A0A087WUW1_HUMAN Loading...

Hydroxyacyl-thioester dehydratase type 2

AlphaFold DB , UniProt , Accession A0A087WUW1, Species HUMAN (Homo sapiens, Human), Gene HTD2, Length 71 aa.

						>A0A087WUW1_HUMAN|A0A087WUW1|HTD2
MFPLISSHHLWWGGLRRTVCLNLPVLTLQHFQHMHIKVGDRAELRRAFTQTDVATFSELTGDVNPLHLNED
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.4	Very low	48.5	Very low	242 Å²	242	162.9 Å²	162.9	100%	1.192	83%	0.827	S	S	*	*				0	112.9	0	-87.3	138.4	66.3	0	0	108
2	F	41.8	Very low	47.9	Very low	196 Å²	196	169.7 Å²	169.7	86%	0.86	84%	0.835	S	S	*	*			trans	-83	151.3	163.9	-71.1	-81	0	0	0	109.1
3	P	49.6	Very low	47.7	Very low	119 Å²	119	161.5 Å²	161.5	77%	0.773	82%	0.821	S	S	*	*				-126.4	136.1	112.2	34.6	-24.9	0	0	0	108.6
4	L	49.1	Very low	47.9	Very low	148 Å²	148	155.1 Å²	155.1	78%	0.775	82%	0.815	S	S	*	*			cis	55.3	127.3	48.8	-93	160.3	0	0	0	114.1
5	I	46.9	Very low	48.2	Very low	167 Å²	167	155.8 Å²	155.8	86%	0.856	82%	0.819	S	S	*	*			trans	91.3	124.2	179.3	-46.7	158.3	0	0	0	112.3
6	S	44	Very low	48.1	Very low	85 Å²	85	160.1 Å²	160.1	59%	0.594	82%	0.82	S	S	*	*			cis	-162.3	131.6	-5.5	174.6	0	0	0	0	107.5	H8	S6-H8 PolarHBondContact O-N 3.07Å; S6-H8 PolarHBondContact OG-CD2 3.2Å
7	S	54.3	Low	48	Very low	121 Å²	121	164.8 Å²	164.8	85%	0.846	83%	0.825	S	S	*	*			trans	-84.9	106.7	175.2	-82.5	0	0	0	0	109.8
8	H	48	Very low	48.2	Very low	142 Å²	142	161.9 Å²	161.9	66%	0.657	82%	0.818	S	S	*	*			trans	-136.5	110.7	162.9	-74.8	-66	0	0	0	111.3	S6	S6-H8 PolarHBondContact O-N 3.07Å; S6-H8 PolarHBondContact OG-CD2 3.2Å
9	H	57.1	Low	48.3	Very low	162 Å²	162	159.1 Å²	159.1	75%	0.75	81%	0.809	S	S	*	*			trans	48.2	118.7	149.2	-54.9	-79.8	0	0	0	118.4
10	L	52.6	Low	48.5	Very low	163 Å²	163	156.1 Å²	156.1	85%	0.853	80%	0.803	S	S	*	*				-159.3	96.5	119.1	-96	157	0	0	0	108	W12	L10-W12 PolarHBondContact O-N 2.62Å; L10-W12 VanDerWaalsContact O-N 3.17Å
11	W	48.2	Very low	48.5	Very low	247 Å²	247	155.2 Å²	155.2	94%	0.936	80%	0.799	S	S	*	*			trans	-73.8	96	176.3	-153.7	45.6	0	0	0	107.6	G13	W11-G13 PolarHBondContact O-N 2.77Å
12	W	42.3	Very low	49.4	Very low	244 Å²	244	151 Å²	151	92%	0.924	78%	0.781	S	S	*	*			trans	-85.9	77.3	163	-83.8	-12.7	0	0	0	108.7	L10 G14	L10-W12 PolarHBondContact O-N 2.62Å; L10-W12 VanDerWaalsContact O-N 3.17Å; W12-G14 PolarHBondContact O-N 2.77Å; W12-G14 VanDerWaalsContact O-N 3.07Å
13	G	45.3	Very low	50	Low	64 Å²	64	147.3 Å²	147.3	66%	0.66	77%	0.769	S	S	*	*			trans	-62.3	103.8	166	0	0	0	0	0	109.4	W11	W11-G13 PolarHBondContact O-N 2.77Å
14	G	49.7	Very low	50	Low	71 Å²	71	146.7 Å²	146.7	73%	0.732	77%	0.765	S	S	*	*			trans	-70.2	137.4	174.6	0	0	0	0	0	112.7	W12	W12-G14 PolarHBondContact O-N 2.77Å; W12-G14 VanDerWaalsContact O-N 3.07Å
