 4.26Å; S53-T143 WeakPolarHBondContact CB-OG1 3.21Å; V54-T143 HydrophobicContact CG2-CG2 3.8Å; I122-T143 HydrophobicContact CD1-CG2 3.91Å; L140-T143 WeakPolarHBondContact O-CB 3.49Å; L140-T143 PolarHBondContact O-N 3.39Å; L140-T143 VanDerWaalsContact O-N 3.1Å; G141-T143 VanDerWaalsContact C-N 3.32Å; G141-T143 PolarHBondContact O-N 2.89Å; T143-G145 VanDerWaalsContact C-N 3.34Å; T143-G145 PolarHBondContact O-N 3.16Å; T143-V146 PolarHBondContact O-N 2.78Å; T143-I147 HydrophobicContact CG2-CD1 4.2Å; T143-I147 WeakPolarHBondContact O-CG1 3.11Å; T143-I147 PolarHBondContact O-N 3.11Å; T143-I147 VanDerWaalsContact O-N 3.08Å; T143-M187 HydrophobicContact CG2-CE 4.24Å; T143-F190 HydrophobicContact CG2-CE1 3.98Å
144	L	97.7	Very high	94.6	Very high	18 Å²	18	53 Å²	53	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-59.3	-44.9	176.5	-178.3	59.6	0	0	0	111.7	Q119 I122 L126 L140 G141 I147 Q148	Q119-L144 HydrophobicContact CG-CD1 3.81Å; I122-L144 HydrophobicContact CB-CD1 4.37Å; I122-L144 HydrophobicContact CG2-CB 3.96Å; I122-L144 HydrophobicContact CG2-CD1 4.31Å; I122-L144 HydrophobicContact CG2-CD2 4.37Å; I122-L144 HydrophobicContact CG2-CG 4.45Å; L126-L144 HydrophobicContact CD1-CD2 4.17Å; L140-L144 PolarHBondContact O-N 3.26Å; G141-L144 PolarHBondContact O-N 3.48Å; L144-I147 PolarHBondContact O-N 3Å; L144-Q148 WeakPolarHBondContact O-CG 3.24Å; L144-Q148 PolarHBondContact O-N 3.24Å
145	G	97.7	Very high	93.4	Very high	24 Å²	24	50 Å²	50	25%	0.247	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-46.3	177	0	0	0	0	0	112.5	G141 P142 T143 I147 Q148 D149	G141-G145 PolarHBondContact O-N 3.47Å; P142-G145 PolarHBondContact O-N 3.3Å; T143-G145 VanDerWaalsContact C-N 3.34Å; T143-G145 PolarHBondContact O-N 3.16Å; G145-I147 VanDerWaalsContact C-N 3.32Å; G145-I147 PolarHBondContact O-N 3.37Å; G145-Q148 WeakPolarHBondContact O-CB 3.42Å; G145-Q148 PolarHBondContact O-N 3.16Å; G145-D149 PolarHBondContact O-N 2.82Å
146	V	97.8	Very high	91.7	Very high	20 Å²	20	51.1 Å²	51.1	12%	0.121	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-38.6	177.5	175.9	0	0	0	0	112	L46 L50 P142 T143 D149 L150	L46-V146 WeakPolarHBondContact O-CG1 3.25Å; L50-V146 HydrophobicContact CB-CG1 3.78Å; L50-V146 HydrophobicContact CD1-CG1 4.2Å; P142-V146 WeakPolarHBondContact O-CG2 3.34Å; P142-V146 PolarHBondContact O-N 3Å; T143-V146 PolarHBondContact O-N 2.78Å; V146-D149 PolarHBondContact O-N 3.3Å; V146-L150 HydrophobicContact CG1-CD1 4.14Å; V146-L150 WeakPolarHBondContact O-CB 3.31Å; V146-L150 WeakPolarHBondContact O-CG 3.36Å; V146-L150 PolarHBondContact O-N 2.94Å
147	I	96.6	Very high	89.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-43.8	175.9	-63.9	166.2	0	0	0	110.9	L50 L115 Q119 I122 T143 L144 G145 D149 L150 R151 F190	L50-I147 HydrophobicContact CD1-CG1 3.69Å; L115-I147 HydrophobicContact CB-CG2 4.1Å; L115-I147 HydrophobicContact CD2-CG2 4.42Å; L115-I147 WeakPolarHBondContact O-CG2 3.35Å; Q119-I147 HydrophobicContact CB-CG2 3.8Å; Q119-I147 HydrophobicContact CG-CG2 4.45Å; I122-I147 HydrophobicContact CD1-CD1 3.8Å; T143-I147 HydrophobicContact CG2-CD1 4.2Å; T143-I147 WeakPolarHBondContact O-CG1 3.11Å; T143-I147 PolarHBondContact O-N 3.11Å; T143-I147 VanDerWaalsContact O-N 3.08Å; L144-I147 PolarHBondContact O-N 3Å; G145-I147 VanDerWaalsContact C-N 3.32Å; G145-I147 PolarHBondContact O-N 3.37Å; I147-D149 VanDerWaalsContact C-N 3.34Å; I147-L150 PolarHBondContact O-N 3.44Å; I147-R151 HydrophobicContact CG2-CG 4.44Å; I147-R151 WeakPolarHBondContact O-CG 3.44Å; I147-R151 PolarHBondContact O-N 3.25Å; I147-F190 HydrophobicContact CD1-CE1 3.74Å; I147-F190 HydrophobicContact CD1-CZ 3.88Å; I147-F190 HydrophobicContact CG1-CE1 4.3Å; I147-F190 HydrophobicContact CG1-CZ 4.1Å
148	Q	95.1	Very high	87.3	Confident	87 Å²	87	58.2 Å²	58.2	41%	0.407	32%	0.318	S	S	.	.	H	α-helix	trans	-61.3	-44.3	177.4	-70.7	170.8	-12.3	0	0	111.1	L144 G145 L150 R151 K152	L144-Q148 WeakPolarHBondContact O-CG 3.24Å; L144-Q148 PolarHBondContact O-N 3.24Å; G145-Q148 WeakPolarHBondContact O-CB 3.42Å; G145-Q148 PolarHBondContact O-N 3.16Å; Q148-L150 PolarHBondContact O-N 2.96Å; Q148-R151 PolarHBondContact O-N 3.05Å; Q148-K152 VanDerWaalsContact O-CB 3.3Å; Q148-K152 WeakPolarHBondContact O-CB 3.45Å; Q148-K152 PolarHBondContact O-N 2.98Å
149	D	94.7	Very high	84.6	Confident	74 Å²	74	59.6 Å²	59.6	40%	0.396	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-42	176.2	-74.7	-24.3	0	0	0	112.2	L46 G145 V146 I147 K152 N153	L46-D149 HydrophobicContact CD1-CB 4.28Å; L46-D149 HydrophobicContact CD2-CB 4Å; G145-D149 PolarHBondContact O-N 2.82Å; V146-D149 PolarHBondContact O-N 3.3Å; I147-D149 VanDerWaalsContact C-N 3.34Å; D149-K152 PolarHBondContact O-N 2.88Å; D149-N153 VanDerWaalsContact O-CB 3.25Å; D149-N153 WeakPolarHBondContact O-CB 3.43Å; D149-N153 PolarHBondContact O-N 3Å; D149-N153 PolarHBondContact O-ND2 3.34Å
150	L	93.6	Very high	81.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-49.4	175.3	-82	167.9	0	0	0	111.5	L46 F47 L50 L115 V146 I147 Q148 K152 C154	L46-L150 HydrophobicContact CB-CD2 3.38Å; L46-L150 HydrophobicContact CB-CG 3.81Å; L46-L150 HydrophobicContact CD1-CD2 4.34Å; L46-L150 HydrophobicContact CG-CD2 4.5Å; F47-L150 HydrophobicContact CD1-CD1 3.82Å; F47-L150 HydrophobicContact CD1-CD2 3.72Å; F47-L150 HydrophobicContact CD1-CG 4.45Å; F47-L150 HydrophobicContact CD2-CD2 3.79Å; F47-L150 HydrophobicContact CE1-CD1 3.99Å; F47-L150 HydrophobicContact CE1-CD2 3.74Å; F47-L150 HydrophobicContact CE1-CG 4.44Å; F47-L150 HydrophobicContact CE2-CD2 3.79Å; F47-L150 HydrophobicContact CG-CD1 4.49Å; F47-L150 HydrophobicContact CG-CD2 3.76Å; F47-L150 HydrophobicContact CZ-CD2 3.78Å; L50-L150 HydrophobicContact CB-CD1 3.98Å; L50-L150 HydrophobicContact CD2-CD1 3.77Å; L50-L150 HydrophobicContact CG-CD1 4.33Å; L115-L150 HydrophobicContact CD1-CB 3.88Å; L115-L150 HydrophobicContact CD1-CD1 4.2Å; L115-L150 HydrophobicContact CD2-CD1 4.3Å; V146-L150 HydrophobicContact CG1-CD1 4.14Å; V146-L150 WeakPolarHBondContact O-CB 3.31Å; V146-L150 WeakPolarHBondContact O-CG 3.36Å; V146-L150 PolarHBondContact O-N 2.94Å; I147-L150 PolarHBondContact O-N 3.44Å; Q148-L150 PolarHBondContact O-N 2.96Å; L150-K152 VanDerWaalsContact C-N 3.3Å; L150-K152 PolarHBondContact O-N 3.06Å; L150-C154 HydrophobicContact CD2-CB 4.41Å; L150-C154 WeakPolarHBondContact O-CA 3.38Å; L150-C154 WeakPolarHBondContact O-CB 3.33Å; L150-C154 PolarHBondContact O-N 3.44Å
