A0A096M2T0_POEFO Loading...

Death domain-containing protein

AlphaFold DB , UniProt , Accession A0A096M2T0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 104 aa.

						>A0A096M2T0_POEFO|A0A096M2T0
LLSPPDARRYEHCERWPAIVLYAIIKEVPVRRWKEFLRLLSVSDQQMERVEMEAGLGSMEKQYQMLRLWSQRSSASLNEVYSSLHLMELSGCVQQLQENLERLQ
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	L	44.7	Very low	45.1	Very low	228 Å²	228	146.2 Å²	146.2	100%	1.194	74%	0.739	S	S	*	*				0	84.2	0	-76.6	163.3	0	0	0	108.6
2	L	43	Very low	45.3	Very low	174 Å²	174	148.8 Å²	148.8	91%	0.911	75%	0.746	S	S	*	*			trans	-129.9	98.1	166.1	-90	145.9	0	0	0	104.7
3	S	47.6	Very low	45.4	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-66.4	131.9	168.5	-61.4	0	0	0	0	107.6	P5	S3-P5 WeakPolarHBondContact O-CD 3.49Å
4	P	45.8	Very low	46.2	Very low	102 Å²	102	139.8 Å²	139.8	66%	0.662	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.4	126.3	173.7	24.3	-29.2	0	0	0	108.3
5	P	54.3	Low	48.2	Very low	107 Å²	107	139.7 Å²	139.7	70%	0.695	70%	0.695	S	S	*	*	S	Bend	trans	-70.6	141.7	167.9	34.2	-32.3	0	0	0	107.3	S3	S3-P5 WeakPolarHBondContact O-CD 3.49Å
6	D	49.7	Very low	50.8	Low	85 Å²	85	132.7 Å²	132.7	46%	0.455	66%	0.658	S	S	.	*	S	Bend	trans	82.5	4.2	164.3	-53.8	-74.4	0	0	0	120.3	R8 R9	D6-R8 VanDerWaalsContact C-N 3.26Å; D6-R8 PolarHBondContact O-N 2.92Å; D6-R9 WeakPolarHBondContact OD1-CD 3.36Å; D6-R9 IonicContact OD1-CZ 3.32Å; D6-R9 IonicContact OD1-NE 3.05Å; D6-R9 IonicContact OD1-NH1 3.1Å; D6-R9 PolarHBondContact OD1-NH1 3.38Å
7	A	41.9	Very low	53.2	Low	61 Å²	61	129.1 Å²	129.1	50%	0.504	65%	0.647	S	S	.	*	G	3₁₀ helix	trans	-66.8	-30	169.5	0	0	0	0	0	112.7	R9	A7-R9 PolarHBondContact O-N 3.11Å
8	R	42.9	Very low	55.4	Low	215 Å²	215	123.7 Å²	123.7	81%	0.811	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-83.5	-5.3	-176.6	-63.3	-175.6	-171.2	160.9	1.9	115.1	D6	D6-R8 VanDerWaalsContact C-N 3.26Å; D6-R8 PolarHBondContact O-N 2.92Å
9	R	42.1	Very low	57.5	Low	201 Å²	201	122.3 Å²	122.3	76%	0.758	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-84	-14.7	-176.5	-69.8	175.5	89.1	172.5	2.6	113.5	D6 A7	D6-R9 WeakPolarHBondContact OD1-CD 3.36Å; D6-R9 IonicContact OD1-CZ 3.32Å; D6-R9 IonicContact OD1-NE 3.05Å; D6-R9 IonicContact OD1-NH1 3.1Å; D6-R9 PolarHBondContact OD1-NH1 3.38Å; A7-R9 PolarHBondContact O-N 3.11Å
10	Y	44.3	Very low	59.4	Low	189 Å²	189	117.3 Å²	117.3	74%	0.741	60%	0.595	S	S	*	*	S	Bend	trans	-93.2	-10.1	174	-67.3	-80.1	0	0	0	113.2
11	E	40	Very low	61.2	Low	139 Å²	139	111.7 Å²	111.7	65%	0.65	57%	0.566	S	S	*	*	S	Bend	trans	-100.6	9.8	-168	-66.6	-172.5	99.7	0	0	114.8
12	H	46.9	Very low	63.7	Low	178 Å²	178	104.4 Å²	104.4	82%	0.824	52%	0.523	S	S	*	.	S	Bend	trans	-142.3	21.8	-170.9	-107.5	77.3	0	0	0	118.7
13	C	47.1	Very low	66.3	Low	72 Å²	72	96.6 Å²	96.6	49%	0.486	48%	0.484	S	S	.	.			trans	-149.1	43.4	165.4	-157.7	0	0	0	0	113.2	R15	C13-R15 PolarHBondContact O-N 3.37Å
14	E	56.1	Low	68.7	Low	99 Å²	99	91.5 Å²	91.5	46%	0.463	45%	0.448	S	S	.	.			trans	-83.1	68.1	165.6	-62.3	-121.5	150.1	0	0	108.7	W16 R67	E14-W16 PolarHBondContact O-N 3.17Å; E14-W16 VanDerWaalsContact O-N 3.17Å; E14-R67 IonicContact OE1-CZ 3.36Å; E14-R67 IonicContact OE1-NH1 2.69Å; E14-R67 PolarHBondContact OE1-NH1 3.22Å; E14-R67 IonicContact OE1-NH2 2.69Å; E14-R67 PolarHBondContact OE1-NH2 3.04Å; E14-R67 IonicContact OE2-NH1 3.83Å
15	R	75.9	Confident	71.2	Confident	138 Å²	138	87 Å²	87	52%	0.521	42%	0.419	S	S	.	.			trans	-57.9	-25.1	170.6	-173.9	177.8	-166.1	-163.2	6.6	111.4	C13 R72 S73	C13-R15 PolarHBondContact O-N 3.37Å; R15-R72 PolarHBondContact NH1-O 3.32Å; R15-S73 VanDerWaalsContact NH1-CA 3.29Å; R15-S73 PolarHBondContact NH1-O 3.43Å; R15-S73 PolarHBondContact NH2-O 3.26Å
16	W	90.2	Very high	73.3	Confident	28 Å²	28	89.4 Å²	89.4	11%	0.106	42%	0.418	C	S	.	.	S	Bend	trans	-122.5	125.4	-177.8	-71.8	82.8	0	0	0	110.7	E14 A18 V20 L21 W69 S70 A75 L77	E14-W16 PolarHBondContact O-N 3.17Å; E14-W16 VanDerWaalsContact O-N 3.17Å; W16-A18 PolarHBondContact O-N 2.93Å; W16-V20 HydrophobicContact CE3-CB 4.37Å; W16-V20 HydrophobicContact CE3-CG1 3.64Å; W16-V20 HydrophobicContact CZ3-CG1 3.74Å; W16-L21 HydrophobicContact CB-CD2 4.05Å; W16-L21 HydrophobicContact CB-CG 4.4Å; W16-W69 HydrophobicContact CD2-CH2 4.28Å; W16-W69 HydrophobicContact CD2-CZ3 4.39Å; W16-W69 AromaticContact CE2-CH2 3.95Å; W16-W69 HydrophobicContact CE3-CH2 4.39Å; W16-W69 AromaticContact CH2-CH2 3.89Å; W16-W69 HydrophobicContact CH2-CH2 3.89Å; W16-W69 AromaticContact CZ2-CH2 3.77Å; W16-W69 HydrophobicContact CZ2-CH2 3.77Å; W16-W69 HydrophobicContact CZ2-CZ2 4.21Å; W16-W69 HydrophobicContact CZ3-CH2 4.2Å; W16-S70 VanDerWaalsContact CD1-O 3.27Å; W16-A75 HydrophobicContact CZ2-CB 4.48Å; W16-A75 WeakPolarHBondContact CZ2-O 3.3Å; W16-L77 HydrophobicContact CH2-CB 4.32Å; W16-L77 HydrophobicContact CH2-CD2 3.98Å; W16-L77 HydrophobicContact CH2-CG 3.68Å; W16-L77 HydrophobicContact CZ3-CD2 3.72Å; W16-L77 HydrophobicContact CZ3-CG 3.75Å
17	P	91.6	Very high	75.6	Confident	72 Å²	72	87.1 Å²	87.1	47%	0.468	41%	0.405	S	S	.	.			trans	-59.7	136.7	172.9	-22.3	32.9	0	0	0	111	I19 V20 L21	P17-I19 HydrophobicContact CB-CG2 4.02Å; P17-I19 PolarHBondContact O-N 2.98Å; P17-I19 VanDerWaalsContact O-N 3.11Å; P17-V20 HydrophobicContact CB-CG2 4.14Å; P17-V20 HydrophobicContact CG-CG2 4.2Å; P17-V20 WeakPolarHBondContact O-CB 3.19Å; P17-V20 PolarHBondContact O-N 3.23Å; P17-L21 PolarHBondContact O-N 2.91Å
18	A	93.5	Very high	78.2	Confident	32 Å²	32	84.5 Å²	84.5	26%	0.264	38%	0.382	S	S	.	.	H	α-helix	trans	-52.5	-37.5	178.7	0	0	0	0	0	112.8	W16 V20 L21 Y22 Y63	W16-A18 PolarHBondContact O-N 2.93Å; A18-V20 VanDerWaalsContact C-N 3.26Å; A18-V20 PolarHBondContact O-N 2.92Å; A18-L21 WeakPolarHBondContact O-CB 3.37Å; A18-L21 PolarHBondContact O-N 3.39Å; A18-L21 VanDerWaalsContact O-N 3.09Å; A18-Y22 HydrophobicContact CB-CD2 4.49Å; A18-Y22 HydrophobicContact CB-CE2 4.33Å; A18-Y22 WeakPolarHBondContact O-CD2 3.28Å; A18-Y22 PolarHBondContact O-N 2.91Å; A18-Y63 HydrophobicContact CB-CE2 4.18Å
19	I	94.6	Very high	80.8	Confident	97 Å²	97	76.8 Å²	76.8	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-33.8	178.6	-164.5	162.1	0	0	0	113.1	P17 A23 L103	P17-I19 HydrophobicContact CB-CG2 4.02Å; P17-I19 PolarHBondContact O-N 2.98Å; P17-I19 VanDerWaalsContact O-N 3.11Å; I19-A23 PolarHBondContact O-N 3.34Å; I19-L103 HydrophobicContact CD1-CD1 4.24Å; I19-L103 HydrophobicContact CD1-CD2 3.52Å; I19-L103 HydrophobicContact CD1-CG 4.49Å; I19-L103 HydrophobicContact CG1-CD1 3.87Å; I19-L103 HydrophobicContact CG1-CD2 4.06Å; I19-L103 HydrophobicContact CG2-CD1 4.3Å
20	V	95.7	Very high	83.4	Confident	22 Å²	22	72 Å²	72	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-69.7	-40.8	175.6	177.4	0	0	0	0	110.4	W16 P17 A18 A23 I24 L77 L100	W16-V20 HydrophobicContact CE3-CB 4.37Å; W16-V20 HydrophobicContact CE3-CG1 3.64Å; W16-V20 HydrophobicContact CZ3-CG1 3.74Å; P17-V20 HydrophobicContact CB-CG2 4.14Å; P17-V20 HydrophobicContact CG-CG2 4.2Å; P17-V20 WeakPolarHBondContact O-CB 3.19Å; P17-V20 PolarHBondContact O-N 3.23Å; A18-V20 VanDerWaalsContact C-N 3.26Å; A18-V20 PolarHBondContact O-N 2.92Å; V20-A23 WeakPolarHBondContact O-CB 3.44Å; V20-A23 PolarHBondContact O-N 3.41Å; V20-I24 WeakPolarHBondContact O-CG1 3.25Å; V20-I24 PolarHBondContact O-N 3.35Å; V20-I24 VanDerWaalsContact O-N 3.1Å; V20-L77 HydrophobicContact CG1-CD2 4.47Å; V20-L100 HydrophobicContact CB-CD2 4.34Å; V20-L100 HydrophobicContact CG1-CD2 3.99Å; V20-L100 HydrophobicContact CG2-CD2 4.16Å
21	L	97.3	Very high	85.9	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-43.6	176.6	-56.3	-176.4	0	0	0	111	W16 P17 A18 A23 I24 I25 Y63 L66 R67 W69	W16-L21 HydrophobicContact CB-CD2 4.05Å; W16-L21 HydrophobicContact CB-CG 4.4Å; P17-L21 PolarHBondContact O-N 2.91Å; A18-L21 WeakPolarHBondContact O-CB 3.37Å; A18-L21 PolarHBondContact O-N 3.39Å; A18-L21 VanDerWaalsContact O-N 3.09Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 3.28Å; L21-I24 PolarHBondContact O-N 3.17Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.22Å; L21-I25 PolarHBondContact O-N 3.24Å; L21-Y63 HydrophobicContact CB-CD2 4.11Å; L21-Y63 HydrophobicContact CB-CE2 3.99Å; L21-Y63 HydrophobicContact CD1-CD2 4.32Å; L21-Y63 HydrophobicContact CD1-CE2 3.7Å; L21-Y63 HydrophobicContact CG-CE2 4.42Å; L21-L66 HydrophobicContact CB-CD1 4.23Å; L21-L66 HydrophobicContact CD2-CB 4.44Å; L21-L66 WeakPolarHBondContact O-CD1 3.31Å; L21-R67 HydrophobicContact CD1-CG 4.1Å; L21-W69 HydrophobicContact CD2-CE3 4.46Å; L21-W69 HydrophobicContact CD2-CZ3 3.97Å