15	L	52.5	Low	50.2	Low	166 Å²	166	146.5 Å²	146.5	87%	0.869	77%	0.77	S	S	*	*			trans	61.6	108.4	142.1	-145	77.2	0	0	0	119.4
16	R	47.5	Very low	50.4	Low	224 Å²	224	146.4 Å²	146.4	85%	0.845	77%	0.771	S	S	*	*				-177.2	92.3	118.2	-99.9	169.1	179.4	-110.3	1.2	110.1	T18	R16-T18 PolarHBondContact O-N 3.49Å
17	R	45.7	Very low	51	Low	240 Å²	240	147 Å²	147	91%	0.906	77%	0.77	S	S	*	*			trans	-81.8	101	155.8	-88.5	-176.1	168.9	175.4	-3.3	106.9	V19	R17-V19 VanDerWaalsContact C-N 3.34Å; R17-V19 PolarHBondContact O-N 2.86Å
18	T	51.1	Low	50.9	Low	113 Å²	113	148.3 Å²	148.3	69%	0.693	77%	0.768	S	S	*	*			trans	-69.2	93.9	170.2	-33.8	0	0	0	0	107.3	R16 C20	R16-T18 PolarHBondContact O-N 3.49Å; T18-C20 PolarHBondContact O-N 2.86Å
19	V	50.4	Low	51.3	Low	108 Å²	108	149.3 Å²	149.3	66%	0.655	77%	0.773	S	S	*	*			trans	-79.3	97.6	166.9	-171.6	0	0	0	0	105.8	R17 L21	R17-V19 VanDerWaalsContact C-N 3.34Å; R17-V19 PolarHBondContact O-N 2.86Å; V19-L21 HydrophobicContact CG1-CD1 4.49Å; V19-L21 HydrophobicContact CG1-CD2 3.7Å; V19-L21 HydrophobicContact CG1-CG 3.7Å; V19-L21 PolarHBondContact O-N 3.13Å
20	C	53.1	Low	51.2	Low	100 Å²	100	147.3 Å²	147.3	68%	0.676	76%	0.763	S	S	*	*			trans	-69.2	86.5	167.3	-66	0	0	0	0	108.2	T18 N22	T18-C20 PolarHBondContact O-N 2.86Å; C20-N22 VanDerWaalsContact C-N 3.27Å; C20-N22 PolarHBondContact O-N 2.83Å; C20-N22 VanDerWaalsContact O-N 3.08Å
21	L	48.5	Very low	51.6	Low	138 Å²	138	146.5 Å²	146.5	72%	0.723	75%	0.753	S	S	*	*			trans	-78.6	80.9	167.6	-66.1	173.7	0	0	0	108.4	V19 L23	V19-L21 HydrophobicContact CG1-CD1 4.49Å; V19-L21 HydrophobicContact CG1-CD2 3.7Å; V19-L21 HydrophobicContact CG1-CG 3.7Å; V19-L21 PolarHBondContact O-N 3.13Å; L21-L23 PolarHBondContact O-N 2.85Å; L21-L23 VanDerWaalsContact O-N 3.13Å
22	N	59.2	Low	52.2	Low	153 Å²	153	142.3 Å²	142.3	82%	0.818	74%	0.744	S	S	*	*			trans	-79.1	77	155.8	-73	-53.2	0	0	0	107.5	C20	C20-N22 VanDerWaalsContact C-N 3.27Å; C20-N22 PolarHBondContact O-N 2.83Å; C20-N22 VanDerWaalsContact O-N 3.08Å
23	L	55.2	Low	53.2	Low	118 Å²	118	138 Å²	138	62%	0.618	73%	0.734	S	S	*	*			trans	-95.7	119.4	166.6	-140.8	76.1	0	0	0	107.2	L21 V25	L21-L23 PolarHBondContact O-N 2.85Å; L21-L23 VanDerWaalsContact O-N 3.13Å; L23-V25 PolarHBondContact O-N 2.85Å
24	P	48.9	Very low	54.2	Low	106 Å²	106	141.5 Å²	141.5	69%	0.688	74%	0.735	S	S	*	*			trans	-63.4	132.6	-178.6	24.6	-30.2	0	0	0	109.8	L26	P24-L26 PolarHBondContact O-N 2.66Å
25	V	54.2	Low	55.7	Low	144 Å²	144	145.5 Å²	145.5	87%	0.873	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	70.4	179.7	178	0	0	0	0	112.4	L23	L23-V25 PolarHBondContact O-N 2.85Å