151	R	90.2	Very high	79.4	Confident	65 Å²	65	69.9 Å²	69.9	25%	0.245	39%	0.392	C	S	.	.	H	α-helix	trans	-65.8	-35.4	-178.5	-69.8	-177.8	72.5	-163.1	2.5	112.2	L115 Q119 I147 Q148 S155	L115-R151 HydrophobicContact CB-CG 4.05Å; L115-R151 HydrophobicContact CD1-CG 4.36Å; Q119-R151 VanDerWaalsContact CD-NH1 3.31Å; I147-R151 HydrophobicContact CG2-CG 4.44Å; I147-R151 WeakPolarHBondContact O-CG 3.44Å; I147-R151 PolarHBondContact O-N 3.25Å; Q148-R151 PolarHBondContact O-N 3.05Å; R151-S155 PolarHBondContact O-OG 3.44Å
152	K	89.7	Confident	76.8	Confident	172 Å²	172	75.7 Å²	75.7	75%	0.748	41%	0.411	S	S	*	.	H	α-helix	trans	-74.1	-44.2	179.1	-174.6	178.3	178	-178.4	0	112.8	Q148 D149 L150	Q148-K152 VanDerWaalsContact O-CB 3.3Å; Q148-K152 WeakPolarHBondContact O-CB 3.45Å; Q148-K152 PolarHBondContact O-N 2.98Å; D149-K152 PolarHBondContact O-N 2.88Å; L150-K152 VanDerWaalsContact C-N 3.3Å; L150-K152 PolarHBondContact O-N 3.06Å
153	N	87.5	Confident	74.4	Confident	70 Å²	70	76.8 Å²	76.8	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-100.9	-15.1	-168.1	-55.9	-50.6	0	0	0	113.7	L46 D149	L46-N153 HydrophobicContact CD1-CB 4.41Å; D149-N153 VanDerWaalsContact O-CB 3.25Å; D149-N153 WeakPolarHBondContact O-CB 3.43Å; D149-N153 PolarHBondContact O-N 3Å; D149-N153 PolarHBondContact O-ND2 3.34Å
154	C	85.5	Confident	71.7	Confident	6 Å²	6	79.2 Å²	79.2	4%	0.041	43%	0.429	C	S	.	.			trans	-123.1	11.5	-172.3	-55.9	0	0	0	0	114.4	C43 M112 L150 L156	C43-C154 WeakPolarHBondContact CA-SG 3.45Å; C43-C154 HydrophobicContact CB-CB 3.82Å; C43-C154 WeakPolarHBondContact CB-SG 3.42Å; C43-C154 WeakPolarHBondContact SG-CA 3.01Å; C43-C154 WeakPolarHBondContact SG-CB 3.38Å; C43-C154 CovalentContact SG-SG 2.03Å; C43-C154 PolarHBondContact SG-SG 3.04Å; M112-C154 HydrophobicContact CE-CB 4.38Å; M112-C154 WeakPolarHBondContact CE-O 3.47Å; L150-C154 HydrophobicContact CD2-CB 4.41Å; L150-C154 WeakPolarHBondContact O-CA 3.38Å; L150-C154 WeakPolarHBondContact O-CB 3.33Å; L150-C154 PolarHBondContact O-N 3.44Å; C154-L156 PolarHBondContact O-N 3.27Å
155	S	70.7	Confident	69.3	Low	71 Å²	71	85.8 Å²	85.8	50%	0.497	46%	0.458	S	S	.	.			trans	-69.9	114.5	171.1	-74.7	0	0	0	0	109.7	R151	R151-S155 PolarHBondContact O-OG 3.44Å
156	L	58.7	Low	67	Low	125 Å²	125	93.1 Å²	93.1	65%	0.654	49%	0.486	S	S	*	.			trans	-95.8	3.3	179.3	-67.8	169.3	0	0	0	113.2	V108 C154	V108-L156 HydrophobicContact CG1-CB 4.24Å; V108-L156 HydrophobicContact CG1-CD1 4.16Å; V108-L156 HydrophobicContact CG2-CD1 4.25Å; C154-L156 PolarHBondContact O-N 3.27Å
157	V	52.2	Low	64.8	Low	64 Å²	64	95.8 Å²	95.8	39%	0.388	50%	0.499	S	S	.	.			trans	-108.9	108.2	-178.4	-176.6	0	0	0	0	109.2
158	E	46.5	Very low	63.2	Low	183 Å²	183	98 Å²	98	86%	0.855	52%	0.517	S	S	*	.			trans	-76.8	136.2	152.5	-72.2	-172.5	170.5	0	0	107.7
159	T	39.3	Very low	61.8	Low	135 Å²	135	94.4 Å²	94.4	83%	0.828	50%	0.501	S	S	*	.	S	Bend	trans	101.7	118.1	170.3	-36.7	0	0	0	0	116.6
160	G	37.6	Very low	60.3	Low	67 Å²	67	92.9 Å²	92.9	69%	0.691	50%	0.503	S	S	*	.			trans	92.1	90.7	149.3	0	0	0	0	0	114.5	H162	G160-H162 PolarHBondContact O-N 3.38Å
161	E	44.1	Very low	59.7	Low	181 Å²	181	104.1 Å²	104.1	85%	0.846	55%	0.546	S	S	*	.			trans	-49.7	105.8	162.8	-62.6	-179	146.5	0	0	110.2
162	H	44	Very low	59.7	Low	153 Å²	153	102.4 Å²	102.4	71%	0.708	54%	0.539	S	S	*	.			trans	-133.2	63	150.4	-138.4	-84.1	0	0	0	108.1	G160 S164	G160-H162 PolarHBondContact O-N 3.38Å; H162-S164 PolarHBondContact O-N 3.04Å
163	N	45	Very low	59.6	Low	96 Å²	96	98.8 Å²	98.8	51%	0.513	53%	0.525	S	S	.	.			trans	-72.3	72.4	157	-63.8	-53.7	0	0	0	106.3	F165	N163-F165 VanDerWaalsContact C-N 3.32Å; N163-F165 HydrophobicContact CB-CE2 4.47Å; N163-F165 WeakPolarHBondContact O-CD2 3.5Å; N163-F165 PolarHBondContact O-N 2.87Å
164	S	42.4	Very low	59.7	Low	52 Å²	52	100.9 Å²	100.9	36%	0.364	55%	0.545	S	S	.	.			trans	-63.5	104	167.5	50.1	0	0	0	0	106.5	H162 E166	H162-S164 PolarHBondContact O-N 3.04Å; S164-E166 PolarHBondContact O-N 2.87Å
165	F	47.2	Very low	60	Low	157 Å²	157	103.4 Å²	103.4	69%	0.689	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-61.5	0.8	173.2	-88.1	-94.1	0	0	0	112.9	N163 D167 A168	N163-F165 VanDerWaalsContact C-N 3.32Å; N163-F165 HydrophobicContact CB-CE2 4.47Å; N163-F165 WeakPolarHBondContact O-CD2 3.5Å; N163-F165 PolarHBondContact O-N 2.87Å; F165-D167 PolarHBondContact O-N 3.46Å; F165-A168 WeakPolarHBondContact O-CB 3.38Å; F165-A168 PolarHBondContact O-N 3.2Å; F165-A168 VanDerWaalsContact O-N 3.07Å
166	E	48.2	Very low	61	Low	178 Å²	178	101.6 Å²	101.6	83%	0.832	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-61.9	-23.4	-179	-61.7	-168	157.1	0	0	113.1	S164	S164-E166 PolarHBondContact O-N 2.87Å
167	D	53.2	Low	62.5	Low	75 Å²	75	100.7 Å²	100.7	40%	0.401	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-89.9	4.3	176.7	-73.2	-16.2	0	0	0	113.7	R76 Y117 F165	R76-D167 HydrophobicContact CG-CB 4.19Å; R76-D167 IonicContact NH1-OD2 3.88Å; R76-D167 PolarHBondContact NH1-OD2 3.16Å; Y117-D167 HydrophobicContact CD2-CB 4.42Å; Y117-D167 WeakPolarHBondContact CD2-O 3.05Å; Y117-D167 WeakPolarHBondContact CE2-O 3.35Å; F165-D167 PolarHBondContact O-N 3.46Å
