A0A077ZLV6_TRITR Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A0A077ZLV6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 83 aa.

						>A0A077ZLV6_TRITR|A0A077ZLV6
MNLTLAECGRTPFDLLEAEGELVSGYNVGYSCVEFPFLLITEYRIIILLSILVSLIVVPQIVSLASSIIITRILFLGYTLQRL
					

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	62.3	Low	71.9	Confident	104 Å²	104	59.8 Å²	59.8	51%	0.512	32%	0.324	S	S	.	.				0	-37.4	0	-157.4	162.2	-176.4	0	0	112.4	L3 T4 L5 R72 I73 L76	M1-L3 PolarHBondContact O-N 2.95Å; M1-T4 WeakPolarHBondContact CA-OG1 3.49Å; M1-T4 PolarHBondContact O-N 2.99Å; M1-T4 PolarHBondContact O-OG1 3.47Å; M1-L5 HydrophobicContact CG-CD1 3.93Å; M1-L5 HydrophobicContact CG-CG 4.41Å; M1-L5 WeakPolarHBondContact O-CD1 3.42Å; M1-L5 WeakPolarHBondContact O-CG 3.31Å; M1-L5 PolarHBondContact O-N 3.45Å; M1-R72 VanDerWaalsContact CE-C 3.49Å; M1-R72 HydrophobicContact CE-CB 3.61Å; M1-I73 HydrophobicContact CE-CG1 4.11Å; M1-L76 HydrophobicContact CE-CD1 3.24Å; M1-L76 HydrophobicContact CE-CG 3.95Å; M1-L76 HydrophobicContact CG-CD1 4.12Å; M1-L76 HydrophobicContact SD-CD1 3.37Å; M1-L76 WeakPolarHBondContact SD-CD1 3.41Å; M1-L76 HydrophobicContact SD-CG 4.48Å
2	N	67.7	Low	71.1	Confident	117 Å²	117	56 Å²	56	63%	0.626	31%	0.305	S	S	*	.	H	α-helix	trans	-61.9	-42.6	-179.9	-63.7	-1.1	0	0	0	113.8	T4 L5 A6	N2-T4 VanDerWaalsContact C-N 3.31Å; N2-T4 PolarHBondContact O-N 3.1Å; N2-L5 PolarHBondContact O-N 2.89Å; N2-A6 PolarHBondContact O-N 3.04Å
3	L	74.1	Confident	71	Confident	129 Å²	129	57.5 Å²	57.5	68%	0.675	31%	0.307	S	S	*	.	H	α-helix	trans	-60.1	-42.1	175.5	-179.3	63.1	0	0	0	111.9	M1 L5 A6 E7	M1-L3 PolarHBondContact O-N 2.95Å; L3-L5 VanDerWaalsContact C-N 3.33Å; L3-L5 PolarHBondContact O-N 3.34Å; L3-A6 PolarHBondContact O-N 3.07Å; L3-E7 HydrophobicContact CD1-CG 4.37Å; L3-E7 WeakPolarHBondContact O-CG 3.3Å; L3-E7 PolarHBondContact O-N 3.47Å
4	T	76.5	Confident	71.1	Confident	22 Å²	22	55.4 Å²	55.4	14%	0.135	30%	0.295	C	S	.	.	H	α-helix	trans	-68.9	-32.8	178.8	54.3	0	0	0	0	112.3	M1 N2 C8 L49 V53	M1-T4 WeakPolarHBondContact CA-OG1 3.49Å; M1-T4 PolarHBondContact O-N 2.99Å; M1-T4 PolarHBondContact O-OG1 3.47Å; N2-T4 VanDerWaalsContact C-N 3.31Å; N2-T4 PolarHBondContact O-N 3.1Å; T4-C8 WeakPolarHBondContact O-CB 3.29Å; T4-C8 PolarHBondContact O-N 3.28Å; T4-C8 PolarHBondContact O-SG 3.39Å; T4-L49 HydrophobicContact CG2-CD2 3.96Å; T4-L49 HydrophobicContact CG2-CG 4.16Å; T4-V53 HydrophobicContact CG2-CG2 3.62Å
5	L	74	Confident	70.8	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-69	-40.1	174	-76.1	155.2	0	0	0	111.8	M1 N2 L3 C8 G9 R10 F13 L76	M1-L5 HydrophobicContact CG-CD1 3.93Å; M1-L5 HydrophobicContact CG-CG 4.41Å; M1-L5 WeakPolarHBondContact O-CD1 3.42Å; M1-L5 WeakPolarHBondContact O-CG 3.31Å; M1-L5 PolarHBondContact O-N 3.45Å; N2-L5 PolarHBondContact O-N 2.89Å; L3-L5 VanDerWaalsContact C-N 3.33Å; L3-L5 PolarHBondContact O-N 3.34Å; L5-C8 PolarHBondContact O-N 3.49Å; L5-G9 PolarHBondContact O-N 3.36Å; L5-R10 PolarHBondContact O-N 3.31Å; L5-F13 HydrophobicContact CB-CD2 4.11Å; L5-F13 HydrophobicContact CB-CE2 4.36Å; L5-L76 HydrophobicContact CD1-CD1 3.92Å; L5-L76 HydrophobicContact CD2-CB 4.48Å
6	A	77.1	Confident	70.5	Confident	45 Å²	45	63.5 Å²	63.5	37%	0.372	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-47	178.6	0	0	0	0	0	112.2	N2 L3 C8 G9 F13	N2-A6 PolarHBondContact O-N 3.04Å; L3-A6 PolarHBondContact O-N 3.07Å; A6-C8 VanDerWaalsContact C-N 3.27Å; A6-C8 PolarHBondContact O-N 3.32Å; A6-G9 PolarHBondContact O-N 3.47Å; A6-F13 HydrophobicContact CB-CB 4.49Å; A6-F13 HydrophobicContact CB-CD2 4.03Å; A6-F13 HydrophobicContact CB-CE2 4.44Å; A6-F13 HydrophobicContact CB-CG 4.14Å
7	E	72.2	Confident	70.4	Confident	129 Å²	129	61.5 Å²	61.5	60%	0.603	33%	0.326	S	S	*	.	H	α-helix	trans	-67.8	-25.2	177.6	-68.4	-69.1	164.8	0	0	113.2	L3 G9 L49	L3-E7 HydrophobicContact CD1-CG 4.37Å; L3-E7 WeakPolarHBondContact O-CG 3.3Å; L3-E7 PolarHBondContact O-N 3.47Å; E7-G9 VanDerWaalsContact C-N 3.32Å; E7-L49 HydrophobicContact CB-CD2 4.01Å
8	C	71.8	Confident	70	Confident	9 Å²	9	58.4 Å²	58.4	6%	0.061	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3	177.7	-70.1	0	0	0	0	113.8	T4 L5 A6 R10 I46	T4-C8 WeakPolarHBondContact O-CB 3.29Å; T4-C8 PolarHBondContact O-N 3.28Å; T4-C8 PolarHBondContact O-SG 3.39Å; L5-C8 PolarHBondContact O-N 3.49Å; A6-C8 VanDerWaalsContact C-N 3.27Å; A6-C8 PolarHBondContact O-N 3.32Å; C8-R10 HydrophobicContact CB-CG 4.17Å; C8-R10 PolarHBondContact O-N 2.9Å; C8-I46 HydrophobicContact CB-CG1 3.93Å
9	G	70.7	Confident	69.6	Low	18 Å²	18	62.6 Å²	62.6	19%	0.186	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	26.1	-177.7	0	0	0	0	0	114	L5 A6 E7 D14	L5-G9 PolarHBondContact O-N 3.36Å; A6-G9 PolarHBondContact O-N 3.47Å; E7-G9 VanDerWaalsContact C-N 3.32Å; G9-D14 WeakPolarHBondContact O-CA 3.38Å; G9-D14 VanDerWaalsContact O-CB 3.24Å; G9-D14 WeakPolarHBondContact O-CB 3.41Å
10	R	75.1	Confident	69.2	Low	52 Å²	52	63.3 Å²	63.3	20%	0.196	35%	0.351	C	S	.	.			trans	-95.8	151.9	-178.6	-68.3	-67.1	169.4	146.9	-7.6	111.3	L5 C8 F13 D14 I46	L5-R10 PolarHBondContact O-N 3.31Å; C8-R10 HydrophobicContact CB-CG 4.17Å; C8-R10 PolarHBondContact O-N 2.9Å; R10-F13 CarbonylContact O-C 3.59Å; R10-F13 WeakPolarHBondContact O-CA 3.16Å; R10-F13 PolarHBondContact O-N 2.91Å; R10-D14 PolarHBondContact O-N 2.92Å; R10-I46 HydrophobicContact CG-CD1 4.4Å