26	L	51.2	Low	57.4	Low	166 Å²	166	144.2 Å²	144.2	87%	0.869	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.7	-14.1	168.5	-72.1	179.7	0	0	0	113.2	P24	P24-L26 PolarHBondContact O-N 2.66Å
27	T	55.7	Low	59.6	Low	96 Å²	96	140.6 Å²	140.6	59%	0.589	72%	0.717	S	S	*	*	S	Bend	trans	-86.3	124.9	173.7	51.3	0	0	0	0	109.5
28	L	52.6	Low	61.9	Low	150 Å²	150	136.8 Å²	136.8	79%	0.785	72%	0.72	S	S	*	*			trans	84.3	55.2	176.5	-112.9	92.1	0	0	0	116.5	H30	L28-H30 HydrophobicContact CD2-CB 3.92Å; L28-H30 HydrophobicContact CG-CB 4.05Å; L28-H30 PolarHBondContact O-N 2.79Å
29	Q	56	Low	64	Low	163 Å²	163	135 Å²	135	76%	0.762	72%	0.724	S	S	*	*				-66.5	78.8	129.8	-74.8	-173.8	-17.4	0	0	106.4	F31	Q29-F31 HydrophobicContact CB-CE2 4.43Å; Q29-F31 WeakPolarHBondContact O-CD2 3.39Å; Q29-F31 PolarHBondContact O-N 3.22Å
30	H	55.9	Low	66.1	Low	119 Å²	119	134.6 Å²	134.6	55%	0.551	72%	0.718	S	S	*	*			trans	-58.6	95.6	163.2	-174.5	-87.4	0	0	0	104.2	L28 Q32	L28-H30 HydrophobicContact CD2-CB 3.92Å; L28-H30 HydrophobicContact CG-CB 4.05Å; L28-H30 PolarHBondContact O-N 2.79Å; H30-Q32 VanDerWaalsContact ND1-CG 3.34Å; H30-Q32 WeakPolarHBondContact ND1-CG 3.4Å; H30-Q32 PolarHBondContact O-N 2.99Å
31	F	60.1	Low	68.1	Low	146 Å²	146	139.9 Å²	139.9	64%	0.64	72%	0.724	S	S	*	*			trans	-60	82.8	164.9	-75	-86.1	0	0	0	104.8	Q29 H33 M34	Q29-F31 HydrophobicContact CB-CE2 4.43Å; Q29-F31 WeakPolarHBondContact O-CD2 3.39Å; Q29-F31 PolarHBondContact O-N 3.22Å; F31-H33 VanDerWaalsContact C-N 3.32Å; F31-H33 PolarHBondContact O-N 2.87Å; F31-M34 HydrophobicContact CD1-SD 4.1Å; F31-M34 HydrophobicContact CE1-SD 4.45Å
32	Q	61.1	Low	70.2	Confident	159 Å²	159	138 Å²	138	74%	0.743	73%	0.729	S	S	*	*			trans	-51.3	108.3	168.2	-72.9	-177.2	-19.2	0	0	103.8	H30 M34	H30-Q32 VanDerWaalsContact ND1-CG 3.34Å; H30-Q32 WeakPolarHBondContact ND1-CG 3.4Å; H30-Q32 PolarHBondContact O-N 2.99Å; Q32-M34 PolarHBondContact O-N 3.13Å
33	H	62.5	Low	72	Confident	154 Å²	154	137 Å²	137	71%	0.713	72%	0.719	S	S	*	*			trans	-8.4	88.5	-175.5	-65.8	91.1	0	0	0	112	F31 H35	F31-H33 VanDerWaalsContact C-N 3.32Å; F31-H33 PolarHBondContact O-N 2.87Å; H33-H35 VanDerWaalsContact C-N 3.35Å; H33-H35 PolarHBondContact O-CD2 2.99Å; H33-H35 PolarHBondContact O-N 3.15Å
34	M	68	Low	73.9	Confident	138 Å²	138	139.4 Å²	139.4	68%	0.68	73%	0.731	S	S	*	*			trans	-63.8	106.6	176	-88.7	-170.6	70.3	0	0	105.7	F31 Q32 I36	F31-M34 HydrophobicContact CD1-SD 4.1Å; F31-M34 HydrophobicContact CE1-SD 4.45Å; Q32-M34 PolarHBondContact O-N 3.13Å; M34-I36 PolarHBondContact O-N 3.13Å
