A0A077YX38_TRITR Loading...

MROH2B-like HEAT-repeats domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YX38, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 81 aa.

						>A0A077YX38_TRITR|A0A077YX38
MICLGVTLSKVKSHTFVVDHLDLLFRNVVYASDSDRTGCAEAVGFCSQGHIDIVLTKLEDFAKREYAKKSVGIFNLLKVCV
					

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	83.7	Confident	94.7	Very high	89 Å²	89	59.3 Å²	59.3	44%	0.438	32%	0.324	S	S	.	.				0	-31.3	0	-70.9	158.4	105.9	0	0	113	C3 L4 G5 L24 G38 C39 A42	M1-C3 VanDerWaalsContact C-N 3.27Å; M1-C3 PolarHBondContact O-N 2.93Å; M1-C3 VanDerWaalsContact O-N 3.16Å; M1-L4 WeakPolarHBondContact O-CB 3.34Å; M1-L4 PolarHBondContact O-N 3.39Å; M1-G5 PolarHBondContact O-N 3.12Å; M1-L24 HydrophobicContact CE-CD1 3.33Å; M1-L24 HydrophobicContact CE-CG 4.4Å; M1-G38 WeakPolarHBondContact CB-O 3.29Å; M1-G38 VanDerWaalsContact SD-C 3.57Å; M1-C39 HydrophobicContact CE-CB 3.79Å; M1-A42 HydrophobicContact CB-CB 4.24Å
2	I	89.6	Confident	94.8	Very high	72 Å²	72	69.5 Å²	69.5	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-44.1	-47.8	174.4	-63.1	170.2	0	0	0	113.5	L4 G5 V6 E41 F45	I2-L4 VanDerWaalsContact C-N 3.27Å; I2-L4 PolarHBondContact O-N 2.91Å; I2-G5 PolarHBondContact O-N 3.34Å; I2-V6 HydrophobicContact CG2-CG2 4.08Å; I2-V6 WeakPolarHBondContact O-CG2 3.49Å; I2-V6 PolarHBondContact O-N 3.26Å; I2-E41 WeakPolarHBondContact CD1-OE2 3.39Å; I2-E41 HydrophobicContact CG1-CB 4.09Å; I2-E41 WeakPolarHBondContact CG1-OE2 3.45Å; I2-F45 HydrophobicContact CB-CE2 4.43Å; I2-F45 HydrophobicContact CG1-CE2 4.29Å; I2-F45 HydrophobicContact CG2-CD2 4.01Å; I2-F45 HydrophobicContact CG2-CE2 3.62Å; I2-F45 HydrophobicContact CG2-CZ 4.29Å
3	C	93.6	Very high	95	Very high	100 Å²	100	69 Å²	69	68%	0.676	37%	0.369	S	S	*	.	H	α-helix	trans	-54.6	-43.2	-179.9	-55.8	0	0	0	0	112.4	M1 V6 T7	M1-C3 VanDerWaalsContact C-N 3.27Å; M1-C3 PolarHBondContact O-N 2.93Å; M1-C3 VanDerWaalsContact O-N 3.16Å; C3-V6 PolarHBondContact O-N 3.46Å; C3-T7 WeakPolarHBondContact O-CB 3.21Å; C3-T7 PolarHBondContact O-N 3.27Å; C3-T7 PolarHBondContact O-OG1 2.72Å
4	L	94.7	Very high	95.1	Very high	58 Å²	58	72.4 Å²	72.4	30%	0.304	38%	0.381	S	S	.	.	H	α-helix	trans	-61.6	-48.8	176.6	178.4	65	0	0	0	110.8	M1 I2 V6 T7 L8 L24	M1-L4 WeakPolarHBondContact O-CB 3.34Å; M1-L4 PolarHBondContact O-N 3.39Å; I2-L4 VanDerWaalsContact C-N 3.27Å; I2-L4 PolarHBondContact O-N 2.91Å; L4-V6 VanDerWaalsContact C-N 3.34Å; L4-V6 PolarHBondContact O-N 3.19Å; L4-T7 PolarHBondContact O-N 3.41Å; L4-L8 HydrophobicContact CD1-CD1 4.15Å; L4-L8 HydrophobicContact CD1-CD2 4.37Å; L4-L8 HydrophobicContact CD1-CG 4.02Å; L4-L8 HydrophobicContact CG-CD1 4.03Å; L4-L8 HydrophobicContact CG-CG 4.25Å; L4-L8 WeakPolarHBondContact O-CB 3.13Å; L4-L8 VanDerWaalsContact O-CG 3.27Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 2.78Å; L4-L24 HydrophobicContact CD2-CD1 4.22Å
5	G	96.3	Very high	95.2	Very high	0 Å²	0	74 Å²	74	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-42.9	179.3	0	0	0	0	0	113.3	M1 I2 L8 S9 A42	M1-G5 PolarHBondContact O-N 3.12Å; I2-G5 PolarHBondContact O-N 3.34Å; G5-L8 PolarHBondContact O-N 2.76Å; G5-S9 PolarHBondContact O-N 3.49Å; G5-A42 WeakPolarHBondContact CA-O 3.26Å
6	V	96.9	Very high	95.4	Very high	60 Å²	60	75 Å²	75	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-45	175.2	175.6	0	0	0	0	111	I2 C3 L4 S9 F45	I2-V6 HydrophobicContact CG2-CG2 4.08Å; I2-V6 WeakPolarHBondContact O-CG2 3.49Å; I2-V6 PolarHBondContact O-N 3.26Å; C3-V6 PolarHBondContact O-N 3.46Å; L4-V6 VanDerWaalsContact C-N 3.34Å; L4-V6 PolarHBondContact O-N 3.19Å; V6-S9 WeakPolarHBondContact O-CB 3.5Å; V6-S9 PolarHBondContact O-N 3.12Å; V6-S9 PolarHBondContact O-OG 2.78Å; V6-F45 HydrophobicContact CG2-CB 4.21Å; V6-F45 HydrophobicContact CG2-CD1 3.9Å; V6-F45 HydrophobicContact CG2-CD2 4.19Å; V6-F45 HydrophobicContact CG2-CE1 4.33Å; V6-F45 HydrophobicContact CG2-CG 3.84Å
7	T	97.2	Very high	95.5	Very high	81 Å²	81	70.6 Å²	70.6	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-58.6	-49.7	174.8	-62.8	0	0	0	0	110.9	C3 L4 S9 K10 V11	C3-T7 WeakPolarHBondContact O-CB 3.21Å; C3-T7 PolarHBondContact O-N 3.27Å; C3-T7 PolarHBondContact O-OG1 2.72Å; L4-T7 PolarHBondContact O-N 3.41Å; T7-S9 VanDerWaalsContact C-N 3.26Å; T7-S9 PolarHBondContact O-N 3.14Å; T7-K10 PolarHBondContact O-N 3.41Å; T7-V11 HydrophobicContact CG2-CG2 4.33Å; T7-V11 WeakPolarHBondContact O-CG2 3.43Å; T7-V11 PolarHBondContact O-N 3.29Å
8	L	97.6	Very high	95.7	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-34.6	180	-68.5	-177.6	0	0	0	112.1	L4 G5 K10 V11 F16 V17 H20 L21 C46 H50	L4-L8 HydrophobicContact CD1-CD1 4.15Å; L4-L8 HydrophobicContact CD1-CD2 4.37Å; L4-L8 HydrophobicContact CD1-CG 4.02Å; L4-L8 HydrophobicContact CG-CD1 4.03Å; L4-L8 HydrophobicContact CG-CG 4.25Å; L4-L8 WeakPolarHBondContact O-CB 3.13Å; L4-L8 VanDerWaalsContact O-CG 3.27Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 2.78Å; G5-L8 PolarHBondContact O-N 2.76Å; L8-K10 PolarHBondContact O-N 3.45Å; L8-K10 VanDerWaalsContact O-N 3.09Å; L8-V11 PolarHBondContact O-N 3.27Å; L8-F16 HydrophobicContact CD2-CD1 3.96Å; L8-F16 HydrophobicContact CD2-CE1 3.9Å; L8-V17 HydrophobicContact CD2-CG2 4.39Å; L8-H20 HydrophobicContact CD1-CB 3.89Å; L8-H20 HydrophobicContact CD2-CB 3.86Å; L8-H20 HydrophobicContact CG-CB 4.48Å; L8-L21 HydrophobicContact CD1-CD2 4.38Å; L8-L21 HydrophobicContact CD1-CG 4.45Å; L8-C46 HydrophobicContact CB-CB 4.33Å; L8-H50 PolarHBondContact O-CD2 2.82Å; L8-H50 PolarHBondContact O-NE2 2.99Å; L8-H50 VanDerWaalsContact O-NE2 3.13Å
9	S	97.5	Very high	95.7	Very high	12 Å²	12	70 Å²	70	8%	0.084	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.2	174.5	82.8	0	0	0	0	114.7	G5 V6 T7 F45	G5-S9 PolarHBondContact O-N 3.49Å; V6-S9 WeakPolarHBondContact O-CB 3.5Å; V6-S9 PolarHBondContact O-N 3.12Å; V6-S9 PolarHBondContact O-OG 2.78Å; T7-S9 VanDerWaalsContact C-N 3.26Å; T7-S9 PolarHBondContact O-N 3.14Å; S9-F45 VanDerWaalsContact CB-O 3.26Å; S9-F45 WeakPolarHBondContact CB-O 3.47Å