11	T	69.2	Low	68.8	Low	31 Å²	31	65.8 Å²	65.8	19%	0.19	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46	126.7	171.6	47.2	0	0	0	0	109.8	D14 G77 R82	T11-D14 HydrophobicContact CG2-CB 4.2Å; T11-G77 VanDerWaalsContact OG1-CA 3.28Å; T11-G77 WeakPolarHBondContact OG1-CA 3.08Å; T11-G77 PolarHBondContact OG1-O 3.23Å; T11-R82 HydrophobicContact CG2-CB 4.43Å
12	P	62.7	Low	68.6	Low	14 Å²	14	69.8 Å²	69.8	9%	0.091	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	-2.4	15	35.3	-36.9	0	0	0	116.6	L83	P12-L83 HydrophobicContact CB-CB 4.08Å; P12-L83 HydrophobicContact CB-CD1 3.72Å; P12-L83 HydrophobicContact CB-CG 3.64Å; P12-L83 HydrophobicContact CG-CD1 3.92Å; P12-L83 HydrophobicContact CG-CG 4.36Å; P12-L83 PolarHBondContact O-N 3.03Å
13	F	69.1	Low	67.9	Low	75 Å²	75	69.1 Å²	69.1	33%	0.329	38%	0.382	S	S	.	.	S	Bend	trans	-97.9	20.2	-174.3	-57.2	-70.8	0	0	0	114.1	L5 A6 R10 L15 L83	L5-F13 HydrophobicContact CB-CD2 4.11Å; L5-F13 HydrophobicContact CB-CE2 4.36Å; A6-F13 HydrophobicContact CB-CB 4.49Å; A6-F13 HydrophobicContact CB-CD2 4.03Å; A6-F13 HydrophobicContact CB-CE2 4.44Å; A6-F13 HydrophobicContact CB-CG 4.14Å; R10-F13 CarbonylContact O-C 3.59Å; R10-F13 WeakPolarHBondContact O-CA 3.16Å; R10-F13 PolarHBondContact O-N 2.91Å; F13-L15 PolarHBondContact O-N 3.45Å; F13-L83 HydrophobicContact CE1-CD1 4.11Å; F13-L83 HydrophobicContact CZ-CD1 4.47Å
14	D	72.4	Confident	67.1	Low	28 Å²	28	65.5 Å²	65.5	15%	0.15	37%	0.368	C	S	.	.			trans	-78.4	69.6	176.8	-174.4	7.8	0	0	0	111	G9 R10 T11 E17 R82	G9-D14 WeakPolarHBondContact O-CA 3.38Å; G9-D14 VanDerWaalsContact O-CB 3.24Å; G9-D14 WeakPolarHBondContact O-CB 3.41Å; R10-D14 PolarHBondContact O-N 2.92Å; T11-D14 HydrophobicContact CG2-CB 4.2Å; D14-E17 WeakPolarHBondContact OD1-CB 3.49Å; D14-E17 PolarHBondContact OD1-N 2.95Å; D14-R82 VanDerWaalsContact O-CZ 3.28Å; D14-R82 PolarHBondContact O-NE 3.11Å; D14-R82 PolarHBondContact O-NH2 2.91Å
15	L	66.6	Low	66.8	Low	118 Å²	118	65.9 Å²	65.9	62%	0.618	38%	0.376	S	S	*	.			trans	-86.9	-21.3	-178.8	-64.6	175.6	0	0	0	112.5	F13	F13-L15 PolarHBondContact O-N 3.45Å
16	L	66.9	Low	66.9	Low	123 Å²	123	69.1 Å²	69.1	64%	0.644	39%	0.389	S	S	*	.	S	Bend	trans	-86.7	-44.5	-171.6	-64.8	170.6	0	0	0	111.5	G25 Y26	L16-G25 WeakPolarHBondContact O-CA 3.42Å; L16-Y26 HydrophobicContact CB-CD1 3.76Å; L16-Y26 HydrophobicContact CB-CE1 3.81Å; L16-Y26 VanDerWaalsContact O-CD1 3.29Å; L16-Y26 WeakPolarHBondContact O-CD1 3.42Å; L16-Y26 PolarHBondContact O-N 3.2Å
17	E	68.8	Low	66.9	Low	30 Å²	30	67.6 Å²	67.6	14%	0.14	37%	0.374	C	S	.	.	S	Bend	trans	-78.4	-34.8	-175.1	-153.2	167.2	-161.2	0	0	111.6	D14 E19 G25 Y26 N27	D14-E17 WeakPolarHBondContact OD1-CB 3.49Å; D14-E17 PolarHBondContact OD1-N 2.95Å; E17-E19 HydrophobicContact CG-CG 4.06Å; E17-E19 PolarHBondContact O-N 3.3Å; E17-G25 PolarHBondContact O-N 3.43Å; E17-Y26 HydrophobicContact CB-CE1 4.13Å; E17-Y26 HydrophobicContact CG-CE1 4.34Å; E17-N27 VanDerWaalsContact CG-ND2 3.26Å; E17-N27 WeakPolarHBondContact CG-ND2 3.26Å; E17-N27 PolarHBondContact OE1-ND2 2.96Å
18	A	63.4	Low	67	Low	5 Å²	5	65.7 Å²	65.7	4%	0.041	37%	0.371	C	S	.	.			trans	40.4	37.4	167.7	0	0	0	0	0	115	G20 E21 R82	A18-G20 PolarHBondContact O-N 3.23Å; A18-E21 HydrophobicContact CB-CB 4.32Å; A18-E21 PolarHBondContact O-N 3.09Å; A18-R82 VanDerWaalsContact CB-NH2 3.29Å
19	E	62.4	Low	67.4	Low	138 Å²	138	68.5 Å²	68.5	65%	0.645	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15	-177.6	-59.6	-163.3	145.1	0	0	113.2	E17	E17-E19 HydrophobicContact CG-CG 4.06Å; E17-E19 PolarHBondContact O-N 3.3Å
20	G	61.5	Low	67.9	Low	77 Å²	77	72.8 Å²	72.8	79%	0.794	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.7	173.9	0	0	0	0	0	115.4	A18	A18-G20 PolarHBondContact O-N 3.23Å
21	E	60.5	Low	68.2	Low	116 Å²	116	74.3 Å²	74.3	54%	0.542	43%	0.432	S	S	.	.	S	Bend	trans	-102.5	165.6	177.1	-72	169.7	-136.6	0	0	111.6	A18 V23 R82	A18-E21 HydrophobicContact CB-CB 4.32Å; A18-E21 PolarHBondContact O-N 3.09Å; E21-V23 PolarHBondContact O-N 2.94Å; E21-R82 IonicContact OE1-CZ 3.18Å; E21-R82 IonicContact OE1-NH1 2.75Å; E21-R82 PolarHBondContact OE1-NH1 3.26Å; E21-R82 IonicContact OE1-NH2 2.82Å; E21-R82 PolarHBondContact OE1-NH2 3.37Å
22	L	57.2	Low	68.8	Low	187 Å²	187	78.6 Å²	78.6	98%	0.979	46%	0.462	S	S	*	.	S	Bend	trans	-60.1	-12.6	-170.3	-70.5	167.5	0	0	0	115
23	V	53.9	Low	70	Confident	104 Å²	104	82.8 Å²	82.8	63%	0.63	49%	0.487	S	S	*	.	S	Bend	trans	-136.2	116	177.6	-175.2	0	0	0	0	105.3	E21 G25	E21-V23 PolarHBondContact O-N 2.94Å; V23-G25 PolarHBondContact O-N 3.41Å
24	S	57.7	Low	70.8	Confident	53 Å²	53	84 Å²	84	37%	0.371	49%	0.494	S	S	.	.			trans	-55.4	133.6	169.6	31.3	0	0	0	0	107.3	V28	S24-V28 WeakPolarHBondContact O-CG2 3.12Å; S24-V28 WeakPolarHBondContact OG-CG2 3.44Å
25	G	70.4	Confident	71.4	Confident	30 Å²	30	86.3 Å²	86.3	31%	0.309	50%	0.502	S	S	.	.			trans	-68.1	-112.4	-159.2	0	0	0	0	0	114	L16 E17 V23 N27	L16-G25 WeakPolarHBondContact O-CA 3.42Å; E17-G25 PolarHBondContact O-N 3.43Å; V23-G25 PolarHBondContact O-N 3.41Å; G25-N27 PolarHBondContact O-N 3.42Å
26	Y	74.6	Confident	72.4	Confident	69 Å²	69	83.4 Å²	83.4	27%	0.271	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-70.5	-15.7	-177.8	70.9	-76.7	0	0	0	113.3	L16 E17 V28 Y30 L38 E42	L16-Y26 HydrophobicContact CB-CD1 3.76Å; L16-Y26 HydrophobicContact CB-CE1 3.81Å; L16-Y26 VanDerWaalsContact O-CD1 3.29Å; L16-Y26 WeakPolarHBondContact O-CD1 3.42Å; L16-Y26 PolarHBondContact O-N 3.2Å; E17-Y26 HydrophobicContact CB-CE1 4.13Å; E17-Y26 HydrophobicContact CG-CE1 4.34Å; Y26-V28 VanDerWaalsContact C-N 3.35Å; Y26-V28 PolarHBondContact O-N 3.4Å; Y26-Y30 HydrophobicContact CD2-CE2 4.06Å; Y26-Y30 WeakPolarHBondContact O-CD2 3.46Å; Y26-Y30 WeakPolarHBondContact O-CE2 3.42Å; Y26-L38 HydrophobicContact CD2-CD1 3.48Å; Y26-L38 VanDerWaalsContact CD2-CD1 3.48Å; Y26-L38 HydrophobicContact CD2-CD2 4.46Å; Y26-L38 HydrophobicContact CD2-CG 4.18Å; Y26-L38 HydrophobicContact CE2-CD1 3.19Å; Y26-L38 HydrophobicContact CE2-CD2 3.46Å; Y26-L38 VanDerWaalsContact CE2-CD2 3.46Å; Y26-L38 HydrophobicContact CE2-CG 3.36Å; Y26-L38 WeakPolarHBondContact OH-CD2 3.35Å; Y26-E42 PolarHBondContact OH-OE1 3.01Å