35	H	79.8	Confident	76.2	Confident	155 Å²	155	145.1 Å²	145.1	72%	0.718	74%	0.739	S	S	*	*			trans	-73.4	82	178.5	-69.9	-82.2	0	0	0	108.4	H33 K37	H33-H35 VanDerWaalsContact C-N 3.35Å; H33-H35 PolarHBondContact O-CD2 2.99Å; H33-H35 PolarHBondContact O-N 3.15Å; H35-K37 PolarHBondContact O-N 3.16Å
36	I	89.1	Confident	78.3	Confident	138 Å²	138	146 Å²	146	71%	0.708	73%	0.727	S	S	*	*			trans	-66.3	128	172.5	-59.1	172.8	0	0	0	108.1	M34 D40	M34-I36 PolarHBondContact O-N 3.13Å; I36-D40 WeakPolarHBondContact CA-OD2 3.39Å; I36-D40 HydrophobicContact CG2-CB 4.31Å
37	K	92.6	Very high	80.5	Confident	149 Å²	149	142.2 Å²	142.2	65%	0.648	72%	0.719	S	S	*	*			trans	-119.3	162	-179.5	-65.1	177.1	-174.1	177.7	0	110.8	H35 G39 D40	H35-K37 PolarHBondContact O-N 3.16Å; K37-G39 PolarHBondContact O-N 3.02Å; K37-D40 PolarHBondContact N-OD2 3.5Å; K37-D40 WeakPolarHBondContact O-CB 3.34Å; K37-D40 PolarHBondContact O-N 3.17Å
38	V	94.1	Very high	82.4	Confident	159 Å²	159	145 Å²	145	96%	0.964	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	122.7	173.6	177.7	0	0	0	0	108.9
39	G	95.9	Very high	84.5	Confident	76 Å²	76	141.4 Å²	141.4	78%	0.784	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	104	-11.9	-177.3	0	0	0	0	0	114.5	K37	K37-G39 PolarHBondContact O-N 3.02Å
40	D	94.4	Very high	86.4	Confident	100 Å²	100	138.2 Å²	138.2	54%	0.535	69%	0.693	S	S	.	*			trans	-67.5	140.1	175.5	-69	-8.3	0	0	0	111	I36 K37	I36-D40 WeakPolarHBondContact CA-OD2 3.39Å; I36-D40 HydrophobicContact CG2-CB 4.31Å; K37-D40 PolarHBondContact N-OD2 3.5Å; K37-D40 WeakPolarHBondContact O-CB 3.34Å; K37-D40 PolarHBondContact O-N 3.17Å
41	R	94.8	Very high	88.3	Confident	211 Å²	211	137.3 Å²	137.3	80%	0.796	70%	0.696	S	S	*	*			trans	-138.2	137.9	178.4	-178.1	175	175.6	160.7	-0.3	109.7	E43	R41-E43 IonicContact CZ-OE1 3.02Å; R41-E43 IonicContact NE-OE1 2.77Å; R41-E43 PolarHBondContact NE-OE1 3.39Å; R41-E43 IonicContact NH2-OE1 2.62Å; R41-E43 PolarHBondContact NH2-OE1 3.26Å
42	A	92.7	Very high	90.1	Very high	99 Å²	99	132.3 Å²	132.3	82%	0.818	68%	0.676	S	S	*	*			trans	-128.7	146.6	171.3	0	0	0	0	0	109.3
43	E	96.3	Very high	91.8	Very high	131 Å²	131	126.8 Å²	126.8	61%	0.612	65%	0.653	S	S	*	*			trans	-134.6	139.5	178	-64.2	-174.3	177.8	0	0	110.1	R41	R41-E43 IonicContact CZ-OE1 3.02Å; R41-E43 IonicContact NE-OE1 2.77Å; R41-E43 PolarHBondContact NE-OE1 3.39Å; R41-E43 IonicContact NH2-OE1 2.62Å; R41-E43 PolarHBondContact NH2-OE1 3.26Å
44	L	96.9	Very high	93.4	Very high	169 Å²	169	121.7 Å²	121.7	89%	0.885	64%	0.637	S	S	*	*			trans	-123.7	131.2	167	-179	64.6	0	0	0	107.9
45	R	97.3	Very high	94.8	Very high	226 Å²	226	118 Å²	118	85%	0.853	62%	0.623	S	S	*	*			trans	-116.9	130.6	177.5	-59.8	-179.9	77.4	-179.3	4.2	108.7