10	K	97.3	Very high	95.8	Very high	148 Å²	148	69.1 Å²	69.1	64%	0.643	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-16.5	-177.8	-57.1	-57	-179.9	-173.3	0	113.3	T7 L8	T7-K10 PolarHBondContact O-N 3.41Å; L8-K10 PolarHBondContact O-N 3.45Å; L8-K10 VanDerWaalsContact O-N 3.09Å
11	V	97.4	Very high	95.9	Very high	31 Å²	31	65.8 Å²	65.8	19%	0.188	35%	0.347	C	S	.	.			trans	-66	140.9	179.4	169.6	0	0	0	0	109.8	T7 L8 F16 V17 H50	T7-V11 HydrophobicContact CG2-CG2 4.33Å; T7-V11 WeakPolarHBondContact O-CG2 3.43Å; T7-V11 PolarHBondContact O-N 3.29Å; L8-V11 PolarHBondContact O-N 3.27Å; V11-F16 HydrophobicContact CG1-CB 4.17Å; V11-F16 HydrophobicContact CG1-CD1 3.85Å; V11-F16 HydrophobicContact CG1-CG 4.29Å; V11-F16 HydrophobicContact CG2-CD1 4.2Å; V11-F16 HydrophobicContact CG2-CE1 4.28Å; V11-V17 HydrophobicContact CB-CG2 4.03Å; V11-V17 HydrophobicContact CG1-CG2 3.95Å; V11-H50 PolarHBondContact O-CE1 3.41Å; V11-H50 PolarHBondContact O-NE2 3.26Å
12	K	95.7	Very high	96.4	Very high	182 Å²	182	62.6 Å²	62.6	79%	0.791	33%	0.332	S	S	*	.			trans	-96.6	-18.5	177.1	-60.7	-57.3	-175.9	-177.1	0	113.7	H14	K12-H14 PolarHBondContact O-CD2 2.97Å; K12-H14 PolarHBondContact O-N 2.92Å
13	S	97.2	Very high	96.7	Very high	63 Å²	63	63.1 Å²	63.1	44%	0.441	34%	0.335	S	S	.	.			trans	-77.6	108.6	177.8	177.2	0	0	0	0	110.7	T15 F16 V17	S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.32Å; S13-F16 WeakPolarHBondContact O-CB 3.46Å; S13-F16 PolarHBondContact O-N 2.91Å; S13-F16 PolarHBondContact OG-N 3.41Å; S13-V17 WeakPolarHBondContact O-CG2 3.43Å; S13-V17 PolarHBondContact O-N 3.45Å; S13-V17 VanDerWaalsContact O-N 3.14Å
14	H	96.5	Very high	96.7	Very high	116 Å²	116	59 Å²	59	54%	0.537	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-40.8	179	-73.3	-153.5	0	0	0	111.6	K12 F16 V17 V18 I53	K12-H14 PolarHBondContact O-CD2 2.97Å; K12-H14 PolarHBondContact O-N 2.92Å; H14-F16 VanDerWaalsContact C-N 3.31Å; H14-F16 PolarHBondContact O-N 3.06Å; H14-V17 PolarHBondContact O-N 3.47Å; H14-V18 WeakPolarHBondContact O-CG2 3.14Å; H14-V18 PolarHBondContact O-N 3.36Å; H14-I53 HydrophobicContact CB-CD1 3.86Å
15	T	97.5	Very high	96.7	Very high	97 Å²	97	57.1 Å²	57.1	60%	0.595	30%	0.296	S	S	*	.	H	α-helix	trans	-58.1	-45	175.9	-49.3	0	0	0	0	111.2	S13 V17 V18 D19	S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.32Å; T15-V17 VanDerWaalsContact C-N 3.32Å; T15-V17 PolarHBondContact O-N 3.39Å; T15-V18 PolarHBondContact O-N 2.97Å; T15-D19 WeakPolarHBondContact O-CB 3.33Å; T15-D19 VanDerWaalsContact O-CG 3.23Å; T15-D19 PolarHBondContact O-N 3.17Å
16	F	97.2	Very high	96.5	Very high	90 Å²	90	65.1 Å²	65.1	40%	0.395	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-43.2	178	-172	-86	0	0	0	111.7	L8 V11 S13 H14 H20	L8-F16 HydrophobicContact CD2-CD1 3.96Å; L8-F16 HydrophobicContact CD2-CE1 3.9Å; V11-F16 HydrophobicContact CG1-CB 4.17Å; V11-F16 HydrophobicContact CG1-CD1 3.85Å; V11-F16 HydrophobicContact CG1-CG 4.29Å; V11-F16 HydrophobicContact CG2-CD1 4.2Å; V11-F16 HydrophobicContact CG2-CE1 4.28Å; S13-F16 WeakPolarHBondContact O-CB 3.46Å; S13-F16 PolarHBondContact O-N 2.91Å; S13-F16 PolarHBondContact OG-N 3.41Å; H14-F16 VanDerWaalsContact C-N 3.31Å; H14-F16 PolarHBondContact O-N 3.06Å; F16-H20 AromaticContact CD1-CE1 3.88Å; F16-H20 AromaticContact CD1-ND1 3.62Å; F16-H20 AromaticContact CD2-CE1 3.63Å; F16-H20 AromaticContact CD2-ND1 3.99Å; F16-H20 AromaticContact CE1-CE1 3.48Å; F16-H20 VanDerWaalsContact CE1-CE1 3.48Å; F16-H20 WeakPolarHBondContact CE1-CE1 3.27Å; F16-H20 AromaticContact CE1-CG 3.99Å; F16-H20 AromaticContact CE1-ND1 3.55Å; F16-H20 AromaticContact CE1-NE2 3.87Å; F16-H20 AromaticContact CE2-CE1 3.21Å; F16-H20 WeakPolarHBondContact CE2-CE1 3.45Å; F16-H20 AromaticContact CE2-ND1 3.93Å; F16-H20 AromaticContact CE2-NE2 3.87Å; F16-H20 AromaticContact CG-CE1 3.95Å; F16-H20 AromaticContact CG-ND1 3.85Å; F16-H20 AromaticContact CZ-CE1 3.13Å; F16-H20 WeakPolarHBondContact CZ-CE1 3.42Å; F16-H20 AromaticContact CZ-ND1 3.72Å; F16-H20 AromaticContact CZ-NE2 3.43Å; F16-H20 WeakPolarHBondContact CZ-NE2 3.39Å; F16-H20 WeakPolarHBondContact O-CB 3.2Å; F16-H20 PolarHBondContact O-N 2.85Å; F16-H20 VanDerWaalsContact O-N 3.12Å; F16-H20 PolarHBondContact O-ND1 3.29Å
17	V	98.1	Very high	96.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-45.6	177.8	175.7	0	0	0	0	111.3	L8 V11 S13 H14 T15 H20 L21 H50 I53	L8-V17 HydrophobicContact CD2-CG2 4.39Å; V11-V17 HydrophobicContact CB-CG2 4.03Å; V11-V17 HydrophobicContact CG1-CG2 3.95Å; S13-V17 WeakPolarHBondContact O-CG2 3.43Å; S13-V17 PolarHBondContact O-N 3.45Å; S13-V17 VanDerWaalsContact O-N 3.14Å; H14-V17 PolarHBondContact O-N 3.47Å; T15-V17 VanDerWaalsContact C-N 3.32Å; T15-V17 PolarHBondContact O-N 3.39Å; V17-H20 PolarHBondContact O-N 3.09Å; V17-L21 HydrophobicContact CG1-CD1 3.98Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.46Å; V17-L21 WeakPolarHBondContact O-CG 3.49Å; V17-L21 PolarHBondContact O-N 2.98Å; V17-H50 HydrophobicContact CG1-CB 4.21Å; V17-I53 HydrophobicContact CB-CD1 4.49Å; V17-I53 HydrophobicContact CG1-CD1 4.4Å; V17-I53 HydrophobicContact CG1-CG2 4.26Å
18	V	97.9	Very high	96.1	Very high	45 Å²	45	64.5 Å²	64.5	27%	0.273	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-50.5	177.3	168.1	0	0	0	0	111.1	H14 T15 H20 L21 D22 I53 K57	H14-V18 WeakPolarHBondContact O-CG2 3.14Å; H14-V18 PolarHBondContact O-N 3.36Å; T15-V18 PolarHBondContact O-N 2.97Å; V18-H20 VanDerWaalsContact C-N 3.32Å; V18-H20 PolarHBondContact O-N 3.13Å; V18-L21 PolarHBondContact O-N 3.1Å; V18-D22 PolarHBondContact O-N 2.97Å; V18-I53 HydrophobicContact CG2-CD1 4.48Å; V18-I53 HydrophobicContact CG2-CG2 3.6Å; V18-K57 HydrophobicContact CG1-CD 4.4Å
19	D	97.4	Very high	95.9	Very high	85 Å²	85	68.3 Å²	68.3	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-42.2	-177.5	-68.8	-20.9	0	0	0	111.4	T15 D22 L23	T15-D19 WeakPolarHBondContact O-CB 3.33Å; T15-D19 VanDerWaalsContact O-CG 3.23Å; T15-D19 PolarHBondContact O-N 3.17Å; D19-D22 PolarHBondContact O-N 3.34Å; D19-L23 WeakPolarHBondContact O-CG 3.38Å; D19-L23 PolarHBondContact O-N 3.33Å