27	N	77.9	Confident	73.4	Confident	13 Å²	13	83.7 Å²	83.7	7%	0.07	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-70.4	-20.7	-177.2	-68.9	-4	0	0	0	115.1	E17 G25 G29 Y30 F35 L38	E17-N27 VanDerWaalsContact CG-ND2 3.26Å; E17-N27 WeakPolarHBondContact CG-ND2 3.26Å; E17-N27 PolarHBondContact OE1-ND2 2.96Å; G25-N27 PolarHBondContact O-N 3.42Å; N27-G29 VanDerWaalsContact C-N 3.3Å; N27-G29 PolarHBondContact O-N 2.71Å; N27-Y30 PolarHBondContact O-N 3.24Å; N27-F35 HydrophobicContact CB-CD2 4.35Å; N27-F35 HydrophobicContact CB-CE2 4.16Å; N27-L38 VanDerWaalsContact OD1-CD2 3.27Å; N27-L38 WeakPolarHBondContact OD1-CD2 3.43Å
28	V	75.2	Confident	74.2	Confident	89 Å²	89	83.2 Å²	83.2	54%	0.539	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-65.8	-30	-172.8	169.4	0	0	0	0	113.7	S24 Y26 Y30	S24-V28 WeakPolarHBondContact O-CG2 3.12Å; S24-V28 WeakPolarHBondContact OG-CG2 3.44Å; Y26-V28 VanDerWaalsContact C-N 3.35Å; Y26-V28 PolarHBondContact O-N 3.4Å; V28-Y30 VanDerWaalsContact C-N 3.33Å
29	G	78.4	Confident	75.1	Confident	68 Å²	68	85 Å²	85	70%	0.701	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-80.8	-11.9	-177	0	0	0	0	0	114.5	N27	N27-G29 VanDerWaalsContact C-N 3.3Å; N27-G29 PolarHBondContact O-N 2.71Å
30	Y	81.9	Confident	76.4	Confident	108 Å²	108	82.6 Å²	82.6	42%	0.424	48%	0.484	S	S	.	.			trans	-93.2	134.2	-168.9	-68	-75.1	0	0	0	112.4	Y26 N27 V28 E34 L38	Y26-Y30 HydrophobicContact CD2-CE2 4.06Å; Y26-Y30 WeakPolarHBondContact O-CD2 3.46Å; Y26-Y30 WeakPolarHBondContact O-CE2 3.42Å; N27-Y30 PolarHBondContact O-N 3.24Å; V28-Y30 VanDerWaalsContact C-N 3.33Å; Y30-E34 HydrophobicContact CD1-CB 3.58Å; Y30-E34 HydrophobicContact CD1-CG 4.45Å; Y30-E34 HydrophobicContact CE1-CB 4.49Å; Y30-E34 HydrophobicContact CG-CB 4.26Å; Y30-L38 HydrophobicContact CD2-CD1 3.42Å; Y30-L38 VanDerWaalsContact CD2-CD1 3.42Å; Y30-L38 HydrophobicContact CE1-CD1 4.46Å; Y30-L38 HydrophobicContact CE2-CD1 3.28Å; Y30-L38 HydrophobicContact CG-CD1 4.07Å
31	S	81.8	Confident	77.6	Confident	84 Å²	84	82.3 Å²	82.3	59%	0.587	47%	0.467	S	S	*	.			trans	-80.4	172.5	175.5	-67	0	0	0	0	111.8	V33 E34 F35	S31-V33 PolarHBondContact O-N 3.03Å; S31-E34 PolarHBondContact N-OE2 3.45Å; S31-E34 PolarHBondContact O-N 3.25Å; S31-F35 PolarHBondContact O-N 3.32Å; S31-F35 VanDerWaalsContact O-N 3.13Å
32	C	82.6	Confident	78.7	Confident	121 Å²	121	78.3 Å²	78.3	82%	0.818	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-30.5	-175.2	-59.2	0	0	0	0	115.7	P36	C32-P36 WeakPolarHBondContact O-CD 3.33Å; C32-P36 WeakPolarHBondContact O-CG 3.37Å
33	V	86.9	Confident	80.1	Confident	102 Å²	102	75.1 Å²	75.1	62%	0.618	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-37.8	-177.9	178.8	0	0	0	0	112	S31 P36 F37	S31-V33 PolarHBondContact O-N 3.03Å; V33-P36 WeakPolarHBondContact O-CD 3.11Å; V33-F37 HydrophobicContact CG1-CD2 4.37Å; V33-F37 HydrophobicContact CG1-CE2 3.92Å; V33-F37 WeakPolarHBondContact O-CD2 3.29Å
34	E	86	Confident	81.8	Confident	102 Å²	102	78.3 Å²	78.3	48%	0.477	43%	0.425	S	S	.	.	H	α-helix	trans	-78.8	-34.5	-173.9	-60.6	172	150.5	0	0	111.5	Y30 S31 F37 L38	Y30-E34 HydrophobicContact CD1-CB 3.58Å; Y30-E34 HydrophobicContact CD1-CG 4.45Å; Y30-E34 HydrophobicContact CE1-CB 4.49Å; Y30-E34 HydrophobicContact CG-CB 4.26Å; S31-E34 PolarHBondContact N-OE2 3.45Å; S31-E34 PolarHBondContact O-N 3.25Å; E34-F37 PolarHBondContact O-N 2.84Å; E34-F37 VanDerWaalsContact O-N 3.11Å; E34-L38 PolarHBondContact O-N 3.46Å; E34-L38 VanDerWaalsContact O-N 3.1Å
35	F	85	Confident	83.3	Confident	76 Å²	76	79.5 Å²	79.5	33%	0.333	43%	0.426	S	S	.	.	H	α-helix	trans	-57.8	-47.1	179	175	-100.6	0	0	0	113.5	N27 S31 F37 L38 L39	N27-F35 HydrophobicContact CB-CD2 4.35Å; N27-F35 HydrophobicContact CB-CE2 4.16Å; S31-F35 PolarHBondContact O-N 3.32Å; S31-F35 VanDerWaalsContact O-N 3.13Å; F35-F37 VanDerWaalsContact C-N 3.32Å; F35-F37 PolarHBondContact O-N 3.43Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 2.66Å; F35-L39 HydrophobicContact CD1-CD1 4.13Å; F35-L39 HydrophobicContact CE1-CD1 3.46Å; F35-L39 VanDerWaalsContact CE1-CD1 3.46Å; F35-L39 HydrophobicContact CE1-CG 4.32Å; F35-L39 HydrophobicContact CE2-CD1 4.28Å; F35-L39 HydrophobicContact CE2-CG 4.36Å; F35-L39 HydrophobicContact CZ-CD1 3.55Å; F35-L39 HydrophobicContact CZ-CD2 4.45Å; F35-L39 HydrophobicContact CZ-CG 4.1Å; F35-L39 PolarHBondContact O-N 3.25Å; F35-L39 VanDerWaalsContact O-N 3.16Å
36	P	87.5	Confident	84.1	Confident	56 Å²	56	78.5 Å²	78.5	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-58.1	-38.4	172.5	-27.2	33.9	0	0	0	114.3	C32 V33 L38 L39 I40	C32-P36 WeakPolarHBondContact O-CD 3.33Å; C32-P36 WeakPolarHBondContact O-CG 3.37Å; V33-P36 WeakPolarHBondContact O-CD 3.11Å; P36-L38 VanDerWaalsContact C-N 3.31Å; P36-L38 PolarHBondContact O-N 2.97Å; P36-L39 PolarHBondContact O-N 3.21Å; P36-I40 WeakPolarHBondContact O-CB 3.5Å; P36-I40 WeakPolarHBondContact O-CD1 3.35Å; P36-I40 WeakPolarHBondContact O-CG1 3.26Å; P36-I40 PolarHBondContact O-N 3.41Å