46	R	96.4	Very high	95.6	Very high	162 Å²	162	116.1 Å²	116.1	61%	0.611	61%	0.613	S	S	*	*			trans	-140.5	138.5	172.4	175.5	175.1	173.1	180	-2.7	108	D52	R46-D52 IonicContact CZ-OD1 3.89Å; R46-D52 IonicContact NH2-OD1 2.72Å; R46-D52 PolarHBondContact NH2-OD1 3.4Å; R46-D52 IonicContact NH2-OD2 3.58Å
47	A	97.8	Very high	96.1	Very high	86 Å²	86	109.9 Å²	109.9	71%	0.711	58%	0.581	S	S	*	*			trans	-86.8	128.8	167.2	0	0	0	0	0	108.4
48	F	96.3	Very high	96.3	Very high	156 Å²	156	110.7 Å²	110.7	68%	0.684	59%	0.587	S	S	*	*			trans	-86.8	140.1	173	-72.2	-85.5	0	0	0	109.8	D52	F48-D52 HydrophobicContact CD1-CB 3.89Å
49	T	96.3	Very high	96.5	Very high	74 Å²	74	109.9 Å²	109.9	45%	0.454	58%	0.577	S	S	.	*			trans	-106	166.8	177.4	64.1	0	0	0	0	110.4	T51 D52 V53	T49-T51 PolarHBondContact O-N 3.23Å; T49-D52 PolarHBondContact N-OD2 2.91Å; T49-D52 WeakPolarHBondContact O-CB 3.29Å; T49-D52 PolarHBondContact O-N 2.83Å; T49-D52 PolarHBondContact OG1-N 3.47Å; T49-D52 PolarHBondContact OG1-OD2 2.72Å; T49-V53 PolarHBondContact O-N 2.88Å
50	Q	95.4	Very high	96.6	Very high	95 Å²	95	109.8 Å²	109.8	44%	0.444	56%	0.561	S	S	.	*	H	α-helix	trans	-59.6	-33.4	175.1	-166.9	58.1	26	0	0	112.3	D52 V53 A54 H67	Q50-D52 VanDerWaalsContact C-N 3.31Å; Q50-D52 PolarHBondContact O-N 3.22Å; Q50-V53 PolarHBondContact O-N 3.43Å; Q50-A54 PolarHBondContact O-N 3.48Å; Q50-H67 PolarHBondContact NE2-O 3.48Å; Q50-H67 VanDerWaalsContact NE2-O 3.16Å
51	T	96.6	Very high	96.8	Very high	100 Å²	100	107.6 Å²	107.6	61%	0.613	56%	0.562	S	S	*	*	H	α-helix	trans	-62.3	-38.3	174.6	-51.3	0	0	0	0	112	T49 V53 A54 T55	T49-T51 PolarHBondContact O-N 3.23Å; T51-V53 VanDerWaalsContact C-N 3.33Å; T51-A54 PolarHBondContact O-N 3.47Å; T51-T55 WeakPolarHBondContact O-CB 3.41Å; T51-T55 PolarHBondContact O-N 3.49Å; T51-T55 PolarHBondContact O-OG1 2.72Å
52	D	97.8	Very high	96.8	Very high	41 Å²	41	100.7 Å²	100.7	22%	0.219	54%	0.541	C	S	.	.	H	α-helix	trans	-65.7	-39.4	176.8	-60.8	-57.2	0	0	0	111	R46 F48 T49 Q50 T55 F56	R46-D52 IonicContact CZ-OD1 3.89Å; R46-D52 IonicContact NH2-OD1 2.72Å; R46-D52 PolarHBondContact NH2-OD1 3.4Å; R46-D52 IonicContact NH2-OD2 3.58Å; F48-D52 HydrophobicContact CD1-CB 3.89Å; T49-D52 PolarHBondContact N-OD2 2.91Å; T49-D52 WeakPolarHBondContact O-CB 3.29Å; T49-D52 PolarHBondContact O-N 2.83Å; T49-D52 PolarHBondContact OG1-N 3.47Å; T49-D52 PolarHBondContact OG1-OD2 2.72Å; Q50-D52 VanDerWaalsContact C-N 3.31Å; Q50-D52 PolarHBondContact O-N 3.22Å; D52-T55 PolarHBondContact O-N 3.03Å; D52-F56 WeakPolarHBondContact O-CB 3.43Å; D52-F56 PolarHBondContact O-N 2.97Å