22	Y	97.3	Very high	88.7	Confident	75 Å²	75	71.8 Å²	71.8	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-34.2	175.3	-74.2	-64.6	0	0	0	113.2	A18 I25 K26 M59 Y63	A18-Y22 HydrophobicContact CB-CD2 4.49Å; A18-Y22 HydrophobicContact CB-CE2 4.33Å; A18-Y22 WeakPolarHBondContact O-CD2 3.28Å; A18-Y22 PolarHBondContact O-N 2.91Å; Y22-I25 HydrophobicContact CD1-CD1 4.12Å; Y22-I25 PolarHBondContact O-N 2.71Å; Y22-K26 WeakPolarHBondContact O-CG 3.39Å; Y22-K26 PolarHBondContact O-N 3.27Å; Y22-M59 HydrophobicContact CD1-CE 4.2Å; Y22-M59 HydrophobicContact CD1-SD 4.44Å; Y22-M59 HydrophobicContact CE1-CE 4.48Å; Y22-M59 HydrophobicContact CE1-CG 4.2Å; Y22-Y63 HydrophobicContact CE1-CD2 4.07Å; Y22-Y63 HydrophobicContact CE1-CG 4.41Å; Y22-Y63 HydrophobicContact CE2-CD2 4.06Å; Y22-Y63 HydrophobicContact CE2-CE2 4.08Å; Y22-Y63 AromaticContact CZ-CD2 3.8Å
23	A	97.6	Very high	91.1	Very high	10 Å²	10	63.9 Å²	63.9	8%	0.083	31%	0.308	C	S	.	.	H	α-helix	trans	-59.7	-47.4	172.4	0	0	0	0	0	110.6	I19 V20 L21 I25 K26 E27 L96 L100	I19-A23 PolarHBondContact O-N 3.34Å; V20-A23 WeakPolarHBondContact O-CB 3.44Å; V20-A23 PolarHBondContact O-N 3.41Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 3.28Å; A23-I25 PolarHBondContact O-N 3.28Å; A23-K26 PolarHBondContact O-N 2.89Å; A23-E27 WeakPolarHBondContact O-CG 3.24Å; A23-E27 PolarHBondContact O-N 2.69Å; A23-L96 HydrophobicContact CB-CD1 3.87Å; A23-L100 HydrophobicContact CB-CD2 3.87Å
24	I	98.1	Very high	93.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.9	-47.8	175.9	-62.7	165.3	0	0	0	110.8	V20 L21 K26 E27 V28 F36 L66 W69 V80 L96	V20-I24 WeakPolarHBondContact O-CG1 3.25Å; V20-I24 PolarHBondContact O-N 3.35Å; V20-I24 VanDerWaalsContact O-N 3.1Å; L21-I24 PolarHBondContact O-N 3.17Å; I24-K26 VanDerWaalsContact C-N 3.28Å; I24-K26 PolarHBondContact O-N 3.19Å; I24-E27 PolarHBondContact O-N 3.25Å; I24-V28 HydrophobicContact CG2-CG2 4.15Å; I24-V28 WeakPolarHBondContact O-CG2 3.49Å; I24-V28 PolarHBondContact O-N 3.44Å; I24-V28 VanDerWaalsContact O-N 3.13Å; I24-F36 HydrophobicContact CG2-CE1 3.8Å; I24-F36 HydrophobicContact CG2-CZ 3.85Å; I24-L66 HydrophobicContact CB-CD1 3.94Å; I24-L66 HydrophobicContact CG2-CD1 3.89Å; I24-L66 HydrophobicContact CG2-CD2 4.37Å; I24-W69 HydrophobicContact CD1-CH2 4.32Å; I24-W69 HydrophobicContact CD1-CZ3 4.09Å; I24-V80 HydrophobicContact CD1-CG1 4.47Å; I24-V80 HydrophobicContact CD1-CG2 4.09Å; I24-V80 HydrophobicContact CG1-CG1 4.39Å; I24-V80 HydrophobicContact CG2-CG1 4.43Å; I24-L96 HydrophobicContact CG1-CD1 4.13Å; I24-L96 HydrophobicContact CG1-CD2 3.98Å
25	I	98.3	Very high	95.6	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-35.6	-176.3	-54.6	159.6	0	0	0	112	L21 Y22 A23 E27 W33 M59 Q62 Y63 L66	L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.22Å; L21-I25 PolarHBondContact O-N 3.24Å; Y22-I25 HydrophobicContact CD1-CD1 4.12Å; Y22-I25 PolarHBondContact O-N 2.71Å; A23-I25 PolarHBondContact O-N 3.28Å; I25-E27 VanDerWaalsContact C-N 3.33Å; I25-W33 HydrophobicContact CB-CH2 4.46Å; I25-W33 HydrophobicContact CG1-CH2 3.83Å; I25-W33 HydrophobicContact CG1-CZ2 4.41Å; I25-W33 HydrophobicContact CG1-CZ3 4.46Å; I25-W33 HydrophobicContact CG2-CH2 4.46Å; I25-M59 HydrophobicContact CB-CE 3.59Å; I25-M59 HydrophobicContact CD1-CE 3.71Å; I25-M59 HydrophobicContact CG1-CE 4.21Å; I25-M59 HydrophobicContact CG2-CE 3.08Å; I25-Q62 HydrophobicContact CD1-CB 4.17Å; I25-Q62 HydrophobicContact CG1-CB 4.26Å; I25-Q62 HydrophobicContact CG2-CB 3.68Å; I25-Q62 VanDerWaalsContact CG2-CD 3.47Å; I25-Q62 HydrophobicContact CG2-CG 4.2Å; I25-Q62 VanDerWaalsContact CG2-OE1 3.26Å; I25-Y63 HydrophobicContact CD1-CD2 4.48Å; I25-L66 HydrophobicContact CD1-CD1 4.14Å; I25-L66 HydrophobicContact CG1-CD1 3.51Å; I25-L66 HydrophobicContact CG1-CG 4.46Å
26	K	97.4	Very high	96.7	Very high	158 Å²	158	56.2 Å²	56.2	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-66.1	-36.2	178.2	-75.7	176.7	-179.8	-178.5	0	112.6	Y22 A23 I24	Y22-K26 WeakPolarHBondContact O-CG 3.39Å; Y22-K26 PolarHBondContact O-N 3.27Å; A23-K26 PolarHBondContact O-N 2.89Å; I24-K26 VanDerWaalsContact C-N 3.28Å; I24-K26 PolarHBondContact O-N 3.19Å
27	E	97.9	Very high	97.1	Very high	37 Å²	37	54.9 Å²	54.9	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-83.9	-25.9	-176.7	-59	-41.5	132.2	0	0	113.7	A23 I24 I25 P29 C92 Q95 L96 N99	A23-E27 WeakPolarHBondContact O-CG 3.24Å; A23-E27 PolarHBondContact O-N 2.69Å; I24-E27 PolarHBondContact O-N 3.25Å; I25-E27 VanDerWaalsContact C-N 3.33Å; E27-P29 WeakPolarHBondContact O-CD 3.39Å; E27-C92 HydrophobicContact CB-CB 4.47Å; E27-C92 PolarHBondContact O-SG 3.2Å; E27-Q95 HydrophobicContact CG-CB 4.43Å; E27-Q95 VanDerWaalsContact OE2-CB 3.23Å; E27-Q95 WeakPolarHBondContact OE2-CB 3.23Å; E27-L96 HydrophobicContact CB-CB 4.37Å; E27-L96 HydrophobicContact CG-CB 3.94Å; E27-L96 HydrophobicContact CG-CD1 4.2Å; E27-N99 PolarHBondContact OE1-ND2 2.92Å
28	V	98.1	Very high	97.4	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	26%	0.264	C	S	.	.	S	Bend	trans	-84.2	123.5	-178.3	-176.4	0	0	0	0	111.1	I24 V30 W33 F36 L84	I24-V28 HydrophobicContact CG2-CG2 4.15Å; I24-V28 WeakPolarHBondContact O-CG2 3.49Å; I24-V28 PolarHBondContact O-N 3.44Å; I24-V28 VanDerWaalsContact O-N 3.13Å; V28-V30 PolarHBondContact O-N 3.18Å; V28-W33 HydrophobicContact CB-CE3 3.84Å; V28-W33 HydrophobicContact CB-CZ3 3.84Å; V28-W33 HydrophobicContact CG1-CE3 3.68Å; V28-W33 HydrophobicContact CG1-CZ3 4.1Å; V28-W33 HydrophobicContact CG2-CZ3 4.18Å; V28-F36 HydrophobicContact CG1-CB 4.06Å; V28-F36 HydrophobicContact CG1-CD1 4.14Å; V28-F36 HydrophobicContact CG1-CG 4.1Å; V28-F36 HydrophobicContact CG2-CD1 4.11Å; V28-F36 HydrophobicContact CG2-CE1 4.02Å; V28-F36 HydrophobicContact CG2-CG 4.37Å; V28-F36 HydrophobicContact CG2-CZ 4.22Å; V28-L84 HydrophobicContact CG2-CD2 3.82Å
29	P	97.6	Very high	97.6	Very high	52 Å²	52	59.3 Å²	59.3	34%	0.338	27%	0.27	S	S	.	.			trans	-59	129.6	177.8	-23.9	33.7	0	0	0	112	E27 R31 R32 W33 L89	E27-P29 WeakPolarHBondContact O-CD 3.39Å; P29-R31 PolarHBondContact O-N 2.9Å; P29-R32 HydrophobicContact CB-CB 4.35Å; P29-R32 HydrophobicContact CB-CG 4.33Å; P29-R32 CarbonylContact O-C 3.56Å; P29-R32 WeakPolarHBondContact O-CA 3.45Å; P29-R32 PolarHBondContact O-N 3.47Å; P29-W33 PolarHBondContact O-N 2.92Å; P29-L89 HydrophobicContact CG-CD1 4.43Å; P29-L89 HydrophobicContact CG-CD2 4.3Å
30	V	96.4	Very high	97.8	Very high	100 Å²	100	54.7 Å²	54.7	61%	0.606	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-54.5	-34.9	-176.4	70.6	0	0	0	0	113.4	V28 R32 W33	V28-V30 PolarHBondContact O-N 3.18Å; V30-R32 PolarHBondContact O-N 2.89Å; V30-W33 VanDerWaalsContact O-CB 3.23Å; V30-W33 WeakPolarHBondContact O-CB 3.4Å; V30-W33 PolarHBondContact O-N 3.3Å
31	R	97.1	Very high	97.9	Very high	245 Å²	245	57 Å²	57	93%	0.925	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-67.6	-23.9	178.1	-66.1	-173.7	177.8	-174.6	-0.3	113.4	P29	P29-R31 PolarHBondContact O-N 2.9Å
32	R	98.1	Very high	97.9	Very high	80 Å²	80	57.1 Å²	57.1	30%	0.302	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-102.3	1.8	-178.8	-63.2	-80.1	-80.6	-178	-6.1	111.9	P29 V30 K34 E35 F36 M87	P29-R32 HydrophobicContact CB-CB 4.35Å; P29-R32 HydrophobicContact CB-CG 4.33Å; P29-R32 CarbonylContact O-C 3.56Å; P29-R32 WeakPolarHBondContact O-CA 3.45Å; P29-R32 PolarHBondContact O-N 3.47Å; V30-R32 PolarHBondContact O-N 2.89Å; R32-K34 PolarHBondContact O-N 3.14Å; R32-E35 WeakPolarHBondContact CD-OE2 3.41Å; R32-E35 IonicContact CZ-OE1 2.84Å; R32-E35 VanDerWaalsContact CZ-OE1 3.25Å; R32-E35 IonicContact CZ-OE2 3.69Å; R32-E35 IonicContact NE-OE2 3.25Å; R32-E35 PolarHBondContact NE-OE2 3.27Å; R32-E35 IonicContact NH1-OE1 3.67Å; R32-E35 PolarHBondContact NH1-OE1 3.17Å; R32-E35 IonicContact NH1-OE2 3.97Å; R32-E35 PolarHBondContact NH1-OE2 3.24Å; R32-E35 IonicContact NH2-OE1 2.67Å; R32-E35 PolarHBondContact NH2-OE1 3.06Å; R32-E35 IonicContact NH2-OE2 3.02Å; R32-E35 WeakPolarHBondContact O-CB 3.43Å; R32-E35 PolarHBondContact O-N 3.45Å; R32-F36 PolarHBondContact O-N 3.47Å; R32-M87 HydrophobicContact CB-CE 3.71Å; R32-M87 PolarHBondContact NH2-O 3.48Å; R32-M87 WeakPolarHBondContact O-CE 3.34Å