20	H	96.9	Very high	95.5	Very high	51 Å²	51	73 Å²	73	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-74.4	-32.5	-178.8	-73.4	72.7	0	0	0	113	L8 F16 V17 V18 L23 L24	L8-H20 HydrophobicContact CD1-CB 3.89Å; L8-H20 HydrophobicContact CD2-CB 3.86Å; L8-H20 HydrophobicContact CG-CB 4.48Å; F16-H20 AromaticContact CD1-CE1 3.88Å; F16-H20 AromaticContact CD1-ND1 3.62Å; F16-H20 AromaticContact CD2-CE1 3.63Å; F16-H20 AromaticContact CD2-ND1 3.99Å; F16-H20 AromaticContact CE1-CE1 3.48Å; F16-H20 VanDerWaalsContact CE1-CE1 3.48Å; F16-H20 WeakPolarHBondContact CE1-CE1 3.27Å; F16-H20 AromaticContact CE1-CG 3.99Å; F16-H20 AromaticContact CE1-ND1 3.55Å; F16-H20 AromaticContact CE1-NE2 3.87Å; F16-H20 AromaticContact CE2-CE1 3.21Å; F16-H20 WeakPolarHBondContact CE2-CE1 3.45Å; F16-H20 AromaticContact CE2-ND1 3.93Å; F16-H20 AromaticContact CE2-NE2 3.87Å; F16-H20 AromaticContact CG-CE1 3.95Å; F16-H20 AromaticContact CG-ND1 3.85Å; F16-H20 AromaticContact CZ-CE1 3.13Å; F16-H20 WeakPolarHBondContact CZ-CE1 3.42Å; F16-H20 AromaticContact CZ-ND1 3.72Å; F16-H20 AromaticContact CZ-NE2 3.43Å; F16-H20 WeakPolarHBondContact CZ-NE2 3.39Å; F16-H20 WeakPolarHBondContact O-CB 3.2Å; F16-H20 PolarHBondContact O-N 2.85Å; F16-H20 VanDerWaalsContact O-N 3.12Å; F16-H20 PolarHBondContact O-ND1 3.29Å; V17-H20 PolarHBondContact O-N 3.09Å; V18-H20 VanDerWaalsContact C-N 3.32Å; V18-H20 PolarHBondContact O-N 3.13Å; H20-L23 PolarHBondContact O-N 3.35Å; H20-L24 WeakPolarHBondContact O-CB 3.35Å; H20-L24 PolarHBondContact O-N 3.29Å
21	L	96.9	Very high	95.4	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-65.8	-41.3	170	-74	174.5	0	0	0	111.2	L8 V17 V18 L24 F25 V43 C46 I53 V54 K57	L8-L21 HydrophobicContact CD1-CD2 4.38Å; L8-L21 HydrophobicContact CD1-CG 4.45Å; V17-L21 HydrophobicContact CG1-CD1 3.98Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.46Å; V17-L21 WeakPolarHBondContact O-CG 3.49Å; V17-L21 PolarHBondContact O-N 2.98Å; V18-L21 PolarHBondContact O-N 3.1Å; L21-L24 HydrophobicContact CD2-CD2 4.48Å; L21-L24 WeakPolarHBondContact O-CB 3.2Å; L21-L24 PolarHBondContact O-N 3.22Å; L21-F25 HydrophobicContact CB-CE2 4.3Å; L21-F25 WeakPolarHBondContact O-CD2 3.38Å; L21-F25 WeakPolarHBondContact O-CG 3.38Å; L21-F25 PolarHBondContact O-N 3.44Å; L21-V43 HydrophobicContact CD2-CG2 4.3Å; L21-C46 HydrophobicContact CD2-CB 4.37Å; L21-I53 HydrophobicContact CD1-CG2 4.04Å; L21-V54 HydrophobicContact CD1-CG2 4.08Å; L21-K57 HydrophobicContact CB-CG 4.38Å; L21-K57 HydrophobicContact CD1-CG 4.14Å
22	D	95.6	Very high	95.3	Very high	22 Å²	22	71.1 Å²	71.1	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-63.3	-40.8	174.3	-91.9	-37	0	0	0	112.5	V18 D19 L24 F25 R26 K57 R64	V18-D22 PolarHBondContact O-N 2.97Å; D19-D22 PolarHBondContact O-N 3.34Å; D22-L24 VanDerWaalsContact C-N 3.34Å; D22-F25 PolarHBondContact O-N 3.44Å; D22-R26 WeakPolarHBondContact O-CB 3.11Å; D22-R26 WeakPolarHBondContact O-CG 3.49Å; D22-R26 PolarHBondContact O-N 3.18Å; D22-K57 VanDerWaalsContact CG-CE 3.48Å; D22-K57 WeakPolarHBondContact OD1-CE 3.48Å; D22-K57 IonicContact OD1-NZ 2.76Å; D22-K57 PolarHBondContact OD1-NZ 3.1Å; D22-K57 IonicContact OD2-NZ 2.72Å; D22-K57 PolarHBondContact OD2-NZ 3.31Å; D22-R64 IonicContact OD1-NH1 3.78Å; D22-R64 IonicContact OD1-NH2 2.81Å; D22-R64 PolarHBondContact OD1-NH2 2.94Å
23	L	95.2	Very high	95.3	Very high	83 Å²	83	67.2 Å²	67.2	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-42.8	173.5	-73.5	171.3	0	0	0	111.4	D19 H20 F25 R26 N27	D19-L23 WeakPolarHBondContact O-CG 3.38Å; D19-L23 PolarHBondContact O-N 3.33Å; H20-L23 PolarHBondContact O-N 3.35Å; L23-F25 PolarHBondContact O-N 2.92Å; L23-R26 PolarHBondContact O-N 3.35Å; L23-N27 WeakPolarHBondContact O-CB 3.3Å; L23-N27 PolarHBondContact O-N 3.43Å; L23-N27 VanDerWaalsContact O-N 3.12Å; L23-N27 PolarHBondContact O-ND2 3.45Å
24	L	94.5	Very high	95.2	Very high	13 Å²	13	68.6 Å²	68.6	7%	0.068	37%	0.368	C	S	.	.	H	α-helix	trans	-57	-50.8	177	-173.7	68.7	0	0	0	111.4	M1 L4 H20 L21 D22 R26 N27 V28 A42 V43	M1-L24 HydrophobicContact CE-CD1 3.33Å; M1-L24 HydrophobicContact CE-CG 4.4Å; L4-L24 HydrophobicContact CD2-CD1 4.22Å; H20-L24 WeakPolarHBondContact O-CB 3.35Å; H20-L24 PolarHBondContact O-N 3.29Å; L21-L24 HydrophobicContact CD2-CD2 4.48Å; L21-L24 WeakPolarHBondContact O-CB 3.2Å; L21-L24 PolarHBondContact O-N 3.22Å; D22-L24 VanDerWaalsContact C-N 3.34Å; L24-R26 VanDerWaalsContact C-N 3.31Å; L24-R26 PolarHBondContact O-N 2.94Å; L24-N27 PolarHBondContact O-N 2.9Å; L24-V28 PolarHBondContact O-N 3.39Å; L24-A42 HydrophobicContact CD2-CB 3.84Å; L24-V43 HydrophobicContact CD2-CG2 3.77Å
25	F	93.8	Very high	95.1	Very high	18 Å²	18	65.4 Å²	65.4	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-67.9	-27	-180	-64.5	-49	0	0	0	113.9	L21 D22 L23 V43 K57 L58 F61	L21-F25 HydrophobicContact CB-CE2 4.3Å; L21-F25 WeakPolarHBondContact O-CD2 3.38Å; L21-F25 WeakPolarHBondContact O-CG 3.38Å; L21-F25 PolarHBondContact O-N 3.44Å; D22-F25 PolarHBondContact O-N 3.44Å; L23-F25 PolarHBondContact O-N 2.92Å; F25-V43 HydrophobicContact CE1-CG2 3.68Å; F25-V43 HydrophobicContact CZ-CG2 3.66Å; F25-K57 HydrophobicContact CE2-CB 4Å; F25-L58 HydrophobicContact CE1-CD2 4.48Å; F25-L58 HydrophobicContact CZ-CD2 4.11Å; F25-F61 HydrophobicContact CB-CD2 3.9Å; F25-F61 HydrophobicContact CB-CE2 4.09Å; F25-F61 HydrophobicContact CD1-CD2 4.29Å; F25-F61 HydrophobicContact CG-CD2 4.02Å; F25-F61 HydrophobicContact CG-CE2 4.49Å
26	R	92.6	Very high	94.9	Very high	169 Å²	169	66.5 Å²	66.5	64%	0.638	35%	0.348	S	S	*	.	H	α-helix	trans	-77.3	-29.7	177.4	-73.3	172.6	-161.8	-178	6.8	113.1	D22 L23 L24	D22-R26 WeakPolarHBondContact O-CB 3.11Å; D22-R26 WeakPolarHBondContact O-CG 3.49Å; D22-R26 PolarHBondContact O-N 3.18Å; L23-R26 PolarHBondContact O-N 3.35Å; L24-R26 VanDerWaalsContact C-N 3.31Å; L24-R26 PolarHBondContact O-N 2.94Å
