YM304_YEAST Loading...

Putative uncharacterized membrane protein YMR304C-A

AlphaFold DB , UniProt , Accession A0A023PYJ7, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 116 aa.

						>YM304_YEAST|A0A023PYJ7
MIYGKMMGNTVLKNTGVFYQVIKPLKLHLLYDHSFSLFLKKQPNMGEISPFPYLLSYSYHVIVYLCVLCKVYILYSFVKDFSICLPFSYGSSLLYSLCSNLYIYIYAALPKSKIKL
					

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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)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	36.1	Very low	238 Å²	238	124.6 Å²	124.6	100%	1.172	65%	0.654	S	S	*	*				0	26.9	0	-127.6	171.8	170.9	0	113.7
2	I	44.8	Very low	35.9	Very low	126 Å²	126	124.2 Å²	124.2	65%	0.646	65%	0.652	S	S	*	*			trans	-102	-30.2	-173.1	-61.2	170.1	0	0	111.9	G4 K5 M6	I2-G4 PolarHBondContact O-N 3.25Å; I2-K5 PolarHBondContact O-N 2.92Å; I2-M6 HydrophobicContact CG2-CE 4.39Å
3	Y	32.7	Very low	36.4	Very low	208 Å²	208	127.5 Å²	127.5	82%	0.816	66%	0.657	S	S	*	*	H	α-helix	trans	-64.7	-38.1	-178.4	-80.8	-85.5	0	0	114.3	K5 M6 M7	Y3-K5 VanDerWaalsContact C-N 3.31Å; Y3-K5 PolarHBondContact O-N 2.62Å; Y3-M6 PolarHBondContact O-N 3.31Å; Y3-M7 PolarHBondContact O-N 2.93Å; Y3-M7 VanDerWaalsContact O-N 3.17Å
4	G	35.2	Very low	36.9	Very low	59 Å²	59	124.2 Å²	124.2	61%	0.608	64%	0.642	S	S	*	*	H	α-helix	trans	-66.8	-29.4	179.6	0	0	0	0	114.1	I2 G8	I2-G4 PolarHBondContact O-N 3.25Å; G4-G8 PolarHBondContact O-N 2.84Å; G4-G8 VanDerWaalsContact O-N 3.08Å
5	K	35.1	Very low	37	Very low	176 Å²	176	120.7 Å²	120.7	77%	0.765	63%	0.628	S	S	*	*	H	α-helix	trans	-77.8	-34.6	-179	-130.9	176.7	-176.6	178.8	112.1	I2 Y3 N9	I2-K5 PolarHBondContact O-N 2.92Å; Y3-K5 VanDerWaalsContact C-N 3.31Å; Y3-K5 PolarHBondContact O-N 2.62Å; K5-N9 PolarHBondContact O-N 2.86Å
6	M	36.7	Very low	37.1	Very low	129 Å²	129	115.4 Å²	115.4	64%	0.635	61%	0.613	S	S	*	*	H	α-helix	trans	-69.1	-41.5	172.2	-71.6	-173.9	179.6	0	111.3	I2 Y3 G8 N9 T10	I2-M6 HydrophobicContact CG2-CE 4.39Å; Y3-M6 PolarHBondContact O-N 3.31Å; M6-G8 PolarHBondContact O-N 3.46Å; M6-N9 PolarHBondContact O-N 3.33Å; M6-T10 PolarHBondContact O-N 2.92Å; M6-T10 VanDerWaalsContact O-N 3.08Å; M6-T10 PolarHBondContact O-OG1 3.41Å
7	M	34	Very low	37.6	Very low	126 Å²	126	113.4 Å²	113.4	62%	0.621	61%	0.605	S	S	*	*	H	α-helix	trans	-65.3	-38.8	179.4	-144.8	152.1	173.6	0	111.9	Y3 T10 V11	Y3-M7 PolarHBondContact O-N 2.93Å; Y3-M7 VanDerWaalsContact O-N 3.17Å; M7-T10 PolarHBondContact O-N 3.45Å; M7-V11 WeakPolarHBondContact O-CB 3.07Å; M7-V11 WeakPolarHBondContact O-CG2 2.96Å; M7-V11 PolarHBondContact O-N 3.09Å
8	G	31.9	Very low	37.8	Very low	32 Å²	32	112.8 Å²	112.8	33%	0.33	60%	0.597	S	S	.	*	H	α-helix	trans	-62.6	-42.3	174.2	0	0	0	0	113.8	G4 M6 V11 L12	G4-G8 PolarHBondContact O-N 2.84Å; G4-G8 VanDerWaalsContact O-N 3.08Å; M6-G8 PolarHBondContact O-N 3.46Å; G8-V11 PolarHBondContact O-N 3.49Å; G8-L12 WeakPolarHBondContact O-CB 3.31Å; G8-L12 PolarHBondContact O-N 3.19Å
9	N	35.9	Very low	38	Very low	115 Å²	115	115.6 Å²	115.6	62%	0.615	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-33.6	178.1	-93.2	-1.4	0	0	113	K5 M6 K13	K5-N9 PolarHBondContact O-N 2.86Å; M6-N9 PolarHBondContact O-N 3.33Å; N9-K13 WeakPolarHBondContact O-CB 3.46Å; N9-K13 PolarHBondContact O-N 3.31Å
10	T	37.9	Very low	38.5	Very low	78 Å²	78	117.2 Å²	117.2	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-71.7	-38.3	175.1	-44.2	0	0	0	111.2	M6 M7 K13 N14	M6-T10 PolarHBondContact O-N 2.92Å; M6-T10 VanDerWaalsContact O-N 3.08Å; M6-T10 PolarHBondContact O-OG1 3.41Å; M7-T10 PolarHBondContact O-N 3.45Å; T10-K13 PolarHBondContact O-N 3.23Å; T10-N14 VanDerWaalsContact O-CB 3.24Å; T10-N14 WeakPolarHBondContact O-CB 3.35Å; T10-N14 PolarHBondContact O-N 2.79Å; T10-N14 PolarHBondContact O-ND2 3.43Å; T10-N14 PolarHBondContact O-OD1 3Å
11	V	32.9	Very low	39	Very low	84 Å²	84	114.3 Å²	114.3	51%	0.509	59%	0.592	S	S	.	*	H	α-helix	trans	-65.2	-42.2	173.9	173.8	0	0	0	110.9	M7 G8 N14 T15	M7-V11 WeakPolarHBondContact O-CB 3.07Å; M7-V11 WeakPolarHBondContact O-CG2 2.96Å; M7-V11 PolarHBondContact O-N 3.09Å; G8-V11 PolarHBondContact O-N 3.49Å; V11-N14 CarbonylContact O-C 3.6Å; V11-N14 PolarHBondContact O-N 2.77Å; V11-T15 WeakPolarHBondContact O-CG2 3.17Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 2.86Å
12	L	34.1	Very low	39.5	Very low	119 Å²	119	106.1 Å²	106.1	62%	0.623	55%	0.552	S	S	*	*	H	α-helix	trans	-68	-34.8	176	-89.7	150.4	0	0	113.9	G8 T15 G16	G8-L12 WeakPolarHBondContact O-CB 3.31Å; G8-L12 PolarHBondContact O-N 3.19Å; L12-T15 WeakPolarHBondContact CA-OG1 3.34Å; L12-T15 PolarHBondContact O-OG1 3.41Å; L12-G16 PolarHBondContact O-N 3.32Å
13	K	42.3	Very low	39.7	Very low	167 Å²	167	106.3 Å²	106.3	73%	0.726	55%	0.548	S	S	*	.	H	α-helix	trans	-67.8	-40.8	169.9	-89.4	-173.1	172.6	-176.1	111.3	N9 T10 T15 G16 V17	N9-K13 WeakPolarHBondContact O-CB 3.46Å; N9-K13 PolarHBondContact O-N 3.31Å; T10-K13 PolarHBondContact O-N 3.23Å; K13-T15 PolarHBondContact O-N 2.86Å; K13-G16 PolarHBondContact O-N 3.3Å; K13-V17 PolarHBondContact O-N 3.33Å; K13-V17 VanDerWaalsContact O-N 3.15Å
14	N	43.4	Very low	40.4	Very low	82 Å²	82	99.1 Å²	99.1	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-69.4	-31.3	179.2	-74.1	-5.3	0	0	112.4	T10 V11 G16 F18	T10-N14 VanDerWaalsContact O-CB 3.24Å; T10-N14 WeakPolarHBondContact O-CB 3.35Å; T10-N14 PolarHBondContact O-N 2.79Å; T10-N14 PolarHBondContact O-ND2 3.43Å; T10-N14 PolarHBondContact O-OD1 3Å; V11-N14 CarbonylContact O-C 3.6Å; V11-N14 PolarHBondContact O-N 2.77Å; N14-G16 VanDerWaalsContact C-N 3.34Å; N14-F18 WeakPolarHBondContact O-CB 3.39Å; N14-F18 PolarHBondContact O-N 3.44Å
15	T	38.7	Very low	41.3	Very low	71 Å²	71	97.4 Å²	97.4	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-31.6	172.7	53.8	0	0	0	112.4	V11 L12 K13 F18 Y19	V11-T15 WeakPolarHBondContact O-CG2 3.17Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 2.86Å; L12-T15 WeakPolarHBondContact CA-OG1 3.34Å; L12-T15 PolarHBondContact O-OG1 3.41Å; K13-T15 PolarHBondContact O-N 2.86Å; T15-F18 WeakPolarHBondContact O-CB 3.45Å; T15-Y19 WeakPolarHBondContact O-CB 3.25Å; T15-Y19 PolarHBondContact O-N 3.32Å
16	G	39.1	Very low	42	Very low	37 Å²	37	95.2 Å²	95.2	38%	0.381	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-47.4	172.7	0	0	0	0	112.7	L12 K13 N14 F18 Y19 Q20	L12-G16 PolarHBondContact O-N 3.32Å; K13-G16 PolarHBondContact O-N 3.3Å; N14-G16 VanDerWaalsContact C-N 3.34Å; G16-F18 VanDerWaalsContact C-N 3.32Å; G16-Y19 PolarHBondContact O-N 3.02Å; G16-Q20 PolarHBondContact O-N 2.91Å
17	V	45.2	Very low	42.7	Very low	81 Å²	81	93 Å²	93	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-39.7	174.3	178.8	0	0	0	110.7	K13 Y19 Q20 V21	K13-V17 PolarHBondContact O-N 3.33Å; K13-V17 VanDerWaalsContact O-N 3.15Å; V17-Y19 PolarHBondContact O-N 2.94Å; V17-Q20 CarbonylContact O-C 3.6Å; V17-Q20 PolarHBondContact O-N 2.74Å; V17-Q20 VanDerWaalsContact O-N 3.16Å; V17-V21 HydrophobicContact CG1-CG2 4.43Å; V17-V21 WeakPolarHBondContact O-CG2 3.05Å; V17-V21 PolarHBondContact O-N 3.43Å