37	F	87.8	Confident	84.8	Confident	130 Å²	130	79.4 Å²	79.4	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-67.5	-35.6	-180	-76.9	-66	0	0	0	112.5	V33 E34 F35 T41	V33-F37 HydrophobicContact CG1-CD2 4.37Å; V33-F37 HydrophobicContact CG1-CE2 3.92Å; V33-F37 WeakPolarHBondContact O-CD2 3.29Å; E34-F37 PolarHBondContact O-N 2.84Å; E34-F37 VanDerWaalsContact O-N 3.11Å; F35-F37 VanDerWaalsContact C-N 3.32Å; F35-F37 PolarHBondContact O-N 3.43Å; F37-T41 WeakPolarHBondContact O-CB 3.3Å; F37-T41 PolarHBondContact O-N 3.36Å; F37-T41 PolarHBondContact O-OG1 3.07Å
38	L	85.1	Confident	85.4	Confident	19 Å²	19	83.9 Å²	83.9	10%	0.099	45%	0.446	C	S	.	.	H	α-helix	trans	-62.6	-52.2	175.2	178.1	158.2	0	0	0	110.8	Y26 N27 Y30 E34 F35 P36 I40 T41 E42	Y26-L38 HydrophobicContact CD2-CD1 3.48Å; Y26-L38 VanDerWaalsContact CD2-CD1 3.48Å; Y26-L38 HydrophobicContact CD2-CD2 4.46Å; Y26-L38 HydrophobicContact CD2-CG 4.18Å; Y26-L38 HydrophobicContact CE2-CD1 3.19Å; Y26-L38 HydrophobicContact CE2-CD2 3.46Å; Y26-L38 VanDerWaalsContact CE2-CD2 3.46Å; Y26-L38 HydrophobicContact CE2-CG 3.36Å; Y26-L38 WeakPolarHBondContact OH-CD2 3.35Å; N27-L38 VanDerWaalsContact OD1-CD2 3.27Å; N27-L38 WeakPolarHBondContact OD1-CD2 3.43Å; Y30-L38 HydrophobicContact CD2-CD1 3.42Å; Y30-L38 VanDerWaalsContact CD2-CD1 3.42Å; Y30-L38 HydrophobicContact CE1-CD1 4.46Å; Y30-L38 HydrophobicContact CE2-CD1 3.28Å; Y30-L38 HydrophobicContact CG-CD1 4.07Å; E34-L38 PolarHBondContact O-N 3.46Å; E34-L38 VanDerWaalsContact O-N 3.1Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 2.66Å; P36-L38 VanDerWaalsContact C-N 3.31Å; P36-L38 PolarHBondContact O-N 2.97Å; L38-I40 PolarHBondContact O-N 3.22Å; L38-T41 WeakPolarHBondContact O-CB 3.48Å; L38-T41 PolarHBondContact O-N 3.45Å; L38-E42 PolarHBondContact O-N 3.23Å; L38-E42 VanDerWaalsContact O-N 3.09Å
39	L	83.3	Confident	86	Confident	43 Å²	43	81.2 Å²	81.2	23%	0.225	43%	0.428	C	S	.	.	H	α-helix	trans	-58.8	-46.6	175.4	-69.9	176.1	0	0	0	111.9	F35 P36 T41 E42 Y43	F35-L39 HydrophobicContact CD1-CD1 4.13Å; F35-L39 HydrophobicContact CE1-CD1 3.46Å; F35-L39 VanDerWaalsContact CE1-CD1 3.46Å; F35-L39 HydrophobicContact CE1-CG 4.32Å; F35-L39 HydrophobicContact CE2-CD1 4.28Å; F35-L39 HydrophobicContact CE2-CG 4.36Å; F35-L39 HydrophobicContact CZ-CD1 3.55Å; F35-L39 HydrophobicContact CZ-CD2 4.45Å; F35-L39 HydrophobicContact CZ-CG 4.1Å; F35-L39 PolarHBondContact O-N 3.25Å; F35-L39 VanDerWaalsContact O-N 3.16Å; P36-L39 PolarHBondContact O-N 3.21Å; L39-T41 PolarHBondContact O-N 2.92Å; L39-E42 PolarHBondContact O-N 3.28Å; L39-Y43 WeakPolarHBondContact O-CD2 3.22Å; L39-Y43 PolarHBondContact O-N 2.89Å
40	I	88.6	Confident	86.4	Confident	88 Å²	88	78 Å²	78	45%	0.451	40%	0.395	S	S	.	.	H	α-helix	trans	-58.6	-39	177.4	-70.4	164	0	0	0	110.6	P36 L38 Y43 R44	P36-I40 WeakPolarHBondContact O-CB 3.5Å; P36-I40 WeakPolarHBondContact O-CD1 3.35Å; P36-I40 WeakPolarHBondContact O-CG1 3.26Å; P36-I40 PolarHBondContact O-N 3.41Å; L38-I40 PolarHBondContact O-N 3.22Å; I40-Y43 PolarHBondContact O-N 2.9Å; I40-R44 HydrophobicContact CG2-CG 4.22Å; I40-R44 WeakPolarHBondContact O-CB 3.33Å; I40-R44 WeakPolarHBondContact O-CG 3.45Å; I40-R44 PolarHBondContact O-N 2.74Å
41	T	88.2	Confident	86.7	Confident	71 Å²	71	76.1 Å²	76.1	44%	0.436	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-44.8	-179.7	-61.7	0	0	0	0	111.3	F37 L38 L39 R44 I45	F37-T41 WeakPolarHBondContact O-CB 3.3Å; F37-T41 PolarHBondContact O-N 3.36Å; F37-T41 PolarHBondContact O-OG1 3.07Å; L38-T41 WeakPolarHBondContact O-CB 3.48Å; L38-T41 PolarHBondContact O-N 3.45Å; L39-T41 PolarHBondContact O-N 2.92Å; T41-R44 WeakPolarHBondContact O-CB 3.27Å; T41-R44 PolarHBondContact O-N 2.87Å; T41-I45 HydrophobicContact CG2-CD1 4.25Å; T41-I45 WeakPolarHBondContact O-CG1 3.35Å; T41-I45 PolarHBondContact O-N 3.18Å
42	E	83.2	Confident	87	Confident	31 Å²	31	76.1 Å²	76.1	15%	0.145	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-47.3	175.4	-66.4	-169.1	135.1	0	0	112.4	Y26 L38 L39 R44 I45 I46	Y26-E42 PolarHBondContact OH-OE1 3.01Å; L38-E42 PolarHBondContact O-N 3.23Å; L38-E42 VanDerWaalsContact O-N 3.09Å; L39-E42 PolarHBondContact O-N 3.28Å; E42-R44 PolarHBondContact O-N 3.12Å; E42-I45 WeakPolarHBondContact O-CB 3.42Å; E42-I45 PolarHBondContact O-N 3.3Å; E42-I45 VanDerWaalsContact O-N 3.08Å; E42-I46 WeakPolarHBondContact O-CG1 3.24Å; E42-I46 PolarHBondContact O-N 2.77Å; E42-I46 VanDerWaalsContact O-N 3.11Å
43	Y	86.8	Confident	87.2	Confident	120 Å²	120	72.1 Å²	72.1	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-61.8	-34.9	177.1	-77.4	-68	0	0	0	111.9	L39 I40 I46 I47	L39-Y43 WeakPolarHBondContact O-CD2 3.22Å; L39-Y43 PolarHBondContact O-N 2.89Å; I40-Y43 PolarHBondContact O-N 2.9Å; Y43-I46 HydrophobicContact CD1-CD1 4.33Å; Y43-I46 PolarHBondContact O-N 3.3Å; Y43-I47 WeakPolarHBondContact O-CG1 3.33Å; Y43-I47 PolarHBondContact O-N 3.41Å
44	R	89.8	Confident	87.3	Confident	172 Å²	172	67.3 Å²	67.3	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-67.1	-37	174.2	-76	177.2	70.1	-168	0.7	112.5	I40 T41 E42 I47 L48	I40-R44 HydrophobicContact CG2-CG 4.22Å; I40-R44 WeakPolarHBondContact O-CB 3.33Å; I40-R44 WeakPolarHBondContact O-CG 3.45Å; I40-R44 PolarHBondContact O-N 2.74Å; T41-R44 WeakPolarHBondContact O-CB 3.27Å; T41-R44 PolarHBondContact O-N 2.87Å; E42-R44 PolarHBondContact O-N 3.12Å; R44-I47 PolarHBondContact O-N 3.06Å; R44-L48 VanDerWaalsContact O-CB 3.27Å; R44-L48 WeakPolarHBondContact O-CB 3.45Å; R44-L48 PolarHBondContact O-N 3.19Å