33	W	98.3	Very high	97.9	Very high	12 Å²	12	55.9 Å²	55.9	5%	0.045	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-49.7	-171.8	-177.1	-114.6	0	0	0	114	I25 V28 P29 V30 E35 F36 L37 Q62 M65 L66	I25-W33 HydrophobicContact CB-CH2 4.46Å; I25-W33 HydrophobicContact CG1-CH2 3.83Å; I25-W33 HydrophobicContact CG1-CZ2 4.41Å; I25-W33 HydrophobicContact CG1-CZ3 4.46Å; I25-W33 HydrophobicContact CG2-CH2 4.46Å; V28-W33 HydrophobicContact CB-CE3 3.84Å; V28-W33 HydrophobicContact CB-CZ3 3.84Å; V28-W33 HydrophobicContact CG1-CE3 3.68Å; V28-W33 HydrophobicContact CG1-CZ3 4.1Å; V28-W33 HydrophobicContact CG2-CZ3 4.18Å; P29-W33 PolarHBondContact O-N 2.92Å; V30-W33 VanDerWaalsContact O-CB 3.23Å; V30-W33 WeakPolarHBondContact O-CB 3.4Å; V30-W33 PolarHBondContact O-N 3.3Å; W33-E35 VanDerWaalsContact C-N 3.33Å; W33-E35 PolarHBondContact O-N 3.06Å; W33-F36 HydrophobicContact CE3-CD1 4.08Å; W33-F36 HydrophobicContact CH2-CD1 4.36Å; W33-F36 HydrophobicContact CH2-CE1 4.33Å; W33-F36 AromaticContact CZ3-CD1 3.78Å; W33-F36 HydrophobicContact CZ3-CD1 3.78Å; W33-F36 AromaticContact CZ3-CE1 3.96Å; W33-F36 HydrophobicContact CZ3-CE1 3.96Å; W33-F36 WeakPolarHBondContact O-CB 3.44Å; W33-F36 PolarHBondContact O-N 3.26Å; W33-L37 HydrophobicContact CD2-CD1 4.3Å; W33-L37 HydrophobicContact CD2-CG 4.41Å; W33-L37 HydrophobicContact CG-CD1 4.37Å; W33-L37 HydrophobicContact CZ2-CD1 4.02Å; W33-L37 HydrophobicContact CZ2-CD2 4Å; W33-L37 HydrophobicContact CZ2-CG 4.11Å; W33-L37 WeakPolarHBondContact O-CG 3.44Å; W33-L37 PolarHBondContact O-N 3.47Å; W33-Q62 HydrophobicContact CD2-CG 4.34Å; W33-Q62 HydrophobicContact CG-CG 4.45Å; W33-Q62 HydrophobicContact CZ2-CB 3.81Å; W33-Q62 HydrophobicContact CZ2-CG 4.33Å; W33-Q62 WeakPolarHBondContact CZ2-O 3.49Å; W33-M65 PolarHBondContact NE1-SD 2.93Å; W33-M65 VanDerWaalsContact NE1-SD 3.37Å; W33-L66 HydrophobicContact CH2-CD1 3.73Å; W33-L66 HydrophobicContact CH2-CD2 4.02Å; W33-L66 HydrophobicContact CH2-CG 3.53Å; W33-L66 HydrophobicContact CZ2-CD1 4.43Å; W33-L66 HydrophobicContact CZ2-CG 3.88Å
34	K	98.2	Very high	98	Very high	77 Å²	77	58.6 Å²	58.6	34%	0.335	28%	0.28	S	S	.	.	H	α-helix	trans	-65.5	-36.8	179.8	-65.2	-167.5	178.9	-165.4	0	112.4	R32 L37 R38 M47 E51	R32-K34 PolarHBondContact O-N 3.14Å; K34-L37 PolarHBondContact O-N 3.4Å; K34-R38 WeakPolarHBondContact O-CG 3.44Å; K34-R38 PolarHBondContact O-N 3.3Å; K34-M47 HydrophobicContact CB-CE 4.38Å; K34-M47 HydrophobicContact CB-SD 4.05Å; K34-M47 HydrophobicContact CG-SD 4.06Å; K34-E51 WeakPolarHBondContact CE-OE1 3.45Å; K34-E51 IonicContact NZ-OE1 3.94Å; K34-E51 PolarHBondContact NZ-OE1 3.43Å; K34-E51 IonicContact NZ-OE2 2.74Å; K34-E51 PolarHBondContact NZ-OE2 2.85Å
35	E	98.6	Very high	98	Very high	70 Å²	70	64.1 Å²	64.1	33%	0.327	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-46.8	175.4	-178.8	-175.7	167.2	0	0	111.1	R32 W33 L37 R38 L39 M87	R32-E35 WeakPolarHBondContact CD-OE2 3.41Å; R32-E35 IonicContact CZ-OE1 2.84Å; R32-E35 VanDerWaalsContact CZ-OE1 3.25Å; R32-E35 IonicContact CZ-OE2 3.69Å; R32-E35 IonicContact NE-OE2 3.25Å; R32-E35 PolarHBondContact NE-OE2 3.27Å; R32-E35 IonicContact NH1-OE1 3.67Å; R32-E35 PolarHBondContact NH1-OE1 3.17Å; R32-E35 IonicContact NH1-OE2 3.97Å; R32-E35 PolarHBondContact NH1-OE2 3.24Å; R32-E35 IonicContact NH2-OE1 2.67Å; R32-E35 PolarHBondContact NH2-OE1 3.06Å; R32-E35 IonicContact NH2-OE2 3.02Å; R32-E35 WeakPolarHBondContact O-CB 3.43Å; R32-E35 PolarHBondContact O-N 3.45Å; W33-E35 VanDerWaalsContact C-N 3.33Å; W33-E35 PolarHBondContact O-N 3.06Å; E35-L37 PolarHBondContact O-N 3.09Å; E35-R38 PolarHBondContact O-N 3.5Å; E35-L39 PolarHBondContact O-N 3.1Å; E35-M87 HydrophobicContact CB-CE 4.06Å; E35-M87 HydrophobicContact CG-CE 3.93Å
36	F	98.8	Very high	98	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-57.9	-46.9	174.7	171.5	-110.9	0	0	0	112.3	I24 V28 R32 W33 R38 L39 L40 L66 V80 L84 M87	I24-F36 HydrophobicContact CG2-CE1 3.8Å; I24-F36 HydrophobicContact CG2-CZ 3.85Å; V28-F36 HydrophobicContact CG1-CB 4.06Å; V28-F36 HydrophobicContact CG1-CD1 4.14Å; V28-F36 HydrophobicContact CG1-CG 4.1Å; V28-F36 HydrophobicContact CG2-CD1 4.11Å; V28-F36 HydrophobicContact CG2-CE1 4.02Å; V28-F36 HydrophobicContact CG2-CG 4.37Å; V28-F36 HydrophobicContact CG2-CZ 4.22Å; R32-F36 PolarHBondContact O-N 3.47Å; W33-F36 HydrophobicContact CE3-CD1 4.08Å; W33-F36 HydrophobicContact CH2-CD1 4.36Å; W33-F36 HydrophobicContact CH2-CE1 4.33Å; W33-F36 AromaticContact CZ3-CD1 3.78Å; W33-F36 HydrophobicContact CZ3-CD1 3.78Å; W33-F36 AromaticContact CZ3-CE1 3.96Å; W33-F36 HydrophobicContact CZ3-CE1 3.96Å; W33-F36 WeakPolarHBondContact O-CB 3.44Å; W33-F36 PolarHBondContact O-N 3.26Å; F36-R38 VanDerWaalsContact C-N 3.31Å; F36-R38 PolarHBondContact O-N 3.13Å; F36-L39 WeakPolarHBondContact O-CB 3.23Å; F36-L39 PolarHBondContact O-N 3.27Å; F36-L39 VanDerWaalsContact O-N 3.1Å; F36-L40 HydrophobicContact CD1-CD1 4.2Å; F36-L40 HydrophobicContact CE1-CD1 3.48Å; F36-L40 VanDerWaalsContact CE1-CD1 3.48Å; F36-L40 HydrophobicContact CE1-CG 4.26Å; F36-L40 HydrophobicContact CE2-CD1 4.08Å; F36-L40 HydrophobicContact CE2-CD2 4.36Å; F36-L40 HydrophobicContact CE2-CG 4.15Å; F36-L40 HydrophobicContact CZ-CD1 3.42Å; F36-L40 VanDerWaalsContact CZ-CD1 3.42Å; F36-L40 HydrophobicContact CZ-CD2 4.4Å; F36-L40 HydrophobicContact CZ-CG 4Å; F36-L40 PolarHBondContact O-N 2.93Å; F36-L66 HydrophobicContact CE1-CD2 4.21Å; F36-V80 HydrophobicContact CE2-CG1 4.18Å; F36-V80 HydrophobicContact CZ-CG1 3.92Å; F36-V80 HydrophobicContact CZ-CG2 4.35Å; F36-L84 HydrophobicContact CD2-CD2 3.75Å; F36-L84 HydrophobicContact CD2-CG 4.26Å; F36-L84 HydrophobicContact CE2-CD2 3.82Å; F36-L84 HydrophobicContact CE2-CG 3.91Å; F36-M87 VanDerWaalsContact CA-SD 3.57Å; F36-M87 HydrophobicContact CB-CE 3.9Å; F36-M87 HydrophobicContact CB-SD 3.71Å; F36-M87 HydrophobicContact CD2-SD 4.09Å; F36-M87 HydrophobicContact CG-SD 4.41Å
37	L	98.6	Very high	98	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-35.1	178.7	-77.1	176.4	0	0	0	113.4	W33 K34 E35 L39 L40 S41 V42 M47 M65 L66	W33-L37 HydrophobicContact CD2-CD1 4.3Å; W33-L37 HydrophobicContact CD2-CG 4.41Å; W33-L37 HydrophobicContact CG-CD1 4.37Å; W33-L37 HydrophobicContact CZ2-CD1 4.02Å; W33-L37 HydrophobicContact CZ2-CD2 4Å; W33-L37 HydrophobicContact CZ2-CG 4.11Å; W33-L37 WeakPolarHBondContact O-CG 3.44Å; W33-L37 PolarHBondContact O-N 3.47Å; K34-L37 PolarHBondContact O-N 3.4Å; E35-L37 PolarHBondContact O-N 3.09Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L40 CarbonylContact O-C 3.36Å; L37-L40 WeakPolarHBondContact O-CA 3.35Å; L37-L40 PolarHBondContact O-N 2.95Å; L37-S41 PolarHBondContact O-N 3.07Å; L37-V42 HydrophobicContact CB-CB 4.16Å; L37-V42 HydrophobicContact CD2-CB 4.35Å; L37-V42 HydrophobicContact CD2-CG2 4.06Å; L37-V42 WeakPolarHBondContact O-CB 3.2Å; L37-V42 PolarHBondContact O-N 2.79Å; L37-M47 HydrophobicContact CB-SD 3.58Å; L37-M47 VanDerWaalsContact CB-SD 3.58Å; L37-M47 HydrophobicContact CD1-CG 4Å; L37-M47 HydrophobicContact CD1-SD 3.54Å; L37-M47 VanDerWaalsContact CD1-SD 3.54Å; L37-M47 HydrophobicContact CG-SD 4.25Å; L37-M65 HydrophobicContact CD1-CB 3.57Å; L37-M65 HydrophobicContact CD1-CG 3.96Å; L37-M65 HydrophobicContact CD1-SD 3.46Å; L37-M65 WeakPolarHBondContact CD1-SD 3.46Å; L37-M65 HydrophobicContact CD2-CB 4.18Å; L37-L66 HydrophobicContact CD2-CD2 4.18Å
38	R	98.6	Very high	98	Very high	122 Å²	122	62.5 Å²	62.5	46%	0.46	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-38.7	173.3	-70.5	-178.4	-164.3	114.8	2.8	112.1	K34 E35 F36 L40 S41 D44 M47	K34-R38 WeakPolarHBondContact O-CG 3.44Å; K34-R38 PolarHBondContact O-N 3.3Å; E35-R38 PolarHBondContact O-N 3.5Å; F36-R38 VanDerWaalsContact C-N 3.31Å; F36-R38 PolarHBondContact O-N 3.13Å; R38-L40 VanDerWaalsContact C-N 3.3Å; R38-L40 PolarHBondContact O-N 3.11Å; R38-S41 VanDerWaalsContact O-CA 3.31Å; R38-S41 WeakPolarHBondContact O-CA 3.3Å; R38-S41 PolarHBondContact O-N 3.38Å; R38-D44 IonicContact CZ-OD1 2.71Å; R38-D44 IonicContact CZ-OD2 3.92Å; R38-D44 IonicContact NE-OD1 2.76Å; R38-D44 PolarHBondContact NE-OD1 2.86Å; R38-D44 IonicContact NE-OD2 3.2Å; R38-D44 PolarHBondContact NE-OD2 2.72Å; R38-D44 VanDerWaalsContact NE-OD2 3.15Å; R38-D44 IonicContact NH2-OD1 2.85Å; R38-D44 PolarHBondContact NH2-OD1 3.36Å; R38-D44 IonicContact NH2-OD2 3.15Å; R38-M47 HydrophobicContact CG-CE 3.87Å
39	L	98.4	Very high	98	Very high	75 Å²	75	68.7 Å²	68.7	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-66.5	-34.3	174.6	-65.9	175.1	0	0	0	111.7	E35 F36 L37 S41 S83 L86 M87	E35-L39 PolarHBondContact O-N 3.1Å; F36-L39 WeakPolarHBondContact O-CB 3.23Å; F36-L39 PolarHBondContact O-N 3.27Å; F36-L39 VanDerWaalsContact O-N 3.1Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L39-S41 PolarHBondContact O-N 2.99Å; L39-S41 VanDerWaalsContact O-N 3.15Å; L39-S83 WeakPolarHBondContact CB-OG 3.46Å; L39-L86 HydrophobicContact CD1-CB 4.48Å; L39-M87 HydrophobicContact CD1-CG 3.53Å; L39-M87 HydrophobicContact CD1-SD 3.74Å