18	F	41.2	Very low	43.6	Very low	103 Å²	103	92 Å²	92	45%	0.452	48%	0.478	S	S	.	.	H	α-helix	trans	-58.7	-43.8	174	-179.3	-96.2	0	0	112.2	N14 T15 G16 Q20 V21 I22 L97	N14-F18 WeakPolarHBondContact O-CB 3.39Å; N14-F18 PolarHBondContact O-N 3.44Å; T15-F18 WeakPolarHBondContact O-CB 3.45Å; G16-F18 VanDerWaalsContact C-N 3.32Å; F18-Q20 VanDerWaalsContact C-N 3.32Å; F18-Q20 PolarHBondContact O-N 2.86Å; F18-V21 PolarHBondContact O-N 2.62Å; F18-I22 HydrophobicContact CD1-CD1 3.43Å; F18-I22 VanDerWaalsContact CD1-CD1 3.43Å; F18-I22 HydrophobicContact CD2-CD1 3.79Å; F18-I22 HydrophobicContact CE1-CD1 3.12Å; F18-I22 HydrophobicContact CE2-CD1 3.53Å; F18-I22 HydrophobicContact CG-CD1 3.76Å; F18-I22 HydrophobicContact CZ-CD1 3.17Å; F18-I22 VanDerWaalsContact O-CB 3.31Å; F18-I22 WeakPolarHBondContact O-CB 3.49Å; F18-I22 VanDerWaalsContact O-CG1 3.3Å; F18-I22 WeakPolarHBondContact O-CG1 3.38Å; F18-I22 PolarHBondContact O-N 2.69Å; F18-L97 HydrophobicContact CD2-CD2 4.45Å; F18-L97 HydrophobicContact CE2-CD2 3.58Å; F18-L97 HydrophobicContact CZ-CD2 4.36Å
19	Y	40.7	Very low	44.5	Very low	166 Å²	166	92.5 Å²	92.5	65%	0.651	47%	0.473	S	S	*	.	H	α-helix	trans	-67.3	-35	176.5	-145.4	-89.7	0	0	111.9	T15 G16 V17 K23	T15-Y19 WeakPolarHBondContact O-CB 3.25Å; T15-Y19 PolarHBondContact O-N 3.32Å; G16-Y19 PolarHBondContact O-N 3.02Å; V17-Y19 PolarHBondContact O-N 2.94Å; Y19-K23 WeakPolarHBondContact O-CB 3.45Å; Y19-K23 PolarHBondContact O-N 3.03Å
20	Q	48.8	Very low	45.2	Very low	147 Å²	147	92.8 Å²	92.8	69%	0.687	47%	0.474	S	S	*	.	H	α-helix	trans	-71.2	-26	175.4	-75.7	-176.9	-10.7	0	114	G16 V17 F18 P24	G16-Q20 PolarHBondContact O-N 2.91Å; V17-Q20 CarbonylContact O-C 3.6Å; V17-Q20 PolarHBondContact O-N 2.74Å; V17-Q20 VanDerWaalsContact O-N 3.16Å; F18-Q20 VanDerWaalsContact C-N 3.32Å; F18-Q20 PolarHBondContact O-N 2.86Å; Q20-P24 WeakPolarHBondContact O-CD 3.34Å; Q20-P24 WeakPolarHBondContact O-CG 3.3Å
21	V	47.8	Very low	45.7	Very low	57 Å²	57	97.9 Å²	97.9	35%	0.345	49%	0.485	S	S	.	.	H	α-helix	trans	-88.1	-37.6	175.6	176.7	0	0	0	111.3	V17 F18 P24 L25	V17-V21 HydrophobicContact CG1-CG2 4.43Å; V17-V21 WeakPolarHBondContact O-CG2 3.05Å; V17-V21 PolarHBondContact O-N 3.43Å; F18-V21 PolarHBondContact O-N 2.62Å; V21-P24 WeakPolarHBondContact O-CD 3.24Å; V21-P24 WeakPolarHBondContact O-CG 3.11Å; V21-L25 WeakPolarHBondContact O-CB 3.41Å; V21-L25 PolarHBondContact O-N 3.43Å
22	I	50.7	Low	46.7	Very low	65 Å²	65	95.8 Å²	95.8	33%	0.333	47%	0.471	S	S	.	.	H	α-helix	trans	-75.1	-34	-179.8	-70.2	174.7	0	0	112.2	F18 L25 K26	F18-I22 HydrophobicContact CD1-CD1 3.43Å; F18-I22 VanDerWaalsContact CD1-CD1 3.43Å; F18-I22 HydrophobicContact CD2-CD1 3.79Å; F18-I22 HydrophobicContact CE1-CD1 3.12Å; F18-I22 HydrophobicContact CE2-CD1 3.53Å; F18-I22 HydrophobicContact CG-CD1 3.76Å; F18-I22 HydrophobicContact CZ-CD1 3.17Å; F18-I22 VanDerWaalsContact O-CB 3.31Å; F18-I22 WeakPolarHBondContact O-CB 3.49Å; F18-I22 VanDerWaalsContact O-CG1 3.3Å; F18-I22 WeakPolarHBondContact O-CG1 3.38Å; F18-I22 PolarHBondContact O-N 2.69Å; I22-L25 PolarHBondContact O-N 3.16Å; I22-K26 VanDerWaalsContact O-CB 3.24Å; I22-K26 WeakPolarHBondContact O-CB 3.38Å; I22-K26 PolarHBondContact O-N 2.86Å
23	K	49.2	Very low	47.1	Very low	130 Å²	130	97.1 Å²	97.1	57%	0.565	47%	0.474	S	S	*	.	H	α-helix	trans	-60.4	-50.2	178	-171.9	176.2	-177.4	-177.6	113	Y19 L25 K26 L27	Y19-K23 WeakPolarHBondContact O-CB 3.45Å; Y19-K23 PolarHBondContact O-N 3.03Å; K23-L25 VanDerWaalsContact C-N 3.34Å; K23-K26 PolarHBondContact O-N 2.89Å; K23-L27 HydrophobicContact CG-CD1 4.27Å; K23-L27 WeakPolarHBondContact O-CB 3.36Å; K23-L27 WeakPolarHBondContact O-CG 3.23Å; K23-L27 PolarHBondContact O-N 2.77Å
24	P	47.9	Very low	47.1	Very low	57 Å²	57	92.6 Å²	92.6	37%	0.37	46%	0.463	S	S	.	.	H	α-helix	trans	-68.5	-32.6	174.5	25.4	-31.6	0	0	111.9	Q20 V21 L27 H28	Q20-P24 WeakPolarHBondContact O-CD 3.34Å; Q20-P24 WeakPolarHBondContact O-CG 3.3Å; V21-P24 WeakPolarHBondContact O-CD 3.24Å; V21-P24 WeakPolarHBondContact O-CG 3.11Å; P24-L27 PolarHBondContact O-N 3.03Å; P24-H28 WeakPolarHBondContact O-CB 3.09Å; P24-H28 PolarHBondContact O-N 3.48Å
25	L	54.5	Low	47.2	Very low	23 Å²	23	91.6 Å²	91.6	12%	0.12	46%	0.455	C	S	.	.	H	α-helix	trans	-65.3	-42.2	174.6	-169.7	69.5	0	0	112.1	V21 I22 K23 H28 L29 L65 L68	V21-L25 WeakPolarHBondContact O-CB 3.41Å; V21-L25 PolarHBondContact O-N 3.43Å; I22-L25 PolarHBondContact O-N 3.16Å; K23-L25 VanDerWaalsContact C-N 3.34Å; L25-H28 PolarHBondContact O-N 3.31Å; L25-L29 HydrophobicContact CG-CD1 4.4Å; L25-L29 WeakPolarHBondContact O-CB 3.08Å; L25-L29 VanDerWaalsContact O-CG 3.29Å; L25-L29 WeakPolarHBondContact O-CG 3.22Å; L25-L29 PolarHBondContact O-N 2.85Å; L25-L65 HydrophobicContact CD2-CD2 3.8Å; L25-L65 HydrophobicContact CG-CD2 4.43Å; L25-L68 HydrophobicContact CD1-CD1 4.32Å; L25-L68 HydrophobicContact CD1-CD2 4.25Å
26	K	49.1	Very low	47.3	Very low	130 Å²	130	90.8 Å²	90.8	57%	0.565	45%	0.453	S	S	*	.	H	α-helix	trans	-64	-42.5	174.3	-178.2	177.5	177.8	178.8	111.2	I22 K23 L30	I22-K26 VanDerWaalsContact O-CB 3.24Å; I22-K26 WeakPolarHBondContact O-CB 3.38Å; I22-K26 PolarHBondContact O-N 2.86Å; K23-K26 PolarHBondContact O-N 2.89Å; K26-L30 HydrophobicContact CG-CD1 4Å; K26-L30 WeakPolarHBondContact O-CB 3.34Å; K26-L30 WeakPolarHBondContact O-CD1 3.38Å; K26-L30 WeakPolarHBondContact O-CG 3.48Å; K26-L30 PolarHBondContact O-N 3.25Å
27	L	51.4	Low	47.4	Very low	83 Å²	83	94 Å²	94	44%	0.435	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-42.1	175.3	-76.7	164.5	0	0	111.4	K23 P24 L30 Y31	K23-L27 HydrophobicContact CG-CD1 4.27Å; K23-L27 WeakPolarHBondContact O-CB 3.36Å; K23-L27 WeakPolarHBondContact O-CG 3.23Å; K23-L27 PolarHBondContact O-N 2.77Å; P24-L27 PolarHBondContact O-N 3.03Å; L27-L30 PolarHBondContact O-N 2.84Å; L27-Y31 HydrophobicContact CD2-CE2 4.45Å; L27-Y31 WeakPolarHBondContact O-CB 3.26Å; L27-Y31 WeakPolarHBondContact O-CD2 3.28Å; L27-Y31 PolarHBondContact O-N 3.35Å
28	H	52.4	Low	47.3	Very low	106 Å²	106	95.4 Å²	95.4	49%	0.491	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-44.3	177.2	-164.7	71.2	0	0	110.7	P24 L25 L30 Y31 D32	P24-H28 WeakPolarHBondContact O-CB 3.09Å; P24-H28 PolarHBondContact O-N 3.48Å; L25-H28 PolarHBondContact O-N 3.31Å; H28-L30 VanDerWaalsContact C-N 3.34Å; H28-L30 PolarHBondContact O-N 3.46Å; H28-Y31 PolarHBondContact O-N 2.83Å; H28-D32 WeakPolarHBondContact O-CA 3.06Å; H28-D32 WeakPolarHBondContact O-CB 3.39Å; H28-D32 PolarHBondContact O-N 3.41Å
29	L	50.9	Low	47.4	Very low	42 Å²	42	94.7 Å²	94.7	22%	0.22	46%	0.461	C	S	.	.	H	α-helix	trans	-65.9	-32.6	175	-70.7	167.9	0	0	113.7	L25 F35 L65	L25-L29 HydrophobicContact CG-CD1 4.4Å; L25-L29 WeakPolarHBondContact O-CB 3.08Å; L25-L29 VanDerWaalsContact O-CG 3.29Å; L25-L29 WeakPolarHBondContact O-CG 3.22Å; L25-L29 PolarHBondContact O-N 2.85Å; L29-F35 HydrophobicContact CD2-CD2 4.16Å; L29-F35 HydrophobicContact CD2-CE2 4.33Å; L29-F35 WeakPolarHBondContact O-CD1 3.42Å; L29-L65 HydrophobicContact CD1-CD2 4.35Å
30	L	50	Low	47.6	Very low	120 Å²	120	95 Å²	95	63%	0.628	47%	0.466	S	S	*	.	H	α-helix	trans	-72.5	-37.6	175.2	-87.8	158.3	0	0	112.4	K26 L27 H28	K26-L30 HydrophobicContact CG-CD1 4Å; K26-L30 WeakPolarHBondContact O-CB 3.34Å; K26-L30 WeakPolarHBondContact O-CD1 3.38Å; K26-L30 WeakPolarHBondContact O-CG 3.48Å; K26-L30 PolarHBondContact O-N 3.25Å; L27-L30 PolarHBondContact O-N 2.84Å; H28-L30 VanDerWaalsContact C-N 3.34Å; H28-L30 PolarHBondContact O-N 3.46Å
