A0A077ZK74_TRITR Loading...

NADH:ubiquinone reductase (H(+)-translocating)

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) that is believed to belong to the minimal assembly required for catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A077ZK74, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 85 aa.

						>A0A077ZK74_TRITR|A0A077ZK74
MHELAEKDLLSQAAPTPVSSLVHSSTLVVAGTVLCIELNLLYFLHHIGYLISLFSRLSAFYEKDLKKLLAYSTKSQSALVIYNLH
					

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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	55.2	Low	62.2	Low	214 Å²	214	130.5 Å²	130.5	100%	1.054	67%	0.672	S	S	*	*				0	-39.4	0	-66.4	-165.5	-67.2	0	0	112.2	E3 L4	M1-E3 PolarHBondContact O-N 3.06Å; M1-L4 PolarHBondContact O-N 3.38Å
2	H	56.4	Low	61.7	Low	180 Å²	180	132.4 Å²	132.4	83%	0.833	68%	0.676	S	S	*	*	H	α-helix	trans	-60.4	-36.9	170.7	-95.3	-91.9	0	0	0	114.1	L4 A5 E6	H2-L4 VanDerWaalsContact C-N 3.3Å; H2-L4 PolarHBondContact O-N 3Å; H2-A5 PolarHBondContact O-N 3.17Å; H2-E6 PolarHBondContact O-N 3.19Å
3	E	67.1	Low	61.3	Low	150 Å²	150	128.4 Å²	128.4	70%	0.701	68%	0.675	S	S	*	*	H	α-helix	trans	-67.9	-21.5	176.5	-88.1	174.5	82	0	0	115.1	M1	M1-E3 PolarHBondContact O-N 3.06Å
4	L	66.9	Low	60.8	Low	119 Å²	119	124.2 Å²	124.2	62%	0.623	67%	0.668	S	S	*	*	H	α-helix	trans	-77.5	-39.4	177.6	-154	83.2	0	0	0	110.5	M1 H2 E6 K7 D8	M1-L4 PolarHBondContact O-N 3.38Å; H2-L4 VanDerWaalsContact C-N 3.3Å; H2-L4 PolarHBondContact O-N 3Å; L4-E6 VanDerWaalsContact C-N 3.27Å; L4-E6 PolarHBondContact O-N 3.05Å; L4-K7 PolarHBondContact O-N 3.3Å; L4-D8 PolarHBondContact O-N 3.23Å
5	A	66	Low	60.1	Low	61 Å²	61	120.5 Å²	120.5	50%	0.504	65%	0.653	S	S	.	*	H	α-helix	trans	-64.4	-31	176.3	0	0	0	0	0	112.7	H2 D8 L9	H2-A5 PolarHBondContact O-N 3.17Å; A5-D8 PolarHBondContact O-N 3.08Å; A5-L9 PolarHBondContact O-N 3.4Å; A5-L9 VanDerWaalsContact O-N 3.1Å
6	E	70.3	Confident	60.1	Low	130 Å²	130	119.1 Å²	119.1	61%	0.607	65%	0.65	S	S	*	*	H	α-helix	trans	-70.8	-36.8	177.2	-152.1	-178.3	154.1	0	0	112.1	H2 L4 L9 L10	H2-E6 PolarHBondContact O-N 3.19Å; L4-E6 VanDerWaalsContact C-N 3.27Å; L4-E6 PolarHBondContact O-N 3.05Å; E6-L9 PolarHBondContact O-N 3.4Å; E6-L10 WeakPolarHBondContact O-CG 3.39Å; E6-L10 PolarHBondContact O-N 3.14Å
7	K	62.7	Low	59.9	Low	145 Å²	145	117.1 Å²	117.1	63%	0.63	64%	0.644	S	S	*	*	H	α-helix	trans	-65.8	-37.9	174.8	-71.9	-178.8	-179.8	176.4	0	112.1	L4 L10 S11	L4-K7 PolarHBondContact O-N 3.3Å; K7-L10 PolarHBondContact O-N 3.45Å; K7-S11 PolarHBondContact O-N 3.38Å; K7-S11 VanDerWaalsContact O-N 3.15Å
8	D	59.1	Low	60.1	Low	98 Å²	98	116.2 Å²	116.2	52%	0.524	64%	0.642	S	S	.	*	H	α-helix	trans	-66.7	-38.3	174.7	-70.3	-37.8	0	0	0	111.4	L4 A5 L10 S11 Q12	L4-D8 PolarHBondContact O-N 3.23Å; A5-D8 PolarHBondContact O-N 3.08Å; D8-L10 PolarHBondContact O-N 3.47Å; D8-S11 PolarHBondContact O-N 3.41Å; D8-S11 VanDerWaalsContact O-N 3.16Å; D8-S11 PolarHBondContact O-OG 3.07Å; D8-Q12 PolarHBondContact O-N 3.19Å; D8-Q12 VanDerWaalsContact O-N 3.17Å
9	L	64.3	Low	60.6	Low	130 Å²	130	113.8 Å²	113.8	68%	0.681	63%	0.634	S	S	*	*	H	α-helix	trans	-67	-36.4	177.8	-154.2	142.2	0	0	0	112.5	A5 E6 S11 Q12 A13	A5-L9 PolarHBondContact O-N 3.4Å; A5-L9 VanDerWaalsContact O-N 3.1Å; E6-L9 PolarHBondContact O-N 3.4Å; L9-S11 VanDerWaalsContact C-N 3.33Å; L9-Q12 PolarHBondContact O-N 3.5Å; L9-A13 PolarHBondContact O-N 3.38Å
10	L	60.3	Low	61.1	Low	128 Å²	128	111.6 Å²	111.6	67%	0.67	63%	0.627	S	S	*	*	H	α-helix	trans	-67.3	-31.7	172.5	-69.5	172.2	0	0	0	112.6	E6 K7 D8	E6-L10 WeakPolarHBondContact O-CG 3.39Å; E6-L10 PolarHBondContact O-N 3.14Å; K7-L10 PolarHBondContact O-N 3.45Å; D8-L10 PolarHBondContact O-N 3.47Å
11	S	55.6	Low	61.7	Low	81 Å²	81	111.8 Å²	111.8	57%	0.566	63%	0.626	S	S	*	*	H	α-helix	trans	-72.9	-27.7	177.1	79	0	0	0	0	113.2	K7 D8 L9	K7-S11 PolarHBondContact O-N 3.38Å; K7-S11 VanDerWaalsContact O-N 3.15Å; D8-S11 PolarHBondContact O-N 3.41Å; D8-S11 VanDerWaalsContact O-N 3.16Å; D8-S11 PolarHBondContact O-OG 3.07Å; L9-S11 VanDerWaalsContact C-N 3.33Å
12	Q	57.2	Low	62.6	Low	153 Å²	153	105.6 Å²	105.6	72%	0.715	60%	0.6	S	S	*	*	H	α-helix	trans	-94.6	-4.2	-177.1	-163.8	167.1	-17.4	0	0	114.1	D8 L9 A14 P15	D8-Q12 PolarHBondContact O-N 3.19Å; D8-Q12 VanDerWaalsContact O-N 3.17Å; L9-Q12 PolarHBondContact O-N 3.5Å; Q12-A14 VanDerWaalsContact C-N 3.33Å; Q12-A14 PolarHBondContact O-N 3.38Å; Q12-P15 HydrophobicContact CG-CG 4.35Å; Q12-P15 WeakPolarHBondContact O-CD 3.49Å; Q12-P15 WeakPolarHBondContact O-CG 3.48Å
13	A	55.5	Low	63.7	Low	80 Å²	80	103.4 Å²	103.4	66%	0.661	59%	0.59	S	S	*	*	S	Bend	trans	-76	-16.9	175.2	0	0	0	0	0	113.9	L9	L9-A13 PolarHBondContact O-N 3.38Å
14	A	54.6	Low	64.4	Low	70 Å²	70	99.2 Å²	99.2	58%	0.579	58%	0.577	S	S	*	*			trans	-141	44.4	175	0	0	0	0	0	116.2	Q12 T16	Q12-A14 VanDerWaalsContact C-N 3.33Å; Q12-A14 PolarHBondContact O-N 3.38Å; A14-T16 PolarHBondContact O-N 3.16Å