40	L	97.9	Very high	98.1	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	10	168.1	-62.1	-169.7	0	0	0	113.9	F36 L37 R38 V42 L66 W69 R72 E79 V80	F36-L40 HydrophobicContact CD1-CD1 4.2Å; F36-L40 HydrophobicContact CE1-CD1 3.48Å; F36-L40 VanDerWaalsContact CE1-CD1 3.48Å; F36-L40 HydrophobicContact CE1-CG 4.26Å; F36-L40 HydrophobicContact CE2-CD1 4.08Å; F36-L40 HydrophobicContact CE2-CD2 4.36Å; F36-L40 HydrophobicContact CE2-CG 4.15Å; F36-L40 HydrophobicContact CZ-CD1 3.42Å; F36-L40 VanDerWaalsContact CZ-CD1 3.42Å; F36-L40 HydrophobicContact CZ-CD2 4.4Å; F36-L40 HydrophobicContact CZ-CG 4Å; F36-L40 PolarHBondContact O-N 2.93Å; L37-L40 CarbonylContact O-C 3.36Å; L37-L40 WeakPolarHBondContact O-CA 3.35Å; L37-L40 PolarHBondContact O-N 2.95Å; R38-L40 VanDerWaalsContact C-N 3.3Å; R38-L40 PolarHBondContact O-N 3.11Å; L40-V42 PolarHBondContact O-N 3.37Å; L40-L66 HydrophobicContact CD1-CD2 3.96Å; L40-W69 HydrophobicContact CB-CB 4.48Å; L40-W69 HydrophobicContact CB-CG 4.11Å; L40-W69 HydrophobicContact CD1-CD2 4.01Å; L40-W69 HydrophobicContact CD1-CG 4Å; L40-R72 PolarHBondContact O-NH1 3.27Å; L40-E79 HydrophobicContact CD2-CB 4.24Å; L40-V80 HydrophobicContact CD1-CG2 4.39Å; L40-V80 HydrophobicContact CD2-CG2 4.22Å
41	S	97.1	Very high	98.1	Very high	69 Å²	69	65.1 Å²	65.1	48%	0.483	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	31.9	-178	-3.4	0	0	0	0	114.9	L37 R38 L39 R72	L37-S41 PolarHBondContact O-N 3.07Å; R38-S41 VanDerWaalsContact O-CA 3.31Å; R38-S41 WeakPolarHBondContact O-CA 3.3Å; R38-S41 PolarHBondContact O-N 3.38Å; L39-S41 PolarHBondContact O-N 2.99Å; L39-S41 VanDerWaalsContact O-N 3.15Å; S41-R72 PolarHBondContact OG-NH1 3.47Å
42	V	98	Very high	98.1	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.018	29%	0.286	C	S	.	.			trans	-83.4	116.4	161.5	-174.9	0	0	0	0	107.1	L37 L40 Q46 M47 L68 W69	L37-V42 HydrophobicContact CB-CB 4.16Å; L37-V42 HydrophobicContact CD2-CB 4.35Å; L37-V42 HydrophobicContact CD2-CG2 4.06Å; L37-V42 WeakPolarHBondContact O-CB 3.2Å; L37-V42 PolarHBondContact O-N 2.79Å; L40-V42 PolarHBondContact O-N 3.37Å; V42-Q46 HydrophobicContact CG1-CB 3.98Å; V42-M47 HydrophobicContact CG1-CG 3.91Å; V42-L68 HydrophobicContact CG1-CB 4.46Å; V42-L68 HydrophobicContact CG1-CD1 4.21Å; V42-W69 HydrophobicContact CG2-CB 3.75Å
43	S	97.9	Very high	98	Very high	50 Å²	50	60.8 Å²	60.8	35%	0.35	29%	0.291	S	S	.	.			trans	-73.4	157.9	-172.8	73.5	0	0	0	0	112.5	Q45 Q46 M47	S43-Q45 PolarHBondContact O-N 3.22Å; S43-Q46 WeakPolarHBondContact O-CB 3.22Å; S43-Q46 PolarHBondContact O-N 3.3Å; S43-Q46 WeakPolarHBondContact OG-CG 3.25Å; S43-Q46 PolarHBondContact OG-N 2.98Å; S43-Q46 PolarHBondContact OG-OE1 3.21Å; S43-M47 PolarHBondContact O-N 3.44Å
44	D	98.3	Very high	97.7	Very high	66 Å²	66	65 Å²	65	35%	0.353	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-41.9	173.5	-71.1	-61.3	0	0	0	111.8	R38 Q46 M47 E48	R38-D44 IonicContact CZ-OD1 2.71Å; R38-D44 IonicContact CZ-OD2 3.92Å; R38-D44 IonicContact NE-OD1 2.76Å; R38-D44 PolarHBondContact NE-OD1 2.86Å; R38-D44 IonicContact NE-OD2 3.2Å; R38-D44 PolarHBondContact NE-OD2 2.72Å; R38-D44 VanDerWaalsContact NE-OD2 3.15Å; R38-D44 IonicContact NH2-OD1 2.85Å; R38-D44 PolarHBondContact NH2-OD1 3.36Å; R38-D44 IonicContact NH2-OD2 3.15Å; D44-Q46 VanDerWaalsContact C-N 3.3Å; D44-Q46 PolarHBondContact O-N 2.97Å; D44-M47 HydrophobicContact CB-CE 4.4Å; D44-M47 PolarHBondContact O-N 3.01Å; D44-M47 VanDerWaalsContact OD1-CE 3.24Å; D44-M47 WeakPolarHBondContact OD1-CE 3.48Å; D44-E48 WeakPolarHBondContact O-CB 3.35Å; D44-E48 VanDerWaalsContact O-CG 3.3Å; D44-E48 WeakPolarHBondContact O-CG 3.31Å; D44-E48 PolarHBondContact O-N 3.18Å
45	Q	98.5	Very high	97.5	Very high	116 Å²	116	65.4 Å²	65.4	54%	0.542	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-39.1	176.1	-171.4	-175.8	28.6	0	0	112.5	S43 R49	S43-Q45 PolarHBondContact O-N 3.22Å; Q45-R49 VanDerWaalsContact O-CG 3.3Å; Q45-R49 WeakPolarHBondContact O-CG 3.32Å; Q45-R49 PolarHBondContact O-N 3.29Å
46	Q	98.2	Very high	97.3	Very high	62 Å²	62	64.5 Å²	64.5	29%	0.29	35%	0.352	S	S	.	.	H	α-helix	trans	-67.9	-44.1	176.5	-79.7	175.7	-50.6	0	0	111.5	V42 S43 D44 R49 V50 L68	V42-Q46 HydrophobicContact CG1-CB 3.98Å; S43-Q46 WeakPolarHBondContact O-CB 3.22Å; S43-Q46 PolarHBondContact O-N 3.3Å; S43-Q46 WeakPolarHBondContact OG-CG 3.25Å; S43-Q46 PolarHBondContact OG-N 2.98Å; S43-Q46 PolarHBondContact OG-OE1 3.21Å; D44-Q46 VanDerWaalsContact C-N 3.3Å; D44-Q46 PolarHBondContact O-N 2.97Å; Q46-R49 PolarHBondContact O-N 3.32Å; Q46-V50 PolarHBondContact O-N 3.32Å; Q46-L68 HydrophobicContact CB-CD1 3.98Å
47	M	98.3	Very high	97.1	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-61.9	-46.7	176.6	-67.8	-173.9	-76.7	0	0	111.5	K34 L37 R38 V42 S43 D44 R49 V50 E51 M65	K34-M47 HydrophobicContact CB-CE 4.38Å; K34-M47 HydrophobicContact CB-SD 4.05Å; K34-M47 HydrophobicContact CG-SD 4.06Å; L37-M47 HydrophobicContact CB-SD 3.58Å; L37-M47 VanDerWaalsContact CB-SD 3.58Å; L37-M47 HydrophobicContact CD1-CG 4Å; L37-M47 HydrophobicContact CD1-SD 3.54Å; L37-M47 VanDerWaalsContact CD1-SD 3.54Å; L37-M47 HydrophobicContact CG-SD 4.25Å; R38-M47 HydrophobicContact CG-CE 3.87Å; V42-M47 HydrophobicContact CG1-CG 3.91Å; S43-M47 PolarHBondContact O-N 3.44Å; D44-M47 HydrophobicContact CB-CE 4.4Å; D44-M47 PolarHBondContact O-N 3.01Å; D44-M47 VanDerWaalsContact OD1-CE 3.24Å; D44-M47 WeakPolarHBondContact OD1-CE 3.48Å; M47-R49 VanDerWaalsContact C-N 3.31Å; M47-R49 PolarHBondContact O-N 2.94Å; M47-V50 PolarHBondContact O-N 3.22Å; M47-V50 VanDerWaalsContact O-N 3.16Å; M47-E51 WeakPolarHBondContact O-CG 3.45Å; M47-E51 PolarHBondContact O-N 3.06Å; M47-M65 HydrophobicContact CB-CE 4.07Å; M47-M65 HydrophobicContact CB-SD 4.49Å; M47-M65 HydrophobicContact CG-CG 4.44Å; M47-M65 HydrophobicContact CG-SD 4.29Å; M47-M65 WeakPolarHBondContact O-CE 3.33Å
48	E	98.2	Very high	96.9	Very high	106 Å²	106	70.7 Å²	70.7	50%	0.495	40%	0.402	S	S	.	.	H	α-helix	trans	-58.8	-40.4	178.6	-76	171.3	-173	0	0	112.2	D44 V50 E51 M52	D44-E48 WeakPolarHBondContact O-CB 3.35Å; D44-E48 VanDerWaalsContact O-CG 3.3Å; D44-E48 WeakPolarHBondContact O-CG 3.31Å; D44-E48 PolarHBondContact O-N 3.18Å; E48-V50 PolarHBondContact O-N 2.69Å; E48-E51 PolarHBondContact O-N 3.23Å; E48-M52 WeakPolarHBondContact O-CG 3.36Å; E48-M52 PolarHBondContact O-N 3.26Å
49	R	98	Very high	96.8	Very high	135 Å²	135	68.7 Å²	68.7	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-58.6	-46.9	175.4	-75.2	173.9	-170.5	167.4	4.9	111.7	Q45 Q46 M47 E51 M52 E53	Q45-R49 VanDerWaalsContact O-CG 3.3Å; Q45-R49 WeakPolarHBondContact O-CG 3.32Å; Q45-R49 PolarHBondContact O-N 3.29Å; Q46-R49 PolarHBondContact O-N 3.32Å; M47-R49 VanDerWaalsContact C-N 3.31Å; M47-R49 PolarHBondContact O-N 2.94Å; R49-E51 VanDerWaalsContact C-N 3.31Å; R49-E51 PolarHBondContact O-N 3.35Å; R49-M52 HydrophobicContact CG-CE 4.46Å; R49-M52 PolarHBondContact O-N 3.49Å; R49-E53 PolarHBondContact O-N 2.97Å
50	V	98	Very high	96.7	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-65	-36.6	176.7	177.2	0	0	0	0	111.3	Q46 M47 E48 M52 E53 K61 Q64 M65 L68	Q46-V50 PolarHBondContact O-N 3.32Å; M47-V50 PolarHBondContact O-N 3.22Å; M47-V50 VanDerWaalsContact O-N 3.16Å; E48-V50 PolarHBondContact O-N 2.69Å; V50-M52 VanDerWaalsContact C-N 3.29Å; V50-M52 PolarHBondContact O-N 2.97Å; V50-E53 WeakPolarHBondContact O-CB 3.22Å; V50-E53 PolarHBondContact O-N 3.38Å; V50-K61 HydrophobicContact CG1-CB 4.05Å; V50-K61 HydrophobicContact CG1-CG 4.23Å; V50-K61 WeakPolarHBondContact CG1-O 3.43Å; V50-Q64 HydrophobicContact CG1-CB 3.72Å; V50-Q64 HydrophobicContact CG2-CB 4.37Å; V50-M65 HydrophobicContact CB-CE 4.26Å; V50-M65 HydrophobicContact CB-CG 4.11Å; V50-M65 HydrophobicContact CG1-CE 4.28Å; V50-M65 HydrophobicContact CG1-CG 4Å; V50-M65 HydrophobicContact CG2-CG 4.32Å; V50-L68 HydrophobicContact CG2-CD1 4Å
51	E	97.1	Very high	96.7	Very high	71 Å²	71	70.3 Å²	70.3	33%	0.332	40%	0.404	S	S	.	.	H	α-helix	trans	-65.7	-32.3	177.2	-71.8	-178.6	145	0	0	113.2	K34 M47 E48 R49 E53 K61 M65	K34-E51 WeakPolarHBondContact CE-OE1 3.45Å; K34-E51 IonicContact NZ-OE1 3.94Å; K34-E51 PolarHBondContact NZ-OE1 3.43Å; K34-E51 IonicContact NZ-OE2 2.74Å; K34-E51 PolarHBondContact NZ-OE2 2.85Å; M47-E51 WeakPolarHBondContact O-CG 3.45Å; M47-E51 PolarHBondContact O-N 3.06Å; E48-E51 PolarHBondContact O-N 3.23Å; R49-E51 VanDerWaalsContact C-N 3.31Å; R49-E51 PolarHBondContact O-N 3.35Å; E51-E53 VanDerWaalsContact C-N 3.3Å; E51-K61 PolarHBondContact O-NZ 3.17Å; E51-M65 HydrophobicContact CG-CE 3.47Å; E51-M65 VanDerWaalsContact CG-CE 3.47Å
52	M	97.1	Very high	96.8	Very high	146 Å²	146	68 Å²	68	72%	0.719	39%	0.386	S	S	*	.	H	α-helix	trans	-76.9	-12.8	176.3	-70	-171	-62.6	0	0	113.8	E48 R49 V50 A54	E48-M52 WeakPolarHBondContact O-CG 3.36Å; E48-M52 PolarHBondContact O-N 3.26Å; R49-M52 HydrophobicContact CG-CE 4.46Å; R49-M52 PolarHBondContact O-N 3.49Å; V50-M52 VanDerWaalsContact C-N 3.29Å; V50-M52 PolarHBondContact O-N 2.97Å; M52-A54 PolarHBondContact O-N 3.28Å; M52-A54 VanDerWaalsContact O-N 3.11Å
