G4VS15_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VS15, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 82 aa.

						>G4VS15_SCHMA|G4VS15
MPVTNAVYLLLVNRLYQLLKECFSKTNLSVLLHLNIKRSIQTISVSILITLHDQNYLLKLCIQLNECSRVRVEVKKNLVYLR
					

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	43.2	Very low	57.6	Low	213 Å²	213	109.3 Å²	109.3	100%	1.049	60%	0.599	S	S	*	*				0	111.1	0	-72.2	-174.6	145.9	0	0	108.6	V3 T4	M1-V3 VanDerWaalsContact C-N 3.35Å; M1-T4 PolarHBondContact O-OG1 3.4Å
2	P	51.4	Low	57.8	Low	109 Å²	109	105.8 Å²	105.8	71%	0.708	58%	0.583	S	S	*	*			trans	-78.2	-13.1	-173.9	28.6	-33.3	0	0	0	114.7	T4 N5	P2-T4 VanDerWaalsContact C-N 3.32Å; P2-T4 PolarHBondContact O-N 3.29Å; P2-N5 PolarHBondContact O-N 3.12Å
3	V	51.5	Low	58.6	Low	106 Å²	106	104.8 Å²	104.8	64%	0.642	58%	0.576	S	S	*	*	H	α-helix	trans	-63.6	-35.5	-175.2	-171	0	0	0	0	112.3	M1 N5 A6 V7	M1-V3 VanDerWaalsContact C-N 3.35Å; V3-N5 VanDerWaalsContact C-N 3.27Å; V3-N5 PolarHBondContact O-N 2.84Å; V3-A6 PolarHBondContact O-N 3.36Å; V3-V7 PolarHBondContact O-N 3.22Å
4	T	55.1	Low	58.9	Low	78 Å²	78	109.2 Å²	109.2	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-61.9	-35.7	177.3	-5.2	0	0	0	0	112.2	M1 P2 Y8	M1-T4 PolarHBondContact O-OG1 3.4Å; P2-T4 VanDerWaalsContact C-N 3.32Å; P2-T4 PolarHBondContact O-N 3.29Å; T4-Y8 WeakPolarHBondContact O-CB 3.48Å; T4-Y8 PolarHBondContact O-N 3.46Å; T4-Y8 VanDerWaalsContact O-N 3.12Å
5	N	54.6	Low	58.8	Low	110 Å²	110	105.2 Å²	105.2	59%	0.588	56%	0.559	S	S	*	*	H	α-helix	trans	-72.7	-38	-176.6	-134.8	30	0	0	0	111.6	P2 V3 L9	P2-N5 PolarHBondContact O-N 3.12Å; V3-N5 VanDerWaalsContact C-N 3.27Å; V3-N5 PolarHBondContact O-N 2.84Å; N5-L9 WeakPolarHBondContact O-CB 3.5Å; N5-L9 PolarHBondContact O-N 2.91Å
6	A	66.7	Low	58.9	Low	55 Å²	55	107.9 Å²	107.9	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-44	178.6	0	0	0	0	0	112.3	V3 L9 L10	V3-A6 PolarHBondContact O-N 3.36Å; A6-L9 PolarHBondContact O-N 3.46Å; A6-L10 WeakPolarHBondContact O-CB 3.39Å; A6-L10 WeakPolarHBondContact O-CG 3.46Å; A6-L10 PolarHBondContact O-N 3.16Å
7	V	61.9	Low	59.2	Low	80 Å²	80	107.9 Å²	107.9	49%	0.485	56%	0.557	S	S	.	*	H	α-helix	trans	-65.8	-42.8	177.9	179.1	0	0	0	0	110.7	V3 L10 L11	V3-V7 PolarHBondContact O-N 3.22Å; V7-L10 PolarHBondContact O-N 3.41Å; V7-L11 HydrophobicContact CG1-CD1 4.12Å; V7-L11 WeakPolarHBondContact O-CG 3.12Å; V7-L11 PolarHBondContact O-N 3.24Å
