A0A087WYB6_HUMAN Loading...

Hydroxyacyl-thioester dehydratase type 2

AlphaFold DB , UniProt , Accession A0A087WYB6, Species HUMAN (Homo sapiens, Human), Gene HTD2, Length 54 aa.

						>A0A087WYB6_HUMAN|A0A087WYB6|HTD2
MFPLISSHHLWWGGLRRTVCLNLPVLTLQHFQHMHIKVGDRAELRRAFTQTDVA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	56	Low	242 Å²	242	141.7 Å²	141.7	100%	1.192	72%	0.715	S	S	*	*				0	102	0	-76.6	153.8	77.4	0	0	107.5
2	F	51.8	Low	56.3	Low	197 Å²	197	142.9 Å²	142.9	86%	0.864	71%	0.705	S	S	*	*			trans	-74.3	135.5	173.3	-74.8	-85.9	0	0	0	108.1	L4	F2-L4 PolarHBondContact O-N 2.86Å
3	P	54.6	Low	56.9	Low	92 Å²	92	135.4 Å²	135.4	60%	0.597	69%	0.686	S	S	*	*			trans	-67.2	127	-177.8	30.5	-32.6	0	0	0	106.6	I5	P3-I5 HydrophobicContact CB-CD1 4.23Å; P3-I5 HydrophobicContact CB-CG1 3.76Å; P3-I5 HydrophobicContact CG-CD1 3.58Å; P3-I5 HydrophobicContact CG-CG1 3.66Å; P3-I5 PolarHBondContact O-N 3.22Å
4	L	57.2	Low	57.4	Low	177 Å²	177	128.6 Å²	128.6	93%	0.927	67%	0.667	S	S	*	*			trans	-64	68.1	161.9	-80	87.3	0	0	0	107.4	F2 S6	F2-L4 PolarHBondContact O-N 2.86Å; L4-S6 PolarHBondContact O-N 2.76Å
5	I	54.4	Low	57.9	Low	123 Å²	123	124.8 Å²	124.8	63%	0.631	65%	0.647	S	S	*	*			trans	-67.6	92.7	171	-63.5	168.6	0	0	0	104.3	P3 S7	P3-I5 HydrophobicContact CB-CD1 4.23Å; P3-I5 HydrophobicContact CB-CG1 3.76Å; P3-I5 HydrophobicContact CG-CD1 3.58Å; P3-I5 HydrophobicContact CG-CG1 3.66Å; P3-I5 PolarHBondContact O-N 3.22Å; I5-S7 PolarHBondContact O-N 2.61Å
6	S	59.2	Low	58.2	Low	49 Å²	49	128.8 Å²	128.8	34%	0.343	65%	0.651	S	S	.	*			trans	22	76.3	153.4	-170	0	0	0	0	113.2	L4 H8 H9	L4-S6 PolarHBondContact O-N 2.76Å; S6-H8 PolarHBondContact O-N 3.5Å; S6-H9 PolarHBondContact O-N 3.19Å; S6-H9 PolarHBondContact OG-CD2 2.81Å; S6-H9 PolarHBondContact OG-N 3.42Å
7	S	57.1	Low	58.5	Low	101 Å²	101	132.8 Å²	132.8	71%	0.706	66%	0.657	S	S	*	*	H	α-helix	trans	-53.2	-24.8	170.1	-158.2	0	0	0	0	110.7	I5 W11	I5-S7 PolarHBondContact O-N 2.61Å; S7-W11 WeakPolarHBondContact O-CB 3.26Å; S7-W11 PolarHBondContact O-N 3.38Å
8	H	58.4	Low	58.8	Low	129 Å²	129	129.4 Å²	129.4	60%	0.597	65%	0.645	S	S	*	*	H	α-helix	trans	-59.8	-42.2	171.8	-113.2	-68.1	0	0	0	114.4	S6 W12	S6-H8 PolarHBondContact O-N 3.5Å; H8-W12 AromaticContact ND1-NE1 3.95Å; H8-W12 PolarHBondContact O-N 3.02Å
9	H	57.8	Low	59.1	Low	143 Å²	143	126.6 Å²	126.6	66%	0.662	64%	0.635	S	S	*	*	H	α-helix	trans	-75.6	-35.6	-178.4	-87.1	-64.9	0	0	0	112.9	S6 W11 W12 G13	S6-H9 PolarHBondContact O-N 3.19Å; S6-H9 PolarHBondContact OG-CD2 2.81Å; S6-H9 PolarHBondContact OG-N 3.42Å; H9-W11 VanDerWaalsContact C-N 3.34Å; H9-W12 PolarHBondContact O-N 3.42Å; H9-G13 PolarHBondContact O-N 2.9Å