15	P	50.8	Low	65.1	Low	68 Å²	68	97 Å²	97	44%	0.442	57%	0.571	S	S	.	*			trans	-77.5	49.2	161.8	35.8	-35.2	0	0	0	109.4	Q12 S19	Q12-P15 HydrophobicContact CG-CG 4.35Å; Q12-P15 WeakPolarHBondContact O-CD 3.49Å; Q12-P15 WeakPolarHBondContact O-CG 3.48Å; P15-S19 PolarHBondContact O-OG 3.35Å
16	T	60.3	Low	66	Low	98 Å²	98	98.1 Å²	98.1	60%	0.601	57%	0.573	S	S	*	*			trans	-119	-17.8	-160.5	48	0	0	0	0	118.4	A14	A14-T16 PolarHBondContact O-N 3.16Å
17	P	55.6	Low	66.4	Low	85 Å²	85	97.3 Å²	97.3	55%	0.552	57%	0.572	S	S	*	*	S	Bend	trans	-99.2	-43.8	169.9	29	-25.8	0	0	0	113.2	L21	P17-L21 VanDerWaalsContact O-CB 3.29Å; P17-L21 WeakPolarHBondContact O-CB 3.48Å; P17-L21 PolarHBondContact O-N 2.95Å; P17-L21 VanDerWaalsContact O-N 3.1Å
18	V	65	Low	67.4	Low	102 Å²	102	93.5 Å²	93.5	62%	0.618	56%	0.56	S	S	*	*	H	α-helix	trans	-76.7	-41.9	-165.3	-164.3	0	0	0	0	112.2	L21 V22	V18-L21 PolarHBondContact O-N 3.41Å; V18-V22 HydrophobicContact CG1-CG2 4.35Å; V18-V22 VanDerWaalsContact O-CG2 3.28Å; V18-V22 WeakPolarHBondContact O-CG2 3.33Å; V18-V22 PolarHBondContact O-N 2.74Å
19	S	68.7	Low	68.6	Low	70 Å²	70	93 Å²	93	49%	0.49	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-46.6	178.1	51.2	0	0	0	0	112.1	P15 L21 V22 H23	P15-S19 PolarHBondContact O-OG 3.35Å; S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.88Å; S19-V22 PolarHBondContact O-N 3.45Å; S19-H23 WeakPolarHBondContact O-CB 3.25Å; S19-H23 PolarHBondContact O-N 2.86Å
20	S	71.1	Confident	69.7	Low	70 Å²	70	89.8 Å²	89.8	49%	0.49	55%	0.553	S	S	.	*	H	α-helix	trans	-60.6	-40.6	174.9	-178.2	0	0	0	0	111.9	S24	S20-S24 WeakPolarHBondContact O-CB 3.09Å; S20-S24 PolarHBondContact O-N 3.41Å; S20-S24 PolarHBondContact O-OG 3.12Å
21	L	73.8	Confident	70.8	Confident	116 Å²	116	85.2 Å²	85.2	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-46.1	177.1	-174.2	64.9	0	0	0	112.2	P17 V18 S19 S24 S25	P17-L21 VanDerWaalsContact O-CB 3.29Å; P17-L21 WeakPolarHBondContact O-CB 3.48Å; P17-L21 PolarHBondContact O-N 2.95Å; P17-L21 VanDerWaalsContact O-N 3.1Å; V18-L21 PolarHBondContact O-N 3.41Å; S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.88Å; L21-S24 PolarHBondContact O-N 3.42Å; L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 3.25Å
22	V	73.2	Confident	72	Confident	84 Å²	84	83.7 Å²	83.7	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-39.6	178.5	172.7	0	0	0	0	111.1	V18 S19 S25 T26	V18-V22 HydrophobicContact CG1-CG2 4.35Å; V18-V22 VanDerWaalsContact O-CG2 3.28Å; V18-V22 WeakPolarHBondContact O-CG2 3.33Å; V18-V22 PolarHBondContact O-N 2.74Å; S19-V22 PolarHBondContact O-N 3.45Å; V22-S25 PolarHBondContact O-N 3.33Å; V22-T26 PolarHBondContact O-N 3.34Å; V22-T26 PolarHBondContact O-OG1 3.25Å
23	H	79.9	Confident	73.3	Confident	133 Å²	133	80.1 Å²	80.1	62%	0.616	51%	0.512	S	S	*	.	H	α-helix	trans	-61.1	-48.1	174.1	-176.5	-91.7	0	0	0	111.2	S19 S25 T26 L27	S19-H23 WeakPolarHBondContact O-CB 3.25Å; S19-H23 PolarHBondContact O-N 2.86Å; H23-S25 VanDerWaalsContact C-N 3.29Å; H23-S25 PolarHBondContact O-N 3.37Å; H23-T26 PolarHBondContact O-N 3.2Å; H23-L27 PolarHBondContact O-N 3.38Å; H23-L27 VanDerWaalsContact O-N 3.1Å
24	S	82.1	Confident	74.5	Confident	62 Å²	62	81.1 Å²	81.1	43%	0.434	51%	0.506	S	S	.	.	H	α-helix	trans	-59	-41.5	175.8	-58.1	0	0	0	0	111.7	S20 L21 L27 V28	S20-S24 WeakPolarHBondContact O-CB 3.09Å; S20-S24 PolarHBondContact O-N 3.41Å; S20-S24 PolarHBondContact O-OG 3.12Å; L21-S24 PolarHBondContact O-N 3.42Å; S24-L27 PolarHBondContact O-N 2.85Å; S24-V28 WeakPolarHBondContact O-CG2 3.4Å; S24-V28 PolarHBondContact O-N 3.31Å
25	S	80.5	Confident	75.6	Confident	72 Å²	72	79 Å²	79	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-40.6	177.8	-177.3	0	0	0	0	112.6	L21 V22 H23 L27 V28 V29	L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 3.25Å; V22-S25 PolarHBondContact O-N 3.33Å; H23-S25 VanDerWaalsContact C-N 3.29Å; H23-S25 PolarHBondContact O-N 3.37Å; S25-L27 PolarHBondContact O-N 2.99Å; S25-V28 WeakPolarHBondContact O-CB 3.49Å; S25-V28 PolarHBondContact O-N 2.92Å; S25-V29 PolarHBondContact O-N 2.95Å; S25-V29 VanDerWaalsContact O-N 3.12Å
26	T	85.6	Confident	76.9	Confident	86 Å²	86	80.2 Å²	80.2	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-66.3	-37.9	178.9	-52.6	0	0	0	0	111.6	V22 H23 V28 V29 A30	V22-T26 PolarHBondContact O-N 3.34Å; V22-T26 PolarHBondContact O-OG1 3.25Å; H23-T26 PolarHBondContact O-N 3.2Å; T26-V28 VanDerWaalsContact C-N 3.32Å; T26-V28 PolarHBondContact O-N 3.44Å; T26-V29 PolarHBondContact O-N 3.5Å; T26-A30 PolarHBondContact O-N 2.84Å
27	L	79.7	Confident	77.8	Confident	113 Å²	113	82.9 Å²	82.9	59%	0.592	49%	0.494	S	S	*	.	H	α-helix	trans	-62.2	-40.1	174.2	-173	154.6	0	0	0	111.6	H23 S24 S25 V29 A30 G31	H23-L27 PolarHBondContact O-N 3.38Å; H23-L27 VanDerWaalsContact O-N 3.1Å; S24-L27 PolarHBondContact O-N 2.85Å; S25-L27 PolarHBondContact O-N 2.99Å; L27-V29 VanDerWaalsContact C-N 3.34Å; L27-V29 PolarHBondContact O-N 3.47Å; L27-A30 PolarHBondContact O-N 2.77Å; L27-G31 PolarHBondContact O-N 3.21Å