27	N	93	Very high	94.9	Very high	116 Å²	116	65 Å²	65	62%	0.62	35%	0.346	S	S	*	.	H	α-helix	trans	-105.6	-6.6	-170	-69.4	-74.8	0	0	0	114.4	L23 L24 V29	L23-N27 WeakPolarHBondContact O-CB 3.3Å; L23-N27 PolarHBondContact O-N 3.43Å; L23-N27 VanDerWaalsContact O-N 3.12Å; L23-N27 PolarHBondContact O-ND2 3.45Å; L24-N27 PolarHBondContact O-N 2.9Å; N27-V29 PolarHBondContact O-N 2.64Å
28	V	93.1	Very high	94.8	Very high	12 Å²	12	65.4 Å²	65.4	7%	0.073	35%	0.35	C	S	.	.			trans	-65.2	127.1	178.7	58.7	0	0	0	0	111.1	L24 Y30 D35 C39	L24-V28 PolarHBondContact O-N 3.39Å; V28-Y30 HydrophobicContact CG1-CD1 4.39Å; V28-Y30 HydrophobicContact CG1-CD2 4.11Å; V28-Y30 HydrophobicContact CG1-CE1 3.74Å; V28-Y30 HydrophobicContact CG1-CE2 3.43Å; V28-Y30 VanDerWaalsContact CG1-CE2 3.43Å; V28-Y30 VanDerWaalsContact CG1-OH 3.22Å; V28-Y30 WeakPolarHBondContact CG1-OH 3.46Å; V28-Y30 HydrophobicContact CG2-CD1 4.39Å; V28-Y30 HydrophobicContact CG2-CE1 4.26Å; V28-Y30 PolarHBondContact O-N 3.24Å; V28-D35 HydrophobicContact CG2-CB 4.09Å; V28-C39 HydrophobicContact CB-CB 4.29Å; V28-C39 HydrophobicContact CG2-CB 3.74Å
29	V	93.1	Very high	94.7	Very high	80 Å²	80	63.7 Å²	63.7	49%	0.485	34%	0.34	S	S	.	.			trans	-86.7	95.4	173.9	-176	0	0	0	0	108.9	N27 A31 S32 D35	N27-V29 PolarHBondContact O-N 2.64Å; V29-A31 HydrophobicContact CG1-CB 4.36Å; V29-A31 PolarHBondContact O-N 3.32Å; V29-S32 WeakPolarHBondContact O-CB 3.31Å; V29-S32 PolarHBondContact O-N 3.05Å; V29-D35 HydrophobicContact CB-CB 4.39Å; V29-D35 VanDerWaalsContact CB-OD2 3.3Å; V29-D35 WeakPolarHBondContact CB-OD2 3.41Å; V29-D35 WeakPolarHBondContact CG2-OD2 3.4Å; V29-D35 PolarHBondContact N-OD2 2.74Å; V29-D35 WeakPolarHBondContact O-CB 3.49Å
30	Y	89.5	Confident	94.6	Very high	112 Å²	112	62.8 Å²	62.8	44%	0.439	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.3	-176.2	-69	-73.8	0	0	0	115.3	V28 S32 R36 F61	V28-Y30 HydrophobicContact CG1-CD1 4.39Å; V28-Y30 HydrophobicContact CG1-CD2 4.11Å; V28-Y30 HydrophobicContact CG1-CE1 3.74Å; V28-Y30 HydrophobicContact CG1-CE2 3.43Å; V28-Y30 VanDerWaalsContact CG1-CE2 3.43Å; V28-Y30 VanDerWaalsContact CG1-OH 3.22Å; V28-Y30 WeakPolarHBondContact CG1-OH 3.46Å; V28-Y30 HydrophobicContact CG2-CD1 4.39Å; V28-Y30 HydrophobicContact CG2-CE1 4.26Å; V28-Y30 PolarHBondContact O-N 3.24Å; Y30-S32 VanDerWaalsContact C-N 3.33Å; Y30-R36 HydrophobicContact CD1-CG 4.09Å; Y30-R36 WeakPolarHBondContact O-CD 3.03Å; Y30-F61 HydrophobicContact CE2-CZ 4.45Å; Y30-F61 AromaticContact CZ-CZ 3.86Å; Y30-F61 WeakPolarHBondContact OH-CE2 3.22Å; Y30-F61 WeakPolarHBondContact OH-CZ 3.48Å
31	A	94.6	Very high	94.6	Very high	102 Å²	102	64.1 Å²	64.1	84%	0.843	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-20	171.8	0	0	0	0	0	113.2	V29	V29-A31 HydrophobicContact CG1-CB 4.36Å; V29-A31 PolarHBondContact O-N 3.32Å
32	S	95.7	Very high	94.6	Very high	36 Å²	36	64.1 Å²	64.1	25%	0.252	35%	0.351	S	S	.	.			trans	-90.6	120.3	177.2	167.2	0	0	0	0	109.6	V29 Y30 S34 D35 R36	V29-S32 WeakPolarHBondContact O-CB 3.31Å; V29-S32 PolarHBondContact O-N 3.05Å; Y30-S32 VanDerWaalsContact C-N 3.33Å; S32-S34 VanDerWaalsContact C-N 3.26Å; S32-S34 PolarHBondContact O-N 2.94Å; S32-D35 WeakPolarHBondContact CB-OD1 3.5Å; S32-D35 PolarHBondContact O-N 2.9Å; S32-D35 PolarHBondContact OG-N 2.9Å; S32-D35 VanDerWaalsContact OG-N 3.14Å; S32-D35 PolarHBondContact OG-OD1 3.37Å; S32-R36 WeakPolarHBondContact O-CG 3.45Å; S32-R36 PolarHBondContact O-N 3.45Å
33	D	95.2	Very high	94.7	Very high	101 Å²	101	63.7 Å²	63.7	54%	0.54	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-34.7	175.6	-170.8	67	0	0	0	112	R36 T37	D33-R36 PolarHBondContact O-N 3.29Å; D33-R36 IonicContact OD1-CZ 2.74Å; D33-R36 IonicContact OD1-NH1 3.89Å; D33-R36 PolarHBondContact OD1-NH1 2.93Å; D33-T37 WeakPolarHBondContact O-CB 3.28Å; D33-T37 PolarHBondContact O-N 3.25Å; D33-T37 PolarHBondContact O-OG1 3.4Å
34	S	94.3	Very high	94.8	Very high	92 Å²	92	61.6 Å²	61.6	64%	0.643	35%	0.347	S	S	*	.	H	α-helix	trans	-64.2	-42.6	175.7	-171	0	0	0	0	111.8	S32 G38	S32-S34 VanDerWaalsContact C-N 3.26Å; S32-S34 PolarHBondContact O-N 2.94Å; S34-G38 PolarHBondContact O-N 3.31Å
35	D	94.4	Very high	95	Very high	48 Å²	48	64.2 Å²	64.2	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-67.9	-41.9	178.3	-74	41.1	0	0	0	111.1	V28 V29 S32 C39	V28-D35 HydrophobicContact CG2-CB 4.09Å; V29-D35 HydrophobicContact CB-CB 4.39Å; V29-D35 VanDerWaalsContact CB-OD2 3.3Å; V29-D35 WeakPolarHBondContact CB-OD2 3.41Å; V29-D35 WeakPolarHBondContact CG2-OD2 3.4Å; V29-D35 PolarHBondContact N-OD2 2.74Å; V29-D35 WeakPolarHBondContact O-CB 3.49Å; S32-D35 WeakPolarHBondContact CB-OD1 3.5Å; S32-D35 PolarHBondContact O-N 2.9Å; S32-D35 PolarHBondContact OG-N 2.9Å; S32-D35 VanDerWaalsContact OG-N 3.14Å; S32-D35 PolarHBondContact OG-OD1 3.37Å; D35-C39 WeakPolarHBondContact O-CB 3.5Å; D35-C39 PolarHBondContact O-N 3.28Å
36	R	94.7	Very high	95.1	Very high	121 Å²	121	63.3 Å²	63.3	46%	0.457	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-50.2	176.2	-78.3	179	46.1	-107.6	-8.5	111.5	Y30 S32 D33 C39 A40	Y30-R36 HydrophobicContact CD1-CG 4.09Å; Y30-R36 WeakPolarHBondContact O-CD 3.03Å; S32-R36 WeakPolarHBondContact O-CG 3.45Å; S32-R36 PolarHBondContact O-N 3.45Å; D33-R36 PolarHBondContact O-N 3.29Å; D33-R36 IonicContact OD1-CZ 2.74Å; D33-R36 IonicContact OD1-NH1 3.89Å; D33-R36 PolarHBondContact OD1-NH1 2.93Å; R36-C39 PolarHBondContact O-N 3.5Å; R36-A40 WeakPolarHBondContact O-CB 3.38Å; R36-A40 PolarHBondContact O-N 2.77Å
37	T	95.9	Very high	95.4	Very high	59 Å²	59	57.3 Å²	57.3	36%	0.362	34%	0.338	S	S	.	.	H	α-helix	trans	-62.5	-49.1	178.8	-60.3	0	0	0	0	110.3	D33 C39 A40 E41	D33-T37 WeakPolarHBondContact O-CB 3.28Å; D33-T37 PolarHBondContact O-N 3.25Å; D33-T37 PolarHBondContact O-OG1 3.4Å; T37-C39 VanDerWaalsContact C-N 3.33Å; T37-C39 PolarHBondContact O-N 3.29Å; T37-A40 PolarHBondContact O-N 3.21Å; T37-A40 VanDerWaalsContact O-N 3.16Å; T37-E41 HydrophobicContact CG2-CG 4.34Å; T37-E41 WeakPolarHBondContact O-CB 3.4Å; T37-E41 VanDerWaalsContact O-CG 3.32Å; T37-E41 WeakPolarHBondContact O-CG 3.48Å; T37-E41 PolarHBondContact O-N 3.43Å