168	A	61	Low	64.3	Low	47 Å²	47	102.3 Å²	102.3	39%	0.388	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-55.7	130.3	-174.8	0	0	0	0	0	110.8	T120 F165 G170	T120-A168 HydrophobicContact CG2-CB 4.26Å; F165-A168 WeakPolarHBondContact O-CB 3.38Å; F165-A168 PolarHBondContact O-N 3.2Å; F165-A168 VanDerWaalsContact O-N 3.07Å; A168-G170 PolarHBondContact O-N 3.44Å
169	P	65.6	Low	66.5	Low	11 Å²	11	93.6 Å²	93.6	7%	0.071	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-57.6	120.3	-179.4	24.1	-32.7	0	0	0	108	Y117 A121 M186	Y117-P169 HydrophobicContact CE2-CB 3.97Å; Y117-P169 HydrophobicContact CE2-CG 4.27Å; A121-P169 VanDerWaalsContact CA-CG 3.46Å; A121-P169 HydrophobicContact CB-CB 4.36Å; A121-P169 HydrophobicContact CB-CG 3.55Å; P169-M186 HydrophobicContact CB-CE 3.36Å; P169-M186 HydrophobicContact CB-SD 3.83Å; P169-M186 HydrophobicContact CG-CE 3.82Å
170	G	64.6	Low	69	Low	42 Å²	42	87.9 Å²	87.9	43%	0.433	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-47.5	155.6	-164.4	0	0	0	0	0	113.9	A168 K182	A168-G170 PolarHBondContact O-N 3.44Å; G170-K182 PolarHBondContact O-NZ 3.03Å
171	R	80.7	Confident	71.4	Confident	236 Å²	236	87.8 Å²	87.8	89%	0.891	44%	0.442	S	S	*	.			trans	-44.9	139.7	-172.3	-160.3	175.6	-179.2	-170.5	0.2	113.6
172	W	89.8	Confident	73.6	Confident	29 Å²	29	82.2 Å²	82.2	11%	0.11	42%	0.415	C	S	.	.			trans	-70.9	143.1	170.6	-53.9	105.5	0	0	0	110.3	A121 T124 Y125 N179 K182 M183 M186	A121-W172 VanDerWaalsContact O-CZ2 3.23Å; A121-W172 WeakPolarHBondContact O-CZ2 3.47Å; T124-W172 VanDerWaalsContact C-CD1 3.45Å; T124-W172 VanDerWaalsContact O-CD1 3.3Å; T124-W172 PolarHBondContact OG1-NE1 3.39Å; Y125-W172 HydrophobicContact CD2-CD2 4.01Å; Y125-W172 AromaticContact CD2-CE3 3.73Å; Y125-W172 HydrophobicContact CD2-CE3 3.73Å; Y125-W172 AromaticContact CD2-CH2 3.94Å; Y125-W172 HydrophobicContact CD2-CH2 3.94Å; Y125-W172 HydrophobicContact CD2-CZ2 4.23Å; Y125-W172 AromaticContact CD2-CZ3 3.66Å; Y125-W172 HydrophobicContact CD2-CZ3 3.66Å; Y125-W172 HydrophobicContact CE2-CE3 4.46Å; Y125-W172 HydrophobicContact CE2-CZ3 4.34Å; Y125-W172 HydrophobicContact CG-CH2 4.41Å; Y125-W172 HydrophobicContact CG-CZ2 4.41Å; W172-N179 HydrophobicContact CE3-CB 4.17Å; W172-K182 HydrophobicContact CE3-CD 4.11Å; W172-K182 HydrophobicContact CH2-CD 4.47Å; W172-K182 HydrophobicContact CH2-CG 4.48Å; W172-K182 HydrophobicContact CZ3-CB 4.06Å; W172-K182 HydrophobicContact CZ3-CD 3.74Å; W172-K182 HydrophobicContact CZ3-CG 3.88Å; W172-M183 HydrophobicContact CH2-CB 4.31Å; W172-M183 HydrophobicContact CH2-CE 3.6Å; W172-M183 HydrophobicContact CZ2-CE 3.83Å; W172-M183 HydrophobicContact CZ3-CB 4.28Å; W172-M186 HydrophobicContact CH2-SD 3.75Å; W172-M186 HydrophobicContact CZ2-SD 4.36Å
173	E	88.2	Confident	76	Confident	96 Å²	96	74.9 Å²	74.9	45%	0.449	38%	0.382	S	S	.	.			trans	-85.3	175.4	-179	-64.7	179.5	-150.9	0	0	111.1	D175 K178 N179	E173-D175 VanDerWaalsContact C-N 3.27Å; E173-K178 WeakPolarHBondContact OE2-CD 3.46Å; E173-K178 IonicContact OE2-NZ 2.68Å; E173-K178 PolarHBondContact OE2-NZ 2.91Å; E173-N179 PolarHBondContact N-OD1 3.37Å; E173-N179 PolarHBondContact O-ND2 3.42Å
174	S	89.1	Confident	78.2	Confident	114 Å²	114	70.5 Å²	70.5	80%	0.797	36%	0.358	S	S	*	.	S	Bend	trans	-73.9	-20	170.4	52.2	0	0	0	0	113.1	S176	S174-S176 PolarHBondContact O-N 3.19Å
175	D	92.1	Very high	80.5	Confident	60 Å²	60	70 Å²	70	32%	0.321	35%	0.349	S	S	.	.			trans	-84.8	109.1	-178.6	-176.6	-27.4	0	0	0	110.9	E173 F177 K178 N179	E173-D175 VanDerWaalsContact C-N 3.27Å; D175-F177 VanDerWaalsContact C-N 3.29Å; D175-F177 PolarHBondContact O-N 2.91Å; D175-F177 WeakPolarHBondContact OD1-CA 3.31Å; D175-F177 WeakPolarHBondContact OD1-CB 3.48Å; D175-F177 PolarHBondContact OD1-N 3.26Å; D175-K178 HydrophobicContact CB-CB 4.12Å; D175-K178 HydrophobicContact CB-CD 3.99Å; D175-K178 HydrophobicContact CB-CG 4.12Å; D175-K178 PolarHBondContact O-N 3.11Å; D175-K178 PolarHBondContact OD1-N 3.2Å; D175-K178 VanDerWaalsContact OD1-N 3.11Å; D175-K178 WeakPolarHBondContact OD2-CE 3.48Å; D175-K178 WeakPolarHBondContact OD2-CG 3.4Å; D175-N179 VanDerWaalsContact O-CG 3.29Å; D175-N179 PolarHBondContact O-N 2.87Å; D175-N179 PolarHBondContact O-ND2 2.86Å
176	S	92.3	Very high	82.7	Confident	33 Å²	33	62.6 Å²	62.6	23%	0.231	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-27.9	-178.8	62.6	0	0	0	0	113.5	P129 S174 R180	P129-S176 WeakPolarHBondContact O-CA 3.49Å; P129-S176 WeakPolarHBondContact O-CB 3.46Å; S174-S176 PolarHBondContact O-N 3.19Å; S176-R180 VanDerWaalsContact O-CB 3.25Å; S176-R180 WeakPolarHBondContact O-CB 3.09Å; S176-R180 PolarHBondContact O-N 3.27Å
177	F	90.3	Very high	84.9	Confident	105 Å²	105	54.1 Å²	54.1	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-70.2	-45.8	176.1	175.1	-93.6	0	0	0	110.9	L67 D175 R180 Q181	L67-F177 HydrophobicContact CD2-CE1 4.48Å; L67-F177 HydrophobicContact CD2-CE2 3.74Å; L67-F177 HydrophobicContact CD2-CZ 3.65Å; D175-F177 VanDerWaalsContact C-N 3.29Å; D175-F177 PolarHBondContact O-N 2.91Å; D175-F177 WeakPolarHBondContact OD1-CA 3.31Å; D175-F177 WeakPolarHBondContact OD1-CB 3.48Å; D175-F177 PolarHBondContact OD1-N 3.26Å; F177-R180 PolarHBondContact O-N 3.06Å; F177-Q181 WeakPolarHBondContact O-CB 3.49Å; F177-Q181 PolarHBondContact O-N 2.05Å
178	K	89.4	Confident	86.7	Confident	98 Å²	98	53.2 Å²	53.2	43%	0.426	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175.7	-70.5	-178.5	-172.9	179.1	0	112.1	E173 D175 Q181 K182	E173-K178 WeakPolarHBondContact OE2-CD 3.46Å; E173-K178 IonicContact OE2-NZ 2.68Å; E173-K178 PolarHBondContact OE2-NZ 2.91Å; D175-K178 HydrophobicContact CB-CB 4.12Å; D175-K178 HydrophobicContact CB-CD 3.99Å; D175-K178 HydrophobicContact CB-CG 4.12Å; D175-K178 PolarHBondContact O-N 3.11Å; D175-K178 PolarHBondContact OD1-N 3.2Å; D175-K178 VanDerWaalsContact OD1-N 3.11Å; D175-K178 WeakPolarHBondContact OD2-CE 3.48Å; D175-K178 WeakPolarHBondContact OD2-CG 3.4Å; K178-Q181 WeakPolarHBondContact O-CB 3.38Å; K178-Q181 PolarHBondContact O-N 3.31Å; K178-K182 WeakPolarHBondContact O-CB 3.28Å; K178-K182 PolarHBondContact O-N 3.22Å