53	E	95.9	Very high	96.8	Very high	88 Å²	88	68.8 Å²	68.8	41%	0.411	39%	0.388	S	S	.	.			trans	-64.2	115.1	177.2	-70.2	177.1	-150	0	0	110.5	R49 V50 E51 L56 K61	R49-E53 PolarHBondContact O-N 2.97Å; V50-E53 WeakPolarHBondContact O-CB 3.22Å; V50-E53 PolarHBondContact O-N 3.38Å; E51-E53 VanDerWaalsContact C-N 3.3Å; E53-L56 HydrophobicContact CB-CD1 3.83Å; E53-L56 HydrophobicContact CB-CG 4.14Å; E53-L56 VanDerWaalsContact OE2-CD1 3.22Å; E53-L56 WeakPolarHBondContact OE2-CD1 3.48Å; E53-K61 WeakPolarHBondContact O-CE 3.48Å
54	A	92.8	Very high	96.8	Very high	100 Å²	100	69.3 Å²	69.3	83%	0.826	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	143.6	-179.4	0	0	0	0	0	110.8	M52 L56	M52-A54 PolarHBondContact O-N 3.28Å; M52-A54 VanDerWaalsContact O-N 3.11Å; A54-L56 VanDerWaalsContact C-N 3.29Å; A54-L56 PolarHBondContact O-N 2.69Å
55	G	93.3	Very high	96.8	Very high	86 Å²	86	66.3 Å²	66.3	89%	0.887	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-7.4	177.5	0	0	0	0	0	115.3
56	L	93.6	Very high	96.7	Very high	50 Å²	50	60.8 Å²	60.8	26%	0.262	34%	0.343	S	S	.	.			trans	-85.4	129.7	174	-58.4	-168.3	0	0	0	112	E53 A54 E60 K61 Q64	E53-L56 HydrophobicContact CB-CD1 3.83Å; E53-L56 HydrophobicContact CB-CG 4.14Å; E53-L56 VanDerWaalsContact OE2-CD1 3.22Å; E53-L56 WeakPolarHBondContact OE2-CD1 3.48Å; A54-L56 VanDerWaalsContact C-N 3.29Å; A54-L56 PolarHBondContact O-N 2.69Å; L56-E60 HydrophobicContact CB-CB 4.4Å; L56-E60 HydrophobicContact CB-CG 4.38Å; L56-E60 HydrophobicContact CD1-CG 4.27Å; L56-E60 HydrophobicContact CD2-CG 3.81Å; L56-E60 HydrophobicContact CG-CG 4.38Å; L56-K61 HydrophobicContact CB-CD 4.47Å; L56-K61 HydrophobicContact CB-CG 3.79Å; L56-K61 HydrophobicContact CD1-CG 4.4Å; L56-K61 VanDerWaalsContact O-CE 3.31Å; L56-K61 WeakPolarHBondContact O-CE 3.47Å; L56-Q64 HydrophobicContact CD1-CG 4.17Å
57	G	95.4	Very high	96.7	Very high	46 Å²	46	59.3 Å²	59.3	47%	0.474	34%	0.335	S	S	.	.			trans	-71.3	166.4	168.9	0	0	0	0	0	112.4	M59 E60 K61	G57-M59 PolarHBondContact O-N 2.96Å; G57-E60 PolarHBondContact O-N 3.03Å; G57-E60 VanDerWaalsContact O-N 3.15Å; G57-K61 PolarHBondContact O-N 3.22Å
58	S	94.6	Very high	96.6	Very high	85 Å²	85	61.8 Å²	61.8	59%	0.594	35%	0.348	S	S	*	.	H	α-helix	trans	-55.1	-49	-177.5	-174.5	0	0	0	0	113.1	E60 K61 Q62	S58-E60 VanDerWaalsContact C-N 3.3Å; S58-E60 PolarHBondContact O-N 3.35Å; S58-K61 WeakPolarHBondContact O-CB 3.34Å; S58-K61 PolarHBondContact O-N 3.44Å; S58-Q62 WeakPolarHBondContact O-CG 3.15Å; S58-Q62 PolarHBondContact O-N 3.13Å
59	M	96	Very high	96.5	Very high	80 Å²	80	56.8 Å²	56.8	39%	0.394	33%	0.325	S	S	.	.	H	α-helix	trans	-57.9	-42.3	178.3	-178.7	89.1	-90.2	0	0	112.1	Y22 I25 G57 Q62 Y63	Y22-M59 HydrophobicContact CD1-CE 4.2Å; Y22-M59 HydrophobicContact CD1-SD 4.44Å; Y22-M59 HydrophobicContact CE1-CE 4.48Å; Y22-M59 HydrophobicContact CE1-CG 4.2Å; I25-M59 HydrophobicContact CB-CE 3.59Å; I25-M59 HydrophobicContact CD1-CE 3.71Å; I25-M59 HydrophobicContact CG1-CE 4.21Å; I25-M59 HydrophobicContact CG2-CE 3.08Å; G57-M59 PolarHBondContact O-N 2.96Å; M59-Q62 PolarHBondContact O-N 3.21Å; M59-Y63 PolarHBondContact O-N 3.31Å
60	E	97.1	Very high	96.4	Very high	58 Å²	58	50.4 Å²	50.4	27%	0.271	30%	0.301	S	S	.	.	H	α-helix	trans	-69	-38.2	-179.6	-171.4	53.3	-146	0	0	111	L56 G57 S58 Q62 Y63 Q64	L56-E60 HydrophobicContact CB-CB 4.4Å; L56-E60 HydrophobicContact CB-CG 4.38Å; L56-E60 HydrophobicContact CD1-CG 4.27Å; L56-E60 HydrophobicContact CD2-CG 3.81Å; L56-E60 HydrophobicContact CG-CG 4.38Å; G57-E60 PolarHBondContact O-N 3.03Å; G57-E60 VanDerWaalsContact O-N 3.15Å; S58-E60 VanDerWaalsContact C-N 3.3Å; S58-E60 PolarHBondContact O-N 3.35Å; E60-Q62 PolarHBondContact O-N 3.39Å; E60-Y63 WeakPolarHBondContact O-CB 3.47Å; E60-Y63 PolarHBondContact O-N 3.25Å; E60-Q64 WeakPolarHBondContact O-CG 3.31Å; E60-Q64 PolarHBondContact O-N 3.09Å; E60-Q64 PolarHBondContact OE1-NE2 2.9Å
61	K	98	Very high	96.1	Very high	51 Å²	51	55 Å²	55	22%	0.222	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-43.8	172.5	-70.2	179	175.1	-176.3	0	112	V50 E51 E53 L56 G57 S58 Y63 Q64 M65	V50-K61 HydrophobicContact CG1-CB 4.05Å; V50-K61 HydrophobicContact CG1-CG 4.23Å; V50-K61 WeakPolarHBondContact CG1-O 3.43Å; E51-K61 PolarHBondContact O-NZ 3.17Å; E53-K61 WeakPolarHBondContact O-CE 3.48Å; L56-K61 HydrophobicContact CB-CD 4.47Å; L56-K61 HydrophobicContact CB-CG 3.79Å; L56-K61 HydrophobicContact CD1-CG 4.4Å; L56-K61 VanDerWaalsContact O-CE 3.31Å; L56-K61 WeakPolarHBondContact O-CE 3.47Å; G57-K61 PolarHBondContact O-N 3.22Å; S58-K61 WeakPolarHBondContact O-CB 3.34Å; S58-K61 PolarHBondContact O-N 3.44Å; K61-Y63 VanDerWaalsContact C-N 3.3Å; K61-Y63 PolarHBondContact O-N 3.28Å; K61-Q64 PolarHBondContact O-N 3.05Å; K61-M65 VanDerWaalsContact O-CG 3.25Å; K61-M65 WeakPolarHBondContact O-CG 3.35Å; K61-M65 PolarHBondContact O-N 2.71Å
62	Q	98.4	Very high	95.8	Very high	22 Å²	22	55.3 Å²	55.3	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-41	175.2	-64.9	179.7	-63.6	0	0	111.6	I25 W33 S58 M59 E60 M65 L66	I25-Q62 HydrophobicContact CD1-CB 4.17Å; I25-Q62 HydrophobicContact CG1-CB 4.26Å; I25-Q62 HydrophobicContact CG2-CB 3.68Å; I25-Q62 VanDerWaalsContact CG2-CD 3.47Å; I25-Q62 HydrophobicContact CG2-CG 4.2Å; I25-Q62 VanDerWaalsContact CG2-OE1 3.26Å; W33-Q62 HydrophobicContact CD2-CG 4.34Å; W33-Q62 HydrophobicContact CG-CG 4.45Å; W33-Q62 HydrophobicContact CZ2-CB 3.81Å; W33-Q62 HydrophobicContact CZ2-CG 4.33Å; W33-Q62 WeakPolarHBondContact CZ2-O 3.49Å; S58-Q62 WeakPolarHBondContact O-CG 3.15Å; S58-Q62 PolarHBondContact O-N 3.13Å; M59-Q62 PolarHBondContact O-N 3.21Å; E60-Q62 PolarHBondContact O-N 3.39Å; Q62-M65 PolarHBondContact O-N 3.2Å; Q62-L66 PolarHBondContact O-N 3.5Å
63	Y	98	Very high	95.4	Very high	19 Å²	19	53.7 Å²	53.7	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-49.8	175	177.8	-99.7	0	0	0	112.1	A18 L21 Y22 I25 M59 E60 K61 M65 L66 R67	A18-Y63 HydrophobicContact CB-CE2 4.18Å; L21-Y63 HydrophobicContact CB-CD2 4.11Å; L21-Y63 HydrophobicContact CB-CE2 3.99Å; L21-Y63 HydrophobicContact CD1-CD2 4.32Å; L21-Y63 HydrophobicContact CD1-CE2 3.7Å; L21-Y63 HydrophobicContact CG-CE2 4.42Å; Y22-Y63 HydrophobicContact CE1-CD2 4.07Å; Y22-Y63 HydrophobicContact CE1-CG 4.41Å; Y22-Y63 HydrophobicContact CE2-CD2 4.06Å; Y22-Y63 HydrophobicContact CE2-CE2 4.08Å; Y22-Y63 AromaticContact CZ-CD2 3.8Å; I25-Y63 HydrophobicContact CD1-CD2 4.48Å; M59-Y63 PolarHBondContact O-N 3.31Å; E60-Y63 WeakPolarHBondContact O-CB 3.47Å; E60-Y63 PolarHBondContact O-N 3.25Å; K61-Y63 VanDerWaalsContact C-N 3.3Å; K61-Y63 PolarHBondContact O-N 3.28Å; Y63-M65 VanDerWaalsContact C-N 3.29Å; Y63-M65 PolarHBondContact O-N 3.15Å; Y63-L66 PolarHBondContact O-N 3.13Å; Y63-L66 VanDerWaalsContact O-N 3.12Å; Y63-R67 HydrophobicContact CD1-CG 3.99Å; Y63-R67 HydrophobicContact CE1-CG 3.6Å; Y63-R67 HydrophobicContact CE2-CG 4.31Å; Y63-R67 HydrophobicContact CG-CG 4.48Å; Y63-R67 VanDerWaalsContact O-CG 3.3Å; Y63-R67 WeakPolarHBondContact O-CG 3.49Å; Y63-R67 PolarHBondContact O-N 3.48Å
64	Q	97.5	Very high	95.1	Very high	60 Å²	60	52 Å²	52	28%	0.28	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-36.5	178.3	-66.6	-58.4	-22.7	0	0	112.2	V50 L56 E60 K61 R67 L68	V50-Q64 HydrophobicContact CG1-CB 3.72Å; V50-Q64 HydrophobicContact CG2-CB 4.37Å; L56-Q64 HydrophobicContact CD1-CG 4.17Å; E60-Q64 WeakPolarHBondContact O-CG 3.31Å; E60-Q64 PolarHBondContact O-N 3.09Å; E60-Q64 PolarHBondContact OE1-NE2 2.9Å; K61-Q64 PolarHBondContact O-N 3.05Å; Q64-R67 WeakPolarHBondContact O-CB 3.42Å; Q64-R67 PolarHBondContact O-N 3.2Å; Q64-L68 PolarHBondContact O-N 3.1Å
65	M	98.1	Very high	95.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-43.9	172.8	-69.8	170.2	-177.3	0	0	112.5	W33 L37 M47 V50 E51 K61 Q62 Y63 R67 L68	W33-M65 PolarHBondContact NE1-SD 2.93Å; W33-M65 VanDerWaalsContact NE1-SD 3.37Å; L37-M65 HydrophobicContact CD1-CB 3.57Å; L37-M65 HydrophobicContact CD1-CG 3.96Å; L37-M65 HydrophobicContact CD1-SD 3.46Å; L37-M65 WeakPolarHBondContact CD1-SD 3.46Å; L37-M65 HydrophobicContact CD2-CB 4.18Å; M47-M65 HydrophobicContact CB-CE 4.07Å; M47-M65 HydrophobicContact CB-SD 4.49Å; M47-M65 HydrophobicContact CG-CG 4.44Å; M47-M65 HydrophobicContact CG-SD 4.29Å; M47-M65 WeakPolarHBondContact O-CE 3.33Å; V50-M65 HydrophobicContact CB-CE 4.26Å; V50-M65 HydrophobicContact CB-CG 4.11Å; V50-M65 HydrophobicContact CG1-CE 4.28Å; V50-M65 HydrophobicContact CG1-CG 4Å; V50-M65 HydrophobicContact CG2-CG 4.32Å; E51-M65 HydrophobicContact CG-CE 3.47Å; E51-M65 VanDerWaalsContact CG-CE 3.47Å; K61-M65 VanDerWaalsContact O-CG 3.25Å; K61-M65 WeakPolarHBondContact O-CG 3.35Å; K61-M65 PolarHBondContact O-N 2.71Å; Q62-M65 PolarHBondContact O-N 3.2Å; Y63-M65 VanDerWaalsContact C-N 3.29Å; Y63-M65 PolarHBondContact O-N 3.15Å; M65-R67 VanDerWaalsContact C-N 3.3Å; M65-R67 PolarHBondContact O-N 2.87Å; M65-L68 WeakPolarHBondContact O-CB 3.48Å; M65-L68 PolarHBondContact O-N 3.25Å