31	Y	49.9	Very low	47.4	Very low	185 Å²	185	96.1 Å²	96.1	73%	0.725	47%	0.468	S	S	*	.	H	α-helix	trans	-93.9	-14.5	-177.2	-89.3	-86.9	0	0	114.3	L27 H28 H33	L27-Y31 HydrophobicContact CD2-CE2 4.45Å; L27-Y31 WeakPolarHBondContact O-CB 3.26Å; L27-Y31 WeakPolarHBondContact O-CD2 3.28Å; L27-Y31 PolarHBondContact O-N 3.35Å; H28-Y31 PolarHBondContact O-N 2.83Å; Y31-H33 PolarHBondContact O-N 3.39Å
32	D	53	Low	47.3	Very low	40 Å²	40	98.7 Å²	98.7	21%	0.214	48%	0.476	C	S	.	.			trans	-69.1	99.1	175	-170.3	4.4	0	0	107.8	H28 S34 F35 S36	H28-D32 WeakPolarHBondContact O-CA 3.06Å; H28-D32 WeakPolarHBondContact O-CB 3.39Å; H28-D32 PolarHBondContact O-N 3.41Å; D32-S34 PolarHBondContact O-N 2.83Å; D32-S34 WeakPolarHBondContact OD1-CB 3.43Å; D32-S34 PolarHBondContact OD1-N 2.78Å; D32-S34 PolarHBondContact OD1-OG 3.27Å; D32-F35 HydrophobicContact CB-CB 4.28Å; D32-F35 WeakPolarHBondContact O-CA 3.43Å; D32-F35 WeakPolarHBondContact O-CB 3.19Å; D32-F35 PolarHBondContact O-N 3.46Å; D32-S36 PolarHBondContact O-N 2.85Å; D32-S36 VanDerWaalsContact O-N 3.16Å
33	H	43.4	Very low	47	Very low	147 Å²	147	99.6 Å²	99.6	68%	0.681	49%	0.486	S	S	*	.	H	α-helix	trans	-51.7	-26.2	173.1	-89.2	-72	0	0	111.3	Y31 S36 L37	Y31-H33 PolarHBondContact O-N 3.39Å; H33-S36 PolarHBondContact O-N 2.73Å; H33-L37 WeakPolarHBondContact O-CB 3.34Å; H33-L37 WeakPolarHBondContact O-CD1 3.24Å; H33-L37 VanDerWaalsContact O-CG 3.25Å; H33-L37 WeakPolarHBondContact O-CG 3.31Å; H33-L37 PolarHBondContact O-N 3.34Å
34	S	41.5	Very low	46.7	Very low	72 Å²	72	101.8 Å²	101.8	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-42.3	173.8	-40	0	0	0	111.4	D32 L37 F38	D32-S34 PolarHBondContact O-N 2.83Å; D32-S34 WeakPolarHBondContact OD1-CB 3.43Å; D32-S34 PolarHBondContact OD1-N 2.78Å; D32-S34 PolarHBondContact OD1-OG 3.27Å; S34-L37 PolarHBondContact O-N 3.43Å; S34-F38 VanDerWaalsContact O-CB 3.24Å; S34-F38 WeakPolarHBondContact O-CB 3.39Å; S34-F38 PolarHBondContact O-N 3.27Å
35	F	46.4	Very low	46.4	Very low	61 Å²	61	102.5 Å²	102.5	27%	0.268	50%	0.504	S	S	.	.	H	α-helix	trans	-69.6	-39.6	176.6	-166	-102.7	0	0	111.8	L29 D32 F38 L39	L29-F35 HydrophobicContact CD2-CD2 4.16Å; L29-F35 HydrophobicContact CD2-CE2 4.33Å; L29-F35 WeakPolarHBondContact O-CD1 3.42Å; D32-F35 HydrophobicContact CB-CB 4.28Å; D32-F35 WeakPolarHBondContact O-CA 3.43Å; D32-F35 WeakPolarHBondContact O-CB 3.19Å; D32-F35 PolarHBondContact O-N 3.46Å; F35-F38 WeakPolarHBondContact O-CB 3.1Å; F35-F38 PolarHBondContact O-N 2.87Å; F35-L39 HydrophobicContact CD1-CD1 3.92Å; F35-L39 HydrophobicContact CD1-CG 4.47Å; F35-L39 HydrophobicContact CE1-CD1 3.73Å; F35-L39 HydrophobicContact CE1-CG 4.32Å; F35-L39 WeakPolarHBondContact O-CG 3.45Å; F35-L39 PolarHBondContact O-N 3.36Å
36	S	40.5	Very low	45.6	Very low	54 Å²	54	104.9 Å²	104.9	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-68.3	-38.2	174.9	-151.2	0	0	0	112.4	D32 H33 F38 K40	D32-S36 PolarHBondContact O-N 2.85Å; D32-S36 VanDerWaalsContact O-N 3.16Å; H33-S36 PolarHBondContact O-N 2.73Å; S36-F38 VanDerWaalsContact C-N 3.34Å; S36-K40 WeakPolarHBondContact O-CB 3.34Å; S36-K40 WeakPolarHBondContact O-CG 3.31Å; S36-K40 PolarHBondContact O-N 2.77Å
37	L	40.9	Very low	45.5	Very low	105 Å²	105	108 Å²	108	55%	0.55	55%	0.55	S	S	.	.	H	α-helix	trans	-66.9	-34.4	169.6	-80.9	159.9	0	0	111.6	H33 S34 K40 K41	H33-L37 WeakPolarHBondContact O-CB 3.34Å; H33-L37 WeakPolarHBondContact O-CD1 3.24Å; H33-L37 VanDerWaalsContact O-CG 3.25Å; H33-L37 WeakPolarHBondContact O-CG 3.31Å; H33-L37 PolarHBondContact O-N 3.34Å; S34-L37 PolarHBondContact O-N 3.43Å; L37-K40 PolarHBondContact O-N 2.98Å; L37-K41 WeakPolarHBondContact O-CB 3.41Å; L37-K41 PolarHBondContact O-N 3.01Å
38	F	42.6	Very low	45.1	Very low	111 Å²	111	109.1 Å²	109.1	49%	0.487	56%	0.555	S	S	.	*	H	α-helix	trans	-65.9	-43.6	175.9	-132.5	-124.6	0	0	111.4	S34 F35 S36 K41 Y57	S34-F38 VanDerWaalsContact O-CB 3.24Å; S34-F38 WeakPolarHBondContact O-CB 3.39Å; S34-F38 PolarHBondContact O-N 3.27Å; F35-F38 WeakPolarHBondContact O-CB 3.1Å; F35-F38 PolarHBondContact O-N 2.87Å; S36-F38 VanDerWaalsContact C-N 3.34Å; F38-K41 PolarHBondContact O-N 2.1Å; F38-Y57 HydrophobicContact CD1-CD2 4.4Å; F38-Y57 AromaticContact CD1-CE2 3.3Å; F38-Y57 HydrophobicContact CD1-CE2 3.3Å; F38-Y57 AromaticContact CD1-CZ 3.44Å; F38-Y57 VanDerWaalsContact CD1-CZ 3.44Å; F38-Y57 WeakPolarHBondContact CD1-OH 3.45Å; F38-Y57 AromaticContact CE1-CD2 3.92Å; F38-Y57 HydrophobicContact CE1-CD2 3.92Å; F38-Y57 AromaticContact CE1-CE2 3.2Å; F38-Y57 HydrophobicContact CE1-CE2 3.2Å; F38-Y57 AromaticContact CE1-CZ 3.79Å; F38-Y57 HydrophobicContact CG-CE2 4.38Å; F38-Y57 HydrophobicContact CZ-CE2 4.28Å
39	L	44.8	Very low	44.7	Very low	88 Å²	88	107.9 Å²	107.9	46%	0.461	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-34.8	174.5	-71	171.4	0	0	112.6	F35 K41	F35-L39 HydrophobicContact CD1-CD1 3.92Å; F35-L39 HydrophobicContact CD1-CG 4.47Å; F35-L39 HydrophobicContact CE1-CD1 3.73Å; F35-L39 HydrophobicContact CE1-CG 4.32Å; F35-L39 WeakPolarHBondContact O-CG 3.45Å; F35-L39 PolarHBondContact O-N 3.36Å; L39-K41 VanDerWaalsContact C-N 3.34Å
40	K	43.8	Very low	44.3	Very low	173 Å²	173	108.3 Å²	108.3	75%	0.752	56%	0.564	S	S	*	*	H	α-helix	trans	-73.3	-24.2	174.2	-78.3	-178.3	177.8	-177.5	113.5	S36 L37 Q42	S36-K40 WeakPolarHBondContact O-CB 3.34Å; S36-K40 WeakPolarHBondContact O-CG 3.31Å; S36-K40 PolarHBondContact O-N 2.77Å; L37-K40 PolarHBondContact O-N 2.98Å; K40-Q42 PolarHBondContact O-N 3.29Å
41	K	44.1	Very low	43.8	Very low	170 Å²	170	106.7 Å²	106.7	74%	0.739	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	15.1	175.8	-93	-170.7	176.6	-177	113.8	L37 F38 L39 P43	L37-K41 WeakPolarHBondContact O-CB 3.41Å; L37-K41 PolarHBondContact O-N 3.01Å; F38-K41 PolarHBondContact O-N 2.1Å; L39-K41 VanDerWaalsContact C-N 3.34Å; K41-P43 WeakPolarHBondContact O-CD 3.34Å
42	Q	47.1	Very low	43.3	Very low	111 Å²	111	101.6 Å²	101.6	52%	0.519	54%	0.542	S	S	.	.			trans	-57.5	113.2	164.2	-73	-153.4	-11.5	0	107.8	K40 N44	K40-Q42 PolarHBondContact O-N 3.29Å; Q42-N44 PolarHBondContact O-N 3.3Å
43	P	43	Very low	42.6	Very low	83 Å²	83	107.2 Å²	107.2	54%	0.539	56%	0.561	S	S	.	*			trans	-57.6	137	174.1	19.9	-23.7	0	0	106.4	K41 M45	K41-P43 WeakPolarHBondContact O-CD 3.34Å; P43-M45 HydrophobicContact CB-CE 4.28Å; P43-M45 HydrophobicContact CB-CG 3.93Å; P43-M45 HydrophobicContact CG-CE 3.55Å; P43-M45 HydrophobicContact CG-CG 3.59Å; P43-M45 HydrophobicContact CG-SD 4.37Å; P43-M45 PolarHBondContact O-N 2.89Å
44	N	44.1	Very low	42.6	Very low	176 Å²	176	102.2 Å²	102.2	94%	0.941	54%	0.539	S	S	*	.			trans	-57.1	76.8	161.5	-89.9	-17.1	0	0	107.1	Q42 G46	Q42-N44 PolarHBondContact O-N 3.3Å; N44-G46 PolarHBondContact O-N 3.31Å
45	M	40.9	Very low	42.7	Very low	73 Å²	73	103.4 Å²	103.4	36%	0.36	54%	0.539	S	S	.	.			trans	-79.4	77.8	176.7	-75.1	-94.8	-171.7	0	105	P43 E47 I48 Y53	P43-M45 HydrophobicContact CB-CE 4.28Å; P43-M45 HydrophobicContact CB-CG 3.93Å; P43-M45 HydrophobicContact CG-CE 3.55Å; P43-M45 HydrophobicContact CG-CG 3.59Å; P43-M45 HydrophobicContact CG-SD 4.37Å; P43-M45 PolarHBondContact O-N 2.89Å; M45-E47 PolarHBondContact O-N 2.9Å; M45-I48 HydrophobicContact SD-CB 3.82Å; M45-I48 HydrophobicContact SD-CD1 4.13Å; M45-I48 HydrophobicContact SD-CG1 4.46Å; M45-I48 HydrophobicContact SD-CG2 4.29Å; M45-Y53 HydrophobicContact CE-CD2 4.21Å; M45-Y53 HydrophobicContact CE-CE2 4.01Å
46	G	38.2	Very low	42.7	Very low	72 Å²	72	103.3 Å²	103.3	74%	0.742	55%	0.546	S	S	*	.	S	Bend	trans	-61.5	-20.8	-179.8	0	0	0	0	113.1	N44	N44-G46 PolarHBondContact O-N 3.31Å