28	V	82.7	Confident	79	Confident	64 Å²	64	84.2 Å²	84.2	39%	0.388	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-41.8	175.8	173.2	0	0	0	0	111.2	S24 S25 T26 G31 T32 I51	S24-V28 WeakPolarHBondContact O-CG2 3.4Å; S24-V28 PolarHBondContact O-N 3.31Å; S25-V28 WeakPolarHBondContact O-CB 3.49Å; S25-V28 PolarHBondContact O-N 2.92Å; T26-V28 VanDerWaalsContact C-N 3.32Å; T26-V28 PolarHBondContact O-N 3.44Å; V28-G31 PolarHBondContact O-N 3.49Å; V28-T32 WeakPolarHBondContact O-CB 3.27Å; V28-T32 PolarHBondContact O-N 3.12Å; V28-T32 PolarHBondContact O-OG1 2.75Å; V28-I51 HydrophobicContact CG1-CD1 3.75Å; V28-I51 HydrophobicContact CG1-CG1 4.45Å
29	V	84.6	Confident	79.4	Confident	89 Å²	89	85.1 Å²	85.1	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-48.3	175.4	175.9	0	0	0	0	110.7	S25 T26 L27 G31 T32 V33	S25-V29 PolarHBondContact O-N 2.95Å; S25-V29 VanDerWaalsContact O-N 3.12Å; T26-V29 PolarHBondContact O-N 3.5Å; L27-V29 VanDerWaalsContact C-N 3.34Å; L27-V29 PolarHBondContact O-N 3.47Å; V29-G31 PolarHBondContact O-N 3.49Å; V29-T32 PolarHBondContact O-N 3.29Å; V29-V33 WeakPolarHBondContact O-CG2 3.49Å; V29-V33 PolarHBondContact O-N 3.46Å; V29-V33 VanDerWaalsContact O-N 3.07Å
30	A	86.5	Confident	79.6	Confident	62 Å²	62	85.5 Å²	85.5	51%	0.512	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-44	178.1	0	0	0	0	0	112.4	T26 L27 T32 V33 L34	T26-A30 PolarHBondContact O-N 2.84Å; L27-A30 PolarHBondContact O-N 2.77Å; A30-T32 VanDerWaalsContact C-N 3.35Å; A30-T32 PolarHBondContact O-N 2.76Å; A30-V33 PolarHBondContact O-N 3.06Å; A30-L34 PolarHBondContact O-N 3.37Å
31	G	84.1	Confident	79.7	Confident	31 Å²	31	87 Å²	87	32%	0.32	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-38.5	176	0	0	0	0	0	112.7	L27 V28 V29 L34 C35	L27-G31 PolarHBondContact O-N 3.21Å; V28-G31 PolarHBondContact O-N 3.49Å; V29-G31 PolarHBondContact O-N 3.49Å; G31-L34 PolarHBondContact O-N 3.26Å; G31-C35 PolarHBondContact O-N 3.46Å; G31-C35 VanDerWaalsContact O-N 3.08Å; G31-C35 PolarHBondContact O-SG 3.47Å
32	T	81.2	Confident	79.6	Confident	49 Å²	49	91.1 Å²	91.1	30%	0.301	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-44.7	177.1	-56.4	0	0	0	0	111.2	V28 V29 A30 L34 C35 I36 L44	V28-T32 WeakPolarHBondContact O-CB 3.27Å; V28-T32 PolarHBondContact O-N 3.12Å; V28-T32 PolarHBondContact O-OG1 2.75Å; V29-T32 PolarHBondContact O-N 3.29Å; A30-T32 VanDerWaalsContact C-N 3.35Å; A30-T32 PolarHBondContact O-N 2.76Å; T32-L34 PolarHBondContact O-N 2.87Å; T32-C35 PolarHBondContact O-N 2.93Å; T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 2.87Å; T32-I36 VanDerWaalsContact O-N 3.14Å; T32-L44 HydrophobicContact CG2-CD2 4.23Å
33	V	83.2	Confident	79.8	Confident	78 Å²	78	92.4 Å²	92.4	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-59.8	-45.5	177.4	173.7	0	0	0	0	111.3	V29 A30 C35 I36 E37	V29-V33 WeakPolarHBondContact O-CG2 3.49Å; V29-V33 PolarHBondContact O-N 3.46Å; V29-V33 VanDerWaalsContact O-N 3.07Å; A30-V33 PolarHBondContact O-N 3.06Å; V33-C35 VanDerWaalsContact C-N 3.32Å; V33-C35 PolarHBondContact O-N 3.45Å; V33-I36 WeakPolarHBondContact O-CB 3.43Å; V33-I36 PolarHBondContact O-N 3.04Å; V33-E37 PolarHBondContact O-N 3.38Å
34	L	81.1	Confident	79.6	Confident	101 Å²	101	87.6 Å²	87.6	53%	0.529	48%	0.482	S	S	.	.	H	α-helix	trans	-59.5	-41	176.7	-177.3	67.6	0	0	0	112.2	A30 G31 T32 I36 E37 L38	A30-L34 PolarHBondContact O-N 3.37Å; G31-L34 PolarHBondContact O-N 3.26Å; T32-L34 PolarHBondContact O-N 2.87Å; L34-I36 VanDerWaalsContact C-N 3.32Å; L34-I36 PolarHBondContact O-N 2.87Å; L34-E37 PolarHBondContact O-N 2.91Å; L34-L38 PolarHBondContact O-N 3.23Å
35	C	77.2	Confident	79.4	Confident	25 Å²	25	91.4 Å²	91.4	17%	0.169	49%	0.492	C	S	.	.	H	α-helix	trans	-69.1	-28.1	178.9	-65.6	0	0	0	0	113.3	G31 T32 V33 L38 L40 L44	G31-C35 PolarHBondContact O-N 3.46Å; G31-C35 VanDerWaalsContact O-N 3.08Å; G31-C35 PolarHBondContact O-SG 3.47Å; T32-C35 PolarHBondContact O-N 2.93Å; V33-C35 VanDerWaalsContact C-N 3.32Å; V33-C35 PolarHBondContact O-N 3.45Å; C35-L38 PolarHBondContact O-N 3.48Å; C35-L40 PolarHBondContact O-N 3.31Å; C35-L44 HydrophobicContact CB-CD1 3.43Å; C35-L44 VanDerWaalsContact CB-CD1 3.43Å; C35-L44 HydrophobicContact CB-CG 4.21Å
36	I	78.2	Confident	79.4	Confident	94 Å²	94	93.8 Å²	93.8	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-44.8	174.7	-64.7	169.8	0	0	0	110	T32 V33 L34 L38 N39 L44	T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 2.87Å; T32-I36 VanDerWaalsContact O-N 3.14Å; V33-I36 WeakPolarHBondContact O-CB 3.43Å; V33-I36 PolarHBondContact O-N 3.04Å; L34-I36 VanDerWaalsContact C-N 3.32Å; L34-I36 PolarHBondContact O-N 2.87Å; I36-L38 VanDerWaalsContact C-N 3.29Å; I36-L38 PolarHBondContact O-N 3.25Å; I36-N39 PolarHBondContact O-N 3.29Å; I36-L44 HydrophobicContact CD1-CD2 4.28Å; I36-L44 HydrophobicContact CG1-CD2 3.41Å; I36-L44 VanDerWaalsContact CG1-CD2 3.41Å