53	V	96.5	Very high	97	Very high	44 Å²	44	100.9 Å²	100.9	27%	0.267	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-47.9	176.3	179.3	0	0	0	0	110.8	T49 Q50 T51 T55 F56 S57 H67	T49-V53 PolarHBondContact O-N 2.88Å; Q50-V53 PolarHBondContact O-N 3.43Å; T51-V53 VanDerWaalsContact C-N 3.33Å; V53-T55 VanDerWaalsContact C-N 3.32Å; V53-T55 PolarHBondContact O-N 3.07Å; V53-F56 WeakPolarHBondContact O-CB 3.44Å; V53-F56 PolarHBondContact O-N 2.73Å; V53-S57 PolarHBondContact O-N 3.21Å; V53-S57 PolarHBondContact O-OG 3.3Å; V53-H67 HydrophobicContact CG1-CB 3.92Å; V53-H67 WeakPolarHBondContact CG1-O 3.34Å
54	A	96.1	Very high	96.9	Very high	46 Å²	46	97.9 Å²	97.9	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-60.1	-42.2	176.9	0	0	0	0	0	112	Q50 T51 F56 S57 E58	Q50-A54 PolarHBondContact O-N 3.48Å; T51-A54 PolarHBondContact O-N 3.47Å; A54-F56 VanDerWaalsContact C-N 3.34Å; A54-F56 PolarHBondContact O-N 3.49Å; A54-S57 PolarHBondContact O-N 3.03Å; A54-E58 PolarHBondContact O-N 3.33Å
55	T	97.8	Very high	96.8	Very high	61 Å²	61	93.5 Å²	93.5	37%	0.374	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-41	176.6	-56.4	0	0	0	0	111.2	T51 D52 V53 E58 L59	T51-T55 WeakPolarHBondContact O-CB 3.41Å; T51-T55 PolarHBondContact O-N 3.49Å; T51-T55 PolarHBondContact O-OG1 2.72Å; D52-T55 PolarHBondContact O-N 3.03Å; V53-T55 VanDerWaalsContact C-N 3.32Å; V53-T55 PolarHBondContact O-N 3.07Å; T55-E58 PolarHBondContact O-N 3.48Å; T55-L59 HydrophobicContact CG2-CD1 3.94Å; T55-L59 HydrophobicContact CG2-CG 4.34Å; T55-L59 WeakPolarHBondContact O-CB 3.29Å; T55-L59 VanDerWaalsContact O-CG 3.27Å; T55-L59 WeakPolarHBondContact O-CG 3.42Å; T55-L59 PolarHBondContact O-N 2.85Å
56	F	97.7	Very high	96.6	Very high	116 Å²	116	89.3 Å²	89.3	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-44.4	175.9	177.5	-90.8	0	0	0	111.8	D52 V53 A54 E58 L59 T60	D52-F56 WeakPolarHBondContact O-CB 3.43Å; D52-F56 PolarHBondContact O-N 2.97Å; V53-F56 WeakPolarHBondContact O-CB 3.44Å; V53-F56 PolarHBondContact O-N 2.73Å; A54-F56 VanDerWaalsContact C-N 3.34Å; A54-F56 PolarHBondContact O-N 3.49Å; F56-E58 PolarHBondContact O-N 2.94Å; F56-L59 PolarHBondContact O-N 3.36Å; F56-T60 HydrophobicContact CD1-CG2 4.38Å; F56-T60 HydrophobicContact CD2-CG2 4.06Å; F56-T60 HydrophobicContact CE1-CG2 4.05Å; F56-T60 HydrophobicContact CE2-CG2 3.72Å; F56-T60 HydrophobicContact CG-CG2 4.39Å; F56-T60 HydrophobicContact CZ-CG2 3.72Å; F56-T60 WeakPolarHBondContact O-CB 3.45Å; F56-T60 WeakPolarHBondContact O-CG2 3.4Å; F56-T60 PolarHBondContact O-N 2.98Å; F56-T60 PolarHBondContact O-OG1 2.72Å
