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Peroxisome proliferator-activated receptor alpha

Ligand-activated transcription factor. Key regulator of lipid metabolism. Activated by the endogenous ligand 1-palmitoyl-2-oleoyl-sn-glycerol-3-phosphocholine (16:0/18:1-GPC). Activated by oleylethanolamide, a naturally occurring lipid that regulates satiety. Receptor for peroxisome proliferators such as hypolipidemic drugs and fatty acids. Regulates the peroxisomal beta-oxidation pathway of fatty acids. Functions as a transcription activator for the ACOX1 and P450 genes. Transactivation activity requires heterodimerization with RXRA and is antagonized by NR2C2. May be required for the propagation of clock information to metabolic pathways regulated by PER2.

AlphaFold DB , UniProt , Accession G7PFY3, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene PPARA, Length 467 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	32.4	Very low	244 Å²	244	151.4 Å²	151.4	100%	1.202	86%	0.86	S	S	*	*				0	107.4	0	-100.9	173	157.2	0	0	107
2	V	37.7	Very low	32.3	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.715	85%	0.847	S	S	*	*			trans	68.6	81.7	163.6	-155.5	0	0	0	0	117.5	T4	V2-T4 HydrophobicContact CG1-CG2 3.82Å
3	D	32.9	Very low	32.1	Very low	164 Å²	164	145.2 Å²	145.2	88%	0.877	84%	0.843	S	S	*	*			trans	-61.6	136.9	135.4	-70.8	-54.4	0	0	0	108.6
4	T	34.1	Very low	32	Very low	129 Å²	129	147.6 Å²	147.6	79%	0.791	85%	0.849	S	S	*	*			trans	-141.5	134.8	164.7	18.8	0	0	0	0	111.2	V2	V2-T4 HydrophobicContact CG1-CG2 3.82Å
5	E	31.4	Very low	31.8	Very low	187 Å²	187	150.2 Å²	150.2	87%	0.874	85%	0.851	S	S	*	*			trans	-84.6	153	-159.1	-62	167.2	132.2	0	0	113.7
6	S	31.2	Very low	32.1	Very low	113 Å²	113	147.9 Å²	147.9	79%	0.79	86%	0.857	S	S	*	*			trans	-62.3	141.9	158.4	-51.8	0	0	0	0	111.4
7	P	33.1	Very low	32.2	Very low	133 Å²	133	142.9 Å²	142.9	86%	0.864	84%	0.844	S	S	*	*			trans	-96	108.4	160.9	12.4	6	0	0	0	110.5
8	L	30.4	Very low	32.1	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	85%	0.848	S	S	*	*			trans	-86.6	134.4	154.7	-82.3	162.3	0	0	0	108.9
9	C	27.7	Very low	32.2	Very low	124 Å²	124	146.2 Å²	146.2	84%	0.838	85%	0.852	S	S	*	*			trans	162.7	158.9	141.2	-96.6	0	0	0	0	111.7
10	P	33.8	Very low	32.2	Very low	110 Å²	110	148.1 Å²	148.1	71%	0.714	85%	0.853	S	S	*	*			cis	-131.9	156.3	-32	33.2	-15.4	0	0	0	113.1
11	L	29.8	Very low	32.4	Very low	181 Å²	181	145.2 Å²	145.2	95%	0.948	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-73.9	127.2	166.1	-77.9	155.4	0	0	0	109.9
12	S	31.3	Very low	32.3	Very low	100 Å²	100	138 Å²	138	70%	0.699	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-99.2	145.7	163.6	-63.7	0	0	0	0	109.5
13	P	29.7	Very low	32.3	Very low	123 Å²	123	138 Å²	138	80%	0.799	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-77.1	128	-167	30.6	-32.4	0	0	0	111.2	E15	P13-E15 PolarHBondContact O-N 3.26Å
14	L	30.7	Very low	32.7	Very low	178 Å²	178	133.4 Å²	133.4	93%	0.932	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75.5	119.1	166.9	-78.6	165.1	0	0	0	108.5
15	E	28.9	Very low	32.6	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.874	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.9	140.8	173.4	-68.6	178.3	146.7	0	0	110.6	P13 G17	P13-E15 PolarHBondContact O-N 3.26Å; E15-G17 PolarHBondContact O-N 3.16Å
16	A	37.2	Very low	33	Very low	114 Å²	114	131.8 Å²	131.8	94%	0.942	77%	0.772	S	S	*	*	S	Bend	trans	-78.5	107.2	172.4	0	0	0	0	0	109.2
17	G	34.3	Very low	33.2	Very low	62 Å²	62	129.5 Å²	129.5	64%	0.639	75%	0.748	S	S	*	*			trans	-176	136.9	172.6	0	0	0	0	0	109.2	E15	E15-G17 PolarHBondContact O-N 3.16Å
18	D	29.3	Very low	33.5	Very low	170 Å²	170	127.6 Å²	127.6	91%	0.909	73%	0.73	S	S	*	*			trans	84	48	177.3	-52.7	-15.3	0	0	0	116.4	E20	D18-E20 VanDerWaalsContact C-N 3.33Å; D18-E20 PolarHBondContact O-N 3.1Å
19	L	34.4	Very low	33.7	Very low	178 Å²	178	126.1 Å²	126.1	93%	0.932	72%	0.719	S	S	*	*			trans	-89.1	69.9	156.6	-126.9	152.7	0	0	0	108.6
20	E	33	Very low	34.4	Very low	185 Å²	185	126.1 Å²	126.1	86%	0.864	71%	0.706	S	S	*	*			trans	-159.3	104.4	163.6	-112.9	171.1	-158.6	0	0	108.1	D18	D18-E20 VanDerWaalsContact C-N 3.33Å; D18-E20 PolarHBondContact O-N 3.1Å
21	S	34.8	Very low	34.5	Very low	88 Å²	88	122.4 Å²	122.4	62%	0.615	68%	0.68	S	S	*	*			trans	-88.2	119.8	-177.8	-146.4	0	0	0	0	109.3	L23	S21-L23 PolarHBondContact O-N 3.45Å; S21-L23 VanDerWaalsContact O-N 3.13Å; S21-L23 VanDerWaalsContact OG-CD1 3.26Å; S21-L23 WeakPolarHBondContact OG-CD1 3.47Å; S21-L23 WeakPolarHBondContact OG-CG 3.29Å
22	P	31.8	Very low	34.6	Very low	91 Å²	91	115.5 Å²	115.5	59%	0.591	65%	0.652	S	S	*	*			trans	-76.5	9.4	179.7	21.4	-17	0	0	0	113.9	S24	P22-S24 VanDerWaalsContact C-N 3.29Å; P22-S24 PolarHBondContact O-N 3.08Å; P22-S24 VanDerWaalsContact O-N 3.15Å
23	L	38.4	Very low	34.7	Very low	119 Å²	119	115.8 Å²	115.8	62%	0.623	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	1.5	-164.7	-62.2	177.1	0	0	0	116	S21	S21-L23 PolarHBondContact O-N 3.45Å; S21-L23 VanDerWaalsContact O-N 3.13Å; S21-L23 VanDerWaalsContact OG-CD1 3.26Å; S21-L23 WeakPolarHBondContact OG-CD1 3.47Å; S21-L23 WeakPolarHBondContact OG-CG 3.29Å
24	S	40.8	Very low	35	Very low	68 Å²	68	113.6 Å²	113.6	48%	0.476	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	-26.4	178.1	60.8	0	0	0	0	113.6	P22 L28	P22-S24 VanDerWaalsContact C-N 3.29Å; P22-S24 PolarHBondContact O-N 3.08Å; P22-S24 VanDerWaalsContact O-N 3.15Å; S24-L28 WeakPolarHBondContact O-CD1 3.39Å; S24-L28 WeakPolarHBondContact O-CG 3.36Å
25	E	33.3	Very low	35.1	Very low	147 Å²	147	111.3 Å²	111.3	69%	0.687	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-41.4	179.3	-87.2	-173.2	153.9	0	0	112.4	F27 L28 Q29	E25-F27 PolarHBondContact O-N 3.21Å; E25-L28 PolarHBondContact O-N 3.35Å; E25-L28 VanDerWaalsContact O-N 3.13Å; E25-Q29 VanDerWaalsContact O-CB 3.3Å; E25-Q29 WeakPolarHBondContact O-CB 3.11Å; E25-Q29 PolarHBondContact O-N 3.4Å
26	E	38.1	Very low	35.2	Very low	135 Å²	135	109.9 Å²	109.9	63%	0.631	61%	0.605	S	S	*	*	H	α-helix	trans	-62.7	-40.5	-179.6	-77.3	-176.4	154.6	0	0	112.4	L28 Q29 E30	E26-L28 VanDerWaalsContact C-N 3.27Å; E26-L28 PolarHBondContact O-N 3.22Å; E26-Q29 PolarHBondContact O-N 2.69Å; E26-E30 WeakPolarHBondContact O-CB 3.08Å; E26-E30 PolarHBondContact O-N 2.89Å
27	F	36.4	Very low	35	Very low	65 Å²	65	110.2 Å²	110.2	29%	0.285	59%	0.59	S	S	.	*	H	α-helix	trans	-61.6	-32.2	175.7	-176.9	-100.3	0	0	0	112.9	E25 M31 L458	E25-F27 PolarHBondContact O-N 3.21Å; F27-M31 VanDerWaalsContact O-CG 3.27Å; F27-M31 WeakPolarHBondContact O-CG 3.44Å; F27-L458 HydrophobicContact CE2-CD1 3.9Å
28	L	38.5	Very low	34.9	Very low	93 Å²	93	111.4 Å²	111.4	49%	0.487	59%	0.588	S	S	.	*	H	α-helix	trans	-87.7	-32.3	178	-67.9	175.6	0	0	0	112.7	S24 E25 E26 G32	S24-L28 WeakPolarHBondContact O-CD1 3.39Å; S24-L28 WeakPolarHBondContact O-CG 3.36Å; E25-L28 PolarHBondContact O-N 3.35Å; E25-L28 VanDerWaalsContact O-N 3.13Å; E26-L28 VanDerWaalsContact C-N 3.27Å; E26-L28 PolarHBondContact O-N 3.22Å; L28-G32 PolarHBondContact O-N 3.43Å
29	Q	36.1	Very low	34.9	Very low	131 Å²	131	111 Å²	111	61%	0.612	58%	0.581	S	S	*	*	H	α-helix	trans	-69.3	-38.1	178.8	-158.8	83.4	22.3	0	0	111.2	E25 E26 M31 G32	E25-Q29 VanDerWaalsContact O-CB 3.3Å; E25-Q29 WeakPolarHBondContact O-CB 3.11Å; E25-Q29 PolarHBondContact O-N 3.4Å; E26-Q29 PolarHBondContact O-N 2.69Å; Q29-M31 VanDerWaalsContact C-N 3.34Å; Q29-G32 PolarHBondContact O-N 2.98Å
30	E	40.8	Very low	34.7	Very low	123 Å²	123	106.3 Å²	106.3	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-72.5	-28.9	179.7	-146.6	170.8	-159.2	0	0	112.1	E26 G32	E26-E30 WeakPolarHBondContact O-CB 3.08Å; E26-E30 PolarHBondContact O-N 2.89Å; E30-G32 VanDerWaalsContact C-N 3.34Å
31	M	36.1	Very low	34.8	Very low	32 Å²	32	104 Å²	104	16%	0.158	56%	0.555	C	S	.	*	H	α-helix	trans	-68.1	-28.6	170.4	-73.1	-96.6	-73.9	0	0	113.2	F27 Q29 T285 T288	F27-M31 VanDerWaalsContact O-CG 3.27Å; F27-M31 WeakPolarHBondContact O-CG 3.44Å; Q29-M31 VanDerWaalsContact C-N 3.34Å; M31-T285 HydrophobicContact CE-CG2 4.3Å; M31-T285 HydrophobicContact SD-CG2 4.13Å; M31-T288 HydrophobicContact CE-CG2 3.85Å
32	G	32	Very low	34.6	Very low	36 Å²	36	103.3 Å²	103.3	37%	0.371	56%	0.562	S	S	.	*	H	α-helix	trans	-72.7	-32	178.2	0	0	0	0	0	113.9	L28 Q29 E30 I34	L28-G32 PolarHBondContact O-N 3.43Å; Q29-G32 PolarHBondContact O-N 2.98Å; E30-G32 VanDerWaalsContact C-N 3.34Å; G32-I34 VanDerWaalsContact C-N 3.34Å; G32-I34 PolarHBondContact O-N 2.95Å
33	N	33.4	Very low	34.5	Very low	107 Å²	107	107.7 Å²	107.7	57%	0.572	57%	0.574	S	S	*	*	H	α-helix	trans	-76.7	-17.2	-177.1	-72.3	-23	0	0	0	113.8
34	I	35.6	Very low	33.9	Very low	77 Å²	77	109.6 Å²	109.6	40%	0.395	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	-21.6	178.7	-63.6	175.8	0	0	0	111.7	G32 E36 I37	G32-I34 VanDerWaalsContact C-N 3.34Å; G32-I34 PolarHBondContact O-N 2.95Å; I34-E36 VanDerWaalsContact C-N 3.3Å; I34-E36 PolarHBondContact O-N 3.17Å; I34-I37 PolarHBondContact O-N 3.39Å
35	Q	33.4	Very low	33.3	Very low	130 Å²	130	112.1 Å²	112.1	61%	0.607	60%	0.603	S	S	*	*	H	α-helix	trans	-66.8	-26.4	179.1	-100.4	165.7	-15.8	0	0	113.8	I37 S38	Q35-I37 VanDerWaalsContact C-N 3.28Å; Q35-I37 PolarHBondContact O-N 3.39Å; Q35-S38 PolarHBondContact O-N 2.92Å; Q35-S38 PolarHBondContact O-OG 2.96Å; Q35-S38 VanDerWaalsContact O-OG 3.08Å
36	E	30.9	Very low	33	Very low	156 Å²	156	111.5 Å²	111.5	73%	0.729	61%	0.614	S	S	*	*	H	α-helix	trans	-71.6	-18.4	179.4	-71.7	-168.6	158.9	0	0	113.7	I34	I34-E36 VanDerWaalsContact C-N 3.3Å; I34-E36 PolarHBondContact O-N 3.17Å
37	I	33.6	Very low	32.4	Very low	122 Å²	122	108 Å²	108	63%	0.626	62%	0.615	S	S	*	*	H	α-helix	trans	-83.1	-28.7	178.9	-60.6	173.1	0	0	0	111.3	I34 Q35 Q39 S40	I34-I37 PolarHBondContact O-N 3.39Å; Q35-I37 VanDerWaalsContact C-N 3.28Å; Q35-I37 PolarHBondContact O-N 3.39Å; I37-Q39 PolarHBondContact O-N 2.91Å; I37-S40 PolarHBondContact O-OG 3.21Å
38	S	31.3	Very low	31.9	Very low	86 Å²	86	110.3 Å²	110.3	60%	0.601	64%	0.639	S	S	*	*	H	α-helix	trans	-74.8	-20.2	-178	79.1	0	0	0	0	114.2	Q35 S40	Q35-S38 PolarHBondContact O-N 2.92Å; Q35-S38 PolarHBondContact O-OG 2.96Å; Q35-S38 VanDerWaalsContact O-OG 3.08Å; S38-S40 VanDerWaalsContact C-N 3.27Å; S38-S40 PolarHBondContact O-N 3.12Å
39	Q	29.2	Very low	31.2	Very low	162 Å²	162	115.2 Å²	115.2	76%	0.757	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	1.2	-174.9	-68.1	-175.4	2	0	0	114.5	I37	I37-Q39 PolarHBondContact O-N 2.91Å
40	S	30.9	Very low	30.6	Very low	80 Å²	80	112.5 Å²	112.5	56%	0.559	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	5.9	-176.9	67.9	0	0	0	0	115.4	I37 S38	I37-S40 PolarHBondContact O-OG 3.21Å; S38-S40 VanDerWaalsContact C-N 3.27Å; S38-S40 PolarHBondContact O-N 3.12Å
41	I	35.2	Very low	29.8	Very low	136 Å²	136	116.8 Å²	116.8	70%	0.697	68%	0.681	S	S	*	*	S	Bend	trans	-134.3	80.7	179	-50.6	179.2	0	0	0	108.9
42	G	31.7	Very low	29.2	Very low	73 Å²	73	120.5 Å²	120.5	75%	0.753	71%	0.705	S	S	*	*			trans	-178	37.3	-178.2	0	0	0	0	0	116.5
43	E	28.4	Very low	28.8	Very low	183 Å²	183	127.3 Å²	127.3	86%	0.855	73%	0.727	S	S	*	*			trans	-134.3	100.1	163.7	-72.4	-170	155	0	0	108.6
44	D	26.6	Very low	28.5	Very low	160 Å²	160	132.6 Å²	132.6	86%	0.856	74%	0.741	S	S	*	*	S	Bend		173.8	139.8	128.6	-86.4	-23.5	0	0	0	111.8
45	S	27.9	Very low	28	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	76%	0.761	S	S	*	*			trans	91.8	74.9	171.9	-53	0	0	0	0	117.8	G47	S45-G47 PolarHBondContact O-N 3.2Å
46	S	27.3	Very low	27.6	Very low	133 Å²	133	142.2 Å²	142.2	93%	0.93	78%	0.776	S	S	*	*			trans	-74.5	104.9	155.5	36.7	0	0	0	0	110.9
47	G	25.8	Very low	27.4	Very low	62 Å²	62	142.6 Å²	142.6	64%	0.639	78%	0.782	S	S	*	*			trans	-115.1	104.8	168.9	0	0	0	0	0	110.6	S45	S45-G47 PolarHBondContact O-N 3.2Å
48	S	25.6	Very low	27	Very low	113 Å²	113	139.8 Å²	139.8	79%	0.79	78%	0.783	S	S	*	*			trans	-64	124.3	177.7	178.3	0	0	0	0	112.1
49	F	23.9	Very low	26.8	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.864	80%	0.796	S	S	*	*			trans	-139.5	115.2	159.4	-69.1	-71.1	0	0	0	110.3
50	G	23.9	Very low	26.6	Very low	73 Å²	73	140.2 Å²	140.2	75%	0.753	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.7	139.8	177.9	0	0	0	0	0	112.1
51	F	22.6	Very low	26.6	Very low	214 Å²	214	142.4 Å²	142.4	94%	0.939	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-87.5	120.4	174.9	-131	-94.8	0	0	0	109.1
52	T	24.5	Very low	26	Very low	110 Å²	110	139.6 Å²	139.6	68%	0.675	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-98.4	129.3	167.4	-45.8	0	0	0	0	109.2
53	E	23.8	Very low	25.9	Very low	178 Å²	178	141.1 Å²	141.1	83%	0.832	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-50.6	134.1	172.4	-156.8	171	-166.5	0	0	112.1
54	Y	25.9	Very low	25.9	Very low	218 Å²	218	139.8 Å²	139.8	86%	0.855	82%	0.817	S	S	*	*			trans	-126.9	118.4	168.7	-93.5	-83	0	0	0	111.8
55	Q	25.8	Very low	25.8	Very low	173 Å²	173	135.7 Å²	135.7	81%	0.808	81%	0.813	S	S	*	*			trans	-71.2	146	172.2	-75	168.9	-30.1	0	0	111.9
56	Y	24.7	Very low	25.8	Very low	237 Å²	237	135.3 Å²	135.3	93%	0.929	81%	0.81	S	S	*	*			trans	-62.8	123.8	166.3	-114.6	-103.3	0	0	0	110.9
57	L	26.9	Very low	25.8	Very low	163 Å²	163	134.3 Å²	134.3	85%	0.853	80%	0.799	S	S	*	*			trans	-138.4	115.4	160.8	-98.6	161.5	0	0	0	108.8
58	G	25.7	Very low	25.9	Very low	63 Å²	63	137.8 Å²	137.8	65%	0.649	80%	0.801	S	S	*	*			trans	-75.2	148.3	171.4	0	0	0	0	0	111.6
59	S	26.3	Very low	26	Very low	126 Å²	126	138.7 Å²	138.7	88%	0.881	80%	0.802	S	S	*	*			trans	-163.4	124.6	158.1	-78.6	0	0	0	0	109.3
60	C	24.9	Very low	26	Very low	132 Å²	132	136.2 Å²	136.2	89%	0.892	80%	0.798	S	S	*	*			trans	-110.8	133.7	167.3	-121.5	0	0	0	0	107.4
61	P	30.8	Very low	26.1	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	80%	0.797	S	S	*	*			trans	-96	136.3	166	18.1	-1.1	0	0	0	111.2
62	G	24	Very low	26.2	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	79%	0.793	S	S	*	*			trans	-90.7	-169.7	176.4	0	0	0	0	0	114.7
63	S	28.8	Very low	26.2	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	80%	0.799	S	S	*	*			trans	154.2	143.4	155.6	-179.5	0	0	0	0	107.5
64	D	27.7	Very low	26.8	Very low	154 Å²	154	133.3 Å²	133.3	82%	0.824	80%	0.795	S	S	*	*			cis	-169.8	157.9	-18.5	-102	-48.2	0	0	0	107.1
65	G	25.9	Very low	26.6	Very low	75 Å²	75	127.2 Å²	127.2	77%	0.773	79%	0.79	S	S	*	*			trans	108.6	134.6	143.1	0	0	0	0	0	116.8
66	S	26.8	Very low	26.6	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	79%	0.792	S	S	*	*			cis	-174.6	163.3	-15	179.5	0	0	0	0	106.8
67	V	27.9	Very low	26.6	Very low	113 Å²	113	119 Å²	119	69%	0.685	79%	0.786	S	S	*	*			trans	110.7	97.5	146.2	-170	0	0	0	0	120.5
68	I	27.5	Very low	27.3	Very low	134 Å²	134	116.6 Å²	116.6	69%	0.687	78%	0.781	S	S	*	*				56	117.3	126.9	-36.3	174.8	0	0	0	121.3
69	T	27.4	Very low	27.2	Very low	133 Å²	133	118.6 Å²	118.6	82%	0.816	79%	0.785	S	S	*	*				170.4	149.7	102.6	35.9	0	0	0	0	113.8
70	D	23.6	Very low	27.2	Very low	144 Å²	144	117.6 Å²	117.6	77%	0.77	78%	0.777	S	S	*	*			trans	-65	158.8	-169.7	-59.6	-73.3	0	0	0	116.8
71	T	26.9	Very low	27.1	Very low	121 Å²	121	117.1 Å²	117.1	74%	0.742	77%	0.77	S	S	*	*				152.2	115.4	105.1	-47.1	0	0	0	0	113
72	L	24.8	Very low	26.8	Very low	164 Å²	164	117.8 Å²	117.8	86%	0.859	77%	0.772	S	S	*	*			trans	27.2	129.6	143.9	-50.5	169.3	0	0	0	122.7
73	S	24.2	Very low	26.8	Very low	113 Å²	113	124.1 Å²	124.1	79%	0.79	77%	0.774	S	S	*	*			trans	-57.7	-176.9	156.6	-41.8	0	0	0	0	113.5
74	P	35.8	Very low	26.8	Very low	116 Å²	116	124.8 Å²	124.8	75%	0.753	78%	0.776	S	S	*	*			cis	-143.1	176.6	1.9	37.8	-15.6	0	0	0	117.4
75	A	23.3	Very low	26.7	Very low	90 Å²	90	123.9 Å²	123.9	74%	0.744	78%	0.775	S	S	*	*			trans	47.8	127.5	145.2	0	0	0	0	0	122.9
76	S	24.2	Very low	27	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	77%	0.774	S	S	*	*				165.2	128.5	114.4	-68.6	0	0	0	0	112.9
77	S	24.8	Very low	27.3	Very low	116 Å²	116	127.2 Å²	127.2	81%	0.811	78%	0.778	S	S	*	*			trans	-89	-179.1	153.3	-51.9	0	0	0	0	108.3
78	P	41.9	Very low	27.1	Very low	113 Å²	113	124.7 Å²	124.7	73%	0.734	78%	0.775	S	S	*	*			cis	-145.4	-167.9	8.3	36.2	-11.9	0	0	0	116.4
79	S	24	Very low	27.3	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	78%	0.78	S	S	*	*			trans	94.8	138.9	156.7	-23.9	0	0	0	0	116.2
80	S	26	Very low	27.5	Very low	104 Å²	104	124.2 Å²	124.2	73%	0.727	78%	0.783	S	S	*	*			cis	-167.8	137.5	10.6	-2.6	0	0	0	0	111.2
81	V	23.9	Very low	27.6	Very low	122 Å²	122	124.3 Å²	124.3	74%	0.739	78%	0.783	S	S	*	*			trans	52.9	115.1	136.7	-169.9	0	0	0	0	120.9
82	T	22.9	Very low	27.9	Very low	141 Å²	141	127.8 Å²	127.8	87%	0.865	79%	0.791	S	S	*	*				-163.1	133.4	113.1	-15.1	0	0	0	0	111.9
83	Y	25	Very low	28	Very low	210 Å²	210	124.6 Å²	124.6	82%	0.824	78%	0.782	S	S	*	*			trans	-88.3	158.7	173.3	-73.6	-86	0	0	0	111.3
84	P	28.4	Very low	28.6	Very low	119 Å²	119	125.2 Å²	125.2	77%	0.773	78%	0.784	S	S	*	*				-142.9	140.7	103.9	30	-11.4	0	0	0	116.3
85	V	26.2	Very low	28.7	Very low	135 Å²	135	125 Å²	125	82%	0.818	79%	0.785	S	S	*	*			trans	57.1	116.4	140.2	-169.8	0	0	0	0	120.8
86	V	31.1	Very low	29.3	Very low	124 Å²	124	124.1 Å²	124.1	75%	0.752	78%	0.784	S	S	*	*			trans	-88.7	154.2	170.9	-167.9	0	0	0	0	109.4
87	P	32.7	Very low	30.2	Very low	132 Å²	132	122.1 Å²	122.1	86%	0.857	78%	0.775	S	S	*	*				-145.9	139	94.3	32	-13	0	0	0	114.1
88	G	25.5	Very low	31.9	Very low	60 Å²	60	121.3 Å²	121.3	62%	0.619	76%	0.761	S	S	*	*			trans	158	61.7	168.1	0	0	0	0	0	114.8	V90	G88-V90 PolarHBondContact O-N 3.33Å
89	S	30.2	Very low	33.4	Very low	115 Å²	115	122.3 Å²	122.3	80%	0.804	76%	0.761	S	S	*	*			trans	-56.2	113.1	163	46.9	0	0	0	0	109.9
90	V	31.8	Very low	36.3	Very low	143 Å²	143	119.6 Å²	119.6	87%	0.867	74%	0.737	S	S	*	*			trans	-78.7	120.5	167.2	-171.3	0	0	0	0	107.3	G88 E92	G88-V90 PolarHBondContact O-N 3.33Å; V90-E92 PolarHBondContact O-N 3.09Å
91	D	26.5	Very low	39.6	Very low	146 Å²	146	120.9 Å²	120.9	78%	0.781	73%	0.732	S	S	*	*			trans	-45.2	122	-179.7	-82.9	-51.5	0	0	0	113.2	S93	D91-S93 PolarHBondContact O-N 3Å; D91-S93 VanDerWaalsContact O-N 3.09Å
92	E	32	Very low	43	Very low	193 Å²	193	115.2 Å²	115.2	90%	0.902	70%	0.697	S	S	*	*			trans	-63.9	103.8	150.4	-88	-164.2	116	0	0	107.8	V90	V90-E92 PolarHBondContact O-N 3.09Å
93	S	27.1	Very low	46.4	Very low	98 Å²	98	117.4 Å²	117.4	69%	0.685	69%	0.69	S	S	*	*			trans	-47.6	132.2	167	-54.3	0	0	0	0	110.6	D91 S95	D91-S93 PolarHBondContact O-N 3Å; D91-S93 VanDerWaalsContact O-N 3.09Å; S93-S95 PolarHBondContact O-N 2.95Å
94	P	37.8	Very low	49.8	Very low	126 Å²	126	107.6 Å²	107.6	82%	0.818	65%	0.652	S	S	*	*			trans	-68.4	111.3	179.4	27.5	-30.4	0	0	0	108.4	G96	P94-G96 PolarHBondContact O-N 3.07Å
95	S	37.1	Very low	53	Low	112 Å²	112	102.2 Å²	102.2	78%	0.783	62%	0.617	S	S	*	*			trans	-43.4	137.6	168.7	-40.4	0	0	0	0	110.2	S93 A97	S93-S95 PolarHBondContact O-N 2.95Å; S95-A97 PolarHBondContact O-N 3.26Å
96	G	36	Very low	56.2	Low	70 Å²	70	97.7 Å²	97.7	72%	0.722	60%	0.597	S	S	*	*			trans	-33.5	119.8	-176.6	0	0	0	0	0	113.1	P94 L98	P94-G96 PolarHBondContact O-N 3.07Å; G96-L98 VanDerWaalsContact C-N 3.34Å; G96-L98 PolarHBondContact O-N 2.81Å
97	A	43.8	Very low	59.2	Low	81 Å²	81	93 Å²	93	67%	0.669	57%	0.568	S	S	*	*			trans	-63.2	96.5	179	0	0	0	0	0	109.1	S95 N99	S95-A97 PolarHBondContact O-N 3.26Å; A97-N99 PolarHBondContact O-N 3.38Å
98	L	59.3	Low	62.1	Low	98 Å²	98	92.9 Å²	92.9	51%	0.513	55%	0.554	S	S	.	*			trans	-43	125.5	169.3	-63.2	169.1	0	0	0	108.5	G96 I100	G96-L98 VanDerWaalsContact C-N 3.34Å; G96-L98 PolarHBondContact O-N 2.81Å; L98-I100 HydrophobicContact CB-CD1 4.02Å; L98-I100 HydrophobicContact CB-CG1 3.82Å; L98-I100 HydrophobicContact CD1-CD1 4.46Å; L98-I100 PolarHBondContact O-N 3.19Å
99	N	73.4	Confident	65.4	Low	135 Å²	135	90.8 Å²	90.8	72%	0.722	53%	0.531	S	S	*	.			trans	-73	63.1	-179.7	-85.7	-30.3	0	0	0	110.7	A97	A97-N99 PolarHBondContact O-N 3.38Å
100	I	86.3	Confident	68.2	Low	48 Å²	48	88.1 Å²	88.1	25%	0.246	51%	0.512	C	S	.	.			trans	-76	127.8	-178.5	-58	170.4	0	0	0	109.1	L98 A109 H117 L184	L98-I100 HydrophobicContact CB-CD1 4.02Å; L98-I100 HydrophobicContact CB-CG1 3.82Å; L98-I100 HydrophobicContact CD1-CD1 4.46Å; L98-I100 PolarHBondContact O-N 3.19Å; I100-A109 HydrophobicContact CG2-CB 4.34Å; I100-A109 WeakPolarHBondContact O-CB 3.22Å; I100-A109 PolarHBondContact O-N 3.25Å; I100-H117 HydrophobicContact CG2-CB 3.88Å; I100-L184 HydrophobicContact CD1-CD2 4.26Å
101	E	94.1	Very high	70.8	Confident	131 Å²	131	82.5 Å²	82.5	61%	0.612	48%	0.483	S	S	*	.	B	Isolated β-bridge	trans	-85.5	149.2	179.2	-63.4	-169.1	167.6	0	0	113.2	R103	E101-R103 PolarHBondContact O-N 3.3Å
102	C	95.4	Very high	73.7	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.014	46%	0.455	C	S	.	.			trans	-69.3	115.7	173	174.4	0	0	0	0	110.2	I104 C105 G106 D107 C119	C102-I104 PolarHBondContact O-N 3.48Å; C102-C105 PolarHBondContact O-N 3.18Å; C102-C105 VanDerWaalsContact O-N 3.14Å; C102-C105 VanDerWaalsContact SG-SG 3.62Å; C102-G106 PolarHBondContact O-N 3.04Å; C102-D107 WeakPolarHBondContact CA-O 3.33Å; C102-D107 WeakPolarHBondContact CB-O 3.27Å; C102-D107 PolarHBondContact N-O 3.07Å; C102-C119 HydrophobicContact CB-CB 3.89Å; C102-C119 PolarHBondContact SG-N 2.97Å
103	R	94.9	Very high	76.5	Confident	187 Å²	187	70.1 Å²	70.1	71%	0.706	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-11.1	-178	-64.6	-75.1	-103.2	176.3	-7.1	114.8	E101 H117	E101-R103 PolarHBondContact O-N 3.3Å; R103-H117 HydrophobicContact CG-CB 4.4Å; R103-H117 PolarHBondContact N-O 2.89Å
104	I	97.1	Very high	79.4	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-39.4	-179.2	-60.7	83.4	0	0	0	111.8	C102 V116 A118 C122 I145 R157 K160 V164 M166	C102-I104 PolarHBondContact O-N 3.48Å; I104-V116 HydrophobicContact CD1-CG2 3.95Å; I104-A118 HydrophobicContact CD1-CB 4.21Å; I104-C122 HydrophobicContact CB-CB 4.16Å; I104-C122 HydrophobicContact CD1-CB 4.44Å; I104-C122 HydrophobicContact CG1-CB 4.39Å; I104-C122 HydrophobicContact CG2-CB 4.28Å; I104-I145 HydrophobicContact CG2-CG2 4.17Å; I104-I145 WeakPolarHBondContact O-CB 3.36Å; I104-I145 VanDerWaalsContact O-CG2 3.25Å; I104-I145 WeakPolarHBondContact O-CG2 3.48Å; I104-R157 HydrophobicContact CG2-CG 4.37Å; I104-K160 HydrophobicContact CG2-CG 4.27Å; I104-V164 HydrophobicContact CD1-CG2 3.94Å; I104-V164 HydrophobicContact CG1-CG2 3.9Å; I104-M166 HydrophobicContact CD1-CE 3.71Å; I104-M166 HydrophobicContact CD1-SD 4.23Å
105	C	95.4	Very high	81.7	Confident	7 Å²	7	62.2 Å²	62.2	5%	0.047	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-1.1	-169.1	70.6	0	0	0	0	115.7	C102 D107 C119 C122 I145 Q146 K147 R150	C102-C105 PolarHBondContact O-N 3.18Å; C102-C105 VanDerWaalsContact O-N 3.14Å; C102-C105 VanDerWaalsContact SG-SG 3.62Å; C105-D107 PolarHBondContact O-N 2.97Å; C105-C119 VanDerWaalsContact SG-SG 3.64Å; C105-C122 VanDerWaalsContact SG-SG 3.65Å; C105-I145 HydrophobicContact CB-CG2 4.1Å; C105-Q146 CarbonylContact O-C 3.55Å; C105-Q146 WeakPolarHBondContact O-CA 3.4Å; C105-K147 PolarHBondContact O-N 3.38Å; C105-R150 HydrophobicContact CB-CB 4.18Å; C105-R150 PolarHBondContact SG-NH1 3.43Å; C105-R150 VanDerWaalsContact SG-NH1 3.36Å
106	G	92.6	Very high	84.2	Confident	39 Å²	39	57.4 Å²	57.4	40%	0.402	33%	0.33	S	S	.	.	S	Bend	trans	72.9	6.5	-179.5	0	0	0	0	0	115.2	C102	C102-G106 PolarHBondContact O-N 3.04Å
107	D	94.9	Very high	86.9	Confident	25 Å²	25	55.3 Å²	55.3	13%	0.134	30%	0.301	C	S	.	.	S	Bend	trans	-75.5	162.9	171.5	-162.9	8.9	0	0	0	111	C102 C105 A109 C119 K147 R150	C102-D107 WeakPolarHBondContact CA-O 3.33Å; C102-D107 WeakPolarHBondContact CB-O 3.27Å; C102-D107 PolarHBondContact N-O 3.07Å; C105-D107 PolarHBondContact O-N 2.97Å; D107-A109 PolarHBondContact O-N 3.31Å; D107-C119 HydrophobicContact CB-CB 4.05Å; D107-K147 HydrophobicContact CB-CB 4.32Å; D107-K147 HydrophobicContact CB-CD 4.03Å; D107-K147 HydrophobicContact CB-CG 4.12Å; D107-K147 WeakPolarHBondContact OD1-CD 3.36Å; D107-K147 WeakPolarHBondContact OD1-CE 3.21Å; D107-K147 IonicContact OD1-NZ 3.82Å; D107-K147 PolarHBondContact OD1-NZ 3.07Å; D107-R150 IonicContact OD2-CZ 2.77Å; D107-R150 IonicContact OD2-NH1 2.8Å; D107-R150 PolarHBondContact OD2-NH1 3Å; D107-R150 IonicContact OD2-NH2 3.75Å
108	K	93.3	Very high	89.2	Confident	130 Å²	130	51.5 Å²	51.5	57%	0.565	27%	0.269	S	S	*	.	B	Isolated β-bridge	trans	-57.5	123.9	178.2	-173.3	170	-177.8	164.6	0	110.6	C119	K108-C119 WeakPolarHBondContact O-CB 3.41Å
109	A	93.1	Very high	91	Very high	17 Å²	17	46.9 Å²	46.9	14%	0.14	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-70.9	136.9	176.7	0	0	0	0	0	109.6	I100 D107 H117	I100-A109 HydrophobicContact CG2-CB 4.34Å; I100-A109 WeakPolarHBondContact O-CB 3.22Å; I100-A109 PolarHBondContact O-N 3.25Å; D107-A109 PolarHBondContact O-N 3.31Å; A109-H117 HydrophobicContact CB-CB 4.19Å
110	S	90.4	Very high	92.1	Very high	58 Å²	58	45.2 Å²	45.2	41%	0.406	23%	0.233	S	C	.	.			trans	-91.1	-5.9	174.5	58.7	0	0	0	0	112.4	H113 A118 E120	S110-H113 PolarHBondContact OG-NE2 3.42Å; S110-A118 PolarHBondContact N-O 3Å; S110-A118 PolarHBondContact OG-O 2.87Å; S110-E120 WeakPolarHBondContact CB-OE1 3.44Å; S110-E120 PolarHBondContact OG-N 3.46Å; S110-E120 PolarHBondContact OG-OE1 2.81Å
111	G	86.9	Confident	92.6	Very high	25 Å²	25	44.2 Å²	44.2	26%	0.258	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	154.2	-166.3	179.6	0	0	0	0	0	112.4	H113 H117 A118	G111-H113 PolarHBondContact O-CD2 3.14Å; G111-H117 WeakPolarHBondContact O-CA 3.19Å; G111-A118 PolarHBondContact O-N 2.92Å; G111-A118 VanDerWaalsContact O-N 3.09Å
112	Y	87.1	Confident	92.7	Very high	46 Å²	46	38 Å²	38	18%	0.18	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	107.4	177.1	-162.1	-99.8	0	0	0	109.3	G115 V116 H117 M176 E180	Y112-G115 VanDerWaalsContact CE1-C 3.48Å; Y112-G115 VanDerWaalsContact CE1-CA 3.46Å; Y112-G115 PolarHBondContact OH-O 3Å; Y112-V116 CarbonylContact C-O 3.24Å; Y112-V116 WeakPolarHBondContact CA-O 3.41Å; Y112-H117 AromaticContact CD2-NE2 3.96Å; Y112-M176 HydrophobicContact CD2-CE 4.09Å; Y112-E180 PolarHBondContact OH-OE1 2.83Å; Y112-E180 VanDerWaalsContact OH-OE1 3.12Å
113	H	89.4	Confident	92.7	Very high	34 Å²	34	40 Å²	40	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.9	-173.1	-58.4	-72.7	0	0	0	109.9	S110 G111 G115 V116 A118 E120 K123	S110-H113 PolarHBondContact OG-NE2 3.42Å; G111-H113 PolarHBondContact O-CD2 3.14Å; H113-G115 PolarHBondContact O-N 3.42Å; H113-V116 PolarHBondContact N-O 3.09Å; H113-V116 PolarHBondContact O-N 2.81Å; H113-A118 HydrophobicContact CB-CB 4.29Å; H113-A118 PolarHBondContact CD2-O 2.87Å; H113-E120 IonicContact NE2-OE1 2.85Å; H113-K123 HydrophobicContact CB-CB 4.2Å; H113-K123 HydrophobicContact CB-CD 4.46Å; H113-K123 HydrophobicContact CB-CG 3.98Å; H113-K123 WeakPolarHBondContact ND1-CE 3.36Å
114	Y	88.8	Confident	92.8	Very high	39 Å²	39	32 Å²	32	15%	0.153	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	30.8	178.7	-55.4	-79.7	0	0	0	113.8	K123 F126 R127 M166 S167 I171	Y114-K123 HydrophobicContact CE2-CG 4.05Å; Y114-F126 AromaticContact CD1-CD1 3.99Å; Y114-F126 HydrophobicContact CD1-CD1 3.99Å; Y114-F126 AromaticContact CD1-CE1 3.88Å; Y114-F126 HydrophobicContact CD1-CE1 3.88Å; Y114-F126 AromaticContact CD2-CD1 3.83Å; Y114-F126 HydrophobicContact CD2-CD1 3.83Å; Y114-F126 HydrophobicContact CD2-CE1 4.44Å; Y114-F126 HydrophobicContact CE1-CD1 4.38Å; Y114-F126 HydrophobicContact CE2-CD1 4.25Å; Y114-F126 AromaticContact CG-CD1 3.71Å; Y114-F126 HydrophobicContact CG-CD1 3.71Å; Y114-F126 AromaticContact CG-CE1 3.86Å; Y114-F126 HydrophobicContact CG-CE1 3.86Å; Y114-R127 HydrophobicContact CE2-CB 4.33Å; Y114-R127 WeakPolarHBondContact OH-CB 3.24Å; Y114-R127 WeakPolarHBondContact OH-CD 3.21Å; Y114-R127 VanDerWaalsContact OH-CG 3.27Å; Y114-R127 WeakPolarHBondContact OH-CG 3.39Å; Y114-M166 CarbonylContact O-C 3.58Å; Y114-M166 VanDerWaalsContact O-CA 3.32Å; Y114-M166 WeakPolarHBondContact O-CA 3.39Å; Y114-S167 PolarHBondContact O-N 2.84Å; Y114-I171 HydrophobicContact CD1-CD1 4.09Å; Y114-I171 HydrophobicContact CD1-CG1 3.56Å; Y114-I171 HydrophobicContact CE1-CD1 3.64Å; Y114-I171 HydrophobicContact CE1-CG1 3.49Å; Y114-I171 VanDerWaalsContact CE1-CG1 3.49Å
115	G	86.7	Confident	92.8	Very high	19 Å²	19	33 Å²	33	20%	0.196	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	6.3	178.7	0	0	0	0	0	115.5	Y112 H113	Y112-G115 VanDerWaalsContact CE1-C 3.48Å; Y112-G115 VanDerWaalsContact CE1-CA 3.46Å; Y112-G115 PolarHBondContact OH-O 3Å; H113-G115 PolarHBondContact O-N 3.42Å
116	V	89.9	Confident	92.9	Very high	10 Å²	10	32.7 Å²	32.7	6%	0.061	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.7	178.9	-51.7	0	0	0	0	112.8	I104 Y112 H113 A118 V164 M166	I104-V116 HydrophobicContact CD1-CG2 3.95Å; Y112-V116 CarbonylContact C-O 3.24Å; Y112-V116 WeakPolarHBondContact CA-O 3.41Å; H113-V116 PolarHBondContact N-O 3.09Å; H113-V116 PolarHBondContact O-N 2.81Å; V116-A118 HydrophobicContact CG2-CB 4.32Å; V116-A118 PolarHBondContact O-N 3.22Å; V116-V164 HydrophobicContact CG1-CG2 4.21Å; V116-V164 WeakPolarHBondContact CG1-O 3.05Å; V116-V164 HydrophobicContact CG2-CG2 4.42Å; V116-M166 HydrophobicContact CG1-CG 4.29Å; V116-M166 HydrophobicContact CG2-CE 3.45Å; V116-M166 VanDerWaalsContact CG2-CE 3.45Å; V116-M166 HydrophobicContact CG2-CG 3.38Å; V116-M166 HydrophobicContact CG2-SD 4.24Å
117	H	91.4	Very high	93	Very high	27 Å²	27	37.4 Å²	37.4	13%	0.125	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	116.5	167.2	-72.5	-72.5	0	0	0	111.5	I100 R103 A109 G111 Y112 M176	I100-H117 HydrophobicContact CG2-CB 3.88Å; R103-H117 HydrophobicContact CG-CB 4.4Å; R103-H117 PolarHBondContact N-O 2.89Å; A109-H117 HydrophobicContact CB-CB 4.19Å; G111-H117 WeakPolarHBondContact O-CA 3.19Å; Y112-H117 AromaticContact CD2-NE2 3.96Å; H117-M176 WeakPolarHBondContact CE1-CE 3.01Å; H117-M176 WeakPolarHBondContact NE2-CE 3.5Å
118	A	93.4	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.9	-175.6	0	0	0	0	0	112.4	I104 S110 G111 H113 V116 M166	I104-A118 HydrophobicContact CD1-CB 4.21Å; S110-A118 PolarHBondContact N-O 3Å; S110-A118 PolarHBondContact OG-O 2.87Å; G111-A118 PolarHBondContact O-N 2.92Å; G111-A118 VanDerWaalsContact O-N 3.09Å; H113-A118 HydrophobicContact CB-CB 4.29Å; H113-A118 PolarHBondContact CD2-O 2.87Å; V116-A118 HydrophobicContact CG2-CB 4.32Å; V116-A118 PolarHBondContact O-N 3.22Å; A118-M166 HydrophobicContact CB-CE 3.31Å
119	C	96.1	Very high	93.2	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.014	20%	0.195	C	C	.	.			trans	-74.6	161.4	166.7	69.8	0	0	0	0	111	C102 C105 D107 K108 G121 C122 K123 R150	C102-C119 HydrophobicContact CB-CB 3.89Å; C102-C119 PolarHBondContact SG-N 2.97Å; C105-C119 VanDerWaalsContact SG-SG 3.64Å; D107-C119 HydrophobicContact CB-CB 4.05Å; K108-C119 WeakPolarHBondContact O-CB 3.41Å; C119-G121 PolarHBondContact O-N 3.37Å; C119-G121 VanDerWaalsContact O-N 3.15Å; C119-C122 PolarHBondContact O-N 3.21Å; C119-C122 VanDerWaalsContact O-N 3.15Å; C119-C122 PolarHBondContact SG-N 3.03Å; C119-C122 VanDerWaalsContact SG-N 3.35Å; C119-K123 WeakPolarHBondContact O-CB 3.36Å; C119-K123 PolarHBondContact O-N 3.47Å; C119-R150 PolarHBondContact SG-NH1 2.57Å
120	E	95.9	Very high	93.3	Very high	100 Å²	100	39.8 Å²	39.8	47%	0.467	20%	0.202	S	C	.	.	H	α-helix	trans	-55.1	-34.7	176.2	-73.3	-55.8	125.8	0	0	112.7	S110 H113 K123 G124	S110-E120 WeakPolarHBondContact CB-OE1 3.44Å; S110-E120 PolarHBondContact OG-N 3.46Å; S110-E120 PolarHBondContact OG-OE1 2.81Å; H113-E120 IonicContact NE2-OE1 2.85Å; E120-K123 VanDerWaalsContact CD-NZ 3.28Å; E120-K123 IonicContact OE1-NZ 4Å; E120-K123 PolarHBondContact OE1-NZ 2.82Å; E120-K123 WeakPolarHBondContact OE2-CD 3.38Å; E120-K123 IonicContact OE2-NZ 3.79Å; E120-K123 PolarHBondContact OE2-NZ 3.42Å; E120-G124 PolarHBondContact O-N 2.9Å
121	G	96.7	Very high	93.4	Very high	27 Å²	27	47.1 Å²	47.1	28%	0.278	22%	0.221	S	C	.	.	H	α-helix	trans	-64.6	-42.9	178.8	0	0	0	0	0	113.8	C119 F125 R157	C119-G121 PolarHBondContact O-N 3.37Å; C119-G121 VanDerWaalsContact O-N 3.15Å; G121-F125 VanDerWaalsContact O-CB 3.32Å; G121-F125 WeakPolarHBondContact O-CB 3.37Å; G121-F125 PolarHBondContact O-N 2.92Å; G121-F125 VanDerWaalsContact O-N 3.16Å; G121-R157 PolarHBondContact O-NH2 2.87Å
122	C	97.6	Very high	93.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-81.1	-34.1	-179.7	-68.2	0	0	0	0	112.3	I104 C105 C119 F125 F126 R157	I104-C122 HydrophobicContact CB-CB 4.16Å; I104-C122 HydrophobicContact CD1-CB 4.44Å; I104-C122 HydrophobicContact CG1-CB 4.39Å; I104-C122 HydrophobicContact CG2-CB 4.28Å; C105-C122 VanDerWaalsContact SG-SG 3.65Å; C119-C122 PolarHBondContact O-N 3.21Å; C119-C122 VanDerWaalsContact O-N 3.15Å; C119-C122 PolarHBondContact SG-N 3.03Å; C119-C122 VanDerWaalsContact SG-N 3.35Å; C122-F125 PolarHBondContact O-N 3.15Å; C122-F126 WeakPolarHBondContact O-CB 3.39Å; C122-F126 PolarHBondContact O-N 3.02Å; C122-R157 PolarHBondContact SG-NH2 3.39Å; C122-R157 VanDerWaalsContact SG-NH2 3.4Å
123	K	95.4	Very high	94.1	Very high	44 Å²	44	57.3 Å²	57.3	19%	0.191	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-52.5	169	171.8	-160.2	-178.1	-174.1	0	111.3	H113 Y114 C119 E120 F125 F126 R127	H113-K123 HydrophobicContact CB-CB 4.2Å; H113-K123 HydrophobicContact CB-CD 4.46Å; H113-K123 HydrophobicContact CB-CG 3.98Å; H113-K123 WeakPolarHBondContact ND1-CE 3.36Å; Y114-K123 HydrophobicContact CE2-CG 4.05Å; C119-K123 WeakPolarHBondContact O-CB 3.36Å; C119-K123 PolarHBondContact O-N 3.47Å; E120-K123 VanDerWaalsContact CD-NZ 3.28Å; E120-K123 IonicContact OE1-NZ 4Å; E120-K123 PolarHBondContact OE1-NZ 2.82Å; E120-K123 WeakPolarHBondContact OE2-CD 3.38Å; E120-K123 IonicContact OE2-NZ 3.79Å; E120-K123 PolarHBondContact OE2-NZ 3.42Å; K123-F125 PolarHBondContact O-N 3.15Å; K123-F126 PolarHBondContact O-N 3.42Å; K123-R127 WeakPolarHBondContact O-CB 3.39Å; K123-R127 PolarHBondContact O-N 3.3Å