37	E	79.8	Confident	79.1	Confident	154 Å²	154	91.9 Å²	91.9	72%	0.72	48%	0.481	S	S	*	.	H	α-helix	trans	-63.2	-35.2	-179.9	-67.2	-174.9	170.5	0	0	112.6	V33 L34 N39	V33-E37 PolarHBondContact O-N 3.38Å; L34-E37 PolarHBondContact O-N 2.91Å; E37-N39 PolarHBondContact O-N 2.87Å
38	L	81.3	Confident	79.2	Confident	114 Å²	114	88.1 Å²	88.1	60%	0.597	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	3.9	176.9	-61.9	174.5	0	0	0	113.4	L34 C35 I36 L40	L34-L38 PolarHBondContact O-N 3.23Å; C35-L38 PolarHBondContact O-N 3.48Å; I36-L38 VanDerWaalsContact C-N 3.29Å; I36-L38 PolarHBondContact O-N 3.25Å; L38-L40 HydrophobicContact CB-CD1 3.78Å; L38-L40 VanDerWaalsContact O-CD1 3.25Å; L38-L40 WeakPolarHBondContact O-CD1 3.31Å; L38-L40 PolarHBondContact O-N 3.37Å; L38-L40 VanDerWaalsContact O-N 3.16Å
39	N	72.7	Confident	79.1	Confident	120 Å²	120	91.8 Å²	91.8	64%	0.642	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	29.1	-178.5	-161.4	19.7	0	0	0	113.6	I36 E37 L41	I36-N39 PolarHBondContact O-N 3.29Å; E37-N39 PolarHBondContact O-N 2.87Å; N39-L41 PolarHBondContact O-N 3.33Å
40	L	73.2	Confident	79	Confident	78 Å²	78	92.7 Å²	92.7	41%	0.408	48%	0.48	S	S	.	.			trans	-81.8	41.7	178.3	-101.6	81.3	0	0	0	111.2	C35 L38 Y42 F43 L44	C35-L40 PolarHBondContact O-N 3.31Å; L38-L40 HydrophobicContact CB-CD1 3.78Å; L38-L40 VanDerWaalsContact O-CD1 3.25Å; L38-L40 WeakPolarHBondContact O-CD1 3.31Å; L38-L40 PolarHBondContact O-N 3.37Å; L38-L40 VanDerWaalsContact O-N 3.16Å; L40-Y42 PolarHBondContact O-N 3.22Å; L40-Y42 VanDerWaalsContact O-N 3.12Å; L40-F43 HydrophobicContact CB-CB 4.04Å; L40-F43 HydrophobicContact CD2-CB 4Å; L40-F43 HydrophobicContact CD2-CD1 3.92Å; L40-F43 HydrophobicContact CD2-CG 4.16Å; L40-F43 HydrophobicContact CG-CB 4.32Å; L40-F43 WeakPolarHBondContact O-CA 3.43Å; L40-F43 WeakPolarHBondContact O-CB 3.46Å; L40-F43 PolarHBondContact O-N 3.46Å; L40-L44 HydrophobicContact CB-CD1 4.33Å; L40-L44 WeakPolarHBondContact O-CD1 3.36Å; L40-L44 PolarHBondContact O-N 3.1Å
41	L	73	Confident	78.7	Confident	102 Å²	102	93 Å²	93	53%	0.534	47%	0.472	S	S	.	.	H	α-helix	trans	-54.7	-36.9	-172.9	-65.2	176	0	0	0	113.4	N39 F43 L44 H45	N39-L41 PolarHBondContact O-N 3.33Å; L41-F43 VanDerWaalsContact C-N 3.35Å; L41-L44 WeakPolarHBondContact O-CB 3.46Å; L41-L44 PolarHBondContact O-N 2.72Å; L41-H45 PolarHBondContact O-N 3Å
42	Y	72.8	Confident	78.6	Confident	203 Å²	203	94.9 Å²	94.9	80%	0.796	48%	0.48	S	S	*	.	H	α-helix	trans	-62.5	-41.8	174.2	-70.5	-74.5	0	0	0	112.4	L40 H45 H46	L40-Y42 PolarHBondContact O-N 3.22Å; L40-Y42 VanDerWaalsContact O-N 3.12Å; Y42-H45 PolarHBondContact O-N 2.81Å; Y42-H46 PolarHBondContact O-CD2 3.04Å; Y42-H46 VanDerWaalsContact O-CD2 3.25Å; Y42-H46 PolarHBondContact O-N 3.44Å
43	F	76.1	Confident	78.6	Confident	110 Å²	110	96 Å²	96	48%	0.482	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-37.3	176.9	-170.5	-121.7	0	0	0	110.9	L40 L41 H45 H46 I47	L40-F43 HydrophobicContact CB-CB 4.04Å; L40-F43 HydrophobicContact CD2-CB 4Å; L40-F43 HydrophobicContact CD2-CD1 3.92Å; L40-F43 HydrophobicContact CD2-CG 4.16Å; L40-F43 HydrophobicContact CG-CB 4.32Å; L40-F43 WeakPolarHBondContact O-CA 3.43Å; L40-F43 WeakPolarHBondContact O-CB 3.46Å; L40-F43 PolarHBondContact O-N 3.46Å; L41-F43 VanDerWaalsContact C-N 3.35Å; F43-H45 PolarHBondContact O-N 3.25Å; F43-H46 PolarHBondContact O-N 3.15Å; F43-I47 HydrophobicContact CD1-CD1 3.24Å; F43-I47 HydrophobicContact CD1-CG1 4.2Å; F43-I47 HydrophobicContact CD2-CD1 4.36Å; F43-I47 HydrophobicContact CE1-CD1 3.12Å; F43-I47 HydrophobicContact CE1-CG1 4.02Å; F43-I47 HydrophobicContact CE2-CD1 4.25Å; F43-I47 HydrophobicContact CE2-CG1 4.31Å; F43-I47 HydrophobicContact CG-CD1 3.89Å; F43-I47 HydrophobicContact CG-CG1 4.43Å; F43-I47 HydrophobicContact CZ-CD1 3.65Å; F43-I47 HydrophobicContact CZ-CG1 4.05Å; F43-I47 WeakPolarHBondContact O-CB 3.22Å; F43-I47 VanDerWaalsContact O-CG1 3.27Å; F43-I47 WeakPolarHBondContact O-CG1 3.42Å; F43-I47 PolarHBondContact O-N 3.33Å
44	L	75.5	Confident	78.5	Confident	33 Å²	33	99 Å²	99	17%	0.173	49%	0.491	C	S	.	.	H	α-helix	trans	-61.1	-40.2	173.5	-86.6	83.2	0	0	0	112.9	T32 C35 I36 L40 L41 H46 I47 G48	T32-L44 HydrophobicContact CG2-CD2 4.23Å; C35-L44 HydrophobicContact CB-CD1 3.43Å; C35-L44 VanDerWaalsContact CB-CD1 3.43Å; C35-L44 HydrophobicContact CB-CG 4.21Å; I36-L44 HydrophobicContact CD1-CD2 4.28Å; I36-L44 HydrophobicContact CG1-CD2 3.41Å; I36-L44 VanDerWaalsContact CG1-CD2 3.41Å; L40-L44 HydrophobicContact CB-CD1 4.33Å; L40-L44 WeakPolarHBondContact O-CD1 3.36Å; L40-L44 PolarHBondContact O-N 3.1Å; L41-L44 WeakPolarHBondContact O-CB 3.46Å; L41-L44 PolarHBondContact O-N 2.72Å; L44-H46 VanDerWaalsContact C-N 3.34Å; L44-I47 PolarHBondContact O-N 3.48Å; L44-G48 WeakPolarHBondContact O-CA 3.42Å; L44-G48 PolarHBondContact O-N 2.75Å
45	H	78.2	Confident	78.3	Confident	141 Å²	141	97.7 Å²	97.7	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-62.3	-45.2	177.9	-174.8	77.6	0	0	0	111.1	L41 Y42 F43 G48 Y49	L41-H45 PolarHBondContact O-N 3Å; Y42-H45 PolarHBondContact O-N 2.81Å; F43-H45 PolarHBondContact O-N 3.25Å; H45-G48 PolarHBondContact O-N 2.91Å; H45-Y49 PolarHBondContact O-N 3.37Å