8	Y	58.5	Low	58.9	Low	137 Å²	137	106.6 Å²	106.6	54%	0.537	55%	0.55	S	S	.	*	H	α-helix	trans	-59.4	-47.6	174.8	-178.1	-98.1	0	0	0	111.5	T4 L10 L11 V12	T4-Y8 WeakPolarHBondContact O-CB 3.48Å; T4-Y8 PolarHBondContact O-N 3.46Å; T4-Y8 VanDerWaalsContact O-N 3.12Å; Y8-L10 VanDerWaalsContact C-N 3.35Å; Y8-L10 PolarHBondContact O-N 2.92Å; Y8-L11 PolarHBondContact O-N 2.96Å; Y8-V12 HydrophobicContact CD1-CG2 4.08Å; Y8-V12 HydrophobicContact CE1-CG2 3.7Å; Y8-V12 HydrophobicContact CE2-CG2 4.22Å; Y8-V12 HydrophobicContact CG-CG2 4.5Å; Y8-V12 VanDerWaalsContact O-CG2 3.3Å; Y8-V12 WeakPolarHBondContact O-CG2 3.47Å; Y8-V12 PolarHBondContact O-N 3.07Å
9	L	64.9	Low	58.5	Low	105 Å²	105	104.4 Å²	104.4	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-60	-43.9	176.8	-116.3	126.4	0	0	0	111.9	N5 A6 L11 V12 N13	N5-L9 WeakPolarHBondContact O-CB 3.5Å; N5-L9 PolarHBondContact O-N 2.91Å; A6-L9 PolarHBondContact O-N 3.46Å; L9-L11 PolarHBondContact O-N 3.11Å; L9-V12 PolarHBondContact O-N 3.42Å; L9-N13 VanDerWaalsContact O-CB 3.28Å; L9-N13 WeakPolarHBondContact O-CB 3.42Å; L9-N13 PolarHBondContact O-N 2.89Å
10	L	66.6	Low	58.1	Low	123 Å²	123	106.4 Å²	106.4	64%	0.644	54%	0.543	S	S	*	.	H	α-helix	trans	-61	-43.4	176.7	-80.7	165.7	0	0	0	112.1	A6 V7 Y8 N13 R14	A6-L10 WeakPolarHBondContact O-CB 3.39Å; A6-L10 WeakPolarHBondContact O-CG 3.46Å; A6-L10 PolarHBondContact O-N 3.16Å; V7-L10 PolarHBondContact O-N 3.41Å; Y8-L10 VanDerWaalsContact C-N 3.35Å; Y8-L10 PolarHBondContact O-N 2.92Å; L10-N13 PolarHBondContact O-N 2.86Å; L10-R14 VanDerWaalsContact O-CB 3.3Å; L10-R14 WeakPolarHBondContact O-CB 3.49Å; L10-R14 PolarHBondContact O-N 2.94Å
11	L	59.5	Low	58	Low	86 Å²	86	107.5 Å²	107.5	45%	0.45	55%	0.546	S	S	.	.	H	α-helix	trans	-63.2	-46.2	176.9	-76.6	168.4	0	0	0	111.5	V7 Y8 L9 N13 R14 L15	V7-L11 HydrophobicContact CG1-CD1 4.12Å; V7-L11 WeakPolarHBondContact O-CG 3.12Å; V7-L11 PolarHBondContact O-N 3.24Å; Y8-L11 PolarHBondContact O-N 2.96Å; L9-L11 PolarHBondContact O-N 3.11Å; L11-N13 VanDerWaalsContact C-N 3.34Å; L11-N13 PolarHBondContact O-N 3.12Å; L11-R14 PolarHBondContact O-N 3.38Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 WeakPolarHBondContact O-CG 3.31Å; L11-L15 PolarHBondContact O-N 2.95Å
12	V	60.3	Low	58.2	Low	68 Å²	68	99.1 Å²	99.1	41%	0.412	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-42.4	177.3	172.9	0	0	0	0	110.8	Y8 L9 L15 Y16	Y8-V12 HydrophobicContact CD1-CG2 4.08Å; Y8-V12 HydrophobicContact CE1-CG2 3.7Å; Y8-V12 HydrophobicContact CE2-CG2 4.22Å; Y8-V12 HydrophobicContact CG-CG2 4.5Å; Y8-V12 VanDerWaalsContact O-CG2 3.3Å; Y8-V12 WeakPolarHBondContact O-CG2 3.47Å; Y8-V12 PolarHBondContact O-N 3.07Å; L9-V12 PolarHBondContact O-N 3.42Å; V12-L15 WeakPolarHBondContact O-CB 3.29Å; V12-L15 PolarHBondContact O-N 3.32Å; V12-Y16 WeakPolarHBondContact O-CB 3.13Å; V12-Y16 PolarHBondContact O-N 2.66Å