124	G	96.1	Very high	94.4	Very high	20 Å²	20	58.9 Å²	58.9	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-40.3	-179.6	0	0	0	0	0	112.8	E120 R128	E120-G124 PolarHBondContact O-N 2.9Å; G124-R128 WeakPolarHBondContact O-CB 3.35Å; G124-R128 PolarHBondContact O-N 2.95Å
125	F	98	Very high	94.7	Very high	23 Å²	23	63.6 Å²	63.6	10%	0.101	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-55.3	174.9	174.1	-101.5	0	0	0	111.7	G121 C122 K123 R127 R128 T129 Y136 Q154 R157 F158	G121-F125 VanDerWaalsContact O-CB 3.32Å; G121-F125 WeakPolarHBondContact O-CB 3.37Å; G121-F125 PolarHBondContact O-N 2.92Å; G121-F125 VanDerWaalsContact O-N 3.16Å; C122-F125 PolarHBondContact O-N 3.15Å; K123-F125 PolarHBondContact O-N 3.15Å; F125-R127 PolarHBondContact O-N 3.46Å; F125-R128 PolarHBondContact O-N 3.46Å; F125-R128 VanDerWaalsContact O-N 3.13Å; F125-T129 PolarHBondContact O-N 3.32Å; F125-T129 PolarHBondContact O-OG1 2.97Å; F125-T129 VanDerWaalsContact O-OG1 3.06Å; F125-Y136 HydrophobicContact CE2-CE2 4.3Å; F125-Y136 AromaticContact CZ-CE2 3.84Å; F125-Y136 HydrophobicContact CZ-CE2 3.84Å; F125-Q154 HydrophobicContact CE2-CB 4.33Å; F125-Q154 HydrophobicContact CE2-CG 4.35Å; F125-Q154 HydrophobicContact CZ-CB 4.34Å; F125-R157 HydrophobicContact CD1-CG 4.08Å; F125-R157 HydrophobicContact CE1-CB 4.04Å; F125-R157 HydrophobicContact CE1-CG 3.84Å; F125-R157 HydrophobicContact CZ-CB 4.19Å; F125-R157 HydrophobicContact CZ-CG 4.35Å; F125-F158 HydrophobicContact CE1-CB 3.72Å; F125-F158 HydrophobicContact CE1-CD2 4.14Å; F125-F158 HydrophobicContact CE1-CG 4.42Å; F125-F158 HydrophobicContact CZ-CB 3.91Å
126	F	96.8	Very high	95.1	Very high	1 Å²	1	64.3 Å²	64.3	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-46.8	-179.8	-175.4	-99	0	0	0	112	Y114 C122 K123 R128 T129 I130 F158 C161 L162 M166	Y114-F126 AromaticContact CD1-CD1 3.99Å; Y114-F126 HydrophobicContact CD1-CD1 3.99Å; Y114-F126 AromaticContact CD1-CE1 3.88Å; Y114-F126 HydrophobicContact CD1-CE1 3.88Å; Y114-F126 AromaticContact CD2-CD1 3.83Å; Y114-F126 HydrophobicContact CD2-CD1 3.83Å; Y114-F126 HydrophobicContact CD2-CE1 4.44Å; Y114-F126 HydrophobicContact CE1-CD1 4.38Å; Y114-F126 HydrophobicContact CE2-CD1 4.25Å; Y114-F126 AromaticContact CG-CD1 3.71Å; Y114-F126 HydrophobicContact CG-CD1 3.71Å; Y114-F126 AromaticContact CG-CE1 3.86Å; Y114-F126 HydrophobicContact CG-CE1 3.86Å; C122-F126 WeakPolarHBondContact O-CB 3.39Å; C122-F126 PolarHBondContact O-N 3.02Å; K123-F126 PolarHBondContact O-N 3.42Å; F126-R128 VanDerWaalsContact C-N 3.3Å; F126-R128 PolarHBondContact O-N 3.04Å; F126-T129 PolarHBondContact O-N 3.48Å; F126-I130 HydrophobicContact CD1-CG1 4.27Å; F126-I130 HydrophobicContact CE1-CG1 3.94Å; F126-I130 HydrophobicContact CE2-CD1 4.42Å; F126-I130 HydrophobicContact CE2-CG1 4.31Å; F126-I130 HydrophobicContact CZ-CD1 4.2Å; F126-I130 HydrophobicContact CZ-CG1 3.96Å; F126-I130 WeakPolarHBondContact O-CG1 3.34Å; F126-I130 PolarHBondContact O-N 3.16Å; F126-F158 HydrophobicContact CD2-CD2 4.12Å; F126-F158 AromaticContact CD2-CE2 3.68Å; F126-F158 HydrophobicContact CD2-CE2 3.68Å; F126-F158 AromaticContact CE2-CE2 3.8Å; F126-F158 HydrophobicContact CE2-CE2 3.8Å; F126-F158 HydrophobicContact CE2-CZ 4.5Å; F126-C161 HydrophobicContact CD2-CB 3.74Å; F126-C161 HydrophobicContact CE2-CB 4.3Å; F126-L162 HydrophobicContact CE2-CD2 3.92Å; F126-L162 HydrophobicContact CZ-CD2 4.47Å; F126-M166 HydrophobicContact CB-SD 3.81Å; F126-M166 HydrophobicContact CD1-CB 4.38Å; F126-M166 HydrophobicContact CD1-SD 4.37Å; F126-M166 HydrophobicContact CD2-CB 3.87Å; F126-M166 HydrophobicContact CD2-SD 3.94Å; F126-M166 HydrophobicContact CE1-CB 4.15Å; F126-M166 HydrophobicContact CE2-CB 3.61Å; F126-M166 HydrophobicContact CG-CB 4.24Å; F126-M166 HydrophobicContact CG-SD 3.78Å; F126-M166 HydrophobicContact CZ-CB 3.76Å; F126-M166 WeakPolarHBondContact CZ-O 3.43Å
127	R	95.1	Very high	95.3	Very high	139 Å²	139	71.1 Å²	71.1	53%	0.525	34%	0.338	S	S	.	.	H	α-helix	trans	-56.7	-42.9	176.8	-173.8	176.5	67	-178.8	-0.2	112.4	Y114 K123 F125 R131	Y114-R127 HydrophobicContact CE2-CB 4.33Å; Y114-R127 WeakPolarHBondContact OH-CB 3.24Å; Y114-R127 WeakPolarHBondContact OH-CD 3.21Å; Y114-R127 VanDerWaalsContact OH-CG 3.27Å; Y114-R127 WeakPolarHBondContact OH-CG 3.39Å; K123-R127 WeakPolarHBondContact O-CB 3.39Å; K123-R127 PolarHBondContact O-N 3.3Å; F125-R127 PolarHBondContact O-N 3.46Å; R127-R131 VanDerWaalsContact O-CB 3.22Å; R127-R131 WeakPolarHBondContact O-CB 3.13Å; R127-R131 PolarHBondContact O-N 3.05Å
128	R	96.8	Very high	95.4	Very high	161 Å²	161	77 Å²	77	61%	0.608	36%	0.363	S	S	*	.	H	α-helix	trans	-67.7	-46	-179.5	-173.5	179.7	-62.3	161.4	0.8	111.2	G124 F125 F126 I130 R131 L132 L134	G124-R128 WeakPolarHBondContact O-CB 3.35Å; G124-R128 PolarHBondContact O-N 2.95Å; F125-R128 PolarHBondContact O-N 3.46Å; F125-R128 VanDerWaalsContact O-N 3.13Å; F126-R128 VanDerWaalsContact C-N 3.3Å; F126-R128 PolarHBondContact O-N 3.04Å; R128-I130 VanDerWaalsContact C-N 3.33Å; R128-I130 PolarHBondContact O-N 2.84Å; R128-R131 PolarHBondContact O-N 3.02Å; R128-L132 HydrophobicContact CG-CD1 3.65Å; R128-L132 HydrophobicContact CG-CG 4.32Å; R128-L132 WeakPolarHBondContact O-CB 3.38Å; R128-L132 PolarHBondContact O-N 3.13Å; R128-L134 HydrophobicContact CG-CD1 4.37Å
129	T	96.7	Very high	95.5	Very high	3 Å²	3	78.2 Å²	78.2	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-57.6	-46.1	177.9	-52.8	0	0	0	0	111.3	F125 F126 K133 L134 Y136 F158	F125-T129 PolarHBondContact O-N 3.32Å; F125-T129 PolarHBondContact O-OG1 2.97Å; F125-T129 VanDerWaalsContact O-OG1 3.06Å; F126-T129 PolarHBondContact O-N 3.48Å; T129-K133 WeakPolarHBondContact O-CA 3.46Å; T129-K133 PolarHBondContact O-N 3.09Å; T129-K133 VanDerWaalsContact O-N 3.07Å; T129-L134 HydrophobicContact CG2-CB 4.22Å; T129-L134 PolarHBondContact O-N 3.05Å; T129-Y136 HydrophobicContact CG2-CE2 3.56Å; T129-Y136 PolarHBondContact OG1-OH 3.42Å; T129-F158 HydrophobicContact CG2-CD1 4.02Å; T129-F158 HydrophobicContact CG2-CD2 3.56Å; T129-F158 HydrophobicContact CG2-CE1 3.88Å; T129-F158 HydrophobicContact CG2-CE2 3.41Å; T129-F158 VanDerWaalsContact CG2-CE2 3.41Å; T129-F158 HydrophobicContact CG2-CG 3.88Å; T129-F158 HydrophobicContact CG2-CZ 3.57Å
130	I	93.8	Very high	95.3	Very high	57 Å²	57	84.1 Å²	84.1	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-69.4	-50.2	179.3	-60.7	-62.1	0	0	0	111.9	F126 R128 L132 K133 F158 H168	F126-I130 HydrophobicContact CD1-CG1 4.27Å; F126-I130 HydrophobicContact CE1-CG1 3.94Å; F126-I130 HydrophobicContact CE2-CD1 4.42Å; F126-I130 HydrophobicContact CE2-CG1 4.31Å; F126-I130 HydrophobicContact CZ-CD1 4.2Å; F126-I130 HydrophobicContact CZ-CG1 3.96Å; F126-I130 WeakPolarHBondContact O-CG1 3.34Å; F126-I130 PolarHBondContact O-N 3.16Å; R128-I130 VanDerWaalsContact C-N 3.33Å; R128-I130 PolarHBondContact O-N 2.84Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 3.06Å; I130-K133 PolarHBondContact O-N 2.98Å; I130-F158 HydrophobicContact CD1-CE2 4.14Å; I130-F158 HydrophobicContact CD1-CZ 3.82Å; I130-H168 HydrophobicContact CG2-CB 4.27Å
131	R	93.2	Very high	94.9	Very high	212 Å²	212	89.9 Å²	89.9	80%	0.8	42%	0.421	S	S	*	.	H	α-helix	trans	-63.2	-39	-175.5	-179.6	175.2	172.5	161.4	-2.2	112.6	R127 R128	R127-R131 VanDerWaalsContact O-CB 3.22Å; R127-R131 WeakPolarHBondContact O-CB 3.13Å; R127-R131 PolarHBondContact O-N 3.05Å; R128-R131 PolarHBondContact O-N 3.02Å
132	L	95.1	Very high	94.6	Very high	104 Å²	104	93.7 Å²	93.7	55%	0.545	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	2.3	-179.5	-58.1	-179.2	0	0	0	112.7	R128 I130 L134	R128-L132 HydrophobicContact CG-CD1 3.65Å; R128-L132 HydrophobicContact CG-CG 4.32Å; R128-L132 WeakPolarHBondContact O-CB 3.38Å; R128-L132 PolarHBondContact O-N 3.13Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 3.06Å; L132-L134 HydrophobicContact CB-CD1 4.44Å; L132-L134 HydrophobicContact CB-CD2 3.81Å; L132-L134 HydrophobicContact CB-CG 3.84Å; L132-L134 PolarHBondContact O-N 2.87Å
133	K	93.8	Very high	94.5	Very high	182 Å²	182	96 Å²	96	79%	0.791	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	45.8	-176.7	-59.5	-177.3	178.9	-179.4	0	112.5	T129 I130	T129-K133 WeakPolarHBondContact O-CA 3.46Å; T129-K133 PolarHBondContact O-N 3.09Å; T129-K133 VanDerWaalsContact O-N 3.07Å; I130-K133 PolarHBondContact O-N 2.98Å
134	L	95.6	Very high	94.4	Very high	66 Å²	66	101.4 Å²	101.4	35%	0.346	48%	0.482	S	S	.	.			trans	-71.7	132.2	-178.4	-56.6	178	0	0	0	110	R128 T129 L132 Y136	R128-L134 HydrophobicContact CG-CD1 4.37Å; T129-L134 HydrophobicContact CG2-CB 4.22Å; T129-L134 PolarHBondContact O-N 3.05Å; L132-L134 HydrophobicContact CB-CD1 4.44Å; L132-L134 HydrophobicContact CB-CD2 3.81Å; L132-L134 HydrophobicContact CB-CG 3.84Å; L132-L134 PolarHBondContact O-N 2.87Å; L134-Y136 HydrophobicContact CB-CE1 4.12Å; L134-Y136 HydrophobicContact CD1-CE1 4.42Å; L134-Y136 WeakPolarHBondContact CD1-OH 3.37Å
135	V	93.9	Very high	94.5	Very high	139 Å²	139	101.5 Å²	101.5	84%	0.842	48%	0.478	S	S	*	.			trans	-108.8	130.6	171.9	-177.2	0	0	0	0	107.5
136	Y	96	Very high	94.4	Very high	33 Å²	33	103.5 Å²	103.5	13%	0.129	49%	0.488	C	S	.	.			trans	-108.9	141.7	179.1	-55.4	-59.6	0	0	0	109.7	F125 T129 L134 K138 Q154 F158	F125-Y136 HydrophobicContact CE2-CE2 4.3Å; F125-Y136 AromaticContact CZ-CE2 3.84Å; F125-Y136 HydrophobicContact CZ-CE2 3.84Å; T129-Y136 HydrophobicContact CG2-CE2 3.56Å; T129-Y136 PolarHBondContact OG1-OH 3.42Å; L134-Y136 HydrophobicContact CB-CE1 4.12Å; L134-Y136 HydrophobicContact CD1-CE1 4.42Å; L134-Y136 WeakPolarHBondContact CD1-OH 3.37Å; Y136-K138 PolarHBondContact O-N 3.27Å; Y136-Q154 HydrophobicContact CD1-CB 3.64Å; Y136-Q154 HydrophobicContact CD1-CG 4.48Å; Y136-Q154 HydrophobicContact CD2-CB 4.1Å; Y136-Q154 HydrophobicContact CE1-CB 3.75Å; Y136-Q154 HydrophobicContact CE1-CG 4.29Å; Y136-Q154 HydrophobicContact CE2-CB 4.19Å; Y136-Q154 HydrophobicContact CG-CB 3.84Å; Y136-F158 HydrophobicContact CD2-CB 4.05Å; Y136-F158 HydrophobicContact CD2-CG 4.45Å; Y136-F158 HydrophobicContact CE2-CB 3.94Å; Y136-F158 HydrophobicContact CE2-CG 4.2Å
137	D	94.3	Very high	94.3	Very high	154 Å²	154	109.4 Å²	109.4	82%	0.824	51%	0.513	S	S	*	.			trans	-58.3	136.3	175.2	-61.8	-42.5	0	0	0	111	C139 Y155	D137-C139 PolarHBondContact O-N 2.96Å; D137-Y155 VanDerWaalsContact O-CB 3.23Å; D137-Y155 WeakPolarHBondContact O-CB 3.14Å
138	K	94	Very high	94.2	Very high	149 Å²	149	111.5 Å²	111.5	65%	0.648	53%	0.526	S	S	*	.			trans	-61.1	134	-177.5	-174.3	179.3	178.2	-161.3	0	110.3	Y136 D140 Y155	Y136-K138 PolarHBondContact O-N 3.27Å; K138-D140 VanDerWaalsContact CE-OD1 3.28Å; K138-D140 WeakPolarHBondContact CE-OD1 3.2Å; K138-D140 IonicContact NZ-OD1 3.06Å; K138-Y155 HydrophobicContact CB-CE2 4.19Å; K138-Y155 HydrophobicContact CG-CE1 4.17Å; K138-Y155 HydrophobicContact CG-CE2 4.11Å
139	C	94.8	Very high	94	Very high	27 Å²	27	105.5 Å²	105.5	18%	0.182	51%	0.506	C	S	.	.			trans	-115.4	122.1	173.5	-175.4	0	0	0	0	110.1	D137 Y155	D137-C139 PolarHBondContact O-N 2.96Å; C139-Y155 HydrophobicContact CB-CD1 3.67Å; C139-Y155 HydrophobicContact CB-CE1 4.43Å; C139-Y155 HydrophobicContact CB-CG 4.24Å; C139-Y155 VanDerWaalsContact N-CD1 3.25Å; C139-Y155 WeakPolarHBondContact O-CE1 3.46Å
140	D	92.4	Very high	94	Very high	126 Å²	126	107.4 Å²	107.4	67%	0.674	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-3.9	-179.4	-56.3	-55.9	0	0	0	113.6	K138 S142	K138-D140 VanDerWaalsContact CE-OD1 3.28Å; K138-D140 WeakPolarHBondContact CE-OD1 3.2Å; K138-D140 IonicContact NZ-OD1 3.06Å; D140-S142 VanDerWaalsContact C-N 3.3Å; D140-S142 PolarHBondContact O-N 3.49Å
141	R	87.9	Confident	94.1	Very high	220 Å²	220	110.7 Å²	110.7	83%	0.83	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-0.8	-173.1	-53	-175.3	-156.9	-159.8	4.9	114.6	C143	R141-C143 VanDerWaalsContact C-N 3.32Å; R141-C143 PolarHBondContact O-N 3.11Å
142	S	89.6	Confident	94.2	Very high	108 Å²	108	109.2 Å²	109.2	76%	0.755	53%	0.531	S	S	*	.			trans	44.2	51.8	-179.2	-64.2	0	0	0	0	113.8	D140 K144	D140-S142 VanDerWaalsContact C-N 3.3Å; D140-S142 PolarHBondContact O-N 3.49Å; S142-K144 PolarHBondContact O-N 3.28Å
143	C	94.9	Very high	94.3	Very high	47 Å²	47	105.2 Å²	105.2	32%	0.318	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-56.2	130.9	-170.9	-60.3	0	0	0	0	113.4	R141 I145 C153 C156	R141-C143 VanDerWaalsContact C-N 3.32Å; R141-C143 PolarHBondContact O-N 3.11Å; C143-I145 HydrophobicContact CB-CD1 4.45Å; C143-I145 PolarHBondContact O-N 3.42Å; C143-C153 HydrophobicContact CB-CB 4.24Å; C143-C156 HydrophobicContact CB-CB 3.78Å; C143-C156 PolarHBondContact N-SG 2.88Å; C143-C156 VanDerWaalsContact N-SG 3.39Å
144	K	94.4	Very high	94.5	Very high	158 Å²	158	101.8 Å²	101.8	69%	0.687	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-70.8	120	171.7	-170.2	175	-176	174.3	0	111	S142 Q146 N149	S142-K144 PolarHBondContact O-N 3.28Å; K144-Q146 HydrophobicContact CG-CG 4.36Å; K144-N149 PolarHBondContact O-ND2 3.38Å; K144-N149 PolarHBondContact O-OD1 2.88Å
145	I	97.3	Very high	94.6	Very high	22 Å²	22	101.7 Å²	101.7	11%	0.113	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-92.9	118.2	-176.7	-50.5	-57.3	0	0	0	110.5	I104 C105 C143 R150 C156 R157 K160	I104-I145 HydrophobicContact CG2-CG2 4.17Å; I104-I145 WeakPolarHBondContact O-CB 3.36Å; I104-I145 VanDerWaalsContact O-CG2 3.25Å; I104-I145 WeakPolarHBondContact O-CG2 3.48Å; C105-I145 HydrophobicContact CB-CG2 4.1Å; C143-I145 HydrophobicContact CB-CD1 4.45Å; C143-I145 PolarHBondContact O-N 3.42Å; I145-R150 HydrophobicContact CG2-CB 3.84Å; I145-C156 HydrophobicContact CD1-CB 4.02Å; I145-R157 HydrophobicContact CD1-CB 4.17Å; I145-R157 HydrophobicContact CG2-CG 4.2Å; I145-K160 HydrophobicContact CG1-CB 4.22Å; I145-K160 HydrophobicContact CG1-CG 4.48Å
146	Q	95.1	Very high	94.8	Very high	66 Å²	66	95.6 Å²	95.6	31%	0.308	46%	0.457	S	S	.	.			trans	-135.9	159.8	179.3	-63.9	-177.9	-36.3	0	0	110.2	C105 K144 K148 N149 R150	C105-Q146 CarbonylContact O-C 3.55Å; C105-Q146 WeakPolarHBondContact O-CA 3.4Å; K144-Q146 HydrophobicContact CG-CG 4.36Å; Q146-K148 HydrophobicContact CB-CG 4.46Å; Q146-K148 PolarHBondContact O-N 3.21Å; Q146-K148 VanDerWaalsContact O-N 3.08Å; Q146-K148 VanDerWaalsContact OE1-CE 3.31Å; Q146-N149 WeakPolarHBondContact CA-OD1 3.32Å; Q146-N149 PolarHBondContact N-OD1 3.09Å; Q146-N149 PolarHBondContact O-N 3.02Å; Q146-N149 PolarHBondContact O-OD1 2.87Å; Q146-R150 WeakPolarHBondContact O-CB 3.38Å; Q146-R150 PolarHBondContact O-N 3.41Å
147	K	95.1	Very high	94.9	Very high	125 Å²	125	94.4 Å²	94.4	54%	0.543	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-45.6	-179.5	-177	175.4	-179	160.9	0	113.3	C105 D107	C105-K147 PolarHBondContact O-N 3.38Å; D107-K147 HydrophobicContact CB-CB 4.32Å; D107-K147 HydrophobicContact CB-CD 4.03Å; D107-K147 HydrophobicContact CB-CG 4.12Å; D107-K147 WeakPolarHBondContact OD1-CD 3.36Å; D107-K147 WeakPolarHBondContact OD1-CE 3.21Å; D107-K147 IonicContact OD1-NZ 3.82Å; D107-K147 PolarHBondContact OD1-NZ 3.07Å
148	K	93.8	Very high	95	Very high	182 Å²	182	88.9 Å²	88.9	79%	0.791	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-27.1	-178.5	64.4	-177.2	178.5	-176.8	0	115.3	Q146	Q146-K148 HydrophobicContact CB-CG 4.46Å; Q146-K148 PolarHBondContact O-N 3.21Å; Q146-K148 VanDerWaalsContact O-N 3.08Å; Q146-K148 VanDerWaalsContact OE1-CE 3.31Å
149	N	93.2	Very high	95.1	Very high	36 Å²	36	86.8 Å²	86.8	19%	0.193	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	3.3	-171.1	73.4	3.4	0	0	0	113.8	K144 Q146 N151 K152	K144-N149 PolarHBondContact O-ND2 3.38Å; K144-N149 PolarHBondContact O-OD1 2.88Å; Q146-N149 WeakPolarHBondContact CA-OD1 3.32Å; Q146-N149 PolarHBondContact N-OD1 3.09Å; Q146-N149 PolarHBondContact O-N 3.02Å; Q146-N149 PolarHBondContact O-OD1 2.87Å; N149-N151 PolarHBondContact O-N 3.49Å; N149-K152 HydrophobicContact CB-CD 3.99Å; N149-K152 HydrophobicContact CB-CG 4.2Å; N149-K152 WeakPolarHBondContact O-CB 3.34Å; N149-K152 WeakPolarHBondContact O-CG 3.43Å; N149-K152 PolarHBondContact O-N 3.46Å
150	R	95.5	Very high	95.2	Very high	42 Å²	42	89.7 Å²	89.7	16%	0.158	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-15.8	-175.9	67.2	-174.8	-175	-163.4	-5.1	114.7	C105 D107 C119 I145 Q146 R157	C105-R150 HydrophobicContact CB-CB 4.18Å; C105-R150 PolarHBondContact SG-NH1 3.43Å; C105-R150 VanDerWaalsContact SG-NH1 3.36Å; D107-R150 IonicContact OD2-CZ 2.77Å; D107-R150 IonicContact OD2-NH1 2.8Å; D107-R150 PolarHBondContact OD2-NH1 3Å; D107-R150 IonicContact OD2-NH2 3.75Å; C119-R150 PolarHBondContact SG-NH1 2.57Å; I145-R150 HydrophobicContact CG2-CB 3.84Å; Q146-R150 WeakPolarHBondContact O-CB 3.38Å; Q146-R150 PolarHBondContact O-N 3.41Å; R150-R157 WeakPolarHBondContact O-CD 3.46Å; R150-R157 PolarHBondContact O-NH1 3.23Å; R150-R157 VanDerWaalsContact O-NH1 3.13Å
151	N	95.6	Very high	95.4	Very high	126 Å²	126	83.7 Å²	83.7	67%	0.674	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.6	177.5	-63.7	-22.3	0	0	0	113.5	N149 R157	N149-N151 PolarHBondContact O-N 3.49Å; N151-R157 PolarHBondContact OD1-NH1 2.76Å
152	K	96.4	Very high	95.8	Very high	182 Å²	182	77.2 Å²	77.2	79%	0.791	37%	0.372	S	S	*	.	S	Bend	trans	-74.1	-35.1	-174.8	-64.8	-166.4	-177.6	-169.7	0	113.8	N149	N149-K152 HydrophobicContact CB-CD 3.99Å; N149-K152 HydrophobicContact CB-CG 4.2Å; N149-K152 WeakPolarHBondContact O-CB 3.34Å; N149-K152 WeakPolarHBondContact O-CG 3.43Å; N149-K152 PolarHBondContact O-N 3.46Å
153	C	97.3	Very high	96	Very high	20 Å²	20	75.7 Å²	75.7	14%	0.135	36%	0.361	C	S	.	.			trans	-135.3	105.6	-179.2	-177.2	0	0	0	0	110.1	C143 C156 R157	C143-C153 HydrophobicContact CB-CB 4.24Å; C153-C156 HydrophobicContact CB-CB 4.28Å; C153-C156 PolarHBondContact SG-N 3.4Å; C153-R157 WeakPolarHBondContact O-CB 3.44Å; C153-R157 PolarHBondContact O-N 3.29Å; C153-R157 VanDerWaalsContact O-N 3.15Å
154	Q	97.6	Very high	95.8	Very high	109 Å²	109	75.3 Å²	75.3	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-68.8	-38.6	-178.3	-65.1	173.5	-44.8	0	0	111.9	F125 Y136 R157 F158	F125-Q154 HydrophobicContact CE2-CB 4.33Å; F125-Q154 HydrophobicContact CE2-CG 4.35Å; F125-Q154 HydrophobicContact CZ-CB 4.34Å; Y136-Q154 HydrophobicContact CD1-CB 3.64Å; Y136-Q154 HydrophobicContact CD1-CG 4.48Å; Y136-Q154 HydrophobicContact CD2-CB 4.1Å; Y136-Q154 HydrophobicContact CE1-CB 3.75Å; Y136-Q154 HydrophobicContact CE1-CG 4.29Å; Y136-Q154 HydrophobicContact CE2-CB 4.19Å; Y136-Q154 HydrophobicContact CG-CB 3.84Å; Q154-R157 PolarHBondContact O-N 3.05Å; Q154-F158 WeakPolarHBondContact O-CB 3.2Å; Q154-F158 PolarHBondContact O-N 3.2Å
155	Y	97.8	Very high	95.6	Very high	64 Å²	64	69.8 Å²	69.8	25%	0.251	35%	0.345	S	S	.	.	H	α-helix	trans	-57.6	-57.9	175.8	177.1	-92.8	0	0	0	112	D137 K138 C139 R157 F158 H159	D137-Y155 VanDerWaalsContact O-CB 3.23Å; D137-Y155 WeakPolarHBondContact O-CB 3.14Å; K138-Y155 HydrophobicContact CB-CE2 4.19Å; K138-Y155 HydrophobicContact CG-CE1 4.17Å; K138-Y155 HydrophobicContact CG-CE2 4.11Å; C139-Y155 HydrophobicContact CB-CD1 3.67Å; C139-Y155 HydrophobicContact CB-CE1 4.43Å; C139-Y155 HydrophobicContact CB-CG 4.24Å; C139-Y155 VanDerWaalsContact N-CD1 3.25Å; C139-Y155 WeakPolarHBondContact O-CE1 3.46Å; Y155-R157 VanDerWaalsContact C-N 3.28Å; Y155-R157 PolarHBondContact O-N 2.85Å; Y155-F158 PolarHBondContact O-N 3.31Å; Y155-H159 WeakPolarHBondContact O-CB 3.35Å; Y155-H159 PolarHBondContact O-N 3.3Å
156	C	97.1	Very high	95.4	Very high	11 Å²	11	68.9 Å²	68.9	7%	0.074	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-33.5	-179.4	-66.6	0	0	0	0	112.3	C143 I145 C153 K160	C143-C156 HydrophobicContact CB-CB 3.78Å; C143-C156 PolarHBondContact N-SG 2.88Å; C143-C156 VanDerWaalsContact N-SG 3.39Å; I145-C156 HydrophobicContact CD1-CB 4.02Å; C153-C156 HydrophobicContact CB-CB 4.28Å; C153-C156 PolarHBondContact SG-N 3.4Å; C156-K160 VanDerWaalsContact O-CB 3.27Å; C156-K160 WeakPolarHBondContact O-CB 3.31Å; C156-K160 PolarHBondContact O-N 2.75Å
157	R	97.9	Very high	95	Very high	9 Å²	9	67.9 Å²	67.9	3%	0.034	34%	0.341	C	S	.	.	H	α-helix	trans	-65.1	-46.6	174.8	-168.8	-165.4	-168.1	160.2	-9.1	111.6	I104 G121 C122 F125 I145 R150 N151 C153 Q154 Y155 K160 C161	I104-R157 HydrophobicContact CG2-CG 4.37Å; G121-R157 PolarHBondContact O-NH2 2.87Å; C122-R157 PolarHBondContact SG-NH2 3.39Å; C122-R157 VanDerWaalsContact SG-NH2 3.4Å; F125-R157 HydrophobicContact CD1-CG 4.08Å; F125-R157 HydrophobicContact CE1-CB 4.04Å; F125-R157 HydrophobicContact CE1-CG 3.84Å; F125-R157 HydrophobicContact CZ-CB 4.19Å; F125-R157 HydrophobicContact CZ-CG 4.35Å; I145-R157 HydrophobicContact CD1-CB 4.17Å; I145-R157 HydrophobicContact CG2-CG 4.2Å; R150-R157 WeakPolarHBondContact O-CD 3.46Å; R150-R157 PolarHBondContact O-NH1 3.23Å; R150-R157 VanDerWaalsContact O-NH1 3.13Å; N151-R157 PolarHBondContact OD1-NH1 2.76Å; C153-R157 WeakPolarHBondContact O-CB 3.44Å; C153-R157 PolarHBondContact O-N 3.29Å; C153-R157 VanDerWaalsContact O-N 3.15Å; Q154-R157 PolarHBondContact O-N 3.05Å; Y155-R157 VanDerWaalsContact C-N 3.28Å; Y155-R157 PolarHBondContact O-N 2.85Å; R157-K160 PolarHBondContact O-N 3.46Å; R157-C161 PolarHBondContact O-N 3.28Å; R157-C161 PolarHBondContact O-SG 2.72Å
158	F	97.4	Very high	94.5	Very high	37 Å²	37	66.8 Å²	66.8	16%	0.162	34%	0.337	C	S	.	.	H	α-helix	trans	-67.9	-41.7	179.6	-173.9	-118.9	0	0	0	111.8	F125 F126 T129 I130 Y136 Q154 Y155 K160 C161 L162	F125-F158 HydrophobicContact CE1-CB 3.72Å; F125-F158 HydrophobicContact CE1-CD2 4.14Å; F125-F158 HydrophobicContact CE1-CG 4.42Å; F125-F158 HydrophobicContact CZ-CB 3.91Å; F126-F158 HydrophobicContact CD2-CD2 4.12Å; F126-F158 AromaticContact CD2-CE2 3.68Å; F126-F158 HydrophobicContact CD2-CE2 3.68Å; F126-F158 AromaticContact CE2-CE2 3.8Å; F126-F158 HydrophobicContact CE2-CE2 3.8Å; F126-F158 HydrophobicContact CE2-CZ 4.5Å; T129-F158 HydrophobicContact CG2-CD1 4.02Å; T129-F158 HydrophobicContact CG2-CD2 3.56Å; T129-F158 HydrophobicContact CG2-CE1 3.88Å; T129-F158 HydrophobicContact CG2-CE2 3.41Å; T129-F158 VanDerWaalsContact CG2-CE2 3.41Å; T129-F158 HydrophobicContact CG2-CG 3.88Å; T129-F158 HydrophobicContact CG2-CZ 3.57Å; I130-F158 HydrophobicContact CD1-CE2 4.14Å; I130-F158 HydrophobicContact CD1-CZ 3.82Å; Y136-F158 HydrophobicContact CD2-CB 4.05Å; Y136-F158 HydrophobicContact CD2-CG 4.45Å; Y136-F158 HydrophobicContact CE2-CB 3.94Å; Y136-F158 HydrophobicContact CE2-CG 4.2Å; Q154-F158 WeakPolarHBondContact O-CB 3.2Å; Q154-F158 PolarHBondContact O-N 3.2Å; Y155-F158 PolarHBondContact O-N 3.31Å; F158-K160 VanDerWaalsContact C-N 3.3Å; F158-K160 PolarHBondContact O-N 3.4Å; F158-C161 VanDerWaalsContact O-CB 3.32Å; F158-C161 WeakPolarHBondContact O-CB 3.35Å; F158-C161 PolarHBondContact O-N 3.36Å; F158-C161 VanDerWaalsContact O-N 3.11Å; F158-L162 HydrophobicContact CD1-CD1 4.2Å; F158-L162 HydrophobicContact CE1-CD1 3.81Å; F158-L162 HydrophobicContact CE1-CG 4.41Å; F158-L162 HydrophobicContact CZ-CD1 4.17Å; F158-L162 HydrophobicContact CZ-CD2 4.38Å; F158-L162 HydrophobicContact CZ-CG 4.36Å; F158-L162 PolarHBondContact O-N 3.13Å
159	H	96.5	Very high	93.8	Very high	105 Å²	105	64.2 Å²	64.2	49%	0.486	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-42.1	172.6	-169.1	-85.2	0	0	0	111.6	Y155 C161 L162 S163	Y155-H159 WeakPolarHBondContact O-CB 3.35Å; Y155-H159 PolarHBondContact O-N 3.3Å; H159-C161 PolarHBondContact O-N 3.19Å; H159-L162 PolarHBondContact O-N 2.9Å; H159-S163 WeakPolarHBondContact O-CB 3.38Å; H159-S163 PolarHBondContact O-N 3.14Å; H159-S163 PolarHBondContact O-OG 2.85Å
160	K	96.9	Very high	92.8	Very high	88 Å²	88	63.3 Å²	63.3	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-39.8	174.1	-174.9	62.6	174.8	178.7	0	111.9	I104 I145 C156 R157 F158 L162 S163 V164	I104-K160 HydrophobicContact CG2-CG 4.27Å; I145-K160 HydrophobicContact CG1-CB 4.22Å; I145-K160 HydrophobicContact CG1-CG 4.48Å; C156-K160 VanDerWaalsContact O-CB 3.27Å; C156-K160 WeakPolarHBondContact O-CB 3.31Å; C156-K160 PolarHBondContact O-N 2.75Å; R157-K160 PolarHBondContact O-N 3.46Å; F158-K160 VanDerWaalsContact C-N 3.3Å; F158-K160 PolarHBondContact O-N 3.4Å; K160-L162 VanDerWaalsContact C-N 3.35Å; K160-L162 PolarHBondContact O-N 3.35Å; K160-S163 PolarHBondContact O-N 2.88Å; K160-S163 PolarHBondContact O-OG 3.19Å; K160-V164 HydrophobicContact CD-CG1 4.01Å; K160-V164 HydrophobicContact CG-CG1 4.44Å; K160-V164 WeakPolarHBondContact O-CG1 3.32Å; K160-V164 WeakPolarHBondContact O-CG2 3.39Å; K160-V164 PolarHBondContact O-N 2.89Å; K160-V164 VanDerWaalsContact O-N 3.07Å
161	C	96.1	Very high	91.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.7	-48.8	173.8	-67.2	0	0	0	0	111.3	F126 R157 F158 H159 V164 M166	F126-C161 HydrophobicContact CD2-CB 3.74Å; F126-C161 HydrophobicContact CE2-CB 4.3Å; R157-C161 PolarHBondContact O-N 3.28Å; R157-C161 PolarHBondContact O-SG 2.72Å; F158-C161 VanDerWaalsContact O-CB 3.32Å; F158-C161 WeakPolarHBondContact O-CB 3.35Å; F158-C161 PolarHBondContact O-N 3.36Å; F158-C161 VanDerWaalsContact O-N 3.11Å; H159-C161 PolarHBondContact O-N 3.19Å; C161-V164 VanDerWaalsContact O-CG2 3.31Å; C161-V164 WeakPolarHBondContact O-CG2 3.37Å; C161-M166 HydrophobicContact CB-CB 4.18Å; C161-M166 HydrophobicContact CB-CG 4.22Å; C161-M166 HydrophobicContact CB-SD 3.66Å; C161-M166 WeakPolarHBondContact O-CB 3.26Å; C161-M166 PolarHBondContact O-N 3.39Å
162	L	95.4	Very high	89.5	Confident	85 Å²	85	70.7 Å²	70.7	45%	0.445	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-43.9	178.7	-65.4	173.6	0	0	0	111.8	F126 F158 H159 K160 V164 G165	F126-L162 HydrophobicContact CE2-CD2 3.92Å; F126-L162 HydrophobicContact CZ-CD2 4.47Å; F158-L162 HydrophobicContact CD1-CD1 4.2Å; F158-L162 HydrophobicContact CE1-CD1 3.81Å; F158-L162 HydrophobicContact CE1-CG 4.41Å; F158-L162 HydrophobicContact CZ-CD1 4.17Å; F158-L162 HydrophobicContact CZ-CD2 4.38Å; F158-L162 HydrophobicContact CZ-CG 4.36Å; F158-L162 PolarHBondContact O-N 3.13Å; H159-L162 PolarHBondContact O-N 2.9Å; K160-L162 VanDerWaalsContact C-N 3.35Å; K160-L162 PolarHBondContact O-N 3.35Å; L162-V164 VanDerWaalsContact C-N 3.31Å; L162-V164 PolarHBondContact O-N 3.38Å; L162-G165 PolarHBondContact O-N 3.32Å
163	S	93.9	Very high	87.5	Confident	75 Å²	75	68.1 Å²	68.1	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-69.2	-26.7	-176.2	75	0	0	0	0	113.9	H159 K160	H159-S163 WeakPolarHBondContact O-CB 3.38Å; H159-S163 PolarHBondContact O-N 3.14Å; H159-S163 PolarHBondContact O-OG 2.85Å; K160-S163 PolarHBondContact O-N 2.88Å; K160-S163 PolarHBondContact O-OG 3.19Å
164	V	91.8	Very high	85.3	Confident	40 Å²	40	70 Å²	70	24%	0.242	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.6	171.6	-57.4	0	0	0	0	113.1	I104 V116 K160 C161 L162	I104-V164 HydrophobicContact CD1-CG2 3.94Å; I104-V164 HydrophobicContact CG1-CG2 3.9Å; V116-V164 HydrophobicContact CG1-CG2 4.21Å; V116-V164 WeakPolarHBondContact CG1-O 3.05Å; V116-V164 HydrophobicContact CG2-CG2 4.42Å; K160-V164 HydrophobicContact CD-CG1 4.01Å; K160-V164 HydrophobicContact CG-CG1 4.44Å; K160-V164 WeakPolarHBondContact O-CG1 3.32Å; K160-V164 WeakPolarHBondContact O-CG2 3.39Å; K160-V164 PolarHBondContact O-N 2.89Å; K160-V164 VanDerWaalsContact O-N 3.07Å; C161-V164 VanDerWaalsContact O-CG2 3.31Å; C161-V164 WeakPolarHBondContact O-CG2 3.37Å; L162-V164 VanDerWaalsContact C-N 3.31Å; L162-V164 PolarHBondContact O-N 3.38Å
165	G	89.9	Confident	83.6	Confident	41 Å²	41	75.6 Å²	75.6	42%	0.423	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.8	13.7	174.9	0	0	0	0	0	115.7	L162 S167	L162-G165 PolarHBondContact O-N 3.32Å; G165-S167 PolarHBondContact O-N 3.48Å
166	M	92.5	Very high	81.9	Confident	4 Å²	4	74.6 Å²	74.6	2%	0.02	38%	0.38	C	S	.	.			trans	-63.9	123.3	173.4	-74.6	-168.7	152.4	0	0	110.9	I104 Y114 V116 A118 F126 C161	I104-M166 HydrophobicContact CD1-CE 3.71Å; I104-M166 HydrophobicContact CD1-SD 4.23Å; Y114-M166 CarbonylContact O-C 3.58Å; Y114-M166 VanDerWaalsContact O-CA 3.32Å; Y114-M166 WeakPolarHBondContact O-CA 3.39Å; V116-M166 HydrophobicContact CG1-CG 4.29Å; V116-M166 HydrophobicContact CG2-CE 3.45Å; V116-M166 VanDerWaalsContact CG2-CE 3.45Å; V116-M166 HydrophobicContact CG2-CG 3.38Å; V116-M166 HydrophobicContact CG2-SD 4.24Å; A118-M166 HydrophobicContact CB-CE 3.31Å; F126-M166 HydrophobicContact CB-SD 3.81Å; F126-M166 HydrophobicContact CD1-CB 4.38Å; F126-M166 HydrophobicContact CD1-SD 4.37Å; F126-M166 HydrophobicContact CD2-CB 3.87Å; F126-M166 HydrophobicContact CD2-SD 3.94Å; F126-M166 HydrophobicContact CE1-CB 4.15Å; F126-M166 HydrophobicContact CE2-CB 3.61Å; F126-M166 HydrophobicContact CG-CB 4.24Å; F126-M166 HydrophobicContact CG-SD 3.78Å; F126-M166 HydrophobicContact CZ-CB 3.76Å; F126-M166 WeakPolarHBondContact CZ-O 3.43Å; C161-M166 HydrophobicContact CB-CB 4.18Å; C161-M166 HydrophobicContact CB-CG 4.22Å; C161-M166 HydrophobicContact CB-SD 3.66Å; C161-M166 WeakPolarHBondContact O-CB 3.26Å; C161-M166 PolarHBondContact O-N 3.39Å
167	S	88.4	Confident	80.5	Confident	45 Å²	45	76 Å²	76	32%	0.315	39%	0.389	S	S	.	.			trans	-135.4	137.1	-178.8	179.2	0	0	0	0	112.1	Y114 G165 N169 A170	Y114-S167 PolarHBondContact O-N 2.84Å; G165-S167 PolarHBondContact O-N 3.48Å; S167-N169 PolarHBondContact O-N 3.44Å; S167-N169 PolarHBondContact OG-N 3.42Å; S167-A170 WeakPolarHBondContact O-CB 3.46Å; S167-A170 PolarHBondContact O-N 3.46Å
168	H	83.9	Confident	78.9	Confident	101 Å²	101	86.7 Å²	86.7	47%	0.468	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-61.3	-31	171.3	-179.6	-90	0	0	0	111.9	I130 A170 I171	I130-H168 HydrophobicContact CG2-CB 4.27Å; H168-A170 VanDerWaalsContact C-N 3.26Å; H168-A170 PolarHBondContact O-N 3.22Å; H168-I171 WeakPolarHBondContact O-CD1 3.21Å; H168-I171 WeakPolarHBondContact O-CG1 3.33Å
169	N	77.7	Confident	77.3	Confident	128 Å²	128	88.8 Å²	88.8	68%	0.684	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-77.2	-15.9	-178.7	-62.4	-19.9	0	0	0	112.4	S167 I171	S167-N169 PolarHBondContact O-N 3.44Å; S167-N169 PolarHBondContact OG-N 3.42Å; N169-I171 PolarHBondContact O-N 3.3Å
170	A	73.3	Confident	75.9	Confident	18 Å²	18	87.6 Å²	87.6	15%	0.149	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-78.9	-1	178.2	0	0	0	0	0	113.8	S167 H168 R172 F173	S167-A170 WeakPolarHBondContact O-CB 3.46Å; S167-A170 PolarHBondContact O-N 3.46Å; H168-A170 VanDerWaalsContact C-N 3.26Å; H168-A170 PolarHBondContact O-N 3.22Å; A170-R172 PolarHBondContact O-N 3.1Å; A170-F173 PolarHBondContact O-N 2.75Å; A170-F173 VanDerWaalsContact O-N 3.08Å
171	I	63.8	Low	74.3	Confident	85 Å²	85	88.9 Å²	88.9	44%	0.436	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-59.1	-30.2	177.8	-64.1	166.1	0	0	0	111.9	Y114 H168 N169 F173 G174	Y114-I171 HydrophobicContact CD1-CD1 4.09Å; Y114-I171 HydrophobicContact CD1-CG1 3.56Å; Y114-I171 HydrophobicContact CE1-CD1 3.64Å; Y114-I171 HydrophobicContact CE1-CG1 3.49Å; Y114-I171 VanDerWaalsContact CE1-CG1 3.49Å; H168-I171 WeakPolarHBondContact O-CD1 3.21Å; H168-I171 WeakPolarHBondContact O-CG1 3.33Å; N169-I171 PolarHBondContact O-N 3.3Å; I171-F173 PolarHBondContact O-N 3.41Å; I171-F173 VanDerWaalsContact O-N 3.16Å; I171-G174 PolarHBondContact O-N 3.22Å
172	R	58.2	Low	73	Confident	237 Å²	237	91.6 Å²	91.6	89%	0.894	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-63	-19.7	178.4	-67.3	-174.1	-179.9	-172	0.3	113.2	A170	A170-R172 PolarHBondContact O-N 3.1Å
173	F	55.1	Low	71.8	Confident	129 Å²	129	94.2 Å²	94.2	57%	0.566	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-102.5	29.4	-179.5	-56.3	-80.8	0	0	0	112.6	A170 I171 R175	A170-F173 PolarHBondContact O-N 2.75Å; A170-F173 VanDerWaalsContact O-N 3.08Å; I171-F173 PolarHBondContact O-N 3.41Å; I171-F173 VanDerWaalsContact O-N 3.16Å; F173-R175 CarbonylContact O-C 3.57Å; F173-R175 VanDerWaalsContact O-C 3.24Å; F173-R175 PolarHBondContact O-N 2.84Å
174	G	49.6	Very low	70.3	Confident	58 Å²	58	93 Å²	93	60%	0.598	47%	0.466	S	S	*	.			trans	-54.9	3.2	-178	0	0	0	0	0	116.9	I171	I171-G174 PolarHBondContact O-N 3.22Å
175	R	63.1	Low	69.1	Low	228 Å²	228	96.4 Å²	96.4	86%	0.86	48%	0.478	S	S	*	.	S	Bend	trans	-124.4	124.5	162.3	-61.6	178.4	-177.2	-178.3	-0.8	107.4	F173	F173-R175 CarbonylContact O-C 3.57Å; F173-R175 VanDerWaalsContact O-C 3.24Å; F173-R175 PolarHBondContact O-N 2.84Å
176	M	62.3	Low	68	Low	42 Å²	42	96.9 Å²	96.9	21%	0.207	48%	0.478	C	S	.	.			trans	-46.8	125.7	173.8	-178.8	-172.3	-80	0	0	109.9	Y112 H117 R178 E180 K181 L184	Y112-M176 HydrophobicContact CD2-CE 4.09Å; H117-M176 WeakPolarHBondContact CE1-CE 3.01Å; H117-M176 WeakPolarHBondContact NE2-CE 3.5Å; M176-R178 PolarHBondContact O-N 2.95Å; M176-E180 HydrophobicContact CG-CB 4.1Å; M176-K181 HydrophobicContact CG-CB 4.11Å; M176-K181 WeakPolarHBondContact SD-CA 3.43Å; M176-K181 HydrophobicContact SD-CB 3.47Å; M176-K181 WeakPolarHBondContact SD-CB 3.21Å; M176-K181 HydrophobicContact SD-CG 3.89Å; M176-L184 HydrophobicContact CE-CD2 4.4Å
177	P	67.2	Low	66.6	Low	42 Å²	42	102.3 Å²	102.3	27%	0.273	50%	0.503	S	S	.	.			trans	-52.7	138.4	174.7	-25.2	33.3	0	0	0	110.6	S179 E180 K181	P177-S179 PolarHBondContact O-N 3.21Å; P177-S179 VanDerWaalsContact O-N 3.1Å; P177-E180 HydrophobicContact CB-CB 4.34Å; P177-E180 WeakPolarHBondContact CD-OE2 3.32Å; P177-E180 PolarHBondContact O-N 3.31Å; P177-K181 PolarHBondContact O-N 3.02Å
178	R	64.2	Low	65.4	Low	232 Å²	232	102.9 Å²	102.9	88%	0.875	50%	0.502	S	S	*	.	H	α-helix	trans	-54.7	-33.8	-178.1	-73.9	-174.8	176.2	-176.1	-1.8	112.4	M176 A182	M176-R178 PolarHBondContact O-N 2.95Å; R178-A182 VanDerWaalsContact O-CB 3.29Å; R178-A182 WeakPolarHBondContact O-CB 3.38Å; R178-A182 PolarHBondContact O-N 2.84Å