46	H	80	Confident	78.4	Confident	122 Å²	122	105.7 Å²	105.7	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-63.7	-45.8	176	-73.1	-57	0	0	0	112.1	Y42 F43 L44 Y49 L50	Y42-H46 PolarHBondContact O-CD2 3.04Å; Y42-H46 VanDerWaalsContact O-CD2 3.25Å; Y42-H46 PolarHBondContact O-N 3.44Å; F43-H46 PolarHBondContact O-N 3.15Å; L44-H46 VanDerWaalsContact C-N 3.34Å; H46-Y49 PolarHBondContact O-N 2.89Å; H46-L50 WeakPolarHBondContact O-CG 3.45Å; H46-L50 PolarHBondContact O-N 3.45Å
47	I	80.7	Confident	78.3	Confident	46 Å²	46	106.1 Å²	106.1	24%	0.236	52%	0.519	C	S	.	.	H	α-helix	trans	-62.5	-44.4	176	-67.3	163.4	0	0	0	111	F43 L44 Y49 L50 I51	F43-I47 HydrophobicContact CD1-CD1 3.24Å; F43-I47 HydrophobicContact CD1-CG1 4.2Å; F43-I47 HydrophobicContact CD2-CD1 4.36Å; F43-I47 HydrophobicContact CE1-CD1 3.12Å; F43-I47 HydrophobicContact CE1-CG1 4.02Å; F43-I47 HydrophobicContact CE2-CD1 4.25Å; F43-I47 HydrophobicContact CE2-CG1 4.31Å; F43-I47 HydrophobicContact CG-CD1 3.89Å; F43-I47 HydrophobicContact CG-CG1 4.43Å; F43-I47 HydrophobicContact CZ-CD1 3.65Å; F43-I47 HydrophobicContact CZ-CG1 4.05Å; F43-I47 WeakPolarHBondContact O-CB 3.22Å; F43-I47 VanDerWaalsContact O-CG1 3.27Å; F43-I47 WeakPolarHBondContact O-CG1 3.42Å; F43-I47 PolarHBondContact O-N 3.33Å; L44-I47 PolarHBondContact O-N 3.48Å; I47-Y49 VanDerWaalsContact C-N 3.29Å; I47-Y49 PolarHBondContact O-N 2.71Å; I47-L50 CarbonylContact O-C 3.52Å; I47-L50 WeakPolarHBondContact O-CA 3.28Å; I47-L50 WeakPolarHBondContact O-CB 3.49Å; I47-L50 PolarHBondContact O-N 3.41Å; I47-I51 HydrophobicContact CG2-CD1 3.56Å; I47-I51 HydrophobicContact CG2-CG1 4Å; I47-I51 VanDerWaalsContact O-CG1 3.31Å; I47-I51 WeakPolarHBondContact O-CG1 3.34Å; I47-I51 PolarHBondContact O-N 3.1Å
48	G	80.9	Confident	77.9	Confident	35 Å²	35	101 Å²	101	36%	0.361	50%	0.501	S	S	.	.	H	α-helix	trans	-61.2	-38.5	179.7	0	0	0	0	0	112.2	L44 H45 I51 S52	L44-G48 WeakPolarHBondContact O-CA 3.42Å; L44-G48 PolarHBondContact O-N 2.75Å; H45-G48 PolarHBondContact O-N 2.91Å; G48-I51 PolarHBondContact O-N 3.22Å; G48-S52 WeakPolarHBondContact O-CB 3.41Å; G48-S52 PolarHBondContact O-N 2.88Å
49	Y	80.6	Confident	77.4	Confident	141 Å²	141	98.2 Å²	98.2	55%	0.553	49%	0.494	S	S	*	.	H	α-helix	trans	-63.1	-45.4	170.8	-179.1	-103.8	0	0	0	111.9	H45 H46 I47 I51 S52 L53	H45-Y49 PolarHBondContact O-N 3.37Å; H46-Y49 PolarHBondContact O-N 2.89Å; I47-Y49 VanDerWaalsContact C-N 3.29Å; I47-Y49 PolarHBondContact O-N 2.71Å; Y49-I51 VanDerWaalsContact C-N 3.34Å; Y49-I51 PolarHBondContact O-N 2.89Å; Y49-S52 PolarHBondContact O-N 2.74Å; Y49-L53 HydrophobicContact CD1-CD1 3.86Å; Y49-L53 HydrophobicContact CD1-CG 4.43Å; Y49-L53 HydrophobicContact CE1-CD1 3.3Å; Y49-L53 HydrophobicContact CE1-CG 4.04Å; Y49-L53 HydrophobicContact CE2-CG 4.46Å; Y49-L53 WeakPolarHBondContact O-CG 3.31Å; Y49-L53 PolarHBondContact O-N 2.9Å
50	L	82	Confident	77.1	Confident	108 Å²	108	99.6 Å²	99.6	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-62.4	-38.7	175.5	-66.4	178.2	0	0	0	112.3	H46 I47 L53 F54	H46-L50 WeakPolarHBondContact O-CG 3.45Å; H46-L50 PolarHBondContact O-N 3.45Å; I47-L50 CarbonylContact O-C 3.52Å; I47-L50 WeakPolarHBondContact O-CA 3.28Å; I47-L50 WeakPolarHBondContact O-CB 3.49Å; I47-L50 PolarHBondContact O-N 3.41Å; L50-L53 PolarHBondContact O-N 3.34Å; L50-F54 WeakPolarHBondContact O-CB 3.31Å; L50-F54 PolarHBondContact O-N 3.32Å
51	I	81.7	Confident	76.6	Confident	68 Å²	68	102.4 Å²	102.4	35%	0.349	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-44.9	175.6	-68.4	167.6	0	0	0	110.5	V28 I47 G48 Y49 L53 F54 S55	V28-I51 HydrophobicContact CG1-CD1 3.75Å; V28-I51 HydrophobicContact CG1-CG1 4.45Å; I47-I51 HydrophobicContact CG2-CD1 3.56Å; I47-I51 HydrophobicContact CG2-CG1 4Å; I47-I51 VanDerWaalsContact O-CG1 3.31Å; I47-I51 WeakPolarHBondContact O-CG1 3.34Å; I47-I51 PolarHBondContact O-N 3.1Å; G48-I51 PolarHBondContact O-N 3.22Å; Y49-I51 VanDerWaalsContact C-N 3.34Å; Y49-I51 PolarHBondContact O-N 2.89Å; I51-L53 VanDerWaalsContact C-N 3.32Å; I51-L53 PolarHBondContact O-N 2.96Å; I51-F54 PolarHBondContact O-N 2.76Å; I51-S55 WeakPolarHBondContact O-CB 3.34Å; I51-S55 PolarHBondContact O-N 3.34Å
52	S	81.2	Confident	76.2	Confident	71 Å²	71	102.3 Å²	102.3	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177.2	-177.3	0	0	0	0	111.2	G48 Y49 S55 R56	G48-S52 WeakPolarHBondContact O-CB 3.41Å; G48-S52 PolarHBondContact O-N 2.88Å; Y49-S52 PolarHBondContact O-N 2.74Å; S52-S55 PolarHBondContact O-N 3.45Å; S52-R56 VanDerWaalsContact O-CB 3.22Å; S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 PolarHBondContact O-N 3.45Å