13	N	67.5	Low	58	Low	92 Å²	92	101.4 Å²	101.4	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-68.9	-39.1	-179.8	-139.7	12.7	0	0	0	111.5	L9 L10 L11 L15 Y16 Q17	L9-N13 VanDerWaalsContact O-CB 3.28Å; L9-N13 WeakPolarHBondContact O-CB 3.42Å; L9-N13 PolarHBondContact O-N 2.89Å; L10-N13 PolarHBondContact O-N 2.86Å; L11-N13 VanDerWaalsContact C-N 3.34Å; L11-N13 PolarHBondContact O-N 3.12Å; N13-L15 VanDerWaalsContact C-N 3.34Å; N13-Y16 PolarHBondContact O-N 3.49Å; N13-Q17 WeakPolarHBondContact O-CG 3.47Å; N13-Q17 PolarHBondContact O-N 3.47Å
14	R	63.4	Low	58	Low	167 Å²	167	101 Å²	101	63%	0.63	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-40.6	174.5	-166.9	68.9	177.8	-138.3	2.9	111.3	L10 L11 Q17 L18	L10-R14 VanDerWaalsContact O-CB 3.3Å; L10-R14 WeakPolarHBondContact O-CB 3.49Å; L10-R14 PolarHBondContact O-N 2.94Å; L11-R14 PolarHBondContact O-N 3.38Å; R14-Q17 PolarHBondContact O-N 2.93Å; R14-L18 HydrophobicContact CG-CD1 4.4Å; R14-L18 WeakPolarHBondContact O-CB 3.45Å; R14-L18 VanDerWaalsContact O-CG 3.29Å; R14-L18 WeakPolarHBondContact O-CG 3.18Å; R14-L18 PolarHBondContact O-N 3.29Å
15	L	57.1	Low	57.8	Low	49 Å²	49	104 Å²	104	26%	0.257	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-45.3	173.1	-89.3	159.7	0	0	0	112	L11 V12 N13 Q17 L18 L19 I43	L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 WeakPolarHBondContact O-CG 3.31Å; L11-L15 PolarHBondContact O-N 2.95Å; V12-L15 WeakPolarHBondContact O-CB 3.29Å; V12-L15 PolarHBondContact O-N 3.32Å; N13-L15 VanDerWaalsContact C-N 3.34Å; L15-Q17 PolarHBondContact O-N 3.18Å; L15-L18 PolarHBondContact O-N 3.49Å; L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 3.42Å; L15-I43 HydrophobicContact CD1-CD1 4.34Å; L15-I43 HydrophobicContact CD1-CG2 4.34Å; L15-I43 HydrophobicContact CD2-CD1 3.7Å; L15-I43 HydrophobicContact CG-CD1 4.32Å
16	Y	60.2	Low	57.2	Low	149 Å²	149	104.1 Å²	104.1	58%	0.584	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-43.1	177.8	-176.8	-99.3	0	0	0	112	V12 N13 L19 K20	V12-Y16 WeakPolarHBondContact O-CB 3.13Å; V12-Y16 PolarHBondContact O-N 2.66Å; N13-Y16 PolarHBondContact O-N 3.49Å; Y16-L19 PolarHBondContact O-N 3.15Å; Y16-K20 WeakPolarHBondContact O-CB 3.44Å; Y16-K20 PolarHBondContact O-N 3.32Å
17	Q	64.1	Low	56.3	Low	108 Å²	108	109.8 Å²	109.8	51%	0.505	54%	0.543	S	S	.	.	H	α-helix	trans	-62.1	-46.1	174.6	-75.7	-177.2	-35.9	0	0	112.2	N13 R14 L15 L19 K20 E21	N13-Q17 WeakPolarHBondContact O-CG 3.47Å; N13-Q17 PolarHBondContact O-N 3.47Å; R14-Q17 PolarHBondContact O-N 2.93Å; L15-Q17 PolarHBondContact O-N 3.18Å; Q17-L19 VanDerWaalsContact C-N 3.32Å; Q17-L19 PolarHBondContact O-N 3.39Å; Q17-K20 PolarHBondContact O-N 2.87Å; Q17-K20 VanDerWaalsContact O-N 3.16Å; Q17-E21 WeakPolarHBondContact O-CG 3.42Å; Q17-E21 PolarHBondContact O-N 2.89Å