179	S	63.2	Low	64.3	Low	82 Å²	82	103.5 Å²	103.5	57%	0.573	51%	0.508	S	S	*	.	H	α-helix	trans	-65.9	-39.1	175.8	49.8	0	0	0	0	113.2	P177 A182 K183	P177-S179 PolarHBondContact O-N 3.21Å; P177-S179 VanDerWaalsContact O-N 3.1Å; S179-A182 PolarHBondContact O-N 2.76Å; S179-K183 WeakPolarHBondContact O-CG 3.37Å; S179-K183 PolarHBondContact O-N 2.92Å
180	E	66.6	Low	63.4	Low	79 Å²	79	101.1 Å²	101.1	37%	0.369	50%	0.499	S	S	.	.	H	α-helix	trans	-75.8	-35.5	178.6	-148.5	176.8	167.4	0	0	110.7	Y112 M176 P177 A182 K183 L184	Y112-E180 PolarHBondContact OH-OE1 2.83Å; Y112-E180 VanDerWaalsContact OH-OE1 3.12Å; M176-E180 HydrophobicContact CG-CB 4.1Å; P177-E180 HydrophobicContact CB-CB 4.34Å; P177-E180 WeakPolarHBondContact CD-OE2 3.32Å; P177-E180 PolarHBondContact O-N 3.31Å; E180-A182 VanDerWaalsContact C-N 3.34Å; E180-K183 PolarHBondContact O-N 3.15Å; E180-L184 WeakPolarHBondContact O-CB 3.25Å; E180-L184 PolarHBondContact O-N 3.01Å
181	K	64.8	Low	62.6	Low	115 Å²	115	103.7 Å²	103.7	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-40	169.3	-167.3	178	-179.4	-178.7	0	112	M176 P177 K185	M176-K181 HydrophobicContact CG-CB 4.11Å; M176-K181 WeakPolarHBondContact SD-CA 3.43Å; M176-K181 HydrophobicContact SD-CB 3.47Å; M176-K181 WeakPolarHBondContact SD-CB 3.21Å; M176-K181 HydrophobicContact SD-CG 3.89Å; P177-K181 PolarHBondContact O-N 3.02Å; K181-K185 WeakPolarHBondContact O-CB 3.21Å; K181-K185 WeakPolarHBondContact O-CG 3.43Å; K181-K185 PolarHBondContact O-N 2.98Å
182	A	67.5	Low	62	Low	57 Å²	57	104.7 Å²	104.7	47%	0.471	52%	0.517	S	S	.	.	H	α-helix	trans	-69.1	-41.4	176.6	0	0	0	0	0	111.6	R178 S179 E180 K185 A186	R178-A182 VanDerWaalsContact O-CB 3.29Å; R178-A182 WeakPolarHBondContact O-CB 3.38Å; R178-A182 PolarHBondContact O-N 2.84Å; S179-A182 PolarHBondContact O-N 2.76Å; E180-A182 VanDerWaalsContact C-N 3.34Å; A182-K185 PolarHBondContact O-N 2.69Å; A182-A186 WeakPolarHBondContact O-CB 3.46Å; A182-A186 PolarHBondContact O-N 2.93Å
183	K	70.5	Confident	61.9	Low	141 Å²	141	98.4 Å²	98.4	61%	0.613	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-46.7	174.2	-77.9	-177.5	177.8	-168.9	0	112.5	S179 E180 K185 A186 E187	S179-K183 WeakPolarHBondContact O-CG 3.37Å; S179-K183 PolarHBondContact O-N 2.92Å; E180-K183 PolarHBondContact O-N 3.15Å; K183-K185 VanDerWaalsContact C-N 3.32Å; K183-K185 PolarHBondContact O-N 3.05Å; K183-A186 PolarHBondContact O-N 3.28Å; K183-A186 VanDerWaalsContact O-N 3.14Å; K183-E187 WeakPolarHBondContact O-CB 3.37Å; K183-E187 WeakPolarHBondContact O-CG 3.25Å; K183-E187 PolarHBondContact O-N 3.2Å
184	L	63.6	Low	61.8	Low	49 Å²	49	97.4 Å²	97.4	26%	0.257	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-38.7	178.6	-158.5	82.6	0	0	0	111.7	I100 M176 E180 I188	I100-L184 HydrophobicContact CD1-CD2 4.26Å; M176-L184 HydrophobicContact CE-CD2 4.4Å; E180-L184 WeakPolarHBondContact O-CB 3.25Å; E180-L184 PolarHBondContact O-N 3.01Å; L184-I188 HydrophobicContact CG-CD1 4.28Å; L184-I188 WeakPolarHBondContact O-CD1 3.38Å; L184-I188 WeakPolarHBondContact O-CG1 3.41Å; L184-I188 PolarHBondContact O-N 3.16Å; L184-I188 VanDerWaalsContact O-N 3.09Å
185	K	65.4	Low	62.2	Low	112 Å²	112	99.5 Å²	99.5	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-42.7	172.1	-80.8	-173.7	170.8	-159.3	0	111.9	K181 A182 K183 L189	K181-K185 WeakPolarHBondContact O-CB 3.21Å; K181-K185 WeakPolarHBondContact O-CG 3.43Å; K181-K185 PolarHBondContact O-N 2.98Å; A182-K185 PolarHBondContact O-N 2.69Å; K183-K185 VanDerWaalsContact C-N 3.32Å; K183-K185 PolarHBondContact O-N 3.05Å; K185-L189 WeakPolarHBondContact O-CB 3.27Å; K185-L189 WeakPolarHBondContact O-CD1 3.42Å; K185-L189 VanDerWaalsContact O-CG 3.24Å; K185-L189 WeakPolarHBondContact O-CG 3.23Å; K185-L189 PolarHBondContact O-N 2.91Å
186	A	66.7	Low	62	Low	51 Å²	51	94.5 Å²	94.5	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-43.7	178	0	0	0	0	0	111.8	A182 K183 I188 L189 T190	A182-A186 WeakPolarHBondContact O-CB 3.46Å; A182-A186 PolarHBondContact O-N 2.93Å; K183-A186 PolarHBondContact O-N 3.28Å; K183-A186 VanDerWaalsContact O-N 3.14Å; A186-I188 VanDerWaalsContact C-N 3.35Å; A186-I188 PolarHBondContact O-N 3.39Å; A186-L189 PolarHBondContact O-N 3.39Å; A186-T190 WeakPolarHBondContact O-CG2 3.28Å; A186-T190 PolarHBondContact O-N 3.39Å; A186-T190 PolarHBondContact O-OG1 3.06Å
187	E	63.5	Low	61.9	Low	118 Å²	118	96.3 Å²	96.3	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-63.5	-37	177.9	-75.2	171.6	-168.1	0	0	112.6	K183 T190 C191	K183-E187 WeakPolarHBondContact O-CB 3.37Å; K183-E187 WeakPolarHBondContact O-CG 3.25Å; K183-E187 PolarHBondContact O-N 3.2Å; E187-T190 WeakPolarHBondContact CA-OG1 3.44Å; E187-T190 PolarHBondContact O-OG1 2.96Å; E187-C191 VanDerWaalsContact O-CB 3.26Å; E187-C191 WeakPolarHBondContact O-CB 3.16Å; E187-C191 PolarHBondContact O-N 2.88Å; E187-C191 VanDerWaalsContact O-N 3.09Å
188	I	63	Low	62.1	Low	57 Å²	57	98.3 Å²	98.3	29%	0.292	51%	0.506	S	S	.	.	H	α-helix	trans	-70	-46.1	174.7	-67.3	165.3	0	0	0	110.3	L184 A186 T190 C191 E192	L184-I188 HydrophobicContact CG-CD1 4.28Å; L184-I188 WeakPolarHBondContact O-CD1 3.38Å; L184-I188 WeakPolarHBondContact O-CG1 3.41Å; L184-I188 PolarHBondContact O-N 3.16Å; L184-I188 VanDerWaalsContact O-N 3.09Å; A186-I188 VanDerWaalsContact C-N 3.35Å; A186-I188 PolarHBondContact O-N 3.39Å; I188-T190 VanDerWaalsContact C-N 3.34Å; I188-T190 PolarHBondContact O-N 3.2Å; I188-C191 PolarHBondContact O-N 3.33Å; I188-E192 HydrophobicContact CG2-CG 4.27Å; I188-E192 WeakPolarHBondContact O-CB 3.36Å; I188-E192 WeakPolarHBondContact O-CG 3.33Å; I188-E192 PolarHBondContact O-N 3.27Å
189	L	61.1	Low	62.4	Low	114 Å²	114	92.7 Å²	92.7	60%	0.597	49%	0.49	S	S	*	.	H	α-helix	trans	-61.7	-39.3	177.6	-75.9	162.9	0	0	0	112.4	K185 A186 H193	K185-L189 WeakPolarHBondContact O-CB 3.27Å; K185-L189 WeakPolarHBondContact O-CD1 3.42Å; K185-L189 VanDerWaalsContact O-CG 3.24Å; K185-L189 WeakPolarHBondContact O-CG 3.23Å; K185-L189 PolarHBondContact O-N 2.91Å; A186-L189 PolarHBondContact O-N 3.39Å; L189-H193 WeakPolarHBondContact O-CB 3.47Å; L189-H193 PolarHBondContact O-N 3.3Å
190	T	59.5	Low	62.9	Low	78 Å²	78	91.3 Å²	91.3	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-70.4	-39.7	176.6	49.6	0	0	0	0	111.9	A186 E187 I188 H193 D194	A186-T190 WeakPolarHBondContact O-CG2 3.28Å; A186-T190 PolarHBondContact O-N 3.39Å; A186-T190 PolarHBondContact O-OG1 3.06Å; E187-T190 WeakPolarHBondContact CA-OG1 3.44Å; E187-T190 PolarHBondContact O-OG1 2.96Å; I188-T190 VanDerWaalsContact C-N 3.34Å; I188-T190 PolarHBondContact O-N 3.2Å; T190-H193 PolarHBondContact O-N 3.18Å; T190-D194 WeakPolarHBondContact O-CB 3.38Å; T190-D194 PolarHBondContact O-N 3.03Å
191	C	55.9	Low	63.4	Low	71 Å²	71	90.1 Å²	90.1	48%	0.48	48%	0.482	S	S	.	.	H	α-helix	trans	-73.7	-34.1	-179.3	-157.3	0	0	0	0	112.3	E187 I188 I195	E187-C191 VanDerWaalsContact O-CB 3.26Å; E187-C191 WeakPolarHBondContact O-CB 3.16Å; E187-C191 PolarHBondContact O-N 2.88Å; E187-C191 VanDerWaalsContact O-N 3.09Å; I188-C191 PolarHBondContact O-N 3.33Å; C191-I195 WeakPolarHBondContact O-CD1 3.4Å; C191-I195 WeakPolarHBondContact O-CG1 3.45Å; C191-I195 PolarHBondContact O-N 2.73Å
192	E	51.6	Low	64.3	Low	107 Å²	107	90.1 Å²	90.1	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-43.3	170.3	-73.5	174.1	168.4	0	0	110.9	I188 I195 E196	I188-E192 HydrophobicContact CG2-CG 4.27Å; I188-E192 WeakPolarHBondContact O-CB 3.36Å; I188-E192 WeakPolarHBondContact O-CG 3.33Å; I188-E192 PolarHBondContact O-N 3.27Å; E192-I195 PolarHBondContact O-N 3.45Å; E192-E196 WeakPolarHBondContact O-CB 3.24Å; E192-E196 WeakPolarHBondContact O-CG 3.28Å; E192-E196 PolarHBondContact O-N 3.36Å
193	H	56	Low	65.1	Low	105 Å²	105	88.5 Å²	88.5	49%	0.486	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-42	176.7	-168.1	45.2	0	0	0	112.8	L189 T190 I195 E196 D197	L189-H193 WeakPolarHBondContact O-CB 3.47Å; L189-H193 PolarHBondContact O-N 3.3Å; T190-H193 PolarHBondContact O-N 3.18Å; H193-I195 VanDerWaalsContact C-N 3.32Å; H193-I195 PolarHBondContact O-N 3.11Å; H193-E196 PolarHBondContact O-N 3.44Å; H193-D197 IonicContact CD2-OD2 3.82Å; H193-D197 IonicContact CE1-OD1 3.51Å; H193-D197 IonicContact CE1-OD2 2.81Å; H193-D197 PolarHBondContact CE1-OD2 3.38Å; H193-D197 IonicContact ND1-OD1 3.59Å; H193-D197 IonicContact ND1-OD2 3.42Å; H193-D197 IonicContact NE2-OD2 2.9Å; H193-D197 VanDerWaalsContact O-CB 3.25Å; H193-D197 WeakPolarHBondContact O-CB 3.24Å; H193-D197 VanDerWaalsContact O-CG 3.3Å; H193-D197 PolarHBondContact O-N 2.86Å
194	D	53.1	Low	65.9	Low	107 Å²	107	89 Å²	89	57%	0.572	47%	0.473	S	S	*	.	H	α-helix	trans	-65.4	-33.4	177.7	-70.3	-30.9	0	0	0	112.5	T190 S198	T190-D194 WeakPolarHBondContact O-CB 3.38Å; T190-D194 PolarHBondContact O-N 3.03Å; D194-S198 WeakPolarHBondContact O-CB 3.12Å; D194-S198 PolarHBondContact O-N 3.08Å
195	I	58.1	Low	67.3	Low	103 Å²	103	89.3 Å²	89.3	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-77	-44.6	176.7	-66.9	167.9	0	0	0	110.6	C191 E192 H193 D197 S198 E199	C191-I195 WeakPolarHBondContact O-CD1 3.4Å; C191-I195 WeakPolarHBondContact O-CG1 3.45Å; C191-I195 PolarHBondContact O-N 2.73Å; E192-I195 PolarHBondContact O-N 3.45Å; H193-I195 VanDerWaalsContact C-N 3.32Å; H193-I195 PolarHBondContact O-N 3.11Å; I195-D197 VanDerWaalsContact C-N 3.33Å; I195-D197 PolarHBondContact O-N 2.96Å; I195-S198 PolarHBondContact O-N 2.84Å; I195-E199 WeakPolarHBondContact O-CB 3.46Å; I195-E199 PolarHBondContact O-N 3.46Å
196	E	57.3	Low	68.7	Low	123 Å²	123	85.7 Å²	85.7	58%	0.575	47%	0.465	S	S	*	.	H	α-helix	trans	-61.9	-39.9	175.3	-76.5	-179	172	0	0	111.5	E192 H193 T200	E192-E196 WeakPolarHBondContact O-CB 3.24Å; E192-E196 WeakPolarHBondContact O-CG 3.28Å; E192-E196 PolarHBondContact O-N 3.36Å; H193-E196 PolarHBondContact O-N 3.44Å; E196-T200 VanDerWaalsContact O-CB 3.24Å; E196-T200 WeakPolarHBondContact O-CB 3.2Å; E196-T200 WeakPolarHBondContact O-CG2 3.42Å; E196-T200 PolarHBondContact O-N 3.29Å; E196-T200 PolarHBondContact O-OG1 3.28Å
197	D	61	Low	70.2	Confident	80 Å²	80	84 Å²	84	43%	0.428	45%	0.451	S	S	.	.	H	α-helix	trans	-67.6	-36.9	176.6	-79.5	-11	0	0	0	112.1	H193 I195 T200 A201	H193-D197 IonicContact CD2-OD2 3.82Å; H193-D197 IonicContact CE1-OD1 3.51Å; H193-D197 IonicContact CE1-OD2 2.81Å; H193-D197 PolarHBondContact CE1-OD2 3.38Å; H193-D197 IonicContact ND1-OD1 3.59Å; H193-D197 IonicContact ND1-OD2 3.42Å; H193-D197 IonicContact NE2-OD2 2.9Å; H193-D197 VanDerWaalsContact O-CB 3.25Å; H193-D197 WeakPolarHBondContact O-CB 3.24Å; H193-D197 VanDerWaalsContact O-CG 3.3Å; H193-D197 PolarHBondContact O-N 2.86Å; I195-D197 VanDerWaalsContact C-N 3.33Å; I195-D197 PolarHBondContact O-N 2.96Å; D197-T200 WeakPolarHBondContact CA-OG1 3.44Å; D197-T200 PolarHBondContact O-OG1 2.79Å; D197-A201 VanDerWaalsContact O-CB 3.24Å; D197-A201 WeakPolarHBondContact O-CB 3.46Å; D197-A201 PolarHBondContact O-N 3.34Å
198	S	70.6	Confident	71.7	Confident	83 Å²	83	84.4 Å²	84.4	58%	0.58	45%	0.451	S	S	*	.	H	α-helix	trans	-71.2	-42.2	176.4	-174.2	0	0	0	0	112.8	D194 I195 D202	D194-S198 WeakPolarHBondContact O-CB 3.12Å; D194-S198 PolarHBondContact O-N 3.08Å; I195-S198 PolarHBondContact O-N 2.84Å; S198-D202 PolarHBondContact O-N 2.85Å
199	E	71.6	Confident	73.4	Confident	115 Å²	115	88.1 Å²	88.1	54%	0.537	46%	0.461	S	S	.	.	H	α-helix	trans	-70.3	-42.4	179	-172.6	171.1	-167.7	0	0	110.8	I195 A201 D202 L203	I195-E199 WeakPolarHBondContact O-CB 3.46Å; I195-E199 PolarHBondContact O-N 3.46Å; E199-A201 VanDerWaalsContact C-N 3.3Å; E199-A201 PolarHBondContact O-N 3.24Å; E199-D202 PolarHBondContact O-N 3.17Å; E199-L203 HydrophobicContact CG-CD1 4.31Å; E199-L203 VanDerWaalsContact O-CG 3.27Å; E199-L203 WeakPolarHBondContact O-CG 3.3Å; E199-L203 PolarHBondContact O-N 3.48Å
200	T	73.4	Confident	75.2	Confident	52 Å²	52	82.7 Å²	82.7	32%	0.319	43%	0.433	S	S	.	.	H	α-helix	trans	-65.6	-32	175.3	56.9	0	0	0	0	112.8	E196 D197 K204	E196-T200 VanDerWaalsContact O-CB 3.24Å; E196-T200 WeakPolarHBondContact O-CB 3.2Å; E196-T200 WeakPolarHBondContact O-CG2 3.42Å; E196-T200 PolarHBondContact O-N 3.29Å; E196-T200 PolarHBondContact O-OG1 3.28Å; D197-T200 WeakPolarHBondContact CA-OG1 3.44Å; D197-T200 PolarHBondContact O-OG1 2.79Å; T200-K204 WeakPolarHBondContact O-CB 3.49Å; T200-K204 VanDerWaalsContact O-CG 3.28Å; T200-K204 WeakPolarHBondContact O-CG 3.32Å; T200-K204 PolarHBondContact O-N 2.98Å
201	A	77.7	Confident	77	Confident	55 Å²	55	82.7 Å²	82.7	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-65.8	-41.4	172.9	0	0	0	0	0	112.4	D197 E199 K204 S205	D197-A201 VanDerWaalsContact O-CB 3.24Å; D197-A201 WeakPolarHBondContact O-CB 3.46Å; D197-A201 PolarHBondContact O-N 3.34Å; E199-A201 VanDerWaalsContact C-N 3.3Å; E199-A201 PolarHBondContact O-N 3.24Å; A201-K204 PolarHBondContact O-N 3.01Å; A201-S205 WeakPolarHBondContact O-CB 3.26Å; A201-S205 PolarHBondContact O-N 3Å
202	D	83.6	Confident	79	Confident	115 Å²	115	84.2 Å²	84.2	62%	0.615	43%	0.425	S	S	*	.	H	α-helix	trans	-66.2	-42.1	177.1	-168	46.4	0	0	0	111.7	S198 E199 K204 S205 L206	S198-D202 PolarHBondContact O-N 2.85Å; E199-D202 PolarHBondContact O-N 3.17Å; D202-K204 PolarHBondContact O-N 3.22Å; D202-S205 WeakPolarHBondContact O-CB 3.27Å; D202-S205 PolarHBondContact O-N 3.04Å; D202-L206 PolarHBondContact O-N 3.48Å
203	L	84.3	Confident	81.3	Confident	23 Å²	23	79.6 Å²	79.6	12%	0.12	41%	0.405	C	S	.	.	H	α-helix	trans	-63.1	-42	176.2	-67.6	172.4	0	0	0	112.6	E199 S205 L206 A207 V407 L410	E199-L203 HydrophobicContact CG-CD1 4.31Å; E199-L203 VanDerWaalsContact O-CG 3.27Å; E199-L203 WeakPolarHBondContact O-CG 3.3Å; E199-L203 PolarHBondContact O-N 3.48Å; L203-S205 VanDerWaalsContact C-N 3.34Å; L203-L206 PolarHBondContact O-N 3.04Å; L203-A207 PolarHBondContact O-N 3.34Å; L203-V407 HydrophobicContact CB-CG2 3.91Å; L203-V407 HydrophobicContact CD2-CG2 3.42Å; L203-V407 VanDerWaalsContact CD2-CG2 3.42Å; L203-V407 HydrophobicContact CG-CG2 4.24Å; L203-L410 HydrophobicContact CD1-CD1 3.83Å
204	K	87.5	Confident	83.3	Confident	150 Å²	150	74.8 Å²	74.8	65%	0.652	38%	0.382	S	S	*	.	H	α-helix	trans	-64.9	-38	174	-74.7	171.8	-177.8	171.4	0	112	T200 A201 D202 A207 K208	T200-K204 WeakPolarHBondContact O-CB 3.49Å; T200-K204 VanDerWaalsContact O-CG 3.28Å; T200-K204 WeakPolarHBondContact O-CG 3.32Å; T200-K204 PolarHBondContact O-N 2.98Å; A201-K204 PolarHBondContact O-N 3.01Å; D202-K204 PolarHBondContact O-N 3.22Å; K204-A207 PolarHBondContact O-N 3.39Å; K204-K208 WeakPolarHBondContact O-CB 3.43Å; K204-K208 PolarHBondContact O-N 3.2Å
205	S	93.1	Very high	85.4	Confident	56 Å²	56	73 Å²	73	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-44.3	174.4	-179.6	0	0	0	0	111.3	A201 D202 L203 K208 R209	A201-S205 WeakPolarHBondContact O-CB 3.26Å; A201-S205 PolarHBondContact O-N 3Å; D202-S205 WeakPolarHBondContact O-CB 3.27Å; D202-S205 PolarHBondContact O-N 3.04Å; L203-S205 VanDerWaalsContact C-N 3.34Å; S205-K208 PolarHBondContact O-N 2.79Å; S205-R209 WeakPolarHBondContact O-CG 3.44Å; S205-R209 PolarHBondContact O-N 3.29Å
206	L	94.8	Very high	87.3	Confident	37 Å²	37	76.8 Å²	76.8	19%	0.194	39%	0.385	C	S	.	.	H	α-helix	trans	-59.8	-47.8	175.7	179.8	55.9	0	0	0	111.7	D202 L203 K208 R209 I210 P295 V407	D202-L206 PolarHBondContact O-N 3.48Å; L203-L206 PolarHBondContact O-N 3.04Å; L206-K208 VanDerWaalsContact C-N 3.34Å; L206-K208 PolarHBondContact O-N 3.47Å; L206-R209 PolarHBondContact O-N 3.1Å; L206-I210 HydrophobicContact CD1-CD1 3.79Å; L206-I210 HydrophobicContact CD1-CG1 4.17Å; L206-I210 HydrophobicContact CG-CD1 4.05Å; L206-I210 WeakPolarHBondContact O-CG1 3.34Å; L206-I210 PolarHBondContact O-N 3.45Å; L206-P295 HydrophobicContact CD1-CB 3.93Å; L206-P295 HydrophobicContact CD1-CG 3.59Å; L206-V407 HydrophobicContact CB-CG2 4.29Å; L206-V407 HydrophobicContact CD2-CG2 3.87Å; L206-V407 HydrophobicContact CG-CG2 4.26Å
207	A	96.8	Very high	89.1	Confident	14 Å²	14	72.5 Å²	72.5	12%	0.116	37%	0.366	C	S	.	.	H	α-helix	trans	-55.4	-49.5	176.1	0	0	0	0	0	112	L203 K204 R209 I210 Y211 L377 V407	L203-A207 PolarHBondContact O-N 3.34Å; K204-A207 PolarHBondContact O-N 3.39Å; A207-R209 PolarHBondContact O-N 2.9Å; A207-I210 PolarHBondContact O-N 2.76Å; A207-Y211 WeakPolarHBondContact O-CB 3.22Å; A207-Y211 PolarHBondContact O-N 3.01Å; A207-L377 HydrophobicContact CB-CD1 4.37Å; A207-V407 HydrophobicContact CB-CG1 3.52Å
208	K	96.7	Very high	90.8	Very high	128 Å²	128	69 Å²	69	56%	0.557	35%	0.347	S	S	*	.	H	α-helix	trans	-60.6	-45.7	-180	-179.8	175	173.5	177.7	0	111.9	K204 S205 L206 I210 Y211 E212	K204-K208 WeakPolarHBondContact O-CB 3.43Å; K204-K208 PolarHBondContact O-N 3.2Å; S205-K208 PolarHBondContact O-N 2.79Å; L206-K208 VanDerWaalsContact C-N 3.34Å; L206-K208 PolarHBondContact O-N 3.47Å; K208-I210 PolarHBondContact O-N 2.86Å; K208-Y211 PolarHBondContact O-N 2.86Å; K208-E212 WeakPolarHBondContact CE-OE1 3.21Å; K208-E212 HydrophobicContact CG-CG 4.36Å; K208-E212 IonicContact NZ-OE1 3.56Å; K208-E212 WeakPolarHBondContact O-CB 2.81Å; K208-E212 WeakPolarHBondContact O-CG 3.45Å; K208-E212 PolarHBondContact O-N 3.07Å
209	R	98	Very high	91.7	Very high	135 Å²	135	69.2 Å²	69.2	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-63.2	-41.4	179.6	-72.5	179.5	69.3	-168.5	0.3	112.3	S205 L206 A207 A213 P295	S205-R209 WeakPolarHBondContact O-CG 3.44Å; S205-R209 PolarHBondContact O-N 3.29Å; L206-R209 PolarHBondContact O-N 3.1Å; A207-R209 PolarHBondContact O-N 2.9Å; R209-A213 WeakPolarHBondContact O-CB 3.26Å; R209-A213 PolarHBondContact O-N 3.04Å; R209-P295 HydrophobicContact CB-CG 4.27Å
210	I	98.5	Very high	92.7	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-43.9	176.5	-68.9	172.1	0	0	0	110.3	L206 A207 K208 A213 Y214 F290 I294 L377 A380 I404	L206-I210 HydrophobicContact CD1-CD1 3.79Å; L206-I210 HydrophobicContact CD1-CG1 4.17Å; L206-I210 HydrophobicContact CG-CD1 4.05Å; L206-I210 WeakPolarHBondContact O-CG1 3.34Å; L206-I210 PolarHBondContact O-N 3.45Å; A207-I210 PolarHBondContact O-N 2.76Å; K208-I210 PolarHBondContact O-N 2.86Å; I210-A213 PolarHBondContact O-N 2.98Å; I210-Y214 WeakPolarHBondContact O-CB 3.49Å; I210-Y214 PolarHBondContact O-N 3.36Å; I210-F290 HydrophobicContact CG2-CE2 4.24Å; I210-F290 HydrophobicContact CG2-CZ 4.04Å; I210-I294 HydrophobicContact CD1-CG2 4.47Å; I210-I294 HydrophobicContact CG1-CG2 4.49Å; I210-L377 HydrophobicContact CB-CD2 4.31Å; I210-L377 HydrophobicContact CD1-CD2 3.85Å; I210-L377 HydrophobicContact CG2-CD2 4.24Å; I210-A380 HydrophobicContact CD1-CB 4.29Å; I210-A380 HydrophobicContact CG2-CB 3.98Å; I210-I404 HydrophobicContact CD1-CG1 4.22Å; I210-I404 HydrophobicContact CD1-CG2 4.46Å
211	Y	98.4	Very high	93.7	Very high	78 Å²	78	64.1 Å²	64.1	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-42.8	178	178.4	-130.3	0	0	0	112.9	A207 K208 A213 Y214 L215 D372	A207-Y211 WeakPolarHBondContact O-CB 3.22Å; A207-Y211 PolarHBondContact O-N 3.01Å; K208-Y211 PolarHBondContact O-N 2.86Å; Y211-A213 PolarHBondContact O-N 2.68Å; Y211-Y214 WeakPolarHBondContact O-CB 3.45Å; Y211-Y214 PolarHBondContact O-N 3.28Å; Y211-L215 HydrophobicContact CD1-CD1 4.41Å; Y211-L215 HydrophobicContact CD2-CD1 4.44Å; Y211-L215 HydrophobicContact CD2-CG 4.16Å; Y211-L215 HydrophobicContact CE1-CD1 3.83Å; Y211-L215 HydrophobicContact CE2-CD1 3.86Å; Y211-L215 HydrophobicContact CE2-CD2 3.87Å; Y211-L215 HydrophobicContact CE2-CG 3.7Å; Y211-L215 WeakPolarHBondContact O-CG 3.28Å; Y211-L215 PolarHBondContact O-N 2.85Å; Y211-D372 HydrophobicContact CE2-CB 3.81Å
212	E	98.1	Very high	94.6	Very high	103 Å²	103	62.2 Å²	62.2	48%	0.481	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-40.8	175.5	-74.7	175.2	171.7	0	0	112.1	K208 L215 K216	K208-E212 WeakPolarHBondContact CE-OE1 3.21Å; K208-E212 HydrophobicContact CG-CG 4.36Å; K208-E212 IonicContact NZ-OE1 3.56Å; K208-E212 WeakPolarHBondContact O-CB 2.81Å; K208-E212 WeakPolarHBondContact O-CG 3.45Å; K208-E212 PolarHBondContact O-N 3.07Å; E212-L215 PolarHBondContact O-N 3Å; E212-K216 WeakPolarHBondContact O-CB 3.46Å; E212-K216 PolarHBondContact O-N 3.36Å
213	A	98.3	Very high	95.2	Very high	10 Å²	10	61 Å²	61	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-46.8	172.4	0	0	0	0	0	111	R209 I210 Y211 L215 K216 N217 F290 A293	R209-A213 WeakPolarHBondContact O-CB 3.26Å; R209-A213 PolarHBondContact O-N 3.04Å; I210-A213 PolarHBondContact O-N 2.98Å; Y211-A213 PolarHBondContact O-N 2.68Å; A213-L215 PolarHBondContact O-N 3.3Å; A213-K216 PolarHBondContact O-N 2.87Å; A213-N217 WeakPolarHBondContact O-CB 3.35Å; A213-N217 PolarHBondContact O-N 3.38Å; A213-N217 PolarHBondContact O-OD1 3.36Å; A213-F290 HydrophobicContact CB-CD2 4.02Å; A213-F290 HydrophobicContact CB-CE2 4.15Å; A213-A293 HydrophobicContact CB-CB 3.64Å
214	Y	98.5	Very high	95.6	Very high	3 Å²	3	64.3 Å²	64.3	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-56.7	-50.2	177.6	-178.1	-91.8	0	0	0	112	I210 Y211 K216 N217 F218 N221 F290 M320 D372 I375 S376	I210-Y214 WeakPolarHBondContact O-CB 3.49Å; I210-Y214 PolarHBondContact O-N 3.36Å; Y211-Y214 WeakPolarHBondContact O-CB 3.45Å; Y211-Y214 PolarHBondContact O-N 3.28Å; Y214-K216 VanDerWaalsContact C-N 3.28Å; Y214-K216 PolarHBondContact O-N 3.25Å; Y214-N217 PolarHBondContact O-N 3Å; Y214-F218 HydrophobicContact CD1-CD2 4.44Å; Y214-F218 AromaticContact CD2-CD2 3.35Å; Y214-F218 HydrophobicContact CD2-CD2 3.35Å; Y214-F218 AromaticContact CD2-CE2 3.49Å; Y214-F218 HydrophobicContact CD2-CE2 3.49Å; Y214-F218 VanDerWaalsContact CD2-CE2 3.49Å; Y214-F218 HydrophobicContact CE1-CD2 4.5Å; Y214-F218 AromaticContact CE2-CD2 3.4Å; Y214-F218 HydrophobicContact CE2-CD2 3.4Å; Y214-F218 AromaticContact CE2-CE2 3.65Å; Y214-F218 HydrophobicContact CE2-CE2 3.65Å; Y214-F218 HydrophobicContact CE2-CG 4.25Å; Y214-F218 AromaticContact CG-CD2 3.89Å; Y214-F218 HydrophobicContact CG-CD2 3.89Å; Y214-F218 HydrophobicContact CG-CE2 4.35Å; Y214-F218 AromaticContact CZ-CD2 3.99Å; Y214-F218 WeakPolarHBondContact O-CD2 3.43Å; Y214-F218 PolarHBondContact O-N 3.47Å; Y214-N221 HydrophobicContact CE1-CB 4.22Å; Y214-F290 HydrophobicContact CD2-CE2 4.37Å; Y214-M320 HydrophobicContact CE2-SD 3.9Å; Y214-D372 HydrophobicContact CE1-CB 4.2Å; Y214-I375 HydrophobicContact CE2-CG2 4.23Å; Y214-S376 VanDerWaalsContact CB-CB 3.49Å
215	L	97.4	Very high	96	Very high	69 Å²	69	57.2 Å²	57.2	36%	0.361	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-31.6	179.4	-70.1	-177.6	0	0	0	113.7	Y211 E212 A213 N221	Y211-L215 HydrophobicContact CD1-CD1 4.41Å; Y211-L215 HydrophobicContact CD2-CD1 4.44Å; Y211-L215 HydrophobicContact CD2-CG 4.16Å; Y211-L215 HydrophobicContact CE1-CD1 3.83Å; Y211-L215 HydrophobicContact CE2-CD1 3.86Å; Y211-L215 HydrophobicContact CE2-CD2 3.87Å; Y211-L215 HydrophobicContact CE2-CG 3.7Å; Y211-L215 WeakPolarHBondContact O-CG 3.28Å; Y211-L215 PolarHBondContact O-N 2.85Å; E212-L215 PolarHBondContact O-N 3Å; A213-L215 PolarHBondContact O-N 3.3Å; L215-N221 WeakPolarHBondContact CD2-ND2 3.21Å
216	K	97.2	Very high	96.1	Very high	183 Å²	183	58.3 Å²	58.3	80%	0.796	27%	0.271	S	S	*	.	H	α-helix	trans	-73.9	-38.4	179	-177.1	-175.9	175.3	-170.2	0	111.8	E212 A213 Y214	E212-K216 WeakPolarHBondContact O-CB 3.46Å; E212-K216 PolarHBondContact O-N 3.36Å; A213-K216 PolarHBondContact O-N 2.87Å; Y214-K216 VanDerWaalsContact C-N 3.28Å; Y214-K216 PolarHBondContact O-N 3.25Å
217	N	96.8	Very high	96.1	Very high	33 Å²	33	59.6 Å²	59.6	18%	0.176	28%	0.281	C	S	.	.	H	α-helix	trans	-91.7	-27.6	-169.6	-71.9	98.9	0	0	0	113.7	A213 Y214 E289 F290	A213-N217 WeakPolarHBondContact O-CB 3.35Å; A213-N217 PolarHBondContact O-N 3.38Å; A213-N217 PolarHBondContact O-OD1 3.36Å; Y214-N217 PolarHBondContact O-N 3Å; N217-E289 WeakPolarHBondContact ND2-CB 3.48Å; N217-F290 HydrophobicContact CB-CB 4.02Å
218	F	95.6	Very high	96	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.035	28%	0.284	C	S	.	.			trans	-104.9	119.1	179.7	-62.8	-68.9	0	0	0	111.9	Y214 E286 L287 F290 M320	Y214-F218 HydrophobicContact CD1-CD2 4.44Å; Y214-F218 AromaticContact CD2-CD2 3.35Å; Y214-F218 HydrophobicContact CD2-CD2 3.35Å; Y214-F218 AromaticContact CD2-CE2 3.49Å; Y214-F218 HydrophobicContact CD2-CE2 3.49Å; Y214-F218 VanDerWaalsContact CD2-CE2 3.49Å; Y214-F218 HydrophobicContact CE1-CD2 4.5Å; Y214-F218 AromaticContact CE2-CD2 3.4Å; Y214-F218 HydrophobicContact CE2-CD2 3.4Å; Y214-F218 AromaticContact CE2-CE2 3.65Å; Y214-F218 HydrophobicContact CE2-CE2 3.65Å; Y214-F218 HydrophobicContact CE2-CG 4.25Å; Y214-F218 AromaticContact CG-CD2 3.89Å; Y214-F218 HydrophobicContact CG-CD2 3.89Å; Y214-F218 HydrophobicContact CG-CE2 4.35Å; Y214-F218 AromaticContact CZ-CD2 3.99Å; Y214-F218 WeakPolarHBondContact O-CD2 3.43Å; Y214-F218 PolarHBondContact O-N 3.47Å; F218-E286 HydrophobicContact CD1-CB 3.92Å; F218-E286 WeakPolarHBondContact CD1-OE2 3.25Å; F218-E286 HydrophobicContact CE1-CB 3.76Å; F218-L287 HydrophobicContact CE1-CD2 4.33Å; F218-L287 HydrophobicContact CE1-CG 4Å; F218-L287 HydrophobicContact CZ-CD2 3.7Å; F218-L287 HydrophobicContact CZ-CG 3.86Å; F218-F290 HydrophobicContact CE2-CB 3.74Å; F218-F290 HydrophobicContact CE2-CD1 4.07Å; F218-F290 HydrophobicContact CE2-CD2 4.12Å; F218-F290 AromaticContact CE2-CG 3.7Å; F218-F290 HydrophobicContact CE2-CG 3.7Å; F218-F290 HydrophobicContact CZ-CB 3.87Å; F218-F290 HydrophobicContact CZ-CD1 4.31Å; F218-F290 HydrophobicContact CZ-CG 4.15Å; F218-M320 HydrophobicContact CD1-CE 4.4Å; F218-M320 HydrophobicContact CD1-SD 4.13Å; F218-M320 HydrophobicContact CD2-SD 4.34Å; F218-M320 HydrophobicContact CE1-CE 3.72Å; F218-M320 HydrophobicContact CE1-SD 3.76Å; F218-M320 HydrophobicContact CE2-SD 3.98Å; F218-M320 HydrophobicContact CG-SD 4.41Å; F218-M320 HydrophobicContact CZ-CE 3.96Å; F218-M320 HydrophobicContact CZ-SD 3.68Å
219	N	89.2	Confident	95.8	Very high	86 Å²	86	56.3 Å²	56.3	46%	0.46	27%	0.267	S	S	.	.	S	Bend	trans	-65.7	-48.5	177.8	-172	-31.5	0	0	0	111.2	K224 Y334	N219-K224 WeakPolarHBondContact O-CD 3.2Å; N219-K224 PolarHBondContact O-NZ 3.45Å; N219-Y334 HydrophobicContact CB-CD1 4.41Å
220	M	93.3	Very high	95.4	Very high	44 Å²	44	53 Å²	53	22%	0.217	26%	0.264	C	S	.	.	S	Bend	trans	-98.7	104.7	-178.4	-169	57.7	58.8	0	0	111.4	K224 A225 I228 V324 Y334	M220-K224 HydrophobicContact SD-CB 3.84Å; M220-A225 HydrophobicContact SD-CB 4.33Å; M220-I228 HydrophobicContact CE-CD1 4.34Å; M220-I228 HydrophobicContact SD-CD1 4.46Å; M220-V324 HydrophobicContact CG-CG1 3.76Å; M220-Y334 WeakPolarHBondContact CE-O 3.44Å
221	N	94.3	Very high	94.9	Very high	17 Å²	17	56.1 Å²	56.1	9%	0.091	30%	0.296	C	S	.	.			trans	-104.1	171.2	175.7	65.4	22.9	0	0	0	111.7	Y214 L215 V223 K224 A225	Y214-N221 HydrophobicContact CE1-CB 4.22Å; L215-N221 WeakPolarHBondContact CD2-ND2 3.21Å; N221-V223 VanDerWaalsContact C-N 3.34Å; N221-V223 PolarHBondContact O-N 3.11Å; N221-K224 PolarHBondContact O-N 3.36Å; N221-K224 VanDerWaalsContact OD1-CB 3.31Å; N221-K224 WeakPolarHBondContact OD1-CB 3.27Å; N221-K224 VanDerWaalsContact OD1-CG 3.22Å; N221-K224 WeakPolarHBondContact OD1-CG 3.41Å; N221-K224 PolarHBondContact OD1-N 3.33Å; N221-A225 WeakPolarHBondContact O-CB 3.38Å; N221-A225 PolarHBondContact O-N 2.9Å
222	K	96.6	Very high	94.1	Very high	15 Å²	15	60.2 Å²	60.2	7%	0.065	32%	0.316	C	S	.	.	H	α-helix	trans	-63.4	-39.8	-176.3	-169.4	166.4	-178	174.1	0	111.8	A225 R226 L370 D372 I375	K222-A225 PolarHBondContact O-N 2.56Å; K222-R226 HydrophobicContact CG-CG 4.1Å; K222-R226 WeakPolarHBondContact O-CB 3.45Å; K222-R226 WeakPolarHBondContact O-CG 3.4Å; K222-R226 PolarHBondContact O-N 2.83Å; K222-L370 WeakPolarHBondContact CD-O 3.31Å; K222-L370 WeakPolarHBondContact CE-O 3.44Å; K222-L370 PolarHBondContact NZ-O 3.11Å; K222-D372 WeakPolarHBondContact CB-OD1 3.32Å; K222-D372 PolarHBondContact N-OD1 2.91Å; K222-D372 PolarHBondContact N-OD2 3.07Å; K222-I375 HydrophobicContact CB-CD1 4.32Å; K222-I375 HydrophobicContact CD-CD1 3.5Å; K222-I375 VanDerWaalsContact CD-CD1 3.5Å
223	V	95.1	Very high	93.1	Very high	88 Å²	88	57.3 Å²	57.3	53%	0.533	31%	0.309	S	S	.	.	H	α-helix	trans	-57.9	-52.5	176.7	169.2	0	0	0	0	111.1	N221 A225 R226 V227 D372	N221-V223 VanDerWaalsContact C-N 3.34Å; N221-V223 PolarHBondContact O-N 3.11Å; V223-A225 PolarHBondContact O-N 2.71Å; V223-R226 PolarHBondContact O-N 3.46Å; V223-V227 WeakPolarHBondContact O-CG2 3.34Å; V223-V227 PolarHBondContact O-N 3.1Å; V223-V227 VanDerWaalsContact O-N 3.1Å; V223-D372 VanDerWaalsContact CG2-OD2 3.25Å; V223-D372 WeakPolarHBondContact CG2-OD2 3.45Å; V223-D372 PolarHBondContact N-OD2 3.26Å
224	K	94.5	Very high	91.2	Very high	94 Å²	94	61.9 Å²	61.9	41%	0.409	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-47.4	177.3	-73.2	174.6	-175.2	178.3	0	111.3	N219 M220 N221 R226 V227 I228	N219-K224 WeakPolarHBondContact O-CD 3.2Å; N219-K224 PolarHBondContact O-NZ 3.45Å; M220-K224 HydrophobicContact SD-CB 3.84Å; N221-K224 PolarHBondContact O-N 3.36Å; N221-K224 VanDerWaalsContact OD1-CB 3.31Å; N221-K224 WeakPolarHBondContact OD1-CB 3.27Å; N221-K224 VanDerWaalsContact OD1-CG 3.22Å; N221-K224 WeakPolarHBondContact OD1-CG 3.41Å; N221-K224 PolarHBondContact OD1-N 3.33Å; K224-R226 VanDerWaalsContact C-N 3.33Å; K224-R226 PolarHBondContact O-N 3.36Å; K224-V227 PolarHBondContact O-N 3.42Å; K224-I228 WeakPolarHBondContact O-CG1 3.25Å; K224-I228 PolarHBondContact O-N 2.86Å; K224-I228 VanDerWaalsContact O-N 3.15Å
225	A	95.9	Very high	89.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-43.1	179.8	0	0	0	0	0	112.2	M220 N221 K222 V223 I228 L229 S323 V324 L331	M220-A225 HydrophobicContact SD-CB 4.33Å; N221-A225 WeakPolarHBondContact O-CB 3.38Å; N221-A225 PolarHBondContact O-N 2.9Å; K222-A225 PolarHBondContact O-N 2.56Å; V223-A225 PolarHBondContact O-N 2.71Å; A225-I228 PolarHBondContact O-N 3.3Å; A225-L229 WeakPolarHBondContact O-CB 3.34Å; A225-L229 VanDerWaalsContact O-CG 3.27Å; A225-L229 WeakPolarHBondContact O-CG 3.34Å; A225-L229 PolarHBondContact O-N 2.96Å; A225-S323 WeakPolarHBondContact CB-O 3.33Å; A225-V324 HydrophobicContact CB-CG1 3.88Å; A225-L331 HydrophobicContact CB-CD1 4.02Å
226	R	94.8	Very high	88.9	Confident	79 Å²	79	72.1 Å²	72.1	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-69.1	-34	179.3	-68.8	-66.2	178.7	-138.6	-3.7	112.9	K222 V223 K224 I228 S230 M325 N366	K222-R226 HydrophobicContact CG-CG 4.1Å; K222-R226 WeakPolarHBondContact O-CB 3.45Å; K222-R226 WeakPolarHBondContact O-CG 3.4Å; K222-R226 PolarHBondContact O-N 2.83Å; V223-R226 PolarHBondContact O-N 3.46Å; K224-R226 VanDerWaalsContact C-N 3.33Å; K224-R226 PolarHBondContact O-N 3.36Å; R226-I228 VanDerWaalsContact C-N 3.34Å; R226-S230 VanDerWaalsContact O-CB 3.25Å; R226-S230 WeakPolarHBondContact O-CB 3.44Å; R226-S230 PolarHBondContact O-N 3.48Å; R226-S230 PolarHBondContact O-OG 3.47Å; R226-M325 PolarHBondContact NH1-O 2.7Å; R226-N366 PolarHBondContact NH2-ND2 3.16Å; R226-N366 VanDerWaalsContact NH2-ND2 3.12Å; R226-N366 PolarHBondContact NH2-OD1 3.43Å
227	V	93.8	Very high	88.4	Confident	64 Å²	64	68.2 Å²	68.2	39%	0.388	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-43.6	172.7	171.9	0	0	0	0	110.9	V223 K224 S230 K232 A233	V223-V227 WeakPolarHBondContact O-CG2 3.34Å; V223-V227 PolarHBondContact O-N 3.1Å; V223-V227 VanDerWaalsContact O-N 3.1Å; K224-V227 PolarHBondContact O-N 3.42Å; V227-S230 PolarHBondContact O-OG 3.3Å; V227-K232 HydrophobicContact CG1-CB 4.3Å; V227-K232 PolarHBondContact O-N 3.41Å; V227-K232 VanDerWaalsContact O-N 3.11Å; V227-A233 HydrophobicContact CG1-CB 4.25Å; V227-A233 PolarHBondContact O-N 3.46Å
228	I	94.4	Very high	88.2	Confident	35 Å²	35	68 Å²	68	18%	0.179	39%	0.39	C	S	.	.	H	α-helix	trans	-66.4	-51.7	177.3	-61	168.1	0	0	0	110.5	M220 K224 A225 R226 S230 G231 A233 P238 L331	M220-I228 HydrophobicContact CE-CD1 4.34Å; M220-I228 HydrophobicContact SD-CD1 4.46Å; K224-I228 WeakPolarHBondContact O-CG1 3.25Å; K224-I228 PolarHBondContact O-N 2.86Å; K224-I228 VanDerWaalsContact O-N 3.15Å; A225-I228 PolarHBondContact O-N 3.3Å; R226-I228 VanDerWaalsContact C-N 3.34Å; I228-S230 VanDerWaalsContact C-N 3.28Å; I228-S230 PolarHBondContact O-N 3.36Å; I228-G231 PolarHBondContact O-N 2.95Å; I228-A233 HydrophobicContact CG1-CB 4.48Å; I228-P238 HydrophobicContact CG2-CG 4.03Å; I228-L331 HydrophobicContact CB-CD1 4.09Å; I228-L331 HydrophobicContact CD1-CD1 4.27Å; I228-L331 HydrophobicContact CG2-CD1 4.11Å; I228-L331 HydrophobicContact CG2-CD2 3.65Å
229	L	93.4	Very high	88.2	Confident	38 Å²	38	70.7 Å²	70.7	20%	0.199	40%	0.401	C	S	.	.	H	α-helix	trans	-65.2	-27.5	-176.5	-71.6	171.9	0	0	0	113.8	A225 G231 L331 F338	A225-L229 WeakPolarHBondContact O-CB 3.34Å; A225-L229 VanDerWaalsContact O-CG 3.27Å; A225-L229 WeakPolarHBondContact O-CG 3.34Å; A225-L229 PolarHBondContact O-N 2.96Å; L229-G231 VanDerWaalsContact C-N 3.28Å; L229-L331 HydrophobicContact CD1-CD1 4.42Å; L229-L331 HydrophobicContact CD2-CD1 4.29Å; L229-L331 HydrophobicContact CD2-CD2 4.02Å; L229-L331 HydrophobicContact CD2-CG 3.86Å; L229-L331 HydrophobicContact CG-CD1 3.96Å; L229-L331 HydrophobicContact CG-CD2 4.49Å; L229-L331 HydrophobicContact CG-CG 4.1Å; L229-F338 HydrophobicContact CD2-CD2 3.86Å; L229-F338 HydrophobicContact CD2-CE2 3.59Å
230	S	90.4	Very high	88.6	Confident	66 Å²	66	69.6 Å²	69.6	46%	0.462	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-0.6	175.9	60.7	0	0	0	0	113.7	R226 V227 I228 K232	R226-S230 VanDerWaalsContact O-CB 3.25Å; R226-S230 WeakPolarHBondContact O-CB 3.44Å; R226-S230 PolarHBondContact O-N 3.48Å; R226-S230 PolarHBondContact O-OG 3.47Å; V227-S230 PolarHBondContact O-OG 3.3Å; I228-S230 VanDerWaalsContact C-N 3.28Å; I228-S230 PolarHBondContact O-N 3.36Å; S230-K232 PolarHBondContact O-N 3.34Å; S230-K232 WeakPolarHBondContact OG-CG 3.33Å
231	G	86	Confident	88.8	Confident	65 Å²	65	68 Å²	68	67%	0.67	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	15.3	-178.4	0	0	0	0	0	113.9	I228 L229	I228-G231 PolarHBondContact O-N 2.95Å; L229-G231 VanDerWaalsContact C-N 3.28Å