47	E	46.3	Very low	43.1	Very low	195 Å²	195	103.8 Å²	103.8	91%	0.911	54%	0.54	S	S	*	.	S	Bend	trans	-148.8	4.7	-169.9	-64.5	-174.7	156.6	0	115.3	M45	M45-E47 PolarHBondContact O-N 2.9Å
48	I	43.7	Very low	43.6	Very low	107 Å²	107	99.9 Å²	99.9	55%	0.549	52%	0.522	S	S	.	.	S	Bend	trans	-113.6	121.6	-178	-58.8	171.1	0	0	109	M45 P50	M45-I48 HydrophobicContact SD-CB 3.82Å; M45-I48 HydrophobicContact SD-CD1 4.13Å; M45-I48 HydrophobicContact SD-CG1 4.46Å; M45-I48 HydrophobicContact SD-CG2 4.29Å; I48-P50 VanDerWaalsContact O-N 3.16Å
49	S	43.6	Very low	44	Very low	80 Å²	80	102 Å²	102	56%	0.559	53%	0.527	S	S	*	.			trans	-48.2	121	-179.3	55.8	0	0	0	110.8	F51 P52	S49-F51 PolarHBondContact O-N 3.26Å; S49-F51 VanDerWaalsContact O-N 3.09Å; S49-P52 WeakPolarHBondContact O-CD 3.27Å
50	P	42.8	Very low	44.4	Very low	51 Å²	51	103.4 Å²	103.4	33%	0.331	53%	0.531	S	S	.	.	S	Bend	trans	-74.3	-0.8	-171.2	28.3	-35.4	0	0	113.8	I48 L54	I48-P50 VanDerWaalsContact O-N 3.16Å; P50-L54 HydrophobicContact CB-CD1 4.21Å; P50-L54 WeakPolarHBondContact O-CB 3.27Å; P50-L54 PolarHBondContact O-N 3.36Å
51	F	38.5	Very low	44.9	Very low	86 Å²	86	96.6 Å²	96.6	38%	0.377	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-53.2	-169.9	-110.7	-84.5	0	0	115.8	S49 Y53 L54 L55 K113	S49-F51 PolarHBondContact O-N 3.26Å; S49-F51 VanDerWaalsContact O-N 3.09Å; F51-Y53 VanDerWaalsContact C-N 3.3Å; F51-Y53 PolarHBondContact O-N 3.11Å; F51-L54 PolarHBondContact O-N 3.43Å; F51-L55 HydrophobicContact CD1-CD1 3.93Å; F51-L55 HydrophobicContact CE1-CD1 4.48Å; F51-L55 WeakPolarHBondContact O-CB 3.44Å; F51-L55 PolarHBondContact O-N 3.35Å; F51-K113 WeakPolarHBondContact CE2-O 3.49Å; F51-K113 WeakPolarHBondContact CZ-O 3.4Å
52	P	40.3	Very low	45.4	Very low	79 Å²	79	89.9 Å²	89.9	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-67.1	-35.2	-177.6	23.5	-31.4	0	0	111.6	S49 L55 S56	S49-P52 WeakPolarHBondContact O-CD 3.27Å; P52-L55 PolarHBondContact O-N 2.82Å; P52-S56 VanDerWaalsContact O-CB 3.31Å; P52-S56 WeakPolarHBondContact O-CB 3.37Å; P52-S56 PolarHBondContact O-N 3.42Å
53	Y	39.1	Very low	45.8	Very low	157 Å²	157	87.2 Å²	87.2	62%	0.616	47%	0.467	S	S	*	.	H	α-helix	trans	-65.8	-43.6	172.3	-86.6	-81.1	0	0	111.3	M45 F51 L55 Y57	M45-Y53 HydrophobicContact CE-CD2 4.21Å; M45-Y53 HydrophobicContact CE-CE2 4.01Å; F51-Y53 VanDerWaalsContact C-N 3.3Å; F51-Y53 PolarHBondContact O-N 3.11Å; Y53-L55 PolarHBondContact O-N 2.96Å; Y53-Y57 WeakPolarHBondContact O-CB 3.45Å; Y53-Y57 PolarHBondContact O-N 3.45Å
54	L	42.5	Very low	46.4	Very low	42 Å²	42	89.1 Å²	89.1	22%	0.22	47%	0.465	C	S	.	.	H	α-helix	trans	-63.2	-39.7	175.5	-118.5	93	0	0	112.5	P50 F51 Y57 S58 L109	P50-L54 HydrophobicContact CB-CD1 4.21Å; P50-L54 WeakPolarHBondContact O-CB 3.27Å; P50-L54 PolarHBondContact O-N 3.36Å; F51-L54 PolarHBondContact O-N 3.43Å; L54-Y57 PolarHBondContact O-N 3.14Å; L54-S58 VanDerWaalsContact O-CB 3.23Å; L54-S58 WeakPolarHBondContact O-CB 3.29Å; L54-S58 PolarHBondContact O-N 3.31Å; L54-S58 PolarHBondContact O-OG 3.47Å; L54-L109 HydrophobicContact CD2-CD1 4.26Å; L54-L109 HydrophobicContact CD2-CD2 3.43Å; L54-L109 VanDerWaalsContact CD2-CD2 3.43Å
55	L	43.7	Very low	47.2	Very low	97 Å²	97	81.3 Å²	81.3	51%	0.508	42%	0.423	S	S	.	.	H	α-helix	trans	-69.7	-46.4	-179.7	-113.2	124.7	0	0	111.5	F51 P52 Y53 Y57 S58 Y59	F51-L55 HydrophobicContact CD1-CD1 3.93Å; F51-L55 HydrophobicContact CE1-CD1 4.48Å; F51-L55 WeakPolarHBondContact O-CB 3.44Å; F51-L55 PolarHBondContact O-N 3.35Å; P52-L55 PolarHBondContact O-N 2.82Å; Y53-L55 PolarHBondContact O-N 2.96Å; L55-Y57 VanDerWaalsContact C-N 3.26Å; L55-Y57 PolarHBondContact O-N 3.44Å; L55-S58 PolarHBondContact O-N 3.42Å; L55-Y59 WeakPolarHBondContact O-CB 3.46Å; L55-Y59 PolarHBondContact O-N 2.84Å
56	S	47.3	Very low	47.9	Very low	59 Å²	59	79.3 Å²	79.3	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-61.4	-39.4	173.3	-179.6	0	0	0	110.8	P52 Y59 H60	P52-S56 VanDerWaalsContact O-CB 3.31Å; P52-S56 WeakPolarHBondContact O-CB 3.37Å; P52-S56 PolarHBondContact O-N 3.42Å; S56-Y59 WeakPolarHBondContact O-CB 3.32Å; S56-Y59 PolarHBondContact O-N 3.22Å; S56-H60 PolarHBondContact O-CD2 2.75Å; S56-H60 PolarHBondContact O-N 2.9Å
57	Y	48.5	Very low	48.8	Very low	65 Å²	65	79.4 Å²	79.4	26%	0.255	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-39.2	177.5	-170.2	-87.2	0	0	112.9	F38 Y53 L54 L55 Y59 H60 V61	F38-Y57 HydrophobicContact CD1-CD2 4.4Å; F38-Y57 AromaticContact CD1-CE2 3.3Å; F38-Y57 HydrophobicContact CD1-CE2 3.3Å; F38-Y57 AromaticContact CD1-CZ 3.44Å; F38-Y57 VanDerWaalsContact CD1-CZ 3.44Å; F38-Y57 WeakPolarHBondContact CD1-OH 3.45Å; F38-Y57 AromaticContact CE1-CD2 3.92Å; F38-Y57 HydrophobicContact CE1-CD2 3.92Å; F38-Y57 AromaticContact CE1-CE2 3.2Å; F38-Y57 HydrophobicContact CE1-CE2 3.2Å; F38-Y57 AromaticContact CE1-CZ 3.79Å; F38-Y57 HydrophobicContact CG-CE2 4.38Å; F38-Y57 HydrophobicContact CZ-CE2 4.28Å; Y53-Y57 WeakPolarHBondContact O-CB 3.45Å; Y53-Y57 PolarHBondContact O-N 3.45Å; L54-Y57 PolarHBondContact O-N 3.14Å; L55-Y57 VanDerWaalsContact C-N 3.26Å; L55-Y57 PolarHBondContact O-N 3.44Å; Y57-Y59 VanDerWaalsContact C-N 3.31Å; Y57-H60 PolarHBondContact O-N 3.37Å; Y57-V61 HydrophobicContact CD1-CG2 4.18Å; Y57-V61 HydrophobicContact CE1-CG2 4.09Å; Y57-V61 VanDerWaalsContact O-CG2 3.3Å; Y57-V61 WeakPolarHBondContact O-CG2 3.28Å; Y57-V61 PolarHBondContact O-N 2.79Å
58	S	51.8	Low	49.4	Very low	23 Å²	23	71.6 Å²	71.6	16%	0.161	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-42.3	172.6	-59.3	0	0	0	109.9	L54 L55 V61 I62	L54-S58 VanDerWaalsContact O-CB 3.23Å; L54-S58 WeakPolarHBondContact O-CB 3.29Å; L54-S58 PolarHBondContact O-N 3.31Å; L54-S58 PolarHBondContact O-OG 3.47Å; L55-S58 PolarHBondContact O-N 3.42Å; S58-V61 PolarHBondContact O-N 2.95Å; S58-I62 VanDerWaalsContact O-CB 3.26Å; S58-I62 WeakPolarHBondContact O-CB 3.42Å; S58-I62 VanDerWaalsContact O-CD1 3.28Å; S58-I62 WeakPolarHBondContact O-CD1 3.2Å; S58-I62 WeakPolarHBondContact O-CG1 3.29Å; S58-I62 PolarHBondContact O-N 3.27Å
59	Y	50.8	Low	50.1	Low	155 Å²	155	67.8 Å²	67.8	61%	0.608	35%	0.348	S	S	*	.	H	α-helix	trans	-61.3	-46.3	174.4	-174.6	-94.3	0	0	111.6	L55 S56 Y57 V61 I62 V63	L55-Y59 WeakPolarHBondContact O-CB 3.46Å; L55-Y59 PolarHBondContact O-N 2.84Å; S56-Y59 WeakPolarHBondContact O-CB 3.32Å; S56-Y59 PolarHBondContact O-N 3.22Å; Y57-Y59 VanDerWaalsContact C-N 3.31Å; Y59-V61 PolarHBondContact O-N 2.88Å; Y59-I62 PolarHBondContact O-N 2.8Å; Y59-V63 HydrophobicContact CD1-CG2 3.86Å; Y59-V63 HydrophobicContact CD2-CG2 4.48Å; Y59-V63 HydrophobicContact CE1-CG2 3.5Å; Y59-V63 HydrophobicContact CE2-CG2 4.17Å; Y59-V63 HydrophobicContact CG-CG2 4.34Å; Y59-V63 WeakPolarHBondContact O-CB 3.46Å; Y59-V63 VanDerWaalsContact O-CG2 3.22Å; Y59-V63 WeakPolarHBondContact O-CG2 3.36Å; Y59-V63 PolarHBondContact O-N 3.49Å
60	H	52.7	Low	50.7	Low	118 Å²	118	70.1 Å²	70.1	55%	0.546	35%	0.348	S	S	.	.	H	α-helix	trans	-62.9	-41.8	177.6	-76.9	-62.3	0	0	112.9	S56 Y57 V63 Y64	S56-H60 PolarHBondContact O-CD2 2.75Å; S56-H60 PolarHBondContact O-N 2.9Å; Y57-H60 PolarHBondContact O-N 3.37Å; H60-V63 PolarHBondContact O-N 2.86Å; H60-Y64 WeakPolarHBondContact O-CB 3.44Å; H60-Y64 PolarHBondContact O-N 2.78Å