45	I	88.9	Confident	87.4	Confident	77 Å²	77	66.4 Å²	66.4	40%	0.395	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.5	-70.1	165.3	0	0	0	110.4	T41 E42 I47 L48 L49	T41-I45 HydrophobicContact CG2-CD1 4.25Å; T41-I45 WeakPolarHBondContact O-CG1 3.35Å; T41-I45 PolarHBondContact O-N 3.18Å; E42-I45 WeakPolarHBondContact O-CB 3.42Å; E42-I45 PolarHBondContact O-N 3.3Å; E42-I45 VanDerWaalsContact O-N 3.08Å; I45-I47 PolarHBondContact O-N 2.91Å; I45-L48 PolarHBondContact O-N 3.49Å; I45-L49 VanDerWaalsContact O-CB 3.29Å; I45-L49 WeakPolarHBondContact O-CB 3.48Å; I45-L49 PolarHBondContact O-N 2.97Å
46	I	87.1	Confident	87.6	Confident	10 Å²	10	69.6 Å²	69.6	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-47.8	177	-63.2	167	0	0	0	110.9	C8 R10 E42 Y43 S50 I73	C8-I46 HydrophobicContact CB-CG1 3.93Å; R10-I46 HydrophobicContact CG-CD1 4.4Å; E42-I46 WeakPolarHBondContact O-CG1 3.24Å; E42-I46 PolarHBondContact O-N 2.77Å; E42-I46 VanDerWaalsContact O-N 3.11Å; Y43-I46 HydrophobicContact CD1-CD1 4.33Å; Y43-I46 PolarHBondContact O-N 3.3Å; I46-S50 WeakPolarHBondContact O-CB 3.3Å; I46-S50 PolarHBondContact O-N 3.44Å; I46-S50 PolarHBondContact O-OG 2.94Å; I46-I73 HydrophobicContact CG2-CD1 4.47Å
47	I	88.6	Confident	87.4	Confident	88 Å²	88	72 Å²	72	45%	0.451	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-48.3	179.2	-65.6	166.6	0	0	0	110.2	Y43 R44 I45 L49 S50 I51	Y43-I47 WeakPolarHBondContact O-CG1 3.33Å; Y43-I47 PolarHBondContact O-N 3.41Å; R44-I47 PolarHBondContact O-N 3.06Å; I45-I47 PolarHBondContact O-N 2.91Å; I47-L49 PolarHBondContact O-N 3.45Å; I47-S50 PolarHBondContact O-N 2.94Å; I47-S50 PolarHBondContact O-OG 3.16Å; I47-I51 HydrophobicContact CG2-CD1 3.84Å; I47-I51 WeakPolarHBondContact O-CG1 3.43Å; I47-I51 PolarHBondContact O-N 2.89Å; I47-I51 VanDerWaalsContact O-N 3.07Å
48	L	90.1	Very high	87.4	Confident	106 Å²	106	68.4 Å²	68.4	56%	0.555	35%	0.346	S	S	*	.	H	α-helix	trans	-60.7	-46.5	-179	-176	152.6	0	0	0	111.3	R44 I45 S50 I51 L52	R44-L48 VanDerWaalsContact O-CB 3.27Å; R44-L48 WeakPolarHBondContact O-CB 3.45Å; R44-L48 PolarHBondContact O-N 3.19Å; I45-L48 PolarHBondContact O-N 3.49Å; L48-S50 VanDerWaalsContact C-N 3.32Å; L48-S50 PolarHBondContact O-N 3.41Å; L48-I51 PolarHBondContact O-N 3.29Å; L48-L52 HydrophobicContact CD2-CD1 3.43Å; L48-L52 VanDerWaalsContact CD2-CD1 3.43Å; L48-L52 HydrophobicContact CD2-CG 3.97Å; L48-L52 WeakPolarHBondContact O-CG 3.37Å; L48-L52 PolarHBondContact O-N 2.92Å
49	L	88	Confident	87.5	Confident	34 Å²	34	71.8 Å²	71.8	18%	0.178	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-38.2	179.4	-169.3	61.7	0	0	0	111.4	T4 E7 I45 I47 I51 L52 V53	T4-L49 HydrophobicContact CG2-CD2 3.96Å; T4-L49 HydrophobicContact CG2-CG 4.16Å; E7-L49 HydrophobicContact CB-CD2 4.01Å; I45-L49 VanDerWaalsContact O-CB 3.29Å; I45-L49 WeakPolarHBondContact O-CB 3.48Å; I45-L49 PolarHBondContact O-N 2.97Å; I47-L49 PolarHBondContact O-N 3.45Å; L49-I51 VanDerWaalsContact C-N 3.26Å; L49-I51 PolarHBondContact O-N 3.21Å; L49-L52 PolarHBondContact O-N 3.29Å; L49-V53 HydrophobicContact CD1-CG2 4.33Å; L49-V53 HydrophobicContact CG-CG2 4.31Å; L49-V53 WeakPolarHBondContact O-CB 3.47Å; L49-V53 WeakPolarHBondContact O-CG2 3.41Å; L49-V53 PolarHBondContact O-N 2.97Å
50	S	86.4	Confident	87.5	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.007	40%	0.399	C	S	.	.	H	α-helix	trans	-62	-34.9	175.3	77	0	0	0	0	112.8	I46 I47 L48 S54 I70	I46-S50 WeakPolarHBondContact O-CB 3.3Å; I46-S50 PolarHBondContact O-N 3.44Å; I46-S50 PolarHBondContact O-OG 2.94Å; I47-S50 PolarHBondContact O-N 2.94Å; I47-S50 PolarHBondContact O-OG 3.16Å; L48-S50 VanDerWaalsContact C-N 3.32Å; L48-S50 PolarHBondContact O-N 3.41Å; S50-S54 WeakPolarHBondContact O-CB 3.33Å; S50-S54 PolarHBondContact O-N 3.18Å; S50-S54 PolarHBondContact O-OG 3.45Å; S50-I70 WeakPolarHBondContact OG-CG1 3.41Å
51	I	88.2	Confident	87.5	Confident	68 Å²	68	78 Å²	78	35%	0.349	40%	0.397	S	S	.	.	H	α-helix	trans	-74.9	-42.9	176.4	-64.7	164.6	0	0	0	110.8	I47 L48 L49 V53 S54 L55 V62	I47-I51 HydrophobicContact CG2-CD1 3.84Å; I47-I51 WeakPolarHBondContact O-CG1 3.43Å; I47-I51 PolarHBondContact O-N 2.89Å; I47-I51 VanDerWaalsContact O-N 3.07Å; L48-I51 PolarHBondContact O-N 3.29Å; L49-I51 VanDerWaalsContact C-N 3.26Å; L49-I51 PolarHBondContact O-N 3.21Å; I51-V53 VanDerWaalsContact C-N 3.35Å; I51-V53 PolarHBondContact O-N 3.44Å; I51-S54 WeakPolarHBondContact CA-OG 3.34Å; I51-S54 PolarHBondContact O-N 3.3Å; I51-S54 PolarHBondContact O-OG 3.24Å; I51-L55 HydrophobicContact CG2-CD1 3.96Å; I51-L55 HydrophobicContact CG2-CG 4.41Å; I51-L55 WeakPolarHBondContact O-CB 3.47Å; I51-L55 VanDerWaalsContact O-CG 3.26Å; I51-L55 WeakPolarHBondContact O-CG 3.37Å; I51-L55 PolarHBondContact O-N 3.03Å; I51-V62 HydrophobicContact CG2-CG1 4.4Å
52	L	89.5	Confident	87.5	Confident	84 Å²	84	76.4 Å²	76.4	44%	0.44	39%	0.387	S	S	.	.	H	α-helix	trans	-62.2	-44.1	176.9	-73.7	-178.7	0	0	0	111.5	L48 L49 L55 I56	L48-L52 HydrophobicContact CD2-CD1 3.43Å; L48-L52 VanDerWaalsContact CD2-CD1 3.43Å; L48-L52 HydrophobicContact CD2-CG 3.97Å; L48-L52 WeakPolarHBondContact O-CG 3.37Å; L48-L52 PolarHBondContact O-N 2.92Å; L49-L52 PolarHBondContact O-N 3.29Å; L52-L55 PolarHBondContact O-N 3.23Å; L52-I56 WeakPolarHBondContact O-CD1 3.15Å; L52-I56 VanDerWaalsContact O-CG1 3.3Å; L52-I56 WeakPolarHBondContact O-CG1 3.32Å; L52-I56 PolarHBondContact O-N 3.48Å; L52-I56 VanDerWaalsContact O-N 3.1Å