232	K	82.3	Confident	88.9	Confident	165 Å²	165	71.7 Å²	71.7	72%	0.717	41%	0.407	S	S	*	.			trans	-85.5	-8.1	-179.6	-66.7	-179.8	-177.3	178.4	0	113.2	V227 S230 S234	V227-K232 HydrophobicContact CG1-CB 4.3Å; V227-K232 PolarHBondContact O-N 3.41Å; V227-K232 VanDerWaalsContact O-N 3.11Å; S230-K232 PolarHBondContact O-N 3.34Å; S230-K232 WeakPolarHBondContact OG-CG 3.33Å; K232-S234 PolarHBondContact O-N 3.43Å
233	A	77.8	Confident	88.9	Confident	42 Å²	42	73.5 Å²	73.5	35%	0.347	42%	0.417	S	S	.	.			trans	-70.9	121.9	174.5	0	0	0	0	0	110.3	V227 I228 N235	V227-A233 HydrophobicContact CG1-CB 4.25Å; V227-A233 PolarHBondContact O-N 3.46Å; I228-A233 HydrophobicContact CG1-CB 4.48Å; A233-N235 PolarHBondContact O-N 3.04Å
234	S	58.5	Low	88.8	Confident	105 Å²	105	73.3 Å²	73.3	73%	0.734	41%	0.411	S	S	*	.	S	Bend	trans	-80.3	-10.1	-157.2	74.4	0	0	0	0	117.5	K232	K232-S234 PolarHBondContact O-N 3.43Å
235	N	66.9	Low	88.8	Confident	151 Å²	151	75.7 Å²	75.7	81%	0.807	42%	0.424	S	S	*	.	S	Bend	trans	-134	-18.5	-167.5	-76	-26.2	0	0	0	117.8	A233	A233-N235 PolarHBondContact O-N 3.04Å
236	N	79.3	Confident	88.8	Confident	136 Å²	136	76.5 Å²	76.5	73%	0.727	43%	0.429	S	S	*	.			trans	-157.2	112.7	175.4	-160.2	16.5	0	0	0	111.1
237	P	87.4	Confident	88.7	Confident	102 Å²	102	73.3 Å²	73.3	66%	0.662	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-66.7	155	174.7	29.5	-34.3	0	0	0	110.8
238	P	93.7	Very high	88.5	Confident	29 Å²	29	72.2 Å²	72.2	19%	0.188	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.4	176.4	26.2	-33.7	0	0	0	111	I228 V240 L331 N336 F338	I228-P238 HydrophobicContact CG2-CG 4.03Å; P238-V240 PolarHBondContact O-N 3.29Å; P238-L331 HydrophobicContact CB-CD2 4.28Å; P238-L331 HydrophobicContact CG-CD2 4.21Å; P238-N336 CarbonylContact C-O 3.58Å; P238-N336 WeakPolarHBondContact CA-O 3.43Å; P238-F338 HydrophobicContact CB-CB 4.01Å; P238-F338 HydrophobicContact CG-CB 3.98Å
239	F	95.2	Very high	88.3	Confident	63 Å²	63	75 Å²	75	28%	0.276	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	120.7	173	178.2	-91.6	0	0	0	110	I241 T246 M249 A250 L254 N336 G337 F338	F239-I241 HydrophobicContact CD1-CG1 3.97Å; F239-I241 HydrophobicContact CE1-CG1 3.99Å; F239-T246 VanDerWaalsContact CE1-O 3.26Å; F239-T246 WeakPolarHBondContact CE1-O 3.43Å; F239-T246 HydrophobicContact CZ-CG2 4.42Å; F239-M249 HydrophobicContact CE1-CB 4.36Å; F239-M249 HydrophobicContact CE2-CB 4.45Å; F239-M249 HydrophobicContact CE2-CE 4.31Å; F239-M249 HydrophobicContact CZ-CB 3.72Å; F239-M249 HydrophobicContact CZ-SD 4.37Å; F239-A250 HydrophobicContact CD1-CB 3.99Å; F239-A250 HydrophobicContact CE1-CB 3.82Å; F239-L254 HydrophobicContact CB-CD1 4.03Å; F239-L254 HydrophobicContact CB-CD2 4.15Å; F239-L254 HydrophobicContact CD1-CD1 4.31Å; F239-L254 HydrophobicContact CG-CD1 4.2Å; F239-N336 PolarHBondContact N-O 3.22Å; F239-G337 CarbonylContact O-C 3.6Å; F239-G337 VanDerWaalsContact O-CA 3.26Å; F239-G337 WeakPolarHBondContact O-CA 3.42Å; F239-F338 PolarHBondContact O-N 2.88Å
240	V	96.9	Very high	88.2	Confident	63 Å²	63	73.4 Å²	73.4	38%	0.382	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.8	-174.3	-174.3	0	0	0	0	110.8	P238 H242 F338 T340	P238-V240 PolarHBondContact O-N 3.29Å; V240-H242 HydrophobicContact CG1-CB 4.49Å; V240-F338 CarbonylContact C-O 3.52Å; V240-F338 WeakPolarHBondContact CA-O 3.33Å; V240-F338 HydrophobicContact CG1-CD1 4.35Å; V240-T340 HydrophobicContact CG1-CG2 3.94Å
241	I	97.5	Very high	88	Confident	11 Å²	11	71 Å²	71	6%	0.056	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.1	175.9	-55.2	166.8	0	0	0	108	F239 L247 A250 V332 F338 I339 T340 F343	F239-I241 HydrophobicContact CD1-CG1 3.97Å; F239-I241 HydrophobicContact CE1-CG1 3.99Å; I241-L247 HydrophobicContact CG2-CB 4Å; I241-L247 HydrophobicContact CG2-CD1 4.19Å; I241-A250 HydrophobicContact CD1-CB 3.53Å; I241-A250 HydrophobicContact CG1-CB 3.79Å; I241-V332 HydrophobicContact CD1-CG2 4.22Å; I241-F338 PolarHBondContact N-O 2.87Å; I241-I339 HydrophobicContact CB-CB 4.22Å; I241-I339 HydrophobicContact CB-CG1 4.12Å; I241-I339 HydrophobicContact CG2-CD1 4.23Å; I241-I339 HydrophobicContact CG2-CG1 4.11Å; I241-I339 WeakPolarHBondContact O-CA 3.44Å; I241-T340 PolarHBondContact O-N 2.88Å; I241-T340 PolarHBondContact O-OG1 3.31Å; I241-F343 HydrophobicContact CG2-CD1 3.99Å; I241-F343 HydrophobicContact CG2-CE1 3.8Å
242	H	97	Very high	87.9	Confident	95 Å²	95	75.1 Å²	75.1	44%	0.44	40%	0.399	S	S	.	.			trans	-134.3	-3.2	-175.5	60.2	67.5	0	0	0	114.7	V240 T246 T340 F343	V240-H242 HydrophobicContact CG1-CB 4.49Å; H242-T246 PolarHBondContact N-OG1 3.1Å; H242-T340 HydrophobicContact CB-CG2 3.78Å; H242-F343 WeakPolarHBondContact O-CB 3.34Å; H242-F343 WeakPolarHBondContact O-CD2 3.48Å
243	D	96.2	Very high	88.1	Confident	52 Å²	52	71.7 Å²	71.7	28%	0.278	39%	0.392	S	S	.	.	S	Bend	trans	-158.1	-178.8	176.6	54.3	36.1	0	0	0	110.6	E245 T246 L247 F343	D243-E245 VanDerWaalsContact C-N 3.29Å; D243-E245 PolarHBondContact O-N 3.39Å; D243-E245 PolarHBondContact OD1-N 3.16Å; D243-E245 VanDerWaalsContact OD1-N 3.14Å; D243-T246 PolarHBondContact N-OG1 3.35Å; D243-T246 VanDerWaalsContact N-OG1 3.07Å; D243-T246 PolarHBondContact O-OG1 3.02Å; D243-T246 VanDerWaalsContact O-OG1 3.09Å; D243-T246 WeakPolarHBondContact OD1-CB 3.5Å; D243-T246 WeakPolarHBondContact OD1-CG2 3.17Å; D243-T246 PolarHBondContact OD1-N 3.33Å; D243-T246 PolarHBondContact OD1-OG1 3.38Å; D243-L247 VanDerWaalsContact O-CB 3.28Å; D243-L247 WeakPolarHBondContact O-CB 3.45Å; D243-L247 PolarHBondContact O-N 3.43Å; D243-F343 VanDerWaalsContact C-CE2 3.47Å; D243-F343 VanDerWaalsContact CA-CE2 3.49Å
244	M	93.2	Very high	88.3	Confident	84 Å²	84	72.3 Å²	72.3	41%	0.414	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-27.4	-179.9	-66.2	-61.7	176.8	0	0	113.4	L247 C248 A268 F343 L347	M244-L247 HydrophobicContact SD-CD2 3.98Å; M244-C248 WeakPolarHBondContact O-CB 3.26Å; M244-C248 PolarHBondContact O-N 2.96Å; M244-A268 HydrophobicContact CE-CB 3.93Å; M244-A268 HydrophobicContact SD-CB 3.56Å; M244-A268 VanDerWaalsContact SD-CB 3.56Å; M244-F343 HydrophobicContact CE-CE2 4.23Å; M244-F343 HydrophobicContact CE-CZ 4.36Å; M244-F343 HydrophobicContact SD-CE2 4.25Å; M244-F343 HydrophobicContact SD-CZ 4.08Å; M244-L347 HydrophobicContact CE-CD2 3.93Å
245	E	93.9	Very high	89.3	Confident	145 Å²	145	68.6 Å²	68.6	68%	0.678	36%	0.362	S	S	*	.	H	α-helix	trans	-70.8	-53.1	178.9	179.5	175.9	-176.1	0	0	110.3	D243 L247 C248 M249	D243-E245 VanDerWaalsContact C-N 3.29Å; D243-E245 PolarHBondContact O-N 3.39Å; D243-E245 PolarHBondContact OD1-N 3.16Å; D243-E245 VanDerWaalsContact OD1-N 3.14Å; E245-L247 VanDerWaalsContact C-N 3.3Å; E245-L247 PolarHBondContact O-N 2.85Å; E245-C248 WeakPolarHBondContact O-CB 3.38Å; E245-C248 PolarHBondContact O-N 3.26Å; E245-C248 VanDerWaalsContact O-N 3.13Å; E245-M249 WeakPolarHBondContact O-CG 3.19Å; E245-M249 PolarHBondContact O-N 3.44Å
246	T	95.4	Very high	89.8	Confident	17 Å²	17	63.3 Å²	63.3	10%	0.104	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-36.3	176.4	51.5	0	0	0	0	111.8	F239 H242 D243 M249 A250	F239-T246 VanDerWaalsContact CE1-O 3.26Å; F239-T246 WeakPolarHBondContact CE1-O 3.43Å; F239-T246 HydrophobicContact CZ-CG2 4.42Å; H242-T246 PolarHBondContact N-OG1 3.1Å; D243-T246 PolarHBondContact N-OG1 3.35Å; D243-T246 VanDerWaalsContact N-OG1 3.07Å; D243-T246 PolarHBondContact O-OG1 3.02Å; D243-T246 VanDerWaalsContact O-OG1 3.09Å; D243-T246 WeakPolarHBondContact OD1-CB 3.5Å; D243-T246 WeakPolarHBondContact OD1-CG2 3.17Å; D243-T246 PolarHBondContact OD1-N 3.33Å; D243-T246 PolarHBondContact OD1-OG1 3.38Å; T246-M249 PolarHBondContact O-N 3.12Å; T246-A250 PolarHBondContact O-N 3.27Å
247	L	93.2	Very high	89.7	Confident	11 Å²	11	63.6 Å²	63.6	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-50.1	170.5	177.2	68.3	0	0	0	111.3	I241 D243 M244 E245 M249 A250 E251 A268 I272 F343	I241-L247 HydrophobicContact CG2-CB 4Å; I241-L247 HydrophobicContact CG2-CD1 4.19Å; D243-L247 VanDerWaalsContact O-CB 3.28Å; D243-L247 WeakPolarHBondContact O-CB 3.45Å; D243-L247 PolarHBondContact O-N 3.43Å; M244-L247 HydrophobicContact SD-CD2 3.98Å; E245-L247 VanDerWaalsContact C-N 3.3Å; E245-L247 PolarHBondContact O-N 2.85Å; L247-M249 PolarHBondContact O-N 2.84Å; L247-A250 PolarHBondContact O-N 3.49Å; L247-A250 VanDerWaalsContact O-N 3.14Å; L247-E251 HydrophobicContact CD1-CG 4.3Å; L247-E251 HydrophobicContact CG-CG 4.32Å; L247-E251 VanDerWaalsContact O-CG 3.29Å; L247-E251 WeakPolarHBondContact O-CG 3.43Å; L247-E251 PolarHBondContact O-N 2.96Å; L247-A268 HydrophobicContact CD2-CB 4.11Å; L247-I272 HydrophobicContact CD1-CD1 4.35Å; L247-I272 HydrophobicContact CD1-CG1 3.93Å; L247-I272 HydrophobicContact CD2-CD1 3.77Å; L247-I272 HydrophobicContact CD2-CG1 3.91Å; L247-F343 HydrophobicContact CB-CE1 4.34Å; L247-F343 HydrophobicContact CB-CZ 4.22Å; L247-F343 HydrophobicContact CD2-CE1 4.5Å; L247-F343 HydrophobicContact CD2-CZ 4.14Å
248	C	89.4	Confident	89	Confident	42 Å²	42	61 Å²	61	28%	0.284	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-35.9	179.9	-172.3	0	0	0	0	112	M244 E245 K252	M244-C248 WeakPolarHBondContact O-CB 3.26Å; M244-C248 PolarHBondContact O-N 2.96Å; E245-C248 WeakPolarHBondContact O-CB 3.38Å; E245-C248 PolarHBondContact O-N 3.26Å; E245-C248 VanDerWaalsContact O-N 3.13Å; C248-K252 WeakPolarHBondContact O-CG 3.39Å; C248-K252 PolarHBondContact O-N 3.44Å; C248-K252 VanDerWaalsContact O-N 3.13Å; C248-K252 VanDerWaalsContact SG-CE 3.6Å; C248-K252 PolarHBondContact SG-NZ 2.82Å
249	M	91.4	Very high	87.9	Confident	94 Å²	94	59.7 Å²	59.7	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-46.2	173.6	-68	-179.3	70.6	0	0	112.1	F239 E245 T246 L247 E251 K252 T253	F239-M249 HydrophobicContact CE1-CB 4.36Å; F239-M249 HydrophobicContact CE2-CB 4.45Å; F239-M249 HydrophobicContact CE2-CE 4.31Å; F239-M249 HydrophobicContact CZ-CB 3.72Å; F239-M249 HydrophobicContact CZ-SD 4.37Å; E245-M249 WeakPolarHBondContact O-CG 3.19Å; E245-M249 PolarHBondContact O-N 3.44Å; T246-M249 PolarHBondContact O-N 3.12Å; L247-M249 PolarHBondContact O-N 2.84Å; M249-E251 VanDerWaalsContact C-N 3.31Å; M249-E251 PolarHBondContact O-N 2.95Å; M249-K252 PolarHBondContact O-N 3.37Å; M249-T253 WeakPolarHBondContact O-CB 3.44Å; M249-T253 PolarHBondContact O-N 3.46Å; M249-T253 VanDerWaalsContact O-N 3.14Å; M249-T253 PolarHBondContact O-OG1 2.8Å
250	A	90.9	Very high	86.3	Confident	3 Å²	3	59.4 Å²	59.4	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-40.4	175	0	0	0	0	0	112	F239 I241 T246 L247 K252 T253 L254 V255	F239-A250 HydrophobicContact CD1-CB 3.99Å; F239-A250 HydrophobicContact CE1-CB 3.82Å; I241-A250 HydrophobicContact CD1-CB 3.53Å; I241-A250 HydrophobicContact CG1-CB 3.79Å; T246-A250 PolarHBondContact O-N 3.27Å; L247-A250 PolarHBondContact O-N 3.49Å; L247-A250 VanDerWaalsContact O-N 3.14Å; A250-K252 VanDerWaalsContact C-N 3.28Å; A250-K252 PolarHBondContact O-N 3.48Å; A250-T253 CarbonylContact O-C 3.58Å; A250-T253 PolarHBondContact O-N 3.33Å; A250-L254 PolarHBondContact O-N 3.3Å; A250-V255 PolarHBondContact O-N 3.27Å; A250-V255 VanDerWaalsContact O-N 3.08Å
251	E	85.9	Confident	84.7	Confident	15 Å²	15	63.2 Å²	63.2	7%	0.07	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-35.8	175.8	-71.9	176.9	149.8	0	0	112.3	L247 M249 V255 A256 V259 R271	L247-E251 HydrophobicContact CD1-CG 4.3Å; L247-E251 HydrophobicContact CG-CG 4.32Å; L247-E251 VanDerWaalsContact O-CG 3.29Å; L247-E251 WeakPolarHBondContact O-CG 3.43Å; L247-E251 PolarHBondContact O-N 2.96Å; M249-E251 VanDerWaalsContact C-N 3.31Å; M249-E251 PolarHBondContact O-N 2.95Å; E251-V255 HydrophobicContact CG-CG2 4.43Å; E251-V255 CarbonylContact O-C 3.54Å; E251-A256 WeakPolarHBondContact O-CA 3.33Å; E251-A256 PolarHBondContact O-N 2.74Å; E251-V259 HydrophobicContact CB-CG2 4.28Å; E251-V259 HydrophobicContact CG-CG2 4.16Å; E251-R271 IonicContact OE1-CZ 3.89Å; E251-R271 IonicContact OE1-NE 2.89Å; E251-R271 PolarHBondContact OE1-NE 2.97Å; E251-R271 IonicContact OE1-NH2 2.69Å; E251-R271 PolarHBondContact OE1-NH2 3.06Å; E251-R271 IonicContact OE2-CZ 3.47Å; E251-R271 IonicContact OE2-NE 2.83Å; E251-R271 PolarHBondContact OE2-NE 3.42Å; E251-R271 IonicContact OE2-NH2 3.28Å; E251-R271 PolarHBondContact OE2-NH2 3.33Å
252	K	84.3	Confident	82.9	Confident	153 Å²	153	65.3 Å²	65.3	67%	0.665	36%	0.358	S	S	*	.	H	α-helix	trans	-80.7	-16.3	178	-72.6	169.8	-178.4	165.5	0	114	C248 M249 A250	C248-K252 WeakPolarHBondContact O-CG 3.39Å; C248-K252 PolarHBondContact O-N 3.44Å; C248-K252 VanDerWaalsContact O-N 3.13Å; C248-K252 VanDerWaalsContact SG-CE 3.6Å; C248-K252 PolarHBondContact SG-NZ 2.82Å; M249-K252 PolarHBondContact O-N 3.37Å; A250-K252 VanDerWaalsContact C-N 3.28Å; A250-K252 PolarHBondContact O-N 3.48Å
253	T	85.9	Confident	81.6	Confident	93 Å²	93	61.6 Å²	61.6	57%	0.571	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	-71.7	-170.3	53.6	0	0	0	0	111.4	M249 A250	M249-T253 WeakPolarHBondContact O-CB 3.44Å; M249-T253 PolarHBondContact O-N 3.46Å; M249-T253 VanDerWaalsContact O-N 3.14Å; M249-T253 PolarHBondContact O-OG1 2.8Å; A250-T253 CarbonylContact O-C 3.58Å; A250-T253 PolarHBondContact O-N 3.33Å
254	L	81.4	Confident	80.4	Confident	54 Å²	54	64.8 Å²	64.8	28%	0.283	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-41.7	-174.6	-82.3	70.3	0	0	0	112.8	F239 A250 A333 N336	F239-L254 HydrophobicContact CB-CD1 4.03Å; F239-L254 HydrophobicContact CB-CD2 4.15Å; F239-L254 HydrophobicContact CD1-CD1 4.31Å; F239-L254 HydrophobicContact CG-CD1 4.2Å; A250-L254 PolarHBondContact O-N 3.3Å; L254-A333 HydrophobicContact CB-CB 4.34Å; L254-A333 HydrophobicContact CD2-CB 4.28Å; L254-N336 HydrophobicContact CD2-CB 4.39Å
255	V	80.7	Confident	79.4	Confident	28 Å²	28	68.3 Å²	68.3	17%	0.17	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	24.3	-173	-61.4	0	0	0	0	113	A250 E251 K257 L258 V259 A333	A250-V255 PolarHBondContact O-N 3.27Å; A250-V255 VanDerWaalsContact O-N 3.08Å; E251-V255 HydrophobicContact CG-CG2 4.43Å; E251-V255 CarbonylContact O-C 3.54Å; V255-K257 PolarHBondContact O-N 3.04Å; V255-K257 VanDerWaalsContact O-N 3.11Å; V255-L258 HydrophobicContact CB-CB 4.28Å; V255-L258 HydrophobicContact CB-CD1 4.1Å; V255-L258 HydrophobicContact CB-CG 4.46Å; V255-L258 HydrophobicContact CG1-CD1 4.06Å; V255-L258 WeakPolarHBondContact O-CB 3.43Å; V255-L258 PolarHBondContact O-N 3.28Å; V255-V259 HydrophobicContact CG2-CG2 3.9Å; V255-V259 PolarHBondContact O-N 3.09Å; V255-A333 HydrophobicContact CG1-CB 4.22Å
256	A	77.6	Confident	78.8	Confident	39 Å²	39	65.3 Å²	65.3	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-50.1	-42.7	-176.6	0	0	0	0	0	113.6	E251 L258 V259 A260	E251-A256 WeakPolarHBondContact O-CA 3.33Å; E251-A256 PolarHBondContact O-N 2.74Å; A256-L258 VanDerWaalsContact C-N 3.34Å; A256-L258 PolarHBondContact O-N 2.96Å; A256-V259 PolarHBondContact O-N 2.88Å; A256-A260 WeakPolarHBondContact O-CB 3.33Å; A256-A260 PolarHBondContact O-N 3.15Å
257	K	75.7	Confident	78.4	Confident	142 Å²	142	69.7 Å²	69.7	62%	0.617	38%	0.379	S	S	*	.	H	α-helix	trans	-66.2	-33.1	178.1	-65.1	-175.6	179.6	-178.2	0	112.9	V255	V255-K257 PolarHBondContact O-N 3.04Å; V255-K257 VanDerWaalsContact O-N 3.11Å
258	L	72.8	Confident	78.1	Confident	48 Å²	48	69.8 Å²	69.8	25%	0.251	38%	0.381	S	S	.	.	H	α-helix	trans	-77.8	-24.2	-177.8	-60.1	179	0	0	0	112.9	V255 A256 H274 C278	V255-L258 HydrophobicContact CB-CB 4.28Å; V255-L258 HydrophobicContact CB-CD1 4.1Å; V255-L258 HydrophobicContact CB-CG 4.46Å; V255-L258 HydrophobicContact CG1-CD1 4.06Å; V255-L258 WeakPolarHBondContact O-CB 3.43Å; V255-L258 PolarHBondContact O-N 3.28Å; A256-L258 VanDerWaalsContact C-N 3.34Å; A256-L258 PolarHBondContact O-N 2.96Å; L258-H274 PolarHBondContact O-CE1 3.45Å; L258-C278 HydrophobicContact CD1-CB 4.34Å; L258-C278 HydrophobicContact CD2-CB 3.95Å
259	V	72.4	Confident	78.2	Confident	1 Å²	1	69 Å²	69	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-100.3	-13.8	-176.7	-164.4	0	0	0	0	112.2	E251 V255 A256 N261 Q264	E251-V259 HydrophobicContact CB-CG2 4.28Å; E251-V259 HydrophobicContact CG-CG2 4.16Å; V255-V259 HydrophobicContact CG2-CG2 3.9Å; V255-V259 PolarHBondContact O-N 3.09Å; A256-V259 PolarHBondContact O-N 2.88Å; V259-N261 VanDerWaalsContact C-N 3.31Å; V259-N261 PolarHBondContact O-N 3.31Å; V259-Q264 HydrophobicContact CG1-CG 3.74Å; V259-Q264 WeakPolarHBondContact O-CG 3.37Å
260	A	61.6	Low	78	Confident	58 Å²	58	65 Å²	65	48%	0.479	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23	-172.4	0	0	0	0	0	115.8	A256 G262	A256-A260 WeakPolarHBondContact O-CB 3.33Å; A256-A260 PolarHBondContact O-N 3.15Å; A260-G262 VanDerWaalsContact C-N 3.27Å; A260-G262 PolarHBondContact O-N 3.25Å
261	N	62.6	Low	77.9	Confident	142 Å²	142	66.6 Å²	66.6	76%	0.759	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	53.6	-172.9	-72.6	-11.4	0	0	0	114	V259 I263	V259-N261 VanDerWaalsContact C-N 3.31Å; V259-N261 PolarHBondContact O-N 3.31Å; N261-I263 HydrophobicContact CB-CD1 4.39Å; N261-I263 PolarHBondContact O-N 3.38Å
262	G	60.4	Low	78.1	Confident	56 Å²	56	67.1 Å²	67.1	58%	0.577	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-0.5	173.3	0	0	0	0	0	115.8	A260 Q264	A260-G262 VanDerWaalsContact C-N 3.27Å; A260-G262 PolarHBondContact O-N 3.25Å; G262-Q264 VanDerWaalsContact C-N 3.34Å
263	I	69.6	Low	78.5	Confident	16 Å²	16	60.7 Å²	60.7	8%	0.082	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-78.4	-19.3	180	-63.1	135	0	0	0	112.1	N261 N265 K266 R271 H274	N261-I263 HydrophobicContact CB-CD1 4.39Å; N261-I263 PolarHBondContact O-N 3.38Å; I263-N265 PolarHBondContact O-N 2.87Å; I263-K266 WeakPolarHBondContact O-CB 3.36Å; I263-K266 PolarHBondContact O-N 3.36Å; I263-R271 HydrophobicContact CG2-CB 4.09Å; I263-R271 HydrophobicContact CG2-CG 3.72Å; I263-R271 WeakPolarHBondContact O-CD 3.31Å; I263-R271 WeakPolarHBondContact O-CG 3.37Å; I263-H274 WeakPolarHBondContact CD1-CE1 3.48Å; I263-H274 VanDerWaalsContact CD1-NE2 3.27Å; I263-H274 WeakPolarHBondContact CD1-NE2 3.22Å; I263-H274 HydrophobicContact CG2-CB 4.26Å
264	Q	69.8	Low	78.6	Confident	120 Å²	120	58.8 Å²	58.8	56%	0.561	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-54.7	-27.9	179.3	-67.3	179.9	0.9	0	0	113.7	V259 G262	V259-Q264 HydrophobicContact CG1-CG 3.74Å; V259-Q264 WeakPolarHBondContact O-CG 3.37Å; G262-Q264 VanDerWaalsContact C-N 3.34Å
265	N	72.1	Confident	78.9	Confident	157 Å²	157	57.1 Å²	57.1	84%	0.84	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-85.8	-4.7	179.9	-68.4	-24.9	0	0	0	114	I263	I263-N265 PolarHBondContact O-N 2.87Å
266	K	82.3	Confident	79.4	Confident	83 Å²	83	58.8 Å²	58.8	36%	0.361	32%	0.324	S	S	.	.	S	Bend	trans	-85	163.6	176.6	-64.1	-158.5	171.5	-162.7	0	111.6	I263 V270 R271 D452	I263-K266 WeakPolarHBondContact O-CB 3.36Å; I263-K266 PolarHBondContact O-N 3.36Å; K266-V270 HydrophobicContact CB-CB 4.3Å; K266-V270 HydrophobicContact CB-CG1 4.28Å; K266-V270 HydrophobicContact CD-CG1 3.68Å; K266-R271 HydrophobicContact CB-CG 4.37Å; K266-R271 PolarHBondContact O-NH1 3.47Å; K266-D452 PolarHBondContact NZ-O 3.13Å; K266-D452 VanDerWaalsContact NZ-O 3.15Å
267	E	87.2	Confident	80.1	Confident	108 Å²	108	57.6 Å²	57.6	51%	0.505	31%	0.312	S	S	.	.			trans	-55.7	146.3	172.8	-63.7	-175	175.3	0	0	111.7	E269 V270 R271 R348	E267-E269 VanDerWaalsContact C-N 3.27Å; E267-E269 PolarHBondContact O-N 2.93Å; E267-V270 HydrophobicContact CB-CG2 4.29Å; E267-V270 WeakPolarHBondContact O-CB 3.35Å; E267-V270 PolarHBondContact O-N 2.94Å; E267-R271 WeakPolarHBondContact O-CG 3.22Å; E267-R271 PolarHBondContact O-N 3.2Å; E267-R271 VanDerWaalsContact O-N 3.09Å; E267-R348 IonicContact OE2-CZ 3.48Å; E267-R348 IonicContact OE2-NE 3.69Å; E267-R348 PolarHBondContact OE2-NE 3.23Å; E267-R348 IonicContact OE2-NH2 3.59Å; E267-R348 PolarHBondContact OE2-NH2 3.4Å
268	A	86.4	Confident	80.8	Confident	13 Å²	13	51.8 Å²	51.8	11%	0.107	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-38.6	-172.3	0	0	0	0	0	112.8	M244 L247 V270 R271 I272	M244-A268 HydrophobicContact CE-CB 3.93Å; M244-A268 HydrophobicContact SD-CB 3.56Å; M244-A268 VanDerWaalsContact SD-CB 3.56Å; L247-A268 HydrophobicContact CD2-CB 4.11Å; A268-V270 VanDerWaalsContact C-N 3.32Å; A268-V270 PolarHBondContact O-N 3.41Å; A268-R271 WeakPolarHBondContact O-CB 3.16Å; A268-R271 PolarHBondContact O-N 2.96Å; A268-R271 VanDerWaalsContact O-N 3.14Å; A268-I272 WeakPolarHBondContact O-CG1 3.49Å; A268-I272 PolarHBondContact O-N 3.43Å
269	E	90.3	Very high	81.6	Confident	26 Å²	26	52.6 Å²	52.6	12%	0.121	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-41.4	176.7	-63.9	82.7	173.2	0	0	111.9	E267 R271 I272 F273 L347 R348 F351	E267-E269 VanDerWaalsContact C-N 3.27Å; E267-E269 PolarHBondContact O-N 2.93Å; E269-R271 VanDerWaalsContact C-N 3.31Å; E269-R271 PolarHBondContact O-N 3.37Å; E269-I272 PolarHBondContact O-N 3.32Å; E269-F273 VanDerWaalsContact O-CB 3.29Å; E269-F273 WeakPolarHBondContact O-CB 3.29Å; E269-F273 PolarHBondContact O-N 2.78Å; E269-L347 HydrophobicContact CG-CB 4.09Å; E269-L347 HydrophobicContact CG-CD2 4.27Å; E269-R348 HydrophobicContact CG-CB 4.17Å; E269-R348 WeakPolarHBondContact OE1-CB 3.43Å; E269-R348 PolarHBondContact OE1-N 2.99Å; E269-F351 HydrophobicContact CB-CB 4.21Å; E269-F351 HydrophobicContact CB-CD1 4.11Å; E269-F351 HydrophobicContact CB-CD2 3.42Å; E269-F351 VanDerWaalsContact CB-CD2 3.42Å; E269-F351 HydrophobicContact CB-CE1 4.33Å; E269-F351 HydrophobicContact CB-CE2 3.68Å; E269-F351 HydrophobicContact CB-CG 3.66Å; E269-F351 HydrophobicContact CB-CZ 4.13Å; E269-F351 HydrophobicContact CG-CB 4.3Å; E269-F351 HydrophobicContact CG-CD2 3.89Å; E269-F351 HydrophobicContact CG-CE2 4.49Å; E269-F351 HydrophobicContact CG-CG 4.19Å
270	V	88.9	Confident	82.6	Confident	11 Å²	11	53.4 Å²	53.4	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-68.1	-34.7	176.8	-178.4	0	0	0	0	110.6	K266 E267 A268 H274 F351 A453	K266-V270 HydrophobicContact CB-CB 4.3Å; K266-V270 HydrophobicContact CB-CG1 4.28Å; K266-V270 HydrophobicContact CD-CG1 3.68Å; E267-V270 HydrophobicContact CB-CG2 4.29Å; E267-V270 WeakPolarHBondContact O-CB 3.35Å; E267-V270 PolarHBondContact O-N 2.94Å; A268-V270 VanDerWaalsContact C-N 3.32Å; A268-V270 PolarHBondContact O-N 3.41Å; V270-H274 WeakPolarHBondContact O-CB 3.39Å; V270-H274 PolarHBondContact O-N 3.03Å; V270-F351 HydrophobicContact CG2-CZ 4.08Å; V270-A453 HydrophobicContact CG1-CB 4.2Å
271	R	88	Confident	84.2	Confident	35 Å²	35	51.1 Å²	51.1	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-69.1	-42.9	175.2	-53.5	-161.7	-57.4	-88.4	0.6	112.3	E251 I263 K266 E267 A268 E269 F273 H274 C275	E251-R271 IonicContact OE1-CZ 3.89Å; E251-R271 IonicContact OE1-NE 2.89Å; E251-R271 PolarHBondContact OE1-NE 2.97Å; E251-R271 IonicContact OE1-NH2 2.69Å; E251-R271 PolarHBondContact OE1-NH2 3.06Å; E251-R271 IonicContact OE2-CZ 3.47Å; E251-R271 IonicContact OE2-NE 2.83Å; E251-R271 PolarHBondContact OE2-NE 3.42Å; E251-R271 IonicContact OE2-NH2 3.28Å; E251-R271 PolarHBondContact OE2-NH2 3.33Å; I263-R271 HydrophobicContact CG2-CB 4.09Å; I263-R271 HydrophobicContact CG2-CG 3.72Å; I263-R271 WeakPolarHBondContact O-CD 3.31Å; I263-R271 WeakPolarHBondContact O-CG 3.37Å; K266-R271 HydrophobicContact CB-CG 4.37Å; K266-R271 PolarHBondContact O-NH1 3.47Å; E267-R271 WeakPolarHBondContact O-CG 3.22Å; E267-R271 PolarHBondContact O-N 3.2Å; E267-R271 VanDerWaalsContact O-N 3.09Å; A268-R271 WeakPolarHBondContact O-CB 3.16Å; A268-R271 PolarHBondContact O-N 2.96Å; A268-R271 VanDerWaalsContact O-N 3.14Å; E269-R271 VanDerWaalsContact C-N 3.31Å; E269-R271 PolarHBondContact O-N 3.37Å; R271-F273 VanDerWaalsContact C-N 3.34Å; R271-H274 WeakPolarHBondContact O-CB 3.43Å; R271-H274 PolarHBondContact O-N 3.38Å; R271-C275 PolarHBondContact O-N 3.2Å; R271-C275 PolarHBondContact O-SG 2.89Å
272	I	90.5	Very high	85.6	Confident	27 Å²	27	47.4 Å²	47.4	14%	0.138	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-47.7	173.4	-67.3	163.4	0	0	0	109.8	L247 A268 E269 H274 C275 C276 F343 L347	L247-I272 HydrophobicContact CD1-CD1 4.35Å; L247-I272 HydrophobicContact CD1-CG1 3.93Å; L247-I272 HydrophobicContact CD2-CD1 3.77Å; L247-I272 HydrophobicContact CD2-CG1 3.91Å; A268-I272 WeakPolarHBondContact O-CG1 3.49Å; A268-I272 PolarHBondContact O-N 3.43Å; E269-I272 PolarHBondContact O-N 3.32Å; I272-H274 VanDerWaalsContact C-N 3.32Å; I272-H274 PolarHBondContact O-N 3.34Å; I272-C275 PolarHBondContact O-N 3.49Å; I272-C276 WeakPolarHBondContact O-CB 3.49Å; I272-C276 PolarHBondContact O-N 3.22Å; I272-F343 HydrophobicContact CD1-CE1 4.3Å; I272-F343 HydrophobicContact CD1-CZ 4.41Å; I272-L347 HydrophobicContact CD1-CD1 3.89Å; I272-L347 HydrophobicContact CD1-CD2 3.81Å
273	F	91.4	Very high	87.2	Confident	17 Å²	17	46.1 Å²	46.1	8%	0.075	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-43.8	177.5	-178.2	-109.3	0	0	0	111.6	E269 R271 C276 Q277 F351 I354 I447 A453 L455	E269-F273 VanDerWaalsContact O-CB 3.29Å; E269-F273 WeakPolarHBondContact O-CB 3.29Å; E269-F273 PolarHBondContact O-N 2.78Å; R271-F273 VanDerWaalsContact C-N 3.34Å; F273-C276 WeakPolarHBondContact O-CB 3.33Å; F273-C276 PolarHBondContact O-N 2.99Å; F273-Q277 HydrophobicContact CE1-CG 4.42Å; F273-Q277 HydrophobicContact CZ-CG 4.43Å; F273-Q277 WeakPolarHBondContact O-CG 3.33Å; F273-Q277 PolarHBondContact O-N 2.94Å; F273-F351 HydrophobicContact CB-CD1 4.23Å; F273-F351 HydrophobicContact CB-CE1 3.81Å; F273-F351 HydrophobicContact CD2-CE1 4.43Å; F273-F351 HydrophobicContact CG-CE1 4.07Å; F273-I354 HydrophobicContact CD2-CD1 4.23Å; F273-I447 HydrophobicContact CD1-CG2 4.34Å; F273-I447 HydrophobicContact CE1-CG2 4.07Å; F273-I447 HydrophobicContact CE2-CD1 4.24Å; F273-I447 HydrophobicContact CE2-CG2 4.36Å; F273-I447 HydrophobicContact CZ-CG2 4.09Å; F273-A453 HydrophobicContact CD1-CB 3.95Å; F273-A453 HydrophobicContact CE1-CB 4.05Å; F273-L455 HydrophobicContact CE1-CD2 4.03Å; F273-L455 HydrophobicContact CZ-CD2 3.75Å
274	H	88.6	Confident	88.5	Confident	53 Å²	53	45.9 Å²	45.9	25%	0.245	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-48.8	174.2	179.2	-82.9	0	0	0	112.3	L258 I263 V270 R271 I272 C276 Q277 C278	L258-H274 PolarHBondContact O-CE1 3.45Å; I263-H274 WeakPolarHBondContact CD1-CE1 3.48Å; I263-H274 VanDerWaalsContact CD1-NE2 3.27Å; I263-H274 WeakPolarHBondContact CD1-NE2 3.22Å; I263-H274 HydrophobicContact CG2-CB 4.26Å; V270-H274 WeakPolarHBondContact O-CB 3.39Å; V270-H274 PolarHBondContact O-N 3.03Å; R271-H274 WeakPolarHBondContact O-CB 3.43Å; R271-H274 PolarHBondContact O-N 3.38Å; I272-H274 VanDerWaalsContact C-N 3.32Å; I272-H274 PolarHBondContact O-N 3.34Å; H274-C276 VanDerWaalsContact C-N 3.28Å; H274-C276 PolarHBondContact O-N 2.83Å; H274-Q277 WeakPolarHBondContact O-CB 3.41Å; H274-Q277 PolarHBondContact O-N 3.28Å; H274-Q277 VanDerWaalsContact O-N 3.09Å; H274-C278 PolarHBondContact CE1-SG 3.11Å; H274-C278 PolarHBondContact O-N 2.92Å; H274-C278 PolarHBondContact O-SG 3.38Å; H274-C278 VanDerWaalsContact O-SG 3.41Å
275	C	88.9	Confident	89.7	Confident	19 Å²	19	41.8 Å²	41.8	13%	0.128	22%	0.223	C	C	.	.	H	α-helix	trans	-60.2	-40.1	178.6	-65.6	0	0	0	0	111.8	R271 I272 Q277 C278 T279	R271-C275 PolarHBondContact O-N 3.2Å; R271-C275 PolarHBondContact O-SG 2.89Å; I272-C275 PolarHBondContact O-N 3.49Å; C275-Q277 VanDerWaalsContact C-N 3.32Å; C275-Q277 PolarHBondContact O-N 2.83Å; C275-C278 WeakPolarHBondContact O-CB 3.39Å; C275-C278 PolarHBondContact O-N 3.04Å; C275-T279 PolarHBondContact O-N 3.44Å; C275-T279 VanDerWaalsContact O-N 3.12Å; C275-T279 PolarHBondContact O-OG1 3.43Å
276	C	91	Very high	90.9	Very high	64 Å²	64	36.5 Å²	36.5	43%	0.432	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-43.5	174.7	-172.1	0	0	0	0	111.4	I272 F273 H274 C278 T279 S280	I272-C276 WeakPolarHBondContact O-CB 3.49Å; I272-C276 PolarHBondContact O-N 3.22Å; F273-C276 WeakPolarHBondContact O-CB 3.33Å; F273-C276 PolarHBondContact O-N 2.99Å; H274-C276 VanDerWaalsContact C-N 3.28Å; H274-C276 PolarHBondContact O-N 2.83Å; C276-C278 PolarHBondContact O-N 2.99Å; C276-T279 PolarHBondContact O-N 3.39Å; C276-S280 PolarHBondContact O-N 2.93Å; C276-S280 PolarHBondContact O-OG 3.13Å; C276-S280 VanDerWaalsContact O-OG 3.06Å
277	Q	91.3	Very high	91.6	Very high	13 Å²	13	32.6 Å²	32.6	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-41.3	176.8	-70.8	-174.1	81.6	0	0	112.3	F273 H274 C275 T279 S280 V281 A454 L459	F273-Q277 HydrophobicContact CE1-CG 4.42Å; F273-Q277 HydrophobicContact CZ-CG 4.43Å; F273-Q277 WeakPolarHBondContact O-CG 3.33Å; F273-Q277 PolarHBondContact O-N 2.94Å; H274-Q277 WeakPolarHBondContact O-CB 3.41Å; H274-Q277 PolarHBondContact O-N 3.28Å; H274-Q277 VanDerWaalsContact O-N 3.09Å; C275-Q277 VanDerWaalsContact C-N 3.32Å; C275-Q277 PolarHBondContact O-N 2.83Å; Q277-T279 PolarHBondContact O-N 2.75Å; Q277-S280 WeakPolarHBondContact O-CB 3.37Å; Q277-S280 PolarHBondContact O-N 3.28Å; Q277-V281 WeakPolarHBondContact O-CG2 3.47Å; Q277-V281 PolarHBondContact O-N 3.15Å; Q277-A454 PolarHBondContact NE2-O 3.44Å; Q277-A454 VanDerWaalsContact NE2-O 3.11Å; Q277-L459 HydrophobicContact CB-CD1 3.7Å; Q277-L459 HydrophobicContact CG-CD1 3.76Å
278	C	89.8	Confident	92.2	Very high	20 Å²	20	27.9 Å²	27.9	14%	0.135	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-47.7	175.5	-63	0	0	0	0	111.6	L258 H274 C275 C276 S280 V281 E282	L258-C278 HydrophobicContact CD1-CB 4.34Å; L258-C278 HydrophobicContact CD2-CB 3.95Å; H274-C278 PolarHBondContact CE1-SG 3.11Å; H274-C278 PolarHBondContact O-N 2.92Å; H274-C278 PolarHBondContact O-SG 3.38Å; H274-C278 VanDerWaalsContact O-SG 3.41Å; C275-C278 WeakPolarHBondContact O-CB 3.39Å; C275-C278 PolarHBondContact O-N 3.04Å; C276-C278 PolarHBondContact O-N 2.99Å; C278-S280 VanDerWaalsContact C-N 3.32Å; C278-S280 PolarHBondContact O-N 3.02Å; C278-V281 PolarHBondContact O-N 3.36Å; C278-E282 PolarHBondContact O-N 3.06Å; C278-E282 VanDerWaalsContact O-N 3.1Å
279	T	91.1	Very high	92.7	Very high	66 Å²	66	30.8 Å²	30.8	41%	0.405	17%	0.166	S	C	.	.	H	α-helix	trans	-64.1	-37.2	176.6	-55.5	0	0	0	0	111.9	C275 C276 Q277 E282 T283	C275-T279 PolarHBondContact O-N 3.44Å; C275-T279 VanDerWaalsContact O-N 3.12Å; C275-T279 PolarHBondContact O-OG1 3.43Å; C276-T279 PolarHBondContact O-N 3.39Å; Q277-T279 PolarHBondContact O-N 2.75Å; T279-E282 PolarHBondContact O-N 2.9Å; T279-T283 WeakPolarHBondContact O-CB 3.33Å; T279-T283 PolarHBondContact O-N 2.94Å; T279-T283 PolarHBondContact O-OG1 2.77Å
280	S	93.3	Very high	93.1	Very high	18 Å²	18	29.5 Å²	29.5	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-41.7	174.3	-62.8	0	0	0	0	112.2	C276 Q277 C278 T283 V284	C276-S280 PolarHBondContact O-N 2.93Å; C276-S280 PolarHBondContact O-OG 3.13Å; C276-S280 VanDerWaalsContact O-OG 3.06Å; Q277-S280 WeakPolarHBondContact O-CB 3.37Å; Q277-S280 PolarHBondContact O-N 3.28Å; C278-S280 VanDerWaalsContact C-N 3.32Å; C278-S280 PolarHBondContact O-N 3.02Å; S280-T283 PolarHBondContact O-N 3.2Å; S280-V284 WeakPolarHBondContact O-CG2 3.31Å; S280-V284 PolarHBondContact O-N 3.12Å
281	V	93.6	Very high	93.6	Very high	10 Å²	10	29 Å²	29	6%	0.061	16%	0.157	C	C	.	.	H	α-helix	trans	-61.8	-47.3	176.7	168.9	0	0	0	0	111.2	Q277 C278 T283 V284 T285 H456 L458 L459	Q277-V281 WeakPolarHBondContact O-CG2 3.47Å; Q277-V281 PolarHBondContact O-N 3.15Å; C278-V281 PolarHBondContact O-N 3.36Å; V281-T283 VanDerWaalsContact C-N 3.29Å; V281-T283 PolarHBondContact O-N 2.96Å; V281-V284 PolarHBondContact O-N 2.84Å; V281-T285 PolarHBondContact O-N 2.94Å; V281-T285 VanDerWaalsContact O-N 3.13Å; V281-T285 PolarHBondContact O-OG1 3.4Å; V281-H456 HydrophobicContact CG2-CB 4.21Å; V281-H456 WeakPolarHBondContact CG2-ND1 3.36Å; V281-L458 HydrophobicContact CG1-CD2 3.98Å; V281-L458 HydrophobicContact CG2-CD2 4.36Å; V281-L459 HydrophobicContact CG2-CD1 4.24Å; V281-L459 HydrophobicContact CG2-CD2 3.93Å; V281-L459 HydrophobicContact CG2-CG 3.89Å
282	E	92.6	Very high	94.1	Very high	64 Å²	64	31 Å²	31	30%	0.299	17%	0.167	S	C	.	.	H	α-helix	trans	-57.1	-45	174.4	-69.2	176	173.3	0	0	111	C278 T279 V284 T285 E286 Y334	C278-E282 PolarHBondContact O-N 3.06Å; C278-E282 VanDerWaalsContact O-N 3.1Å; T279-E282 PolarHBondContact O-N 2.9Å; E282-V284 PolarHBondContact O-N 2.98Å; E282-T285 WeakPolarHBondContact O-CB 3.43Å; E282-T285 PolarHBondContact O-N 3.25Å; E282-E286 WeakPolarHBondContact O-CG 3.41Å; E282-E286 PolarHBondContact O-N 3.25Å; E282-Y334 PolarHBondContact OE2-OH 2.86Å
283	T	94.7	Very high	94.4	Very high	28 Å²	28	31.7 Å²	31.7	17%	0.172	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-35.2	179.4	-49.4	0	0	0	0	112.4	T279 S280 V281 T285 E286 L287 I317 M320	T279-T283 WeakPolarHBondContact O-CB 3.33Å; T279-T283 PolarHBondContact O-N 2.94Å; T279-T283 PolarHBondContact O-OG1 2.77Å; S280-T283 PolarHBondContact O-N 3.2Å; V281-T283 VanDerWaalsContact C-N 3.29Å; V281-T283 PolarHBondContact O-N 2.96Å; T283-T285 VanDerWaalsContact C-N 3.32Å; T283-E286 PolarHBondContact O-N 3.06Å; T283-L287 HydrophobicContact CG2-CD1 4.26Å; T283-L287 WeakPolarHBondContact O-CB 3.44Å; T283-L287 PolarHBondContact O-N 3.43Å; T283-I317 HydrophobicContact CG2-CD1 4.36Å; T283-I317 HydrophobicContact CG2-CG1 3.83Å; T283-M320 HydrophobicContact CG2-CE 4.02Å
284	V	96.3	Very high	94.8	Very high	11 Å²	11	31 Å²	31	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-42.2	174.5	173.2	0	0	0	0	110.5	S280 V281 E282 L287 T288 V313 I317 L458 L459 I462	S280-V284 WeakPolarHBondContact O-CG2 3.31Å; S280-V284 PolarHBondContact O-N 3.12Å; V281-V284 PolarHBondContact O-N 2.84Å; E282-V284 PolarHBondContact O-N 2.98Å; V284-L287 PolarHBondContact O-N 2.94Å; V284-T288 WeakPolarHBondContact O-CB 3.35Å; V284-T288 PolarHBondContact O-N 3.36Å; V284-T288 PolarHBondContact O-OG1 2.85Å; V284-V313 HydrophobicContact CB-CG2 4.2Å; V284-V313 HydrophobicContact CG1-CG2 4.21Å; V284-V313 HydrophobicContact CG2-CG2 3.62Å; V284-I317 HydrophobicContact CG2-CD1 4.29Å; V284-L458 HydrophobicContact CB-CD2 4.32Å; V284-L458 HydrophobicContact CG1-CD2 4.06Å; V284-L459 HydrophobicContact CG2-CD2 4.29Å; V284-I462 HydrophobicContact CG1-CD1 4.06Å; V284-I462 HydrophobicContact CG2-CD1 4.01Å