61	V	54.3	Low	51.5	Low	29 Å²	29	71.7 Å²	71.7	18%	0.176	36%	0.357	C	S	.	.	H	α-helix	trans	-67.5	-41.5	176.5	173.7	0	0	0	111	Y57 S58 Y59 Y64 L65	Y57-V61 HydrophobicContact CD1-CG2 4.18Å; Y57-V61 HydrophobicContact CE1-CG2 4.09Å; Y57-V61 VanDerWaalsContact O-CG2 3.3Å; Y57-V61 WeakPolarHBondContact O-CG2 3.28Å; Y57-V61 PolarHBondContact O-N 2.79Å; S58-V61 PolarHBondContact O-N 2.95Å; Y59-V61 PolarHBondContact O-N 2.88Å; V61-Y64 PolarHBondContact O-N 3.39Å; V61-L65 HydrophobicContact CG1-CD1 3.73Å; V61-L65 VanDerWaalsContact O-CB 3.31Å; V61-L65 WeakPolarHBondContact O-CB 3.34Å; V61-L65 WeakPolarHBondContact O-CD1 3.34Å; V61-L65 WeakPolarHBondContact O-CG 3.23Å; V61-L65 PolarHBondContact O-N 3.37Å
62	I	53.7	Low	52.3	Low	30 Å²	30	72.2 Å²	72.2	15%	0.154	36%	0.357	C	S	.	.	H	α-helix	trans	-63.7	-46.1	175.8	-69.9	162.5	0	0	110.4	S58 Y59 L65 C66 C98 Y102 I105	S58-I62 VanDerWaalsContact O-CB 3.26Å; S58-I62 WeakPolarHBondContact O-CB 3.42Å; S58-I62 VanDerWaalsContact O-CD1 3.28Å; S58-I62 WeakPolarHBondContact O-CD1 3.2Å; S58-I62 WeakPolarHBondContact O-CG1 3.29Å; S58-I62 PolarHBondContact O-N 3.27Å; Y59-I62 PolarHBondContact O-N 2.8Å; I62-L65 PolarHBondContact O-N 2.97Å; I62-C66 VanDerWaalsContact O-CB 3.27Å; I62-C66 WeakPolarHBondContact O-CB 3.27Å; I62-C66 PolarHBondContact O-N 3.44Å; I62-C98 HydrophobicContact CG2-CB 4.27Å; I62-Y102 HydrophobicContact CD1-CD2 3.92Å; I62-I105 HydrophobicContact CG1-CD1 4.21Å
63	V	56.2	Low	53.2	Low	55 Å²	55	71 Å²	71	33%	0.333	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-45.1	176.8	169.9	0	0	0	110.2	Y59 H60 L65 C66 V67	Y59-V63 HydrophobicContact CD1-CG2 3.86Å; Y59-V63 HydrophobicContact CD2-CG2 4.48Å; Y59-V63 HydrophobicContact CE1-CG2 3.5Å; Y59-V63 HydrophobicContact CE2-CG2 4.17Å; Y59-V63 HydrophobicContact CG-CG2 4.34Å; Y59-V63 WeakPolarHBondContact O-CB 3.46Å; Y59-V63 VanDerWaalsContact O-CG2 3.22Å; Y59-V63 WeakPolarHBondContact O-CG2 3.36Å; Y59-V63 PolarHBondContact O-N 3.49Å; H60-V63 PolarHBondContact O-N 2.86Å; V63-L65 PolarHBondContact O-N 3.5Å; V63-C66 PolarHBondContact O-N 2.84Å; V63-V67 HydrophobicContact CG1-CG2 4.29Å; V63-V67 WeakPolarHBondContact O-CB 3.43Å; V63-V67 VanDerWaalsContact O-CG2 3.24Å; V63-V67 WeakPolarHBondContact O-CG2 3.28Å; V63-V67 PolarHBondContact O-N 3.41Å
64	Y	55.8	Low	53.9	Low	123 Å²	123	69 Å²	69	48%	0.482	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-44.4	177.6	-173.2	-105.5	0	0	111.8	H60 V61 V67 L68	H60-Y64 WeakPolarHBondContact O-CB 3.44Å; H60-Y64 PolarHBondContact O-N 2.78Å; V61-Y64 PolarHBondContact O-N 3.39Å; Y64-V67 PolarHBondContact O-N 2.92Å; Y64-L68 HydrophobicContact CD1-CD1 3.68Å; Y64-L68 HydrophobicContact CE1-CD1 3.22Å; Y64-L68 HydrophobicContact CE2-CD1 4.48Å; Y64-L68 HydrophobicContact CG-CD1 4.48Å; Y64-L68 WeakPolarHBondContact O-CB 3.44Å; Y64-L68 PolarHBondContact O-N 3.33Å
65	L	59.6	Low	54.4	Low	12 Å²	12	73.4 Å²	73.4	6%	0.063	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-44.6	174	-79.4	160	0	0	112.4	L25 L29 V61 I62 V63 V67 L68 C69 L101	L25-L65 HydrophobicContact CD2-CD2 3.8Å; L25-L65 HydrophobicContact CG-CD2 4.43Å; L29-L65 HydrophobicContact CD1-CD2 4.35Å; V61-L65 HydrophobicContact CG1-CD1 3.73Å; V61-L65 VanDerWaalsContact O-CB 3.31Å; V61-L65 WeakPolarHBondContact O-CB 3.34Å; V61-L65 WeakPolarHBondContact O-CD1 3.34Å; V61-L65 WeakPolarHBondContact O-CG 3.23Å; V61-L65 PolarHBondContact O-N 3.37Å; I62-L65 PolarHBondContact O-N 2.97Å; V63-L65 PolarHBondContact O-N 3.5Å; L65-V67 VanDerWaalsContact C-N 3.29Å; L65-V67 PolarHBondContact O-N 2.9Å; L65-L68 PolarHBondContact O-N 3.47Å; L65-C69 WeakPolarHBondContact O-CB 3.47Å; L65-C69 PolarHBondContact O-N 2.82Å; L65-C69 PolarHBondContact O-SG 2.86Å; L65-L101 HydrophobicContact CD1-CD1 3.86Å; L65-L101 HydrophobicContact CD1-CD2 3.38Å; L65-L101 HydrophobicContact CD1-CG 4.24Å; L65-L101 HydrophobicContact CD2-CD1 4.49Å
66	C	56.4	Low	54.7	Low	31 Å²	31	71.7 Å²	71.7	21%	0.209	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-34.4	177.1	-110.8	0	0	0	109.9	I62 V63 K70 C98	I62-C66 VanDerWaalsContact O-CB 3.27Å; I62-C66 WeakPolarHBondContact O-CB 3.27Å; I62-C66 PolarHBondContact O-N 3.44Å; V63-C66 PolarHBondContact O-N 2.84Å; C66-K70 WeakPolarHBondContact O-CB 3.2Å; C66-K70 VanDerWaalsContact O-CG 3.31Å; C66-K70 WeakPolarHBondContact O-CG 3.29Å; C66-K70 PolarHBondContact O-N 3.36Å; C66-C98 WeakPolarHBondContact CB-SG 3.39Å; C66-C98 WeakPolarHBondContact SG-CB 3.31Å; C66-C98 CovalentContact SG-SG 2.1Å; C66-C98 PolarHBondContact SG-SG 3.48Å
67	V	57.3	Low	54.9	Low	74 Å²	74	72.7 Å²	72.7	45%	0.448	35%	0.352	S	S	.	.	H	α-helix	trans	-69.2	-47.5	172.7	170.7	0	0	0	111.2	V63 Y64 L65 C69 K70 V71	V63-V67 HydrophobicContact CG1-CG2 4.29Å; V63-V67 WeakPolarHBondContact O-CB 3.43Å; V63-V67 VanDerWaalsContact O-CG2 3.24Å; V63-V67 WeakPolarHBondContact O-CG2 3.28Å; V63-V67 PolarHBondContact O-N 3.41Å; Y64-V67 PolarHBondContact O-N 2.92Å; L65-V67 VanDerWaalsContact C-N 3.29Å; L65-V67 PolarHBondContact O-N 2.9Å; V67-C69 VanDerWaalsContact C-N 3.33Å; V67-C69 PolarHBondContact O-N 2.85Å; V67-K70 WeakPolarHBondContact O-CB 3.15Å; V67-K70 PolarHBondContact O-N 3.46Å; V67-K70 VanDerWaalsContact O-N 3.14Å; V67-V71 HydrophobicContact CG1-CG2 4.35Å; V67-V71 WeakPolarHBondContact O-CG2 3.16Å; V67-V71 PolarHBondContact O-N 2.9Å
68	L	59.3	Low	54.9	Low	31 Å²	31	74.4 Å²	74.4	16%	0.162	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-46.6	174.5	-103.8	151.4	0	0	111.1	L25 Y64 L65 K70 V71 Y72	L25-L68 HydrophobicContact CD1-CD1 4.32Å; L25-L68 HydrophobicContact CD1-CD2 4.25Å; Y64-L68 HydrophobicContact CD1-CD1 3.68Å; Y64-L68 HydrophobicContact CE1-CD1 3.22Å; Y64-L68 HydrophobicContact CE2-CD1 4.48Å; Y64-L68 HydrophobicContact CG-CD1 4.48Å; Y64-L68 WeakPolarHBondContact O-CB 3.44Å; Y64-L68 PolarHBondContact O-N 3.33Å; L65-L68 PolarHBondContact O-N 3.47Å; L68-K70 PolarHBondContact O-N 3.33Å; L68-V71 PolarHBondContact O-N 3.26Å; L68-Y72 HydrophobicContact CD2-CD2 3.9Å; L68-Y72 HydrophobicContact CD2-CE2 3.63Å; L68-Y72 WeakPolarHBondContact O-CB 3.5Å; L68-Y72 WeakPolarHBondContact O-CD2 3.22Å; L68-Y72 PolarHBondContact O-N 3.45Å
69	C	58	Low	54.6	Low	26 Å²	26	80.3 Å²	80.3	18%	0.176	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-42.4	175.1	-72	0	0	0	111.7	L65 V67 Y72 I73 L94	L65-C69 WeakPolarHBondContact O-CB 3.47Å; L65-C69 PolarHBondContact O-N 2.82Å; L65-C69 PolarHBondContact O-SG 2.86Å; V67-C69 VanDerWaalsContact C-N 3.33Å; V67-C69 PolarHBondContact O-N 2.85Å; C69-Y72 PolarHBondContact O-N 3.39Å; C69-I73 VanDerWaalsContact O-CB 3.29Å; C69-I73 WeakPolarHBondContact O-CB 3.35Å; C69-I73 WeakPolarHBondContact O-CD1 3.42Å; C69-I73 WeakPolarHBondContact O-CG1 3.17Å; C69-I73 PolarHBondContact O-N 3.43Å; C69-L94 HydrophobicContact CB-CD2 3.65Å
70	K	56.6	Low	54.2	Low	129 Å²	129	76.8 Å²	76.8	56%	0.561	38%	0.384	S	S	*	.	H	α-helix	trans	-60.9	-44.7	173.8	-79.8	178.3	-180	-176.4	112	C66 V67 L68 I73 L74 L94	C66-K70 WeakPolarHBondContact O-CB 3.2Å; C66-K70 VanDerWaalsContact O-CG 3.31Å; C66-K70 WeakPolarHBondContact O-CG 3.29Å; C66-K70 PolarHBondContact O-N 3.36Å; V67-K70 WeakPolarHBondContact O-CB 3.15Å; V67-K70 PolarHBondContact O-N 3.46Å; V67-K70 VanDerWaalsContact O-N 3.14Å; L68-K70 PolarHBondContact O-N 3.33Å; K70-I73 PolarHBondContact O-N 2.78Å; K70-L74 WeakPolarHBondContact O-CB 3.24Å; K70-L74 PolarHBondContact O-N 2.83Å; K70-L94 HydrophobicContact CG-CD1 3.93Å