179	N	91.8	Very high	88.2	Confident	1 Å²	1	51 Å²	51	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-59.5	-48.7	174.9	-71.6	-18.3	0	0	0	111.2	Y125 W172 E173 D175 Q181 K182 M183	Y125-N179 HydrophobicContact CD2-CB 4.43Å; Y125-N179 HydrophobicContact CE2-CB 3.92Å; W172-N179 HydrophobicContact CE3-CB 4.17Å; E173-N179 PolarHBondContact N-OD1 3.37Å; E173-N179 PolarHBondContact O-ND2 3.42Å; D175-N179 VanDerWaalsContact O-CG 3.29Å; D175-N179 PolarHBondContact O-N 2.87Å; D175-N179 PolarHBondContact O-ND2 2.86Å; N179-Q181 VanDerWaalsContact C-N 3.3Å; N179-Q181 PolarHBondContact O-N 3.43Å; N179-K182 PolarHBondContact O-N 2.96Å; N179-M183 WeakPolarHBondContact O-CB 3.03Å; N179-M183 PolarHBondContact O-N 2.93Å
180	R	91.8	Very high	89.6	Confident	15 Å²	15	50.4 Å²	50.4	6%	0.057	25%	0.247	C	C	.	.	H	α-helix	trans	-58.6	-42.4	176.5	-177.2	179.9	173.7	-101.3	-2.8	111.9	E61 D62 L63 L67 Y125 S176 F177 M183 C184	E61-R180 PolarHBondContact O-NH2 3.39Å; D62-R180 VanDerWaalsContact C-NH2 3.28Å; D62-R180 VanDerWaalsContact O-CZ 3.28Å; D62-R180 PolarHBondContact O-NE 2.65Å; D62-R180 PolarHBondContact O-NH2 3.2Å; L63-R180 HydrophobicContact CD1-CG 4.33Å; L63-R180 PolarHBondContact O-NE 3.32Å; L67-R180 HydrophobicContact CD1-CG 4.11Å; Y125-R180 VanDerWaalsContact OH-CA 3.29Å; Y125-R180 WeakPolarHBondContact OH-CA 3.11Å; S176-R180 VanDerWaalsContact O-CB 3.25Å; S176-R180 WeakPolarHBondContact O-CB 3.09Å; S176-R180 PolarHBondContact O-N 3.27Å; F177-R180 PolarHBondContact O-N 3.06Å; R180-M183 PolarHBondContact O-N 2.93Å; R180-C184 WeakPolarHBondContact O-CB 3.35Å; R180-C184 PolarHBondContact O-N 3.18Å
181	Q	89.8	Confident	91.1	Very high	64 Å²	64	50.7 Å²	50.7	30%	0.299	24%	0.236	S	C	.	.	H	α-helix	trans	-61	-47.2	175.2	-172.2	178.5	25.7	0	0	112.1	L67 F177 K178 N179 C184 K185	L67-Q181 HydrophobicContact CD1-CB 4.45Å; L67-Q181 HydrophobicContact CD2-CB 4.02Å; L67-Q181 HydrophobicContact CD2-CG 4.09Å; F177-Q181 WeakPolarHBondContact O-CB 3.49Å; F177-Q181 PolarHBondContact O-N 2.05Å; K178-Q181 WeakPolarHBondContact O-CB 3.38Å; K178-Q181 PolarHBondContact O-N 3.31Å; N179-Q181 VanDerWaalsContact C-N 3.3Å; N179-Q181 PolarHBondContact O-N 3.43Å; Q181-C184 PolarHBondContact O-N 3.41Å; Q181-K185 WeakPolarHBondContact O-CG 3.33Å; Q181-K185 PolarHBondContact O-N 3.09Å; Q181-K185 VanDerWaalsContact O-N 3.09Å
182	K	90.3	Very high	91.8	Very high	64 Å²	64	42.4 Å²	42.4	28%	0.278	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-46.6	177.4	-177.5	179.1	-178.4	-179.7	0	111.4	G170 W172 K178 N179 C184 K185 M186	G170-K182 PolarHBondContact O-NZ 3.03Å; W172-K182 HydrophobicContact CE3-CD 4.11Å; W172-K182 HydrophobicContact CH2-CD 4.47Å; W172-K182 HydrophobicContact CH2-CG 4.48Å; W172-K182 HydrophobicContact CZ3-CB 4.06Å; W172-K182 HydrophobicContact CZ3-CD 3.74Å; W172-K182 HydrophobicContact CZ3-CG 3.88Å; K178-K182 WeakPolarHBondContact O-CB 3.28Å; K178-K182 PolarHBondContact O-N 3.22Å; N179-K182 PolarHBondContact O-N 2.96Å; K182-C184 PolarHBondContact O-N 3Å; K182-K185 WeakPolarHBondContact O-CB 3.49Å; K182-K185 PolarHBondContact O-N 3.25Å; K182-M186 WeakPolarHBondContact O-CG 3.45Å; K182-M186 PolarHBondContact O-N 3.35Å
183	M	92.9	Very high	92	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-43.2	177	179.2	50.4	77.5	0	0	111.5	L63 A121 I122 Y125 L140 W172 N179 R180 K185 M186 M187	L63-M183 HydrophobicContact CD1-CB 4.48Å; L63-M183 HydrophobicContact CD1-CG 4Å; L63-M183 HydrophobicContact CD2-CG 4.16Å; A121-M183 HydrophobicContact CB-CE 4.48Å; A121-M183 WeakPolarHBondContact O-CE 3.43Å; I122-M183 HydrophobicContact CG1-CE 4.35Å; Y125-M183 HydrophobicContact CD1-CB 4.46Å; Y125-M183 HydrophobicContact CD1-CE 3.77Å; Y125-M183 HydrophobicContact CD1-CG 4Å; Y125-M183 HydrophobicContact CD2-CB 3.8Å; Y125-M183 HydrophobicContact CD2-CE 3.9Å; Y125-M183 HydrophobicContact CD2-CG 4.19Å; Y125-M183 HydrophobicContact CE1-CB 4.26Å; Y125-M183 HydrophobicContact CE1-CG 3.93Å; Y125-M183 HydrophobicContact CE2-CB 3.53Å; Y125-M183 HydrophobicContact CE2-CG 4.1Å; Y125-M183 HydrophobicContact CG-CB 4.24Å; Y125-M183 HydrophobicContact CG-CE 3.34Å; Y125-M183 HydrophobicContact CG-CG 4.12Å; L140-M183 HydrophobicContact CD1-CG 4.2Å; W172-M183 HydrophobicContact CH2-CB 4.31Å; W172-M183 HydrophobicContact CH2-CE 3.6Å; W172-M183 HydrophobicContact CZ2-CE 3.83Å; W172-M183 HydrophobicContact CZ3-CB 4.28Å; N179-M183 WeakPolarHBondContact O-CB 3.03Å; N179-M183 PolarHBondContact O-N 2.93Å; R180-M183 PolarHBondContact O-N 2.93Å; M183-K185 VanDerWaalsContact C-N 3.34Å; M183-K185 PolarHBondContact O-N 2.97Å; M183-M186 WeakPolarHBondContact O-CB 3.42Å; M183-M186 PolarHBondContact O-N 3.49Å; M183-M186 VanDerWaalsContact O-N 3.16Å; M183-M186 HydrophobicContact SD-CB 4.49Å; M183-M187 HydrophobicContact CG-CG 4.39Å; M183-M187 WeakPolarHBondContact O-CG 3.41Å; M183-M187 PolarHBondContact O-N 3.46Å; M183-M187 HydrophobicContact SD-CG 3.86Å; M183-M187 HydrophobicContact SD-SD 4Å
184	C	92.4	Very high	92.4	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-57.7	-44.8	174.5	177.6	0	0	0	0	112.4	C64 L67 R180 Q181 K182 M186 M187 R188	C64-C184 WeakPolarHBondContact CA-SG 3.04Å; C64-C184 HydrophobicContact CB-CB 4.18Å; C64-C184 WeakPolarHBondContact CB-SG 3.43Å; C64-C184 WeakPolarHBondContact SG-CA 3.43Å; C64-C184 WeakPolarHBondContact SG-CB 3.37Å; C64-C184 CovalentContact SG-SG 2.05Å; C64-C184 PolarHBondContact SG-SG 3.46Å; L67-C184 HydrophobicContact CD1-CB 4.19Å; R180-C184 WeakPolarHBondContact O-CB 3.35Å; R180-C184 PolarHBondContact O-N 3.18Å; Q181-C184 PolarHBondContact O-N 3.41Å; K182-C184 PolarHBondContact O-N 3Å; C184-M186 VanDerWaalsContact C-N 3.34Å; C184-M186 PolarHBondContact O-N 2.89Å; C184-M187 PolarHBondContact O-N 3.23Å; C184-R188 WeakPolarHBondContact O-CG 3.4Å; C184-R188 PolarHBondContact O-N 3.21Å; C184-R188 VanDerWaalsContact O-N 3.12Å