285	T	95.6	Very high	95.1	Very high	34 Å²	34	29.9 Å²	29.9	21%	0.209	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-46.4	176.9	-53.9	0	0	0	0	111	M31 V281 E282 T283 L287 T288 E289	M31-T285 HydrophobicContact CE-CG2 4.3Å; M31-T285 HydrophobicContact SD-CG2 4.13Å; V281-T285 PolarHBondContact O-N 2.94Å; V281-T285 VanDerWaalsContact O-N 3.13Å; V281-T285 PolarHBondContact O-OG1 3.4Å; E282-T285 WeakPolarHBondContact O-CB 3.43Å; E282-T285 PolarHBondContact O-N 3.25Å; T283-T285 VanDerWaalsContact C-N 3.32Å; T285-L287 PolarHBondContact O-N 3.17Å; T285-T288 WeakPolarHBondContact O-CB 3.47Å; T285-T288 PolarHBondContact O-N 2.98Å; T285-E289 PolarHBondContact O-N 3.03Å
286	E	97	Very high	95.4	Very high	46 Å²	46	30.2 Å²	30.2	22%	0.215	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-43.9	175.4	-67.8	178.7	175.3	0	0	112	F218 E282 T283 T288 E289 F290	F218-E286 HydrophobicContact CD1-CB 3.92Å; F218-E286 WeakPolarHBondContact CD1-OE2 3.25Å; F218-E286 HydrophobicContact CE1-CB 3.76Å; E282-E286 WeakPolarHBondContact O-CG 3.41Å; E282-E286 PolarHBondContact O-N 3.25Å; T283-E286 PolarHBondContact O-N 3.06Å; E286-T288 VanDerWaalsContact C-N 3.32Å; E286-T288 PolarHBondContact O-N 3.36Å; E286-E289 PolarHBondContact O-N 3.14Å; E286-F290 WeakPolarHBondContact O-CB 3.19Å; E286-F290 PolarHBondContact O-N 3.21Å
287	L	97.9	Very high	95.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-62.7	-37.6	175.7	-90.6	165.4	0	0	0	112.7	F218 T283 V284 T285 F290 A291 V313 A316 I317 M320 V379 I383	F218-L287 HydrophobicContact CE1-CD2 4.33Å; F218-L287 HydrophobicContact CE1-CG 4Å; F218-L287 HydrophobicContact CZ-CD2 3.7Å; F218-L287 HydrophobicContact CZ-CG 3.86Å; T283-L287 HydrophobicContact CG2-CD1 4.26Å; T283-L287 WeakPolarHBondContact O-CB 3.44Å; T283-L287 PolarHBondContact O-N 3.43Å; V284-L287 PolarHBondContact O-N 2.94Å; T285-L287 PolarHBondContact O-N 3.17Å; L287-F290 HydrophobicContact CD2-CD1 4.45Å; L287-F290 PolarHBondContact O-N 3.48Å; L287-A291 VanDerWaalsContact O-CB 3.31Å; L287-A291 WeakPolarHBondContact O-CB 3.48Å; L287-A291 PolarHBondContact O-N 3.3Å; L287-V313 HydrophobicContact CD1-CG2 3.72Å; L287-A316 HydrophobicContact CD1-CB 3.91Å; L287-A316 HydrophobicContact CD2-CB 3.71Å; L287-I317 HydrophobicContact CD1-CD1 4.45Å; L287-I317 HydrophobicContact CD1-CG1 3.7Å; L287-M320 HydrophobicContact CD1-CE 3.74Å; L287-M320 HydrophobicContact CD2-CE 3.82Å; L287-M320 HydrophobicContact CG-CE 3.77Å; L287-V379 HydrophobicContact CD2-CG1 3.94Å; L287-I383 HydrophobicContact CD2-CD1 3.91Å
288	T	98	Very high	96.1	Very high	9 Å²	9	29.2 Å²	29.2	6%	0.055	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-44.3	177.2	-61.3	0	0	0	0	110.6	M31 V284 T285 E286 A291 K292 L309	M31-T288 HydrophobicContact CE-CG2 3.85Å; V284-T288 WeakPolarHBondContact O-CB 3.35Å; V284-T288 PolarHBondContact O-N 3.36Å; V284-T288 PolarHBondContact O-OG1 2.85Å; T285-T288 WeakPolarHBondContact O-CB 3.47Å; T285-T288 PolarHBondContact O-N 2.98Å; E286-T288 VanDerWaalsContact C-N 3.32Å; E286-T288 PolarHBondContact O-N 3.36Å; T288-A291 PolarHBondContact O-N 2.83Å; T288-K292 WeakPolarHBondContact O-CG 3.25Å; T288-K292 PolarHBondContact O-N 3.25Å; T288-L309 HydrophobicContact CG2-CD1 3.92Å
289	E	98.3	Very high	96.4	Very high	74 Å²	74	34.7 Å²	34.7	35%	0.346	21%	0.205	S	C	.	.	H	α-helix	trans	-68.6	-37.3	176.8	-67.7	-58.1	121.4	0	0	112.3	N217 T285 E286 K292 A293	N217-E289 WeakPolarHBondContact ND2-CB 3.48Å; T285-E289 PolarHBondContact O-N 3.03Å; E286-E289 PolarHBondContact O-N 3.14Å; E289-K292 IonicContact OE1-NZ 2.82Å; E289-K292 PolarHBondContact OE1-NZ 3.43Å; E289-A293 PolarHBondContact O-N 3.25Å
290	F	98.7	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-48	170.2	169.8	-111.4	0	0	0	111.5	I210 A213 Y214 N217 F218 E286 L287 K292 A293 I294 V379 A380 I383	I210-F290 HydrophobicContact CG2-CE2 4.24Å; I210-F290 HydrophobicContact CG2-CZ 4.04Å; A213-F290 HydrophobicContact CB-CD2 4.02Å; A213-F290 HydrophobicContact CB-CE2 4.15Å; Y214-F290 HydrophobicContact CD2-CE2 4.37Å; N217-F290 HydrophobicContact CB-CB 4.02Å; F218-F290 HydrophobicContact CE2-CB 3.74Å; F218-F290 HydrophobicContact CE2-CD1 4.07Å; F218-F290 HydrophobicContact CE2-CD2 4.12Å; F218-F290 AromaticContact CE2-CG 3.7Å; F218-F290 HydrophobicContact CE2-CG 3.7Å; F218-F290 HydrophobicContact CZ-CB 3.87Å; F218-F290 HydrophobicContact CZ-CD1 4.31Å; F218-F290 HydrophobicContact CZ-CG 4.15Å; E286-F290 WeakPolarHBondContact O-CB 3.19Å; E286-F290 PolarHBondContact O-N 3.21Å; L287-F290 HydrophobicContact CD2-CD1 4.45Å; L287-F290 PolarHBondContact O-N 3.48Å; F290-K292 PolarHBondContact O-N 3.22Å; F290-A293 WeakPolarHBondContact O-CA 3.45Å; F290-A293 WeakPolarHBondContact O-CB 3.44Å; F290-A293 PolarHBondContact O-N 2.87Å; F290-I294 HydrophobicContact CD1-CD1 4.35Å; F290-I294 HydrophobicContact CE1-CD1 3.85Å; F290-I294 HydrophobicContact CE1-CG1 4.26Å; F290-I294 HydrophobicContact CE2-CG1 4.47Å; F290-I294 HydrophobicContact CZ-CD1 4.17Å; F290-I294 HydrophobicContact CZ-CG1 4.17Å; F290-I294 PolarHBondContact O-N 3.44Å; F290-V379 HydrophobicContact CD1-CG1 4.33Å; F290-V379 HydrophobicContact CE1-CB 4.39Å; F290-V379 HydrophobicContact CE1-CG1 3.83Å; F290-A380 HydrophobicContact CE1-CB 4.45Å; F290-A380 HydrophobicContact CZ-CB 4.22Å; F290-I383 HydrophobicContact CD1-CD1 3.9Å; F290-I383 HydrophobicContact CE1-CD1 4.01Å
291	A	98.6	Very high	96.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.7	-46	-179.6	0	0	0	0	0	111.7	L287 T288 A293 I294 F297 L309 I383	L287-A291 VanDerWaalsContact O-CB 3.31Å; L287-A291 WeakPolarHBondContact O-CB 3.48Å; L287-A291 PolarHBondContact O-N 3.3Å; T288-A291 PolarHBondContact O-N 2.83Å; A291-A293 PolarHBondContact O-N 3.41Å; A291-I294 WeakPolarHBondContact O-CB 3.39Å; A291-I294 PolarHBondContact O-N 3.36Å; A291-F297 HydrophobicContact CB-CD1 4.14Å; A291-F297 HydrophobicContact CB-CE1 3.86Å; A291-F297 HydrophobicContact CB-CE2 4.26Å; A291-F297 HydrophobicContact CB-CG 4.46Å; A291-F297 HydrophobicContact CB-CZ 3.93Å; A291-F297 WeakPolarHBondContact O-CB 3.5Å; A291-F297 WeakPolarHBondContact O-CD1 3.27Å; A291-F297 WeakPolarHBondContact O-CG 3.36Å; A291-L309 HydrophobicContact CB-CD2 3.83Å; A291-I383 HydrophobicContact CB-CD1 4.32Å; A291-I383 HydrophobicContact CB-CG2 4.09Å
292	K	98.1	Very high	97.1	Very high	77 Å²	77	37.9 Å²	37.9	34%	0.335	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-28.4	175.2	-70.5	172.1	-173.2	168.6	0	113.2	T288 E289 F290	T288-K292 WeakPolarHBondContact O-CG 3.25Å; T288-K292 PolarHBondContact O-N 3.25Å; E289-K292 IonicContact OE1-NZ 2.82Å; E289-K292 PolarHBondContact OE1-NZ 3.43Å; F290-K292 PolarHBondContact O-N 3.22Å
293	A	98.3	Very high	97.3	Very high	42 Å²	42	39.6 Å²	39.6	35%	0.347	23%	0.228	S	C	.	.	H	α-helix	trans	-83.5	-12.6	177.8	0	0	0	0	0	113.8	A213 E289 F290 A291	A213-A293 HydrophobicContact CB-CB 3.64Å; E289-A293 PolarHBondContact O-N 3.25Å; F290-A293 WeakPolarHBondContact O-CA 3.45Å; F290-A293 WeakPolarHBondContact O-CB 3.44Å; F290-A293 PolarHBondContact O-N 2.87Å; A291-A293 PolarHBondContact O-N 3.41Å
294	I	98.3	Very high	97.4	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.015	22%	0.22	C	C	.	.	S	Bend	trans	-66.4	127.1	173.6	-59.1	171.8	0	0	0	108.9	I210 F290 A291 G296 F297 A380 M400 I404	I210-I294 HydrophobicContact CD1-CG2 4.47Å; I210-I294 HydrophobicContact CG1-CG2 4.49Å; F290-I294 HydrophobicContact CD1-CD1 4.35Å; F290-I294 HydrophobicContact CE1-CD1 3.85Å; F290-I294 HydrophobicContact CE1-CG1 4.26Å; F290-I294 HydrophobicContact CE2-CG1 4.47Å; F290-I294 HydrophobicContact CZ-CD1 4.17Å; F290-I294 HydrophobicContact CZ-CG1 4.17Å; F290-I294 PolarHBondContact O-N 3.44Å; A291-I294 WeakPolarHBondContact O-CB 3.39Å; A291-I294 PolarHBondContact O-N 3.36Å; I294-G296 PolarHBondContact O-N 3.2Å; I294-G296 VanDerWaalsContact O-N 3.11Å; I294-F297 HydrophobicContact CB-CB 4.16Å; I294-F297 WeakPolarHBondContact O-CB 3.07Å; I294-F297 PolarHBondContact O-N 2.84Å; I294-A380 HydrophobicContact CD1-CB 3.74Å; I294-A380 HydrophobicContact CG1-CB 4.36Å; I294-M400 HydrophobicContact CB-CE 4.32Å; I294-M400 HydrophobicContact CG2-CE 3.46Å; I294-M400 VanDerWaalsContact CG2-CE 3.46Å; I294-I404 HydrophobicContact CG2-CD1 4.04Å
295	P	96.7	Very high	97.5	Very high	29 Å²	29	39 Å²	39	19%	0.188	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	118.5	-177.9	-29.2	38.6	0	0	0	113	L206 R209 M400	L206-P295 HydrophobicContact CD1-CB 3.93Å; L206-P295 HydrophobicContact CD1-CG 3.59Å; R209-P295 HydrophobicContact CB-CG 4.27Å; P295-M400 VanDerWaalsContact O-CE 3.22Å; P295-M400 WeakPolarHBondContact O-CE 3.39Å
296	G	95	Very high	97.6	Very high	26 Å²	26	40.2 Å²	40.2	27%	0.268	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	-17	179.6	0	0	0	0	0	115.1	I294 N299	I294-G296 PolarHBondContact O-N 3.2Å; I294-G296 VanDerWaalsContact O-N 3.11Å; G296-N299 PolarHBondContact O-N 3.48Å
297	F	98.3	Very high	97.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-65.4	-48.7	-176.2	-174.1	-89	0	0	0	112.3	A291 I294 N299 L300 Q305 L308 L309 I383 M400	A291-F297 HydrophobicContact CB-CD1 4.14Å; A291-F297 HydrophobicContact CB-CE1 3.86Å; A291-F297 HydrophobicContact CB-CE2 4.26Å; A291-F297 HydrophobicContact CB-CG 4.46Å; A291-F297 HydrophobicContact CB-CZ 3.93Å; A291-F297 WeakPolarHBondContact O-CB 3.5Å; A291-F297 WeakPolarHBondContact O-CD1 3.27Å; A291-F297 WeakPolarHBondContact O-CG 3.36Å; I294-F297 HydrophobicContact CB-CB 4.16Å; I294-F297 WeakPolarHBondContact O-CB 3.07Å; I294-F297 PolarHBondContact O-N 2.84Å; F297-N299 PolarHBondContact O-N 3.2Å; F297-L300 HydrophobicContact CD2-CD1 4.05Å; F297-L300 HydrophobicContact CE2-CD1 4.41Å; F297-L300 VanDerWaalsContact O-CB 3.3Å; F297-L300 WeakPolarHBondContact O-CB 3.2Å; F297-L300 WeakPolarHBondContact O-CG 3.35Å; F297-L300 PolarHBondContact O-N 3.3Å; F297-Q305 HydrophobicContact CD1-CG 4.22Å; F297-Q305 HydrophobicContact CE1-CB 3.89Å; F297-Q305 HydrophobicContact CE1-CG 3.74Å; F297-Q305 HydrophobicContact CZ-CB 3.98Å; F297-Q305 HydrophobicContact CZ-CG 4.09Å; F297-L308 HydrophobicContact CD2-CD1 4.5Å; F297-L308 HydrophobicContact CE2-CB 4.23Å; F297-L308 HydrophobicContact CE2-CD1 3.84Å; F297-L309 HydrophobicContact CZ-CD1 4.37Å; F297-L309 HydrophobicContact CZ-CG 4.2Å; F297-I383 HydrophobicContact CD2-CG2 4.44Å; F297-I383 HydrophobicContact CE2-CG2 3.8Å; F297-I383 HydrophobicContact CZ-CG2 4.44Å; F297-M400 HydrophobicContact CB-CE 3.95Å
298	A	97.3	Very high	97.6	Very high	56 Å²	56	39.1 Å²	39.1	46%	0.463	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-64.3	-11.1	179.9	0	0	0	0	0	113.6	Q305	A298-Q305 PolarHBondContact O-NE2 3.19Å
299	N	96.8	Very high	97.6	Very high	135 Å²	135	39.8 Å²	39.8	72%	0.722	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-93.2	-4.3	176.5	-56	112.8	0	0	0	113.3	G296 F297	G296-N299 PolarHBondContact O-N 3.48Å; F297-N299 PolarHBondContact O-N 3.2Å
300	L	97.7	Very high	97.4	Very high	11 Å²	11	38.6 Å²	38.6	6%	0.058	22%	0.223	C	C	.	.	S	Bend	trans	-72.1	162.7	174.3	-61.8	175.5	0	0	0	111.1	F297 Q305 L308 H396 I397 M400	F297-L300 HydrophobicContact CD2-CD1 4.05Å; F297-L300 HydrophobicContact CE2-CD1 4.41Å; F297-L300 VanDerWaalsContact O-CB 3.3Å; F297-L300 WeakPolarHBondContact O-CB 3.2Å; F297-L300 WeakPolarHBondContact O-CG 3.35Å; F297-L300 PolarHBondContact O-N 3.3Å; L300-Q305 HydrophobicContact CB-CG 3.87Å; L300-Q305 PolarHBondContact O-NE2 3.48Å; L300-L308 HydrophobicContact CD1-CD1 3.69Å; L300-H396 WeakPolarHBondContact CD2-ND1 3.49Å; L300-I397 HydrophobicContact CD1-CG1 4.23Å; L300-I397 HydrophobicContact CD2-CG1 4.03Å; L300-M400 HydrophobicContact CD1-SD 4.44Å
301	D	97.9	Very high	97.3	Very high	63 Å²	63	39.9 Å²	39.9	34%	0.337	23%	0.228	S	C	.	.			trans	-57	142.3	170	-173.7	-95.9	0	0	0	110.5	N303 D304 Q305	D301-N303 VanDerWaalsContact C-N 3.26Å; D301-N303 PolarHBondContact O-N 3.01Å; D301-N303 WeakPolarHBondContact OD1-CB 3.48Å; D301-N303 PolarHBondContact OD1-N 3.02Å; D301-N303 PolarHBondContact OD1-ND2 3.24Å; D301-D304 HydrophobicContact CB-CB 4.14Å; D301-D304 WeakPolarHBondContact O-CB 3.46Å; D301-D304 PolarHBondContact O-N 3.48Å; D301-D304 VanDerWaalsContact O-N 3.1Å; D301-Q305 WeakPolarHBondContact O-CG 3.04Å; D301-Q305 PolarHBondContact O-N 3.23Å
302	L	96.9	Very high	97.2	Very high	86 Å²	86	39.9 Å²	39.9	45%	0.45	23%	0.228	S	C	.	.	H	α-helix	trans	-61	-36.6	-177.2	-174.4	65.2	0	0	0	111.8	Q305 V306	L302-Q305 PolarHBondContact O-N 3.01Å; L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 3.05Å
303	N	96.8	Very high	97.2	Very high	101 Å²	101	36.4 Å²	36.4	54%	0.54	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-38	176.9	-58.2	-70	0	0	0	111.4	D301 V306 T307	D301-N303 VanDerWaalsContact C-N 3.26Å; D301-N303 PolarHBondContact O-N 3.01Å; D301-N303 WeakPolarHBondContact OD1-CB 3.48Å; D301-N303 PolarHBondContact OD1-N 3.02Å; D301-N303 PolarHBondContact OD1-ND2 3.24Å; N303-V306 PolarHBondContact O-N 3.02Å; N303-T307 VanDerWaalsContact O-CB 3.29Å; N303-T307 WeakPolarHBondContact O-CB 3.45Å; N303-T307 PolarHBondContact O-N 3.24Å; N303-T307 PolarHBondContact O-OG1 3.27Å
304	D	98.1	Very high	97.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-44.6	174.2	-74	-25.6	0	0	0	110.3	D301 V306 T307 L308 L391 L392 N393 I397	D301-D304 HydrophobicContact CB-CB 4.14Å; D301-D304 WeakPolarHBondContact O-CB 3.46Å; D301-D304 PolarHBondContact O-N 3.48Å; D301-D304 VanDerWaalsContact O-N 3.1Å; D304-V306 PolarHBondContact O-N 2.74Å; D304-T307 PolarHBondContact O-N 3.11Å; D304-L308 WeakPolarHBondContact O-CB 3.43Å; D304-L308 WeakPolarHBondContact O-CG 3.43Å; D304-L308 PolarHBondContact O-N 3.28Å; D304-L391 HydrophobicContact CB-CD2 4.17Å; D304-L391 WeakPolarHBondContact OD1-CA 3.37Å; D304-L392 PolarHBondContact OD1-N 3.35Å; D304-N393 WeakPolarHBondContact OD2-CB 3.39Å; D304-N393 PolarHBondContact OD2-N 3.4Å; D304-N393 VanDerWaalsContact OD2-N 3.07Å; D304-N393 PolarHBondContact OD2-ND2 3Å; D304-I397 HydrophobicContact CB-CD1 4.07Å
305	Q	98.3	Very high	97.1	Very high	26 Å²	26	34.4 Å²	34.4	12%	0.121	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-47.2	176.5	-68	-178.6	48.1	0	0	112	F297 A298 L300 D301 L302 L309	F297-Q305 HydrophobicContact CD1-CG 4.22Å; F297-Q305 HydrophobicContact CE1-CB 3.89Å; F297-Q305 HydrophobicContact CE1-CG 3.74Å; F297-Q305 HydrophobicContact CZ-CB 3.98Å; F297-Q305 HydrophobicContact CZ-CG 4.09Å; A298-Q305 PolarHBondContact O-NE2 3.19Å; L300-Q305 HydrophobicContact CB-CG 3.87Å; L300-Q305 PolarHBondContact O-NE2 3.48Å; D301-Q305 WeakPolarHBondContact O-CG 3.04Å; D301-Q305 PolarHBondContact O-N 3.23Å; L302-Q305 PolarHBondContact O-N 3.01Å; Q305-L309 PolarHBondContact O-N 2.69Å; Q305-L309 VanDerWaalsContact O-N 3.11Å
306	V	96.6	Very high	97.2	Very high	60 Å²	60	33 Å²	33	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-63	-44.2	177.2	172.2	0	0	0	0	110.9	L302 N303 D304 L309 K310	L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 3.05Å; N303-V306 PolarHBondContact O-N 3.02Å; D304-V306 PolarHBondContact O-N 2.74Å; V306-L309 PolarHBondContact O-N 2.83Å; V306-K310 VanDerWaalsContact O-CB 3.26Å; V306-K310 WeakPolarHBondContact O-CB 3.07Å; V306-K310 PolarHBondContact O-N 3.48Å
307	T	97.1	Very high	97.3	Very high	24 Å²	24	32.5 Å²	32.5	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-44.8	179.8	-60.8	0	0	0	0	111.8	N303 D304 L309 K310 Y311 R388 P389 L391	N303-T307 VanDerWaalsContact O-CB 3.29Å; N303-T307 WeakPolarHBondContact O-CB 3.45Å; N303-T307 PolarHBondContact O-N 3.24Å; N303-T307 PolarHBondContact O-OG1 3.27Å; D304-T307 PolarHBondContact O-N 3.11Å; T307-L309 PolarHBondContact O-N 2.89Å; T307-K310 PolarHBondContact O-N 2.99Å; T307-Y311 HydrophobicContact CG2-CD2 4.09Å; T307-Y311 HydrophobicContact CG2-CE2 4.28Å; T307-Y311 WeakPolarHBondContact O-CD2 3.4Å; T307-Y311 PolarHBondContact O-N 3.22Å; T307-Y311 VanDerWaalsContact O-N 3.16Å; T307-R388 HydrophobicContact CG2-CB 4.11Å; T307-P389 WeakPolarHBondContact CG2-O 3.47Å; T307-L391 HydrophobicContact CG2-CD2 3.71Å; T307-L391 HydrophobicContact CG2-CG 4.18Å
308	L	98.1	Very high	97.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-45.4	177.6	-70.7	174.6	0	0	0	111.6	F297 L300 D304 G312 I383 C385 R388 L391 I397	F297-L308 HydrophobicContact CD2-CD1 4.5Å; F297-L308 HydrophobicContact CE2-CB 4.23Å; F297-L308 HydrophobicContact CE2-CD1 3.84Å; L300-L308 HydrophobicContact CD1-CD1 3.69Å; D304-L308 WeakPolarHBondContact O-CB 3.43Å; D304-L308 WeakPolarHBondContact O-CG 3.43Å; D304-L308 PolarHBondContact O-N 3.28Å; L308-G312 WeakPolarHBondContact O-CA 3.44Å; L308-G312 PolarHBondContact O-N 3.49Å; L308-I383 WeakPolarHBondContact CD2-O 3.41Å; L308-C385 WeakPolarHBondContact CD2-O 3.36Å; L308-R388 HydrophobicContact CD2-CG 3.94Å; L308-L391 HydrophobicContact CD2-CD1 4.14Å; L308-L391 HydrophobicContact CD2-CD2 4.02Å; L308-L391 HydrophobicContact CG-CD2 4.07Å; L308-I397 HydrophobicContact CD1-CD1 4.16Å; L308-I397 HydrophobicContact CD1-CG1 4.38Å; L308-I397 HydrophobicContact CD1-CG2 4.24Å; L308-I397 HydrophobicContact CD2-CD1 4.46Å; L308-I397 HydrophobicContact CD2-CG2 4.02Å
309	L	97.4	Very high	97.4	Very high	23 Å²	23	30.4 Å²	30.4	12%	0.12	16%	0.159	C	C	.	.	H	α-helix	trans	-66.5	-45.8	176.7	-76.3	169.4	0	0	0	111.8	T288 A291 F297 Q305 V306 T307 Y311 G312 V313 I383	T288-L309 HydrophobicContact CG2-CD1 3.92Å; A291-L309 HydrophobicContact CB-CD2 3.83Å; F297-L309 HydrophobicContact CZ-CD1 4.37Å; F297-L309 HydrophobicContact CZ-CG 4.2Å; Q305-L309 PolarHBondContact O-N 2.69Å; Q305-L309 VanDerWaalsContact O-N 3.11Å; V306-L309 PolarHBondContact O-N 2.83Å; T307-L309 PolarHBondContact O-N 2.89Å; L309-Y311 VanDerWaalsContact C-N 3.3Å; L309-Y311 PolarHBondContact O-N 3.49Å; L309-G312 PolarHBondContact O-N 3.46Å; L309-V313 VanDerWaalsContact O-CB 3.22Å; L309-V313 WeakPolarHBondContact O-CB 3.06Å; L309-V313 WeakPolarHBondContact O-CG1 3.43Å; L309-V313 PolarHBondContact O-N 3.45Å; L309-I383 HydrophobicContact CD2-CG2 4.39Å
310	K	95.4	Very high	97.5	Very high	48 Å²	48	25 Å²	25	21%	0.209	13%	0.13	C	C	.	.	H	α-helix	trans	-52	-47.6	179.1	179.6	176.6	-179.8	178.5	0	112.1	V306 T307 I462 R464	V306-K310 VanDerWaalsContact O-CB 3.26Å; V306-K310 WeakPolarHBondContact O-CB 3.07Å; V306-K310 PolarHBondContact O-N 3.48Å; T307-K310 PolarHBondContact O-N 2.99Å; K310-I462 WeakPolarHBondContact CE-O 3.49Å; K310-R464 WeakPolarHBondContact CE-O 3.46Å; K310-R464 PolarHBondContact NZ-O 3.44Å
311	Y	96.1	Very high	97.5	Very high	27 Å²	27	26.2 Å²	26.2	11%	0.106	14%	0.136	C	C	.	.	H	α-helix	trans	-88.9	-21.5	-178.6	-73.3	-80.5	0	0	0	114.4	T307 L309 R388 P389 D465 M466	T307-Y311 HydrophobicContact CG2-CD2 4.09Å; T307-Y311 HydrophobicContact CG2-CE2 4.28Å; T307-Y311 WeakPolarHBondContact O-CD2 3.4Å; T307-Y311 PolarHBondContact O-N 3.22Å; T307-Y311 VanDerWaalsContact O-N 3.16Å; L309-Y311 VanDerWaalsContact C-N 3.3Å; L309-Y311 PolarHBondContact O-N 3.49Å; Y311-R388 HydrophobicContact CD2-CB 4.24Å; Y311-R388 HydrophobicContact CG-CB 4.5Å; Y311-R388 PolarHBondContact O-NH1 3.08Å; Y311-P389 HydrophobicContact CD1-CG 4.49Å; Y311-P389 HydrophobicContact CD2-CG 4.24Å; Y311-P389 HydrophobicContact CE1-CG 3.81Å; Y311-P389 HydrophobicContact CE2-CG 3.52Å; Y311-P389 VanDerWaalsContact OH-CG 3.28Å; Y311-P389 WeakPolarHBondContact OH-CG 3.38Å; Y311-D465 PolarHBondContact OH-O 2.96Å; Y311-M466 HydrophobicContact CD1-CG 4.49Å; Y311-M466 HydrophobicContact CE1-CG 4.37Å
312	G	97.2	Very high	97.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-92	-21.5	-177.3	0	0	0	0	0	114.9	L308 L309 Y314 E315 A316	L308-G312 WeakPolarHBondContact O-CA 3.44Å; L308-G312 PolarHBondContact O-N 3.49Å; L309-G312 PolarHBondContact O-N 3.46Å; G312-Y314 PolarHBondContact O-N 3.36Å; G312-E315 PolarHBondContact O-N 2.99Å; G312-A316 WeakPolarHBondContact O-CB 3.36Å; G312-A316 PolarHBondContact O-N 2.95Å
313	V	96.6	Very high	97.6	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.024	10%	0.1	C	C	.	.	H	α-helix	trans	-62.8	-44.5	-168.5	68.8	0	0	0	0	113.1	V284 L287 L309 A316 I317 I462	V284-V313 HydrophobicContact CB-CG2 4.2Å; V284-V313 HydrophobicContact CG1-CG2 4.21Å; V284-V313 HydrophobicContact CG2-CG2 3.62Å; L287-V313 HydrophobicContact CD1-CG2 3.72Å; L309-V313 VanDerWaalsContact O-CB 3.22Å; L309-V313 WeakPolarHBondContact O-CB 3.06Å; L309-V313 WeakPolarHBondContact O-CG1 3.43Å; L309-V313 PolarHBondContact O-N 3.45Å; V313-A316 PolarHBondContact O-N 3.19Å; V313-I317 HydrophobicContact CG2-CD1 3.96Å; V313-I317 HydrophobicContact CG2-CG1 4.42Å; V313-I317 WeakPolarHBondContact O-CB 3.47Å; V313-I317 VanDerWaalsContact O-CG1 3.25Å; V313-I317 WeakPolarHBondContact O-CG1 3.35Å; V313-I317 PolarHBondContact O-N 2.85Å; V313-I462 HydrophobicContact CG1-CD1 4.25Å; V313-I462 HydrophobicContact CG1-CG2 3.7Å
314	Y	97	Very high	97.6	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.016	8%	0.08	C	C	.	.	H	α-helix	trans	-74.6	-32.3	-178.9	-78	-66.1	0	0	0	113.3	G312 A316 I317 F318 I462 Y463 M466	G312-Y314 PolarHBondContact O-N 3.36Å; Y314-A316 VanDerWaalsContact C-N 3.32Å; Y314-I317 HydrophobicContact CD1-CD1 4.2Å; Y314-I317 HydrophobicContact CE1-CD1 4.33Å; Y314-I317 PolarHBondContact O-N 3.06Å; Y314-F318 HydrophobicContact CD1-CZ 4.26Å; Y314-F318 VanDerWaalsContact O-CD2 3.27Å; Y314-F318 WeakPolarHBondContact O-CD2 3.21Å; Y314-F318 VanDerWaalsContact O-CG 3.31Å; Y314-F318 WeakPolarHBondContact O-CG 3.33Å; Y314-F318 PolarHBondContact O-N 2.94Å; Y314-I462 HydrophobicContact CD2-CG2 3.95Å; Y314-I462 HydrophobicContact CE2-CB 4.45Å; Y314-I462 HydrophobicContact CE2-CG2 3.55Å; Y314-Y463 AromaticContact CD2-CE1 3.98Å; Y314-Y463 HydrophobicContact CD2-CE1 3.98Å; Y314-Y463 VanDerWaalsContact CE1-OH 3.32Å; Y314-Y463 WeakPolarHBondContact CE1-OH 3.43Å; Y314-Y463 HydrophobicContact CE2-CD1 4.03Å; Y314-Y463 AromaticContact CE2-CE1 3.37Å; Y314-Y463 HydrophobicContact CE2-CE1 3.37Å; Y314-Y463 HydrophobicContact CE2-CE2 4.01Å; Y314-Y463 AromaticContact CE2-CZ 3.37Å; Y314-Y463 WeakPolarHBondContact CE2-OH 3.33Å; Y314-Y463 AromaticContact CZ-CE1 3.78Å; Y314-Y463 AromaticContact CZ-CE2 3.77Å; Y314-Y463 AromaticContact CZ-CZ 3.23Å; Y314-Y463 WeakPolarHBondContact OH-CE2 3.46Å; Y314-Y463 PolarHBondContact OH-OH 3.05Å; Y314-M466 HydrophobicContact CD2-SD 4.32Å
315	E	98.4	Very high	97.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.5	-46.3	170.6	-66.7	176.7	-160.6	0	0	109.9	G312 A319 I382 R388 L433 R434 V437	G312-E315 PolarHBondContact O-N 2.99Å; E315-A319 WeakPolarHBondContact O-CB 3.12Å; E315-A319 PolarHBondContact O-N 2.91Å; E315-A319 VanDerWaalsContact O-N 3.09Å; E315-I382 HydrophobicContact CB-CG2 3.53Å; E315-I382 WeakPolarHBondContact OE2-CG2 3.42Å; E315-R388 IonicContact OE1-CZ 3.5Å; E315-R388 IonicContact OE1-NH1 3.46Å; E315-R388 PolarHBondContact OE1-NH1 3.26Å; E315-R388 IonicContact OE1-NH2 2.72Å; E315-R388 PolarHBondContact OE1-NH2 3.26Å; E315-R388 IonicContact OE2-CZ 3.36Å; E315-R388 IonicContact OE2-NH1 3.01Å; E315-R388 IonicContact OE2-NH2 3.32Å; E315-R388 PolarHBondContact OE2-NH2 2.81Å; E315-L433 HydrophobicContact CB-CB 4.3Å; E315-L433 HydrophobicContact CG-CB 4.22Å; E315-R434 VanDerWaalsContact OE1-CG 3.24Å; E315-R434 WeakPolarHBondContact OE1-CG 3.49Å; E315-V437 HydrophobicContact CG-CG2 3.89Å
316	A	98.5	Very high	97.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.3	-45.4	176.9	0	0	0	0	0	112.7	L287 G312 V313 Y314 F318 A319 M320 V379 I382	L287-A316 HydrophobicContact CD1-CB 3.91Å; L287-A316 HydrophobicContact CD2-CB 3.71Å; G312-A316 WeakPolarHBondContact O-CB 3.36Å; G312-A316 PolarHBondContact O-N 2.95Å; V313-A316 PolarHBondContact O-N 3.19Å; Y314-A316 VanDerWaalsContact C-N 3.32Å; A316-F318 PolarHBondContact O-N 2.95Å; A316-A319 PolarHBondContact O-N 2.76Å; A316-M320 WeakPolarHBondContact O-CG 3.48Å; A316-M320 PolarHBondContact O-N 3.45Å; A316-V379 HydrophobicContact CB-CG1 3.8Å; A316-I382 HydrophobicContact CB-CG2 4.42Å
317	I	97.9	Very high	97.6	Very high	14 Å²	14	20 Å²	20	7%	0.072	10%	0.096	C	C	.	.	H	α-helix	trans	-57.2	-49.6	177.2	-73.6	171.5	0	0	0	110.1	T283 V284 L287 V313 Y314 A319 M320 L321	T283-I317 HydrophobicContact CG2-CD1 4.36Å; T283-I317 HydrophobicContact CG2-CG1 3.83Å; V284-I317 HydrophobicContact CG2-CD1 4.29Å; L287-I317 HydrophobicContact CD1-CD1 4.45Å; L287-I317 HydrophobicContact CD1-CG1 3.7Å; V313-I317 HydrophobicContact CG2-CD1 3.96Å; V313-I317 HydrophobicContact CG2-CG1 4.42Å; V313-I317 WeakPolarHBondContact O-CB 3.47Å; V313-I317 VanDerWaalsContact O-CG1 3.25Å; V313-I317 WeakPolarHBondContact O-CG1 3.35Å; V313-I317 PolarHBondContact O-N 2.85Å; Y314-I317 HydrophobicContact CD1-CD1 4.2Å; Y314-I317 HydrophobicContact CE1-CD1 4.33Å; Y314-I317 PolarHBondContact O-N 3.06Å; I317-A319 PolarHBondContact O-N 3.35Å; I317-M320 PolarHBondContact O-N 3.33Å; I317-L321 WeakPolarHBondContact O-CB 3.43Å; I317-L321 PolarHBondContact O-N 3.09Å
318	F	98.6	Very high	97.6	Very high	13 Å²	13	23.1 Å²	23.1	6%	0.057	11%	0.112	C	C	.	.	H	α-helix	trans	-69	-32.8	-177.7	-62.1	-28.4	0	0	0	113.3	Y314 A316 L321 S322 K358 L433 L436 V437 H440	Y314-F318 HydrophobicContact CD1-CZ 4.26Å; Y314-F318 VanDerWaalsContact O-CD2 3.27Å; Y314-F318 WeakPolarHBondContact O-CD2 3.21Å; Y314-F318 VanDerWaalsContact O-CG 3.31Å; Y314-F318 WeakPolarHBondContact O-CG 3.33Å; Y314-F318 PolarHBondContact O-N 2.94Å; A316-F318 PolarHBondContact O-N 2.95Å; F318-L321 HydrophobicContact CD1-CD2 4.39Å; F318-S322 PolarHBondContact O-N 3.02Å; F318-S322 PolarHBondContact O-OG 2.99Å; F318-K358 HydrophobicContact CD1-CG 4.01Å; F318-K358 HydrophobicContact CE1-CG 4.09Å; F318-K358 HydrophobicContact CG-CG 4.44Å; F318-L433 HydrophobicContact CB-CD2 3.63Å; F318-L436 HydrophobicContact CB-CD2 4.09Å; F318-L436 HydrophobicContact CD2-CD2 3.79Å; F318-L436 HydrophobicContact CD2-CG 3.87Å; F318-L436 HydrophobicContact CE2-CG 4.16Å; F318-L436 HydrophobicContact CG-CD2 4.09Å; F318-V437 HydrophobicContact CD2-CG2 3.83Å; F318-V437 HydrophobicContact CE2-CG2 3.76Å; F318-H440 HydrophobicContact CE2-CB 4.13Å; F318-H440 HydrophobicContact CZ-CB 3.99Å; F318-H440 AromaticContact CZ-CD2 3.63Å; F318-H440 AromaticContact CZ-CG 3.72Å
319	A	98.6	Very high	97.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.6	-48.6	170.4	0	0	0	0	0	111.4	E315 A316 I317 S322 F378 I382 L433	E315-A319 WeakPolarHBondContact O-CB 3.12Å; E315-A319 PolarHBondContact O-N 2.91Å; E315-A319 VanDerWaalsContact O-N 3.09Å; A316-A319 PolarHBondContact O-N 2.76Å; I317-A319 PolarHBondContact O-N 3.35Å; A319-S322 WeakPolarHBondContact O-CB 3.43Å; A319-S322 PolarHBondContact O-N 3.46Å; A319-F378 HydrophobicContact CB-CD1 4.23Å; A319-F378 HydrophobicContact CB-CE1 3.98Å; A319-I382 HydrophobicContact CB-CD1 4.4Å; A319-L433 HydrophobicContact CB-CD1 4.13Å
320	M	98.3	Very high	97.6	Very high	20 Å²	20	22.9 Å²	22.9	10%	0.099	11%	0.111	C	C	.	.	H	α-helix	trans	-71.8	-36.4	-179.8	-65.6	-172.2	-59.1	0	0	113	Y214 F218 T283 L287 A316 I317 S322 S323 I375 V379	Y214-M320 HydrophobicContact CE2-SD 3.9Å; F218-M320 HydrophobicContact CD1-CE 4.4Å; F218-M320 HydrophobicContact CD1-SD 4.13Å; F218-M320 HydrophobicContact CD2-SD 4.34Å; F218-M320 HydrophobicContact CE1-CE 3.72Å; F218-M320 HydrophobicContact CE1-SD 3.76Å; F218-M320 HydrophobicContact CE2-SD 3.98Å; F218-M320 HydrophobicContact CG-SD 4.41Å; F218-M320 HydrophobicContact CZ-CE 3.96Å; F218-M320 HydrophobicContact CZ-SD 3.68Å; T283-M320 HydrophobicContact CG2-CE 4.02Å; L287-M320 HydrophobicContact CD1-CE 3.74Å; L287-M320 HydrophobicContact CD2-CE 3.82Å; L287-M320 HydrophobicContact CG-CE 3.77Å; A316-M320 WeakPolarHBondContact O-CG 3.48Å; A316-M320 PolarHBondContact O-N 3.45Å; I317-M320 PolarHBondContact O-N 3.33Å; M320-S322 PolarHBondContact O-N 2.83Å; M320-S323 WeakPolarHBondContact O-CB 3.45Å; M320-S323 PolarHBondContact O-N 3.34Å; M320-S323 PolarHBondContact O-OG 3.37Å; M320-I375 HydrophobicContact CG-CG2 4.48Å; M320-V379 HydrophobicContact CG-CG2 3.93Å; M320-V379 HydrophobicContact SD-CG2 4.45Å
321	L	97.9	Very high	97.7	Very high	38 Å²	38	21 Å²	21	20%	0.199	10%	0.103	C	C	.	.	H	α-helix	trans	-58.6	-31.3	178.2	-168.5	66.4	0	0	0	111.6	I317 F318 S323 V324 M325 M330 M355	I317-L321 WeakPolarHBondContact O-CB 3.43Å; I317-L321 PolarHBondContact O-N 3.09Å; F318-L321 HydrophobicContact CD1-CD2 4.39Å; L321-S323 PolarHBondContact O-N 3.45Å; L321-V324 HydrophobicContact CD1-CG2 3.87Å; L321-V324 HydrophobicContact CG-CG2 4.5Å; L321-V324 WeakPolarHBondContact O-CG2 3.37Å; L321-V324 PolarHBondContact O-N 3.42Å; L321-V324 VanDerWaalsContact O-N 3.14Å; L321-M325 HydrophobicContact CD1-CE 4.4Å; L321-M325 HydrophobicContact CD2-CE 3.61Å; L321-M325 HydrophobicContact CD2-SD 4.48Å; L321-M325 HydrophobicContact CG-CE 3.65Å; L321-M325 HydrophobicContact CG-SD 4.14Å; L321-M325 WeakPolarHBondContact O-CG 3.21Å; L321-M330 HydrophobicContact CD1-CE 3.61Å; L321-M330 HydrophobicContact CG-CE 4.43Å; L321-M355 HydrophobicContact CD2-CE 4.3Å
322	S	98.3	Very high	97.6	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.007	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-57.9	-32.4	175.2	-58.7	0	0	0	0	112.4	F318 A319 M320 V324 M325 F361 A362 N366	F318-S322 PolarHBondContact O-N 3.02Å; F318-S322 PolarHBondContact O-OG 2.99Å; A319-S322 WeakPolarHBondContact O-CB 3.43Å; A319-S322 PolarHBondContact O-N 3.46Å; M320-S322 PolarHBondContact O-N 2.83Å; S322-V324 VanDerWaalsContact C-N 3.28Å; S322-V324 PolarHBondContact O-N 2.85Å; S322-M325 PolarHBondContact O-N 3.04Å; S322-F361 WeakPolarHBondContact OG-CD1 3.41Å; S322-F361 WeakPolarHBondContact OG-CE1 3.46Å; S322-A362 WeakPolarHBondContact OG-CA 3.43Å; S322-N366 PolarHBondContact O-ND2 3.27Å; S322-N366 PolarHBondContact O-OD1 3.2Å
323	S	97.9	Very high	97.3	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.021	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-66.1	-28.1	179.8	-62.1	0	0	0	0	113.6	A225 M320 L321 I375	A225-S323 WeakPolarHBondContact CB-O 3.33Å; M320-S323 WeakPolarHBondContact O-CB 3.45Å; M320-S323 PolarHBondContact O-N 3.34Å; M320-S323 PolarHBondContact O-OG 3.37Å; L321-S323 PolarHBondContact O-N 3.45Å; S323-I375 WeakPolarHBondContact OG-CD1 3.22Å
324	V	97.3	Very high	97	Very high	18 Å²	18	28 Å²	28	11%	0.109	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-96.3	6.9	179.6	-62.9	0	0	0	0	113.3	M220 A225 L321 S322 M330 L331	M220-V324 HydrophobicContact CG-CG1 3.76Å; A225-V324 HydrophobicContact CB-CG1 3.88Å; L321-V324 HydrophobicContact CD1-CG2 3.87Å; L321-V324 HydrophobicContact CG-CG2 4.5Å; L321-V324 WeakPolarHBondContact O-CG2 3.37Å; L321-V324 PolarHBondContact O-N 3.42Å; L321-V324 VanDerWaalsContact O-N 3.14Å; S322-V324 VanDerWaalsContact C-N 3.28Å; S322-V324 PolarHBondContact O-N 2.85Å; V324-M330 WeakPolarHBondContact O-CA 3.22Å; V324-L331 HydrophobicContact CB-CB 4.16Å; V324-L331 PolarHBondContact O-N 3.39Å
325	M	98.3	Very high	96.7	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-108.3	147.4	-178.1	-74.2	175.3	164.5	0	0	112.7	R226 L321 S322 M330 M355 K358 F359 A362 M363	R226-M325 PolarHBondContact NH1-O 2.7Å; L321-M325 HydrophobicContact CD1-CE 4.4Å; L321-M325 HydrophobicContact CD2-CE 3.61Å; L321-M325 HydrophobicContact CD2-SD 4.48Å; L321-M325 HydrophobicContact CG-CE 3.65Å; L321-M325 HydrophobicContact CG-SD 4.14Å; L321-M325 WeakPolarHBondContact O-CG 3.21Å; S322-M325 PolarHBondContact O-N 3.04Å; M325-M330 HydrophobicContact CE-CB 4.15Å; M325-M330 HydrophobicContact CE-CE 4.15Å; M325-M330 HydrophobicContact CE-CG 4.48Å; M325-M330 HydrophobicContact CE-SD 3.6Å; M325-M330 VanDerWaalsContact CE-SD 3.6Å; M325-M330 HydrophobicContact CG-CB 3.65Å; M325-M355 HydrophobicContact CE-CE 3.41Å; M325-M355 VanDerWaalsContact CE-CE 3.41Å; M325-K358 HydrophobicContact CE-CB 4.46Å; M325-F359 HydrophobicContact CE-CD1 4.46Å; M325-F359 HydrophobicContact CE-CE1 4.23Å; M325-F359 HydrophobicContact CE-CZ 4.29Å; M325-F359 HydrophobicContact CG-CD1 4.4Å; M325-F359 HydrophobicContact CG-CE1 4.11Å; M325-F359 HydrophobicContact SD-CD1 4.2Å; M325-F359 HydrophobicContact SD-CE1 4.31Å; M325-A362 HydrophobicContact CB-CB 4Å; M325-A362 HydrophobicContact CG-CB 4.42Å; M325-A362 HydrophobicContact SD-CB 3.6Å; M325-M363 HydrophobicContact CB-CE 4.28Å
326	N	97.1	Very high	96.4	Very high	39 Å²	39	33 Å²	33	21%	0.209	17%	0.168	C	C	.	.			trans	-129.4	-174.5	160.4	71	16	0	0	0	109.4	D328 G329 M363	N326-D328 PolarHBondContact O-N 3.25Å; N326-D328 WeakPolarHBondContact OD1-CA 3.5Å; N326-D328 PolarHBondContact OD1-N 3.18Å; N326-G329 PolarHBondContact N-O 3Å; N326-G329 PolarHBondContact OD1-N 3.12Å; N326-G329 PolarHBondContact OD1-O 3.25Å; N326-M363 VanDerWaalsContact O-CE 3.25Å; N326-M363 WeakPolarHBondContact O-CE 3.46Å
327	K	97.4	Very high	96.2	Very high	143 Å²	143	33 Å²	33	62%	0.622	17%	0.168	S	C	*	.	S	Bend	trans	-63.8	-24.5	-178.1	67.8	176	-173.6	174.4	0	113.5	R341 M363	K327-R341 WeakPolarHBondContact O-CD 3.24Å; K327-M363 HydrophobicContact CB-SD 4Å
328	D	97.8	Very high	96.2	Very high	89 Å²	89	33.5 Å²	33.5	48%	0.476	17%	0.169	S	C	.	.	S	Bend	trans	-100.8	-16.3	-169.1	-56.5	-55.5	0	0	0	112.6	N326 F338 T340 R341	N326-D328 PolarHBondContact O-N 3.25Å; N326-D328 WeakPolarHBondContact OD1-CA 3.5Å; N326-D328 PolarHBondContact OD1-N 3.18Å; D328-F338 HydrophobicContact CB-CZ 4.46Å; D328-T340 WeakPolarHBondContact O-CA 3.39Å; D328-R341 PolarHBondContact O-N 3.45Å
329	G	98.1	Very high	96.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-164	-177.4	0	0	0	0	0	113.9	N326 I339	N326-G329 PolarHBondContact N-O 3Å; N326-G329 PolarHBondContact OD1-N 3.12Å; N326-G329 PolarHBondContact OD1-O 3.25Å; G329-I339 CarbonylContact C-O 3.58Å; G329-I339 WeakPolarHBondContact CA-O 3.45Å