10	L	60.1	Low	59.4	Low	130 Å²	130	124.1 Å²	124.1	68%	0.681	63%	0.629	S	S	*	*	H	α-helix	trans	-66.6	-38.4	173	-85.5	157.5	0	0	0	111.4	G13 G14	L10-G13 PolarHBondContact O-N 2.84Å; L10-G14 PolarHBondContact O-N 2.8Å
11	W	59.7	Low	59.5	Low	176 Å²	176	124 Å²	124	67%	0.667	63%	0.629	S	S	*	*	H	α-helix	trans	-64.7	-43.3	175.2	-152.7	56.3	0	0	0	111.8	S7 H9 G13 G14 L15	S7-W11 WeakPolarHBondContact O-CB 3.26Å; S7-W11 PolarHBondContact O-N 3.38Å; H9-W11 VanDerWaalsContact C-N 3.34Å; W11-G13 PolarHBondContact O-N 2.9Å; W11-G14 PolarHBondContact O-N 3.16Å; W11-L15 VanDerWaalsContact O-CB 3.26Å; W11-L15 WeakPolarHBondContact O-CB 3.38Å; W11-L15 PolarHBondContact O-N 3.15Å
12	W	59.7	Low	60.2	Low	156 Å²	156	116.5 Å²	116.5	59%	0.591	59%	0.594	S	S	*	*	H	α-helix	trans	-63.4	-39.1	173.6	-84.1	118.4	0	0	0	113.6	H8 H9 L15 R16	H8-W12 AromaticContact ND1-NE1 3.95Å; H8-W12 PolarHBondContact O-N 3.02Å; H9-W12 PolarHBondContact O-N 3.42Å; W12-L15 HydrophobicContact CE3-CD2 4.42Å; W12-L15 HydrophobicContact CZ3-CD2 4.19Å; W12-R16 VanDerWaalsContact O-CB 3.26Å; W12-R16 WeakPolarHBondContact O-CB 3.25Å; W12-R16 PolarHBondContact O-N 3.2Å
13	G	64	Low	60.8	Low	45 Å²	45	111.8 Å²	111.8	46%	0.464	58%	0.578	S	S	.	*	H	α-helix	trans	-64.7	-41.6	177.1	0	0	0	0	0	112.8	H9 L10 W11 R17	H9-G13 PolarHBondContact O-N 2.9Å; L10-G13 PolarHBondContact O-N 2.84Å; W11-G13 PolarHBondContact O-N 2.9Å; G13-R17 PolarHBondContact O-N 3.42Å
14	G	64.8	Low	61.2	Low	40 Å²	40	110.7 Å²	110.7	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-67.6	-48.4	174.6	0	0	0	0	0	112.6	L10 W11 R16 R17 T18	L10-G14 PolarHBondContact O-N 2.8Å; W11-G14 PolarHBondContact O-N 3.16Å; G14-R16 PolarHBondContact O-N 3.26Å; G14-R17 PolarHBondContact O-N 3.36Å; G14-R17 VanDerWaalsContact O-N 3.14Å; G14-T18 PolarHBondContact O-N 2.94Å; G14-T18 PolarHBondContact O-OG1 2.82Å
15	L	63.7	Low	61.4	Low	72 Å²	72	106.4 Å²	106.4	38%	0.377	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-40.9	-179.7	-153	95.6	0	0	0	111.7	W11 W12 R17 T18 V19	W11-L15 VanDerWaalsContact O-CB 3.26Å; W11-L15 WeakPolarHBondContact O-CB 3.38Å; W11-L15 PolarHBondContact O-N 3.15Å; W12-L15 HydrophobicContact CE3-CD2 4.42Å; W12-L15 HydrophobicContact CZ3-CD2 4.19Å; L15-R17 VanDerWaalsContact C-N 3.32Å; L15-R17 PolarHBondContact O-N 2.93Å; L15-T18 WeakPolarHBondContact CA-OG1 3.46Å; L15-T18 PolarHBondContact O-N 2.55Å; L15-T18 PolarHBondContact O-OG1 2.82Å; L15-V19 HydrophobicContact CG-CG2 4.5Å; L15-V19 VanDerWaalsContact O-CB 3.26Å; L15-V19 WeakPolarHBondContact O-CB 3.36Å; L15-V19 WeakPolarHBondContact O-CG2 3.44Å; L15-V19 PolarHBondContact O-N 2.78Å