185	K	91	Very high	92.7	Very high	41 Å²	41	33.6 Å²	33.6	18%	0.178	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-43.8	175.6	-67.5	177.8	-177.6	-169.9	0	111.6	S70 E72 P74 Q181 K182 M183 M187 R188 G189	S70-K185 VanDerWaalsContact CB-CE 3.49Å; S70-K185 WeakPolarHBondContact OG-CE 3.29Å; S70-K185 PolarHBondContact OG-NZ 3.19Å; E72-K185 HydrophobicContact CB-CD 4.19Å; E72-K185 IonicContact OE2-NZ 3.71Å; E72-K185 PolarHBondContact OE2-NZ 3.15Å; P74-K185 HydrophobicContact CG-CB 4.15Å; Q181-K185 WeakPolarHBondContact O-CG 3.33Å; Q181-K185 PolarHBondContact O-N 3.09Å; Q181-K185 VanDerWaalsContact O-N 3.09Å; K182-K185 WeakPolarHBondContact O-CB 3.49Å; K182-K185 PolarHBondContact O-N 3.25Å; M183-K185 VanDerWaalsContact C-N 3.34Å; M183-K185 PolarHBondContact O-N 2.97Å; K185-M187 PolarHBondContact O-N 3.02Å; K185-R188 WeakPolarHBondContact O-CB 3.39Å; K185-R188 PolarHBondContact O-N 2.93Å; K185-G189 PolarHBondContact O-N 2.69Å; K185-G189 VanDerWaalsContact O-N 3.09Å
186	M	92.1	Very high	92.8	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-43.3	176.8	-70.4	-171.6	70.7	0	0	112.3	P74 Y117 A121 P169 W172 K182 M183 C184 R188 G189 F190	P74-M186 HydrophobicContact CG-CG 3.96Å; Y117-M186 HydrophobicContact CD1-CE 4.48Å; Y117-M186 HydrophobicContact CE1-CE 3.54Å; A121-M186 HydrophobicContact CB-CE 3.31Å; A121-M186 HydrophobicContact CB-SD 4.17Å; P169-M186 HydrophobicContact CB-CE 3.36Å; P169-M186 HydrophobicContact CB-SD 3.83Å; P169-M186 HydrophobicContact CG-CE 3.82Å; W172-M186 HydrophobicContact CH2-SD 3.75Å; W172-M186 HydrophobicContact CZ2-SD 4.36Å; K182-M186 WeakPolarHBondContact O-CG 3.45Å; K182-M186 PolarHBondContact O-N 3.35Å; M183-M186 WeakPolarHBondContact O-CB 3.42Å; M183-M186 PolarHBondContact O-N 3.49Å; M183-M186 VanDerWaalsContact O-N 3.16Å; M183-M186 HydrophobicContact SD-CB 4.49Å; C184-M186 VanDerWaalsContact C-N 3.34Å; C184-M186 PolarHBondContact O-N 2.89Å; M186-R188 VanDerWaalsContact C-N 3.26Å; M186-R188 PolarHBondContact O-N 3.36Å; M186-G189 CarbonylContact O-C 3.6Å; M186-G189 PolarHBondContact O-N 3.44Å; M186-F190 WeakPolarHBondContact O-CB 3.43Å; M186-F190 PolarHBondContact O-N 2.65Å
187	M	93.9	Very high	92.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-30.2	177.5	-66.6	-51.6	-58.7	0	0	112.5	V54 V57 L58 L63 I122 L140 T143 M183 C184 K185 F190 H191	V54-M187 HydrophobicContact CB-CE 4.37Å; V54-M187 HydrophobicContact CG1-CE 4.01Å; V54-M187 HydrophobicContact CG2-CE 4.06Å; V57-M187 HydrophobicContact CB-CE 4.17Å; V57-M187 HydrophobicContact CG1-CB 4.26Å; V57-M187 HydrophobicContact CG1-CE 3.97Å; V57-M187 HydrophobicContact CG1-CG 3.92Å; V57-M187 HydrophobicContact CG2-CE 4.25Å; L58-M187 HydrophobicContact CD2-CB 3.88Å; L63-M187 HydrophobicContact CD2-CG 3.89Å; I122-M187 HydrophobicContact CD1-SD 4.23Å; I122-M187 HydrophobicContact CG1-SD 4.34Å; L140-M187 HydrophobicContact CD2-CE 4.39Å; L140-M187 HydrophobicContact CD2-CG 4.32Å; L140-M187 HydrophobicContact CD2-SD 4.05Å; T143-M187 HydrophobicContact CG2-CE 4.24Å; M183-M187 HydrophobicContact CG-CG 4.39Å; M183-M187 WeakPolarHBondContact O-CG 3.41Å; M183-M187 PolarHBondContact O-N 3.46Å; M183-M187 HydrophobicContact SD-CG 3.86Å; M183-M187 HydrophobicContact SD-SD 4Å; C184-M187 PolarHBondContact O-N 3.23Å; K185-M187 PolarHBondContact O-N 3.02Å; M187-F190 HydrophobicContact CE-CD1 3.92Å; M187-F190 PolarHBondContact O-N 3.01Å; M187-F190 HydrophobicContact SD-CD1 4.38Å; M187-H191 WeakPolarHBondContact O-CB 3.33Å; M187-H191 PolarHBondContact O-N 3.41Å
188	R	92.3	Very high	93	Very high	55 Å²	55	27.5 Å²	27.5	21%	0.208	13%	0.132	C	C	.	.	H	α-helix	trans	-67.2	-46.5	171.8	-68.3	174	178	-148.6	-6.1	111.6	L58 S70 M73 C184 K185 M186 F190 H191 V192	L58-R188 HydrophobicContact CD2-CG 3.73Å; S70-R188 PolarHBondContact O-NH1 3.04Å; M73-R188 HydrophobicContact CE-CB 4.33Å; M73-R188 HydrophobicContact CG-CB 3.82Å; M73-R188 HydrophobicContact SD-CB 4.09Å; C184-R188 WeakPolarHBondContact O-CG 3.4Å; C184-R188 PolarHBondContact O-N 3.21Å; C184-R188 VanDerWaalsContact O-N 3.12Å; K185-R188 WeakPolarHBondContact O-CB 3.39Å; K185-R188 PolarHBondContact O-N 2.93Å; M186-R188 VanDerWaalsContact C-N 3.26Å; M186-R188 PolarHBondContact O-N 3.36Å; R188-F190 VanDerWaalsContact C-N 3.26Å; R188-F190 PolarHBondContact O-N 2.94Å; R188-H191 PolarHBondContact O-N 3.12Å; R188-V192 PolarHBondContact O-N 2.97Å
189	G	92.7	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.7	-42.1	171.4	0	0	0	0	0	111.6	M75 K185 M186 H191 V192 R193	M75-G189 WeakPolarHBondContact CE-O 3.44Å; K185-G189 PolarHBondContact O-N 2.69Å; K185-G189 VanDerWaalsContact O-N 3.09Å; M186-G189 CarbonylContact O-C 3.6Å; M186-G189 PolarHBondContact O-N 3.44Å; G189-H191 VanDerWaalsContact C-N 3.34Å; G189-H191 PolarHBondContact O-N 3.27Å; G189-V192 PolarHBondContact O-N 3.17Å; G189-R193 PolarHBondContact O-N 3.21Å