66	L	97.6	Very high	95.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-30.6	174.8	-87	-176.1	0	0	0	113	L21 I24 I25 W33 F36 L37 L40 Q62 Y63 L68 W69 S70	L21-L66 HydrophobicContact CB-CD1 4.23Å; L21-L66 HydrophobicContact CD2-CB 4.44Å; L21-L66 WeakPolarHBondContact O-CD1 3.31Å; I24-L66 HydrophobicContact CB-CD1 3.94Å; I24-L66 HydrophobicContact CG2-CD1 3.89Å; I24-L66 HydrophobicContact CG2-CD2 4.37Å; I25-L66 HydrophobicContact CD1-CD1 4.14Å; I25-L66 HydrophobicContact CG1-CD1 3.51Å; I25-L66 HydrophobicContact CG1-CG 4.46Å; W33-L66 HydrophobicContact CH2-CD1 3.73Å; W33-L66 HydrophobicContact CH2-CD2 4.02Å; W33-L66 HydrophobicContact CH2-CG 3.53Å; W33-L66 HydrophobicContact CZ2-CD1 4.43Å; W33-L66 HydrophobicContact CZ2-CG 3.88Å; F36-L66 HydrophobicContact CE1-CD2 4.21Å; L37-L66 HydrophobicContact CD2-CD2 4.18Å; L40-L66 HydrophobicContact CD1-CD2 3.96Å; Q62-L66 PolarHBondContact O-N 3.5Å; Y63-L66 PolarHBondContact O-N 3.13Å; Y63-L66 VanDerWaalsContact O-N 3.12Å; L66-L68 PolarHBondContact O-N 3.46Å; L66-W69 HydrophobicContact CD2-CE3 3.99Å; L66-W69 PolarHBondContact O-N 3.41Å; L66-W69 VanDerWaalsContact O-N 3.13Å; L66-S70 WeakPolarHBondContact O-CB 3.46Å; L66-S70 PolarHBondContact O-N 3.36Å
67	R	96.7	Very high	95.5	Very high	31 Å²	31	45.5 Å²	45.5	12%	0.117	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-35.9	175.4	-74.7	-79.1	-85.2	-167.4	-16.2	111.8	E14 L21 Y63 Q64 M65 W69 S70 Q71	E14-R67 IonicContact OE1-CZ 3.36Å; E14-R67 IonicContact OE1-NH1 2.69Å; E14-R67 PolarHBondContact OE1-NH1 3.22Å; E14-R67 IonicContact OE1-NH2 2.69Å; E14-R67 PolarHBondContact OE1-NH2 3.04Å; E14-R67 IonicContact OE2-NH1 3.83Å; L21-R67 HydrophobicContact CD1-CG 4.1Å; Y63-R67 HydrophobicContact CD1-CG 3.99Å; Y63-R67 HydrophobicContact CE1-CG 3.6Å; Y63-R67 HydrophobicContact CE2-CG 4.31Å; Y63-R67 HydrophobicContact CG-CG 4.48Å; Y63-R67 VanDerWaalsContact O-CG 3.3Å; Y63-R67 WeakPolarHBondContact O-CG 3.49Å; Y63-R67 PolarHBondContact O-N 3.48Å; Q64-R67 WeakPolarHBondContact O-CB 3.42Å; Q64-R67 PolarHBondContact O-N 3.2Å; M65-R67 VanDerWaalsContact C-N 3.3Å; M65-R67 PolarHBondContact O-N 2.87Å; R67-W69 VanDerWaalsContact C-N 3.33Å; R67-W69 PolarHBondContact O-N 2.99Å; R67-S70 WeakPolarHBondContact CA-OG 2.82Å; R67-S70 PolarHBondContact O-N 3.26Å; R67-S70 PolarHBondContact O-OG 3.02Å; R67-Q71 WeakPolarHBondContact O-CG 3.41Å; R67-Q71 PolarHBondContact O-N 3.32Å
68	L	96.4	Very high	95.5	Very high	53 Å²	53	48.7 Å²	48.7	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-40.6	174.2	-64.5	167.4	0	0	0	112.1	V42 Q46 V50 Q64 M65 L66	V42-L68 HydrophobicContact CG1-CB 4.46Å; V42-L68 HydrophobicContact CG1-CD1 4.21Å; Q46-L68 HydrophobicContact CB-CD1 3.98Å; V50-L68 HydrophobicContact CG2-CD1 4Å; Q64-L68 PolarHBondContact O-N 3.1Å; M65-L68 WeakPolarHBondContact O-CB 3.48Å; M65-L68 PolarHBondContact O-N 3.25Å; L66-L68 PolarHBondContact O-N 3.46Å
69	W	96.4	Very high	95.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-47.8	173.8	161.8	78	0	0	0	111.5	W16 L21 I24 L40 V42 L66 R67 Q71 R72 A75 S76 E79 V80	W16-W69 HydrophobicContact CD2-CH2 4.28Å; W16-W69 HydrophobicContact CD2-CZ3 4.39Å; W16-W69 AromaticContact CE2-CH2 3.95Å; W16-W69 HydrophobicContact CE3-CH2 4.39Å; W16-W69 AromaticContact CH2-CH2 3.89Å; W16-W69 HydrophobicContact CH2-CH2 3.89Å; W16-W69 AromaticContact CZ2-CH2 3.77Å; W16-W69 HydrophobicContact CZ2-CH2 3.77Å; W16-W69 HydrophobicContact CZ2-CZ2 4.21Å; W16-W69 HydrophobicContact CZ3-CH2 4.2Å; L21-W69 HydrophobicContact CD2-CE3 4.46Å; L21-W69 HydrophobicContact CD2-CZ3 3.97Å; I24-W69 HydrophobicContact CD1-CH2 4.32Å; I24-W69 HydrophobicContact CD1-CZ3 4.09Å; L40-W69 HydrophobicContact CB-CB 4.48Å; L40-W69 HydrophobicContact CB-CG 4.11Å; L40-W69 HydrophobicContact CD1-CD2 4.01Å; L40-W69 HydrophobicContact CD1-CG 4Å; V42-W69 HydrophobicContact CG2-CB 3.75Å; L66-W69 HydrophobicContact CD2-CE3 3.99Å; L66-W69 PolarHBondContact O-N 3.41Å; L66-W69 VanDerWaalsContact O-N 3.13Å; R67-W69 VanDerWaalsContact C-N 3.33Å; R67-W69 PolarHBondContact O-N 2.99Å; W69-Q71 PolarHBondContact O-N 3.48Å; W69-R72 VanDerWaalsContact O-CB 3.25Å; W69-R72 WeakPolarHBondContact O-CB 3.45Å; W69-R72 VanDerWaalsContact O-CG 3.3Å; W69-R72 WeakPolarHBondContact O-CG 3.49Å; W69-R72 PolarHBondContact O-N 3.38Å; W69-A75 HydrophobicContact CD2-CB 4.3Å; W69-A75 HydrophobicContact CZ2-CB 3.96Å; W69-A75 WeakPolarHBondContact O-CB 3.5Å; W69-S76 WeakPolarHBondContact CZ2-O 3.44Å; W69-E79 PolarHBondContact NE1-OE2 3.36Å; W69-V80 HydrophobicContact CH2-CG2 3.6Å; W69-V80 HydrophobicContact CZ2-CG2 3.59Å; W69-V80 HydrophobicContact CZ3-CG2 4.37Å
70	S	95.6	Very high	95.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-22.1	-170.5	75.9	0	0	0	0	114.2	W16 L66 R67 R72	W16-S70 VanDerWaalsContact CD1-O 3.27Å; L66-S70 WeakPolarHBondContact O-CB 3.46Å; L66-S70 PolarHBondContact O-N 3.36Å; R67-S70 WeakPolarHBondContact CA-OG 2.82Å; R67-S70 PolarHBondContact O-N 3.26Å; R67-S70 PolarHBondContact O-OG 3.02Å; S70-R72 VanDerWaalsContact C-N 3.25Å; S70-R72 PolarHBondContact O-N 3.32Å
71	Q	92.6	Very high	95.8	Very high	104 Å²	104	42.2 Å²	42.2	49%	0.486	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.8	173.8	-71.5	169.2	14.7	0	0	113.6	R67 W69	R67-Q71 WeakPolarHBondContact O-CG 3.41Å; R67-Q71 PolarHBondContact O-N 3.32Å; W69-Q71 PolarHBondContact O-N 3.48Å
72	R	91.3	Very high	95.9	Very high	78 Å²	78	42.2 Å²	42.2	29%	0.294	23%	0.226	S	C	.	.	S	Bend	trans	-71.3	142.8	178.8	-62.7	171.3	59.4	-176.6	-2.9	110.9	R15 L40 S41 W69 S70 S74 A75	R15-R72 PolarHBondContact NH1-O 3.32Å; L40-R72 PolarHBondContact O-NH1 3.27Å; S41-R72 PolarHBondContact OG-NH1 3.47Å; W69-R72 VanDerWaalsContact O-CB 3.25Å; W69-R72 WeakPolarHBondContact O-CB 3.45Å; W69-R72 VanDerWaalsContact O-CG 3.3Å; W69-R72 WeakPolarHBondContact O-CG 3.49Å; W69-R72 PolarHBondContact O-N 3.38Å; S70-R72 VanDerWaalsContact C-N 3.25Å; S70-R72 PolarHBondContact O-N 3.32Å; R72-S74 PolarHBondContact NH2-OG 3.12Å; R72-S74 PolarHBondContact O-N 3.25Å; R72-A75 HydrophobicContact CB-CB 4.36Å; R72-A75 WeakPolarHBondContact O-CB 3.47Å; R72-A75 PolarHBondContact O-N 3.06Å
73	S	89	Confident	95.9	Very high	112 Å²	112	41.5 Å²	41.5	78%	0.783	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.7	173.8	55.8	0	0	0	0	113.4	R15	R15-S73 VanDerWaalsContact NH1-CA 3.29Å; R15-S73 PolarHBondContact NH1-O 3.43Å; R15-S73 PolarHBondContact NH2-O 3.26Å
74	S	89.7	Confident	95.9	Very high	53 Å²	53	40.6 Å²	40.6	37%	0.371	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-12.6	175	66.7	0	0	0	0	114.6	R72 S76	R72-S74 PolarHBondContact NH2-OG 3.12Å; R72-S74 PolarHBondContact O-N 3.25Å; S74-S76 PolarHBondContact O-N 2.88Å
75	A	94.4	Very high	95.9	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.041	23%	0.228	C	C	.	.			trans	-54.7	122.6	-173.4	0	0	0	0	0	111.6	W16 W69 R72 E79	W16-A75 HydrophobicContact CZ2-CB 4.48Å; W16-A75 WeakPolarHBondContact CZ2-O 3.3Å; W69-A75 HydrophobicContact CD2-CB 4.3Å; W69-A75 HydrophobicContact CZ2-CB 3.96Å; W69-A75 WeakPolarHBondContact O-CB 3.5Å; R72-A75 HydrophobicContact CB-CB 4.36Å; R72-A75 WeakPolarHBondContact O-CB 3.47Å; R72-A75 PolarHBondContact O-N 3.06Å; A75-E79 WeakPolarHBondContact CA-OE2 3.4Å
76	S	95.9	Very high	95.9	Very high	40 Å²	40	48.6 Å²	48.6	28%	0.28	26%	0.261	S	S	.	.			trans	-145.8	154.5	-178.8	70.8	0	0	0	0	112.8	W69 S74 N78 E79 V80	W69-S76 WeakPolarHBondContact CZ2-O 3.44Å; S74-S76 PolarHBondContact O-N 2.88Å; S76-N78 PolarHBondContact O-N 3.47Å; S76-E79 PolarHBondContact N-OE2 2.81Å; S76-E79 PolarHBondContact O-N 3.31Å; S76-E79 PolarHBondContact OG-N 3.29Å; S76-V80 PolarHBondContact O-N 3.02Å
77	L	96.1	Very high	95.9	Very high	54 Å²	54	48.9 Å²	48.9	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-30	174.2	-81.4	179.1	0	0	0	110.9	W16 V20 E79 V80 Y81 L100	W16-L77 HydrophobicContact CH2-CB 4.32Å; W16-L77 HydrophobicContact CH2-CD2 3.98Å; W16-L77 HydrophobicContact CH2-CG 3.68Å; W16-L77 HydrophobicContact CZ3-CD2 3.72Å; W16-L77 HydrophobicContact CZ3-CG 3.75Å; V20-L77 HydrophobicContact CG1-CD2 4.47Å; L77-E79 VanDerWaalsContact C-N 3.34Å; L77-E79 PolarHBondContact O-N 2.81Å; L77-V80 WeakPolarHBondContact O-CB 3.4Å; L77-V80 PolarHBondContact O-N 3.36Å; L77-V80 VanDerWaalsContact O-N 3.14Å; L77-Y81 HydrophobicContact CB-CD2 4.32Å; L77-Y81 HydrophobicContact CB-CE2 3.77Å; L77-Y81 WeakPolarHBondContact O-CD2 3.38Å; L77-Y81 VanDerWaalsContact O-CG 3.28Å; L77-Y81 PolarHBondContact O-N 3.44Å; L77-L100 HydrophobicContact CD1-CD1 3.79Å; L77-L100 HydrophobicContact CD2-CD1 3.71Å; L77-L100 HydrophobicContact CG-CD1 4.43Å