71	V	58.3	Low	53.7	Low	84 Å²	84	80.6 Å²	80.6	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-42.5	178	173	0	0	0	110.6	V67 L68 L74 Y75	V67-V71 HydrophobicContact CG1-CG2 4.35Å; V67-V71 WeakPolarHBondContact O-CG2 3.16Å; V67-V71 PolarHBondContact O-N 2.9Å; L68-V71 PolarHBondContact O-N 3.26Å; V71-L74 PolarHBondContact O-N 3.43Å; V71-Y75 WeakPolarHBondContact O-CB 3.18Å; V71-Y75 PolarHBondContact O-N 3.44Å
72	Y	57.1	Low	53	Low	98 Å²	98	83.8 Å²	83.8	38%	0.384	42%	0.423	S	S	.	.	H	α-helix	trans	-67	-43.4	176.8	-95	-81.6	0	0	112.5	L68 C69 Y75 S76	L68-Y72 HydrophobicContact CD2-CD2 3.9Å; L68-Y72 HydrophobicContact CD2-CE2 3.63Å; L68-Y72 WeakPolarHBondContact O-CB 3.5Å; L68-Y72 WeakPolarHBondContact O-CD2 3.22Å; L68-Y72 PolarHBondContact O-N 3.45Å; C69-Y72 PolarHBondContact O-N 3.39Å; Y72-Y75 PolarHBondContact O-N 2.77Å; Y72-S76 WeakPolarHBondContact O-CB 3.44Å; Y72-S76 PolarHBondContact O-N 3.5Å; Y72-S76 PolarHBondContact O-OG 3.49Å
73	I	57.3	Low	52.5	Low	53 Å²	53	86.6 Å²	86.6	27%	0.272	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-49.1	175	-71.5	165.9	0	0	109.1	C69 K70 Y75 S76 F77 L94	C69-I73 VanDerWaalsContact O-CB 3.29Å; C69-I73 WeakPolarHBondContact O-CB 3.35Å; C69-I73 WeakPolarHBondContact O-CD1 3.42Å; C69-I73 WeakPolarHBondContact O-CG1 3.17Å; C69-I73 PolarHBondContact O-N 3.43Å; K70-I73 PolarHBondContact O-N 2.78Å; I73-Y75 VanDerWaalsContact C-N 3.33Å; I73-Y75 PolarHBondContact O-N 3.05Å; I73-S76 PolarHBondContact O-N 3.35Å; I73-F77 HydrophobicContact CG2-CD2 3.53Å; I73-F77 HydrophobicContact CG2-CE2 3.49Å; I73-F77 VanDerWaalsContact CG2-CE2 3.49Å; I73-F77 VanDerWaalsContact O-CD2 3.22Å; I73-F77 WeakPolarHBondContact O-CD2 3.34Å; I73-F77 PolarHBondContact O-N 3.45Å; I73-L94 HydrophobicContact CD1-CD1 4.32Å; I73-L94 HydrophobicContact CD1-CD2 3.96Å; I73-L94 HydrophobicContact CD1-CG 4.01Å
74	L	54.6	Low	51.5	Low	115 Å²	115	90.2 Å²	90.2	60%	0.602	46%	0.464	S	S	*	.	H	α-helix	trans	-59.5	-43.8	176.8	-172.5	69.8	0	0	111.6	K70 V71 S76 F77 V78	K70-L74 WeakPolarHBondContact O-CB 3.24Å; K70-L74 PolarHBondContact O-N 2.83Å; V71-L74 PolarHBondContact O-N 3.43Å; L74-S76 PolarHBondContact O-N 3.27Å; L74-F77 PolarHBondContact O-N 3.31Å; L74-V78 WeakPolarHBondContact O-CB 3.5Å; L74-V78 VanDerWaalsContact O-CG2 3.24Å; L74-V78 WeakPolarHBondContact O-CG2 2.81Å; L74-V78 PolarHBondContact O-N 3Å
75	Y	53.6	Low	50.9	Low	135 Å²	135	87.9 Å²	87.9	53%	0.529	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-41.3	177.3	-173.4	-94.7	0	0	111.8	V71 Y72 I73 V78 K79	V71-Y75 WeakPolarHBondContact O-CB 3.18Å; V71-Y75 PolarHBondContact O-N 3.44Å; Y72-Y75 PolarHBondContact O-N 2.77Å; I73-Y75 VanDerWaalsContact C-N 3.33Å; I73-Y75 PolarHBondContact O-N 3.05Å; Y75-V78 PolarHBondContact O-N 3.22Å; Y75-K79 HydrophobicContact CE1-CD 3.87Å; Y75-K79 WeakPolarHBondContact O-CB 3.42Å; Y75-K79 PolarHBondContact O-N 3.4Å; Y75-K79 PolarHBondContact OH-NZ 3.38Å
76	S	49	Very low	50	Low	60 Å²	60	90.9 Å²	90.9	42%	0.42	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-41.5	172.7	-82.3	0	0	0	112.3	Y72 I73 L74 V78 K79 D80	Y72-S76 WeakPolarHBondContact O-CB 3.44Å; Y72-S76 PolarHBondContact O-N 3.5Å; Y72-S76 PolarHBondContact O-OG 3.49Å; I73-S76 PolarHBondContact O-N 3.35Å; L74-S76 PolarHBondContact O-N 3.27Å; S76-V78 VanDerWaalsContact C-N 3.33Å; S76-V78 PolarHBondContact O-N 3.31Å; S76-K79 PolarHBondContact O-N 2.86Å; S76-D80 WeakPolarHBondContact O-CB 3.37Å; S76-D80 PolarHBondContact O-N 2.9Å
77	F	51.2	Low	49.4	Very low	80 Å²	80	98.9 Å²	98.9	35%	0.351	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-37.4	174.9	-90.3	-76	0	0	112.7	I73 L74 D80 I83 L85	I73-F77 HydrophobicContact CG2-CD2 3.53Å; I73-F77 HydrophobicContact CG2-CE2 3.49Å; I73-F77 VanDerWaalsContact CG2-CE2 3.49Å; I73-F77 VanDerWaalsContact O-CD2 3.22Å; I73-F77 WeakPolarHBondContact O-CD2 3.34Å; I73-F77 PolarHBondContact O-N 3.45Å; L74-F77 PolarHBondContact O-N 3.31Å; F77-D80 CarbonylContact O-C 3.56Å; F77-I83 WeakPolarHBondContact CE1-O 3.36Å; F77-L85 HydrophobicContact CE1-CB 4.48Å; F77-L85 HydrophobicContact CZ-CB 4Å; F77-L85 WeakPolarHBondContact CZ-O 3.06Å
78	V	48.6	Very low	48.8	Very low	101 Å²	101	99.4 Å²	99.4	61%	0.612	52%	0.518	S	S	*	.	H	α-helix	trans	-72.5	-31.5	178.3	172	0	0	0	111.5	L74 Y75 S76	L74-V78 WeakPolarHBondContact O-CB 3.5Å; L74-V78 VanDerWaalsContact O-CG2 3.24Å; L74-V78 WeakPolarHBondContact O-CG2 2.81Å; L74-V78 PolarHBondContact O-N 3Å; Y75-V78 PolarHBondContact O-N 3.22Å; S76-V78 VanDerWaalsContact C-N 3.33Å; S76-V78 PolarHBondContact O-N 3.31Å
79	K	46.5	Very low	48.1	Very low	148 Å²	148	103.8 Å²	103.8	64%	0.643	53%	0.533	S	S	*	.	H	α-helix	trans	-87.6	-29	-178.4	-147	173.3	-175.9	174.9	113.2	Y75 S76	Y75-K79 HydrophobicContact CE1-CD 3.87Å; Y75-K79 WeakPolarHBondContact O-CB 3.42Å; Y75-K79 PolarHBondContact O-N 3.4Å; Y75-K79 PolarHBondContact OH-NZ 3.38Å; S76-K79 PolarHBondContact O-N 2.86Å
80	D	42.6	Very low	47.6	Very low	80 Å²	80	103.3 Å²	103.3	43%	0.428	53%	0.532	S	S	.	.			trans	-115.6	82	175.8	-73.6	-57.4	0	0	110.2	S76 F77 S82 I83	S76-D80 WeakPolarHBondContact O-CB 3.37Å; S76-D80 PolarHBondContact O-N 2.9Å; F77-D80 CarbonylContact O-C 3.56Å; D80-S82 PolarHBondContact O-N 3.38Å; D80-I83 HydrophobicContact CB-CD1 4.49Å; D80-I83 PolarHBondContact O-N 2.9Å
81	F	41	Very low	47	Very low	199 Å²	199	100.2 Å²	100.2	87%	0.873	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	12.5	168.8	-111.7	-87.5	0	0	113.9
82	S	41.1	Very low	46.6	Very low	95 Å²	95	99.2 Å²	99.2	66%	0.664	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-4	-174.1	49.3	0	0	0	113.8	D80	D80-S82 PolarHBondContact O-N 3.38Å
83	I	42.6	Very low	46.4	Very low	90 Å²	90	98.6 Å²	98.6	46%	0.462	53%	0.527	S	S	.	.			trans	-117.6	83.2	179	-52.5	176.7	0	0	109.8	F77 D80 L85	F77-I83 WeakPolarHBondContact CE1-O 3.36Å; D80-I83 HydrophobicContact CB-CD1 4.49Å; D80-I83 PolarHBondContact O-N 2.9Å; I83-L85 HydrophobicContact CG2-CB 4.29Å; I83-L85 HydrophobicContact CG2-CD1 3.58Å; I83-L85 HydrophobicContact CG2-CG 3.81Å; I83-L85 PolarHBondContact O-N 3.4Å
84	C	35.3	Very low	46.1	Very low	131 Å²	131	97.2 Å²	97.2	89%	0.885	52%	0.52	S	S	*	.			trans	-68.7	73.1	164	-77.7	0	0	0	110.3
85	L	43.4	Very low	46.1	Very low	74 Å²	74	100.8 Å²	100.8	39%	0.387	53%	0.526	S	S	.	.			trans	-85.5	122.9	162.6	-88.1	160.4	0	0	107.8	F77 I83 F87 Y89	F77-L85 HydrophobicContact CE1-CB 4.48Å; F77-L85 HydrophobicContact CZ-CB 4Å; F77-L85 WeakPolarHBondContact CZ-O 3.06Å; I83-L85 HydrophobicContact CG2-CB 4.29Å; I83-L85 HydrophobicContact CG2-CD1 3.58Å; I83-L85 HydrophobicContact CG2-CG 3.81Å; I83-L85 PolarHBondContact O-N 3.4Å; L85-F87 PolarHBondContact O-N 2.89Å; L85-Y89 HydrophobicContact CD2-CG 4.34Å
86	P	40.7	Very low	46.1	Very low	75 Å²	75	97.1 Å²	97.1	49%	0.487	52%	0.521	S	S	.	.			trans	-59.2	142.1	-177.7	24.5	-33.4	0	0	109.6	S88 Y89	P86-S88 PolarHBondContact O-N 3.31Å; P86-Y89 HydrophobicContact CG-CD2 3.81Å; P86-Y89 PolarHBondContact O-N 3.46Å
87	F	44.3	Very low	46.3	Very low	198 Å²	198	96.3 Å²	96.3	87%	0.868	51%	0.512	S	S	*	.	H	α-helix	trans	-48.7	-27.4	178.4	-148	-98.1	0	0	112.8	L85 Y89 G90 S91	L85-F87 PolarHBondContact O-N 2.89Å; F87-Y89 PolarHBondContact O-N 3Å; F87-G90 PolarHBondContact O-N 3.36Å; F87-S91 PolarHBondContact O-N 2.94Å; F87-S91 PolarHBondContact O-OG 2.85Å