190	F	95.4	Very high	93.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.9	-38	179.4	-165.1	-160.3	0	0	0	112.5	L50 V54 L115 Y118 T143 I147 M186 M187 R188 V192 R193 A194	L50-F190 HydrophobicContact CD1-CE1 3.91Å; L50-F190 HydrophobicContact CD1-CZ 3.67Å; L50-F190 HydrophobicContact CD2-CE2 4.16Å; L50-F190 HydrophobicContact CD2-CZ 3.83Å; L50-F190 HydrophobicContact CG-CZ 4.07Å; V54-F190 HydrophobicContact CG1-CB 4.39Å; V54-F190 HydrophobicContact CG1-CD1 4.32Å; V54-F190 HydrophobicContact CG2-CD1 3.44Å; V54-F190 VanDerWaalsContact CG2-CD1 3.44Å; V54-F190 HydrophobicContact CG2-CE1 3.49Å; V54-F190 VanDerWaalsContact CG2-CE1 3.49Å; V54-F190 HydrophobicContact CG2-CG 4.17Å; V54-F190 HydrophobicContact CG2-CZ 4.3Å; L115-F190 HydrophobicContact CD2-CE2 4.41Å; L115-F190 HydrophobicContact CD2-CZ 4.28Å; Y118-F190 HydrophobicContact CD1-CB 3.69Å; Y118-F190 HydrophobicContact CD1-CD1 4.04Å; Y118-F190 HydrophobicContact CD1-CD2 4.04Å; Y118-F190 AromaticContact CD1-CG 3.67Å; Y118-F190 HydrophobicContact CD1-CG 3.67Å; Y118-F190 HydrophobicContact CD2-CB 4.33Å; Y118-F190 HydrophobicContact CD2-CD1 4.38Å; Y118-F190 AromaticContact CD2-CD2 3.17Å; Y118-F190 HydrophobicContact CD2-CD2 3.17Å; Y118-F190 AromaticContact CD2-CE2 3.39Å; Y118-F190 HydrophobicContact CD2-CE2 3.39Å; Y118-F190 AromaticContact CD2-CG 3.72Å; Y118-F190 HydrophobicContact CD2-CG 3.72Å; Y118-F190 HydrophobicContact CD2-CZ 4.09Å; Y118-F190 HydrophobicContact CE1-CB 3.41Å; Y118-F190 VanDerWaalsContact CE1-CB 3.41Å; Y118-F190 HydrophobicContact CE1-CD2 4.16Å; Y118-F190 AromaticContact CE1-CG 3.84Å; Y118-F190 HydrophobicContact CE1-CG 3.84Å; Y118-F190 HydrophobicContact CE2-CB 4.11Å; Y118-F190 AromaticContact CE2-CD2 3.33Å; Y118-F190 HydrophobicContact CE2-CD2 3.33Å; Y118-F190 AromaticContact CE2-CE2 3.96Å; Y118-F190 HydrophobicContact CE2-CE2 3.96Å; Y118-F190 AromaticContact CE2-CG 3.9Å; Y118-F190 HydrophobicContact CE2-CG 3.9Å; Y118-F190 HydrophobicContact CG-CB 4.15Å; Y118-F190 AromaticContact CG-CD1 3.92Å; Y118-F190 HydrophobicContact CG-CD1 3.92Å; Y118-F190 AromaticContact CG-CD2 3.57Å; Y118-F190 HydrophobicContact CG-CD2 3.57Å; Y118-F190 HydrophobicContact CG-CE1 4.18Å; Y118-F190 AromaticContact CG-CE2 3.83Å; Y118-F190 HydrophobicContact CG-CE2 3.83Å; Y118-F190 AromaticContact CG-CG 3.61Å; Y118-F190 HydrophobicContact CG-CG 3.61Å; Y118-F190 HydrophobicContact CG-CZ 4.11Å; Y118-F190 AromaticContact CZ-CD2 3.82Å; Y118-F190 AromaticContact CZ-CG 3.95Å; Y118-F190 WeakPolarHBondContact OH-CA 3.32Å; Y118-F190 PolarHBondContact OH-N 3.22Å; T143-F190 HydrophobicContact CG2-CE1 3.98Å; I147-F190 HydrophobicContact CD1-CE1 3.74Å; I147-F190 HydrophobicContact CD1-CZ 3.88Å; I147-F190 HydrophobicContact CG1-CE1 4.3Å; I147-F190 HydrophobicContact CG1-CZ 4.1Å; M186-F190 WeakPolarHBondContact O-CB 3.43Å; M186-F190 PolarHBondContact O-N 2.65Å; M187-F190 HydrophobicContact CE-CD1 3.92Å; M187-F190 PolarHBondContact O-N 3.01Å; M187-F190 HydrophobicContact SD-CD1 4.38Å; R188-F190 VanDerWaalsContact C-N 3.26Å; R188-F190 PolarHBondContact O-N 2.94Å; F190-V192 PolarHBondContact O-N 3.02Å; F190-R193 HydrophobicContact CD2-CB 4.36Å; F190-R193 CarbonylContact O-C 3.55Å; F190-R193 PolarHBondContact O-N 3.17Å; F190-R193 VanDerWaalsContact O-N 3.16Å; F190-A194 WeakPolarHBondContact O-CB 3.37Å; F190-A194 PolarHBondContact O-N 3.36Å
191	H	95.4	Very high	93	Very high	47 Å²	47	32.2 Å²	32.2	22%	0.218	15%	0.15	C	C	.	.	H	α-helix	trans	-60.1	-47.5	177.1	-178	63.9	0	0	0	112	V54 T55 L58 M187 R188 G189 R193 A194 I195	V54-H191 HydrophobicContact CG1-CB 3.66Å; T55-H191 PolarHBondContact OG1-CE1 3.16Å; T55-H191 PolarHBondContact OG1-ND1 2.96Å; L58-H191 HydrophobicContact CD1-CB 3.39Å; M187-H191 WeakPolarHBondContact O-CB 3.33Å; M187-H191 PolarHBondContact O-N 3.41Å; R188-H191 PolarHBondContact O-N 3.12Å; G189-H191 VanDerWaalsContact C-N 3.34Å; G189-H191 PolarHBondContact O-N 3.27Å; H191-R193 VanDerWaalsContact C-N 3.29Å; H191-R193 PolarHBondContact O-N 3.45Å; H191-A194 PolarHBondContact O-N 3.41Å; H191-I195 WeakPolarHBondContact O-CG1 3.1Å; H191-I195 PolarHBondContact O-N 2.92Å
192	V	94.2	Very high	92.9	Very high	62 Å²	62	30.6 Å²	30.6	38%	0.376	15%	0.15	S	C	.	.	H	α-helix	trans	-60.4	-43	174.6	175.9	0	0	0	0	110.3	M73 M75 R188 G189 F190 A194 I195 T196	M73-V192 HydrophobicContact SD-CG2 4.1Å; M75-V192 HydrophobicContact CE-CB 3.68Å; M75-V192 HydrophobicContact CE-CG1 3.67Å; R188-V192 PolarHBondContact O-N 2.97Å; G189-V192 PolarHBondContact O-N 3.17Å; F190-V192 PolarHBondContact O-N 3.02Å; V192-A194 PolarHBondContact O-N 3.3Å; V192-I195 PolarHBondContact O-N 3.47Å; V192-T196 PolarHBondContact O-N 3Å; V192-T196 VanDerWaalsContact O-N 3.15Å; V192-T196 PolarHBondContact O-OG1 3.31Å
193	R	94.8	Very high	92.7	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-42.3	176.7	-172.5	57	71.5	-162.6	-2.2	112.5	M75 S77 D114 Y118 G189 F190 H191 I195 T196 I197	M75-R193 HydrophobicContact CE-CB 3.91Å; S77-R193 PolarHBondContact O-NH2 3.49Å; D114-R193 HydrophobicContact CB-CG 4.22Å; D114-R193 WeakPolarHBondContact OD2-CD 3.3Å; D114-R193 WeakPolarHBondContact OD2-CG 3.17Å; D114-R193 IonicContact OD2-CZ 3.18Å; D114-R193 IonicContact OD2-NE 3.6Å; D114-R193 PolarHBondContact OD2-NE 2.91Å; Y118-R193 HydrophobicContact CE2-CB 4.37Å; Y118-R193 HydrophobicContact CE2-CG 4.41Å; G189-R193 PolarHBondContact O-N 3.21Å; F190-R193 HydrophobicContact CD2-CB 4.36Å; F190-R193 CarbonylContact O-C 3.55Å; F190-R193 PolarHBondContact O-N 3.17Å; F190-R193 VanDerWaalsContact O-N 3.16Å; H191-R193 VanDerWaalsContact C-N 3.29Å; H191-R193 PolarHBondContact O-N 3.45Å; R193-I195 VanDerWaalsContact C-N 3.29Å; R193-I195 PolarHBondContact O-N 3.18Å; R193-T196 WeakPolarHBondContact O-CB 3.33Å; R193-T196 PolarHBondContact O-N 2.03Å; R193-T196 VanDerWaalsContact O-N 3.12Å; R193-I197 HydrophobicContact CG-CD1 3.78Å; R193-I197 HydrophobicContact CG-CG1 4.21Å; R193-I197 VanDerWaalsContact O-CG1 3.26Å; R193-I197 WeakPolarHBondContact O-CG1 2.94Å; R193-I197 PolarHBondContact O-N 3.26Å
194	A	96.1	Very high	92.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.5	-35.5	179.8	0	0	0	0	0	111.8	L51 F190 H191 V192 N198	L51-A194 HydrophobicContact CB-CB 4.45Å; L51-A194 HydrophobicContact CD1-CB 4Å; F190-A194 WeakPolarHBondContact O-CB 3.37Å; F190-A194 PolarHBondContact O-N 3.36Å; H191-A194 PolarHBondContact O-N 3.41Å; V192-A194 PolarHBondContact O-N 3.3Å; A194-N198 WeakPolarHBondContact O-CB 3.3Å; A194-N198 PolarHBondContact O-N 2.85Å; A194-N198 PolarHBondContact O-ND2 3.36Å