18	L	54	Low	55.7	Low	84 Å²	84	109.8 Å²	109.8	44%	0.44	54%	0.54	S	S	.	.	H	α-helix	trans	-60.8	-41.4	177.2	-74.5	170.1	0	0	0	111.7	R14 L15 E21 C22	R14-L18 HydrophobicContact CG-CD1 4.4Å; R14-L18 WeakPolarHBondContact O-CB 3.45Å; R14-L18 VanDerWaalsContact O-CG 3.29Å; R14-L18 WeakPolarHBondContact O-CG 3.18Å; R14-L18 PolarHBondContact O-N 3.29Å; L15-L18 PolarHBondContact O-N 3.49Å; L18-E21 PolarHBondContact O-N 2.89Å; L18-C22 WeakPolarHBondContact O-CB 3.38Å; L18-C22 PolarHBondContact O-N 3.34Å; L18-C22 PolarHBondContact O-SG 3.4Å
19	L	51.1	Low	55.5	Low	65 Å²	65	107.4 Å²	107.4	34%	0.34	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-44.6	174.3	-80.9	162.9	0	0	0	111.4	L15 Y16 Q17 C22 F23 I36	L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 3.42Å; Y16-L19 PolarHBondContact O-N 3.15Å; Q17-L19 VanDerWaalsContact C-N 3.32Å; Q17-L19 PolarHBondContact O-N 3.39Å; L19-C22 PolarHBondContact O-N 2.91Å; L19-F23 WeakPolarHBondContact O-CD2 3.28Å; L19-F23 PolarHBondContact O-N 3Å; L19-I36 HydrophobicContact CD2-CD1 4.35Å; L19-I36 HydrophobicContact CD2-CG2 4.25Å
20	K	50.7	Low	54.8	Low	143 Å²	143	108.1 Å²	108.1	62%	0.622	55%	0.552	S	S	*	*	H	α-helix	trans	-63.3	-42.5	178.9	-171.9	173.7	-179.5	178.5	0	112.1	Y16 Q17 C22 F23 S24	Y16-K20 WeakPolarHBondContact O-CB 3.44Å; Y16-K20 PolarHBondContact O-N 3.32Å; Q17-K20 PolarHBondContact O-N 2.87Å; Q17-K20 VanDerWaalsContact O-N 3.16Å; K20-C22 VanDerWaalsContact C-N 3.34Å; K20-F23 PolarHBondContact O-N 2.84Å; K20-S24 PolarHBondContact O-N 3.37Å
21	E	56.4	Low	53.9	Low	130 Å²	130	108.1 Å²	108.1	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-65.5	-36.7	174.6	-72	-173	149.8	0	0	112.4	Q17 L18	Q17-E21 WeakPolarHBondContact O-CG 3.42Å; Q17-E21 PolarHBondContact O-N 2.89Å; L18-E21 PolarHBondContact O-N 2.89Å
22	C	46.1	Very low	53.4	Low	37 Å²	37	105.8 Å²	105.8	25%	0.25	54%	0.54	C	S	.	.	H	α-helix	trans	-67.3	-42.9	176.4	-72.1	0	0	0	0	112	L18 L19 K20 S24 K25 L32 I36	L18-C22 WeakPolarHBondContact O-CB 3.38Å; L18-C22 PolarHBondContact O-N 3.34Å; L18-C22 PolarHBondContact O-SG 3.4Å; L19-C22 PolarHBondContact O-N 2.91Å; K20-C22 VanDerWaalsContact C-N 3.34Å; C22-S24 VanDerWaalsContact C-N 3.29Å; C22-S24 PolarHBondContact O-N 2.75Å; C22-K25 PolarHBondContact O-N 3Å; C22-L32 HydrophobicContact CB-CD1 4.1Å; C22-L32 HydrophobicContact CB-CD2 4.47Å; C22-I36 HydrophobicContact CB-CD1 4.49Å
23	F	49	Very low	52.8	Low	157 Å²	157	108.9 Å²	108.9	69%	0.689	55%	0.549	S	S	*	.	H	α-helix	trans	-65.3	-31.5	178.4	-98.1	-83.2	0	0	0	112.9	L19 K20 K25 T26	L19-F23 WeakPolarHBondContact O-CD2 3.28Å; L19-F23 PolarHBondContact O-N 3Å; K20-F23 PolarHBondContact O-N 2.84Å; F23-K25 VanDerWaalsContact C-N 3.26Å; F23-K25 PolarHBondContact O-N 3.48Å; F23-T26 WeakPolarHBondContact O-CG2 3.24Å