57	S	97.8	Very high	96.4	Very high	6 Å²	6	85.1 Å²	85.1	4%	0.042	48%	0.483	C	S	.	.	H	α-helix	trans	-60.2	-43.6	175.7	-71.4	0	0	0	0	112.4	V53 A54 G61 D62	V53-S57 PolarHBondContact O-N 3.21Å; V53-S57 PolarHBondContact O-OG 3.3Å; A54-S57 PolarHBondContact O-N 3.03Å; S57-G61 VanDerWaalsContact O-CA 3.29Å; S57-G61 WeakPolarHBondContact O-CA 3.09Å; S57-G61 PolarHBondContact O-N 2.93Å; S57-D62 WeakPolarHBondContact CA-O 3.29Å; S57-D62 WeakPolarHBondContact CB-O 3.38Å; S57-D62 PolarHBondContact O-N 2.74Å; S57-D62 PolarHBondContact OG-O 3.08Å
58	E	97.8	Very high	95.9	Very high	166 Å²	166	84 Å²	84	78%	0.776	46%	0.464	S	S	*	.	H	α-helix	trans	-62.7	-44.7	176.4	-174.2	-179.6	-176.2	0	0	112	A54 T55 F56	A54-E58 PolarHBondContact O-N 3.33Å; T55-E58 PolarHBondContact O-N 3.48Å; F56-E58 PolarHBondContact O-N 2.94Å
59	L	98.4	Very high	95.2	Very high	142 Å²	142	81.5 Å²	81.5	74%	0.743	46%	0.458	S	S	*	.	H	α-helix	trans	-69.5	-34.4	-177.6	-72.2	174.4	0	0	0	113.4	T55 F56	T55-L59 HydrophobicContact CG2-CD1 3.94Å; T55-L59 HydrophobicContact CG2-CG 4.34Å; T55-L59 WeakPolarHBondContact O-CB 3.29Å; T55-L59 VanDerWaalsContact O-CG 3.27Å; T55-L59 WeakPolarHBondContact O-CG 3.42Å; T55-L59 PolarHBondContact O-N 2.85Å; F56-L59 PolarHBondContact O-N 3.36Å
60	T	98	Very high	94	Very high	75 Å²	75	86.4 Å²	86.4	46%	0.46	48%	0.476	S	S	.	.	H	α-helix	trans	-98.7	-19.7	-174.4	60.2	0	0	0	0	113.4	F56 D62	F56-T60 HydrophobicContact CD1-CG2 4.38Å; F56-T60 HydrophobicContact CD2-CG2 4.06Å; F56-T60 HydrophobicContact CE1-CG2 4.05Å; F56-T60 HydrophobicContact CE2-CG2 3.72Å; F56-T60 HydrophobicContact CG-CG2 4.39Å; F56-T60 HydrophobicContact CZ-CG2 3.72Å; F56-T60 WeakPolarHBondContact O-CB 3.45Å; F56-T60 WeakPolarHBondContact O-CG2 3.4Å; F56-T60 PolarHBondContact O-N 2.98Å; F56-T60 PolarHBondContact O-OG1 2.72Å; T60-D62 PolarHBondContact O-N 3.34Å; T60-D62 WeakPolarHBondContact OG1-CB 3.35Å; T60-D62 PolarHBondContact OG1-N 3.13Å
61	G	97.3	Very high	92.7	Very high	54 Å²	54	92.6 Å²	92.6	56%	0.557	51%	0.512	S	S	*	.			trans	75.6	4.7	-168.3	0	0	0	0	0	113.7	S57 V63	S57-G61 VanDerWaalsContact O-CA 3.29Å; S57-G61 WeakPolarHBondContact O-CA 3.09Å; S57-G61 PolarHBondContact O-N 2.93Å; G61-V63 PolarHBondContact O-N 2.93Å
62	D	96.3	Very high	92.5	Very high	66 Å²	66	92.2 Å²	92.2	35%	0.353	51%	0.507	S	S	.	.			trans	-76.7	93.3	174.8	-171.9	-6.1	0	0	0	110.5	S57 T60 N64	S57-D62 WeakPolarHBondContact CA-O 3.29Å; S57-D62 WeakPolarHBondContact CB-O 3.38Å; S57-D62 PolarHBondContact O-N 2.74Å; S57-D62 PolarHBondContact OG-O 3.08Å; T60-D62 PolarHBondContact O-N 3.34Å; T60-D62 WeakPolarHBondContact OG1-CB 3.35Å; T60-D62 PolarHBondContact OG1-N 3.13Å; D62-N64 VanDerWaalsContact OD1-CB 3.29Å; D62-N64 WeakPolarHBondContact OD1-CB 3.41Å; D62-N64 PolarHBondContact OD1-N 3.2Å; D62-N64 VanDerWaalsContact OD1-N 3.13Å