195	I	95.2	Very high	92	Very high	52 Å²	52	32.1 Å²	32.1	27%	0.267	16%	0.16	S	C	.	.	H	α-helix	trans	-62.2	-50.3	170.8	-66.7	166.9	0	0	0	110.1	L51 H191 V192 R193 I197 N198 R199	L51-I195 HydrophobicContact CD1-CG1 3.68Å; H191-I195 WeakPolarHBondContact O-CG1 3.1Å; H191-I195 PolarHBondContact O-N 2.92Å; V192-I195 PolarHBondContact O-N 3.47Å; R193-I195 VanDerWaalsContact C-N 3.29Å; R193-I195 PolarHBondContact O-N 3.18Å; I195-I197 VanDerWaalsContact C-N 3.34Å; I195-I197 PolarHBondContact O-N 3.4Å; I195-N198 PolarHBondContact O-N 2.7Å; I195-R199 WeakPolarHBondContact O-CG 3.43Å; I195-R199 PolarHBondContact O-N 3.24Å
196	T	93.9	Very high	91.6	Very high	37 Å²	37	30.6 Å²	30.6	23%	0.227	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-45.8	177.6	-60.7	0	0	0	0	111.7	V192 R193 N198 R199 A200	V192-T196 PolarHBondContact O-N 3Å; V192-T196 VanDerWaalsContact O-N 3.15Å; V192-T196 PolarHBondContact O-OG1 3.31Å; R193-T196 WeakPolarHBondContact O-CB 3.33Å; R193-T196 PolarHBondContact O-N 2.03Å; R193-T196 VanDerWaalsContact O-N 3.12Å; T196-N198 PolarHBondContact O-N 3.31Å; T196-R199 PolarHBondContact O-N 3.31Å; T196-A200 WeakPolarHBondContact O-CB 3.42Å; T196-A200 PolarHBondContact O-N 3.5Å
197	I	93.8	Very high	91.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.3	-48.8	176.3	-70.1	168.4	0	0	0	110.7	F47 I111 R193 I195 R199 A200 V201	F47-I197 HydrophobicContact CD1-CG2 3.31Å; F47-I197 HydrophobicContact CE1-CG2 3.42Å; F47-I197 VanDerWaalsContact CE1-CG2 3.42Å; F47-I197 HydrophobicContact CG-CG2 4.14Å; F47-I197 HydrophobicContact CZ-CG2 4.34Å; I111-I197 HydrophobicContact CD1-CG2 4.35Å; I111-I197 HydrophobicContact CG1-CG1 4.07Å; I111-I197 HydrophobicContact CG2-CD1 4.07Å; I111-I197 HydrophobicContact CG2-CG1 4.02Å; I111-I197 HydrophobicContact CG2-CG2 3.88Å; R193-I197 HydrophobicContact CG-CD1 3.78Å; R193-I197 HydrophobicContact CG-CG1 4.21Å; R193-I197 VanDerWaalsContact O-CG1 3.26Å; R193-I197 WeakPolarHBondContact O-CG1 2.94Å; R193-I197 PolarHBondContact O-N 3.26Å; I195-I197 VanDerWaalsContact C-N 3.34Å; I195-I197 PolarHBondContact O-N 3.4Å; I197-R199 VanDerWaalsContact C-N 3.29Å; I197-R199 PolarHBondContact O-N 3.37Å; I197-A200 PolarHBondContact O-N 2.89Å; I197-V201 HydrophobicContact CG2-CG2 4.19Å; I197-V201 WeakPolarHBondContact O-CB 3.15Å; I197-V201 VanDerWaalsContact O-CG2 3.31Å; I197-V201 WeakPolarHBondContact O-CG2 3.36Å; I197-V201 PolarHBondContact O-N 3.43Å
198	N	94.2	Very high	90.2	Very high	34 Å²	34	33.4 Å²	33.4	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-38.3	-179.7	-89.8	-97.9	0	0	0	112.1	F47 R48 A194 I195 T196 G202	F47-N198 PolarHBondContact O-ND2 2.95Å; F47-N198 PolarHBondContact O-OD1 2.88Å; R48-N198 WeakPolarHBondContact CA-OD1 3.21Å; R48-N198 PolarHBondContact N-OD1 2.89Å; A194-N198 WeakPolarHBondContact O-CB 3.3Å; A194-N198 PolarHBondContact O-N 2.85Å; A194-N198 PolarHBondContact O-ND2 3.36Å; I195-N198 PolarHBondContact O-N 2.7Å; T196-N198 PolarHBondContact O-N 3.31Å; N198-G202 PolarHBondContact O-N 3.47Å
199	R	92.4	Very high	89.4	Confident	189 Å²	189	32.5 Å²	32.5	71%	0.713	17%	0.172	S	C	*	.	H	α-helix	trans	-64.8	-47.4	174.5	-70.3	176.9	179.6	175.6	0	111.6	I195 T196 I197 G202 Y203	I195-R199 WeakPolarHBondContact O-CG 3.43Å; I195-R199 PolarHBondContact O-N 3.24Å; T196-R199 PolarHBondContact O-N 3.31Å; I197-R199 VanDerWaalsContact C-N 3.29Å; I197-R199 PolarHBondContact O-N 3.37Å; R199-G202 PolarHBondContact O-N 2.95Å; R199-Y203 WeakPolarHBondContact O-CB 3.46Å; R199-Y203 PolarHBondContact O-N 2.95Å
200	A	90.3	Very high	88.8	Confident	5 Å²	5	40.7 Å²	40.7	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-47	179.5	0	0	0	0	0	112.1	C84 I111 T196 I197 G202 Y203 I204	C84-A200 HydrophobicContact CB-CB 3.75Å; I111-A200 HydrophobicContact CD1-CB 4.22Å; T196-A200 WeakPolarHBondContact O-CB 3.42Å; T196-A200 PolarHBondContact O-N 3.5Å; I197-A200 PolarHBondContact O-N 2.89Å; A200-G202 VanDerWaalsContact C-N 3.31Å; A200-G202 PolarHBondContact O-N 3.36Å; A200-Y203 WeakPolarHBondContact O-CB 3.39Å; A200-Y203 PolarHBondContact O-N 3.41Å; A200-I204 WeakPolarHBondContact O-CG1 3.28Å; A200-I204 PolarHBondContact O-N 3.07Å
201	V	89.8	Confident	87.4	Confident	19 Å²	19	51 Å²	51	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-40.1	176.7	171.5	0	0	0	0	111.1	A44 F47 I111 I197 I204 S205	A44-V201 HydrophobicContact CB-CG1 4.49Å; F47-V201 HydrophobicContact CD1-CG2 4.48Å; F47-V201 HydrophobicContact CD2-CB 4.33Å; F47-V201 HydrophobicContact CD2-CG1 3.94Å; F47-V201 HydrophobicContact CD2-CG2 3.65Å; F47-V201 HydrophobicContact CE2-CG1 4.46Å; F47-V201 HydrophobicContact CE2-CG2 3.69Å; F47-V201 HydrophobicContact CG-CG2 4.07Å; F47-V201 HydrophobicContact CZ-CG2 4.13Å; I111-V201 HydrophobicContact CD1-CG2 4.46Å; I197-V201 HydrophobicContact CG2-CG2 4.19Å; I197-V201 WeakPolarHBondContact O-CB 3.15Å; I197-V201 VanDerWaalsContact O-CG2 3.31Å; I197-V201 WeakPolarHBondContact O-CG2 3.36Å; I197-V201 PolarHBondContact O-N 3.43Å; V201-I204 PolarHBondContact O-N 3.34Å; V201-S205 VanDerWaalsContact O-CB 3.28Å; V201-S205 WeakPolarHBondContact O-CB 3.25Å; V201-S205 PolarHBondContact O-N 3.49Å; V201-S205 PolarHBondContact O-OG 2.69Å
202	G	88.3	Confident	87	Confident	29 Å²	29	51.2 Å²	51.2	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-45	173.7	0	0	0	0	0	112.5	N198 R199 A200 S205 S206	N198-G202 PolarHBondContact O-N 3.47Å; R199-G202 PolarHBondContact O-N 2.95Å; A200-G202 VanDerWaalsContact C-N 3.31Å; A200-G202 PolarHBondContact O-N 3.36Å; G202-S205 PolarHBondContact O-N 3.29Å; G202-S206 PolarHBondContact O-N 3.31Å