16	R	63	Low	61.7	Low	188 Å²	188	105.5 Å²	105.5	71%	0.709	55%	0.547	S	S	*	.	H	α-helix	trans	-64.5	-37.9	176	-169.7	175.6	-178.5	-164.8	1.1	111.5	W12 G14 C20	W12-R16 VanDerWaalsContact O-CB 3.26Å; W12-R16 WeakPolarHBondContact O-CB 3.25Å; W12-R16 PolarHBondContact O-N 3.2Å; G14-R16 PolarHBondContact O-N 3.26Å; R16-C20 WeakPolarHBondContact O-CB 3.41Å; R16-C20 PolarHBondContact O-N 3.33Å; R16-C20 PolarHBondContact O-SG 3.46Å
17	R	64.1	Low	61.7	Low	198 Å²	198	106.2 Å²	106.2	75%	0.747	55%	0.55	S	S	*	.	H	α-helix	trans	-68.1	-46.6	177.7	-118.8	177.1	-177.2	159.6	0.2	111.9	G13 G14 L15 C20 L21	G13-R17 PolarHBondContact O-N 3.42Å; G14-R17 PolarHBondContact O-N 3.36Å; G14-R17 VanDerWaalsContact O-N 3.14Å; L15-R17 VanDerWaalsContact C-N 3.32Å; L15-R17 PolarHBondContact O-N 2.93Å; R17-C20 PolarHBondContact O-N 2.96Å; R17-L21 WeakPolarHBondContact O-CB 3.25Å; R17-L21 VanDerWaalsContact O-CG 3.23Å; R17-L21 WeakPolarHBondContact O-CG 3.2Å; R17-L21 PolarHBondContact O-N 3.25Å
18	T	63.5	Low	61.8	Low	72 Å²	72	106.5 Å²	106.5	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-65.6	-41.5	175.8	35.2	0	0	0	0	111.5	G14 L15 L21 N22	G14-T18 PolarHBondContact O-N 2.94Å; G14-T18 PolarHBondContact O-OG1 2.82Å; L15-T18 WeakPolarHBondContact CA-OG1 3.46Å; L15-T18 PolarHBondContact O-N 2.55Å; L15-T18 PolarHBondContact O-OG1 2.82Å; T18-L21 PolarHBondContact O-N 2.98Å; T18-N22 WeakPolarHBondContact O-CB 3.34Å; T18-N22 PolarHBondContact O-N 3.45Å; T18-N22 PolarHBondContact O-ND2 3.44Å
19	V	64.2	Low	61.9	Low	76 Å²	76	105.6 Å²	105.6	46%	0.461	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-44.5	174.8	173.8	0	0	0	0	110.8	L15 L21 N22 L23	L15-V19 HydrophobicContact CG-CG2 4.5Å; L15-V19 VanDerWaalsContact O-CB 3.26Å; L15-V19 WeakPolarHBondContact O-CB 3.36Å; L15-V19 WeakPolarHBondContact O-CG2 3.44Å; L15-V19 PolarHBondContact O-N 2.78Å; V19-L21 VanDerWaalsContact C-N 3.29Å; V19-L21 PolarHBondContact O-N 3.27Å; V19-N22 PolarHBondContact O-N 3.06Å; V19-L23 WeakPolarHBondContact O-CA 3.27Å; V19-L23 WeakPolarHBondContact O-CB 3.27Å; V19-L23 PolarHBondContact O-N 2.8Å
20	C	64.3	Low	62	Low	76 Å²	76	105.2 Å²	105.2	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-64.8	-28.7	177.2	-75.5	0	0	0	0	113.9	R16 R17 P24	R16-C20 WeakPolarHBondContact O-CB 3.41Å; R16-C20 PolarHBondContact O-N 3.33Å; R16-C20 PolarHBondContact O-SG 3.46Å; R17-C20 PolarHBondContact O-N 2.96Å; C20-P24 WeakPolarHBondContact O-CD 3.09Å
21	L	62	Low	61.9	Low	121 Å²	121	105.3 Å²	105.3	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-82.3	-32	175.3	-68.4	170.3	0	0	0	112.3	R17 T18 V19 P24	R17-L21 WeakPolarHBondContact O-CB 3.25Å; R17-L21 VanDerWaalsContact O-CG 3.23Å; R17-L21 WeakPolarHBondContact O-CG 3.2Å; R17-L21 PolarHBondContact O-N 3.25Å; T18-L21 PolarHBondContact O-N 2.98Å; V19-L21 VanDerWaalsContact C-N 3.29Å; V19-L21 PolarHBondContact O-N 3.27Å; L21-P24 WeakPolarHBondContact O-CD 3.1Å; L21-P24 WeakPolarHBondContact O-CG 3.05Å