78	N	97	Very high	96	Very high	112 Å²	112	55.8 Å²	55.8	60%	0.599	30%	0.296	S	S	*	.	H	α-helix	trans	-63.4	-37.8	176.8	-170	65.6	0	0	0	112.6	S76 V80 S82	S76-N78 PolarHBondContact O-N 3.47Å; N78-V80 VanDerWaalsContact C-N 3.32Å; N78-S82 VanDerWaalsContact O-CB 3.24Å; N78-S82 WeakPolarHBondContact O-CB 3.49Å; N78-S82 PolarHBondContact O-N 2.84Å; N78-S82 PolarHBondContact O-OG 3.31Å
79	E	97.5	Very high	96.1	Very high	52 Å²	52	54.7 Å²	54.7	24%	0.243	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-41.2	172.3	-74.7	177.4	144.6	0	0	111.3	L40 W69 A75 S76 L77 S83	L40-E79 HydrophobicContact CD2-CB 4.24Å; W69-E79 PolarHBondContact NE1-OE2 3.36Å; A75-E79 WeakPolarHBondContact CA-OE2 3.4Å; S76-E79 PolarHBondContact N-OE2 2.81Å; S76-E79 PolarHBondContact O-N 3.31Å; S76-E79 PolarHBondContact OG-N 3.29Å; L77-E79 VanDerWaalsContact C-N 3.34Å; L77-E79 PolarHBondContact O-N 2.81Å; E79-S83 VanDerWaalsContact O-CB 3.32Å; E79-S83 WeakPolarHBondContact O-CB 3.25Å; E79-S83 PolarHBondContact O-N 2.97Å; E79-S83 PolarHBondContact O-OG 3.07Å
80	V	98.1	Very high	96.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-52.9	177	171.9	0	0	0	0	110.7	I24 F36 L40 W69 S76 L77 N78 S82 S83 L84 L96	I24-V80 HydrophobicContact CD1-CG1 4.47Å; I24-V80 HydrophobicContact CD1-CG2 4.09Å; I24-V80 HydrophobicContact CG1-CG1 4.39Å; I24-V80 HydrophobicContact CG2-CG1 4.43Å; F36-V80 HydrophobicContact CE2-CG1 4.18Å; F36-V80 HydrophobicContact CZ-CG1 3.92Å; F36-V80 HydrophobicContact CZ-CG2 4.35Å; L40-V80 HydrophobicContact CD1-CG2 4.39Å; L40-V80 HydrophobicContact CD2-CG2 4.22Å; W69-V80 HydrophobicContact CH2-CG2 3.6Å; W69-V80 HydrophobicContact CZ2-CG2 3.59Å; W69-V80 HydrophobicContact CZ3-CG2 4.37Å; S76-V80 PolarHBondContact O-N 3.02Å; L77-V80 WeakPolarHBondContact O-CB 3.4Å; L77-V80 PolarHBondContact O-N 3.36Å; L77-V80 VanDerWaalsContact O-N 3.14Å; N78-V80 VanDerWaalsContact C-N 3.32Å; V80-S82 PolarHBondContact O-N 3.06Å; V80-S83 PolarHBondContact O-N 3.04Å; V80-L84 HydrophobicContact CG1-CD1 4.08Å; V80-L84 WeakPolarHBondContact O-CG 3.24Å; V80-L84 PolarHBondContact O-N 2.87Å; V80-L96 HydrophobicContact CG1-CD2 3.76Å
81	Y	98.4	Very high	96.2	Very high	36 Å²	36	59.3 Å²	59.3	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-43.9	-179.7	-59	-39.1	0	0	0	112.1	L77 S83 L84 H85 V93 L96 Q97	L77-Y81 HydrophobicContact CB-CD2 4.32Å; L77-Y81 HydrophobicContact CB-CE2 3.77Å; L77-Y81 WeakPolarHBondContact O-CD2 3.38Å; L77-Y81 VanDerWaalsContact O-CG 3.28Å; L77-Y81 PolarHBondContact O-N 3.44Å; Y81-S83 VanDerWaalsContact C-N 3.33Å; Y81-S83 PolarHBondContact O-N 3.22Å; Y81-L84 PolarHBondContact O-N 2.97Å; Y81-H85 PolarHBondContact O-CD2 3.35Å; Y81-H85 VanDerWaalsContact O-CD2 3.27Å; Y81-H85 PolarHBondContact O-N 3.3Å; Y81-V93 HydrophobicContact CD1-CG1 3.84Å; Y81-V93 HydrophobicContact CE1-CG1 4.47Å; Y81-V93 HydrophobicContact CG-CG1 4.24Å; Y81-L96 HydrophobicContact CD1-CD2 4.31Å; Y81-L96 HydrophobicContact CE1-CB 4.44Å; Y81-L96 HydrophobicContact CE1-CD2 3.78Å; Y81-L96 HydrophobicContact CE1-CG 4.07Å; Y81-Q97 HydrophobicContact CE1-CG 3.82Å; Y81-Q97 HydrophobicContact CE2-CG 4.37Å
82	S	98.1	Very high	96.4	Very high	50 Å²	50	55.3 Å²	55.3	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-42.7	177.6	-56.9	0	0	0	0	111.4	N78 V80 H85 L86	N78-S82 VanDerWaalsContact O-CB 3.24Å; N78-S82 WeakPolarHBondContact O-CB 3.49Å; N78-S82 PolarHBondContact O-N 2.84Å; N78-S82 PolarHBondContact O-OG 3.31Å; V80-S82 PolarHBondContact O-N 3.06Å; S82-H85 PolarHBondContact O-N 2.95Å; S82-L86 VanDerWaalsContact O-CG 3.31Å; S82-L86 WeakPolarHBondContact O-CG 3.45Å; S82-L86 PolarHBondContact O-N 3.37Å
83	S	98.4	Very high	96.7	Very high	8 Å²	8	51.7 Å²	51.7	6%	0.056	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-43.8	177.8	-59.1	0	0	0	0	111.7	L39 E79 V80 Y81 L86 M87	L39-S83 WeakPolarHBondContact CB-OG 3.46Å; E79-S83 VanDerWaalsContact O-CB 3.32Å; E79-S83 WeakPolarHBondContact O-CB 3.25Å; E79-S83 PolarHBondContact O-N 2.97Å; E79-S83 PolarHBondContact O-OG 3.07Å; V80-S83 PolarHBondContact O-N 3.04Å; Y81-S83 VanDerWaalsContact C-N 3.33Å; Y81-S83 PolarHBondContact O-N 3.22Å; S83-L86 PolarHBondContact O-N 3.44Å; S83-M87 WeakPolarHBondContact O-CG 3.5Å; S83-M87 PolarHBondContact O-N 3.29Å
84	L	98.5	Very high	97.2	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-38.9	177.2	-66.6	174.2	0	0	0	112.2	V28 F36 V80 Y81 M87 E88 L89 C92 V93 L96	V28-L84 HydrophobicContact CG2-CD2 3.82Å; F36-L84 HydrophobicContact CD2-CD2 3.75Å; F36-L84 HydrophobicContact CD2-CG 4.26Å; F36-L84 HydrophobicContact CE2-CD2 3.82Å; F36-L84 HydrophobicContact CE2-CG 3.91Å; V80-L84 HydrophobicContact CG1-CD1 4.08Å; V80-L84 WeakPolarHBondContact O-CG 3.24Å; V80-L84 PolarHBondContact O-N 2.87Å; Y81-L84 PolarHBondContact O-N 2.97Å; L84-M87 CarbonylContact O-C 3.54Å; L84-M87 PolarHBondContact O-N 3.21Å; L84-E88 PolarHBondContact O-N 3.01Å; L84-L89 HydrophobicContact CB-CB 4.32Å; L84-L89 HydrophobicContact CD2-CB 4.34Å; L84-L89 HydrophobicContact CD2-CD1 3.99Å; L84-L89 WeakPolarHBondContact O-CA 3.42Å; L84-L89 WeakPolarHBondContact O-CB 3.22Å; L84-L89 PolarHBondContact O-N 2.84Å; L84-C92 HydrophobicContact CD1-CB 4.36Å; L84-V93 HydrophobicContact CB-CG2 3.48Å; L84-V93 VanDerWaalsContact CB-CG2 3.48Å; L84-V93 HydrophobicContact CD1-CG2 4.06Å; L84-V93 HydrophobicContact CG-CG2 4.43Å; L84-L96 HydrophobicContact CD1-CD2 4.41Å
85	H	98	Very high	97.6	Very high	97 Å²	97	53.6 Å²	53.6	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-43	173.3	-80	-52.7	0	0	0	112.7	Y81 S82 M87 E88 S90	Y81-H85 PolarHBondContact O-CD2 3.35Å; Y81-H85 VanDerWaalsContact O-CD2 3.27Å; Y81-H85 PolarHBondContact O-N 3.3Å; S82-H85 PolarHBondContact O-N 2.95Å; H85-M87 PolarHBondContact O-N 2.67Å; H85-E88 PolarHBondContact O-N 3.33Å; H85-S90 PolarHBondContact ND1-OG 3.4Å
86	L	98.2	Very high	97.7	Very high	135 Å²	135	53.3 Å²	53.3	71%	0.707	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-29.8	174.7	-73.1	171.1	0	0	0	112.5	L39 S82 S83 E88	L39-L86 HydrophobicContact CD1-CB 4.48Å; S82-L86 VanDerWaalsContact O-CG 3.31Å; S82-L86 WeakPolarHBondContact O-CG 3.45Å; S82-L86 PolarHBondContact O-N 3.37Å; S83-L86 PolarHBondContact O-N 3.44Å; L86-E88 VanDerWaalsContact C-N 3.26Å; L86-E88 PolarHBondContact O-N 3.33Å
87	M	98.3	Very high	97.8	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.025	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	6.7	176	-67.2	171.9	71.2	0	0	113.7	R32 E35 F36 L39 S83 L84 H85 L89	R32-M87 HydrophobicContact CB-CE 3.71Å; R32-M87 PolarHBondContact NH2-O 3.48Å; R32-M87 WeakPolarHBondContact O-CE 3.34Å; E35-M87 HydrophobicContact CB-CE 4.06Å; E35-M87 HydrophobicContact CG-CE 3.93Å; F36-M87 VanDerWaalsContact CA-SD 3.57Å; F36-M87 HydrophobicContact CB-CE 3.9Å; F36-M87 HydrophobicContact CB-SD 3.71Å; F36-M87 HydrophobicContact CD2-SD 4.09Å; F36-M87 HydrophobicContact CG-SD 4.41Å; L39-M87 HydrophobicContact CD1-CG 3.53Å; L39-M87 HydrophobicContact CD1-SD 3.74Å; S83-M87 WeakPolarHBondContact O-CG 3.5Å; S83-M87 PolarHBondContact O-N 3.29Å; L84-M87 CarbonylContact O-C 3.54Å; L84-M87 PolarHBondContact O-N 3.21Å; H85-M87 PolarHBondContact O-N 2.67Å; M87-L89 HydrophobicContact CB-CD1 4.02Å; M87-L89 HydrophobicContact CB-CG 4.02Å; M87-L89 HydrophobicContact CE-CD1 3.9Å; M87-L89 PolarHBondContact O-N 2.99Å; M87-L89 HydrophobicContact SD-CD1 4.47Å
88	E	98.1	Very high	97.8	Very high	177 Å²	177	57.2 Å²	57.2	83%	0.827	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	26.8	-175.6	-53.7	-177	143	0	0	113.5	L84 H85 L86 S90	L84-E88 PolarHBondContact O-N 3.01Å; H85-E88 PolarHBondContact O-N 3.33Å; L86-E88 VanDerWaalsContact C-N 3.26Å; L86-E88 PolarHBondContact O-N 3.33Å; E88-S90 PolarHBondContact O-N 3.35Å
89	L	97.9	Very high	97.8	Very high	30 Å²	30	54.1 Å²	54.1	16%	0.157	28%	0.283	C	S	.	.			trans	-99.5	43	-179.2	-63.7	176.9	0	0	0	112.3	P29 L84 M87 G91 C92 V93	P29-L89 HydrophobicContact CG-CD1 4.43Å; P29-L89 HydrophobicContact CG-CD2 4.3Å; L84-L89 HydrophobicContact CB-CB 4.32Å; L84-L89 HydrophobicContact CD2-CB 4.34Å; L84-L89 HydrophobicContact CD2-CD1 3.99Å; L84-L89 WeakPolarHBondContact O-CA 3.42Å; L84-L89 WeakPolarHBondContact O-CB 3.22Å; L84-L89 PolarHBondContact O-N 2.84Å; M87-L89 HydrophobicContact CB-CD1 4.02Å; M87-L89 HydrophobicContact CB-CG 4.02Å; M87-L89 HydrophobicContact CE-CD1 3.9Å; M87-L89 PolarHBondContact O-N 2.99Å; M87-L89 HydrophobicContact SD-CD1 4.47Å; L89-G91 PolarHBondContact O-N 3.19Å; L89-G91 VanDerWaalsContact O-N 3.17Å; L89-C92 HydrophobicContact CB-CB 4.13Å; L89-C92 WeakPolarHBondContact O-CB 3.46Å; L89-C92 PolarHBondContact O-N 3.15Å; L89-V93 PolarHBondContact O-N 3.39Å