38	G	96	Very high	95.6	Very high	7 Å²	7	58.4 Å²	58.4	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-36.3	179.3	0	0	0	0	0	113.8	M1 S34 A42	M1-G38 WeakPolarHBondContact CB-O 3.29Å; M1-G38 VanDerWaalsContact SD-C 3.57Å; S34-G38 PolarHBondContact O-N 3.31Å; G38-A42 VanDerWaalsContact O-CB 3.27Å; G38-A42 WeakPolarHBondContact O-CB 3.46Å; G38-A42 PolarHBondContact O-N 2.89Å
39	C	95.8	Very high	95.7	Very high	9 Å²	9	59.8 Å²	59.8	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-48.1	173.1	-176.8	0	0	0	0	111	M1 V28 D35 R36 T37 E41 A42 V43	M1-C39 HydrophobicContact CE-CB 3.79Å; V28-C39 HydrophobicContact CB-CB 4.29Å; V28-C39 HydrophobicContact CG2-CB 3.74Å; D35-C39 WeakPolarHBondContact O-CB 3.5Å; D35-C39 PolarHBondContact O-N 3.28Å; R36-C39 PolarHBondContact O-N 3.5Å; T37-C39 VanDerWaalsContact C-N 3.33Å; T37-C39 PolarHBondContact O-N 3.29Å; C39-E41 PolarHBondContact O-N 3Å; C39-A42 PolarHBondContact O-N 2.99Å; C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.45Å; C39-V43 PolarHBondContact O-N 3.45Å
40	A	96	Very high	96	Very high	67 Å²	67	56.7 Å²	56.7	55%	0.554	34%	0.337	S	S	*	.	H	α-helix	trans	-60.9	-44.9	178.9	0	0	0	0	0	111.7	R36 T37 V43 G44	R36-A40 WeakPolarHBondContact O-CB 3.38Å; R36-A40 PolarHBondContact O-N 2.77Å; T37-A40 PolarHBondContact O-N 3.21Å; T37-A40 VanDerWaalsContact O-N 3.16Å; A40-V43 PolarHBondContact O-N 2.88Å; A40-G44 PolarHBondContact O-N 3.35Å
41	E	97	Very high	96.3	Very high	78 Å²	78	56 Å²	56	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-60.8	-47.1	175.1	-71.5	174.9	151	0	0	111.7	I2 T37 C39 V43 G44 F45	I2-E41 WeakPolarHBondContact CD1-OE2 3.39Å; I2-E41 HydrophobicContact CG1-CB 4.09Å; I2-E41 WeakPolarHBondContact CG1-OE2 3.45Å; T37-E41 HydrophobicContact CG2-CG 4.34Å; T37-E41 WeakPolarHBondContact O-CB 3.4Å; T37-E41 VanDerWaalsContact O-CG 3.32Å; T37-E41 WeakPolarHBondContact O-CG 3.48Å; T37-E41 PolarHBondContact O-N 3.43Å; C39-E41 PolarHBondContact O-N 3Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.23Å; E41-G44 PolarHBondContact O-N 3.44Å; E41-G44 VanDerWaalsContact O-N 3.16Å; E41-F45 HydrophobicContact CB-CE2 4.46Å; E41-F45 WeakPolarHBondContact O-CD2 3.43Å; E41-F45 PolarHBondContact O-N 3.38Å
42	A	97.3	Very high	96.5	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-41.8	-179	0	0	0	0	0	112.2	M1 G5 L24 G38 C39 F45 C46	M1-A42 HydrophobicContact CB-CB 4.24Å; G5-A42 WeakPolarHBondContact CA-O 3.26Å; L24-A42 HydrophobicContact CD2-CB 3.84Å; G38-A42 VanDerWaalsContact O-CB 3.27Å; G38-A42 WeakPolarHBondContact O-CB 3.46Å; G38-A42 PolarHBondContact O-N 2.89Å; C39-A42 PolarHBondContact O-N 2.99Å; A42-F45 PolarHBondContact O-N 3.04Å; A42-C46 WeakPolarHBondContact O-CB 3.39Å; A42-C46 PolarHBondContact O-N 3.27Å; A42-C46 VanDerWaalsContact O-N 3.07Å
43	V	97.3	Very high	96.6	Very high	13 Å²	13	56.1 Å²	56.1	8%	0.079	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-43.2	174.4	175.9	0	0	0	0	110.9	L21 L24 F25 C39 A40 E41 F45 C46 S47 V54 L58	L21-V43 HydrophobicContact CD2-CG2 4.3Å; L24-V43 HydrophobicContact CD2-CG2 3.77Å; F25-V43 HydrophobicContact CE1-CG2 3.68Å; F25-V43 HydrophobicContact CZ-CG2 3.66Å; C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.45Å; C39-V43 PolarHBondContact O-N 3.45Å; A40-V43 PolarHBondContact O-N 2.88Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.23Å; V43-F45 PolarHBondContact O-N 2.95Å; V43-C46 WeakPolarHBondContact O-CB 3.48Å; V43-C46 PolarHBondContact O-N 3.27Å; V43-S47 PolarHBondContact O-N 3.19Å; V43-V54 HydrophobicContact CG1-CG1 3.6Å; V43-L58 HydrophobicContact CG1-CD1 4.42Å; V43-L58 HydrophobicContact CG1-CD2 4.35Å
44	G	97.4	Very high	96.7	Very high	39 Å²	39	51.6 Å²	51.6	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-37.4	177.5	0	0	0	0	0	113.8	A40 E41 S47	A40-G44 PolarHBondContact O-N 3.35Å; E41-G44 PolarHBondContact O-N 3.44Å; E41-G44 VanDerWaalsContact O-N 3.16Å; G44-S47 PolarHBondContact O-OG 3.16Å
45	F	97.8	Very high	96.9	Very high	68 Å²	68	52 Å²	52	30%	0.298	29%	0.294	S	S	.	.	H	α-helix	trans	-69.7	-40.6	173.2	-78.5	-65.9	0	0	0	112	I2 V6 S9 E41 A42 V43 S47 Q48	I2-F45 HydrophobicContact CB-CE2 4.43Å; I2-F45 HydrophobicContact CG1-CE2 4.29Å; I2-F45 HydrophobicContact CG2-CD2 4.01Å; I2-F45 HydrophobicContact CG2-CE2 3.62Å; I2-F45 HydrophobicContact CG2-CZ 4.29Å; V6-F45 HydrophobicContact CG2-CB 4.21Å; V6-F45 HydrophobicContact CG2-CD1 3.9Å; V6-F45 HydrophobicContact CG2-CD2 4.19Å; V6-F45 HydrophobicContact CG2-CE1 4.33Å; V6-F45 HydrophobicContact CG2-CG 3.84Å; S9-F45 VanDerWaalsContact CB-O 3.26Å; S9-F45 WeakPolarHBondContact CB-O 3.47Å; E41-F45 HydrophobicContact CB-CE2 4.46Å; E41-F45 WeakPolarHBondContact O-CD2 3.43Å; E41-F45 PolarHBondContact O-N 3.38Å; A42-F45 PolarHBondContact O-N 3.04Å; V43-F45 PolarHBondContact O-N 2.95Å; F45-S47 PolarHBondContact O-N 3.2Å; F45-Q48 WeakPolarHBondContact O-CB 3.49Å; F45-Q48 PolarHBondContact O-N 3.07Å
46	C	97.5	Very high	97.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-31.1	178.7	-171.2	0	0	0	0	112.5	L8 L21 A42 V43 Q48 G49 H50 V54	L8-C46 HydrophobicContact CB-CB 4.33Å; L21-C46 HydrophobicContact CD2-CB 4.37Å; A42-C46 WeakPolarHBondContact O-CB 3.39Å; A42-C46 PolarHBondContact O-N 3.27Å; A42-C46 VanDerWaalsContact O-N 3.07Å; V43-C46 WeakPolarHBondContact O-CB 3.48Å; V43-C46 PolarHBondContact O-N 3.27Å; C46-Q48 PolarHBondContact O-N 3.33Å; C46-G49 PolarHBondContact O-N 3.09Å; C46-H50 PolarHBondContact O-N 3.22Å; C46-H50 VanDerWaalsContact O-N 3.09Å; C46-V54 HydrophobicContact CB-CG2 4.01Å
47	S	97.5	Very high	97.1	Very high	42 Å²	42	48.3 Å²	48.3	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-65.5	-19.3	-179	74.9	0	0	0	0	113.5	V43 G44 F45 G49 I51	V43-S47 PolarHBondContact O-N 3.19Å; G44-S47 PolarHBondContact O-OG 3.16Å; F45-S47 PolarHBondContact O-N 3.2Å; S47-G49 VanDerWaalsContact C-N 3.26Å; S47-G49 PolarHBondContact O-N 3.34Å; S47-I51 PolarHBondContact O-N 3.16Å