24	S	51.5	Low	51.9	Low	97 Å²	97	110.2 Å²	110.2	68%	0.678	56%	0.556	S	S	*	*	H	α-helix	trans	-69.6	-20.6	178.5	-170.2	0	0	0	0	113.7	K20 C22 T26	K20-S24 PolarHBondContact O-N 3.37Å; C22-S24 VanDerWaalsContact C-N 3.29Å; C22-S24 PolarHBondContact O-N 2.75Å; S24-T26 PolarHBondContact O-N 3.47Å
25	K	49.1	Very low	51.3	Low	143 Å²	143	107.2 Å²	107.2	62%	0.622	55%	0.552	S	S	*	*	S	Bend	trans	-100.6	63.4	-178.9	-67.3	-179.3	-179.8	174.8	0	109.7	C22 F23 N27 L28	C22-K25 PolarHBondContact O-N 3Å; F23-K25 VanDerWaalsContact C-N 3.26Å; F23-K25 PolarHBondContact O-N 3.48Å; K25-N27 PolarHBondContact O-N 2.93Å; K25-L28 HydrophobicContact CB-CD1 4.34Å; K25-L28 PolarHBondContact O-N 3.24Å; K25-L28 VanDerWaalsContact O-N 3.12Å
26	T	42.5	Very low	51	Low	112 Å²	112	106.7 Å²	106.7	69%	0.687	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	9.3	-165.9	37.5	0	0	0	0	118.3	F23 S24	F23-T26 WeakPolarHBondContact O-CG2 3.24Å; S24-T26 PolarHBondContact O-N 3.47Å
27	N	49.3	Very low	50.5	Low	174 Å²	174	105.7 Å²	105.7	93%	0.93	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	1.7	167.5	-92.9	-2.7	0	0	0	114.9	K25	K25-N27 PolarHBondContact O-N 2.93Å
28	L	49.2	Very low	50.1	Low	80 Å²	80	109.1 Å²	109.1	42%	0.419	56%	0.556	S	S	.	*			trans	-94.3	-3.2	175	-92.5	141.6	0	0	0	114.3	K25 V30 L31 L32	K25-L28 HydrophobicContact CB-CD1 4.34Å; K25-L28 PolarHBondContact O-N 3.24Å; K25-L28 VanDerWaalsContact O-N 3.12Å; L28-V30 VanDerWaalsContact C-N 3.31Å; L28-V30 PolarHBondContact O-N 3.2Å; L28-L31 PolarHBondContact O-N 3.48Å; L28-L31 VanDerWaalsContact O-N 3.12Å; L28-L32 HydrophobicContact CB-CD1 3.87Å; L28-L32 HydrophobicContact CD2-CD1 4.28Å; L28-L32 HydrophobicContact CG-CD1 4.47Å; L28-L32 WeakPolarHBondContact O-CB 3.13Å; L28-L32 PolarHBondContact O-N 3.31Å
29	S	52.3	Low	50	Low	87 Å²	87	107.6 Å²	107.6	61%	0.608	55%	0.553	S	S	*	*	H	α-helix	trans	-47	-42.8	-166.5	-177.6	0	0	0	0	115	H33	S29-H33 VanDerWaalsContact O-CB 3.31Å; S29-H33 WeakPolarHBondContact O-CB 3.44Å; S29-H33 PolarHBondContact O-N 2.78Å
30	V	50.7	Low	50.2	Low	119 Å²	119	108.8 Å²	108.8	72%	0.721	56%	0.559	S	S	*	*	H	α-helix	trans	-75.8	-44.2	-177.1	-177.1	0	0	0	0	112.4	L28 H33	L28-V30 VanDerWaalsContact C-N 3.31Å; L28-V30 PolarHBondContact O-N 3.2Å; V30-H33 PolarHBondContact O-N 3.37Å
31	L	48.5	Very low	50.3	Low	124 Å²	124	107.2 Å²	107.2	65%	0.649	55%	0.554	S	S	*	*	H	α-helix	trans	-69.3	-37.2	177.9	-80.5	162	0	0	0	111.4	L28 N35	L28-L31 PolarHBondContact O-N 3.48Å; L28-L31 VanDerWaalsContact O-N 3.12Å; L31-N35 PolarHBondContact O-N 3.41Å