330	M	97.9	Very high	96.1	Very high	19 Å²	19	34.7 Å²	34.7	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	149.3	-175.2	68	178.4	-75.4	0	0	112.5	L321 V324 M325 V332 F338 I339 M355 F359	L321-M330 HydrophobicContact CD1-CE 3.61Å; L321-M330 HydrophobicContact CG-CE 4.43Å; V324-M330 WeakPolarHBondContact O-CA 3.22Å; M325-M330 HydrophobicContact CE-CB 4.15Å; M325-M330 HydrophobicContact CE-CE 4.15Å; M325-M330 HydrophobicContact CE-CG 4.48Å; M325-M330 HydrophobicContact CE-SD 3.6Å; M325-M330 VanDerWaalsContact CE-SD 3.6Å; M325-M330 HydrophobicContact CG-CB 3.65Å; M330-V332 HydrophobicContact CE-CG1 4.23Å; M330-V332 HydrophobicContact CG-CG1 4.38Å; M330-F338 CarbonylContact O-C 3.37Å; M330-F338 WeakPolarHBondContact O-CA 3.18Å; M330-I339 HydrophobicContact CG-CG2 3.35Å; M330-I339 PolarHBondContact N-O 3.46Å; M330-I339 PolarHBondContact O-N 3.4Å; M330-I339 HydrophobicContact SD-CG2 4.16Å; M330-M355 HydrophobicContact CE-CE 4.42Å; M330-M355 HydrophobicContact SD-CE 3.45Å; M330-M355 WeakPolarHBondContact SD-CE 3.36Å; M330-F359 HydrophobicContact CB-CE1 4.33Å; M330-F359 HydrophobicContact CB-CZ 4.24Å; M330-F359 HydrophobicContact CG-CZ 4.26Å; M330-F359 HydrophobicContact SD-CZ 4.47Å
331	L	96.8	Very high	96.1	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	144.7	170.8	-62	170.9	0	0	0	111	A225 I228 L229 P238 V324 G337 F338	A225-L331 HydrophobicContact CB-CD1 4.02Å; I228-L331 HydrophobicContact CB-CD1 4.09Å; I228-L331 HydrophobicContact CD1-CD1 4.27Å; I228-L331 HydrophobicContact CG2-CD1 4.11Å; I228-L331 HydrophobicContact CG2-CD2 3.65Å; L229-L331 HydrophobicContact CD1-CD1 4.42Å; L229-L331 HydrophobicContact CD2-CD1 4.29Å; L229-L331 HydrophobicContact CD2-CD2 4.02Å; L229-L331 HydrophobicContact CD2-CG 3.86Å; L229-L331 HydrophobicContact CG-CD1 3.96Å; L229-L331 HydrophobicContact CG-CD2 4.49Å; L229-L331 HydrophobicContact CG-CG 4.1Å; P238-L331 HydrophobicContact CB-CD2 4.28Å; P238-L331 HydrophobicContact CG-CD2 4.21Å; V324-L331 HydrophobicContact CB-CB 4.16Å; V324-L331 PolarHBondContact O-N 3.39Å; L331-G337 CarbonylContact C-O 3.58Å; L331-G337 WeakPolarHBondContact CA-O 3.18Å; L331-F338 HydrophobicContact CD2-CB 4.47Å; L331-F338 HydrophobicContact CD2-CD2 4.07Å
332	V	94.3	Very high	96.1	Very high	43 Å²	43	39.7 Å²	39.7	26%	0.261	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	168.1	176.6	-64	0	0	0	0	110.2	I241 M330 Y334 G335 N336 G337 I339	I241-V332 HydrophobicContact CD1-CG2 4.22Å; M330-V332 HydrophobicContact CE-CG1 4.23Å; M330-V332 HydrophobicContact CG-CG1 4.38Å; V332-Y334 PolarHBondContact O-N 2.85Å; V332-G335 PolarHBondContact O-N 3.08Å; V332-G335 VanDerWaalsContact O-N 3.08Å; V332-N336 PolarHBondContact O-N 3.34Å; V332-G337 PolarHBondContact N-O 3.34Å; V332-G337 PolarHBondContact O-N 3.08Å; V332-G337 VanDerWaalsContact O-N 3.08Å; V332-I339 HydrophobicContact CG1-CB 4.43Å; V332-I339 HydrophobicContact CG1-CG2 3.68Å
333	A	90.7	Very high	96.1	Very high	22 Å²	22	40 Å²	40	18%	0.182	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	49.7	53.9	177.2	0	0	0	0	0	112.7	L254 V255 G335 N336	L254-A333 HydrophobicContact CB-CB 4.34Å; L254-A333 HydrophobicContact CD2-CB 4.28Å; V255-A333 HydrophobicContact CG1-CB 4.22Å; A333-G335 VanDerWaalsContact C-N 3.26Å; A333-G335 PolarHBondContact O-N 3.17Å; A333-N336 WeakPolarHBondContact O-CB 3.46Å; A333-N336 PolarHBondContact O-N 3.27Å; A333-N336 VanDerWaalsContact O-N 3.17Å; A333-N336 PolarHBondContact O-ND2 2.79Å
334	Y	89.2	Confident	96.1	Very high	112 Å²	112	40.5 Å²	40.5	44%	0.439	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	56.6	36.2	-179.2	-53.3	-82.5	0	0	0	114.1	N219 M220 E282 V332 N336	N219-Y334 HydrophobicContact CB-CD1 4.41Å; M220-Y334 WeakPolarHBondContact CE-O 3.44Å; E282-Y334 PolarHBondContact OE2-OH 2.86Å; V332-Y334 PolarHBondContact O-N 2.85Å; Y334-N336 VanDerWaalsContact C-N 3.3Å; Y334-N336 PolarHBondContact O-N 2.86Å
335	G	91.8	Very high	96.1	Very high	8 Å²	8	43.6 Å²	43.6	8%	0.082	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	84.7	0.6	177	0	0	0	0	0	114.4	V332 A333	V332-G335 PolarHBondContact O-N 3.08Å; V332-G335 VanDerWaalsContact O-N 3.08Å; A333-G335 VanDerWaalsContact C-N 3.26Å; A333-G335 PolarHBondContact O-N 3.17Å
336	N	92.4	Very high	96	Very high	102 Å²	102	47.4 Å²	47.4	55%	0.545	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-18.1	178.2	-62.8	-61.9	0	0	0	113	P238 F239 L254 V332 A333 Y334	P238-N336 CarbonylContact C-O 3.58Å; P238-N336 WeakPolarHBondContact CA-O 3.43Å; F239-N336 PolarHBondContact N-O 3.22Å; L254-N336 HydrophobicContact CD2-CB 4.39Å; V332-N336 PolarHBondContact O-N 3.34Å; A333-N336 WeakPolarHBondContact O-CB 3.46Å; A333-N336 PolarHBondContact O-N 3.27Å; A333-N336 VanDerWaalsContact O-N 3.17Å; A333-N336 PolarHBondContact O-ND2 2.79Å; Y334-N336 VanDerWaalsContact C-N 3.3Å; Y334-N336 PolarHBondContact O-N 2.86Å
337	G	94.6	Very high	95.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.5	175.3	0	0	0	0	0	112.3	F239 L331 V332	F239-G337 CarbonylContact O-C 3.6Å; F239-G337 VanDerWaalsContact O-CA 3.26Å; F239-G337 WeakPolarHBondContact O-CA 3.42Å; L331-G337 CarbonylContact C-O 3.58Å; L331-G337 WeakPolarHBondContact CA-O 3.18Å; V332-G337 PolarHBondContact N-O 3.34Å; V332-G337 PolarHBondContact O-N 3.08Å; V332-G337 VanDerWaalsContact O-N 3.08Å
338	F	96.8	Very high	95.7	Very high	24 Å²	24	44.1 Å²	44.1	11%	0.105	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	111.8	172.4	-178.8	-90.1	0	0	0	109.3	L229 P238 F239 V240 I241 D328 M330 L331 T340	L229-F338 HydrophobicContact CD2-CD2 3.86Å; L229-F338 HydrophobicContact CD2-CE2 3.59Å; P238-F338 HydrophobicContact CB-CB 4.01Å; P238-F338 HydrophobicContact CG-CB 3.98Å; F239-F338 PolarHBondContact O-N 2.88Å; V240-F338 CarbonylContact C-O 3.52Å; V240-F338 WeakPolarHBondContact CA-O 3.33Å; V240-F338 HydrophobicContact CG1-CD1 4.35Å; I241-F338 PolarHBondContact N-O 2.87Å; D328-F338 HydrophobicContact CB-CZ 4.46Å; M330-F338 CarbonylContact O-C 3.37Å; M330-F338 WeakPolarHBondContact O-CA 3.18Å; L331-F338 HydrophobicContact CD2-CB 4.47Å; L331-F338 HydrophobicContact CD2-CD2 4.07Å; F338-T340 HydrophobicContact CD1-CG2 4.37Å; F338-T340 HydrophobicContact CE1-CG2 4.18Å
339	I	97.4	Very high	95.4	Very high	13 Å²	13	46.7 Å²	46.7	7%	0.067	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128	176.8	-169.8	165.9	0	0	0	110	I241 G329 M330 V332 F343 L344	I241-I339 HydrophobicContact CB-CB 4.22Å; I241-I339 HydrophobicContact CB-CG1 4.12Å; I241-I339 HydrophobicContact CG2-CD1 4.23Å; I241-I339 HydrophobicContact CG2-CG1 4.11Å; I241-I339 WeakPolarHBondContact O-CA 3.44Å; G329-I339 CarbonylContact C-O 3.58Å; G329-I339 WeakPolarHBondContact CA-O 3.45Å; M330-I339 HydrophobicContact CG-CG2 3.35Å; M330-I339 PolarHBondContact N-O 3.46Å; M330-I339 PolarHBondContact O-N 3.4Å; M330-I339 HydrophobicContact SD-CG2 4.16Å; V332-I339 HydrophobicContact CG1-CB 4.43Å; V332-I339 HydrophobicContact CG1-CG2 3.68Å; I339-F343 HydrophobicContact CD1-CD1 3.95Å; I339-F343 HydrophobicContact CD1-CE1 4.16Å; I339-F343 HydrophobicContact CG1-CD1 3.92Å; I339-L344 HydrophobicContact CD1-CD1 4.39Å; I339-L344 HydrophobicContact CD1-CD2 3.65Å; I339-L344 HydrophobicContact CD1-CG 3.94Å; I339-L344 HydrophobicContact CG1-CD1 4.3Å; I339-L344 HydrophobicContact CG1-CD2 4.33Å; I339-L344 HydrophobicContact CG1-CG 4.04Å; I339-L344 HydrophobicContact CG2-CD1 4.07Å
340	T	98.4	Very high	95.2	Very high	26 Å²	26	47.2 Å²	47.2	16%	0.16	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.5	-177.1	65.5	0	0	0	0	111.4	V240 I241 H242 D328 F338 E342 F343 L344	V240-T340 HydrophobicContact CG1-CG2 3.94Å; I241-T340 PolarHBondContact O-N 2.88Å; I241-T340 PolarHBondContact O-OG1 3.31Å; H242-T340 HydrophobicContact CB-CG2 3.78Å; D328-T340 WeakPolarHBondContact O-CA 3.39Å; F338-T340 HydrophobicContact CD1-CG2 4.37Å; F338-T340 HydrophobicContact CE1-CG2 4.18Å; T340-E342 VanDerWaalsContact C-N 3.28Å; T340-E342 PolarHBondContact O-N 3.02Å; T340-F343 PolarHBondContact O-N 2.85Å; T340-F343 WeakPolarHBondContact OG1-CB 3.34Å; T340-F343 PolarHBondContact OG1-N 2.77Å; T340-L344 PolarHBondContact O-N 3.45Å
341	R	98.3	Very high	95	Very high	38 Å²	38	46.7 Å²	46.7	14%	0.143	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-41.4	175.3	179.4	176.5	-178.8	170.1	2.8	111	K327 D328 F343 L344 K345 E356 F359 D360	K327-R341 WeakPolarHBondContact O-CD 3.24Å; D328-R341 PolarHBondContact O-N 3.45Å; R341-F343 PolarHBondContact O-N 3.05Å; R341-L344 PolarHBondContact O-N 3.3Å; R341-K345 HydrophobicContact CG-CD 4.07Å; R341-K345 WeakPolarHBondContact O-CG 3.48Å; R341-K345 PolarHBondContact O-N 3.41Å; R341-E356 IonicContact CZ-OE1 2.73Å; R341-E356 IonicContact CZ-OE2 4Å; R341-E356 IonicContact NE-OE1 3.07Å; R341-E356 PolarHBondContact NE-OE1 2.84Å; R341-E356 IonicContact NE-OE2 3.28Å; R341-E356 PolarHBondContact NE-OE2 3.34Å; R341-E356 IonicContact NH2-OE1 2.76Å; R341-E356 PolarHBondContact NH2-OE1 2.89Å; R341-E356 IonicContact NH2-OE2 3.82Å; R341-E356 PolarHBondContact NH2-OE2 3.21Å; R341-F359 HydrophobicContact CB-CD2 4.4Å; R341-F359 HydrophobicContact CB-CE1 4.17Å; R341-F359 HydrophobicContact CB-CE2 4.03Å; R341-F359 HydrophobicContact CB-CZ 3.92Å; R341-F359 HydrophobicContact CG-CD1 4.36Å; R341-F359 HydrophobicContact CG-CD2 3.79Å; R341-F359 HydrophobicContact CG-CE1 4.44Å; R341-F359 HydrophobicContact CG-CE2 3.88Å; R341-F359 HydrophobicContact CG-CG 4.06Å; R341-F359 HydrophobicContact CG-CZ 4.22Å; R341-D360 IonicContact CZ-OD1 3.67Å; R341-D360 IonicContact NH2-OD1 2.79Å; R341-D360 PolarHBondContact NH2-OD1 3.44Å
342	E	98.2	Very high	94.9	Very high	125 Å²	125	47.1 Å²	47.1	58%	0.584	23%	0.233	S	C	*	.	H	α-helix	trans	-66.9	-37.1	-177.8	-164.4	60.3	-161	0	0	112.3	T340 K345 S346	T340-E342 VanDerWaalsContact C-N 3.28Å; T340-E342 PolarHBondContact O-N 3.02Å; E342-K345 PolarHBondContact O-N 3Å; E342-K345 IonicContact OE1-NZ 3.49Å; E342-K345 IonicContact OE2-NZ 2.75Å; E342-K345 PolarHBondContact OE2-NZ 2.79Å; E342-S346 PolarHBondContact O-N 2.8Å; E342-S346 VanDerWaalsContact O-N 3.08Å
343	F	97.8	Very high	94.9	Very high	7 Å²	7	48.4 Å²	48.4	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-46.6	172.7	176.6	-125.6	0	0	0	112.1	I241 H242 D243 M244 L247 I272 I339 T340 R341 K345 S346 L347	I241-F343 HydrophobicContact CG2-CD1 3.99Å; I241-F343 HydrophobicContact CG2-CE1 3.8Å; H242-F343 WeakPolarHBondContact O-CB 3.34Å; H242-F343 WeakPolarHBondContact O-CD2 3.48Å; D243-F343 VanDerWaalsContact C-CE2 3.47Å; D243-F343 VanDerWaalsContact CA-CE2 3.49Å; M244-F343 HydrophobicContact CE-CE2 4.23Å; M244-F343 HydrophobicContact CE-CZ 4.36Å; M244-F343 HydrophobicContact SD-CE2 4.25Å; M244-F343 HydrophobicContact SD-CZ 4.08Å; L247-F343 HydrophobicContact CB-CE1 4.34Å; L247-F343 HydrophobicContact CB-CZ 4.22Å; L247-F343 HydrophobicContact CD2-CE1 4.5Å; L247-F343 HydrophobicContact CD2-CZ 4.14Å; I272-F343 HydrophobicContact CD1-CE1 4.3Å; I272-F343 HydrophobicContact CD1-CZ 4.41Å; I339-F343 HydrophobicContact CD1-CD1 3.95Å; I339-F343 HydrophobicContact CD1-CE1 4.16Å; I339-F343 HydrophobicContact CG1-CD1 3.92Å; T340-F343 PolarHBondContact O-N 2.85Å; T340-F343 WeakPolarHBondContact OG1-CB 3.34Å; T340-F343 PolarHBondContact OG1-N 2.77Å; R341-F343 PolarHBondContact O-N 3.05Å; F343-K345 VanDerWaalsContact C-N 3.26Å; F343-K345 PolarHBondContact O-N 3.05Å; F343-S346 WeakPolarHBondContact O-CB 3.19Å; F343-S346 PolarHBondContact O-N 3.2Å; F343-S346 PolarHBondContact O-OG 3.16Å; F343-L347 HydrophobicContact CE2-CD2 4.23Å; F343-L347 HydrophobicContact CZ-CD2 4.15Å
344	L	97.4	Very high	95.1	Very high	13 Å²	13	48.2 Å²	48.2	7%	0.068	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-38	176.9	-73.6	169.1	0	0	0	112.2	I339 T340 R341 S346 L347 C352 M355 F359	I339-L344 HydrophobicContact CD1-CD1 4.39Å; I339-L344 HydrophobicContact CD1-CD2 3.65Å; I339-L344 HydrophobicContact CD1-CG 3.94Å; I339-L344 HydrophobicContact CG1-CD1 4.3Å; I339-L344 HydrophobicContact CG1-CD2 4.33Å; I339-L344 HydrophobicContact CG1-CG 4.04Å; I339-L344 HydrophobicContact CG2-CD1 4.07Å; T340-L344 PolarHBondContact O-N 3.45Å; R341-L344 PolarHBondContact O-N 3.3Å; L344-S346 VanDerWaalsContact C-N 3.28Å; L344-S346 PolarHBondContact O-N 3.21Å; L344-L347 HydrophobicContact CD2-CD1 4.11Å; L344-L347 WeakPolarHBondContact O-CG 3.4Å; L344-L347 PolarHBondContact O-N 3.49Å; L344-C352 WeakPolarHBondContact O-CA 3.31Å; L344-M355 HydrophobicContact CD1-CB 4.23Å; L344-M355 HydrophobicContact CD1-CG 4.13Å; L344-M355 HydrophobicContact CD2-CG 4.48Å; L344-F359 HydrophobicContact CD1-CE2 3.85Å; L344-F359 HydrophobicContact CD1-CZ 4.17Å
345	K	96.8	Very high	95.5	Very high	83 Å²	83	44.2 Å²	44.2	36%	0.361	22%	0.219	S	C	.	.	H	α-helix	trans	-69	-23.6	174.9	-72.1	169.8	61.9	-151.8	0	113.8	R341 E342 F343 L347 C352 E356	R341-K345 HydrophobicContact CG-CD 4.07Å; R341-K345 WeakPolarHBondContact O-CG 3.48Å; R341-K345 PolarHBondContact O-N 3.41Å; E342-K345 PolarHBondContact O-N 3Å; E342-K345 IonicContact OE1-NZ 3.49Å; E342-K345 IonicContact OE2-NZ 2.75Å; E342-K345 PolarHBondContact OE2-NZ 2.79Å; F343-K345 VanDerWaalsContact C-N 3.26Å; F343-K345 PolarHBondContact O-N 3.05Å; K345-L347 VanDerWaalsContact C-N 3.32Å; K345-C352 VanDerWaalsContact O-CB 3.26Å; K345-C352 WeakPolarHBondContact O-CB 3.26Å; K345-E356 WeakPolarHBondContact CD-OE2 3.46Å
346	S	96.5	Very high	95.7	Very high	81 Å²	81	46.3 Å²	46.3	57%	0.566	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.5	-179.6	76.7	0	0	0	0	114.2	E342 F343 L344	E342-S346 PolarHBondContact O-N 2.8Å; E342-S346 VanDerWaalsContact O-N 3.08Å; F343-S346 WeakPolarHBondContact O-CB 3.19Å; F343-S346 PolarHBondContact O-N 3.2Å; F343-S346 PolarHBondContact O-OG 3.16Å; L344-S346 VanDerWaalsContact C-N 3.28Å; L344-S346 PolarHBondContact O-N 3.21Å
347	L	94.1	Very high	96	Very high	12 Å²	12	43.4 Å²	43.4	6%	0.063	21%	0.214	C	C	.	.	S	Bend	trans	-64.8	157.4	-179.9	-61.2	179.6	0	0	0	112.2	M244 E269 I272 F343 L344 K345 F351 C352	M244-L347 HydrophobicContact CE-CD2 3.93Å; E269-L347 HydrophobicContact CG-CB 4.09Å; E269-L347 HydrophobicContact CG-CD2 4.27Å; I272-L347 HydrophobicContact CD1-CD1 3.89Å; I272-L347 HydrophobicContact CD1-CD2 3.81Å; F343-L347 HydrophobicContact CE2-CD2 4.23Å; F343-L347 HydrophobicContact CZ-CD2 4.15Å; L344-L347 HydrophobicContact CD2-CD1 4.11Å; L344-L347 WeakPolarHBondContact O-CG 3.4Å; L344-L347 PolarHBondContact O-N 3.49Å; K345-L347 VanDerWaalsContact C-N 3.32Å; L347-F351 HydrophobicContact CB-CB 4.21Å; L347-F351 HydrophobicContact CD1-CB 4.44Å; L347-C352 HydrophobicContact CB-CB 4.49Å; L347-C352 VanDerWaalsContact O-CB 3.28Å; L347-C352 WeakPolarHBondContact O-CB 3.42Å
348	R	93.8	Very high	96.2	Very high	102 Å²	102	43.7 Å²	43.7	39%	0.385	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-61.3	142.4	176.2	-172.9	179.6	58.3	77.5	-14	111.3	E267 E269 F351	E267-R348 IonicContact OE2-CZ 3.48Å; E267-R348 IonicContact OE2-NE 3.69Å; E267-R348 PolarHBondContact OE2-NE 3.23Å; E267-R348 IonicContact OE2-NH2 3.59Å; E267-R348 PolarHBondContact OE2-NH2 3.4Å; E269-R348 HydrophobicContact CG-CB 4.17Å; E269-R348 WeakPolarHBondContact OE1-CB 3.43Å; E269-R348 PolarHBondContact OE1-N 2.99Å; R348-F351 WeakPolarHBondContact O-CB 3.41Å; R348-F351 WeakPolarHBondContact O-CD2 3.34Å; R348-F351 PolarHBondContact O-N 3.36Å
349	K	93	Very high	96.3	Very high	143 Å²	143	42.6 Å²	42.6	62%	0.622	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	141.1	168.4	-81.3	-171.6	166.3	-171.5	0	111.6	C352	K349-C352 WeakPolarHBondContact CG-SG 3.33Å
350	P	93	Very high	96.3	Very high	10 Å²	10	45.4 Å²	45.4	7%	0.065	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.1	8.1	4.4	35.3	-37.4	0	0	0	115.3	C352 D353 L443 I446 I447	P350-C352 PolarHBondContact O-N 3.07Å; P350-D353 PolarHBondContact O-N 3.34Å; P350-L443 HydrophobicContact CB-CD1 3.96Å; P350-I446 HydrophobicContact CB-CG2 4.29Å; P350-I446 HydrophobicContact CG-CG2 4.15Å; P350-I447 HydrophobicContact CB-CG1 4.46Å; P350-I447 HydrophobicContact CG-CG1 3.63Å
351	F	93.6	Very high	96.4	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.035	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-70.2	-32.7	-171.3	-62.1	-86.5	0	0	0	114.8	E269 V270 F273 L347 R348 D353 I354 I447	E269-F351 HydrophobicContact CB-CB 4.21Å; E269-F351 HydrophobicContact CB-CD1 4.11Å; E269-F351 HydrophobicContact CB-CD2 3.42Å; E269-F351 VanDerWaalsContact CB-CD2 3.42Å; E269-F351 HydrophobicContact CB-CE1 4.33Å; E269-F351 HydrophobicContact CB-CE2 3.68Å; E269-F351 HydrophobicContact CB-CG 3.66Å; E269-F351 HydrophobicContact CB-CZ 4.13Å; E269-F351 HydrophobicContact CG-CB 4.3Å; E269-F351 HydrophobicContact CG-CD2 3.89Å; E269-F351 HydrophobicContact CG-CE2 4.49Å; E269-F351 HydrophobicContact CG-CG 4.19Å; V270-F351 HydrophobicContact CG2-CZ 4.08Å; F273-F351 HydrophobicContact CB-CD1 4.23Å; F273-F351 HydrophobicContact CB-CE1 3.81Å; F273-F351 HydrophobicContact CD2-CE1 4.43Å; F273-F351 HydrophobicContact CG-CE1 4.07Å; L347-F351 HydrophobicContact CB-CB 4.21Å; L347-F351 HydrophobicContact CD1-CB 4.44Å; R348-F351 WeakPolarHBondContact O-CB 3.41Å; R348-F351 WeakPolarHBondContact O-CD2 3.34Å; R348-F351 PolarHBondContact O-N 3.36Å; F351-D353 PolarHBondContact O-N 3.28Å; F351-D353 VanDerWaalsContact O-N 3.15Å; F351-I354 HydrophobicContact CB-CD1 4.32Å; F351-I354 HydrophobicContact CD1-CD1 3.89Å; F351-I354 WeakPolarHBondContact O-CG1 3.36Å; F351-I354 PolarHBondContact O-N 3.16Å; F351-I447 HydrophobicContact CD1-CD1 4.38Å; F351-I447 HydrophobicContact CE1-CD1 4.47Å; F351-I447 HydrophobicContact CE1-CG1 4.36Å; F351-I447 HydrophobicContact CE1-CG2 3.72Å; F351-I447 HydrophobicContact CZ-CG2 3.94Å
352	C	94.6	Very high	96.4	Very high	18 Å²	18	43 Å²	43	12%	0.122	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-60.2	-23.4	176.8	56	0	0	0	0	113.7	L344 K345 L347 K349 P350	L344-C352 WeakPolarHBondContact O-CA 3.31Å; K345-C352 VanDerWaalsContact O-CB 3.26Å; K345-C352 WeakPolarHBondContact O-CB 3.26Å; L347-C352 HydrophobicContact CB-CB 4.49Å; L347-C352 VanDerWaalsContact O-CB 3.28Å; L347-C352 WeakPolarHBondContact O-CB 3.42Å; K349-C352 WeakPolarHBondContact CG-SG 3.33Å; P350-C352 PolarHBondContact O-N 3.07Å
353	D	95.6	Very high	96.4	Very high	70 Å²	70	39.7 Å²	39.7	37%	0.374	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-88	-7.3	-174.5	-58.4	-29.4	0	0	0	112.1	P350 F351 P357 L443	P350-D353 PolarHBondContact O-N 3.34Å; F351-D353 PolarHBondContact O-N 3.28Å; F351-D353 VanDerWaalsContact O-N 3.15Å; D353-P357 VanDerWaalsContact O-CD 3.3Å; D353-P357 WeakPolarHBondContact O-CD 3.38Å; D353-L443 HydrophobicContact CB-CD2 4.27Å
354	I	95.1	Very high	96.4	Very high	18 Å²	18	45.6 Å²	45.6	9%	0.092	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-50.8	-174.7	-60.3	170.6	0	0	0	112	F273 F351 K358 L443 I447	F273-I354 HydrophobicContact CD2-CD1 4.23Å; F351-I354 HydrophobicContact CB-CD1 4.32Å; F351-I354 HydrophobicContact CD1-CD1 3.89Å; F351-I354 WeakPolarHBondContact O-CG1 3.36Å; F351-I354 PolarHBondContact O-N 3.16Å; I354-K358 WeakPolarHBondContact O-CD 3.3Å; I354-K358 WeakPolarHBondContact O-CE 3.35Å; I354-K358 PolarHBondContact O-NZ 3.24Å; I354-L443 HydrophobicContact CB-CD2 3.97Å; I354-L443 HydrophobicContact CG1-CD2 3.49Å; I354-L443 VanDerWaalsContact CG1-CD2 3.49Å; I354-L443 HydrophobicContact CG1-CG 4.14Å; I354-I447 HydrophobicContact CD1-CD1 3.39Å; I354-I447 HydrophobicContact CG1-CD1 3.77Å
355	M	96.9	Very high	96.5	Very high	27 Å²	27	45 Å²	45	13%	0.133	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-23.6	-165.5	-69.4	-58.4	-60.4	0	0	113.3	L321 M325 M330 L344 K358 F359	L321-M355 HydrophobicContact CD2-CE 4.3Å; M325-M355 HydrophobicContact CE-CE 3.41Å; M325-M355 VanDerWaalsContact CE-CE 3.41Å; M330-M355 HydrophobicContact CE-CE 4.42Å; M330-M355 HydrophobicContact SD-CE 3.45Å; M330-M355 WeakPolarHBondContact SD-CE 3.36Å; L344-M355 HydrophobicContact CD1-CB 4.23Å; L344-M355 HydrophobicContact CD1-CG 4.13Å; L344-M355 HydrophobicContact CD2-CG 4.48Å; M355-K358 WeakPolarHBondContact O-CA 3.3Å; M355-K358 WeakPolarHBondContact O-CB 3.45Å; M355-K358 PolarHBondContact O-N 3.47Å; M355-F359 HydrophobicContact CB-CD2 4.15Å; M355-F359 HydrophobicContact CB-CE2 4.02Å; M355-F359 HydrophobicContact CE-CE2 4.46Å; M355-F359 WeakPolarHBondContact O-CD2 3.49Å; M355-F359 PolarHBondContact O-N 3.33Å
356	E	96.7	Very high	96.5	Very high	53 Å²	53	42.1 Å²	42.1	25%	0.248	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-45.6	-175.3	-170.5	68.9	176.4	0	0	113	R341 K345 K358 F359 D360	R341-E356 IonicContact CZ-OE1 2.73Å; R341-E356 IonicContact CZ-OE2 4Å; R341-E356 IonicContact NE-OE1 3.07Å; R341-E356 PolarHBondContact NE-OE1 2.84Å; R341-E356 IonicContact NE-OE2 3.28Å; R341-E356 PolarHBondContact NE-OE2 3.34Å; R341-E356 IonicContact NH2-OE1 2.76Å; R341-E356 PolarHBondContact NH2-OE1 2.89Å; R341-E356 IonicContact NH2-OE2 3.82Å; R341-E356 PolarHBondContact NH2-OE2 3.21Å; K345-E356 WeakPolarHBondContact CD-OE2 3.46Å; E356-K358 PolarHBondContact O-N 3.29Å; E356-F359 PolarHBondContact O-N 3.39Å; E356-D360 PolarHBondContact O-N 3.44Å
357	P	98.4	Very high	96.6	Very high	41 Å²	41	41.9 Å²	41.9	27%	0.266	21%	0.213	S	C	.	.	H	α-helix	trans	-61.1	-29.9	174.2	-25	36.3	0	0	0	113.7	D353 F361 L436	D353-P357 VanDerWaalsContact O-CD 3.3Å; D353-P357 WeakPolarHBondContact O-CD 3.38Å; P357-F361 WeakPolarHBondContact O-CB 3.44Å; P357-F361 PolarHBondContact O-N 2.98Å; P357-L436 HydrophobicContact CB-CD1 3.55Å
358	K	98.4	Very high	96.8	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-75.5	-38.8	179.5	-72.1	81.8	-165.1	163.1	0	110.4	F318 M325 I354 M355 E356 F361 A362 L436	F318-K358 HydrophobicContact CD1-CG 4.01Å; F318-K358 HydrophobicContact CE1-CG 4.09Å; F318-K358 HydrophobicContact CG-CG 4.44Å; M325-K358 HydrophobicContact CE-CB 4.46Å; I354-K358 WeakPolarHBondContact O-CD 3.3Å; I354-K358 WeakPolarHBondContact O-CE 3.35Å; I354-K358 PolarHBondContact O-NZ 3.24Å; M355-K358 WeakPolarHBondContact O-CA 3.3Å; M355-K358 WeakPolarHBondContact O-CB 3.45Å; M355-K358 PolarHBondContact O-N 3.47Å; E356-K358 PolarHBondContact O-N 3.29Å; K358-F361 PolarHBondContact O-N 2.93Å; K358-A362 WeakPolarHBondContact O-CB 3.49Å; K358-A362 PolarHBondContact O-N 2.89Å; K358-L436 HydrophobicContact CD-CD1 4.18Å; K358-L436 HydrophobicContact CG-CD1 4.38Å; K358-L436 HydrophobicContact CG-CD2 4.28Å
359	F	98.6	Very high	96.9	Very high	1 Å²	1	45 Å²	45	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-45	170.3	-81.2	-69.8	0	0	0	111.6	M325 M330 R341 L344 M355 E356 F361 A362 M363	M325-F359 HydrophobicContact CE-CD1 4.46Å; M325-F359 HydrophobicContact CE-CE1 4.23Å; M325-F359 HydrophobicContact CE-CZ 4.29Å; M325-F359 HydrophobicContact CG-CD1 4.4Å; M325-F359 HydrophobicContact CG-CE1 4.11Å; M325-F359 HydrophobicContact SD-CD1 4.2Å; M325-F359 HydrophobicContact SD-CE1 4.31Å; M330-F359 HydrophobicContact CB-CE1 4.33Å; M330-F359 HydrophobicContact CB-CZ 4.24Å; M330-F359 HydrophobicContact CG-CZ 4.26Å; M330-F359 HydrophobicContact SD-CZ 4.47Å; R341-F359 HydrophobicContact CB-CD2 4.4Å; R341-F359 HydrophobicContact CB-CE1 4.17Å; R341-F359 HydrophobicContact CB-CE2 4.03Å; R341-F359 HydrophobicContact CB-CZ 3.92Å; R341-F359 HydrophobicContact CG-CD1 4.36Å; R341-F359 HydrophobicContact CG-CD2 3.79Å; R341-F359 HydrophobicContact CG-CE1 4.44Å; R341-F359 HydrophobicContact CG-CE2 3.88Å; R341-F359 HydrophobicContact CG-CG 4.06Å; R341-F359 HydrophobicContact CG-CZ 4.22Å; L344-F359 HydrophobicContact CD1-CE2 3.85Å; L344-F359 HydrophobicContact CD1-CZ 4.17Å; M355-F359 HydrophobicContact CB-CD2 4.15Å; M355-F359 HydrophobicContact CB-CE2 4.02Å; M355-F359 HydrophobicContact CE-CE2 4.46Å; M355-F359 WeakPolarHBondContact O-CD2 3.49Å; M355-F359 PolarHBondContact O-N 3.33Å; E356-F359 PolarHBondContact O-N 3.39Å; F359-F361 PolarHBondContact O-N 3.44Å; F359-A362 PolarHBondContact O-N 3.01Å; F359-M363 WeakPolarHBondContact O-CG 3.04Å; F359-M363 PolarHBondContact O-N 2.98Å
360	D	98.4	Very high	97.1	Very high	72 Å²	72	38.3 Å²	38.3	39%	0.385	20%	0.203	S	C	.	.	H	α-helix	trans	-64.1	-40.9	179.1	-77.5	-7	0	0	0	112.6	R341 E356 K364	R341-D360 IonicContact CZ-OD1 3.67Å; R341-D360 IonicContact NH2-OD1 2.79Å; R341-D360 PolarHBondContact NH2-OD1 3.44Å; E356-D360 PolarHBondContact O-N 3.44Å; D360-K364 WeakPolarHBondContact O-CG 3.31Å; D360-K364 PolarHBondContact O-N 3.33Å
361	F	98.8	Very high	97.4	Very high	14 Å²	14	40.5 Å²	40.5	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-61.2	-50.4	170.6	174.8	-93.5	0	0	0	111.1	S322 P357 K358 F359 M363 K364 F365 K429 D432 L433 L436	S322-F361 WeakPolarHBondContact OG-CD1 3.41Å; S322-F361 WeakPolarHBondContact OG-CE1 3.46Å; P357-F361 WeakPolarHBondContact O-CB 3.44Å; P357-F361 PolarHBondContact O-N 2.98Å; K358-F361 PolarHBondContact O-N 2.93Å; F359-F361 PolarHBondContact O-N 3.44Å; F361-M363 VanDerWaalsContact C-N 3.29Å; F361-M363 PolarHBondContact O-N 3.49Å; F361-K364 PolarHBondContact O-N 3.07Å; F361-K364 VanDerWaalsContact O-N 3.11Å; F361-F365 HydrophobicContact CD1-CB 4.3Å; F361-F365 HydrophobicContact CE1-CB 3.86Å; F361-F365 HydrophobicContact CE1-CD2 4.19Å; F361-F365 AromaticContact CE1-CG 3.95Å; F361-F365 HydrophobicContact CE1-CG 3.95Å; F361-F365 HydrophobicContact CZ-CB 4.07Å; F361-F365 AromaticContact CZ-CD2 3.77Å; F361-F365 HydrophobicContact CZ-CD2 3.77Å; F361-F365 HydrophobicContact CZ-CE2 4.44Å; F361-F365 HydrophobicContact CZ-CG 4.01Å; F361-F365 WeakPolarHBondContact O-CB 3.14Å; F361-F365 PolarHBondContact O-N 3Å; F361-K429 HydrophobicContact CE2-CB 4.4Å; F361-K429 HydrophobicContact CE2-CD 3.95Å; F361-K429 HydrophobicContact CZ-CD 4.48Å; F361-D432 HydrophobicContact CD2-CB 4.27Å; F361-D432 HydrophobicContact CE2-CB 4.13Å; F361-L433 HydrophobicContact CD1-CD2 4.48Å; F361-L433 HydrophobicContact CE1-CD2 3.82Å; F361-L433 HydrophobicContact CE1-CG 4.38Å; F361-L433 HydrophobicContact CE2-CD2 3.95Å; F361-L433 HydrophobicContact CE2-CG 3.81Å; F361-L433 HydrophobicContact CZ-CD1 4.11Å; F361-L433 HydrophobicContact CZ-CD2 3.52Å; F361-L433 HydrophobicContact CZ-CG 3.58Å; F361-L436 HydrophobicContact CB-CD2 3.82Å; F361-L436 HydrophobicContact CD1-CD2 4.27Å; F361-L436 HydrophobicContact CD2-CD2 4.32Å; F361-L436 HydrophobicContact CG-CD2 3.87Å
362	A	98.6	Very high	97.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-37.5	-176.3	0	0	0	0	0	112.5	S322 M325 K358 F359 F365 N366	S322-A362 WeakPolarHBondContact OG-CA 3.43Å; M325-A362 HydrophobicContact CB-CB 4Å; M325-A362 HydrophobicContact CG-CB 4.42Å; M325-A362 HydrophobicContact SD-CB 3.6Å; K358-A362 WeakPolarHBondContact O-CB 3.49Å; K358-A362 PolarHBondContact O-N 2.89Å; F359-A362 PolarHBondContact O-N 3.01Å; A362-F365 PolarHBondContact O-N 2.89Å; A362-N366 WeakPolarHBondContact O-CB 3.27Å; A362-N366 VanDerWaalsContact O-CG 3.22Å; A362-N366 PolarHBondContact O-N 3.25Å; A362-N366 PolarHBondContact O-ND2 2.9Å
363	M	98.3	Very high	97.7	Very high	54 Å²	54	40.1 Å²	40.1	27%	0.266	21%	0.212	S	C	.	.	H	α-helix	trans	-66.4	-41.7	177.9	-67.1	-48.2	98.6	0	0	111.4	M325 N326 K327 F359 F361 A367	M325-M363 HydrophobicContact CB-CE 4.28Å; N326-M363 VanDerWaalsContact O-CE 3.25Å; N326-M363 WeakPolarHBondContact O-CE 3.46Å; K327-M363 HydrophobicContact CB-SD 4Å; F359-M363 WeakPolarHBondContact O-CG 3.04Å; F359-M363 PolarHBondContact O-N 2.98Å; F361-M363 VanDerWaalsContact C-N 3.29Å; F361-M363 PolarHBondContact O-N 3.49Å; M363-A367 PolarHBondContact O-N 2.74Å
364	K	98.4	Very high	97.9	Very high	132 Å²	132	36.8 Å²	36.8	57%	0.574	19%	0.194	S	C	*	.	H	α-helix	trans	-69.1	-38.3	176.3	-64.9	171.1	-173.3	170.7	0	112	D360 F361	D360-K364 WeakPolarHBondContact O-CG 3.31Å; D360-K364 PolarHBondContact O-N 3.33Å; F361-K364 PolarHBondContact O-N 3.07Å; F361-K364 VanDerWaalsContact O-N 3.11Å
365	F	98.7	Very high	98.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-72.3	-41.8	-179.9	-169.3	-104.6	0	0	0	111.7	F361 A362 A367 L368 L370 F378 L426 K429	F361-F365 HydrophobicContact CD1-CB 4.3Å; F361-F365 HydrophobicContact CE1-CB 3.86Å; F361-F365 HydrophobicContact CE1-CD2 4.19Å; F361-F365 AromaticContact CE1-CG 3.95Å; F361-F365 HydrophobicContact CE1-CG 3.95Å; F361-F365 HydrophobicContact CZ-CB 4.07Å; F361-F365 AromaticContact CZ-CD2 3.77Å; F361-F365 HydrophobicContact CZ-CD2 3.77Å; F361-F365 HydrophobicContact CZ-CE2 4.44Å; F361-F365 HydrophobicContact CZ-CG 4.01Å; F361-F365 WeakPolarHBondContact O-CB 3.14Å; F361-F365 PolarHBondContact O-N 3Å; A362-F365 PolarHBondContact O-N 2.89Å; F365-A367 VanDerWaalsContact C-N 3.27Å; F365-A367 PolarHBondContact O-N 2.92Å; F365-L368 HydrophobicContact CD2-CD1 4.23Å; F365-L368 VanDerWaalsContact O-CB 3.26Å; F365-L368 WeakPolarHBondContact O-CB 3.32Å; F365-L368 WeakPolarHBondContact O-CG 3.47Å; F365-L368 PolarHBondContact O-N 3.39Å; F365-L368 VanDerWaalsContact O-N 3.1Å; F365-L370 HydrophobicContact CE1-CD1 4.16Å; F365-L370 HydrophobicContact CE2-CD1 4.1Å; F365-L370 HydrophobicContact CZ-CD1 3.67Å; F365-F378 HydrophobicContact CE2-CD1 4.21Å; F365-F378 AromaticContact CE2-CE1 3.68Å; F365-F378 HydrophobicContact CE2-CE1 3.68Å; F365-F378 HydrophobicContact CE2-CZ 4.14Å; F365-F378 AromaticContact CZ-CD1 3.86Å; F365-F378 HydrophobicContact CZ-CD1 3.86Å; F365-F378 AromaticContact CZ-CE1 3.73Å; F365-F378 HydrophobicContact CZ-CE1 3.73Å; F365-L426 HydrophobicContact CE2-CD1 3.62Å; F365-L426 HydrophobicContact CZ-CD1 4.18Å; F365-K429 HydrophobicContact CD2-CB 4.04Å; F365-K429 HydrophobicContact CD2-CD 4.06Å; F365-K429 HydrophobicContact CD2-CG 3.84Å; F365-K429 HydrophobicContact CE2-CB 4.14Å; F365-K429 HydrophobicContact CE2-CG 4.28Å
366	N	98.1	Very high	98.1	Very high	23 Å²	23	34.6 Å²	34.6	12%	0.123	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-26.4	177.8	-77.5	-40.8	0	0	0	113.8	R226 S322 A362 L368 E369	R226-N366 PolarHBondContact NH2-ND2 3.16Å; R226-N366 VanDerWaalsContact NH2-ND2 3.12Å; R226-N366 PolarHBondContact NH2-OD1 3.43Å; S322-N366 PolarHBondContact O-ND2 3.27Å; S322-N366 PolarHBondContact O-OD1 3.2Å; A362-N366 WeakPolarHBondContact O-CB 3.27Å; A362-N366 VanDerWaalsContact O-CG 3.22Å; A362-N366 PolarHBondContact O-N 3.25Å; A362-N366 PolarHBondContact O-ND2 2.9Å; N366-L368 PolarHBondContact O-N 2.84Å; N366-E369 PolarHBondContact O-N 3.49Å
367	A	97.4	Very high	98.2	Very high	75 Å²	75	32.2 Å²	32.2	62%	0.62	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.5	173.1	0	0	0	0	0	113.6	M363 F365	M363-A367 PolarHBondContact O-N 2.74Å; F365-A367 VanDerWaalsContact C-N 3.27Å; F365-A367 PolarHBondContact O-N 2.92Å
368	L	97.6	Very high	98.3	Very high	21 Å²	21	30.2 Å²	30.2	11%	0.11	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-5.9	170.6	-57.4	179.2	0	0	0	112.8	F365 N366 L370 L422 K425 L426 K429	F365-L368 HydrophobicContact CD2-CD1 4.23Å; F365-L368 VanDerWaalsContact O-CB 3.26Å; F365-L368 WeakPolarHBondContact O-CB 3.32Å; F365-L368 WeakPolarHBondContact O-CG 3.47Å; F365-L368 PolarHBondContact O-N 3.39Å; F365-L368 VanDerWaalsContact O-N 3.1Å; N366-L368 PolarHBondContact O-N 2.84Å; L368-L370 HydrophobicContact CB-CD1 4.43Å; L368-L370 HydrophobicContact CB-CD2 4.31Å; L368-L370 HydrophobicContact CB-CG 3.97Å; L368-L370 PolarHBondContact O-N 3.4Å; L368-L422 HydrophobicContact CB-CD1 3.96Å; L368-L422 HydrophobicContact CD2-CD1 4.1Å; L368-L422 HydrophobicContact CG-CD1 4.48Å; L368-K425 HydrophobicContact CD2-CB 4.16Å; L368-K425 HydrophobicContact CD2-CD 4.15Å; L368-L426 HydrophobicContact CD1-CD1 4.18Å; L368-K429 HydrophobicContact CD1-CG 3.94Å
369	E	96.9	Very high	98.3	Very high	159 Å²	159	30 Å²	30	74%	0.743	16%	0.158	S	C	*	.			trans	53.7	26.2	173.4	-59.4	-170	164.9	0	0	115.8	N366	N366-E369 PolarHBondContact O-N 3.49Å
370	L	98.1	Very high	98.3	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.158	C	C	.	.			trans	-60.1	142.2	177.7	-55.6	178.8	0	0	0	112.3	K222 F365 L368 D374 I375 L412 L422 L426	K222-L370 WeakPolarHBondContact CD-O 3.31Å; K222-L370 WeakPolarHBondContact CE-O 3.44Å; K222-L370 PolarHBondContact NZ-O 3.11Å; F365-L370 HydrophobicContact CE1-CD1 4.16Å; F365-L370 HydrophobicContact CE2-CD1 4.1Å; F365-L370 HydrophobicContact CZ-CD1 3.67Å; L368-L370 HydrophobicContact CB-CD1 4.43Å; L368-L370 HydrophobicContact CB-CD2 4.31Å; L368-L370 HydrophobicContact CB-CG 3.97Å; L368-L370 PolarHBondContact O-N 3.4Å; L370-D374 WeakPolarHBondContact CA-OD2 3.48Å; L370-D374 HydrophobicContact CB-CB 3.93Å; L370-D374 HydrophobicContact CD2-CB 4.09Å; L370-D374 HydrophobicContact CG-CB 4.46Å; L370-I375 HydrophobicContact CB-CG1 4.2Å; L370-L412 HydrophobicContact CD2-CD2 3.87Å; L370-L422 HydrophobicContact CD2-CD1 4.08Å; L370-L422 HydrophobicContact CD2-CD2 4.03Å; L370-L422 HydrophobicContact CD2-CG 4.27Å; L370-L426 HydrophobicContact CD1-CD1 3.64Å; L370-L426 HydrophobicContact CD1-CD2 4.27Å
371	D	97.5	Very high	98.3	Very high	57 Å²	57	26.5 Å²	26.5	31%	0.305	14%	0.14	S	C	.	.			trans	-92.7	-179.3	171.1	74.4	18.1	0	0	0	112.4	S373 D374 I375 N415	D371-S373 VanDerWaalsContact CG-OG 3.29Å; D371-S373 PolarHBondContact O-N 3.24Å; D371-S373 WeakPolarHBondContact OD1-CA 3.26Å; D371-S373 WeakPolarHBondContact OD1-CB 3.25Å; D371-S373 PolarHBondContact OD1-N 3.33Å; D371-S373 PolarHBondContact OD1-OG 3.24Å; D371-S373 PolarHBondContact OD2-OG 2.74Å; D371-D374 PolarHBondContact N-OD2 2.86Å; D371-D374 PolarHBondContact O-N 2.9Å; D371-D374 PolarHBondContact OD1-N 3.44Å; D371-I375 VanDerWaalsContact O-CG1 3.27Å; D371-I375 WeakPolarHBondContact O-CG1 3.47Å; D371-I375 PolarHBondContact O-N 3.42Å; D371-N415 PolarHBondContact OD2-ND2 2.75Å