22	N	61.4	Low	61.7	Low	85 Å²	85	103.1 Å²	103.1	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-87	-22.8	178.8	-68.8	-39	0	0	0	113.1	T18 V19 V25 L26	T18-N22 WeakPolarHBondContact O-CB 3.34Å; T18-N22 PolarHBondContact O-N 3.45Å; T18-N22 PolarHBondContact O-ND2 3.44Å; V19-N22 PolarHBondContact O-N 3.06Å; N22-V25 PolarHBondContact O-N 2.78Å; N22-L26 HydrophobicContact CB-CD1 4.43Å; N22-L26 VanDerWaalsContact O-CB 3.3Å; N22-L26 WeakPolarHBondContact O-CB 3.06Å; N22-L26 WeakPolarHBondContact O-CG 3.26Å; N22-L26 PolarHBondContact O-N 2.9Å
23	L	63.6	Low	61.7	Low	99 Å²	99	103.4 Å²	103.4	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-46.4	176.5	-161.3	75.8	0	0	0	112.4	V19 V25 L26 T27	V19-L23 WeakPolarHBondContact O-CA 3.27Å; V19-L23 WeakPolarHBondContact O-CB 3.27Å; V19-L23 PolarHBondContact O-N 2.8Å; L23-V25 VanDerWaalsContact C-N 3.29Å; L23-V25 PolarHBondContact O-N 3.29Å; L23-L26 PolarHBondContact O-N 3.15Å; L23-T27 WeakPolarHBondContact O-CB 3.36Å; L23-T27 WeakPolarHBondContact O-CG2 3.38Å; L23-T27 PolarHBondContact O-N 2.99Å; L23-T27 PolarHBondContact O-OG1 2.77Å
24	P	64.1	Low	61.3	Low	69 Å²	69	106.8 Å²	106.8	45%	0.448	54%	0.542	S	S	.	.	H	α-helix	trans	-65.1	-32.8	175.2	23.7	-32.3	0	0	0	112.1	C20 L21 T27 L28	C20-P24 WeakPolarHBondContact O-CD 3.09Å; L21-P24 WeakPolarHBondContact O-CD 3.1Å; L21-P24 WeakPolarHBondContact O-CG 3.05Å; P24-T27 WeakPolarHBondContact CA-OG1 3.3Å; P24-T27 PolarHBondContact O-OG1 3.34Å; P24-L28 VanDerWaalsContact O-CB 3.26Å; P24-L28 WeakPolarHBondContact O-CB 3.43Å; P24-L28 PolarHBondContact O-N 3.25Å
25	V	60.4	Low	61	Low	86 Å²	86	112.7 Å²	112.7	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-43.9	174.9	175.4	0	0	0	0	110.8	N22 L23 L28 Q29	N22-V25 PolarHBondContact O-N 2.78Å; L23-V25 VanDerWaalsContact C-N 3.29Å; L23-V25 PolarHBondContact O-N 3.29Å; V25-L28 PolarHBondContact O-N 2.77Å; V25-Q29 WeakPolarHBondContact O-CB 2.96Å; V25-Q29 PolarHBondContact O-N 3.41Å
26	L	59.8	Low	60.7	Low	105 Å²	105	112.5 Å²	112.5	55%	0.55	56%	0.557	S	S	.	*	H	α-helix	trans	-66.3	-40.6	176.7	-80.6	161.4	0	0	0	111.7	N22 L23 H30	N22-L26 HydrophobicContact CB-CD1 4.43Å; N22-L26 VanDerWaalsContact O-CB 3.3Å; N22-L26 WeakPolarHBondContact O-CB 3.06Å; N22-L26 WeakPolarHBondContact O-CG 3.26Å; N22-L26 PolarHBondContact O-N 2.9Å; L23-L26 PolarHBondContact O-N 3.15Å; L26-H30 WeakPolarHBondContact O-CB 3.22Å; L26-H30 PolarHBondContact O-N 3.26Å