88	S	43.9	Very low	46.5	Very low	85 Å²	85	93.8 Å²	93.8	59%	0.594	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-27	173	-177.6	0	0	0	115.5	P86 S91 S92	P86-S88 PolarHBondContact O-N 3.31Å; S88-S91 PolarHBondContact O-OG 3.23Å; S88-S91 VanDerWaalsContact O-OG 3.05Å; S88-S92 PolarHBondContact O-OG 3.03Å
89	Y	45.4	Very low	46.8	Very low	123 Å²	123	91.5 Å²	91.5	48%	0.482	49%	0.492	S	S	.	.	H	α-helix	trans	-82.9	-32	174.4	-101.2	-94.9	0	0	111.5	L85 P86 F87 S91 S92 L93	L85-Y89 HydrophobicContact CD2-CG 4.34Å; P86-Y89 HydrophobicContact CG-CD2 3.81Å; P86-Y89 PolarHBondContact O-N 3.46Å; F87-Y89 PolarHBondContact O-N 3Å; Y89-S91 VanDerWaalsContact C-N 3.35Å; Y89-S92 WeakPolarHBondContact CA-OG 3.34Å; Y89-S92 PolarHBondContact O-OG 3.44Å; Y89-S92 VanDerWaalsContact O-OG 3.07Å; Y89-L93 VanDerWaalsContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CD1 3.34Å; Y89-L93 VanDerWaalsContact O-CG 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.24Å; Y89-L93 PolarHBondContact O-N 2.92Å
90	G	47.6	Very low	47.3	Very low	16 Å²	16	88.9 Å²	88.9	17%	0.165	49%	0.485	C	S	.	.	H	α-helix	trans	-63.1	-42.1	173.9	0	0	0	0	111.8	F87 L94	F87-G90 PolarHBondContact O-N 3.36Å; G90-L94 VanDerWaalsContact O-CB 3.28Å; G90-L94 WeakPolarHBondContact O-CB 3.42Å; G90-L94 WeakPolarHBondContact O-CD1 3.22Å; G90-L94 WeakPolarHBondContact O-CG 3.13Å; G90-L94 PolarHBondContact O-N 3.28Å
91	S	43.3	Very low	47.8	Very low	65 Å²	65	87.8 Å²	87.8	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-68.9	-40.1	178.3	50.5	0	0	0	113.3	F87 S88 Y89 L94 Y95	F87-S91 PolarHBondContact O-N 2.94Å; F87-S91 PolarHBondContact O-OG 2.85Å; S88-S91 PolarHBondContact O-OG 3.23Å; S88-S91 VanDerWaalsContact O-OG 3.05Å; Y89-S91 VanDerWaalsContact C-N 3.35Å; S91-L94 PolarHBondContact O-N 3.42Å; S91-Y95 WeakPolarHBondContact O-CB 3.46Å; S91-Y95 PolarHBondContact O-N 2.84Å
92	S	50.5	Low	48.4	Very low	62 Å²	62	83.2 Å²	83.2	43%	0.434	46%	0.457	S	S	.	.	H	α-helix	trans	-69.9	-38.1	176.7	60.3	0	0	0	112.4	S88 Y89 Y95 S96	S88-S92 PolarHBondContact O-OG 3.03Å; Y89-S92 WeakPolarHBondContact CA-OG 3.34Å; Y89-S92 PolarHBondContact O-OG 3.44Å; Y89-S92 VanDerWaalsContact O-OG 3.07Å; S92-Y95 PolarHBondContact O-N 2.88Å; S92-S96 WeakPolarHBondContact O-CB 3.45Å; S92-S96 PolarHBondContact O-N 3.06Å
93	L	51.5	Low	49.1	Very low	86 Å²	86	83.3 Å²	83.3	45%	0.45	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-43.5	171.2	-77.1	167.3	0	0	111.4	Y89 Y95 S96 L97	Y89-L93 VanDerWaalsContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CB 3.3Å; Y89-L93 WeakPolarHBondContact O-CD1 3.34Å; Y89-L93 VanDerWaalsContact O-CG 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.24Å; Y89-L93 PolarHBondContact O-N 2.92Å; L93-Y95 PolarHBondContact O-N 3.32Å; L93-S96 PolarHBondContact O-N 2.77Å; L93-L97 VanDerWaalsContact O-CB 3.22Å; L93-L97 WeakPolarHBondContact O-CB 3.37Å; L93-L97 WeakPolarHBondContact O-CD1 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 3.46Å
94	L	52.1	Low	49.5	Very low	23 Å²	23	87 Å²	87	12%	0.12	46%	0.458	C	S	.	.	H	α-helix	trans	-62.8	-40	175	-77.6	167.2	0	0	112.3	C69 K70 I73 G90 S91 L97 C98	C69-L94 HydrophobicContact CB-CD2 3.65Å; K70-L94 HydrophobicContact CG-CD1 3.93Å; I73-L94 HydrophobicContact CD1-CD1 4.32Å; I73-L94 HydrophobicContact CD1-CD2 3.96Å; I73-L94 HydrophobicContact CD1-CG 4.01Å; G90-L94 VanDerWaalsContact O-CB 3.28Å; G90-L94 WeakPolarHBondContact O-CB 3.42Å; G90-L94 WeakPolarHBondContact O-CD1 3.22Å; G90-L94 WeakPolarHBondContact O-CG 3.13Å; G90-L94 PolarHBondContact O-N 3.28Å; S91-L94 PolarHBondContact O-N 3.42Å; L94-L97 HydrophobicContact CD2-CD1 4.46Å; L94-L97 WeakPolarHBondContact O-CB 3.3Å; L94-L97 PolarHBondContact O-N 2.86Å; L94-C98 WeakPolarHBondContact O-CB 3.11Å; L94-C98 PolarHBondContact O-N 2.83Å
95	Y	53.3	Low	50.3	Low	190 Å²	190	82.7 Å²	82.7	75%	0.745	43%	0.425	S	S	*	.	H	α-helix	trans	-66.6	-44.4	176.6	-165	-92.7	0	0	111.3	S91 S92 L93 L97 C98 S99	S91-Y95 WeakPolarHBondContact O-CB 3.46Å; S91-Y95 PolarHBondContact O-N 2.84Å; S92-Y95 PolarHBondContact O-N 2.88Å; L93-Y95 PolarHBondContact O-N 3.32Å; Y95-L97 VanDerWaalsContact C-N 3.34Å; Y95-L97 PolarHBondContact O-N 3.48Å; Y95-C98 PolarHBondContact O-N 2.94Å; Y95-S99 VanDerWaalsContact O-CB 3.27Å; Y95-S99 WeakPolarHBondContact O-CB 3.34Å; Y95-S99 PolarHBondContact O-N 3.16Å
96	S	54	Low	50.7	Low	59 Å²	59	83.8 Å²	83.8	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-63.1	-40	174.4	-175.5	0	0	0	112	S92 L93 S99 N100	S92-S96 WeakPolarHBondContact O-CB 3.45Å; S92-S96 PolarHBondContact O-N 3.06Å; L93-S96 PolarHBondContact O-N 2.77Å; S96-S99 PolarHBondContact O-N 3.43Å; S96-N100 WeakPolarHBondContact O-CB 3.5Å; S96-N100 VanDerWaalsContact O-CG 3.31Å; S96-N100 PolarHBondContact O-N 3.15Å; S96-N100 PolarHBondContact O-ND2 3.36Å; S96-N100 PolarHBondContact OG-ND2 3.07Å
97	L	53.8	Low	51.3	Low	43 Å²	43	84 Å²	84	23%	0.225	43%	0.434	C	S	.	.	H	α-helix	trans	-61.7	-54.1	174.4	-80.5	165.5	0	0	111.2	F18 L93 L94 Y95 S99 N100 L101	F18-L97 HydrophobicContact CD2-CD2 4.45Å; F18-L97 HydrophobicContact CE2-CD2 3.58Å; F18-L97 HydrophobicContact CZ-CD2 4.36Å; L93-L97 VanDerWaalsContact O-CB 3.22Å; L93-L97 WeakPolarHBondContact O-CB 3.37Å; L93-L97 WeakPolarHBondContact O-CD1 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 3.46Å; L94-L97 HydrophobicContact CD2-CD1 4.46Å; L94-L97 WeakPolarHBondContact O-CB 3.3Å; L94-L97 PolarHBondContact O-N 2.86Å; Y95-L97 VanDerWaalsContact C-N 3.34Å; Y95-L97 PolarHBondContact O-N 3.48Å; L97-S99 VanDerWaalsContact C-N 3.26Å; L97-S99 PolarHBondContact O-N 2.85Å; L97-N100 PolarHBondContact O-N 3.24Å; L97-L101 WeakPolarHBondContact O-CB 3.31Å; L97-L101 PolarHBondContact O-N 3.5Å
98	C	54.9	Low	51.5	Low	26 Å²	26	78 Å²	78	18%	0.176	42%	0.421	C	S	.	.	H	α-helix	trans	-68	-28.1	-177.5	-74.1	0	0	0	110.6	I62 C66 L94 Y95 Y102	I62-C98 HydrophobicContact CG2-CB 4.27Å; C66-C98 WeakPolarHBondContact CB-SG 3.39Å; C66-C98 WeakPolarHBondContact SG-CB 3.31Å; C66-C98 CovalentContact SG-SG 2.1Å; C66-C98 PolarHBondContact SG-SG 3.48Å; L94-C98 WeakPolarHBondContact O-CB 3.11Å; L94-C98 PolarHBondContact O-N 2.83Å; Y95-C98 PolarHBondContact O-N 2.94Å; C98-Y102 VanDerWaalsContact O-CB 3.27Å; C98-Y102 WeakPolarHBondContact O-CB 3.24Å; C98-Y102 PolarHBondContact O-N 3.27Å
99	S	55.2	Low	51.5	Low	54 Å²	54	76.2 Å²	76.2	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-70.3	-49.1	169.6	-174.1	0	0	0	113.8	Y95 S96 L97 L101 Y102 I103	Y95-S99 VanDerWaalsContact O-CB 3.27Å; Y95-S99 WeakPolarHBondContact O-CB 3.34Å; Y95-S99 PolarHBondContact O-N 3.16Å; S96-S99 PolarHBondContact O-N 3.43Å; L97-S99 VanDerWaalsContact C-N 3.26Å; L97-S99 PolarHBondContact O-N 2.85Å; S99-L101 VanDerWaalsContact C-N 3.26Å; S99-L101 PolarHBondContact O-N 3.49Å; S99-Y102 WeakPolarHBondContact O-CB 3.34Å; S99-Y102 PolarHBondContact O-N 2.85Å; S99-I103 VanDerWaalsContact O-CG1 3.31Å; S99-I103 WeakPolarHBondContact O-CG1 3.07Å; S99-I103 PolarHBondContact O-N 3.42Å
100	N	56.4	Low	51.4	Low	93 Å²	93	73.8 Å²	73.8	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-64.6	-35.3	179.6	-76.5	-45.8	0	0	111.6	S96 L97 I103 Y104	S96-N100 WeakPolarHBondContact O-CB 3.5Å; S96-N100 VanDerWaalsContact O-CG 3.31Å; S96-N100 PolarHBondContact O-N 3.15Å; S96-N100 PolarHBondContact O-ND2 3.36Å; S96-N100 PolarHBondContact OG-ND2 3.07Å; L97-N100 PolarHBondContact O-N 3.24Å; N100-I103 PolarHBondContact O-N 2.9Å; N100-Y104 WeakPolarHBondContact O-CB 3.4Å; N100-Y104 PolarHBondContact O-N 2.88Å