372	D	98.4	Very high	98.3	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-27.5	179.5	-76.7	-51.5	0	0	0	112.8	Y211 Y214 K222 V223 S376	Y211-D372 HydrophobicContact CE2-CB 3.81Å; Y214-D372 HydrophobicContact CE1-CB 4.2Å; K222-D372 WeakPolarHBondContact CB-OD1 3.32Å; K222-D372 PolarHBondContact N-OD1 2.91Å; K222-D372 PolarHBondContact N-OD2 3.07Å; V223-D372 VanDerWaalsContact CG2-OD2 3.25Å; V223-D372 WeakPolarHBondContact CG2-OD2 3.45Å; V223-D372 PolarHBondContact N-OD2 3.26Å; D372-S376 WeakPolarHBondContact O-CB 3.35Å; D372-S376 PolarHBondContact O-N 2.85Å
373	S	97.9	Very high	98.3	Very high	14 Å²	14	25.8 Å²	25.8	10%	0.098	14%	0.137	C	C	.	.	H	α-helix	trans	-72.3	-41.1	177.3	73.2	0	0	0	0	111.3	D371 S376 L377 H411	D371-S373 VanDerWaalsContact CG-OG 3.29Å; D371-S373 PolarHBondContact O-N 3.24Å; D371-S373 WeakPolarHBondContact OD1-CA 3.26Å; D371-S373 WeakPolarHBondContact OD1-CB 3.25Å; D371-S373 PolarHBondContact OD1-N 3.33Å; D371-S373 PolarHBondContact OD1-OG 3.24Å; D371-S373 PolarHBondContact OD2-OG 2.74Å; S373-S376 PolarHBondContact O-N 2.74Å; S373-S376 PolarHBondContact O-OG 2.97Å; S373-L377 PolarHBondContact O-N 3.38Å; S373-H411 PolarHBondContact OG-CE1 2.91Å; S373-H411 PolarHBondContact OG-NE2 3.23Å
374	D	98.4	Very high	98.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-45.7	173.1	-56.1	-44.5	0	0	0	111.4	L370 D371 S376 L377 F378 H411 L412 H416	L370-D374 WeakPolarHBondContact CA-OD2 3.48Å; L370-D374 HydrophobicContact CB-CB 3.93Å; L370-D374 HydrophobicContact CD2-CB 4.09Å; L370-D374 HydrophobicContact CG-CB 4.46Å; D371-D374 PolarHBondContact N-OD2 2.86Å; D371-D374 PolarHBondContact O-N 2.9Å; D371-D374 PolarHBondContact OD1-N 3.44Å; D374-S376 VanDerWaalsContact C-N 3.33Å; D374-S376 PolarHBondContact O-N 3.1Å; D374-L377 PolarHBondContact O-N 3.19Å; D374-F378 WeakPolarHBondContact O-CB 3.45Å; D374-F378 PolarHBondContact O-N 3.03Å; D374-H411 IonicContact OD1-CD2 3.49Å; D374-H411 PolarHBondContact OD1-CD2 3.13Å; D374-H411 IonicContact OD1-NE2 3.58Å; D374-H411 PolarHBondContact OD1-NE2 3.42Å; D374-L412 HydrophobicContact CB-CD2 4.06Å; D374-L412 WeakPolarHBondContact OD1-CD2 3.29Å; D374-H416 IonicContact OD1-CD2 2.75Å; D374-H416 IonicContact OD1-NE2 2.84Å; D374-H416 IonicContact OD2-CD2 3.52Å; D374-H416 IonicContact OD2-CE1 3.85Å; D374-H416 IonicContact OD2-NE2 3.63Å; D374-H416 PolarHBondContact OD2-NE2 2.66Å
375	I	98.7	Very high	98.2	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.8	-39.8	-179.9	-68.7	169.5	0	0	0	110.6	Y214 K222 M320 S323 L370 D371 L377 F378 V379	Y214-I375 HydrophobicContact CE2-CG2 4.23Å; K222-I375 HydrophobicContact CB-CD1 4.32Å; K222-I375 HydrophobicContact CD-CD1 3.5Å; K222-I375 VanDerWaalsContact CD-CD1 3.5Å; M320-I375 HydrophobicContact CG-CG2 4.48Å; S323-I375 WeakPolarHBondContact OG-CD1 3.22Å; L370-I375 HydrophobicContact CB-CG1 4.2Å; D371-I375 VanDerWaalsContact O-CG1 3.27Å; D371-I375 WeakPolarHBondContact O-CG1 3.47Å; D371-I375 PolarHBondContact O-N 3.42Å; I375-L377 VanDerWaalsContact C-N 3.34Å; I375-L377 PolarHBondContact O-N 3.2Å; I375-F378 PolarHBondContact O-N 3.34Å; I375-V379 HydrophobicContact CG2-CG2 4.01Å; I375-V379 WeakPolarHBondContact O-CB 3.48Å; I375-V379 VanDerWaalsContact O-CG2 3.29Å; I375-V379 WeakPolarHBondContact O-CG2 3.46Å; I375-V379 PolarHBondContact O-N 2.96Å
376	S	98.7	Very high	98.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.2	-44.8	178.7	74	0	0	0	0	112.5	Y214 D372 S373 D374 A380	Y214-S376 VanDerWaalsContact CB-CB 3.49Å; D372-S376 WeakPolarHBondContact O-CB 3.35Å; D372-S376 PolarHBondContact O-N 2.85Å; S373-S376 PolarHBondContact O-N 2.74Å; S373-S376 PolarHBondContact O-OG 2.97Å; D374-S376 VanDerWaalsContact C-N 3.33Å; D374-S376 PolarHBondContact O-N 3.1Å; S376-A380 WeakPolarHBondContact O-CB 3.26Å; S376-A380 PolarHBondContact O-N 3.02Å
377	L	98.8	Very high	98	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-69	-39.7	177.3	-73.6	170.3	0	0	0	111.8	A207 I210 S373 D374 I375 A380 A381 V407 L408 H411	A207-L377 HydrophobicContact CB-CD1 4.37Å; I210-L377 HydrophobicContact CB-CD2 4.31Å; I210-L377 HydrophobicContact CD1-CD2 3.85Å; I210-L377 HydrophobicContact CG2-CD2 4.24Å; S373-L377 PolarHBondContact O-N 3.38Å; D374-L377 PolarHBondContact O-N 3.19Å; I375-L377 VanDerWaalsContact C-N 3.34Å; I375-L377 PolarHBondContact O-N 3.2Å; L377-A380 PolarHBondContact O-N 3.2Å; L377-A381 WeakPolarHBondContact O-CB 3.29Å; L377-A381 PolarHBondContact O-N 2.79Å; L377-V407 HydrophobicContact CD1-CG1 4.08Å; L377-V407 HydrophobicContact CD2-CB 4.48Å; L377-V407 HydrophobicContact CD2-CG1 3.82Å; L377-L408 HydrophobicContact CB-CB 4.17Å; L377-L408 HydrophobicContact CB-CD1 3.67Å; L377-L408 HydrophobicContact CB-CG 4.42Å; L377-L408 HydrophobicContact CD1-CD1 4.4Å; L377-H411 HydrophobicContact CD1-CB 3.79Å
378	F	98.8	Very high	97.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.9	-45.4	176.9	-177.4	-114.8	0	0	0	112.3	A319 F365 D374 I375 A381 I382 L408 L426 K429 M430 L433	A319-F378 HydrophobicContact CB-CD1 4.23Å; A319-F378 HydrophobicContact CB-CE1 3.98Å; F365-F378 HydrophobicContact CE2-CD1 4.21Å; F365-F378 AromaticContact CE2-CE1 3.68Å; F365-F378 HydrophobicContact CE2-CE1 3.68Å; F365-F378 HydrophobicContact CE2-CZ 4.14Å; F365-F378 AromaticContact CZ-CD1 3.86Å; F365-F378 HydrophobicContact CZ-CD1 3.86Å; F365-F378 AromaticContact CZ-CE1 3.73Å; F365-F378 HydrophobicContact CZ-CE1 3.73Å; D374-F378 WeakPolarHBondContact O-CB 3.45Å; D374-F378 PolarHBondContact O-N 3.03Å; I375-F378 PolarHBondContact O-N 3.34Å; F378-A381 PolarHBondContact O-N 2.9Å; F378-I382 HydrophobicContact CD1-CD1 3.86Å; F378-I382 HydrophobicContact CE1-CD1 3.5Å; F378-I382 HydrophobicContact CE2-CD1 4.45Å; F378-I382 HydrophobicContact CG-CD1 4.48Å; F378-I382 HydrophobicContact CZ-CD1 3.84Å; F378-I382 WeakPolarHBondContact O-CG1 3.47Å; F378-I382 PolarHBondContact O-N 3.1Å; F378-L408 HydrophobicContact CD2-CD2 4.42Å; F378-L426 HydrophobicContact CB-CD2 4.32Å; F378-L426 HydrophobicContact CD1-CD1 4.34Å; F378-L426 HydrophobicContact CD2-CD1 3.68Å; F378-L426 HydrophobicContact CD2-CD2 3.7Å; F378-L426 HydrophobicContact CD2-CG 3.48Å; F378-L426 VanDerWaalsContact CD2-CG 3.48Å; F378-L426 HydrophobicContact CE1-CD1 4.23Å; F378-L426 HydrophobicContact CE2-CD1 3.56Å; F378-L426 HydrophobicContact CE2-CD2 4.29Å; F378-L426 HydrophobicContact CE2-CG 3.55Å; F378-L426 HydrophobicContact CG-CD1 4.07Å; F378-L426 HydrophobicContact CG-CD2 4.18Å; F378-L426 HydrophobicContact CG-CG 4.23Å; F378-L426 HydrophobicContact CZ-CD1 3.85Å; F378-L426 HydrophobicContact CZ-CG 4.34Å; F378-K429 HydrophobicContact CZ-CB 4.26Å; F378-M430 HydrophobicContact CE2-CG 3.45Å; F378-M430 VanDerWaalsContact CE2-CG 3.45Å; F378-M430 HydrophobicContact CE2-SD 4.2Å; F378-M430 HydrophobicContact CZ-CG 3.77Å; F378-L433 HydrophobicContact CE1-CD1 3.99Å; F378-L433 HydrophobicContact CZ-CD1 4.1Å
379	V	98.8	Very high	97.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-40.3	176.8	173.8	0	0	0	0	110.9	L287 F290 A316 M320 I375 A381 I382 I383	L287-V379 HydrophobicContact CD2-CG1 3.94Å; F290-V379 HydrophobicContact CD1-CG1 4.33Å; F290-V379 HydrophobicContact CE1-CB 4.39Å; F290-V379 HydrophobicContact CE1-CG1 3.83Å; A316-V379 HydrophobicContact CB-CG1 3.8Å; M320-V379 HydrophobicContact CG-CG2 3.93Å; M320-V379 HydrophobicContact SD-CG2 4.45Å; I375-V379 HydrophobicContact CG2-CG2 4.01Å; I375-V379 WeakPolarHBondContact O-CB 3.48Å; I375-V379 VanDerWaalsContact O-CG2 3.29Å; I375-V379 WeakPolarHBondContact O-CG2 3.46Å; I375-V379 PolarHBondContact O-N 2.96Å; V379-A381 VanDerWaalsContact C-N 3.33Å; V379-A381 PolarHBondContact O-N 3.3Å; V379-I382 WeakPolarHBondContact O-CB 3.44Å; V379-I382 PolarHBondContact O-N 3.08Å; V379-I383 HydrophobicContact CG1-CD1 3.97Å; V379-I383 WeakPolarHBondContact O-CG1 3.47Å; V379-I383 PolarHBondContact O-N 3.36Å
380	A	98.7	Very high	97.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.1	-42	173	0	0	0	0	0	112.1	I210 F290 I294 S376 L377 I382 I383 C384 I404	I210-A380 HydrophobicContact CD1-CB 4.29Å; I210-A380 HydrophobicContact CG2-CB 3.98Å; F290-A380 HydrophobicContact CE1-CB 4.45Å; F290-A380 HydrophobicContact CZ-CB 4.22Å; I294-A380 HydrophobicContact CD1-CB 3.74Å; I294-A380 HydrophobicContact CG1-CB 4.36Å; S376-A380 WeakPolarHBondContact O-CB 3.26Å; S376-A380 PolarHBondContact O-N 3.02Å; L377-A380 PolarHBondContact O-N 3.2Å; A380-I382 VanDerWaalsContact C-N 3.31Å; A380-I382 PolarHBondContact O-N 3.43Å; A380-I383 PolarHBondContact O-N 3.35Å; A380-C384 WeakPolarHBondContact O-CB 3.11Å; A380-C384 PolarHBondContact O-N 2.88Å; A380-C384 PolarHBondContact O-SG 3.31Å; A380-I404 HydrophobicContact CB-CD1 4.35Å; A380-I404 HydrophobicContact CB-CG2 3.99Å
381	A	98.6	Very high	97.6	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.5	-32	176.8	0	0	0	0	0	113.2	L377 F378 V379 Q401 I404 V405	L377-A381 WeakPolarHBondContact O-CB 3.29Å; L377-A381 PolarHBondContact O-N 2.79Å; F378-A381 PolarHBondContact O-N 2.9Å; V379-A381 VanDerWaalsContact C-N 3.33Å; V379-A381 PolarHBondContact O-N 3.3Å; A381-Q401 PolarHBondContact O-NE2 2.6Å; A381-I404 HydrophobicContact CB-CG2 4.02Å; A381-V405 HydrophobicContact CB-CG2 4.01Å
382	I	98.6	Very high	97.5	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.6	-49	174	-76.6	167.7	0	0	0	111.2	E315 A316 A319 F378 V379 A380 C385 R388 M430 L433	E315-I382 HydrophobicContact CB-CG2 3.53Å; E315-I382 WeakPolarHBondContact OE2-CG2 3.42Å; A316-I382 HydrophobicContact CB-CG2 4.42Å; A319-I382 HydrophobicContact CB-CD1 4.4Å; F378-I382 HydrophobicContact CD1-CD1 3.86Å; F378-I382 HydrophobicContact CE1-CD1 3.5Å; F378-I382 HydrophobicContact CE2-CD1 4.45Å; F378-I382 HydrophobicContact CG-CD1 4.48Å; F378-I382 HydrophobicContact CZ-CD1 3.84Å; F378-I382 WeakPolarHBondContact O-CG1 3.47Å; F378-I382 PolarHBondContact O-N 3.1Å; V379-I382 WeakPolarHBondContact O-CB 3.44Å; V379-I382 PolarHBondContact O-N 3.08Å; A380-I382 VanDerWaalsContact C-N 3.31Å; A380-I382 PolarHBondContact O-N 3.43Å; I382-C385 WeakPolarHBondContact O-CB 3.45Å; I382-R388 PolarHBondContact O-NH2 3.43Å; I382-M430 HydrophobicContact CG1-CE 4.05Å; I382-L433 HydrophobicContact CD1-CD1 3.71Å
383	I	98.4	Very high	97.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-48.7	-177.2	-67.3	168.8	0	0	0	109.8	L287 F290 A291 F297 L308 L309 V379 A380 C385	L287-I383 HydrophobicContact CD2-CD1 3.91Å; F290-I383 HydrophobicContact CD1-CD1 3.9Å; F290-I383 HydrophobicContact CE1-CD1 4.01Å; A291-I383 HydrophobicContact CB-CD1 4.32Å; A291-I383 HydrophobicContact CB-CG2 4.09Å; F297-I383 HydrophobicContact CD2-CG2 4.44Å; F297-I383 HydrophobicContact CE2-CG2 3.8Å; F297-I383 HydrophobicContact CZ-CG2 4.44Å; L308-I383 WeakPolarHBondContact CD2-O 3.41Å; L309-I383 HydrophobicContact CD2-CG2 4.39Å; V379-I383 HydrophobicContact CG1-CD1 3.97Å; V379-I383 WeakPolarHBondContact O-CG1 3.47Å; V379-I383 PolarHBondContact O-N 3.36Å; A380-I383 PolarHBondContact O-N 3.35Å; I383-C385 PolarHBondContact O-N 3.47Å
384	C	98.2	Very high	97.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	48.8	-175.1	-56.8	0	0	0	0	112.5	A380 Q401 I404	A380-C384 WeakPolarHBondContact O-CB 3.11Å; A380-C384 PolarHBondContact O-N 2.88Å; A380-C384 PolarHBondContact O-SG 3.31Å; C384-Q401 WeakPolarHBondContact O-CB 3.44Å; C384-Q401 WeakPolarHBondContact O-CG 3.28Å; C384-I404 HydrophobicContact CB-CD1 4.01Å
385	C	97.2	Very high	97.4	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.007	18%	0.182	C	C	.	.			trans	-97.4	128.2	-176.9	-177.4	0	0	0	0	112.7	L308 I382 I383 D387 R388	L308-C385 WeakPolarHBondContact CD2-O 3.36Å; I382-C385 WeakPolarHBondContact O-CB 3.45Å; I383-C385 PolarHBondContact O-N 3.47Å; C385-D387 VanDerWaalsContact C-N 3.26Å; C385-D387 PolarHBondContact O-N 2.99Å; C385-R388 WeakPolarHBondContact O-CG 3.22Å
386	G	96.8	Very high	97.3	Very high	7 Å²	7	32.6 Å²	32.6	7%	0.072	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.6	179.1	0	0	0	0	0	115.3	R388 L391	G386-R388 PolarHBondContact O-N 3.37Å; G386-L391 WeakPolarHBondContact O-CD1 3.26Å
387	D	95.2	Very high	97.3	Very high	111 Å²	111	32.6 Å²	32.6	59%	0.594	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	2.6	-176.6	-59.7	-29	0	0	0	113.6	C385 R434	C385-D387 VanDerWaalsContact C-N 3.26Å; C385-D387 PolarHBondContact O-N 2.99Å; D387-R434 IonicContact OD2-CZ 2.74Å; D387-R434 IonicContact OD2-NH2 3.56Å; D387-R434 PolarHBondContact OD2-NH2 3.49Å
388	R	95.6	Very high	97.2	Very high	14 Å²	14	37 Å²	37	5%	0.053	23%	0.225	C	C	.	.			trans	-75.8	139.1	-176.3	-49.4	-44.9	-173.9	170.4	-10.8	110.7	T307 L308 Y311 E315 I382 C385 G386 L391	T307-R388 HydrophobicContact CG2-CB 4.11Å; L308-R388 HydrophobicContact CD2-CG 3.94Å; Y311-R388 HydrophobicContact CD2-CB 4.24Å; Y311-R388 HydrophobicContact CG-CB 4.5Å; Y311-R388 PolarHBondContact O-NH1 3.08Å; E315-R388 IonicContact OE1-CZ 3.5Å; E315-R388 IonicContact OE1-NH1 3.46Å; E315-R388 PolarHBondContact OE1-NH1 3.26Å; E315-R388 IonicContact OE1-NH2 2.72Å; E315-R388 PolarHBondContact OE1-NH2 3.26Å; E315-R388 IonicContact OE2-CZ 3.36Å; E315-R388 IonicContact OE2-NH1 3.01Å; E315-R388 IonicContact OE2-NH2 3.32Å; E315-R388 PolarHBondContact OE2-NH2 2.81Å; I382-R388 PolarHBondContact O-NH2 3.43Å; C385-R388 WeakPolarHBondContact O-CG 3.22Å; G386-R388 PolarHBondContact O-N 3.37Å; R388-L391 HydrophobicContact CB-CD1 3.87Å; R388-L391 HydrophobicContact CB-CD2 4.5Å; R388-L391 HydrophobicContact CB-CG 4.06Å; R388-L391 HydrophobicContact CG-CD1 4.48Å; R388-L391 WeakPolarHBondContact O-CD1 3.46Å; R388-L391 WeakPolarHBondContact O-CG 3.28Å
389	P	94.8	Very high	97.1	Very high	69 Å²	69	43.1 Å²	43.1	45%	0.448	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	143.8	179.1	31.4	-36.2	0	0	0	110.9	T307 Y311	T307-P389 WeakPolarHBondContact CG2-O 3.47Å; Y311-P389 HydrophobicContact CD1-CG 4.49Å; Y311-P389 HydrophobicContact CD2-CG 4.24Å; Y311-P389 HydrophobicContact CE1-CG 3.81Å; Y311-P389 HydrophobicContact CE2-CG 3.52Å; Y311-P389 VanDerWaalsContact OH-CG 3.28Å; Y311-P389 WeakPolarHBondContact OH-CG 3.38Å
390	G	94.6	Very high	97	Very high	66 Å²	66	44.3 Å²	44.3	68%	0.68	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	5.7	175.9	0	0	0	0	0	115.7
391	L	96.9	Very high	97	Very high	20 Å²	20	45.8 Å²	45.8	11%	0.105	26%	0.264	C	S	.	.			trans	-68.9	137.1	176.2	-67.4	175.8	0	0	0	112.3	D304 T307 L308 G386 R388 V394 I397	D304-L391 HydrophobicContact CB-CD2 4.17Å; D304-L391 WeakPolarHBondContact OD1-CA 3.37Å; T307-L391 HydrophobicContact CG2-CD2 3.71Å; T307-L391 HydrophobicContact CG2-CG 4.18Å; L308-L391 HydrophobicContact CD2-CD1 4.14Å; L308-L391 HydrophobicContact CD2-CD2 4.02Å; L308-L391 HydrophobicContact CG-CD2 4.07Å; G386-L391 WeakPolarHBondContact O-CD1 3.26Å; R388-L391 HydrophobicContact CB-CD1 3.87Å; R388-L391 HydrophobicContact CB-CD2 4.5Å; R388-L391 HydrophobicContact CB-CG 4.06Å; R388-L391 HydrophobicContact CG-CD1 4.48Å; R388-L391 WeakPolarHBondContact O-CD1 3.46Å; R388-L391 WeakPolarHBondContact O-CG 3.28Å; L391-V394 HydrophobicContact CB-CG2 3.75Å; L391-I397 HydrophobicContact CB-CD1 4.41Å; L391-I397 HydrophobicContact CD1-CD1 3.9Å; L391-I397 HydrophobicContact CD2-CD1 3.74Å; L391-I397 HydrophobicContact CG-CD1 4.23Å
392	L	96.3	Very high	96.9	Very high	113 Å²	113	51 Å²	51	59%	0.592	29%	0.288	S	S	*	.	S	Bend	trans	-86.6	-48.1	177.6	-62.2	178	0	0	0	111.5	D304	D304-L392 PolarHBondContact OD1-N 3.35Å
393	N	95.8	Very high	96.7	Very high	78 Å²	78	52.2 Å²	52.2	42%	0.417	30%	0.301	S	S	.	.			trans	-108.7	50.7	-172.3	-57.7	-79.7	0	0	0	113.1	D304 G395 H396 I397	D304-N393 WeakPolarHBondContact OD2-CB 3.39Å; D304-N393 PolarHBondContact OD2-N 3.4Å; D304-N393 VanDerWaalsContact OD2-N 3.07Å; D304-N393 PolarHBondContact OD2-ND2 3Å; N393-G395 VanDerWaalsContact C-N 3.32Å; N393-G395 PolarHBondContact O-N 3.13Å; N393-H396 HydrophobicContact CB-CB 4.34Å; N393-H396 PolarHBondContact O-N 3.48Å; N393-I397 PolarHBondContact O-N 3.1Å
394	V	98	Very high	96.7	Very high	52 Å²	52	52.4 Å²	52.4	32%	0.315	30%	0.301	S	S	.	.	H	α-helix	trans	-48.4	-48.5	-175	-178.2	0	0	0	0	112.8	L391 H396 I397 E398	L391-V394 HydrophobicContact CB-CG2 3.75Å; V394-H396 VanDerWaalsContact C-N 3.29Å; V394-H396 PolarHBondContact O-N 3.15Å; V394-I397 PolarHBondContact O-N 3.5Å; V394-I397 VanDerWaalsContact O-N 3.12Å; V394-E398 HydrophobicContact CG1-CG 4.04Å; V394-E398 WeakPolarHBondContact O-CG 3.49Å; V394-E398 PolarHBondContact O-N 3.45Å
395	G	97.3	Very high	96.7	Very high	51 Å²	51	53.7 Å²	53.7	53%	0.526	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-29.6	-177.2	0	0	0	0	0	114.5	N393 K399	N393-G395 VanDerWaalsContact C-N 3.32Å; N393-G395 PolarHBondContact O-N 3.13Å; G395-K399 WeakPolarHBondContact O-CB 3.32Å; G395-K399 PolarHBondContact O-N 2.66Å
396	H	96.8	Very high	96.6	Very high	101 Å²	101	57 Å²	57	47%	0.468	32%	0.324	S	S	.	.	H	α-helix	trans	-73	-41.9	174.5	-177	-150.6	0	0	0	110.9	L300 N393 V394 K399 M400	L300-H396 WeakPolarHBondContact CD2-ND1 3.49Å; N393-H396 HydrophobicContact CB-CB 4.34Å; N393-H396 PolarHBondContact O-N 3.48Å; V394-H396 VanDerWaalsContact C-N 3.29Å; V394-H396 PolarHBondContact O-N 3.15Å; H396-K399 PolarHBondContact O-N 3.32Å; H396-M400 PolarHBondContact O-N 2.93Å
397	I	98.4	Very high	96.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-45.5	178.1	-62.6	166	0	0	0	110.6	L300 D304 L308 L391 N393 V394 K399 M400 Q401	L300-I397 HydrophobicContact CD1-CG1 4.23Å; L300-I397 HydrophobicContact CD2-CG1 4.03Å; D304-I397 HydrophobicContact CB-CD1 4.07Å; L308-I397 HydrophobicContact CD1-CD1 4.16Å; L308-I397 HydrophobicContact CD1-CG1 4.38Å; L308-I397 HydrophobicContact CD1-CG2 4.24Å; L308-I397 HydrophobicContact CD2-CD1 4.46Å; L308-I397 HydrophobicContact CD2-CG2 4.02Å; L391-I397 HydrophobicContact CB-CD1 4.41Å; L391-I397 HydrophobicContact CD1-CD1 3.9Å; L391-I397 HydrophobicContact CD2-CD1 3.74Å; L391-I397 HydrophobicContact CG-CD1 4.23Å; N393-I397 PolarHBondContact O-N 3.1Å; V394-I397 PolarHBondContact O-N 3.5Å; V394-I397 VanDerWaalsContact O-N 3.12Å; I397-K399 VanDerWaalsContact C-N 3.31Å; I397-K399 PolarHBondContact O-N 3.23Å; I397-M400 WeakPolarHBondContact O-CB 3.28Å; I397-M400 PolarHBondContact O-N 3.3Å; I397-Q401 PolarHBondContact O-N 3.45Å
398	E	97.8	Very high	96.8	Very high	95 Å²	95	51.7 Å²	51.7	44%	0.444	30%	0.295	S	S	.	.	H	α-helix	trans	-60.4	-40.9	176	-74.2	-178.9	160.5	0	0	111.6	V394 M400 Q401 E402	V394-E398 HydrophobicContact CG1-CG 4.04Å; V394-E398 WeakPolarHBondContact O-CG 3.49Å; V394-E398 PolarHBondContact O-N 3.45Å; E398-M400 VanDerWaalsContact C-N 3.33Å; E398-M400 PolarHBondContact O-N 3.47Å; E398-Q401 PolarHBondContact O-N 2.9Å; E398-E402 WeakPolarHBondContact O-CB 3.38Å; E398-E402 PolarHBondContact O-N 3.25Å
399	K	96.4	Very high	96.9	Very high	128 Å²	128	56 Å²	56	56%	0.557	31%	0.311	S	S	*	.	H	α-helix	trans	-64.7	-40	176.7	-171.4	70.4	-152.5	159.9	0	111.9	G395 H396 I397 E402 G403	G395-K399 WeakPolarHBondContact O-CB 3.32Å; G395-K399 PolarHBondContact O-N 2.66Å; H396-K399 PolarHBondContact O-N 3.32Å; I397-K399 VanDerWaalsContact C-N 3.31Å; I397-K399 PolarHBondContact O-N 3.23Å; K399-E402 IonicContact NZ-OE1 3.59Å; K399-E402 IonicContact NZ-OE2 2.74Å; K399-E402 PolarHBondContact NZ-OE2 3.14Å; K399-G403 PolarHBondContact O-N 2.72Å
400	M	96.8	Very high	96.9	Very high	24 Å²	24	55.8 Å²	55.8	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-46.1	174.2	-179.3	177.5	171.1	0	0	111.1	I294 P295 F297 L300 H396 I397 E398 E402 G403 I404	I294-M400 HydrophobicContact CB-CE 4.32Å; I294-M400 HydrophobicContact CG2-CE 3.46Å; I294-M400 VanDerWaalsContact CG2-CE 3.46Å; P295-M400 VanDerWaalsContact O-CE 3.22Å; P295-M400 WeakPolarHBondContact O-CE 3.39Å; F297-M400 HydrophobicContact CB-CE 3.95Å; L300-M400 HydrophobicContact CD1-SD 4.44Å; H396-M400 PolarHBondContact O-N 2.93Å; I397-M400 WeakPolarHBondContact O-CB 3.28Å; I397-M400 PolarHBondContact O-N 3.3Å; E398-M400 VanDerWaalsContact C-N 3.33Å; E398-M400 PolarHBondContact O-N 3.47Å; M400-E402 PolarHBondContact O-N 2.82Å; M400-G403 PolarHBondContact O-N 2.96Å; M400-I404 HydrophobicContact CE-CD1 4.22Å; M400-I404 HydrophobicContact CG-CD1 4.36Å; M400-I404 PolarHBondContact O-N 3.09Å
401	Q	97.9	Very high	96.9	Very high	31 Å²	31	54.8 Å²	54.8	15%	0.145	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-43.6	176.6	-159.3	-178.6	17.6	0	0	112.1	A381 C384 I397 E398 G403 I404 V405	A381-Q401 PolarHBondContact O-NE2 2.6Å; C384-Q401 WeakPolarHBondContact O-CB 3.44Å; C384-Q401 WeakPolarHBondContact O-CG 3.28Å; I397-Q401 PolarHBondContact O-N 3.45Å; E398-Q401 PolarHBondContact O-N 2.9Å; Q401-G403 VanDerWaalsContact C-N 3.25Å; Q401-G403 PolarHBondContact O-N 3.41Å; Q401-I404 PolarHBondContact O-N 3.21Å; Q401-I404 VanDerWaalsContact O-N 3.09Å; Q401-V405 HydrophobicContact CG-CG2 4.06Å; Q401-V405 WeakPolarHBondContact O-CB 3.32Å; Q401-V405 WeakPolarHBondContact O-CG2 3.34Å; Q401-V405 PolarHBondContact O-N 2.91Å
402	E	96.4	Very high	96.8	Very high	111 Å²	111	54 Å²	54	52%	0.519	28%	0.279	S	S	.	.	H	α-helix	trans	-56.2	-43.3	179.1	-172	-167.7	168.5	0	0	110.6	E398 K399 M400 H406	E398-E402 WeakPolarHBondContact O-CB 3.38Å; E398-E402 PolarHBondContact O-N 3.25Å; K399-E402 IonicContact NZ-OE1 3.59Å; K399-E402 IonicContact NZ-OE2 2.74Å; K399-E402 PolarHBondContact NZ-OE2 3.14Å; M400-E402 PolarHBondContact O-N 2.82Å; E402-H406 WeakPolarHBondContact O-CB 3.47Å; E402-H406 PolarHBondContact O-N 3.11Å
403	G	95.7	Very high	96.7	Very high	25 Å²	25	54.1 Å²	54.1	26%	0.258	28%	0.277	S	S	.	.	H	α-helix	trans	-60	-48.5	173.8	0	0	0	0	0	112.5	K399 M400 Q401 H406 V407	K399-G403 PolarHBondContact O-N 2.72Å; M400-G403 PolarHBondContact O-N 2.96Å; Q401-G403 VanDerWaalsContact C-N 3.25Å; Q401-G403 PolarHBondContact O-N 3.41Å; G403-H406 PolarHBondContact O-N 2.94Å; G403-V407 WeakPolarHBondContact O-CG2 3.5Å; G403-V407 PolarHBondContact O-N 3.31Å
404	I	98	Very high	96.5	Very high	3 Å²	3	55 Å²	55	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-46	179.3	-62.9	166.7	0	0	0	111.2	I210 I294 A380 A381 C384 M400 Q401 H406 V407 L408	I210-I404 HydrophobicContact CD1-CG1 4.22Å; I210-I404 HydrophobicContact CD1-CG2 4.46Å; I294-I404 HydrophobicContact CG2-CD1 4.04Å; A380-I404 HydrophobicContact CB-CD1 4.35Å; A380-I404 HydrophobicContact CB-CG2 3.99Å; A381-I404 HydrophobicContact CB-CG2 4.02Å; C384-I404 HydrophobicContact CB-CD1 4.01Å; M400-I404 HydrophobicContact CE-CD1 4.22Å; M400-I404 HydrophobicContact CG-CD1 4.36Å; M400-I404 PolarHBondContact O-N 3.09Å; Q401-I404 PolarHBondContact O-N 3.21Å; Q401-I404 VanDerWaalsContact O-N 3.09Å; I404-H406 VanDerWaalsContact C-N 3.31Å; I404-H406 PolarHBondContact O-N 3.48Å; I404-V407 PolarHBondContact O-N 3.13Å; I404-L408 WeakPolarHBondContact O-CB 3.4Å; I404-L408 PolarHBondContact O-N 3.06Å
405	V	97.9	Very high	96.2	Very high	27 Å²	27	55.7 Å²	55.7	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-35	179.8	171.9	0	0	0	0	111.2	A381 Q401 R409 F423	A381-V405 HydrophobicContact CB-CG2 4.01Å; Q401-V405 HydrophobicContact CG-CG2 4.06Å; Q401-V405 WeakPolarHBondContact O-CB 3.32Å; Q401-V405 WeakPolarHBondContact O-CG2 3.34Å; Q401-V405 PolarHBondContact O-N 2.91Å; V405-R409 PolarHBondContact O-N 2.92Å; V405-F423 HydrophobicContact CG1-CE2 3.96Å; V405-F423 HydrophobicContact CG1-CZ 3.64Å
406	H	96.3	Very high	96	Very high	70 Å²	70	55.1 Å²	55.1	32%	0.324	27%	0.274	S	S	.	.	H	α-helix	trans	-64.7	-47.9	173.6	-176.3	57.2	0	0	0	111.5	E402 G403 I404 L408 R409 L410	E402-H406 WeakPolarHBondContact O-CB 3.47Å; E402-H406 PolarHBondContact O-N 3.11Å; G403-H406 PolarHBondContact O-N 2.94Å; I404-H406 VanDerWaalsContact C-N 3.31Å; I404-H406 PolarHBondContact O-N 3.48Å; H406-L408 PolarHBondContact O-N 3.42Å; H406-R409 WeakPolarHBondContact O-CB 3.19Å; H406-R409 PolarHBondContact O-N 3.28Å; H406-L410 PolarHBondContact O-N 2.83Å; H406-L410 VanDerWaalsContact O-N 3.17Å
407	V	96.9	Very high	95.7	Very high	5 Å²	5	54.3 Å²	54.3	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-46.3	174	173.1	0	0	0	0	111.3	L203 L206 A207 L377 G403 I404 R409 L410 H411	L203-V407 HydrophobicContact CB-CG2 3.91Å; L203-V407 HydrophobicContact CD2-CG2 3.42Å; L203-V407 VanDerWaalsContact CD2-CG2 3.42Å; L203-V407 HydrophobicContact CG-CG2 4.24Å; L206-V407 HydrophobicContact CB-CG2 4.29Å; L206-V407 HydrophobicContact CD2-CG2 3.87Å; L206-V407 HydrophobicContact CG-CG2 4.26Å; A207-V407 HydrophobicContact CB-CG1 3.52Å; L377-V407 HydrophobicContact CD1-CG1 4.08Å; L377-V407 HydrophobicContact CD2-CB 4.48Å; L377-V407 HydrophobicContact CD2-CG1 3.82Å; G403-V407 WeakPolarHBondContact O-CG2 3.5Å; G403-V407 PolarHBondContact O-N 3.31Å; I404-V407 PolarHBondContact O-N 3.13Å; V407-R409 VanDerWaalsContact C-N 3.3Å; V407-R409 PolarHBondContact O-N 3.03Å; V407-L410 PolarHBondContact O-N 3.14Å; V407-H411 VanDerWaalsContact O-CB 3.26Å; V407-H411 WeakPolarHBondContact O-CB 3.46Å; V407-H411 PolarHBondContact O-N 3.3Å
408	L	98	Very high	95.4	Very high	3 Å²	3	62 Å²	62	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-56.7	-43.5	177.3	176.9	61.3	0	0	0	111.9	L377 F378 I404 H406 H411 L412 L426	L377-L408 HydrophobicContact CB-CB 4.17Å; L377-L408 HydrophobicContact CB-CD1 3.67Å; L377-L408 HydrophobicContact CB-CG 4.42Å; L377-L408 HydrophobicContact CD1-CD1 4.4Å; F378-L408 HydrophobicContact CD2-CD2 4.42Å; I404-L408 WeakPolarHBondContact O-CB 3.4Å; I404-L408 PolarHBondContact O-N 3.06Å; H406-L408 PolarHBondContact O-N 3.42Å; L408-H411 PolarHBondContact O-N 3.42Å; L408-L412 HydrophobicContact CD1-CD1 3.82Å; L408-L412 HydrophobicContact CD1-CG 3.96Å; L408-L412 HydrophobicContact CG-CD1 3.99Å; L408-L412 HydrophobicContact CG-CG 4.5Å; L408-L412 WeakPolarHBondContact O-CB 3.49Å; L408-L412 VanDerWaalsContact O-CG 3.28Å; L408-L412 WeakPolarHBondContact O-CG 3.44Å; L408-L412 PolarHBondContact O-N 3.09Å; L408-L426 HydrophobicContact CD1-CD2 4.21Å; L408-L426 HydrophobicContact CD2-CD2 4.18Å
409	R	97.4	Very high	95.1	Very high	104 Å²	104	59.9 Å²	59.9	39%	0.392	31%	0.311	S	S	.	.	H	α-helix	trans	-60	-49.5	177.6	-176	-175	-61.6	163.3	4	111.7	V405 H406 V407 Q413 F423	V405-R409 PolarHBondContact O-N 2.92Å; H406-R409 WeakPolarHBondContact O-CB 3.19Å; H406-R409 PolarHBondContact O-N 3.28Å; V407-R409 VanDerWaalsContact C-N 3.3Å; V407-R409 PolarHBondContact O-N 3.03Å; R409-Q413 VanDerWaalsContact O-CG 3.3Å; R409-Q413 WeakPolarHBondContact O-CG 3.47Å; R409-Q413 PolarHBondContact O-N 3.35Å; R409-Q413 VanDerWaalsContact O-N 3.11Å; R409-F423 HydrophobicContact CB-CD1 4.48Å; R409-F423 HydrophobicContact CB-CD2 3.81Å; R409-F423 HydrophobicContact CB-CE1 4.44Å; R409-F423 HydrophobicContact CB-CE2 3.75Å; R409-F423 HydrophobicContact CB-CG 4.18Å; R409-F423 HydrophobicContact CB-CZ 4.09Å; R409-F423 HydrophobicContact CG-CD1 4.08Å; R409-F423 HydrophobicContact CG-CD2 4.17Å; R409-F423 HydrophobicContact CG-CE1 4.32Å; R409-F423 HydrophobicContact CG-CE2 4.39Å; R409-F423 HydrophobicContact CG-CG 4Å; R409-F423 HydrophobicContact CG-CZ 4.46Å; R409-F423 VanDerWaalsContact NE-CE1 3.26Å
410	L	94.6	Very high	94.9	Very high	65 Å²	65	60.5 Å²	60.5	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-66.3	-41.2	-179	-66.1	178.3	0	0	0	111.5	L203 H406 V407 Q413 S414	L203-L410 HydrophobicContact CD1-CD1 3.83Å; H406-L410 PolarHBondContact O-N 2.83Å; H406-L410 VanDerWaalsContact O-N 3.17Å; V407-L410 PolarHBondContact O-N 3.14Å; L410-Q413 PolarHBondContact O-N 3.38Å; L410-S414 WeakPolarHBondContact O-CB 3.49Å; L410-S414 PolarHBondContact O-N 3.06Å
411	H	95.5	Very high	94.8	Very high	44 Å²	44	65.9 Å²	65.9	20%	0.204	34%	0.342	C	S	.	.	H	α-helix	trans	-61.6	-47.4	178.5	-173.6	75.9	0	0	0	111.5	S373 D374 L377 V407 L408 Q413 S414 N415	S373-H411 PolarHBondContact OG-CE1 2.91Å; S373-H411 PolarHBondContact OG-NE2 3.23Å; D374-H411 IonicContact OD1-CD2 3.49Å; D374-H411 PolarHBondContact OD1-CD2 3.13Å; D374-H411 IonicContact OD1-NE2 3.58Å; D374-H411 PolarHBondContact OD1-NE2 3.42Å; L377-H411 HydrophobicContact CD1-CB 3.79Å; V407-H411 VanDerWaalsContact O-CB 3.26Å; V407-H411 WeakPolarHBondContact O-CB 3.46Å; V407-H411 PolarHBondContact O-N 3.3Å; L408-H411 PolarHBondContact O-N 3.42Å; H411-Q413 PolarHBondContact O-N 2.9Å; H411-S414 WeakPolarHBondContact O-CB 3.48Å; H411-S414 PolarHBondContact O-N 3.49Å; H411-N415 VanDerWaalsContact O-CB 3.32Å; H411-N415 WeakPolarHBondContact O-CB 3.41Å; H411-N415 PolarHBondContact O-N 3.32Å
412	L	95.6	Very high	94.8	Very high	3 Å²	3	64.5 Å²	64.5	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-41.2	176.4	-70.2	169.8	0	0	0	112.6	L370 D374 L408 S414 N415 H416 L422 F423 L426	L370-L412 HydrophobicContact CD2-CD2 3.87Å; D374-L412 HydrophobicContact CB-CD2 4.06Å; D374-L412 WeakPolarHBondContact OD1-CD2 3.29Å; L408-L412 HydrophobicContact CD1-CD1 3.82Å; L408-L412 HydrophobicContact CD1-CG 3.96Å; L408-L412 HydrophobicContact CG-CD1 3.99Å; L408-L412 HydrophobicContact CG-CG 4.5Å; L408-L412 WeakPolarHBondContact O-CB 3.49Å; L408-L412 VanDerWaalsContact O-CG 3.28Å; L408-L412 WeakPolarHBondContact O-CG 3.44Å; L408-L412 PolarHBondContact O-N 3.09Å; L412-S414 VanDerWaalsContact C-N 3.26Å; L412-S414 PolarHBondContact O-N 3.05Å; L412-N415 PolarHBondContact O-N 3.46Å; L412-H416 WeakPolarHBondContact O-CA 3.49Å; L412-H416 WeakPolarHBondContact O-CB 3.35Å; L412-H416 PolarHBondContact O-N 3.47Å; L412-L422 HydrophobicContact CB-CD2 4.49Å; L412-L422 HydrophobicContact CD2-CD2 3.73Å; L412-L422 HydrophobicContact CD2-CG 4.18Å; L412-F423 HydrophobicContact CD1-CB 4.22Å; L412-F423 HydrophobicContact CD1-CD2 4.13Å; L412-L426 HydrophobicContact CD1-CD2 3.76Å
413	Q	93.4	Very high	94.8	Very high	117 Å²	117	60.4 Å²	60.4	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-35.1	176.7	-75.6	175.7	-17.2	0	0	112.5	R409 L410 H411	R409-Q413 VanDerWaalsContact O-CG 3.3Å; R409-Q413 WeakPolarHBondContact O-CG 3.47Å; R409-Q413 PolarHBondContact O-N 3.35Å; R409-Q413 VanDerWaalsContact O-N 3.11Å; L410-Q413 PolarHBondContact O-N 3.38Å; H411-Q413 PolarHBondContact O-N 2.9Å
414	S	91.4	Very high	94.9	Very high	96 Å²	96	62.4 Å²	62.4	67%	0.671	32%	0.324	S	S	*	.	H	α-helix	trans	-74.6	-45.9	177.2	170.5	0	0	0	0	112.3	L410 H411 L412	L410-S414 WeakPolarHBondContact O-CB 3.49Å; L410-S414 PolarHBondContact O-N 3.06Å; H411-S414 WeakPolarHBondContact O-CB 3.48Å; H411-S414 PolarHBondContact O-N 3.49Å; L412-S414 VanDerWaalsContact C-N 3.26Å; L412-S414 PolarHBondContact O-N 3.05Å
415	N	91.8	Very high	94.9	Very high	66 Å²	66	66.5 Å²	66.5	35%	0.353	34%	0.342	S	S	.	.	H	α-helix	trans	-83.4	-26.7	-171	-153.3	37.1	0	0	0	112.3	D371 H411 L412 P417	D371-N415 PolarHBondContact OD2-ND2 2.75Å; H411-N415 VanDerWaalsContact O-CB 3.32Å; H411-N415 WeakPolarHBondContact O-CB 3.41Å; H411-N415 PolarHBondContact O-N 3.32Å; L412-N415 PolarHBondContact O-N 3.46Å; N415-P417 VanDerWaalsContact C-CD 3.48Å
416	H	93	Very high	94.9	Very high	39 Å²	39	65.3 Å²	65.3	18%	0.181	34%	0.335	C	S	.	.			trans	-129	62	-177.9	-55.3	-85	0	0	0	111.3	D374 L412 D418 D419 L422	D374-H416 IonicContact OD1-CD2 2.75Å; D374-H416 IonicContact OD1-NE2 2.84Å; D374-H416 IonicContact OD2-CD2 3.52Å; D374-H416 IonicContact OD2-CE1 3.85Å; D374-H416 IonicContact OD2-NE2 3.63Å; D374-H416 PolarHBondContact OD2-NE2 2.66Å; L412-H416 WeakPolarHBondContact O-CA 3.49Å; L412-H416 WeakPolarHBondContact O-CB 3.35Å; L412-H416 PolarHBondContact O-N 3.47Å; H416-D418 PolarHBondContact O-N 3.14Å; H416-D418 VanDerWaalsContact O-N 3.1Å; H416-D419 PolarHBondContact O-N 3.2Å; H416-L422 HydrophobicContact CB-CD2 3.5Å; H416-L422 VanDerWaalsContact CD2-CD2 3.49Å; H416-L422 WeakPolarHBondContact CD2-CD2 3.5Å; H416-L422 VanDerWaalsContact CG-CD2 3.42Å
417	P	89.8	Confident	94.9	Very high	85 Å²	85	65.1 Å²	65.1	55%	0.552	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.2	-174.7	26.5	-35.6	0	0	0	113.4	N415	N415-P417 VanDerWaalsContact C-CD 3.48Å
418	D	92.5	Very high	94.9	Very high	161 Å²	161	70.1 Å²	70.1	86%	0.861	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-25.3	-179	-63.1	-34.3	0	0	0	113.4	H416	H416-D418 PolarHBondContact O-N 3.14Å; H416-D418 VanDerWaalsContact O-N 3.1Å
419	D	91.8	Very high	94.9	Very high	50 Å²	50	71.2 Å²	71.2	27%	0.267	36%	0.364	S	S	.	.			trans	-104.5	77.8	176.9	-166.2	-8.2	0	0	0	111.6	H416 F421 L422 K425	H416-D419 PolarHBondContact O-N 3.2Å; D419-F421 PolarHBondContact O-N 3.18Å; D419-F421 PolarHBondContact OD1-N 3.13Å; D419-L422 HydrophobicContact CB-CB 4.02Å; D419-L422 WeakPolarHBondContact O-CB 3.35Å; D419-L422 PolarHBondContact O-N 3.46Å; D419-L422 PolarHBondContact OD1-N 3.37Å; D419-K425 IonicContact OD1-NZ 3.74Å; D419-K425 PolarHBondContact OD1-NZ 3.21Å; D419-K425 IonicContact OD2-NZ 3.63Å; D419-K425 PolarHBondContact OD2-NZ 2.86Å
420	I	92.4	Very high	94.9	Very high	141 Å²	141	67.1 Å²	67.1	72%	0.723	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25	-178.7	-53.8	169.4	0	0	0	112.5
421	F	95.2	Very high	94.9	Very high	138 Å²	138	66 Å²	66	61%	0.605	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	12.9	-179.4	-65.1	-70.6	0	0	0	113.4	D419 F423 P424 K425	D419-F421 PolarHBondContact O-N 3.18Å; D419-F421 PolarHBondContact OD1-N 3.13Å; F421-F423 PolarHBondContact O-N 3.47Å; F421-P424 HydrophobicContact CB-CG 4.23Å; F421-P424 HydrophobicContact CD1-CG 4.24Å; F421-P424 VanDerWaalsContact O-CD 3.22Å; F421-P424 WeakPolarHBondContact O-CD 3.43Å; F421-P424 VanDerWaalsContact O-CG 3.26Å; F421-P424 WeakPolarHBondContact O-CG 3.44Å; F421-K425 WeakPolarHBondContact O-CB 3.49Å; F421-K425 WeakPolarHBondContact O-CD 3.48Å; F421-K425 WeakPolarHBondContact O-CG 3.38Å; F421-K425 PolarHBondContact O-N 3.08Å; F421-K425 VanDerWaalsContact O-N 3.1Å