53	V	86.7	Confident	87.6	Confident	37 Å²	37	79.2 Å²	79.2	22%	0.224	41%	0.411	C	S	.	.	H	α-helix	trans	-65.2	-42	177	174.7	0	0	0	0	110.5	T4 L49 I51 L55 I56 V57 I69	T4-V53 HydrophobicContact CG2-CG2 3.62Å; L49-V53 HydrophobicContact CD1-CG2 4.33Å; L49-V53 HydrophobicContact CG-CG2 4.31Å; L49-V53 WeakPolarHBondContact O-CB 3.47Å; L49-V53 WeakPolarHBondContact O-CG2 3.41Å; L49-V53 PolarHBondContact O-N 2.97Å; I51-V53 VanDerWaalsContact C-N 3.35Å; I51-V53 PolarHBondContact O-N 3.44Å; V53-L55 VanDerWaalsContact C-N 3.34Å; V53-L55 PolarHBondContact O-N 3.11Å; V53-I56 PolarHBondContact O-N 3.08Å; V53-V57 HydrophobicContact CG1-CG2 4.16Å; V53-V57 VanDerWaalsContact O-CG2 3.29Å; V53-V57 WeakPolarHBondContact O-CG2 3.33Å; V53-V57 PolarHBondContact O-N 2.89Å; V53-I69 HydrophobicContact CB-CD1 4.27Å; V53-I69 HydrophobicContact CG1-CD1 3.86Å
54	S	87.6	Confident	87.6	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.007	42%	0.415	C	S	.	.	H	α-helix	trans	-65.3	-37.8	177.9	66.9	0	0	0	0	112.6	S50 I51 I56 V58 V62	S50-S54 WeakPolarHBondContact O-CB 3.33Å; S50-S54 PolarHBondContact O-N 3.18Å; S50-S54 PolarHBondContact O-OG 3.45Å; I51-S54 WeakPolarHBondContact CA-OG 3.34Å; I51-S54 PolarHBondContact O-N 3.3Å; I51-S54 PolarHBondContact O-OG 3.24Å; S54-I56 VanDerWaalsContact C-N 3.34Å; S54-I56 PolarHBondContact O-N 3.06Å; S54-V58 CarbonylContact O-C 3.22Å; S54-V58 PolarHBondContact O-N 3Å; S54-V62 WeakPolarHBondContact OG-CG1 3.49Å; S54-V62 PolarHBondContact OG-O 3.39Å
55	L	89.5	Confident	87.5	Confident	83 Å²	83	71.4 Å²	71.4	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-61.3	-40.1	174	-76.5	166.5	0	0	0	112.5	I51 L52 V53 V62	I51-L55 HydrophobicContact CG2-CD1 3.96Å; I51-L55 HydrophobicContact CG2-CG 4.41Å; I51-L55 WeakPolarHBondContact O-CB 3.47Å; I51-L55 VanDerWaalsContact O-CG 3.26Å; I51-L55 WeakPolarHBondContact O-CG 3.37Å; I51-L55 PolarHBondContact O-N 3.03Å; L52-L55 PolarHBondContact O-N 3.23Å; V53-L55 VanDerWaalsContact C-N 3.34Å; V53-L55 PolarHBondContact O-N 3.11Å; L55-V62 HydrophobicContact CD2-CG1 4.34Å; L55-V62 HydrophobicContact CD2-CG2 3.66Å; L55-V62 HydrophobicContact CG-CG1 4.35Å; L55-V62 HydrophobicContact CG-CG2 4.3Å
56	I	88.5	Confident	87.3	Confident	142 Å²	142	68.7 Å²	68.7	73%	0.728	38%	0.38	S	S	*	.	H	α-helix	trans	-73.8	-41.4	-179.2	-66.7	164.6	0	0	0	111.5	L52 V53 S54	L52-I56 WeakPolarHBondContact O-CD1 3.15Å; L52-I56 VanDerWaalsContact O-CG1 3.3Å; L52-I56 WeakPolarHBondContact O-CG1 3.32Å; L52-I56 PolarHBondContact O-N 3.48Å; L52-I56 VanDerWaalsContact O-N 3.1Å; V53-I56 PolarHBondContact O-N 3.08Å; S54-I56 VanDerWaalsContact C-N 3.34Å; S54-I56 PolarHBondContact O-N 3.06Å
57	V	84.7	Confident	87.3	Confident	106 Å²	106	70.9 Å²	70.9	64%	0.642	40%	0.396	S	S	*	.	H	α-helix	trans	-83.6	-47.1	-172.9	-176.2	0	0	0	0	111.8	V53	V53-V57 HydrophobicContact CG1-CG2 4.16Å; V53-V57 VanDerWaalsContact O-CG2 3.29Å; V53-V57 WeakPolarHBondContact O-CG2 3.33Å; V53-V57 PolarHBondContact O-N 2.89Å
58	V	87	Confident	87.2	Confident	55 Å²	55	71.2 Å²	71.2	33%	0.333	40%	0.398	S	S	.	.			trans	-143.8	84.5	-178.3	-169.1	0	0	0	0	110.3	S54 Q60 I61	S54-V58 CarbonylContact O-C 3.22Å; S54-V58 PolarHBondContact O-N 3Å; V58-Q60 PolarHBondContact O-N 2.98Å; V58-Q60 VanDerWaalsContact O-N 3.09Å; V58-I61 HydrophobicContact CG1-CB 4.14Å; V58-I61 HydrophobicContact CG1-CD1 4.46Å; V58-I61 HydrophobicContact CG1-CG1 4.38Å; V58-I61 PolarHBondContact O-N 2.91Å
59	P	86.1	Confident	87.1	Confident	90 Å²	90	68 Å²	68	58%	0.584	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-65.3	-17.6	-176.4	25.6	-34.9	0	0	0	113.6	V62	P59-V62 VanDerWaalsContact O-CG2 3.31Å; P59-V62 WeakPolarHBondContact O-CG2 3.35Å
60	Q	85	Confident	87	Confident	180 Å²	180	68.6 Å²	68.6	84%	0.841	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-76.7	-26	-179.5	-66.9	177.6	-29.3	0	0	113.1	V58	V58-Q60 PolarHBondContact O-N 2.98Å; V58-Q60 VanDerWaalsContact O-N 3.09Å
61	I	87.9	Confident	87.1	Confident	81 Å²	81	72.5 Å²	72.5	42%	0.415	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-129.7	45.9	-168.3	-56.5	170.8	0	0	0	109.7	V58 S63 L64 A65	V58-I61 HydrophobicContact CG1-CB 4.14Å; V58-I61 HydrophobicContact CG1-CD1 4.46Å; V58-I61 HydrophobicContact CG1-CG1 4.38Å; V58-I61 PolarHBondContact O-N 2.91Å; I61-S63 VanDerWaalsContact C-N 3.34Å; I61-S63 PolarHBondContact O-N 2.82Å; I61-L64 HydrophobicContact CG2-CB 3.61Å; I61-L64 HydrophobicContact CG2-CD1 3.82Å; I61-L64 HydrophobicContact CG2-CG 4.11Å; I61-A65 WeakPolarHBondContact O-CB 3.29Å; I61-A65 PolarHBondContact O-N 2.75Å
62	V	87.4	Confident	86.8	Confident	39 Å²	39	76.2 Å²	76.2	24%	0.236	42%	0.417	C	S	.	.	H	α-helix	trans	-57.8	-43.4	-172.6	177.6	0	0	0	0	112.5	I51 S54 L55 P59 S66	I51-V62 HydrophobicContact CG2-CG1 4.4Å; S54-V62 WeakPolarHBondContact OG-CG1 3.49Å; S54-V62 PolarHBondContact OG-O 3.39Å; L55-V62 HydrophobicContact CD2-CG1 4.34Å; L55-V62 HydrophobicContact CD2-CG2 3.66Å; L55-V62 HydrophobicContact CG-CG1 4.35Å; L55-V62 HydrophobicContact CG-CG2 4.3Å; P59-V62 VanDerWaalsContact O-CG2 3.31Å; P59-V62 WeakPolarHBondContact O-CG2 3.35Å; V62-S66 WeakPolarHBondContact O-CB 3.33Å; V62-S66 PolarHBondContact O-N 3.07Å; V62-S66 PolarHBondContact O-OG 3.35Å; V62-S66 VanDerWaalsContact O-OG 3.12Å
63	S	86.5	Confident	86.6	Confident	90 Å²	90	72.5 Å²	72.5	63%	0.629	40%	0.397	S	S	*	.	H	α-helix	trans	-69.5	-44.2	-174.7	55.9	0	0	0	0	113.4	I61 S66 S67	I61-S63 VanDerWaalsContact C-N 3.34Å; I61-S63 PolarHBondContact O-N 2.82Å; S63-S66 PolarHBondContact O-OG 2.76Å; S63-S67 PolarHBondContact O-N 3.25Å