48	Q	97	Very high	97.1	Very high	139 Å²	139	49 Å²	49	65%	0.65	29%	0.286	S	S	*	.	H	α-helix	trans	-64.1	-30.3	175.7	-64.4	-175.9	13.6	0	0	112.9	F45 C46	F45-Q48 WeakPolarHBondContact O-CB 3.49Å; F45-Q48 PolarHBondContact O-N 3.07Å; C46-Q48 PolarHBondContact O-N 3.33Å
49	G	96.6	Very high	97.1	Very high	41 Å²	41	53.7 Å²	53.7	42%	0.423	31%	0.306	S	S	.	.	H	α-helix	trans	-106.8	-24.1	179.3	0	0	0	0	0	114.1	C46 S47	C46-G49 PolarHBondContact O-N 3.09Å; S47-G49 VanDerWaalsContact C-N 3.26Å; S47-G49 PolarHBondContact O-N 3.34Å
50	H	97.6	Very high	97	Very high	16 Å²	16	56 Å²	56	7%	0.074	32%	0.318	C	S	.	.	H	α-helix	trans	-142.6	48.5	-167.1	-57.1	-68.5	0	0	0	112.9	L8 V11 V17 C46 D52 I53 V54	L8-H50 PolarHBondContact O-CD2 2.82Å; L8-H50 PolarHBondContact O-NE2 2.99Å; L8-H50 VanDerWaalsContact O-NE2 3.13Å; V11-H50 PolarHBondContact O-CE1 3.41Å; V11-H50 PolarHBondContact O-NE2 3.26Å; V17-H50 HydrophobicContact CG1-CB 4.21Å; C46-H50 PolarHBondContact O-N 3.22Å; C46-H50 VanDerWaalsContact O-N 3.09Å; H50-D52 VanDerWaalsContact C-N 3.31Å; H50-D52 PolarHBondContact O-N 2.98Å; H50-I53 HydrophobicContact CB-CB 4.08Å; H50-I53 HydrophobicContact CB-CD1 4.04Å; H50-I53 HydrophobicContact CB-CG1 4.24Å; H50-I53 PolarHBondContact O-N 3.29Å; H50-I53 VanDerWaalsContact O-N 3.16Å; H50-V54 WeakPolarHBondContact O-CG2 3.43Å; H50-V54 PolarHBondContact O-N 2.95Å
51	I	97.8	Very high	96.8	Very high	96 Å²	96	54.9 Å²	54.9	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-52.9	-44.5	-176.1	-169.1	167.6	0	0	0	113.1	S47 I53 V54 L55	S47-I51 PolarHBondContact O-N 3.16Å; I51-I53 PolarHBondContact O-N 3.42Å; I51-V54 PolarHBondContact O-N 3.45Å; I51-L55 HydrophobicContact CG1-CD1 4.1Å; I51-L55 HydrophobicContact CG1-CG 4.31Å; I51-L55 WeakPolarHBondContact O-CG 3.47Å; I51-L55 PolarHBondContact O-N 2.63Å
52	D	98	Very high	96.4	Very high	120 Å²	120	54 Å²	54	64%	0.642	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-39.8	-178.6	-57.2	-43.7	0	0	0	112.3	H50 T56	H50-D52 VanDerWaalsContact C-N 3.31Å; H50-D52 PolarHBondContact O-N 2.98Å; D52-T56 WeakPolarHBondContact O-CB 3.4Å; D52-T56 PolarHBondContact O-N 3.37Å; D52-T56 PolarHBondContact O-OG1 3.15Å
53	I	97.9	Very high	96.1	Very high	21 Å²	21	59.5 Å²	59.5	11%	0.108	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-48.2	175.2	-58.7	-177.8	0	0	0	109.1	H14 V17 V18 L21 H50 I51 L55 T56 K57	H14-I53 HydrophobicContact CB-CD1 3.86Å; V17-I53 HydrophobicContact CB-CD1 4.49Å; V17-I53 HydrophobicContact CG1-CD1 4.4Å; V17-I53 HydrophobicContact CG1-CG2 4.26Å; V18-I53 HydrophobicContact CG2-CD1 4.48Å; V18-I53 HydrophobicContact CG2-CG2 3.6Å; L21-I53 HydrophobicContact CD1-CG2 4.04Å; H50-I53 HydrophobicContact CB-CB 4.08Å; H50-I53 HydrophobicContact CB-CD1 4.04Å; H50-I53 HydrophobicContact CB-CG1 4.24Å; H50-I53 PolarHBondContact O-N 3.29Å; H50-I53 VanDerWaalsContact O-N 3.16Å; I51-I53 PolarHBondContact O-N 3.42Å; I53-L55 PolarHBondContact O-N 2.88Å; I53-T56 PolarHBondContact O-N 3.49Å; I53-K57 HydrophobicContact CG2-CG 4.19Å; I53-K57 WeakPolarHBondContact O-CB 2.96Å; I53-K57 VanDerWaalsContact O-CG 3.29Å; I53-K57 WeakPolarHBondContact O-CG 3.3Å; I53-K57 PolarHBondContact O-N 3.41Å
54	V	97.9	Very high	95.6	Very high	7 Å²	7	63.1 Å²	63.1	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-46.5	-179.2	169	0	0	0	0	111.3	L21 V43 C46 H50 I51 T56 K57 L58	L21-V54 HydrophobicContact CD1-CG2 4.08Å; V43-V54 HydrophobicContact CG1-CG1 3.6Å; C46-V54 HydrophobicContact CB-CG2 4.01Å; H50-V54 WeakPolarHBondContact O-CG2 3.43Å; H50-V54 PolarHBondContact O-N 2.95Å; I51-V54 PolarHBondContact O-N 3.45Å; V54-T56 PolarHBondContact O-N 3.05Å; V54-K57 PolarHBondContact O-N 3.17Å; V54-L58 HydrophobicContact CG1-CD1 3.9Å; V54-L58 HydrophobicContact CG1-CG 4.38Å; V54-L58 WeakPolarHBondContact O-CB 3.36Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.43Å
55	L	98	Very high	94.8	Very high	101 Å²	101	64.3 Å²	64.3	53%	0.529	34%	0.337	S	S	.	.	H	α-helix	trans	-60.9	-45.9	177.4	-70.8	176.8	0	0	0	111.6	I51 I53 K57 L58 E59	I51-L55 HydrophobicContact CG1-CD1 4.1Å; I51-L55 HydrophobicContact CG1-CG 4.31Å; I51-L55 WeakPolarHBondContact O-CG 3.47Å; I51-L55 PolarHBondContact O-N 2.63Å; I53-L55 PolarHBondContact O-N 2.88Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 3.26Å; L55-L58 PolarHBondContact O-N 3.25Å; L55-E59 PolarHBondContact O-N 3.1Å
56	T	97.5	Very high	93.9	Very high	74 Å²	74	69.7 Å²	69.7	45%	0.454	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-45.9	176.9	-56.7	0	0	0	0	111.1	D52 I53 V54 L58 E59 D60	D52-T56 WeakPolarHBondContact O-CB 3.4Å; D52-T56 PolarHBondContact O-N 3.37Å; D52-T56 PolarHBondContact O-OG1 3.15Å; I53-T56 PolarHBondContact O-N 3.49Å; V54-T56 PolarHBondContact O-N 3.05Å; T56-L58 PolarHBondContact O-N 3.5Å; T56-E59 PolarHBondContact O-N 3.21Å; T56-D60 PolarHBondContact O-N 2.89Å
57	K	95.7	Very high	93	Very high	17 Å²	17	71.9 Å²	71.9	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-66.9	-35.7	-180	-67.5	-50.1	-57.5	179	0	113.1	V18 L21 D22 F25 I53 V54 L55 D60 F61	V18-K57 HydrophobicContact CG1-CD 4.4Å; L21-K57 HydrophobicContact CB-CG 4.38Å; L21-K57 HydrophobicContact CD1-CG 4.14Å; D22-K57 VanDerWaalsContact CG-CE 3.48Å; D22-K57 WeakPolarHBondContact OD1-CE 3.48Å; D22-K57 IonicContact OD1-NZ 2.76Å; D22-K57 PolarHBondContact OD1-NZ 3.1Å; D22-K57 IonicContact OD2-NZ 2.72Å; D22-K57 PolarHBondContact OD2-NZ 3.31Å; F25-K57 HydrophobicContact CE2-CB 4Å; I53-K57 HydrophobicContact CG2-CG 4.19Å; I53-K57 WeakPolarHBondContact O-CB 2.96Å; I53-K57 VanDerWaalsContact O-CG 3.29Å; I53-K57 WeakPolarHBondContact O-CG 3.3Å; I53-K57 PolarHBondContact O-N 3.41Å; V54-K57 PolarHBondContact O-N 3.17Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 3.26Å; K57-D60 IonicContact NZ-OD2 3.79Å; K57-F61 VanDerWaalsContact O-CB 3.28Å; K57-F61 WeakPolarHBondContact O-CB 3.45Å; K57-F61 PolarHBondContact O-N 3.17Å