422	L	96.5	Very high	95	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-44.9	-179.2	-173.2	56.5	0	0	0	112.6	L368 L370 L412 H416 D419 K425 L426	L368-L422 HydrophobicContact CB-CD1 3.96Å; L368-L422 HydrophobicContact CD2-CD1 4.1Å; L368-L422 HydrophobicContact CG-CD1 4.48Å; L370-L422 HydrophobicContact CD2-CD1 4.08Å; L370-L422 HydrophobicContact CD2-CD2 4.03Å; L370-L422 HydrophobicContact CD2-CG 4.27Å; L412-L422 HydrophobicContact CB-CD2 4.49Å; L412-L422 HydrophobicContact CD2-CD2 3.73Å; L412-L422 HydrophobicContact CD2-CG 4.18Å; H416-L422 HydrophobicContact CB-CD2 3.5Å; H416-L422 VanDerWaalsContact CD2-CD2 3.49Å; H416-L422 WeakPolarHBondContact CD2-CD2 3.5Å; H416-L422 VanDerWaalsContact CG-CD2 3.42Å; D419-L422 HydrophobicContact CB-CB 4.02Å; D419-L422 WeakPolarHBondContact O-CB 3.35Å; D419-L422 PolarHBondContact O-N 3.46Å; D419-L422 PolarHBondContact OD1-N 3.37Å; L422-K425 WeakPolarHBondContact O-CB 3.11Å; L422-K425 PolarHBondContact O-N 2.85Å; L422-L426 WeakPolarHBondContact O-CB 3.47Å; L422-L426 PolarHBondContact O-N 3.12Å
423	F	97.9	Very high	95.1	Very high	24 Å²	24	66.2 Å²	66.2	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-57.5	-53.9	178.4	178.5	-104.6	0	0	0	113.3	V405 R409 L412 F421 K425 L426 L427	V405-F423 HydrophobicContact CG1-CE2 3.96Å; V405-F423 HydrophobicContact CG1-CZ 3.64Å; R409-F423 HydrophobicContact CB-CD1 4.48Å; R409-F423 HydrophobicContact CB-CD2 3.81Å; R409-F423 HydrophobicContact CB-CE1 4.44Å; R409-F423 HydrophobicContact CB-CE2 3.75Å; R409-F423 HydrophobicContact CB-CG 4.18Å; R409-F423 HydrophobicContact CB-CZ 4.09Å; R409-F423 HydrophobicContact CG-CD1 4.08Å; R409-F423 HydrophobicContact CG-CD2 4.17Å; R409-F423 HydrophobicContact CG-CE1 4.32Å; R409-F423 HydrophobicContact CG-CE2 4.39Å; R409-F423 HydrophobicContact CG-CG 4Å; R409-F423 HydrophobicContact CG-CZ 4.46Å; R409-F423 VanDerWaalsContact NE-CE1 3.26Å; L412-F423 HydrophobicContact CD1-CB 4.22Å; L412-F423 HydrophobicContact CD1-CD2 4.13Å; F421-F423 PolarHBondContact O-N 3.47Å; F423-K425 PolarHBondContact O-N 3.27Å; F423-L426 WeakPolarHBondContact O-CB 3.27Å; F423-L426 PolarHBondContact O-N 3.46Å; F423-L426 VanDerWaalsContact O-N 3.16Å; F423-L427 HydrophobicContact CD1-CD1 4.27Å; F423-L427 HydrophobicContact CE1-CD1 3.61Å; F423-L427 HydrophobicContact CE1-CG 4.25Å; F423-L427 HydrophobicContact CE2-CD1 4.5Å; F423-L427 HydrophobicContact CE2-CD2 4.28Å; F423-L427 HydrophobicContact CE2-CG 4.38Å; F423-L427 HydrophobicContact CZ-CD1 3.75Å; F423-L427 HydrophobicContact CZ-CD2 4.17Å; F423-L427 HydrophobicContact CZ-CG 4.11Å; F423-L427 PolarHBondContact O-N 3.13Å
424	P	97.7	Very high	95.3	Very high	67 Å²	67	64.4 Å²	64.4	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-34.4	176.7	22.9	-31.9	0	0	0	113.4	F421 L426 L427 Q428	F421-P424 HydrophobicContact CB-CG 4.23Å; F421-P424 HydrophobicContact CD1-CG 4.24Å; F421-P424 VanDerWaalsContact O-CD 3.22Å; F421-P424 WeakPolarHBondContact O-CD 3.43Å; F421-P424 VanDerWaalsContact O-CG 3.26Å; F421-P424 WeakPolarHBondContact O-CG 3.44Å; P424-L426 VanDerWaalsContact C-N 3.27Å; P424-L426 PolarHBondContact O-N 3.11Å; P424-L427 PolarHBondContact O-N 3.32Å; P424-Q428 PolarHBondContact O-N 3.32Å; P424-Q428 VanDerWaalsContact O-N 3.12Å
425	K	97.9	Very high	95.5	Very high	90 Å²	90	64.8 Å²	64.8	39%	0.391	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-40	172	-73.1	167.5	-177.7	166	0	111.4	L368 D419 F421 L422 F423 Q428 K429	L368-K425 HydrophobicContact CD2-CB 4.16Å; L368-K425 HydrophobicContact CD2-CD 4.15Å; D419-K425 IonicContact OD1-NZ 3.74Å; D419-K425 PolarHBondContact OD1-NZ 3.21Å; D419-K425 IonicContact OD2-NZ 3.63Å; D419-K425 PolarHBondContact OD2-NZ 2.86Å; F421-K425 WeakPolarHBondContact O-CB 3.49Å; F421-K425 WeakPolarHBondContact O-CD 3.48Å; F421-K425 WeakPolarHBondContact O-CG 3.38Å; F421-K425 PolarHBondContact O-N 3.08Å; F421-K425 VanDerWaalsContact O-N 3.1Å; L422-K425 WeakPolarHBondContact O-CB 3.11Å; L422-K425 PolarHBondContact O-N 2.85Å; F423-K425 PolarHBondContact O-N 3.27Å; K425-Q428 WeakPolarHBondContact O-CB 3.5Å; K425-Q428 PolarHBondContact O-N 3.23Å; K425-K429 PolarHBondContact O-N 2.92Å
426	L	97.8	Very high	95.8	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-70.3	-39.3	179.8	-171.3	56.9	0	0	0	112.2	F365 L368 L370 F378 L408 L412 L422 F423 P424 Q428 K429 M430	F365-L426 HydrophobicContact CE2-CD1 3.62Å; F365-L426 HydrophobicContact CZ-CD1 4.18Å; L368-L426 HydrophobicContact CD1-CD1 4.18Å; L370-L426 HydrophobicContact CD1-CD1 3.64Å; L370-L426 HydrophobicContact CD1-CD2 4.27Å; F378-L426 HydrophobicContact CB-CD2 4.32Å; F378-L426 HydrophobicContact CD1-CD1 4.34Å; F378-L426 HydrophobicContact CD2-CD1 3.68Å; F378-L426 HydrophobicContact CD2-CD2 3.7Å; F378-L426 HydrophobicContact CD2-CG 3.48Å; F378-L426 VanDerWaalsContact CD2-CG 3.48Å; F378-L426 HydrophobicContact CE1-CD1 4.23Å; F378-L426 HydrophobicContact CE2-CD1 3.56Å; F378-L426 HydrophobicContact CE2-CD2 4.29Å; F378-L426 HydrophobicContact CE2-CG 3.55Å; F378-L426 HydrophobicContact CG-CD1 4.07Å; F378-L426 HydrophobicContact CG-CD2 4.18Å; F378-L426 HydrophobicContact CG-CG 4.23Å; F378-L426 HydrophobicContact CZ-CD1 3.85Å; F378-L426 HydrophobicContact CZ-CG 4.34Å; L408-L426 HydrophobicContact CD1-CD2 4.21Å; L408-L426 HydrophobicContact CD2-CD2 4.18Å; L412-L426 HydrophobicContact CD1-CD2 3.76Å; L422-L426 WeakPolarHBondContact O-CB 3.47Å; L422-L426 PolarHBondContact O-N 3.12Å; F423-L426 WeakPolarHBondContact O-CB 3.27Å; F423-L426 PolarHBondContact O-N 3.46Å; F423-L426 VanDerWaalsContact O-N 3.16Å; P424-L426 VanDerWaalsContact C-N 3.27Å; P424-L426 PolarHBondContact O-N 3.11Å; L426-Q428 VanDerWaalsContact C-N 3.29Å; L426-Q428 PolarHBondContact O-N 3.34Å; L426-K429 WeakPolarHBondContact O-CB 3.36Å; L426-K429 PolarHBondContact O-N 3.48Å; L426-M430 PolarHBondContact O-N 3.24Å
427	L	95.8	Very high	96	Very high	66 Å²	66	60.3 Å²	60.3	35%	0.346	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-39	172.4	-66.4	-176.3	0	0	0	112	F423 P424 K429 M430	F423-L427 HydrophobicContact CD1-CD1 4.27Å; F423-L427 HydrophobicContact CE1-CD1 3.61Å; F423-L427 HydrophobicContact CE1-CG 4.25Å; F423-L427 HydrophobicContact CE2-CD1 4.5Å; F423-L427 HydrophobicContact CE2-CD2 4.28Å; F423-L427 HydrophobicContact CE2-CG 4.38Å; F423-L427 HydrophobicContact CZ-CD1 3.75Å; F423-L427 HydrophobicContact CZ-CD2 4.17Å; F423-L427 HydrophobicContact CZ-CG 4.11Å; F423-L427 PolarHBondContact O-N 3.13Å; P424-L427 PolarHBondContact O-N 3.32Å; L427-K429 PolarHBondContact O-N 2.86Å; L427-M430 HydrophobicContact CD2-SD 3.93Å; L427-M430 WeakPolarHBondContact O-CB 3.33Å; L427-M430 PolarHBondContact O-N 3.44Å
428	Q	97.6	Very high	96.3	Very high	111 Å²	111	58.1 Å²	58.1	52%	0.519	29%	0.294	S	S	.	.	H	α-helix	trans	-60	-32.4	174.1	-177	59.2	54.7	0	0	112	P424 K425 L426 M430 A431 D432	P424-Q428 PolarHBondContact O-N 3.32Å; P424-Q428 VanDerWaalsContact O-N 3.12Å; K425-Q428 WeakPolarHBondContact O-CB 3.5Å; K425-Q428 PolarHBondContact O-N 3.23Å; L426-Q428 VanDerWaalsContact C-N 3.29Å; L426-Q428 PolarHBondContact O-N 3.34Å; Q428-M430 VanDerWaalsContact C-N 3.26Å; Q428-M430 PolarHBondContact O-N 3.23Å; Q428-A431 WeakPolarHBondContact O-CB 3.47Å; Q428-A431 PolarHBondContact O-N 2.81Å; Q428-A431 VanDerWaalsContact O-N 3.15Å; Q428-D432 PolarHBondContact NE2-OD1 3.36Å; Q428-D432 PolarHBondContact O-N 3.33Å; Q428-D432 VanDerWaalsContact O-N 3.13Å
429	K	98.1	Very high	96.4	Very high	26 Å²	26	54.2 Å²	54.2	11%	0.113	27%	0.27	C	S	.	.	H	α-helix	trans	-66.7	-25.2	176.1	-63.4	-71.2	155.1	-148.8	0	113.4	F361 F365 L368 F378 K425 L426 L427 A431 D432 L433	F361-K429 HydrophobicContact CE2-CB 4.4Å; F361-K429 HydrophobicContact CE2-CD 3.95Å; F361-K429 HydrophobicContact CZ-CD 4.48Å; F365-K429 HydrophobicContact CD2-CB 4.04Å; F365-K429 HydrophobicContact CD2-CD 4.06Å; F365-K429 HydrophobicContact CD2-CG 3.84Å; F365-K429 HydrophobicContact CE2-CB 4.14Å; F365-K429 HydrophobicContact CE2-CG 4.28Å; L368-K429 HydrophobicContact CD1-CG 3.94Å; F378-K429 HydrophobicContact CZ-CB 4.26Å; K425-K429 PolarHBondContact O-N 2.92Å; L426-K429 WeakPolarHBondContact O-CB 3.36Å; L426-K429 PolarHBondContact O-N 3.48Å; L427-K429 PolarHBondContact O-N 2.86Å; K429-A431 VanDerWaalsContact C-N 3.33Å; K429-D432 IonicContact NZ-OD2 3.54Å; K429-D432 PolarHBondContact NZ-OD2 2.96Å; K429-D432 PolarHBondContact O-N 3.36Å; K429-L433 WeakPolarHBondContact O-CB 3.46Å; K429-L433 VanDerWaalsContact O-CG 3.31Å; K429-L433 WeakPolarHBondContact O-CG 3.49Å; K429-L433 PolarHBondContact O-N 2.97Å
430	M	96.2	Very high	96.6	Very high	17 Å²	17	52.9 Å²	52.9	8%	0.084	26%	0.262	C	S	.	.	H	α-helix	trans	-65.6	-38	172.2	-57.6	179.4	70.4	0	0	111.5	F378 I382 L426 L427 Q428 L433 R434	F378-M430 HydrophobicContact CE2-CG 3.45Å; F378-M430 VanDerWaalsContact CE2-CG 3.45Å; F378-M430 HydrophobicContact CE2-SD 4.2Å; F378-M430 HydrophobicContact CZ-CG 3.77Å; I382-M430 HydrophobicContact CG1-CE 4.05Å; L426-M430 PolarHBondContact O-N 3.24Å; L427-M430 HydrophobicContact CD2-SD 3.93Å; L427-M430 WeakPolarHBondContact O-CB 3.33Å; L427-M430 PolarHBondContact O-N 3.44Å; Q428-M430 VanDerWaalsContact C-N 3.26Å; Q428-M430 PolarHBondContact O-N 3.23Å; M430-L433 PolarHBondContact O-N 3.08Å; M430-R434 PolarHBondContact O-N 3.44Å
431	A	95.1	Very high	96.6	Very high	42 Å²	42	47 Å²	47	35%	0.347	24%	0.236	S	C	.	.	H	α-helix	trans	-69	-43.4	175.2	0	0	0	0	0	111.5	Q428 K429 L433 R434 Q435	Q428-A431 WeakPolarHBondContact O-CB 3.47Å; Q428-A431 PolarHBondContact O-N 2.81Å; Q428-A431 VanDerWaalsContact O-N 3.15Å; K429-A431 VanDerWaalsContact C-N 3.33Å; A431-L433 VanDerWaalsContact C-N 3.26Å; A431-L433 PolarHBondContact O-N 3.09Å; A431-R434 PolarHBondContact O-N 3.2Å; A431-Q435 PolarHBondContact O-N 3.41Å
432	D	97.8	Very high	96.5	Very high	52 Å²	52	46.3 Å²	46.3	28%	0.278	23%	0.234	S	C	.	.	H	α-helix	trans	-59	-38.7	175	-61.7	-10.9	0	0	0	111.2	F361 Q428 K429 Q435 L436	F361-D432 HydrophobicContact CD2-CB 4.27Å; F361-D432 HydrophobicContact CE2-CB 4.13Å; Q428-D432 PolarHBondContact NE2-OD1 3.36Å; Q428-D432 PolarHBondContact O-N 3.33Å; Q428-D432 VanDerWaalsContact O-N 3.13Å; K429-D432 IonicContact NZ-OD2 3.54Å; K429-D432 PolarHBondContact NZ-OD2 2.96Å; K429-D432 PolarHBondContact O-N 3.36Å; D432-Q435 PolarHBondContact O-N 3.46Å; D432-L436 WeakPolarHBondContact O-CB 3.29Å; D432-L436 PolarHBondContact O-N 3.28Å
433	L	98.3	Very high	96.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-44	177	-81.6	169.2	0	0	0	112.6	E315 F318 A319 F361 F378 I382 K429 M430 A431 Q435 L436 V437	E315-L433 HydrophobicContact CB-CB 4.3Å; E315-L433 HydrophobicContact CG-CB 4.22Å; F318-L433 HydrophobicContact CB-CD2 3.63Å; A319-L433 HydrophobicContact CB-CD1 4.13Å; F361-L433 HydrophobicContact CD1-CD2 4.48Å; F361-L433 HydrophobicContact CE1-CD2 3.82Å; F361-L433 HydrophobicContact CE1-CG 4.38Å; F361-L433 HydrophobicContact CE2-CD2 3.95Å; F361-L433 HydrophobicContact CE2-CG 3.81Å; F361-L433 HydrophobicContact CZ-CD1 4.11Å; F361-L433 HydrophobicContact CZ-CD2 3.52Å; F361-L433 HydrophobicContact CZ-CG 3.58Å; F378-L433 HydrophobicContact CE1-CD1 3.99Å; F378-L433 HydrophobicContact CZ-CD1 4.1Å; I382-L433 HydrophobicContact CD1-CD1 3.71Å; K429-L433 WeakPolarHBondContact O-CB 3.46Å; K429-L433 VanDerWaalsContact O-CG 3.31Å; K429-L433 WeakPolarHBondContact O-CG 3.49Å; K429-L433 PolarHBondContact O-N 2.97Å; M430-L433 PolarHBondContact O-N 3.08Å; A431-L433 VanDerWaalsContact C-N 3.26Å; A431-L433 PolarHBondContact O-N 3.09Å; L433-Q435 VanDerWaalsContact C-N 3.3Å; L433-Q435 PolarHBondContact O-N 3.24Å; L433-L436 HydrophobicContact CD2-CD2 4.47Å; L433-L436 WeakPolarHBondContact O-CB 2.98Å; L433-L436 PolarHBondContact O-N 2.95Å; L433-L436 VanDerWaalsContact O-N 3.16Å; L433-V437 VanDerWaalsContact O-CG2 3.31Å; L433-V437 WeakPolarHBondContact O-CG2 3.09Å; L433-V437 PolarHBondContact O-N 3.48Å
434	R	96.3	Very high	96	Very high	78 Å²	78	46.4 Å²	46.4	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-56.6	-47	176.6	-74	168.1	179.5	159.5	-11.5	111.1	E315 D387 M430 A431 L436 V437 T438	E315-R434 VanDerWaalsContact OE1-CG 3.24Å; E315-R434 WeakPolarHBondContact OE1-CG 3.49Å; D387-R434 IonicContact OD2-CZ 2.74Å; D387-R434 IonicContact OD2-NH2 3.56Å; D387-R434 PolarHBondContact OD2-NH2 3.49Å; M430-R434 PolarHBondContact O-N 3.44Å; A431-R434 PolarHBondContact O-N 3.2Å; R434-L436 PolarHBondContact O-N 3.16Å; R434-V437 PolarHBondContact O-N 3.02Å; R434-T438 PolarHBondContact O-N 2.89Å; R434-T438 VanDerWaalsContact O-N 3.07Å; R434-T438 PolarHBondContact O-OG1 3.42Å
435	Q	96.4	Very high	95.6	Very high	105 Å²	105	48.1 Å²	48.1	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-46.3	176	-178.6	61.6	29.4	0	0	111.7	A431 D432 L433 V437 T438 E439	A431-Q435 PolarHBondContact O-N 3.41Å; D432-Q435 PolarHBondContact O-N 3.46Å; L433-Q435 VanDerWaalsContact C-N 3.3Å; L433-Q435 PolarHBondContact O-N 3.24Å; Q435-V437 VanDerWaalsContact C-N 3.3Å; Q435-V437 PolarHBondContact O-N 2.89Å; Q435-T438 PolarHBondContact O-N 3.14Å; Q435-E439 WeakPolarHBondContact CG-OE1 3.4Å; Q435-E439 PolarHBondContact NE2-OE1 2.82Å; Q435-E439 WeakPolarHBondContact O-CG 3.08Å; Q435-E439 PolarHBondContact O-N 3.21Å
436	L	98.1	Very high	95.3	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-36.4	179.7	-177.4	62.4	0	0	0	112.7	F318 P357 K358 F361 D432 L433 R434 H440	F318-L436 HydrophobicContact CB-CD2 4.09Å; F318-L436 HydrophobicContact CD2-CD2 3.79Å; F318-L436 HydrophobicContact CD2-CG 3.87Å; F318-L436 HydrophobicContact CE2-CG 4.16Å; F318-L436 HydrophobicContact CG-CD2 4.09Å; P357-L436 HydrophobicContact CB-CD1 3.55Å; K358-L436 HydrophobicContact CD-CD1 4.18Å; K358-L436 HydrophobicContact CG-CD1 4.38Å; K358-L436 HydrophobicContact CG-CD2 4.28Å; F361-L436 HydrophobicContact CB-CD2 3.82Å; F361-L436 HydrophobicContact CD1-CD2 4.27Å; F361-L436 HydrophobicContact CD2-CD2 4.32Å; F361-L436 HydrophobicContact CG-CD2 3.87Å; D432-L436 WeakPolarHBondContact O-CB 3.29Å; D432-L436 PolarHBondContact O-N 3.28Å; L433-L436 HydrophobicContact CD2-CD2 4.47Å; L433-L436 WeakPolarHBondContact O-CB 2.98Å; L433-L436 PolarHBondContact O-N 2.95Å; L433-L436 VanDerWaalsContact O-N 3.16Å; R434-L436 PolarHBondContact O-N 3.16Å; L436-H440 WeakPolarHBondContact O-CB 3.45Å; L436-H440 PolarHBondContact O-N 3.29Å
437	V	97.3	Very high	94.8	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-44.8	175.2	172.5	0	0	0	0	111.2	E315 F318 L433 R434 Q435 E439 H440 A441 M466	E315-V437 HydrophobicContact CG-CG2 3.89Å; F318-V437 HydrophobicContact CD2-CG2 3.83Å; F318-V437 HydrophobicContact CE2-CG2 3.76Å; L433-V437 VanDerWaalsContact O-CG2 3.31Å; L433-V437 WeakPolarHBondContact O-CG2 3.09Å; L433-V437 PolarHBondContact O-N 3.48Å; R434-V437 PolarHBondContact O-N 3.02Å; Q435-V437 VanDerWaalsContact C-N 3.3Å; Q435-V437 PolarHBondContact O-N 2.89Å; V437-E439 PolarHBondContact O-N 3.01Å; V437-H440 WeakPolarHBondContact O-CB 3.39Å; V437-H440 PolarHBondContact O-N 3.22Å; V437-A441 PolarHBondContact O-N 3.04Å; V437-M466 HydrophobicContact CG1-CE 3.78Å; V437-M466 HydrophobicContact CG1-SD 4.39Å
438	T	95.1	Very high	94.3	Very high	39 Å²	39	48 Å²	48	24%	0.239	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-47	176	-57.9	0	0	0	0	111.6	R434 Q435 H440 A441 Q442	R434-T438 PolarHBondContact O-N 2.89Å; R434-T438 VanDerWaalsContact O-N 3.07Å; R434-T438 PolarHBondContact O-OG1 3.42Å; Q435-T438 PolarHBondContact O-N 3.14Å; T438-H440 VanDerWaalsContact C-N 3.33Å; T438-H440 PolarHBondContact O-N 2.9Å; T438-A441 PolarHBondContact O-N 3.13Å; T438-Q442 WeakPolarHBondContact O-CG 3.16Å; T438-Q442 PolarHBondContact O-N 2.71Å; T438-Q442 VanDerWaalsContact O-N 3.1Å
439	E	94.9	Very high	93.7	Very high	78 Å²	78	47.9 Å²	47.9	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-39.2	176.9	-70.6	172.4	-171.8	0	0	112	Q435 V437 Q442 L443	Q435-E439 WeakPolarHBondContact CG-OE1 3.4Å; Q435-E439 PolarHBondContact NE2-OE1 2.82Å; Q435-E439 WeakPolarHBondContact O-CG 3.08Å; Q435-E439 PolarHBondContact O-N 3.21Å; V437-E439 PolarHBondContact O-N 3.01Å; E439-Q442 PolarHBondContact O-N 3.36Å; E439-L443 PolarHBondContact O-N 3.32Å; E439-L443 VanDerWaalsContact O-N 3.13Å
440	H	95.5	Very high	92.9	Very high	22 Å²	22	53 Å²	53	10%	0.102	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-46.1	175.3	-177.3	59	0	0	0	112.1	F318 L436 V437 T438 Q442 L443 V444 Y463	F318-H440 HydrophobicContact CE2-CB 4.13Å; F318-H440 HydrophobicContact CZ-CB 3.99Å; F318-H440 AromaticContact CZ-CD2 3.63Å; F318-H440 AromaticContact CZ-CG 3.72Å; L436-H440 WeakPolarHBondContact O-CB 3.45Å; L436-H440 PolarHBondContact O-N 3.29Å; V437-H440 WeakPolarHBondContact O-CB 3.39Å; V437-H440 PolarHBondContact O-N 3.22Å; T438-H440 VanDerWaalsContact C-N 3.33Å; T438-H440 PolarHBondContact O-N 2.9Å; H440-Q442 VanDerWaalsContact C-N 3.34Å; H440-Q442 PolarHBondContact O-N 3.3Å; H440-L443 PolarHBondContact O-N 3.09Å; H440-V444 WeakPolarHBondContact O-CG2 3.5Å; H440-V444 PolarHBondContact O-N 2.87Å; H440-Y463 PolarHBondContact CD2-OH 3.21Å; H440-Y463 PolarHBondContact NE2-OH 3.41Å
441	A	93.6	Very high	91.6	Very high	19 Å²	19	52.9 Å²	52.9	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-43	179.7	0	0	0	0	0	111.9	V437 T438 L443 V444 Q445 Y463 M466	V437-A441 PolarHBondContact O-N 3.04Å; T438-A441 PolarHBondContact O-N 3.13Å; A441-L443 VanDerWaalsContact C-N 3.34Å; A441-L443 PolarHBondContact O-N 2.89Å; A441-V444 PolarHBondContact O-N 3.4Å; A441-Q445 WeakPolarHBondContact O-CB 3.35Å; A441-Q445 PolarHBondContact O-N 3.33Å; A441-Y463 HydrophobicContact CB-CD1 4.4Å; A441-Y463 HydrophobicContact CB-CE1 4.42Å; A441-M466 HydrophobicContact CB-CE 3.46Å; A441-M466 VanDerWaalsContact CB-CE 3.46Å
442	Q	92.8	Very high	90.4	Very high	122 Å²	122	57.5 Å²	57.5	57%	0.57	29%	0.288	S	S	*	.	H	α-helix	trans	-59.4	-45	175.3	-70.9	173.2	-3.2	0	0	111.7	T438 E439 H440 Q445 I446	T438-Q442 WeakPolarHBondContact O-CG 3.16Å; T438-Q442 PolarHBondContact O-N 2.71Å; T438-Q442 VanDerWaalsContact O-N 3.1Å; E439-Q442 PolarHBondContact O-N 3.36Å; H440-Q442 VanDerWaalsContact C-N 3.34Å; H440-Q442 PolarHBondContact O-N 3.3Å; Q442-Q445 WeakPolarHBondContact O-CB 3.41Å; Q442-Q445 PolarHBondContact O-N 3.29Å; Q442-I446 WeakPolarHBondContact O-CG1 3.33Å; Q442-I446 PolarHBondContact O-N 3.11Å; Q442-I446 VanDerWaalsContact O-N 3.08Å
443	L	92.7	Very high	89.6	Confident	23 Å²	23	55.2 Å²	55.2	12%	0.12	28%	0.276	C	S	.	.	H	α-helix	trans	-68.3	-39.6	179.6	-173.2	62.1	0	0	0	112.7	P350 D353 I354 E439 H440 A441 Q445 I446 I447	P350-L443 HydrophobicContact CB-CD1 3.96Å; D353-L443 HydrophobicContact CB-CD2 4.27Å; I354-L443 HydrophobicContact CB-CD2 3.97Å; I354-L443 HydrophobicContact CG1-CD2 3.49Å; I354-L443 VanDerWaalsContact CG1-CD2 3.49Å; I354-L443 HydrophobicContact CG1-CG 4.14Å; E439-L443 PolarHBondContact O-N 3.32Å; E439-L443 VanDerWaalsContact O-N 3.13Å; H440-L443 PolarHBondContact O-N 3.09Å; A441-L443 VanDerWaalsContact C-N 3.34Å; A441-L443 PolarHBondContact O-N 2.89Å; L443-Q445 VanDerWaalsContact C-N 3.26Å; L443-Q445 PolarHBondContact O-N 3.09Å; L443-I446 WeakPolarHBondContact O-CB 3.49Å; L443-I446 PolarHBondContact O-N 3.48Å; L443-I447 HydrophobicContact CG-CD1 4.15Å; L443-I447 WeakPolarHBondContact O-CD1 3.42Å; L443-I447 WeakPolarHBondContact O-CG1 3.24Å; L443-I447 PolarHBondContact O-N 3.25Å
444	V	91.4	Very high	88.8	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-39.9	173.5	168.6	0	0	0	0	110.8	H440 A441 I447 K448 L455 Y463	H440-V444 WeakPolarHBondContact O-CG2 3.5Å; H440-V444 PolarHBondContact O-N 2.87Å; A441-V444 PolarHBondContact O-N 3.4Å; V444-I447 PolarHBondContact O-N 3.21Å; V444-K448 WeakPolarHBondContact O-CB 3.38Å; V444-K448 PolarHBondContact O-N 3.01Å; V444-L455 HydrophobicContact CG1-CD1 3.92Å; V444-L455 HydrophobicContact CG1-CD2 3.75Å; V444-L455 HydrophobicContact CG1-CG 4.41Å; V444-Y463 HydrophobicContact CG1-CD2 4.42Å; V444-Y463 HydrophobicContact CG1-CE2 4.11Å
445	Q	89.3	Confident	88.4	Confident	104 Å²	104	56 Å²	56	49%	0.486	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-40.3	175.9	-175.6	55	47.1	0	0	112.2	A441 Q442 L443 K448 T449	A441-Q445 WeakPolarHBondContact O-CB 3.35Å; A441-Q445 PolarHBondContact O-N 3.33Å; Q442-Q445 WeakPolarHBondContact O-CB 3.41Å; Q442-Q445 PolarHBondContact O-N 3.29Å; L443-Q445 VanDerWaalsContact C-N 3.26Å; L443-Q445 PolarHBondContact O-N 3.09Å; Q445-K448 PolarHBondContact O-N 3.11Å; Q445-T449 PolarHBondContact NE2-OG1 3.46Å; Q445-T449 PolarHBondContact O-N 3.24Å; Q445-T449 VanDerWaalsContact O-N 3.16Å; Q445-T449 PolarHBondContact O-OG1 3.01Å
446	I	90.6	Very high	88.1	Confident	72 Å²	72	54.3 Å²	54.3	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-48.4	174	-65.8	166.9	0	0	0	110.5	P350 Q442 L443 K448 T449 E450	P350-I446 HydrophobicContact CB-CG2 4.29Å; P350-I446 HydrophobicContact CG-CG2 4.15Å; Q442-I446 WeakPolarHBondContact O-CG1 3.33Å; Q442-I446 PolarHBondContact O-N 3.11Å; Q442-I446 VanDerWaalsContact O-N 3.08Å; L443-I446 WeakPolarHBondContact O-CB 3.49Å; L443-I446 PolarHBondContact O-N 3.48Å; I446-K448 VanDerWaalsContact C-N 3.31Å; I446-K448 PolarHBondContact O-N 3.45Å; I446-T449 PolarHBondContact O-N 3.27Å; I446-T449 VanDerWaalsContact O-N 3.09Å; I446-E450 HydrophobicContact CG2-CG 4.21Å; I446-E450 WeakPolarHBondContact O-CB 3.4Å; I446-E450 WeakPolarHBondContact O-CG 3.47Å; I446-E450 PolarHBondContact O-N 3.21Å
447	I	88.8	Confident	87.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-44	179.1	-70.4	158	0	0	0	111.4	F273 P350 F351 I354 L443 V444 T449 E450 S451 A453	F273-I447 HydrophobicContact CD1-CG2 4.34Å; F273-I447 HydrophobicContact CE1-CG2 4.07Å; F273-I447 HydrophobicContact CE2-CD1 4.24Å; F273-I447 HydrophobicContact CE2-CG2 4.36Å; F273-I447 HydrophobicContact CZ-CG2 4.09Å; P350-I447 HydrophobicContact CB-CG1 4.46Å; P350-I447 HydrophobicContact CG-CG1 3.63Å; F351-I447 HydrophobicContact CD1-CD1 4.38Å; F351-I447 HydrophobicContact CE1-CD1 4.47Å; F351-I447 HydrophobicContact CE1-CG1 4.36Å; F351-I447 HydrophobicContact CE1-CG2 3.72Å; F351-I447 HydrophobicContact CZ-CG2 3.94Å; I354-I447 HydrophobicContact CD1-CD1 3.39Å; I354-I447 HydrophobicContact CG1-CD1 3.77Å; L443-I447 HydrophobicContact CG-CD1 4.15Å; L443-I447 WeakPolarHBondContact O-CD1 3.42Å; L443-I447 WeakPolarHBondContact O-CG1 3.24Å; L443-I447 PolarHBondContact O-N 3.25Å; V444-I447 PolarHBondContact O-N 3.21Å; I447-T449 VanDerWaalsContact C-N 3.27Å; I447-T449 PolarHBondContact O-N 3.47Å; I447-E450 PolarHBondContact O-N 3.4Å; I447-S451 WeakPolarHBondContact O-CB 3.27Å; I447-S451 PolarHBondContact O-N 3.15Å; I447-A453 HydrophobicContact CG2-CB 3.84Å
448	K	85	Confident	87.4	Confident	83 Å²	83	58.2 Å²	58.2	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-60.4	-37.5	177.7	-177.7	-179.7	173.4	-178.3	0	112	V444 Q445 I446 L455	V444-K448 WeakPolarHBondContact O-CB 3.38Å; V444-K448 PolarHBondContact O-N 3.01Å; Q445-K448 PolarHBondContact O-N 3.11Å; I446-K448 VanDerWaalsContact C-N 3.31Å; I446-K448 PolarHBondContact O-N 3.45Å; K448-L455 HydrophobicContact CD-CD1 4.12Å
449	T	84.6	Confident	87.2	Confident	108 Å²	108	56.5 Å²	56.5	66%	0.663	30%	0.302	S	S	*	.	H	α-helix	trans	-78.8	-35.6	179.5	-59.9	0	0	0	0	112.6	Q445 I446 I447	Q445-T449 PolarHBondContact NE2-OG1 3.46Å; Q445-T449 PolarHBondContact O-N 3.24Å; Q445-T449 VanDerWaalsContact O-N 3.16Å; Q445-T449 PolarHBondContact O-OG1 3.01Å; I446-T449 PolarHBondContact O-N 3.27Å; I446-T449 VanDerWaalsContact O-N 3.09Å; I447-T449 VanDerWaalsContact C-N 3.27Å; I447-T449 PolarHBondContact O-N 3.47Å
450	E	80.6	Confident	86.9	Confident	133 Å²	133	56.5 Å²	56.5	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-99.2	-21.1	-168.6	-66.6	-175.9	176.2	0	0	115.4	I446 I447	I446-E450 HydrophobicContact CG2-CG 4.21Å; I446-E450 WeakPolarHBondContact O-CB 3.4Å; I446-E450 WeakPolarHBondContact O-CG 3.47Å; I446-E450 PolarHBondContact O-N 3.21Å; I447-E450 PolarHBondContact O-N 3.4Å
451	S	69.3	Low	86.6	Confident	15 Å²	15	59.4 Å²	59.4	11%	0.105	32%	0.316	C	S	.	.	S	Bend	trans	-126.8	17.7	-162.9	-61.8	0	0	0	0	116.4	I447 A453	I447-S451 WeakPolarHBondContact O-CB 3.27Å; I447-S451 PolarHBondContact O-N 3.15Å; S451-A453 PolarHBondContact O-N 3.04Å
452	D	71.2	Confident	86.5	Confident	139 Å²	139	59.2 Å²	59.2	74%	0.743	31%	0.312	S	S	*	.			trans	45.1	32	-177.3	-164	27.4	0	0	0	113.3	K266	K266-D452 PolarHBondContact NZ-O 3.13Å; K266-D452 VanDerWaalsContact NZ-O 3.15Å
453	A	79.1	Confident	86.2	Confident	3 Å²	3	55.1 Å²	55.1	3%	0.025	29%	0.292	C	S	.	.			trans	-95.6	103.4	-177.9	0	0	0	0	0	107.6	V270 F273 I447 S451	V270-A453 HydrophobicContact CG1-CB 4.2Å; F273-A453 HydrophobicContact CD1-CB 3.95Å; F273-A453 HydrophobicContact CE1-CB 4.05Å; I447-A453 HydrophobicContact CG2-CB 3.84Å; S451-A453 PolarHBondContact O-N 3.04Å
454	A	83	Confident	85.7	Confident	74 Å²	74	60.2 Å²	60.2	61%	0.612	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-68.9	142.9	175.6	0	0	0	0	0	110.6	Q277	Q277-A454 PolarHBondContact NE2-O 3.44Å; Q277-A454 VanDerWaalsContact NE2-O 3.11Å
455	L	87.3	Confident	85	Confident	22 Å²	22	65.7 Å²	65.7	12%	0.115	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-85.3	144	168.9	-70.2	178.3	0	0	0	110.2	F273 V444 K448 Q460 Y463	F273-L455 HydrophobicContact CE1-CD2 4.03Å; F273-L455 HydrophobicContact CZ-CD2 3.75Å; V444-L455 HydrophobicContact CG1-CD1 3.92Å; V444-L455 HydrophobicContact CG1-CD2 3.75Å; V444-L455 HydrophobicContact CG1-CG 4.41Å; K448-L455 HydrophobicContact CD-CD1 4.12Å; L455-Q460 HydrophobicContact CB-CB 4.24Å; L455-Y463 HydrophobicContact CD1-CD2 4.19Å
456	H	89.8	Confident	84.1	Confident	69 Å²	69	61.6 Å²	61.6	32%	0.319	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-60	137.7	168.8	-172.6	-77.4	0	0	0	109.7	V281 L458 L459 Q460	V281-H456 HydrophobicContact CG2-CB 4.21Å; V281-H456 WeakPolarHBondContact CG2-ND1 3.36Å; H456-L458 PolarHBondContact ND1-N 3.46Å; H456-L458 PolarHBondContact O-N 2.72Å; H456-L459 HydrophobicContact CB-CB 4.42Å; H456-L459 HydrophobicContact CB-CD1 4.16Å; H456-L459 HydrophobicContact CB-CG 4.06Å; H456-L459 PolarHBondContact O-N 2.99Å; H456-Q460 PolarHBondContact O-N 2.91Å
457	P	90	Very high	82.4	Confident	71 Å²	71	66.7 Å²	66.7	46%	0.461	34%	0.335	S	S	.	.	H	α-helix	trans	-50.7	-50.5	-175.9	-30	35.5	0	0	0	114	L459 Q460 E461	P457-L459 VanDerWaalsContact C-N 3.34Å; P457-L459 PolarHBondContact O-N 3.37Å; P457-Q460 WeakPolarHBondContact O-CA 3.3Å; P457-Q460 WeakPolarHBondContact O-CB 3.4Å; P457-Q460 PolarHBondContact O-N 3.09Å; P457-Q460 VanDerWaalsContact O-N 3.09Å; P457-E461 PolarHBondContact O-N 3.19Å
458	L	90.1	Very high	82.1	Confident	22 Å²	22	70 Å²	70	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-54.8	-45.8	176	-179.1	64.6	0	0	0	113.1	F27 V281 V284 H456 Q460 E461 I462	F27-L458 HydrophobicContact CE2-CD1 3.9Å; V281-L458 HydrophobicContact CG1-CD2 3.98Å; V281-L458 HydrophobicContact CG2-CD2 4.36Å; V284-L458 HydrophobicContact CB-CD2 4.32Å; V284-L458 HydrophobicContact CG1-CD2 4.06Å; H456-L458 PolarHBondContact ND1-N 3.46Å; H456-L458 PolarHBondContact O-N 2.72Å; L458-Q460 VanDerWaalsContact C-N 3.31Å; L458-Q460 PolarHBondContact O-N 3.36Å; L458-E461 PolarHBondContact O-N 3.16Å; L458-I462 HydrophobicContact CG-CD1 4.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.48Å; L458-I462 PolarHBondContact O-N 3.44Å; L458-I462 VanDerWaalsContact O-N 3.11Å
459	L	91	Very high	81.9	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-69.4	-35.5	-179.6	-55.1	-175.5	0	0	0	110.6	Q277 V281 V284 H456 P457 E461 I462 Y463	Q277-L459 HydrophobicContact CB-CD1 3.7Å; Q277-L459 HydrophobicContact CG-CD1 3.76Å; V281-L459 HydrophobicContact CG2-CD1 4.24Å; V281-L459 HydrophobicContact CG2-CD2 3.93Å; V281-L459 HydrophobicContact CG2-CG 3.89Å; V284-L459 HydrophobicContact CG2-CD2 4.29Å; H456-L459 HydrophobicContact CB-CB 4.42Å; H456-L459 HydrophobicContact CB-CD1 4.16Å; H456-L459 HydrophobicContact CB-CG 4.06Å; H456-L459 PolarHBondContact O-N 2.99Å; P457-L459 VanDerWaalsContact C-N 3.34Å; P457-L459 PolarHBondContact O-N 3.37Å; L459-E461 VanDerWaalsContact C-N 3.27Å; L459-E461 PolarHBondContact O-N 3.38Å; L459-I462 HydrophobicContact CD2-CD1 4.23Å; L459-I462 PolarHBondContact O-N 3.35Å; L459-Y463 HydrophobicContact CB-CD2 4.27Å; L459-Y463 HydrophobicContact CB-CE2 4.17Å; L459-Y463 WeakPolarHBondContact O-CB 3.45Å; L459-Y463 WeakPolarHBondContact O-CD2 3.44Å; L459-Y463 PolarHBondContact O-N 3.49Å
460	Q	89.7	Confident	81.8	Confident	78 Å²	78	67.2 Å²	67.2	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-36.8	174	-177.8	175.9	-4.8	0	0	111.7	L455 H456 P457 L458 R464	L455-Q460 HydrophobicContact CB-CB 4.24Å; H456-Q460 PolarHBondContact O-N 2.91Å; P457-Q460 WeakPolarHBondContact O-CA 3.3Å; P457-Q460 WeakPolarHBondContact O-CB 3.4Å; P457-Q460 PolarHBondContact O-N 3.09Å; P457-Q460 VanDerWaalsContact O-N 3.09Å; L458-Q460 VanDerWaalsContact C-N 3.31Å; L458-Q460 PolarHBondContact O-N 3.36Å; Q460-R464 WeakPolarHBondContact O-CB 3.42Å; Q460-R464 PolarHBondContact O-N 2.95Å
461	E	89.6	Confident	81.9	Confident	84 Å²	84	63.3 Å²	63.3	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-68.6	-41.8	174.2	-67.4	-171.8	162.9	0	0	112.8	P457 L458 L459 Y463 R464	P457-E461 PolarHBondContact O-N 3.19Å; L458-E461 PolarHBondContact O-N 3.16Å; L459-E461 VanDerWaalsContact C-N 3.27Å; L459-E461 PolarHBondContact O-N 3.38Å; E461-Y463 VanDerWaalsContact C-N 3.33Å; E461-Y463 PolarHBondContact O-N 2.91Å; E461-R464 WeakPolarHBondContact O-CB 3.26Å; E461-R464 PolarHBondContact O-N 3.15Å
462	I	89.8	Confident	82.6	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-61.4	-45.2	176.4	-65.6	164.9	0	0	0	110.3	V284 K310 V313 Y314 L458 L459 R464	V284-I462 HydrophobicContact CG1-CD1 4.06Å; V284-I462 HydrophobicContact CG2-CD1 4.01Å; K310-I462 WeakPolarHBondContact CE-O 3.49Å; V313-I462 HydrophobicContact CG1-CD1 4.25Å; V313-I462 HydrophobicContact CG1-CG2 3.7Å; Y314-I462 HydrophobicContact CD2-CG2 3.95Å; Y314-I462 HydrophobicContact CE2-CB 4.45Å; Y314-I462 HydrophobicContact CE2-CG2 3.55Å; L458-I462 HydrophobicContact CG-CD1 4.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.48Å; L458-I462 PolarHBondContact O-N 3.44Å; L458-I462 VanDerWaalsContact O-N 3.11Å; L459-I462 HydrophobicContact CD2-CD1 4.23Å; L459-I462 PolarHBondContact O-N 3.35Å; I462-R464 VanDerWaalsContact C-N 3.31Å; I462-R464 PolarHBondContact O-N 2.97Å
463	Y	86.8	Confident	83.4	Confident	37 Å²	37	61.5 Å²	61.5	15%	0.145	30%	0.303	C	S	.	.	H	α-helix	trans	-73.7	-19.3	177.9	-71.4	-56.1	0	0	0	114.1	Y314 H440 A441 V444 L455 L459 E461 D465 M466	Y314-Y463 AromaticContact CD2-CE1 3.98Å; Y314-Y463 HydrophobicContact CD2-CE1 3.98Å; Y314-Y463 VanDerWaalsContact CE1-OH 3.32Å; Y314-Y463 WeakPolarHBondContact CE1-OH 3.43Å; Y314-Y463 HydrophobicContact CE2-CD1 4.03Å; Y314-Y463 AromaticContact CE2-CE1 3.37Å; Y314-Y463 HydrophobicContact CE2-CE1 3.37Å; Y314-Y463 HydrophobicContact CE2-CE2 4.01Å; Y314-Y463 AromaticContact CE2-CZ 3.37Å; Y314-Y463 WeakPolarHBondContact CE2-OH 3.33Å; Y314-Y463 AromaticContact CZ-CE1 3.78Å; Y314-Y463 AromaticContact CZ-CE2 3.77Å; Y314-Y463 AromaticContact CZ-CZ 3.23Å; Y314-Y463 WeakPolarHBondContact OH-CE2 3.46Å; Y314-Y463 PolarHBondContact OH-OH 3.05Å; H440-Y463 PolarHBondContact CD2-OH 3.21Å; H440-Y463 PolarHBondContact NE2-OH 3.41Å; A441-Y463 HydrophobicContact CB-CD1 4.4Å; A441-Y463 HydrophobicContact CB-CE1 4.42Å; V444-Y463 HydrophobicContact CG1-CD2 4.42Å; V444-Y463 HydrophobicContact CG1-CE2 4.11Å; L455-Y463 HydrophobicContact CD1-CD2 4.19Å; L459-Y463 HydrophobicContact CB-CD2 4.27Å; L459-Y463 HydrophobicContact CB-CE2 4.17Å; L459-Y463 WeakPolarHBondContact O-CB 3.45Å; L459-Y463 WeakPolarHBondContact O-CD2 3.44Å; L459-Y463 PolarHBondContact O-N 3.49Å; E461-Y463 VanDerWaalsContact C-N 3.33Å; E461-Y463 PolarHBondContact O-N 2.91Å; Y463-D465 PolarHBondContact O-N 2.73Å; Y463-M466 HydrophobicContact CD1-CE 3.57Å; Y463-M466 HydrophobicContact CD1-SD 4.1Å; Y463-M466 HydrophobicContact CE1-CE 3.82Å; Y463-M466 WeakPolarHBondContact O-CB 3.47Å; Y463-M466 PolarHBondContact O-N 2.94Å; Y463-M466 VanDerWaalsContact O-N 3.16Å
464	R	82.8	Confident	83.7	Confident	130 Å²	130	65.6 Å²	65.6	49%	0.491	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	126.4	-179.3	-166.3	-175.1	-59.3	178.1	5.3	109	K310 Q460 E461 I462 M466	K310-R464 WeakPolarHBondContact CE-O 3.46Å; K310-R464 PolarHBondContact NZ-O 3.44Å; Q460-R464 WeakPolarHBondContact O-CB 3.42Å; Q460-R464 PolarHBondContact O-N 2.95Å; E461-R464 WeakPolarHBondContact O-CB 3.26Å; E461-R464 PolarHBondContact O-N 3.15Å; I462-R464 VanDerWaalsContact C-N 3.31Å; I462-R464 PolarHBondContact O-N 2.97Å; R464-M466 PolarHBondContact O-N 3.36Å; R464-M466 VanDerWaalsContact O-N 3.13Å
465	D	76.3	Confident	83.8	Confident	120 Å²	120	65 Å²	65	64%	0.642	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	23.5	-178.9	-41.9	-45.8	0	0	0	113.2	Y311 Y463 Y467	Y311-D465 PolarHBondContact OH-O 2.96Å; Y463-D465 PolarHBondContact O-N 2.73Å; D465-Y467 PolarHBondContact O-N 3.45Å; D465-Y467 VanDerWaalsContact O-N 3.09Å
466	M	71.7	Confident	83.5	Confident	18 Å²	18	68.6 Å²	68.6	9%	0.089	32%	0.317	C	S	.	.			trans	-80.9	89.9	173.4	-156.8	-179.6	77.7	0	0	108.3	Y311 Y314 V437 A441 Y463 R464	Y311-M466 HydrophobicContact CD1-CG 4.49Å; Y311-M466 HydrophobicContact CE1-CG 4.37Å; Y314-M466 HydrophobicContact CD2-SD 4.32Å; V437-M466 HydrophobicContact CG1-CE 3.78Å; V437-M466 HydrophobicContact CG1-SD 4.39Å; A441-M466 HydrophobicContact CB-CE 3.46Å; A441-M466 VanDerWaalsContact CB-CE 3.46Å; Y463-M466 HydrophobicContact CD1-CE 3.57Å; Y463-M466 HydrophobicContact CD1-SD 4.1Å; Y463-M466 HydrophobicContact CE1-CE 3.82Å; Y463-M466 WeakPolarHBondContact O-CB 3.47Å; Y463-M466 PolarHBondContact O-N 2.94Å; Y463-M466 VanDerWaalsContact O-N 3.16Å; R464-M466 PolarHBondContact O-N 3.36Å; R464-M466 VanDerWaalsContact O-N 3.13Å
467	Y	54	Low	82.9	Confident	178 Å²	178	68.5 Å²	68.5	70%	0.698	32%	0.316	S	S	*	.			trans	77.8	0	-177.6	-52.3	-75.1	0	0	0	116.2	D465	D465-Y467 PolarHBondContact O-N 3.45Å; D465-Y467 VanDerWaalsContact O-N 3.09Å

Retrieved 467 of 467 residues in 126.1 ms (Link to these results)

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