64	L	86.8	Confident	86.5	Confident	109 Å²	109	74 Å²	74	57%	0.571	40%	0.404	S	S	*	.	H	α-helix	trans	-72.7	-42.7	177	-62.3	169.7	0	0	0	110.1	I61 S66 S67 I68	I61-L64 HydrophobicContact CG2-CB 3.61Å; I61-L64 HydrophobicContact CG2-CD1 3.82Å; I61-L64 HydrophobicContact CG2-CG 4.11Å; L64-S66 VanDerWaalsContact C-N 3.35Å; L64-S66 PolarHBondContact O-N 3.13Å; L64-S67 PolarHBondContact O-N 3.15Å; L64-S67 PolarHBondContact O-OG 3.02Å; L64-I68 VanDerWaalsContact O-CG1 3.3Å; L64-I68 WeakPolarHBondContact O-CG1 3.28Å; L64-I68 PolarHBondContact O-N 2.53Å
65	A	86.9	Confident	86.4	Confident	19 Å²	19	79.7 Å²	79.7	16%	0.157	43%	0.429	C	S	.	.	H	α-helix	trans	-60.4	-42.2	178.4	0	0	0	0	0	112	I61 I68 I69	I61-A65 WeakPolarHBondContact O-CB 3.29Å; I61-A65 PolarHBondContact O-N 2.75Å; A65-I68 PolarHBondContact O-N 2.79Å; A65-I69 WeakPolarHBondContact O-CB 2.99Å; A65-I69 WeakPolarHBondContact O-CD1 3.14Å; A65-I69 WeakPolarHBondContact O-CG1 3.05Å; A65-I69 PolarHBondContact O-N 3.28Å
66	S	85.1	Confident	86.1	Confident	20 Å²	20	77.9 Å²	77.9	14%	0.14	42%	0.419	C	S	.	.	H	α-helix	trans	-63.7	-43	176.3	64.4	0	0	0	0	111.8	V62 S63 L64 I68 I69 I70	V62-S66 WeakPolarHBondContact O-CB 3.33Å; V62-S66 PolarHBondContact O-N 3.07Å; V62-S66 PolarHBondContact O-OG 3.35Å; V62-S66 VanDerWaalsContact O-OG 3.12Å; S63-S66 PolarHBondContact O-OG 2.76Å; L64-S66 VanDerWaalsContact C-N 3.35Å; L64-S66 PolarHBondContact O-N 3.13Å; S66-I68 VanDerWaalsContact C-N 3.34Å; S66-I68 PolarHBondContact O-N 3.11Å; S66-I69 PolarHBondContact O-N 3.1Å; S66-I70 VanDerWaalsContact O-CG1 3.26Å; S66-I70 WeakPolarHBondContact O-CG1 3.26Å; S66-I70 PolarHBondContact O-N 3.33Å
67	S	86.9	Confident	85.6	Confident	56 Å²	56	72.1 Å²	72.1	39%	0.392	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-38.4	176.8	72	0	0	0	0	113	S63 L64 T71	S63-S67 PolarHBondContact O-N 3.25Å; L64-S67 PolarHBondContact O-N 3.15Å; L64-S67 PolarHBondContact O-OG 3.02Å; S67-T71 WeakPolarHBondContact O-CG2 3.2Å; S67-T71 PolarHBondContact O-N 3.49Å; S67-T71 PolarHBondContact O-OG1 3.4Å
68	I	87.3	Confident	85.3	Confident	95 Å²	95	76.4 Å²	76.4	49%	0.487	40%	0.4	S	S	.	.	H	α-helix	trans	-67.1	-43.7	175.1	-64.9	163.2	0	0	0	110.1	L64 A65 S66 T71 R72	L64-I68 VanDerWaalsContact O-CG1 3.3Å; L64-I68 WeakPolarHBondContact O-CG1 3.28Å; L64-I68 PolarHBondContact O-N 2.53Å; A65-I68 PolarHBondContact O-N 2.79Å; S66-I68 VanDerWaalsContact C-N 3.34Å; S66-I68 PolarHBondContact O-N 3.11Å; I68-T71 WeakPolarHBondContact CA-OG1 3.32Å; I68-T71 PolarHBondContact O-N 3.27Å; I68-T71 PolarHBondContact O-OG1 2.94Å; I68-R72 HydrophobicContact CG2-CG 4.35Å; I68-R72 WeakPolarHBondContact O-CB 3.41Å; I68-R72 WeakPolarHBondContact O-CG 3.1Å; I68-R72 PolarHBondContact O-N 3.29Å
69	I	86.3	Confident	85.2	Confident	38 Å²	38	77.2 Å²	77.2	20%	0.195	41%	0.406	C	S	.	.	H	α-helix	trans	-63.2	-45.1	178.9	-68.9	162.6	0	0	0	110.7	V53 A65 S66 R72 I73	V53-I69 HydrophobicContact CB-CD1 4.27Å; V53-I69 HydrophobicContact CG1-CD1 3.86Å; A65-I69 WeakPolarHBondContact O-CB 2.99Å; A65-I69 WeakPolarHBondContact O-CD1 3.14Å; A65-I69 WeakPolarHBondContact O-CG1 3.05Å; A65-I69 PolarHBondContact O-N 3.28Å; S66-I69 PolarHBondContact O-N 3.1Å; I69-R72 PolarHBondContact O-N 3.04Å; I69-I73 HydrophobicContact CG2-CD1 3.76Å; I69-I73 HydrophobicContact CG2-CG1 4.35Å; I69-I73 WeakPolarHBondContact O-CG1 3.39Å; I69-I73 PolarHBondContact O-N 3.06Å
70	I	87.6	Confident	84.8	Confident	47 Å²	47	76.7 Å²	76.7	24%	0.241	40%	0.398	C	S	.	.	H	α-helix	trans	-61	-49.3	179.1	-67.4	164.7	0	0	0	110.7	S50 S66 R72 I73 L74	S50-I70 WeakPolarHBondContact OG-CG1 3.41Å; S66-I70 VanDerWaalsContact O-CG1 3.26Å; S66-I70 WeakPolarHBondContact O-CG1 3.26Å; S66-I70 PolarHBondContact O-N 3.33Å; I70-R72 PolarHBondContact O-N 3.47Å; I70-I73 PolarHBondContact O-N 3.48Å; I70-I73 VanDerWaalsContact O-N 3.16Å; I70-L74 HydrophobicContact CG2-CD1 4.08Å; I70-L74 HydrophobicContact CG2-CG 4.44Å; I70-L74 WeakPolarHBondContact O-CG 3.27Å; I70-L74 PolarHBondContact O-N 2.71Å
71	T	86.7	Confident	84.1	Confident	83 Å²	83	76.8 Å²	76.8	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-35.2	178.7	51.8	0	0	0	0	112.2	S67 I68 F75	S67-T71 WeakPolarHBondContact O-CG2 3.2Å; S67-T71 PolarHBondContact O-N 3.49Å; S67-T71 PolarHBondContact O-OG1 3.4Å; I68-T71 WeakPolarHBondContact CA-OG1 3.32Å; I68-T71 PolarHBondContact O-N 3.27Å; I68-T71 PolarHBondContact O-OG1 2.94Å; T71-F75 VanDerWaalsContact O-CB 3.3Å; T71-F75 WeakPolarHBondContact O-CB 2.89Å; T71-F75 PolarHBondContact O-N 3.09Å
72	R	82.9	Confident	83	Confident	146 Å²	146	76.6 Å²	76.6	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-69.8	-40.4	174.8	-67	-68.9	-176.5	-167	0.7	112.7	M1 I68 I69 I70 F75 L76	M1-R72 VanDerWaalsContact CE-C 3.49Å; M1-R72 HydrophobicContact CE-CB 3.61Å; I68-R72 HydrophobicContact CG2-CG 4.35Å; I68-R72 WeakPolarHBondContact O-CB 3.41Å; I68-R72 WeakPolarHBondContact O-CG 3.1Å; I68-R72 PolarHBondContact O-N 3.29Å; I69-R72 PolarHBondContact O-N 3.04Å; I70-R72 PolarHBondContact O-N 3.47Å; R72-F75 PolarHBondContact O-N 3.16Å; R72-L76 WeakPolarHBondContact O-CB 2.9Å; R72-L76 WeakPolarHBondContact O-CG 3.01Å; R72-L76 PolarHBondContact O-N 2.91Å
73	I	85.6	Confident	82	Confident	5 Å²	5	82.9 Å²	82.9	3%	0.026	42%	0.423	C	S	.	.	H	α-helix	trans	-61.7	-46.6	174.9	-69.1	166.8	0	0	0	109.9	M1 I46 I69 I70 L76 G77	M1-I73 HydrophobicContact CE-CG1 4.11Å; I46-I73 HydrophobicContact CG2-CD1 4.47Å; I69-I73 HydrophobicContact CG2-CD1 3.76Å; I69-I73 HydrophobicContact CG2-CG1 4.35Å; I69-I73 WeakPolarHBondContact O-CG1 3.39Å; I69-I73 PolarHBondContact O-N 3.06Å; I70-I73 PolarHBondContact O-N 3.48Å; I70-I73 VanDerWaalsContact O-N 3.16Å; I73-L76 PolarHBondContact O-N 3.32Å; I73-G77 PolarHBondContact O-N 2.95Å