53	L	81.9	Confident	75.6	Confident	71 Å²	71	99.9 Å²	99.9	37%	0.372	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-46.8	172.3	-77.2	178.9	0	0	0	111.9	Y49 L50 I51 R56 L57	Y49-L53 HydrophobicContact CD1-CD1 3.86Å; Y49-L53 HydrophobicContact CD1-CG 4.43Å; Y49-L53 HydrophobicContact CE1-CD1 3.3Å; Y49-L53 HydrophobicContact CE1-CG 4.04Å; Y49-L53 HydrophobicContact CE2-CG 4.46Å; Y49-L53 WeakPolarHBondContact O-CG 3.31Å; Y49-L53 PolarHBondContact O-N 2.9Å; L50-L53 PolarHBondContact O-N 3.34Å; I51-L53 VanDerWaalsContact C-N 3.32Å; I51-L53 PolarHBondContact O-N 2.96Å; L53-R56 PolarHBondContact O-N 2.98Å; L53-L57 WeakPolarHBondContact O-CG 3.33Å; L53-L57 PolarHBondContact O-N 3.14Å
54	F	79.9	Confident	75	Confident	142 Å²	142	98 Å²	98	62%	0.623	49%	0.486	S	S	*	.	H	α-helix	trans	-62.7	-45.2	177.9	-170.6	-100.7	0	0	0	111.6	L50 I51 R56 L57 S58	L50-F54 WeakPolarHBondContact O-CB 3.31Å; L50-F54 PolarHBondContact O-N 3.32Å; I51-F54 PolarHBondContact O-N 2.76Å; F54-R56 VanDerWaalsContact C-N 3.29Å; F54-R56 PolarHBondContact O-N 2.9Å; F54-L57 CarbonylContact O-C 3.46Å; F54-L57 WeakPolarHBondContact O-CB 3.49Å; F54-L57 PolarHBondContact O-N 3.35Å; F54-S58 WeakPolarHBondContact O-CB 3.29Å; F54-S58 PolarHBondContact O-N 3.29Å; F54-S58 PolarHBondContact O-OG 3.35Å
55	S	77.8	Confident	74.5	Confident	73 Å²	73	101.5 Å²	101.5	51%	0.51	50%	0.504	S	S	.	.	H	α-helix	trans	-60.9	-38.2	175.2	176.3	0	0	0	0	112.1	I51 S52 S58 A59	I51-S55 WeakPolarHBondContact O-CB 3.34Å; I51-S55 PolarHBondContact O-N 3.34Å; S52-S55 PolarHBondContact O-N 3.45Å; S55-S58 PolarHBondContact O-N 3.39Å; S55-A59 WeakPolarHBondContact O-CB 3.46Å; S55-A59 PolarHBondContact O-N 3.25Å
56	R	78.4	Confident	73.8	Confident	194 Å²	194	101.3 Å²	101.3	73%	0.732	50%	0.501	S	S	*	.	H	α-helix	trans	-69.7	-38	177.2	-164.5	167.1	-174.6	167.2	0.2	111.9	S52 L53 F54 A59 F60	S52-R56 VanDerWaalsContact O-CB 3.22Å; S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 PolarHBondContact O-N 3.45Å; L53-R56 PolarHBondContact O-N 2.98Å; F54-R56 VanDerWaalsContact C-N 3.29Å; F54-R56 PolarHBondContact O-N 2.9Å; R56-A59 PolarHBondContact O-N 3.5Å; R56-F60 PolarHBondContact O-N 3.15Å; R56-F60 VanDerWaalsContact O-N 3.15Å
57	L	76.8	Confident	73	Confident	102 Å²	102	101.9 Å²	101.9	53%	0.534	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-47.8	170.1	-71	170.7	0	0	0	110.7	L53 F54 A59 F60 Y61	L53-L57 WeakPolarHBondContact O-CG 3.33Å; L53-L57 PolarHBondContact O-N 3.14Å; F54-L57 CarbonylContact O-C 3.46Å; F54-L57 WeakPolarHBondContact O-CB 3.49Å; F54-L57 PolarHBondContact O-N 3.35Å; L57-A59 VanDerWaalsContact C-N 3.28Å; L57-A59 PolarHBondContact O-N 3.47Å; L57-F60 WeakPolarHBondContact O-CA 3.34Å; L57-F60 WeakPolarHBondContact O-CB 3.33Å; L57-F60 PolarHBondContact O-N 3.26Å; L57-Y61 WeakPolarHBondContact O-CD2 3.35Å; L57-Y61 PolarHBondContact O-N 2.92Å
58	S	71.4	Confident	72.3	Confident	48 Å²	48	105 Å²	105	34%	0.336	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-39.6	175.1	-59.6	0	0	0	0	111.8	F54 S55 F60 Y61 E62	F54-S58 WeakPolarHBondContact O-CB 3.29Å; F54-S58 PolarHBondContact O-N 3.29Å; F54-S58 PolarHBondContact O-OG 3.35Å; S55-S58 PolarHBondContact O-N 3.39Å; S58-F60 VanDerWaalsContact C-N 3.31Å; S58-F60 PolarHBondContact O-N 3.36Å; S58-Y61 CarbonylContact O-C 3.49Å; S58-Y61 PolarHBondContact O-N 2.72Å; S58-E62 VanDerWaalsContact O-CB 3.31Å; S58-E62 WeakPolarHBondContact O-CB 3.22Å; S58-E62 PolarHBondContact O-N 2.79Å
59	A	70.2	Confident	71.6	Confident	55 Å²	55	109.3 Å²	109.3	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-65.8	-33	175.8	0	0	0	0	0	112.8	S55 R56 L57	S55-A59 WeakPolarHBondContact O-CB 3.46Å; S55-A59 PolarHBondContact O-N 3.25Å; R56-A59 PolarHBondContact O-N 3.5Å; L57-A59 VanDerWaalsContact C-N 3.28Å; L57-A59 PolarHBondContact O-N 3.47Å
60	F	67.1	Low	71	Confident	148 Å²	148	105.6 Å²	105.6	65%	0.649	53%	0.531	S	S	*	.	H	α-helix	trans	-67.3	-48	171.7	-168.3	-101.1	0	0	0	110.4	R56 L57 S58 E62	R56-F60 PolarHBondContact O-N 3.15Å; R56-F60 VanDerWaalsContact O-N 3.15Å; L57-F60 WeakPolarHBondContact O-CA 3.34Å; L57-F60 WeakPolarHBondContact O-CB 3.33Å; L57-F60 PolarHBondContact O-N 3.26Å; S58-F60 VanDerWaalsContact C-N 3.31Å; S58-F60 PolarHBondContact O-N 3.36Å; F60-E62 PolarHBondContact O-N 2.72Å
61	Y	62.3	Low	70.4	Confident	137 Å²	137	108.6 Å²	108.6	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-69.2	-26.1	177.6	-84.8	-83.4	0	0	0	114.2	L57 S58 K63 D64 L65	L57-Y61 WeakPolarHBondContact O-CD2 3.35Å; L57-Y61 PolarHBondContact O-N 2.92Å; S58-Y61 CarbonylContact O-C 3.49Å; S58-Y61 PolarHBondContact O-N 2.72Å; Y61-K63 VanDerWaalsContact C-N 3.26Å; Y61-K63 PolarHBondContact O-N 3.1Å; Y61-D64 CarbonylContact O-C 3.59Å; Y61-D64 WeakPolarHBondContact O-CA 3.37Å; Y61-D64 PolarHBondContact O-N 3.28Å; Y61-L65 WeakPolarHBondContact O-CG 3.4Å; Y61-L65 PolarHBondContact O-N 3.17Å