27	T	60.2	Low	60.5	Low	63 Å²	63	110.9 Å²	110.9	39%	0.387	56%	0.555	S	S	.	*	H	α-helix	trans	-68.6	-44.3	174.5	53.5	0	0	0	0	110.8	L23 P24 Q29 H30 F31	L23-T27 WeakPolarHBondContact O-CB 3.36Å; L23-T27 WeakPolarHBondContact O-CG2 3.38Å; L23-T27 PolarHBondContact O-N 2.99Å; L23-T27 PolarHBondContact O-OG1 2.77Å; P24-T27 WeakPolarHBondContact CA-OG1 3.3Å; P24-T27 PolarHBondContact O-OG1 3.34Å; T27-Q29 VanDerWaalsContact C-N 3.31Å; T27-Q29 PolarHBondContact O-N 2.73Å; T27-H30 PolarHBondContact O-N 2.86Å; T27-F31 VanDerWaalsContact O-CB 3.27Å; T27-F31 WeakPolarHBondContact O-CB 3.35Å; T27-F31 WeakPolarHBondContact O-CD2 3.49Å; T27-F31 PolarHBondContact O-N 2.78Å
28	L	59.7	Low	60.1	Low	107 Å²	107	107.5 Å²	107.5	56%	0.56	56%	0.556	S	S	*	*	H	α-helix	trans	-61.1	-42	175.8	-137.2	86.4	0	0	0	111.5	P24 V25 F31 Q32	P24-L28 VanDerWaalsContact O-CB 3.26Å; P24-L28 WeakPolarHBondContact O-CB 3.43Å; P24-L28 PolarHBondContact O-N 3.25Å; V25-L28 PolarHBondContact O-N 2.77Å; L28-F31 CarbonylContact O-C 3.49Å; L28-F31 PolarHBondContact O-N 3.43Å; L28-Q32 WeakPolarHBondContact O-CB 3.4Å; L28-Q32 WeakPolarHBondContact O-CG 3.18Å; L28-Q32 PolarHBondContact O-N 2.94Å
29	Q	59.7	Low	59.8	Low	110 Å²	110	106.2 Å²	106.2	51%	0.514	56%	0.558	S	S	.	*	H	α-helix	trans	-70.6	-37.1	179	-164.7	174.2	14.1	0	0	111.2	V25 T27 F31 Q32 H33	V25-Q29 WeakPolarHBondContact O-CB 2.96Å; V25-Q29 PolarHBondContact O-N 3.41Å; T27-Q29 VanDerWaalsContact C-N 3.31Å; T27-Q29 PolarHBondContact O-N 2.73Å; Q29-F31 VanDerWaalsContact C-N 3.34Å; Q29-Q32 PolarHBondContact O-N 2.82Å; Q29-H33 VanDerWaalsContact O-CB 3.25Å; Q29-H33 WeakPolarHBondContact O-CB 3.49Å; Q29-H33 PolarHBondContact O-N 3.41Å
30	H	59.3	Low	59.8	Low	136 Å²	136	106.5 Å²	106.5	63%	0.63	56%	0.556	S	S	*	*	H	α-helix	trans	-66.1	-38	172.1	-158.4	72.5	0	0	0	111.1	L26 T27 M34	L26-H30 WeakPolarHBondContact O-CB 3.22Å; L26-H30 PolarHBondContact O-N 3.26Å; T27-H30 PolarHBondContact O-N 2.86Å; H30-M34 WeakPolarHBondContact O-CB 3.45Å; H30-M34 PolarHBondContact O-N 2.84Å
31	F	58	Low	59.7	Low	132 Å²	132	111.9 Å²	111.9	58%	0.579	57%	0.566	S	S	*	*	H	α-helix	trans	-73.1	-22.7	173	-84.3	-65.4	0	0	0	113.9	T27 L28 Q29 M34 I36	T27-F31 VanDerWaalsContact O-CB 3.27Å; T27-F31 WeakPolarHBondContact O-CB 3.35Å; T27-F31 WeakPolarHBondContact O-CD2 3.49Å; T27-F31 PolarHBondContact O-N 2.78Å; L28-F31 CarbonylContact O-C 3.49Å; L28-F31 PolarHBondContact O-N 3.43Å; Q29-F31 VanDerWaalsContact C-N 3.34Å; F31-M34 CarbonylContact C-O 3.59Å; F31-I36 HydrophobicContact CD1-CD1 3.53Å; F31-I36 HydrophobicContact CE1-CD1 3.74Å
32	Q	56.3	Low	59.7	Low	129 Å²	129	108.7 Å²	108.7	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-83.5	-36	172.9	-78.5	172	-4.6	0	0	111.4	L28 Q29	L28-Q32 WeakPolarHBondContact O-CB 3.4Å; L28-Q32 WeakPolarHBondContact O-CG 3.18Å; L28-Q32 PolarHBondContact O-N 2.94Å; Q29-Q32 PolarHBondContact O-N 2.82Å