90	S	96.6	Very high	97.6	Very high	54 Å²	54	52.5 Å²	52.5	38%	0.378	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-29.1	-178.3	-60.2	0	0	0	0	113.5	H85 E88 V93 Q94	H85-S90 PolarHBondContact ND1-OG 3.4Å; E88-S90 PolarHBondContact O-N 3.35Å; S90-V93 WeakPolarHBondContact O-CB 3.44Å; S90-V93 PolarHBondContact O-N 3.19Å; S90-Q94 PolarHBondContact O-N 3.37Å; S90-Q94 VanDerWaalsContact O-N 3.13Å
91	G	97.5	Very high	97.4	Very high	43 Å²	43	58.6 Å²	58.6	44%	0.443	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-38.3	172.7	0	0	0	0	0	113.1	L89 V93 Q94 Q95	L89-G91 PolarHBondContact O-N 3.19Å; L89-G91 VanDerWaalsContact O-N 3.17Å; G91-V93 VanDerWaalsContact C-N 3.3Å; G91-V93 PolarHBondContact O-N 3.33Å; G91-Q94 PolarHBondContact O-N 2.83Å; G91-Q95 WeakPolarHBondContact O-CG 3.49Å; G91-Q95 PolarHBondContact O-N 2.71Å
92	C	97.9	Very high	97.2	Very high	20 Å²	20	66.5 Å²	66.5	14%	0.135	34%	0.335	C	S	.	.	H	α-helix	trans	-66.4	-34.2	174.2	-59.9	0	0	0	0	111.5	E27 L84 L89 L96	E27-C92 HydrophobicContact CB-CB 4.47Å; E27-C92 PolarHBondContact O-SG 3.2Å; L84-C92 HydrophobicContact CD1-CB 4.36Å; L89-C92 HydrophobicContact CB-CB 4.13Å; L89-C92 WeakPolarHBondContact O-CB 3.46Å; L89-C92 PolarHBondContact O-N 3.15Å; C92-L96 WeakPolarHBondContact O-CB 3.3Å; C92-L96 PolarHBondContact O-N 3.33Å
93	V	97.9	Very high	96.6	Very high	3 Å²	3	68 Å²	68	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-50.4	174.8	177.4	0	0	0	0	110.4	Y81 L84 L89 S90 G91 L96 Q97	Y81-V93 HydrophobicContact CD1-CG1 3.84Å; Y81-V93 HydrophobicContact CE1-CG1 4.47Å; Y81-V93 HydrophobicContact CG-CG1 4.24Å; L84-V93 HydrophobicContact CB-CG2 3.48Å; L84-V93 VanDerWaalsContact CB-CG2 3.48Å; L84-V93 HydrophobicContact CD1-CG2 4.06Å; L84-V93 HydrophobicContact CG-CG2 4.43Å; L89-V93 PolarHBondContact O-N 3.39Å; S90-V93 WeakPolarHBondContact O-CB 3.44Å; S90-V93 PolarHBondContact O-N 3.19Å; G91-V93 VanDerWaalsContact C-N 3.3Å; G91-V93 PolarHBondContact O-N 3.33Å; V93-L96 PolarHBondContact O-N 3.19Å; V93-Q97 HydrophobicContact CG1-CG 4.46Å; V93-Q97 WeakPolarHBondContact O-CG 3.3Å; V93-Q97 PolarHBondContact O-N 3.27Å
94	Q	97.9	Very high	95	Very high	118 Å²	118	78.3 Å²	78.3	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-58.8	-50.3	179.4	-70.3	175.1	-18.3	0	0	111.5	S90 G91 L96 Q97 E98	S90-Q94 PolarHBondContact O-N 3.37Å; S90-Q94 VanDerWaalsContact O-N 3.13Å; G91-Q94 PolarHBondContact O-N 2.83Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.15Å; Q94-Q97 PolarHBondContact O-N 3.47Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.36Å
95	Q	98.2	Very high	94.9	Very high	86 Å²	86	82.3 Å²	82.3	40%	0.402	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-38.8	178.5	-68.8	-58.9	-69.9	0	0	112.6	E27 G91 E98 N99	E27-Q95 HydrophobicContact CG-CB 4.43Å; E27-Q95 VanDerWaalsContact OE2-CB 3.23Å; E27-Q95 WeakPolarHBondContact OE2-CB 3.23Å; G91-Q95 WeakPolarHBondContact O-CG 3.49Å; G91-Q95 PolarHBondContact O-N 2.71Å; Q95-E98 PolarHBondContact NE2-OE2 3.41Å; Q95-N99 VanDerWaalsContact O-CB 3.25Å; Q95-N99 WeakPolarHBondContact O-CB 3.39Å; Q95-N99 VanDerWaalsContact O-CG 3.26Å; Q95-N99 PolarHBondContact O-N 2.85Å; Q95-N99 PolarHBondContact O-ND2 3.16Å
96	L	97.8	Very high	94.7	Very high	0 Å²	0	81.5 Å²	81.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65.4	-42.9	176.3	-177.9	59	0	0	0	111.5	A23 I24 E27 V80 Y81 L84 C92 V93 Q94 N99 L100	A23-L96 HydrophobicContact CB-CD1 3.87Å; I24-L96 HydrophobicContact CG1-CD1 4.13Å; I24-L96 HydrophobicContact CG1-CD2 3.98Å; E27-L96 HydrophobicContact CB-CB 4.37Å; E27-L96 HydrophobicContact CG-CB 3.94Å; E27-L96 HydrophobicContact CG-CD1 4.2Å; V80-L96 HydrophobicContact CG1-CD2 3.76Å; Y81-L96 HydrophobicContact CD1-CD2 4.31Å; Y81-L96 HydrophobicContact CE1-CB 4.44Å; Y81-L96 HydrophobicContact CE1-CD2 3.78Å; Y81-L96 HydrophobicContact CE1-CG 4.07Å; L84-L96 HydrophobicContact CD1-CD2 4.41Å; C92-L96 WeakPolarHBondContact O-CB 3.3Å; C92-L96 PolarHBondContact O-N 3.33Å; V93-L96 PolarHBondContact O-N 3.19Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.15Å; L96-N99 PolarHBondContact O-N 3.46Å; L96-L100 HydrophobicContact CD1-CD1 4.05Å; L96-L100 HydrophobicContact CD1-CD2 4.41Å; L96-L100 HydrophobicContact CD1-CG 3.99Å; L96-L100 HydrophobicContact CG-CD1 4.07Å; L96-L100 HydrophobicContact CG-CG 4.38Å; L96-L100 WeakPolarHBondContact O-CB 3.4Å; L96-L100 VanDerWaalsContact O-CG 3.22Å; L96-L100 WeakPolarHBondContact O-CG 3.44Å; L96-L100 PolarHBondContact O-N 2.76Å
97	Q	97.1	Very high	94.5	Very high	81 Å²	81	78.5 Å²	78.5	38%	0.379	39%	0.386	S	S	.	.	H	α-helix	trans	-60.7	-51.3	176.4	-72.7	178.2	-58.2	0	0	111.3	Y81 V93 Q94 N99 L100 E101	Y81-Q97 HydrophobicContact CE1-CG 3.82Å; Y81-Q97 HydrophobicContact CE2-CG 4.37Å; V93-Q97 HydrophobicContact CG1-CG 4.46Å; V93-Q97 WeakPolarHBondContact O-CG 3.3Å; V93-Q97 PolarHBondContact O-N 3.27Å; Q94-Q97 PolarHBondContact O-N 3.47Å; Q97-N99 VanDerWaalsContact C-N 3.3Å; Q97-N99 PolarHBondContact O-N 3.4Å; Q97-L100 PolarHBondContact O-N 2.74Å; Q97-E101 WeakPolarHBondContact O-CG 3.44Å; Q97-E101 PolarHBondContact O-N 3.41Å
98	E	96.8	Very high	94.3	Very high	94 Å²	94	82.8 Å²	82.8	44%	0.439	41%	0.407	S	S	.	.	H	α-helix	trans	-56.8	-43.4	176.9	-71.2	171.9	-174.2	0	0	111.7	Q94 Q95 R102	Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.36Å; Q95-E98 PolarHBondContact NE2-OE2 3.41Å; E98-R102 VanDerWaalsContact O-CG 3.28Å; E98-R102 WeakPolarHBondContact O-CG 3.31Å; E98-R102 PolarHBondContact O-N 2.98Å
99	N	95.5	Very high	94.1	Very high	47 Å²	47	76.9 Å²	76.9	25%	0.251	38%	0.381	S	S	.	.	H	α-helix	trans	-66.5	-40.4	178.7	-79.1	-24.6	0	0	0	112.3	E27 Q95 L96 Q97 R102 L103	E27-N99 PolarHBondContact OE1-ND2 2.92Å; Q95-N99 VanDerWaalsContact O-CB 3.25Å; Q95-N99 WeakPolarHBondContact O-CB 3.39Å; Q95-N99 VanDerWaalsContact O-CG 3.26Å; Q95-N99 PolarHBondContact O-N 2.85Å; Q95-N99 PolarHBondContact O-ND2 3.16Å; L96-N99 PolarHBondContact O-N 3.46Å; Q97-N99 VanDerWaalsContact C-N 3.3Å; Q97-N99 PolarHBondContact O-N 3.4Å; N99-R102 PolarHBondContact O-N 3.19Å; N99-L103 WeakPolarHBondContact O-CG 3.35Å
100	L	94.6	Very high	93.8	Very high	19 Å²	19	80.1 Å²	80.1	10%	0.099	40%	0.396	C	S	.	.	H	α-helix	trans	-71.7	-36.3	179	-68	-179.4	0	0	0	112.6	V20 A23 L77 L96 Q97 R102 L103	V20-L100 HydrophobicContact CB-CD2 4.34Å; V20-L100 HydrophobicContact CG1-CD2 3.99Å; V20-L100 HydrophobicContact CG2-CD2 4.16Å; A23-L100 HydrophobicContact CB-CD2 3.87Å; L77-L100 HydrophobicContact CD1-CD1 3.79Å; L77-L100 HydrophobicContact CD2-CD1 3.71Å; L77-L100 HydrophobicContact CG-CD1 4.43Å; L96-L100 HydrophobicContact CD1-CD1 4.05Å; L96-L100 HydrophobicContact CD1-CD2 4.41Å; L96-L100 HydrophobicContact CD1-CG 3.99Å; L96-L100 HydrophobicContact CG-CD1 4.07Å; L96-L100 HydrophobicContact CG-CG 4.38Å; L96-L100 WeakPolarHBondContact O-CB 3.4Å; L96-L100 VanDerWaalsContact O-CG 3.22Å; L96-L100 WeakPolarHBondContact O-CG 3.44Å; L96-L100 PolarHBondContact O-N 2.76Å; Q97-L100 PolarHBondContact O-N 2.74Å; L100-R102 PolarHBondContact O-N 3.23Å; L100-L103 HydrophobicContact CD2-CD1 4Å; L100-L103 WeakPolarHBondContact O-CB 2.83Å; L100-L103 PolarHBondContact O-N 3.42Å; L100-L103 VanDerWaalsContact O-N 3.11Å
101	E	94.4	Very high	93.6	Very high	128 Å²	128	81.9 Å²	81.9	60%	0.598	40%	0.397	S	S	*	.	H	α-helix	trans	-59.5	-37	173.3	-74.7	174.8	-178.1	0	0	111.7	Q97 L103 Q104	Q97-E101 WeakPolarHBondContact O-CG 3.44Å; Q97-E101 PolarHBondContact O-N 3.41Å; E101-L103 PolarHBondContact O-N 3.11Å; E101-Q104 PolarHBondContact O-N 2.75Å
102	R	93.1	Very high	93.3	Very high	202 Å²	202	84.9 Å²	84.9	76%	0.762	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-10.7	177.2	-67.7	173.6	69.3	-167.5	3.4	114.5	E98 N99 L100	E98-R102 VanDerWaalsContact O-CG 3.28Å; E98-R102 WeakPolarHBondContact O-CG 3.31Å; E98-R102 PolarHBondContact O-N 2.98Å; N99-R102 PolarHBondContact O-N 3.19Å; L100-R102 PolarHBondContact O-N 3.23Å
103	L	85.1	Confident	92.9	Very high	82 Å²	82	90.3 Å²	90.3	43%	0.429	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-9.3	177.1	-65.4	176.7	0	0	0	113.1	I19 N99 L100 E101	I19-L103 HydrophobicContact CD1-CD1 4.24Å; I19-L103 HydrophobicContact CD1-CD2 3.52Å; I19-L103 HydrophobicContact CD1-CG 4.49Å; I19-L103 HydrophobicContact CG1-CD1 3.87Å; I19-L103 HydrophobicContact CG1-CD2 4.06Å; I19-L103 HydrophobicContact CG2-CD1 4.3Å; N99-L103 WeakPolarHBondContact O-CG 3.35Å; L100-L103 HydrophobicContact CD2-CD1 4Å; L100-L103 WeakPolarHBondContact O-CB 2.83Å; L100-L103 PolarHBondContact O-N 3.42Å; L100-L103 VanDerWaalsContact O-N 3.11Å; E101-L103 PolarHBondContact O-N 3.11Å
104	Q	66.7	Low	92.5	Very high	224 Å²	224	98.3 Å²	98.3	100%	1.047	45%	0.451	S	S	*	.			trans	-80.6	0	175.2	-61.9	-173.3	-38.7	0	0	111	E101	E101-Q104 PolarHBondContact O-N 2.75Å

Retrieved 104 of 104 residues in 106.7 ms (Link to these results)

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