62	E	65.3	Low	69.9	Low	100 Å²	100	108.8 Å²	108.8	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-32.2	-177.5	-168.1	173.8	162.8	0	0	111.5	S58 F60 D64 K66	S58-E62 VanDerWaalsContact O-CB 3.31Å; S58-E62 WeakPolarHBondContact O-CB 3.22Å; S58-E62 PolarHBondContact O-N 2.79Å; F60-E62 PolarHBondContact O-N 2.72Å; E62-D64 PolarHBondContact O-N 3.48Å; E62-K66 HydrophobicContact CG-CD 4.44Å; E62-K66 WeakPolarHBondContact O-CG 3.34Å; E62-K66 PolarHBondContact O-N 3.4Å; E62-K66 VanDerWaalsContact OE1-CE 3.31Å; E62-K66 WeakPolarHBondContact OE1-CE 3.33Å; E62-K66 IonicContact OE1-NZ 2.72Å; E62-K66 PolarHBondContact OE1-NZ 3.5Å
63	K	59.6	Low	69.5	Low	153 Å²	153	109.5 Å²	109.5	67%	0.665	55%	0.546	S	S	*	.	H	α-helix	trans	-63.2	-33.6	168.7	-79.9	-177.2	179.1	174.4	0	111.9	Y61 K67	Y61-K63 VanDerWaalsContact C-N 3.26Å; Y61-K63 PolarHBondContact O-N 3.1Å; K63-K67 WeakPolarHBondContact O-CD 3.41Å; K63-K67 WeakPolarHBondContact O-CG 2.9Å
64	D	64.2	Low	68.9	Low	71 Å²	71	113 Å²	113	38%	0.38	56%	0.558	S	S	.	*	H	α-helix	trans	-88.2	-34.1	-176.3	-64.1	-35.1	0	0	0	112.8	Y61 E62 K67 L68	Y61-D64 CarbonylContact O-C 3.59Å; Y61-D64 WeakPolarHBondContact O-CA 3.37Å; Y61-D64 PolarHBondContact O-N 3.28Å; E62-D64 PolarHBondContact O-N 3.48Å; D64-K67 CarbonylContact O-C 3.58Å; D64-K67 PolarHBondContact O-N 3.44Å; D64-L68 WeakPolarHBondContact O-CB 3.5Å; D64-L68 PolarHBondContact O-N 3.36Å
65	L	63.6	Low	68.5	Low	106 Å²	106	108.4 Å²	108.4	56%	0.555	54%	0.543	S	S	*	.	H	α-helix	trans	-68.7	-43.7	177	-73.4	173.4	0	0	0	112	Y61 K67 L68 L69	Y61-L65 WeakPolarHBondContact O-CG 3.4Å; Y61-L65 PolarHBondContact O-N 3.17Å; L65-K67 VanDerWaalsContact C-N 3.26Å; L65-K67 PolarHBondContact O-N 3.16Å; L65-L68 PolarHBondContact O-N 3.33Å; L65-L69 WeakPolarHBondContact O-CB 3.22Å; L65-L69 PolarHBondContact O-N 3.13Å
66	K	64.6	Low	68.2	Low	136 Å²	136	111.2 Å²	111.2	59%	0.591	55%	0.548	S	S	*	.	H	α-helix	trans	-60	-40	174	-71.4	176.3	-175.2	164.9	0	110.9	E62 A70	E62-K66 HydrophobicContact CG-CD 4.44Å; E62-K66 WeakPolarHBondContact O-CG 3.34Å; E62-K66 PolarHBondContact O-N 3.4Å; E62-K66 VanDerWaalsContact OE1-CE 3.31Å; E62-K66 WeakPolarHBondContact OE1-CE 3.33Å; E62-K66 IonicContact OE1-NZ 2.72Å; E62-K66 PolarHBondContact OE1-NZ 3.5Å; K66-A70 WeakPolarHBondContact O-CB 3.49Å; K66-A70 PolarHBondContact O-N 2.8Å; K66-A70 VanDerWaalsContact O-N 3.14Å
67	K	63.6	Low	67.8	Low	134 Å²	134	105.1 Å²	105.1	58%	0.583	54%	0.535	S	S	*	.	H	α-helix	trans	-71.8	-39.7	176.1	-74.2	176.8	-174.5	176.5	0	112.8	K63 D64 L65 A70 Y71	K63-K67 WeakPolarHBondContact O-CD 3.41Å; K63-K67 WeakPolarHBondContact O-CG 2.9Å; D64-K67 CarbonylContact O-C 3.58Å; D64-K67 PolarHBondContact O-N 3.44Å; L65-K67 VanDerWaalsContact C-N 3.26Å; L65-K67 PolarHBondContact O-N 3.16Å; K67-A70 PolarHBondContact O-N 3.33Å; K67-Y71 WeakPolarHBondContact O-CB 3.17Å; K67-Y71 PolarHBondContact O-N 2.95Å
68	L	65.7	Low	67.8	Low	113 Å²	113	102.9 Å²	102.9	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-64.6	-44.2	179.2	-177.9	69.1	0	0	0	110.7	D64 L65 Y71 S72	D64-L68 WeakPolarHBondContact O-CB 3.5Å; D64-L68 PolarHBondContact O-N 3.36Å; L65-L68 PolarHBondContact O-N 3.33Å; L68-Y71 PolarHBondContact O-N 2.87Å; L68-S72 PolarHBondContact O-N 3.29Å
69	L	65.8	Low	67.9	Low	125 Å²	125	105.5 Å²	105.5	65%	0.654	54%	0.541	S	S	*	.	H	α-helix	trans	-61.8	-47.1	174.5	-171.8	66.9	0	0	0	110.9	L65 Y71 S72 T73	L65-L69 WeakPolarHBondContact O-CB 3.22Å; L65-L69 PolarHBondContact O-N 3.13Å; L69-Y71 VanDerWaalsContact C-N 3.29Å; L69-Y71 PolarHBondContact O-N 3.26Å; L69-S72 PolarHBondContact O-N 3.38Å; L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 VanDerWaalsContact O-N 3.13Å; L69-T73 PolarHBondContact O-OG1 3.04Å
70	A	68.9	Low	68.4	Low	62 Å²	62	107.5 Å²	107.5	51%	0.512	55%	0.547	S	S	.	.	H	α-helix	trans	-60.3	-38.5	174.7	0	0	0	0	0	112.4	K66 K67 K74	K66-A70 WeakPolarHBondContact O-CB 3.49Å; K66-A70 PolarHBondContact O-N 2.8Å; K66-A70 VanDerWaalsContact O-N 3.14Å; K67-A70 PolarHBondContact O-N 3.33Å; A70-K74 VanDerWaalsContact O-CB 3.22Å; A70-K74 WeakPolarHBondContact O-CB 3.45Å; A70-K74 PolarHBondContact O-N 2.77Å
71	Y	69.2	Low	69	Low	171 Å²	171	106.4 Å²	106.4	67%	0.671	55%	0.547	S	S	*	.	H	α-helix	trans	-70.3	-35.8	178.6	-146.7	-88.1	0	0	0	112	K67 L68 L69 K74 S75	K67-Y71 WeakPolarHBondContact O-CB 3.17Å; K67-Y71 PolarHBondContact O-N 2.95Å; L68-Y71 PolarHBondContact O-N 2.87Å; L69-Y71 VanDerWaalsContact C-N 3.29Å; L69-Y71 PolarHBondContact O-N 3.26Å; Y71-K74 PolarHBondContact O-N 3.38Å; Y71-S75 WeakPolarHBondContact O-CB 3.39Å; Y71-S75 PolarHBondContact O-N 3.23Å; Y71-S75 PolarHBondContact O-OG 3.34Å
72	S	70.2	Confident	69.6	Low	73 Å²	73	108.6 Å²	108.6	51%	0.51	56%	0.555	S	S	.	*	H	α-helix	trans	-69.5	-38	177.4	-170.1	0	0	0	0	112.6	L68 L69 S75 Q76	L68-S72 PolarHBondContact O-N 3.29Å; L69-S72 PolarHBondContact O-N 3.38Å; S72-S75 PolarHBondContact O-OG 3.46Å; S72-Q76 PolarHBondContact O-N 3.46Å; S72-Q76 VanDerWaalsContact O-N 3.08Å