33	H	58.8	Low	59.6	Low	163 Å²	163	111 Å²	111	76%	0.755	57%	0.565	S	S	*	*	H	α-helix	trans	-79.5	-35.6	179.6	-147.9	94.5	0	0	0	111.9	Q29 H35	Q29-H33 VanDerWaalsContact O-CB 3.25Å; Q29-H33 WeakPolarHBondContact O-CB 3.49Å; Q29-H33 PolarHBondContact O-N 3.41Å; H33-H35 PolarHBondContact O-N 3.33Å
34	M	56.4	Low	59.7	Low	116 Å²	116	111.2 Å²	111.2	57%	0.571	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	89.6	161	-157.1	176.5	-158.1	0	0	105.2	H30 F31 I36	H30-M34 WeakPolarHBondContact O-CB 3.45Å; H30-M34 PolarHBondContact O-N 2.84Å; F31-M34 CarbonylContact C-O 3.59Å; M34-I36 HydrophobicContact CB-CG1 4.38Å; M34-I36 HydrophobicContact CG-CG1 4.12Å; M34-I36 PolarHBondContact O-N 3.5Å; M34-I36 HydrophobicContact SD-CG1 4.46Å
35	H	58.3	Low	59.6	Low	163 Å²	163	117.1 Å²	117.1	76%	0.755	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	74.3	169.4	-99.2	-110.2	0	0	0	109	H33 K37	H33-H35 PolarHBondContact O-N 3.33Å; H35-K37 PolarHBondContact O-N 3.34Å
36	I	58.3	Low	59.6	Low	68 Å²	68	122.4 Å²	122.4	35%	0.349	59%	0.59	S	S	.	*			trans	-68.6	89.4	169.1	-60.6	-177.8	0	0	0	103.2	F31 M34 V38 D40 R41	F31-I36 HydrophobicContact CD1-CD1 3.53Å; F31-I36 HydrophobicContact CE1-CD1 3.74Å; M34-I36 HydrophobicContact CB-CG1 4.38Å; M34-I36 HydrophobicContact CG-CG1 4.12Å; M34-I36 PolarHBondContact O-N 3.5Å; M34-I36 HydrophobicContact SD-CG1 4.46Å; I36-V38 PolarHBondContact O-N 2.98Å; I36-D40 HydrophobicContact CG2-CB 4.46Å; I36-R41 HydrophobicContact CG2-CB 4.29Å
37	K	59.2	Low	59.7	Low	155 Å²	155	120 Å²	120	67%	0.674	59%	0.585	S	S	*	*			trans	-51	128.4	168.4	-74.3	179.8	177.7	175.7	0	104.9	H35 G39 D40	H35-K37 PolarHBondContact O-N 3.34Å; K37-G39 CarbonylContact O-C 3.59Å; K37-G39 PolarHBondContact O-N 3.21Å; K37-D40 PolarHBondContact O-N 2.88Å
38	V	55.3	Low	59.7	Low	127 Å²	127	124.2 Å²	124.2	77%	0.77	60%	0.598	S	S	*	*	H	α-helix	trans	-51.6	-23.7	-177.6	178.2	0	0	0	0	111.8	I36 R41 A42	I36-V38 PolarHBondContact O-N 2.98Å; V38-R41 PolarHBondContact O-N 2.94Å; V38-A42 PolarHBondContact O-N 3.01Å
39	G	57.6	Low	59.7	Low	45 Å²	45	123.4 Å²	123.4	46%	0.464	60%	0.598	S	S	.	*	H	α-helix	trans	-56.5	-45.3	168.2	0	0	0	0	0	115.4	K37 R41 A42 E43	K37-G39 CarbonylContact O-C 3.59Å; K37-G39 PolarHBondContact O-N 3.21Å; G39-R41 VanDerWaalsContact C-N 3.33Å; G39-R41 PolarHBondContact O-N 3.45Å; G39-A42 PolarHBondContact O-N 2.96Å; G39-A42 VanDerWaalsContact O-N 3.16Å; G39-E43 PolarHBondContact O-N 3.16Å