58	L	96	Very high	92.1	Very high	73 Å²	73	76.2 Å²	76.2	38%	0.382	39%	0.389	S	S	.	.	H	α-helix	trans	-66.6	-40.3	174.8	-73.9	172.6	0	0	0	111.3	F25 V43 V54 L55 T56 F61 A62	F25-L58 HydrophobicContact CE1-CD2 4.48Å; F25-L58 HydrophobicContact CZ-CD2 4.11Å; V43-L58 HydrophobicContact CG1-CD1 4.42Å; V43-L58 HydrophobicContact CG1-CD2 4.35Å; V54-L58 HydrophobicContact CG1-CD1 3.9Å; V54-L58 HydrophobicContact CG1-CG 4.38Å; V54-L58 WeakPolarHBondContact O-CB 3.36Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.43Å; L55-L58 PolarHBondContact O-N 3.25Å; T56-L58 PolarHBondContact O-N 3.5Å; L58-F61 PolarHBondContact O-N 3.2Å; L58-A62 WeakPolarHBondContact O-CB 3.3Å; L58-A62 PolarHBondContact O-N 2.93Å
59	E	95.6	Very high	90.8	Very high	106 Å²	106	77.1 Å²	77.1	50%	0.495	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-47.1	173.9	-168.7	-174.6	166.8	0	0	111.4	L55 T56 F61 A62 K63	L55-E59 PolarHBondContact O-N 3.1Å; T56-E59 PolarHBondContact O-N 3.21Å; E59-F61 VanDerWaalsContact C-N 3.3Å; E59-F61 PolarHBondContact O-N 3.05Å; E59-A62 PolarHBondContact O-N 3.31Å; E59-K63 HydrophobicContact CG-CD 4.37Å; E59-K63 WeakPolarHBondContact O-CG 3.44Å; E59-K63 PolarHBondContact O-N 3.06Å; E59-K63 WeakPolarHBondContact OE1-CE 3.18Å; E59-K63 IonicContact OE1-NZ 3.45Å; E59-K63 PolarHBondContact OE1-NZ 3.44Å
60	D	94.3	Very high	89.5	Confident	58 Å²	58	77.1 Å²	77.1	31%	0.31	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-40.7	175.6	-73.3	-16.9	0	0	0	112.2	T56 K57 R64	T56-D60 PolarHBondContact O-N 2.89Å; K57-D60 IonicContact NZ-OD2 3.79Å; D60-R64 WeakPolarHBondContact O-CB 3.29Å; D60-R64 VanDerWaalsContact O-CG 3.31Å; D60-R64 WeakPolarHBondContact O-CG 3.18Å; D60-R64 PolarHBondContact O-N 2.9Å; D60-R64 PolarHBondContact O-NE 3.03Å
61	F	90.3	Very high	88	Confident	43 Å²	43	80 Å²	80	19%	0.189	40%	0.403	C	S	.	.	H	α-helix	trans	-64.6	-47	176.4	-176.1	-94.6	0	0	0	111.1	F25 Y30 K57 L58 E59 K63 R64 E65	F25-F61 HydrophobicContact CB-CD2 3.9Å; F25-F61 HydrophobicContact CB-CE2 4.09Å; F25-F61 HydrophobicContact CD1-CD2 4.29Å; F25-F61 HydrophobicContact CG-CD2 4.02Å; F25-F61 HydrophobicContact CG-CE2 4.49Å; Y30-F61 HydrophobicContact CE2-CZ 4.45Å; Y30-F61 AromaticContact CZ-CZ 3.86Å; Y30-F61 WeakPolarHBondContact OH-CE2 3.22Å; Y30-F61 WeakPolarHBondContact OH-CZ 3.48Å; K57-F61 VanDerWaalsContact O-CB 3.28Å; K57-F61 WeakPolarHBondContact O-CB 3.45Å; K57-F61 PolarHBondContact O-N 3.17Å; L58-F61 PolarHBondContact O-N 3.2Å; E59-F61 VanDerWaalsContact C-N 3.3Å; E59-F61 PolarHBondContact O-N 3.05Å; F61-K63 PolarHBondContact O-N 3.31Å; F61-R64 PolarHBondContact O-N 3.31Å; F61-E65 HydrophobicContact CD1-CG 4.18Å; F61-E65 HydrophobicContact CE1-CG 3.63Å; F61-E65 HydrophobicContact CE2-CG 4.29Å; F61-E65 HydrophobicContact CZ-CG 3.66Å; F61-E65 WeakPolarHBondContact O-CG 3.17Å; F61-E65 PolarHBondContact O-N 2.9Å
62	A	89.6	Confident	86.3	Confident	59 Å²	59	77 Å²	77	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-43.2	177.2	0	0	0	0	0	112.3	L58 E59 E65 Y66	L58-A62 WeakPolarHBondContact O-CB 3.3Å; L58-A62 PolarHBondContact O-N 2.93Å; E59-A62 PolarHBondContact O-N 3.31Å; A62-E65 PolarHBondContact O-N 3.29Å; A62-Y66 WeakPolarHBondContact O-CB 3.27Å; A62-Y66 PolarHBondContact O-N 3.37Å
63	K	91.1	Very high	84.7	Confident	116 Å²	116	76.4 Å²	76.4	50%	0.504	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-44	175.4	-74.8	173.7	-177.9	165	0	112	E59 F61 Y66 A67	E59-K63 HydrophobicContact CG-CD 4.37Å; E59-K63 WeakPolarHBondContact O-CG 3.44Å; E59-K63 PolarHBondContact O-N 3.06Å; E59-K63 WeakPolarHBondContact OE1-CE 3.18Å; E59-K63 IonicContact OE1-NZ 3.45Å; E59-K63 PolarHBondContact OE1-NZ 3.44Å; F61-K63 PolarHBondContact O-N 3.31Å; K63-Y66 PolarHBondContact O-N 2.99Å; K63-A67 WeakPolarHBondContact O-CB 3.16Å; K63-A67 PolarHBondContact O-N 3.39Å
64	R	86.5	Confident	83.2	Confident	89 Å²	89	82.1 Å²	82.1	34%	0.336	42%	0.416	S	S	.	.	H	α-helix	trans	-62.8	-44.5	177.1	-76.6	-178	-69.3	-179.8	-4	112.1	D22 D60 F61 Y66 A67 K68	D22-R64 IonicContact OD1-NH1 3.78Å; D22-R64 IonicContact OD1-NH2 2.81Å; D22-R64 PolarHBondContact OD1-NH2 2.94Å; D60-R64 WeakPolarHBondContact O-CB 3.29Å; D60-R64 VanDerWaalsContact O-CG 3.31Å; D60-R64 WeakPolarHBondContact O-CG 3.18Å; D60-R64 PolarHBondContact O-N 2.9Å; D60-R64 PolarHBondContact O-NE 3.03Å; F61-R64 PolarHBondContact O-N 3.31Å; R64-Y66 VanDerWaalsContact C-N 3.34Å; R64-A67 PolarHBondContact O-N 2.79Å; R64-K68 WeakPolarHBondContact O-CG 3.44Å; R64-K68 PolarHBondContact O-N 3.34Å
65	E	81.6	Confident	81.5	Confident	65 Å²	65	86.3 Å²	86.3	30%	0.304	44%	0.438	S	S	.	.	H	α-helix	trans	-66.5	-37.5	178.3	-71.1	-60.3	109.9	0	0	112	F61 A62 K68 K69	F61-E65 HydrophobicContact CD1-CG 4.18Å; F61-E65 HydrophobicContact CE1-CG 3.63Å; F61-E65 HydrophobicContact CE2-CG 4.29Å; F61-E65 HydrophobicContact CZ-CG 3.66Å; F61-E65 WeakPolarHBondContact O-CG 3.17Å; F61-E65 PolarHBondContact O-N 2.9Å; A62-E65 PolarHBondContact O-N 3.29Å; E65-K68 PolarHBondContact O-N 3.43Å; E65-K68 WeakPolarHBondContact OE1-CD 3.45Å; E65-K68 WeakPolarHBondContact OE1-CE 3.03Å; E65-K68 IonicContact OE1-NZ 2.64Å; E65-K68 PolarHBondContact OE1-NZ 3.04Å; E65-K69 PolarHBondContact O-N 3.4Å
66	Y	78.3	Confident	80	Confident	180 Å²	180	87.4 Å²	87.4	71%	0.706	44%	0.444	S	S	*	.	H	α-helix	trans	-64.2	-44.1	172.5	-170.1	-93.5	0	0	0	112	A62 K63 R64 K68 K69 S70	A62-Y66 WeakPolarHBondContact O-CB 3.27Å; A62-Y66 PolarHBondContact O-N 3.37Å; K63-Y66 PolarHBondContact O-N 2.99Å; R64-Y66 VanDerWaalsContact C-N 3.34Å; Y66-K68 VanDerWaalsContact C-N 3.35Å; Y66-K68 PolarHBondContact O-N 3.45Å; Y66-K69 WeakPolarHBondContact O-CB 3.46Å; Y66-K69 PolarHBondContact O-N 3.5Å; Y66-S70 PolarHBondContact O-N 3.07Å
67	A	78.1	Confident	78.7	Confident	47 Å²	47	88.8 Å²	88.8	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-38.2	176.7	0	0	0	0	0	112.4	K63 R64 K69 S70 V71	K63-A67 WeakPolarHBondContact O-CB 3.16Å; K63-A67 PolarHBondContact O-N 3.39Å; R64-A67 PolarHBondContact O-N 2.79Å; A67-K69 VanDerWaalsContact C-N 3.31Å; A67-K69 PolarHBondContact O-N 2.84Å; A67-S70 PolarHBondContact O-N 2.93Å; A67-S70 PolarHBondContact O-OG 3.16Å; A67-V71 VanDerWaalsContact O-CG2 3.3Å; A67-V71 WeakPolarHBondContact O-CG2 3.34Å; A67-V71 PolarHBondContact O-N 2.99Å