74	L	83.6	Confident	81.7	Confident	69 Å²	69	82.5 Å²	82.5	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-49.1	176.8	-68.2	174.8	0	0	0	111.3	I70 L76 G77 Y78	I70-L74 HydrophobicContact CG2-CD1 4.08Å; I70-L74 HydrophobicContact CG2-CG 4.44Å; I70-L74 WeakPolarHBondContact O-CG 3.27Å; I70-L74 PolarHBondContact O-N 2.71Å; L74-L76 PolarHBondContact O-N 2.92Å; L74-G77 PolarHBondContact O-N 2.89Å; L74-Y78 HydrophobicContact CB-CE2 4.45Å; L74-Y78 WeakPolarHBondContact O-CD2 3.36Å; L74-Y78 PolarHBondContact O-N 2.9Å; L74-Y78 VanDerWaalsContact O-N 3.15Å
75	F	85.6	Confident	81.5	Confident	121 Å²	121	81.1 Å²	81.1	53%	0.531	41%	0.405	S	S	.	.	H	α-helix	trans	-58.1	-46.7	178.7	-178.8	-100	0	0	0	112.1	T71 R72 G77 Y78 T79	T71-F75 VanDerWaalsContact O-CB 3.3Å; T71-F75 WeakPolarHBondContact O-CB 2.89Å; T71-F75 PolarHBondContact O-N 3.09Å; R72-F75 PolarHBondContact O-N 3.16Å; F75-G77 VanDerWaalsContact C-N 3.33Å; F75-G77 PolarHBondContact O-N 3.36Å; F75-Y78 PolarHBondContact O-N 3.34Å; F75-T79 HydrophobicContact CD1-CG2 4.19Å; F75-T79 HydrophobicContact CD2-CG2 4.45Å; F75-T79 HydrophobicContact CE1-CG2 3.78Å; F75-T79 HydrophobicContact CE2-CG2 4.07Å; F75-T79 HydrophobicContact CZ-CG2 3.72Å; F75-T79 WeakPolarHBondContact O-CG2 3.15Å; F75-T79 PolarHBondContact O-N 3.31Å; F75-T79 VanDerWaalsContact O-N 3.13Å; F75-T79 PolarHBondContact O-OG1 3.46Å
76	L	83.1	Confident	81.2	Confident	45 Å²	45	84.6 Å²	84.6	24%	0.236	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-40.5	177.8	-75.2	-172.3	0	0	0	112.4	M1 L5 R72 I73 L74 Y78 T79 L80	M1-L76 HydrophobicContact CE-CD1 3.24Å; M1-L76 HydrophobicContact CE-CG 3.95Å; M1-L76 HydrophobicContact CG-CD1 4.12Å; M1-L76 HydrophobicContact SD-CD1 3.37Å; M1-L76 WeakPolarHBondContact SD-CD1 3.41Å; M1-L76 HydrophobicContact SD-CG 4.48Å; L5-L76 HydrophobicContact CD1-CD1 3.92Å; L5-L76 HydrophobicContact CD2-CB 4.48Å; R72-L76 WeakPolarHBondContact O-CB 2.9Å; R72-L76 WeakPolarHBondContact O-CG 3.01Å; R72-L76 PolarHBondContact O-N 2.91Å; I73-L76 PolarHBondContact O-N 3.32Å; L74-L76 PolarHBondContact O-N 2.92Å; L76-Y78 PolarHBondContact O-N 2.88Å; L76-T79 WeakPolarHBondContact CA-OG1 3.33Å; L76-T79 PolarHBondContact O-N 2.71Å; L76-T79 VanDerWaalsContact O-N 3.11Å; L76-T79 PolarHBondContact O-OG1 3.35Å; L76-T79 VanDerWaalsContact O-OG1 3.06Å; L76-L80 PolarHBondContact O-N 3.13Å; L76-L80 VanDerWaalsContact O-N 3.07Å
77	G	79.4	Confident	80.9	Confident	20 Å²	20	88.4 Å²	88.4	21%	0.206	44%	0.435	C	S	.	.	H	α-helix	trans	-59.6	-32.2	177.2	0	0	0	0	0	113.5	T11 I73 L74 F75	T11-G77 VanDerWaalsContact OG1-CA 3.28Å; T11-G77 WeakPolarHBondContact OG1-CA 3.08Å; T11-G77 PolarHBondContact OG1-O 3.23Å; I73-G77 PolarHBondContact O-N 2.95Å; L74-G77 PolarHBondContact O-N 2.89Å; F75-G77 VanDerWaalsContact C-N 3.33Å; F75-G77 PolarHBondContact O-N 3.36Å
78	Y	77.5	Confident	80.5	Confident	196 Å²	196	90.4 Å²	90.4	77%	0.769	44%	0.438	S	S	*	.	H	α-helix	trans	-82.5	-26.2	174.7	-68.6	-66.1	0	0	0	114.1	L74 F75 L76	L74-Y78 HydrophobicContact CB-CE2 4.45Å; L74-Y78 WeakPolarHBondContact O-CD2 3.36Å; L74-Y78 PolarHBondContact O-N 2.9Å; L74-Y78 VanDerWaalsContact O-N 3.15Å; F75-Y78 PolarHBondContact O-N 3.34Å; L76-Y78 PolarHBondContact O-N 2.88Å
79	T	84.1	Confident	80.1	Confident	73 Å²	73	90.1 Å²	90.1	45%	0.448	43%	0.434	S	S	.	.	H	α-helix	trans	-88.1	-31	-175.3	56.2	0	0	0	0	114.6	F75 L76	F75-T79 HydrophobicContact CD1-CG2 4.19Å; F75-T79 HydrophobicContact CD2-CG2 4.45Å; F75-T79 HydrophobicContact CE1-CG2 3.78Å; F75-T79 HydrophobicContact CE2-CG2 4.07Å; F75-T79 HydrophobicContact CZ-CG2 3.72Å; F75-T79 WeakPolarHBondContact O-CG2 3.15Å; F75-T79 PolarHBondContact O-N 3.31Å; F75-T79 VanDerWaalsContact O-N 3.13Å; F75-T79 PolarHBondContact O-OG1 3.46Å; L76-T79 WeakPolarHBondContact CA-OG1 3.33Å; L76-T79 PolarHBondContact O-N 2.71Å; L76-T79 VanDerWaalsContact O-N 3.11Å; L76-T79 PolarHBondContact O-OG1 3.35Å; L76-T79 VanDerWaalsContact O-OG1 3.06Å
80	L	78.9	Confident	79.7	Confident	78 Å²	78	93.8 Å²	93.8	41%	0.408	45%	0.451	S	S	.	.	S	Bend	trans	-91.9	136.2	-172.4	-66.1	175.2	0	0	0	110.9	L76	L76-L80 PolarHBondContact O-N 3.13Å; L76-L80 VanDerWaalsContact O-N 3.07Å
81	Q	70.4	Confident	79	Confident	182 Å²	182	97.4 Å²	97.4	85%	0.85	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-67.8	146.3	166.5	-67.7	178.5	-14.4	0	0	109.2
82	R	65.3	Low	78.4	Confident	78 Å²	78	98.6 Å²	98.6	29%	0.294	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-59.8	135.1	171.7	-169.2	173.1	177.6	-126.4	-8.2	109	T11 D14 A18 E21	T11-R82 HydrophobicContact CG2-CB 4.43Å; D14-R82 VanDerWaalsContact O-CZ 3.28Å; D14-R82 PolarHBondContact O-NE 3.11Å; D14-R82 PolarHBondContact O-NH2 2.91Å; A18-R82 VanDerWaalsContact CB-NH2 3.29Å; E21-R82 IonicContact OE1-CZ 3.18Å; E21-R82 IonicContact OE1-NH1 2.75Å; E21-R82 PolarHBondContact OE1-NH1 3.26Å; E21-R82 IonicContact OE1-NH2 2.82Å; E21-R82 PolarHBondContact OE1-NH2 3.37Å
83	L	64.6	Low	78	Confident	170 Å²	170	94.3 Å²	94.3	89%	0.89	46%	0.456	S	S	*	.			trans	-73.8	0	172.3	-81	166.6	0	0	0	110.8	P12 F13	P12-L83 HydrophobicContact CB-CB 4.08Å; P12-L83 HydrophobicContact CB-CD1 3.72Å; P12-L83 HydrophobicContact CB-CG 3.64Å; P12-L83 HydrophobicContact CG-CD1 3.92Å; P12-L83 HydrophobicContact CG-CG 4.36Å; P12-L83 PolarHBondContact O-N 3.03Å; F13-L83 HydrophobicContact CE1-CD1 4.11Å; F13-L83 HydrophobicContact CZ-CD1 4.47Å

Retrieved 83 of 83 residues in 148.2 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).