40	D	63.7	Low	59.5	Low	82 Å²	82	125.8 Å²	125.8	44%	0.439	61%	0.609	S	S	.	*	H	α-helix	trans	-66.8	-36.1	-179.2	-71.4	-5	0	0	0	111.4	I36 K37 A42 E43 L44	I36-D40 HydrophobicContact CG2-CB 4.46Å; K37-D40 PolarHBondContact O-N 2.88Å; D40-A42 VanDerWaalsContact C-N 3.33Å; D40-E43 PolarHBondContact O-N 3.14Å; D40-L44 WeakPolarHBondContact O-CB 3.26Å; D40-L44 VanDerWaalsContact O-CG 3.26Å; D40-L44 WeakPolarHBondContact O-CG 3.23Å; D40-L44 PolarHBondContact O-N 3.44Å
41	R	61.7	Low	59.2	Low	189 Å²	189	124.5 Å²	124.5	71%	0.713	61%	0.611	S	S	*	*	H	α-helix	trans	-67.6	-35.7	175.4	-170.5	176.1	-179.3	-174.9	0.6	111.5	I36 V38 G39 R45	I36-R41 HydrophobicContact CG2-CB 4.29Å; V38-R41 PolarHBondContact O-N 2.94Å; G39-R41 VanDerWaalsContact C-N 3.33Å; G39-R41 PolarHBondContact O-N 3.45Å; R41-R45 VanDerWaalsContact O-CB 3.25Å; R41-R45 WeakPolarHBondContact O-CB 3.26Å; R41-R45 PolarHBondContact O-N 3.49Å
42	A	61.4	Low	58.9	Low	53 Å²	53	125.3 Å²	125.3	44%	0.438	62%	0.622	S	S	.	*	H	α-helix	trans	-71.7	-36.7	175.2	0	0	0	0	0	111.9	V38 G39 D40 R46	V38-A42 PolarHBondContact O-N 3.01Å; G39-A42 PolarHBondContact O-N 2.96Å; G39-A42 VanDerWaalsContact O-N 3.16Å; D40-A42 VanDerWaalsContact C-N 3.33Å; A42-R46 WeakPolarHBondContact O-CB 3.22Å; A42-R46 PolarHBondContact O-N 3.29Å
43	E	60.2	Low	58.7	Low	135 Å²	135	125.3 Å²	125.3	63%	0.631	63%	0.63	S	S	*	*	H	α-helix	trans	-66.5	-46.4	172.8	-87.2	-173	167.5	0	0	112.5	G39 D40 R45 R46 A47	G39-E43 PolarHBondContact O-N 3.16Å; D40-E43 PolarHBondContact O-N 3.14Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.02Å; E43-R46 PolarHBondContact O-N 3.04Å; E43-A47 WeakPolarHBondContact O-CB 3.43Å; E43-A47 PolarHBondContact O-N 3.21Å
44	L	65.2	Low	58.1	Low	103 Å²	103	125.7 Å²	125.7	54%	0.539	66%	0.661	S	S	.	*	H	α-helix	trans	-58.9	-45.9	174	-73.9	171.3	0	0	0	110.5	D40 R46 A47 F48	D40-L44 WeakPolarHBondContact O-CB 3.26Å; D40-L44 VanDerWaalsContact O-CG 3.26Å; D40-L44 WeakPolarHBondContact O-CG 3.23Å; D40-L44 PolarHBondContact O-N 3.44Å; L44-R46 VanDerWaalsContact C-N 3.34Å; L44-R46 PolarHBondContact O-N 3.37Å; L44-A47 PolarHBondContact O-N 3.42Å; L44-F48 VanDerWaalsContact O-CD2 3.27Å; L44-F48 WeakPolarHBondContact O-CD2 3.14Å; L44-F48 PolarHBondContact O-N 3.41Å
45	R	62.2	Low	58.1	Low	192 Å²	192	126.2 Å²	126.2	73%	0.725	67%	0.666	S	S	*	*	H	α-helix	trans	-62.3	-41.8	178.1	-157.1	173	178.1	-167.9	-1.8	111.2	R41 E43 T49	R41-R45 VanDerWaalsContact O-CB 3.25Å; R41-R45 WeakPolarHBondContact O-CB 3.26Å; R41-R45 PolarHBondContact O-N 3.49Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.02Å; R45-T49 WeakPolarHBondContact O-CB 3.26Å; R45-T49 PolarHBondContact O-N 3.06Å; R45-T49 PolarHBondContact O-OG1 3.46Å