203	Y	86.3	Confident	86.7	Confident	45 Å²	45	50.6 Å²	50.6	18%	0.176	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-45.7	176.7	179.7	-113	0	0	0	112.3	P86 F102 R199 A200 S205 S206 D208 H209	P86-Y203 HydrophobicContact CB-CE1 3.99Å; P86-Y203 HydrophobicContact CB-CE2 4.29Å; P86-Y203 HydrophobicContact CG-CD1 4.24Å; P86-Y203 HydrophobicContact CG-CE1 4.07Å; P86-Y203 HydrophobicContact CG-CE2 4.36Å; P86-Y203 HydrophobicContact CG-CG 4.45Å; F102-Y203 HydrophobicContact CD1-CE1 4.23Å; F102-Y203 HydrophobicContact CD2-CE1 4.15Å; F102-Y203 HydrophobicContact CE1-CD1 4.42Å; F102-Y203 HydrophobicContact CE1-CE1 4.16Å; F102-Y203 HydrophobicContact CE2-CD1 4.14Å; F102-Y203 HydrophobicContact CE2-CE1 4.07Å; F102-Y203 HydrophobicContact CG-CE1 4.21Å; F102-Y203 HydrophobicContact CZ-CD1 4.02Å; F102-Y203 HydrophobicContact CZ-CE1 4.08Å; R199-Y203 WeakPolarHBondContact O-CB 3.46Å; R199-Y203 PolarHBondContact O-N 2.95Å; A200-Y203 WeakPolarHBondContact O-CB 3.39Å; A200-Y203 PolarHBondContact O-N 3.41Å; Y203-S205 VanDerWaalsContact C-N 3.34Å; Y203-S205 PolarHBondContact O-N 3.49Å; Y203-S206 PolarHBondContact O-N 2.99Å; Y203-S206 PolarHBondContact O-OG 3.28Å; Y203-D208 HydrophobicContact CD2-CB 4.05Å; Y203-D208 HydrophobicContact CE2-CB 3.55Å; Y203-H209 HydrophobicContact CD1-CB 4.45Å; Y203-H209 HydrophobicContact CE1-CB 3.58Å; Y203-H209 WeakPolarHBondContact OH-CA 2.92Å
204	I	85.7	Confident	86.2	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-47.9	174.7	-68.7	165.9	0	0	0	110.3	F102 E104 V108 A200 V201 S206 G207 H209	F102-I204 HydrophobicContact CE1-CG1 4.28Å; F102-I204 HydrophobicContact CZ-CD1 4.31Å; F102-I204 HydrophobicContact CZ-CG1 3.86Å; E104-I204 VanDerWaalsContact CD-CG2 3.5Å; E104-I204 HydrophobicContact CG-CD1 4.11Å; E104-I204 HydrophobicContact CG-CG1 4.13Å; E104-I204 HydrophobicContact CG-CG2 3.84Å; E104-I204 WeakPolarHBondContact OE1-CG2 3.5Å; V108-I204 HydrophobicContact CG2-CD1 3.96Å; A200-I204 WeakPolarHBondContact O-CG1 3.28Å; A200-I204 PolarHBondContact O-N 3.07Å; V201-I204 PolarHBondContact O-N 3.34Å; I204-S206 VanDerWaalsContact C-N 3.26Å; I204-S206 PolarHBondContact O-N 3.04Å; I204-G207 PolarHBondContact O-N 2.92Å; I204-H209 PolarHBondContact O-CE1 3.48Å
205	S	84.3	Confident	85.6	Confident	36 Å²	36	56.4 Å²	56.4	25%	0.252	27%	0.27	S	S	.	.	H	α-helix	trans	-64.4	-29.9	-177.7	-57.5	0	0	0	0	113.1	P34 V201 G202 Y203 G207	P34-S205 WeakPolarHBondContact CD-O 3.13Å; V201-S205 VanDerWaalsContact O-CB 3.28Å; V201-S205 WeakPolarHBondContact O-CB 3.25Å; V201-S205 PolarHBondContact O-N 3.49Å; V201-S205 PolarHBondContact O-OG 2.69Å; G202-S205 PolarHBondContact O-N 3.29Å; Y203-S205 VanDerWaalsContact C-N 3.34Å; Y203-S205 PolarHBondContact O-N 3.49Å; S205-G207 PolarHBondContact O-N 3.09Å
206	S	83.6	Confident	85	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-21	175.5	74.8	0	0	0	0	113.5	G202 Y203 I204 D208	G202-S206 PolarHBondContact O-N 3.31Å; Y203-S206 PolarHBondContact O-N 2.99Å; Y203-S206 PolarHBondContact O-OG 3.28Å; I204-S206 VanDerWaalsContact C-N 3.26Å; I204-S206 PolarHBondContact O-N 3.04Å; S206-D208 PolarHBondContact O-N 3.32Å; S206-D208 WeakPolarHBondContact OG-CB 2.94Å; S206-D208 VanDerWaalsContact OG-CG 3.32Å; S206-D208 PolarHBondContact OG-N 2.96Å; S206-D208 PolarHBondContact OG-OD2 2.91Å
207	G	80.2	Confident	84.4	Confident	15 Å²	15	58 Å²	58	16%	0.155	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	6.2	-173.6	0	0	0	0	0	114.7	I204 S205 H209 R210	I204-G207 PolarHBondContact O-N 2.92Å; S205-G207 PolarHBondContact O-N 3.09Å; G207-H209 PolarHBondContact O-N 3.05Å; G207-R210 WeakPolarHBondContact O-CB 3.38Å; G207-R210 PolarHBondContact O-N 2.96Å
208	D	76.6	Confident	83.8	Confident	47 Å²	47	62.1 Å²	62.1	25%	0.251	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.1	-177.2	-81.1	-13.8	0	0	0	113.5	Y203 S206 R210 K211	Y203-D208 HydrophobicContact CD2-CB 4.05Å; Y203-D208 HydrophobicContact CE2-CB 3.55Å; S206-D208 PolarHBondContact O-N 3.32Å; S206-D208 WeakPolarHBondContact OG-CB 2.94Å; S206-D208 VanDerWaalsContact OG-CG 3.32Å; S206-D208 PolarHBondContact OG-N 2.96Å; S206-D208 PolarHBondContact OG-OD2 2.91Å; D208-R210 PolarHBondContact O-N 3.47Å; D208-K211 PolarHBondContact O-N 2.98Å; D208-K211 IonicContact OD1-NZ 3.91Å; D208-K211 PolarHBondContact OD1-NZ 2.73Å
209	H	74.6	Confident	83	Confident	37 Å²	37	64.3 Å²	64.3	17%	0.171	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-68.9	-9.4	176.9	64.8	-83.9	0	0	0	115	F102 E104 Y203 I204 G207	F102-H209 HydrophobicContact CD1-CB 3.43Å; F102-H209 VanDerWaalsContact CD1-CB 3.43Å; F102-H209 AromaticContact CD1-CG 3.86Å; F102-H209 HydrophobicContact CE1-CB 3.7Å; F102-H209 AromaticContact CE1-CD2 3.97Å; F102-H209 AromaticContact CE1-CG 3.69Å; F102-H209 HydrophobicContact CG-CB 4.29Å; E104-H209 IonicContact OE2-CE1 3.8Å; E104-H209 PolarHBondContact OE2-CE1 2.96Å; E104-H209 IonicContact OE2-NE2 3.16Å; E104-H209 PolarHBondContact OE2-NE2 3.09Å; Y203-H209 HydrophobicContact CD1-CB 4.45Å; Y203-H209 HydrophobicContact CE1-CB 3.58Å; Y203-H209 WeakPolarHBondContact OH-CA 2.92Å; I204-H209 PolarHBondContact O-CE1 3.48Å; G207-H209 PolarHBondContact O-N 3.05Å
210	R	79.1	Confident	82.2	Confident	171 Å²	171	53.9 Å²	53.9	65%	0.645	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-98.6	-3.7	179.5	-52.1	-179.6	-172	157.2	1.3	112.7	E104 G207 D208	E104-R210 IonicContact OE1-NH2 2.82Å; E104-R210 IonicContact OE2-CZ 2.98Å; E104-R210 IonicContact OE2-NE 3.41Å; E104-R210 IonicContact OE2-NH2 3.73Å; E104-R210 PolarHBondContact OE2-NH2 3.36Å; G207-R210 WeakPolarHBondContact O-CB 3.38Å; G207-R210 PolarHBondContact O-N 2.96Å; D208-R210 PolarHBondContact O-N 3.47Å
211	K	67.7	Low	81.5	Confident	216 Å²	216	58.4 Å²	58.4	94%	0.939	29%	0.287	S	S	*	.			trans	-86.9	0	178.8	-63.2	175.5	-179.1	164.9	0	110.1	D208	D208-K211 PolarHBondContact O-N 2.98Å; D208-K211 IonicContact OD1-NZ 3.91Å; D208-K211 PolarHBondContact OD1-NZ 2.73Å

Retrieved 211 of 211 residues in 68 ms (Link to these results)

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