101	L	54.4	Low	51.6	Low	56 Å²	56	82.4 Å²	82.4	29%	0.293	44%	0.436	S	S	.	.	H	α-helix	trans	-73.3	-36.8	178.1	-155.2	137	0	0	111.3	L65 L97 S99 Y104 I105	L65-L101 HydrophobicContact CD1-CD1 3.86Å; L65-L101 HydrophobicContact CD1-CD2 3.38Å; L65-L101 HydrophobicContact CD1-CG 4.24Å; L65-L101 HydrophobicContact CD2-CD1 4.49Å; L97-L101 WeakPolarHBondContact O-CB 3.31Å; L97-L101 PolarHBondContact O-N 3.5Å; S99-L101 VanDerWaalsContact C-N 3.26Å; S99-L101 PolarHBondContact O-N 3.49Å; L101-Y104 PolarHBondContact O-N 3.5Å; L101-I105 HydrophobicContact CD2-CD1 3.61Å; L101-I105 HydrophobicContact CD2-CG1 4.27Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.16Å; L101-I105 PolarHBondContact O-N 2.92Å
102	Y	53	Low	51.6	Low	104 Å²	104	84.4 Å²	84.4	41%	0.408	45%	0.45	S	S	.	.	H	α-helix	trans	-58.9	-47	168.6	-176.2	-94.9	0	0	111.7	I62 C98 S99 Y104 I105 Y106	I62-Y102 HydrophobicContact CD1-CD2 3.92Å; C98-Y102 VanDerWaalsContact O-CB 3.27Å; C98-Y102 WeakPolarHBondContact O-CB 3.24Å; C98-Y102 PolarHBondContact O-N 3.27Å; S99-Y102 WeakPolarHBondContact O-CB 3.34Å; S99-Y102 PolarHBondContact O-N 2.85Å; Y102-Y104 VanDerWaalsContact C-N 3.33Å; Y102-Y104 PolarHBondContact O-N 3.37Å; Y102-I105 PolarHBondContact O-N 3.46Å; Y102-Y106 HydrophobicContact CD1-CD2 4.15Å; Y102-Y106 AromaticContact CE1-CD2 3.62Å; Y102-Y106 HydrophobicContact CE1-CD2 3.62Å; Y102-Y106 AromaticContact CE1-CE2 3.76Å; Y102-Y106 HydrophobicContact CE1-CE2 3.76Å; Y102-Y106 HydrophobicContact CE1-CG 4.44Å; Y102-Y106 HydrophobicContact CE2-CD2 4.05Å; Y102-Y106 AromaticContact CE2-CE2 3.87Å; Y102-Y106 HydrophobicContact CE2-CE2 3.87Å; Y102-Y106 AromaticContact CZ-CD2 3.58Å; Y102-Y106 AromaticContact CZ-CE2 3.3Å; Y102-Y106 WeakPolarHBondContact O-CB 3.19Å; Y102-Y106 PolarHBondContact O-N 2.92Å; Y102-Y106 WeakPolarHBondContact OH-CE2 3.39Å
103	I	56.2	Low	51.4	Low	96 Å²	96	86.3 Å²	86.3	49%	0.492	45%	0.451	S	S	.	.	H	α-helix	trans	-60.4	-43.4	175.8	-65.5	166.2	0	0	110.8	S99 N100 Y106 A107	S99-I103 VanDerWaalsContact O-CG1 3.31Å; S99-I103 WeakPolarHBondContact O-CG1 3.07Å; S99-I103 PolarHBondContact O-N 3.42Å; N100-I103 PolarHBondContact O-N 2.9Å; I103-Y106 PolarHBondContact O-N 3.08Å; I103-A107 VanDerWaalsContact O-CB 3.28Å; I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 3.47Å
104	Y	50.6	Low	50.9	Low	167 Å²	167	86.6 Å²	86.6	66%	0.655	45%	0.452	S	S	*	.	H	α-helix	trans	-64.7	-42.8	179.3	-169.5	-95.3	0	0	112.2	N100 L101 Y102 A107 A108	N100-Y104 WeakPolarHBondContact O-CB 3.4Å; N100-Y104 PolarHBondContact O-N 2.88Å; L101-Y104 PolarHBondContact O-N 3.5Å; Y102-Y104 VanDerWaalsContact C-N 3.33Å; Y102-Y104 PolarHBondContact O-N 3.37Å; Y104-A107 PolarHBondContact O-N 3.32Å; Y104-A108 VanDerWaalsContact O-CB 3.23Å; Y104-A108 WeakPolarHBondContact O-CB 3.49Å; Y104-A108 PolarHBondContact O-N 3.08Å
105	I	51.9	Low	50.3	Low	41 Å²	41	94.6 Å²	94.6	21%	0.21	49%	0.485	C	S	.	.	H	α-helix	trans	-61.8	-45.8	174	-69.1	169.8	0	0	109.9	I62 L101 Y102 A107 A108 L109	I62-I105 HydrophobicContact CG1-CD1 4.21Å; L101-I105 HydrophobicContact CD2-CD1 3.61Å; L101-I105 HydrophobicContact CD2-CG1 4.27Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.16Å; L101-I105 PolarHBondContact O-N 2.92Å; Y102-I105 PolarHBondContact O-N 3.46Å; I105-A107 VanDerWaalsContact C-N 3.33Å; I105-A107 PolarHBondContact O-N 3.43Å; I105-A108 PolarHBondContact O-N 2.98Å; I105-L109 WeakPolarHBondContact O-CG 3.47Å; I105-L109 PolarHBondContact O-N 3.17Å; I105-L109 VanDerWaalsContact O-N 3.11Å
106	Y	52.4	Low	49.5	Very low	98 Å²	98	97.3 Å²	97.3	38%	0.384	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-39	177.5	-111.8	-94	0	0	112.9	Y102 I103 L109	Y102-Y106 HydrophobicContact CD1-CD2 4.15Å; Y102-Y106 AromaticContact CE1-CD2 3.62Å; Y102-Y106 HydrophobicContact CE1-CD2 3.62Å; Y102-Y106 AromaticContact CE1-CE2 3.76Å; Y102-Y106 HydrophobicContact CE1-CE2 3.76Å; Y102-Y106 HydrophobicContact CE1-CG 4.44Å; Y102-Y106 HydrophobicContact CE2-CD2 4.05Å; Y102-Y106 AromaticContact CE2-CE2 3.87Å; Y102-Y106 HydrophobicContact CE2-CE2 3.87Å; Y102-Y106 AromaticContact CZ-CD2 3.58Å; Y102-Y106 AromaticContact CZ-CE2 3.3Å; Y102-Y106 WeakPolarHBondContact O-CB 3.19Å; Y102-Y106 PolarHBondContact O-N 2.92Å; Y102-Y106 WeakPolarHBondContact OH-CE2 3.39Å; I103-Y106 PolarHBondContact O-N 3.08Å; Y106-L109 PolarHBondContact O-N 2.94Å
107	A	52.9	Low	49.2	Very low	80 Å²	80	99.2 Å²	99.2	66%	0.661	52%	0.516	S	S	*	.	H	α-helix	trans	-73.6	-29.5	177.5	0	0	0	0	112.9	I103 Y104 I105 L109	I103-A107 VanDerWaalsContact O-CB 3.28Å; I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 3.47Å; Y104-A107 PolarHBondContact O-N 3.32Å; I105-A107 VanDerWaalsContact C-N 3.33Å; I105-A107 PolarHBondContact O-N 3.43Å; A107-L109 VanDerWaalsContact C-N 3.32Å
108	A	47.9	Very low	49	Very low	72 Å²	72	102.2 Å²	102.2	60%	0.595	53%	0.532	S	S	*	.	H	α-helix	trans	-79.5	-13.2	176	0	0	0	0	113.1	Y104 I105	Y104-A108 VanDerWaalsContact O-CB 3.23Å; Y104-A108 WeakPolarHBondContact O-CB 3.49Å; Y104-A108 PolarHBondContact O-N 3.08Å; I105-A108 PolarHBondContact O-N 2.98Å
109	L	45.2	Very low	48.7	Very low	46 Å²	46	106.4 Å²	106.4	24%	0.241	55%	0.551	C	S	.	*	S	Bend	trans	-71.8	128.8	173.7	-76.1	166	0	0	110	L54 I105 Y106 A107 K111	L54-L109 HydrophobicContact CD2-CD1 4.26Å; L54-L109 HydrophobicContact CD2-CD2 3.43Å; L54-L109 VanDerWaalsContact CD2-CD2 3.43Å; I105-L109 WeakPolarHBondContact O-CG 3.47Å; I105-L109 PolarHBondContact O-N 3.17Å; I105-L109 VanDerWaalsContact O-N 3.11Å; Y106-L109 PolarHBondContact O-N 2.94Å; A107-L109 VanDerWaalsContact C-N 3.32Å; L109-K111 PolarHBondContact O-N 3.3Å
110	P	42.4	Very low	48.3	Very low	72 Å²	72	109.5 Å²	109.5	47%	0.468	56%	0.562	S	S	.	*			trans	-60.3	129	177.8	24.2	-32	0	0	109.5	S112 K113	P110-S112 PolarHBondContact O-N 3.46Å; P110-K113 PolarHBondContact O-N 3.37Å
111	K	51.2	Low	47.8	Very low	197 Å²	197	110.5 Å²	110.5	86%	0.857	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-51.8	-18.1	-179.3	-69.1	-175.4	177.7	-178.5	113.8	L109 K113	L109-K111 PolarHBondContact O-N 3.3Å; K111-K113 PolarHBondContact O-N 3.38Å
112	S	44.8	Very low	47.3	Very low	107 Å²	107	114.1 Å²	114.1	75%	0.748	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-70.5	-8.1	176.5	56.6	0	0	0	115.4	P110	P110-S112 PolarHBondContact O-N 3.46Å
113	K	44.6	Very low	46.9	Very low	103 Å²	103	114.9 Å²	114.9	45%	0.448	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-112.1	6.3	177.4	-70.4	-166.7	177.7	-176.6	114.8	F51 P110 K111 K115	F51-K113 WeakPolarHBondContact CE2-O 3.49Å; F51-K113 WeakPolarHBondContact CZ-O 3.4Å; P110-K113 PolarHBondContact O-N 3.37Å; K111-K113 PolarHBondContact O-N 3.38Å; K113-K115 PolarHBondContact O-N 3.46Å
114	I	42.1	Very low	46.2	Very low	92 Å²	92	116.3 Å²	116.3	47%	0.472	60%	0.604	S	S	.	*			trans	-96.1	87.8	176.6	-54.4	171.7	0	0	108.1
115	K	39.3	Very low	45.9	Very low	190 Å²	190	112.1 Å²	112.1	83%	0.826	60%	0.6	S	S	*	*			trans	-94.5	124	158.6	-87.1	-174.6	174.5	-178.4	107.1	K113	K113-K115 PolarHBondContact O-N 3.46Å
116	L	35.7	Very low	45.3	Very low	247 Å²	247	118.5 Å²	118.5	100%	1.293	64%	0.636	S	S	*	*			trans	-51.2	0	171.2	-96.6	131.4	0	0	111.7

Retrieved 116 of 116 residues in 23.2 ms (Link to these results)

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