73	T	72.9	Confident	70.1	Confident	86 Å²	86	110 Å²	110	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-71.7	-40.1	172.9	-52	0	0	0	0	110.9	L69 S75 Q76 S77	L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 VanDerWaalsContact O-N 3.13Å; L69-T73 PolarHBondContact O-OG1 3.04Å; T73-S75 VanDerWaalsContact C-N 3.32Å; T73-S75 PolarHBondContact O-N 3.38Å; T73-Q76 PolarHBondContact O-N 3.41Å; T73-S77 PolarHBondContact O-N 3.43Å; T73-S77 PolarHBondContact O-OG 2.91Å
74	K	69.4	Low	70.6	Confident	144 Å²	144	110.1 Å²	110.1	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-60.2	-42.2	174.6	-172.5	176.3	-179.1	175.7	0	111.2	A70 Y71 S77 A78	A70-K74 VanDerWaalsContact O-CB 3.22Å; A70-K74 WeakPolarHBondContact O-CB 3.45Å; A70-K74 PolarHBondContact O-N 2.77Å; Y71-K74 PolarHBondContact O-N 3.38Å; K74-S77 PolarHBondContact O-N 2.96Å; K74-S77 PolarHBondContact O-OG 2.82Å; K74-A78 WeakPolarHBondContact O-CB 3.36Å; K74-A78 PolarHBondContact O-N 3.41Å
75	S	72.1	Confident	70.3	Confident	45 Å²	45	117.8 Å²	117.8	32%	0.315	61%	0.606	S	S	.	*	H	α-helix	trans	-67.9	-40.2	177.3	69.2	0	0	0	0	112.1	Y71 S72 T73 S77 A78 L79	Y71-S75 WeakPolarHBondContact O-CB 3.39Å; Y71-S75 PolarHBondContact O-N 3.23Å; Y71-S75 PolarHBondContact O-OG 3.34Å; S72-S75 PolarHBondContact O-OG 3.46Å; T73-S75 VanDerWaalsContact C-N 3.32Å; T73-S75 PolarHBondContact O-N 3.38Å; S75-S77 PolarHBondContact O-N 3.23Å; S75-A78 PolarHBondContact O-N 3.33Å; S75-L79 WeakPolarHBondContact O-CB 3.36Å; S75-L79 VanDerWaalsContact O-CG 3.23Å; S75-L79 WeakPolarHBondContact O-CG 3.23Å; S75-L79 PolarHBondContact O-N 2.95Å
76	Q	71.9	Confident	70.6	Confident	133 Å²	133	118.4 Å²	118.4	62%	0.621	61%	0.609	S	S	*	*	H	α-helix	trans	-60.3	-44.8	173.9	-170.4	-178.8	16.8	0	0	111.5	S72 T73 A78 L79 V80	S72-Q76 PolarHBondContact O-N 3.46Å; S72-Q76 VanDerWaalsContact O-N 3.08Å; T73-Q76 PolarHBondContact O-N 3.41Å; Q76-A78 PolarHBondContact O-N 3.31Å; Q76-L79 PolarHBondContact O-N 3.08Å; Q76-V80 WeakPolarHBondContact O-CG2 3.48Å; Q76-V80 PolarHBondContact O-N 3.41Å
77	S	69.6	Low	71	Confident	66 Å²	66	117.4 Å²	117.4	46%	0.462	61%	0.61	S	S	.	*	H	α-helix	trans	-64.1	-38.2	175.7	69.3	0	0	0	0	112.6	T73 K74 S75 I81	T73-S77 PolarHBondContact O-N 3.43Å; T73-S77 PolarHBondContact O-OG 2.91Å; K74-S77 PolarHBondContact O-N 2.96Å; K74-S77 PolarHBondContact O-OG 2.82Å; S75-S77 PolarHBondContact O-N 3.23Å; S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.96Å
78	A	77	Confident	71.4	Confident	54 Å²	54	116.5 Å²	116.5	45%	0.446	61%	0.611	S	S	.	*	H	α-helix	trans	-68.9	-39.7	176.6	0	0	0	0	0	112.7	K74 S75 Q76 V80 I81 Y82	K74-A78 WeakPolarHBondContact O-CB 3.36Å; K74-A78 PolarHBondContact O-N 3.41Å; S75-A78 PolarHBondContact O-N 3.33Å; Q76-A78 PolarHBondContact O-N 3.31Å; A78-V80 PolarHBondContact O-N 3.48Å; A78-I81 PolarHBondContact O-N 3.01Å; A78-Y82 PolarHBondContact O-N 3.03Å
79	L	73.6	Confident	71.7	Confident	104 Å²	104	116.7 Å²	116.7	55%	0.545	61%	0.612	S	S	.	*	H	α-helix	trans	-65.9	-35.7	179.2	-75.4	171.4	0	0	0	112.6	S75 Q76 Y82 N83	S75-L79 WeakPolarHBondContact O-CB 3.36Å; S75-L79 VanDerWaalsContact O-CG 3.23Å; S75-L79 WeakPolarHBondContact O-CG 3.23Å; S75-L79 PolarHBondContact O-N 2.95Å; Q76-L79 PolarHBondContact O-N 3.08Å; L79-Y82 PolarHBondContact O-N 3.4Å; L79-N83 PolarHBondContact O-N 3.49Å; L79-N83 PolarHBondContact O-ND2 3.19Å
80	V	79.1	Confident	72.1	Confident	97 Å²	97	116.2 Å²	116.2	59%	0.588	61%	0.61	S	S	*	*	H	α-helix	trans	-66.3	-40.9	175.9	173.4	0	0	0	0	110.9	Q76 A78 L84	Q76-V80 WeakPolarHBondContact O-CG2 3.48Å; Q76-V80 PolarHBondContact O-N 3.41Å; A78-V80 PolarHBondContact O-N 3.48Å; V80-L84 PolarHBondContact O-N 3.43Å
81	I	79.8	Confident	72.3	Confident	124 Å²	124	119.8 Å²	119.8	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-67.6	-40.9	175.9	-62.8	167.9	0	0	0	110.7	S77 A78 N83 L84	S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.96Å; A78-I81 PolarHBondContact O-N 3.01Å; I81-N83 PolarHBondContact O-N 3.47Å; I81-L84 PolarHBondContact O-N 3.21Å
82	Y	74.9	Confident	72.5	Confident	183 Å²	183	116.1 Å²	116.1	72%	0.718	61%	0.612	S	S	*	*	H	α-helix	trans	-65.6	-33.9	178.2	-179	-96.3	0	0	0	113.2	A78 L79 L84	A78-Y82 PolarHBondContact O-N 3.03Å; L79-Y82 PolarHBondContact O-N 3.4Å; Y82-L84 VanDerWaalsContact C-N 3.28Å; Y82-L84 PolarHBondContact O-N 3.47Å
83	N	75.9	Confident	72.7	Confident	130 Å²	130	119.5 Å²	119.5	70%	0.695	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-9.1	175.8	-86.6	-93.2	0	0	0	114	L79 I81	L79-N83 PolarHBondContact O-N 3.49Å; L79-N83 PolarHBondContact O-ND2 3.19Å; I81-N83 PolarHBondContact O-N 3.47Å
84	L	71.7	Confident	72.7	Confident	155 Å²	155	122.3 Å²	122.3	81%	0.812	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-7.6	-176.2	-167.1	69.8	0	0	0	113.4	V80 I81 Y82	V80-L84 PolarHBondContact O-N 3.43Å; I81-L84 PolarHBondContact O-N 3.21Å; Y82-L84 VanDerWaalsContact C-N 3.28Å; Y82-L84 PolarHBondContact O-N 3.47Å
85	H	57	Low	73	Confident	232 Å²	232	120.3 Å²	120.3	100%	1.074	63%	0.628	S	S	*	*			trans	-118.5	0	171.8	-172.9	74.5	0	0	0	109.9

Retrieved 85 of 85 residues in 606.1 ms (Link to these results)

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