46	R	61.2	Low	58.1	Low	198 Å²	198	124.2 Å²	124.2	75%	0.747	66%	0.661	S	S	*	*	H	α-helix	trans	-61.5	-48.1	172.7	-86.4	-176.1	175.8	176.6	-0.4	112.5	A42 E43 L44 F48 T49 Q50	A42-R46 WeakPolarHBondContact O-CB 3.22Å; A42-R46 PolarHBondContact O-N 3.29Å; E43-R46 PolarHBondContact O-N 3.04Å; L44-R46 VanDerWaalsContact C-N 3.34Å; L44-R46 PolarHBondContact O-N 3.37Å; R46-F48 VanDerWaalsContact C-N 3.29Å; R46-F48 PolarHBondContact O-N 2.97Å; R46-T49 PolarHBondContact O-N 3.03Å; R46-T49 VanDerWaalsContact O-N 3.15Å; R46-Q50 WeakPolarHBondContact O-CB 3.32Å; R46-Q50 PolarHBondContact O-N 2.94Å
47	A	61.1	Low	58.1	Low	54 Å²	54	127.3 Å²	127.3	45%	0.446	68%	0.678	S	S	.	*	H	α-helix	trans	-57.7	-43.4	179.8	0	0	0	0	0	111.5	E43 L44 Q50 T51	E43-A47 WeakPolarHBondContact O-CB 3.43Å; E43-A47 PolarHBondContact O-N 3.21Å; L44-A47 PolarHBondContact O-N 3.42Å; A47-Q50 PolarHBondContact O-N 2.7Å; A47-T51 PolarHBondContact O-N 2.97Å; A47-T51 PolarHBondContact O-OG1 2.78Å
48	F	60.1	Low	58.1	Low	151 Å²	151	125.7 Å²	125.7	66%	0.662	68%	0.679	S	S	*	*	H	α-helix	trans	-72.9	-31.9	176.9	-85.2	-80.7	0	0	0	113.8	L44 R46 Q50 T51	L44-F48 VanDerWaalsContact O-CD2 3.27Å; L44-F48 WeakPolarHBondContact O-CD2 3.14Å; L44-F48 PolarHBondContact O-N 3.41Å; R46-F48 VanDerWaalsContact C-N 3.29Å; R46-F48 PolarHBondContact O-N 2.97Å; F48-Q50 VanDerWaalsContact C-N 3.31Å; F48-T51 PolarHBondContact O-OG1 3.21Å; F48-T51 VanDerWaalsContact O-OG1 3.06Å
49	T	59.2	Low	58.2	Low	91 Å²	91	125.6 Å²	125.6	56%	0.558	67%	0.673	S	S	*	*	H	α-helix	trans	-75	-24.8	176.3	-37.8	0	0	0	0	111.6	R45 R46	R45-T49 WeakPolarHBondContact O-CB 3.26Å; R45-T49 PolarHBondContact O-N 3.06Å; R45-T49 PolarHBondContact O-OG1 3.46Å; R46-T49 PolarHBondContact O-N 3.03Å; R46-T49 VanDerWaalsContact O-N 3.15Å
50	Q	55.8	Low	58.3	Low	159 Å²	159	131 Å²	131	74%	0.743	69%	0.687	S	S	*	*	H	α-helix	trans	-82.2	-20.5	-178.8	-161.8	170.2	7.5	0	0	113	R46 A47 F48	R46-Q50 WeakPolarHBondContact O-CB 3.32Å; R46-Q50 PolarHBondContact O-N 2.94Å; A47-Q50 PolarHBondContact O-N 2.7Å; F48-Q50 VanDerWaalsContact C-N 3.31Å
51	T	54.3	Low	57.9	Low	109 Å²	109	134.5 Å²	134.5	67%	0.669	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-6.6	175.1	38.6	0	0	0	0	114.7	A47 F48	A47-T51 PolarHBondContact O-N 2.97Å; A47-T51 PolarHBondContact O-OG1 2.78Å; F48-T51 PolarHBondContact O-OG1 3.21Å; F48-T51 VanDerWaalsContact O-OG1 3.06Å
52	D	50.6	Low	57.6	Low	150 Å²	150	130.3 Å²	130.3	80%	0.802	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	23.3	-177.2	-133.7	-1.5	0	0	0	112.5
53	V	51.1	Low	57.3	Low	128 Å²	128	136.8 Å²	136.8	78%	0.776	73%	0.726	S	S	*	*			trans	-125.3	78.3	166.1	-174	0	0	0	0	107.5
54	A	46.6	Very low	57	Low	171 Å²	171	136.9 Å²	136.9	100%	1.413	74%	0.735	S	S	*	*			trans	-126.1	0	161.4	0	0	0	0	0	108.4

Retrieved 54 of 54 residues in 15.2 ms (Link to these results)

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