63	V	96	Very high	92.3	Very high	102 Å²	102	94.9 Å²	94.9	62%	0.618	52%	0.522	S	S	*	.			trans	-99.6	28.9	179	-63.1	0	0	0	0	112.3	G61 P65	G61-V63 PolarHBondContact O-N 2.93Å; V63-P65 VanDerWaalsContact O-CD 3.29Å; V63-P65 WeakPolarHBondContact O-CD 3.46Å; V63-P65 VanDerWaalsContact O-N 3.12Å
64	N	95.4	Very high	92	Very high	69 Å²	69	97.7 Å²	97.7	37%	0.369	54%	0.536	S	S	.	.			trans	-54	119.9	175.6	179.5	0.6	0	0	0	110.3	D62 L66 H67	D62-N64 VanDerWaalsContact OD1-CB 3.29Å; D62-N64 WeakPolarHBondContact OD1-CB 3.41Å; D62-N64 PolarHBondContact OD1-N 3.2Å; D62-N64 VanDerWaalsContact OD1-N 3.13Å; N64-L66 PolarHBondContact O-N 3.21Å; N64-L66 PolarHBondContact OD1-N 3.17Å; N64-H67 PolarHBondContact O-N 3.17Å
65	P	93.3	Very high	91.8	Very high	76 Å²	76	100.8 Å²	100.8	49%	0.494	55%	0.545	S	S	.	.	H	α-helix	trans	-54.4	-27.1	-176.7	-29.1	36.2	0	0	0	114.2	V63 H67 L68 N69	V63-P65 VanDerWaalsContact O-CD 3.29Å; V63-P65 WeakPolarHBondContact O-CD 3.46Å; V63-P65 VanDerWaalsContact O-N 3.12Å; P65-H67 PolarHBondContact O-N 3.01Å; P65-H67 VanDerWaalsContact O-N 3.15Å; P65-L68 PolarHBondContact O-N 3.4Å; P65-L68 VanDerWaalsContact O-N 3.13Å; P65-N69 WeakPolarHBondContact O-CB 3.27Å; P65-N69 PolarHBondContact O-N 3.07Å
66	L	93.1	Very high	91.4	Very high	138 Å²	138	103.3 Å²	103.3	72%	0.723	56%	0.556	S	S	*	*	H	α-helix	trans	-57.1	-27.6	176.7	-176.2	65	0	0	0	113.5	N64	N64-L66 PolarHBondContact O-N 3.21Å; N64-L66 PolarHBondContact OD1-N 3.17Å
67	H	91.8	Very high	91	Very high	75 Å²	75	102.4 Å²	102.4	35%	0.347	56%	0.559	S	S	.	*	H	α-helix	trans	-90.2	-19.4	-179.1	-59	-45.2	0	0	0	113.4	Q50 V53 N64 P65	Q50-H67 PolarHBondContact NE2-O 3.48Å; Q50-H67 VanDerWaalsContact NE2-O 3.16Å; V53-H67 HydrophobicContact CG1-CB 3.92Å; V53-H67 WeakPolarHBondContact CG1-O 3.34Å; N64-H67 PolarHBondContact O-N 3.17Å; P65-H67 PolarHBondContact O-N 3.01Å; P65-H67 VanDerWaalsContact O-N 3.15Å
68	L	89.3	Confident	90.5	Very high	62 Å²	62	109.3 Å²	109.3	33%	0.325	60%	0.596	S	S	.	*	H	α-helix	trans	-119.1	-26.3	-165.6	-59.7	-179.9	0	0	0	113.6	P65	P65-L68 PolarHBondContact O-N 3.4Å; P65-L68 VanDerWaalsContact O-N 3.13Å
69	N	80.3	Confident	89.9	Confident	103 Å²	103	104.9 Å²	104.9	55%	0.551	58%	0.582	S	S	*	*			trans	-100.9	131.9	-179	-64.7	-9.6	0	0	0	110.3	P65	P65-N69 WeakPolarHBondContact O-CB 3.27Å; P65-N69 PolarHBondContact O-N 3.07Å
70	E	71	Confident	89.2	Confident	178 Å²	178	101.8 Å²	101.8	83%	0.832	57%	0.569	S	S	*	*			trans	-93.6	-1.5	174.2	-61.1	-169.6	168.5	0	0	112.9
71	D	69.1	Low	88.4	Confident	224 Å²	224	104.3 Å²	104.3	100%	1.198	58%	0.579	S	S	*	*			trans	-89.5	0	-177.1	-63.4	-36	0	0	0	113.9

Retrieved 71 of 71 residues in 96.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).