68	K	77.9	Confident	77.4	Confident	133 Å²	133	95.6 Å²	95.6	58%	0.578	48%	0.477	S	S	*	.	H	α-helix	trans	-62.1	-39.2	173.8	-73.2	176.5	-173.1	168.4	0	112.2	R64 E65 Y66 V71 G72	R64-K68 WeakPolarHBondContact O-CG 3.44Å; R64-K68 PolarHBondContact O-N 3.34Å; E65-K68 PolarHBondContact O-N 3.43Å; E65-K68 WeakPolarHBondContact OE1-CD 3.45Å; E65-K68 WeakPolarHBondContact OE1-CE 3.03Å; E65-K68 IonicContact OE1-NZ 2.64Å; E65-K68 PolarHBondContact OE1-NZ 3.04Å; Y66-K68 VanDerWaalsContact C-N 3.35Å; Y66-K68 PolarHBondContact O-N 3.45Å; K68-V71 PolarHBondContact O-N 3.49Å; K68-G72 PolarHBondContact O-N 3.19Å
69	K	70.9	Confident	76	Confident	157 Å²	157	98.1 Å²	98.1	68%	0.683	50%	0.496	S	S	*	.	H	α-helix	trans	-65.7	-39.1	176.6	-72.9	-178.4	178.9	-178.5	0	112.2	E65 Y66 A67 G72	E65-K69 PolarHBondContact O-N 3.4Å; Y66-K69 WeakPolarHBondContact O-CB 3.46Å; Y66-K69 PolarHBondContact O-N 3.5Å; A67-K69 VanDerWaalsContact C-N 3.31Å; A67-K69 PolarHBondContact O-N 2.84Å; K69-G72 PolarHBondContact O-N 3.22Å
70	S	68.6	Low	74.3	Confident	41 Å²	41	98.4 Å²	98.4	29%	0.287	51%	0.508	S	S	.	.	H	α-helix	trans	-69.3	-39.4	177.5	65.5	0	0	0	0	112.4	Y66 A67 G72 I73 F74	Y66-S70 PolarHBondContact O-N 3.07Å; A67-S70 PolarHBondContact O-N 2.93Å; A67-S70 PolarHBondContact O-OG 3.16Å; S70-G72 VanDerWaalsContact C-N 3.26Å; S70-G72 PolarHBondContact O-N 3.28Å; S70-I73 PolarHBondContact O-N 2.84Å; S70-I73 VanDerWaalsContact O-N 3.1Å; S70-F74 WeakPolarHBondContact O-CD2 3.32Å; S70-F74 PolarHBondContact O-N 3.5Å; S70-F74 VanDerWaalsContact O-N 3.17Å
71	V	66.6	Low	72.3	Confident	77 Å²	77	104.2 Å²	104.2	47%	0.467	55%	0.545	S	S	.	.	H	α-helix	trans	-59.6	-35.8	175.3	173.6	0	0	0	0	111.9	A67 K68 I73 F74 N75	A67-V71 VanDerWaalsContact O-CG2 3.3Å; A67-V71 WeakPolarHBondContact O-CG2 3.34Å; A67-V71 PolarHBondContact O-N 2.99Å; K68-V71 PolarHBondContact O-N 3.49Å; V71-I73 VanDerWaalsContact C-N 3.28Å; V71-I73 PolarHBondContact O-N 3.31Å; V71-F74 PolarHBondContact O-N 3.17Å; V71-N75 PolarHBondContact O-N 2.98Å
72	G	61.8	Low	71.4	Confident	34 Å²	34	107.3 Å²	107.3	35%	0.351	56%	0.563	S	S	.	*	H	α-helix	trans	-58.2	-39	175.1	0	0	0	0	0	113.2	K68 K69 S70 L76	K68-G72 PolarHBondContact O-N 3.19Å; K69-G72 PolarHBondContact O-N 3.22Å; S70-G72 VanDerWaalsContact C-N 3.26Å; S70-G72 PolarHBondContact O-N 3.28Å; G72-L76 WeakPolarHBondContact O-CG 3.49Å; G72-L76 PolarHBondContact O-N 3.14Å; G72-L76 VanDerWaalsContact O-N 3.15Å
73	I	64.9	Low	70.4	Confident	106 Å²	106	109.8 Å²	109.8	54%	0.544	57%	0.567	S	S	.	*	H	α-helix	trans	-73	-41.1	178.5	-57	168.1	0	0	0	110.6	S70 V71 N75 L76 L77	S70-I73 PolarHBondContact O-N 2.84Å; S70-I73 VanDerWaalsContact O-N 3.1Å; V71-I73 VanDerWaalsContact C-N 3.28Å; V71-I73 PolarHBondContact O-N 3.31Å; I73-N75 VanDerWaalsContact C-N 3.3Å; I73-N75 PolarHBondContact O-N 3.16Å; I73-L76 PolarHBondContact O-N 3.43Å; I73-L77 WeakPolarHBondContact O-CG 3.46Å; I73-L77 PolarHBondContact O-N 3.04Å
74	F	65.7	Low	69.2	Low	142 Å²	142	109.4 Å²	109.4	62%	0.623	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-35.9	175.1	-75.5	-70.8	0	0	0	112.5	S70 V71 L77 K78	S70-F74 WeakPolarHBondContact O-CD2 3.32Å; S70-F74 PolarHBondContact O-N 3.5Å; S70-F74 VanDerWaalsContact O-N 3.17Å; V71-F74 PolarHBondContact O-N 3.17Å; F74-L77 PolarHBondContact O-N 3.37Å; F74-K78 WeakPolarHBondContact O-CB 3.33Å; F74-K78 PolarHBondContact O-N 3.44Å
75	N	63.4	Low	68.2	Low	95 Å²	95	110.6 Å²	110.6	51%	0.508	58%	0.584	S	S	.	*	H	α-helix	trans	-68.4	-36.6	174.5	-80.3	-9.1	0	0	0	112.5	V71 I73 L77 K78 V79	V71-N75 PolarHBondContact O-N 2.98Å; I73-N75 VanDerWaalsContact C-N 3.3Å; I73-N75 PolarHBondContact O-N 3.16Å; N75-L77 VanDerWaalsContact C-N 3.32Å; N75-L77 PolarHBondContact O-N 2.85Å; N75-K78 PolarHBondContact O-N 2.93Å; N75-V79 WeakPolarHBondContact O-CG2 3.14Å; N75-V79 PolarHBondContact O-N 2.91Å
76	L	66.4	Low	67.4	Low	124 Å²	124	113.5 Å²	113.5	65%	0.649	60%	0.601	S	S	*	*	H	α-helix	trans	-63.2	-39.2	173	-71.5	164.9	0	0	0	111.5	G72 I73 V79	G72-L76 WeakPolarHBondContact O-CG 3.49Å; G72-L76 PolarHBondContact O-N 3.14Å; G72-L76 VanDerWaalsContact O-N 3.15Å; I73-L76 PolarHBondContact O-N 3.43Å; L76-V79 PolarHBondContact O-N 2.84Å
77	L	69.7	Low	66.7	Low	103 Å²	103	109.1 Å²	109.1	54%	0.539	60%	0.595	S	S	.	*	H	α-helix	trans	-69.2	-36.8	175.6	-67.6	171	0	0	0	112.5	I73 F74 N75 V79 C80 V81	I73-L77 WeakPolarHBondContact O-CG 3.46Å; I73-L77 PolarHBondContact O-N 3.04Å; F74-L77 PolarHBondContact O-N 3.37Å; N75-L77 VanDerWaalsContact C-N 3.32Å; N75-L77 PolarHBondContact O-N 2.85Å; L77-V79 VanDerWaalsContact C-N 3.25Å; L77-V79 PolarHBondContact O-N 3.33Å; L77-C80 PolarHBondContact O-N 2.87Å; L77-C80 VanDerWaalsContact O-N 3.1Å; L77-V81 PolarHBondContact O-N 2.81Å
78	K	68	Low	65.9	Low	159 Å²	159	113.5 Å²	113.5	69%	0.691	61%	0.609	S	S	*	*	H	α-helix	trans	-70.3	-18.4	177.7	-159.8	-172.8	175.3	77.6	0	113.3	F74 N75 C80	F74-K78 WeakPolarHBondContact O-CB 3.33Å; F74-K78 PolarHBondContact O-N 3.44Å; N75-K78 PolarHBondContact O-N 2.93Å; K78-C80 VanDerWaalsContact C-N 3.33Å
79	V	67.7	Low	64.9	Low	127 Å²	127	112 Å²	112	77%	0.77	61%	0.612	S	S	*	*	H	α-helix	trans	-82.3	-16.3	172.1	174.3	0	0	0	0	111.5	N75 L76 L77	N75-V79 WeakPolarHBondContact O-CG2 3.14Å; N75-V79 PolarHBondContact O-N 2.91Å; L76-V79 PolarHBondContact O-N 2.84Å; L77-V79 VanDerWaalsContact C-N 3.25Å; L77-V79 PolarHBondContact O-N 3.33Å
80	C	58.3	Low	64.4	Low	111 Å²	111	108.3 Å²	108.3	75%	0.75	61%	0.606	S	S	*	*			trans	-100.1	-3.3	179	-64	0	0	0	0	114.2	L77 K78	L77-C80 PolarHBondContact O-N 2.87Å; L77-C80 VanDerWaalsContact O-N 3.1Å; K78-C80 VanDerWaalsContact C-N 3.33Å
81	V	52.1	Low	64.1	Low	180 Å²	180	114.4 Å²	114.4	100%	1.091	64%	0.635	S	S	*	*			trans	-119.3	0	176.5	-179	0	0	0	0	109.1	L77	L77-V81 PolarHBondContact O-N 2.81Å

Retrieved 81 of 81 residues in 37.3 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).