32	L	48.5	Very low	50.3	Low	37 Å²	37	104.7 Å²	104.7	19%	0.194	55%	0.547	C	S	.	.	H	α-helix	trans	-76.4	-29.4	176.5	-106.6	159.2	0	0	0	112.4	C22 L28 L34 N35 I36	C22-L32 HydrophobicContact CB-CD1 4.1Å; C22-L32 HydrophobicContact CB-CD2 4.47Å; L28-L32 HydrophobicContact CB-CD1 3.87Å; L28-L32 HydrophobicContact CD2-CD1 4.28Å; L28-L32 HydrophobicContact CG-CD1 4.47Å; L28-L32 WeakPolarHBondContact O-CB 3.13Å; L28-L32 PolarHBondContact O-N 3.31Å; L32-L34 VanDerWaalsContact C-N 3.25Å; L32-L34 PolarHBondContact O-N 3.01Å; L32-N35 HydrophobicContact CD2-CB 4.36Å; L32-N35 CarbonylContact O-C 3.55Å; L32-N35 PolarHBondContact O-N 2.91Å; L32-N35 VanDerWaalsContact O-N 3.15Å; L32-I36 HydrophobicContact CB-CD1 4.14Å; L32-I36 HydrophobicContact CD2-CD1 3.9Å; L32-I36 HydrophobicContact CD2-CG1 3.65Å; L32-I36 WeakPolarHBondContact O-CA 3.4Å; L32-I36 WeakPolarHBondContact O-CB 3.45Å; L32-I36 WeakPolarHBondContact O-CD1 3.5Å; L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.42Å
33	H	47.3	Very low	50.6	Low	132 Å²	132	105.2 Å²	105.2	61%	0.611	55%	0.547	S	S	*	.	H	α-helix	trans	-61	-38.2	173.9	-166.7	-110.8	0	0	0	111.7	S29 V30 K37	S29-H33 VanDerWaalsContact O-CB 3.31Å; S29-H33 WeakPolarHBondContact O-CB 3.44Å; S29-H33 PolarHBondContact O-N 2.78Å; V30-H33 PolarHBondContact O-N 3.37Å; H33-K37 VanDerWaalsContact O-CB 3.24Å; H33-K37 WeakPolarHBondContact O-CB 3.4Å; H33-K37 PolarHBondContact O-N 2.92Å
34	L	49.3	Very low	50.7	Low	121 Å²	121	100.3 Å²	100.3	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-46.8	171.6	-75.5	164.2	0	0	0	112	L32 K37 R38	L32-L34 VanDerWaalsContact C-N 3.25Å; L32-L34 PolarHBondContact O-N 3.01Å; L34-K37 PolarHBondContact O-N 3.4Å; L34-R38 WeakPolarHBondContact O-CB 3.24Å; L34-R38 PolarHBondContact O-N 2.91Å
35	N	51.5	Low	50.7	Low	103 Å²	103	99.3 Å²	99.3	55%	0.551	52%	0.522	S	S	*	.	H	α-helix	trans	-69.2	-36.4	179.6	-87	-10.8	0	0	0	113.6	L31 L32 R38 S39	L31-N35 PolarHBondContact O-N 3.41Å; L32-N35 HydrophobicContact CD2-CB 4.36Å; L32-N35 CarbonylContact O-C 3.55Å; L32-N35 PolarHBondContact O-N 2.91Å; L32-N35 VanDerWaalsContact O-N 3.15Å; N35-R38 PolarHBondContact O-N 3.44Å; N35-S39 WeakPolarHBondContact O-CB 3.38Å; N35-S39 PolarHBondContact O-N 2.83Å
36	I	50.5	Low	50.8	Low	39 Å²	39	95.9 Å²	95.9	20%	0.2	52%	0.516	C	S	.	.	H	α-helix	trans	-67.6	-45.6	176	-70.1	163.7	0	0	0	108.7	L19 C22 L32 R38 S39 I40	L19-I36 HydrophobicContact CD2-CD1 4.35Å; L19-I36 HydrophobicContact CD2-CG2 4.25Å; C22-I36 HydrophobicContact CB-CD1 4.49Å; L32-I36 HydrophobicContact CB-CD1 4.14Å; L32-I36 HydrophobicContact CD2-CD1 3.9Å; L32-I36 HydrophobicContact CD2-CG1 3.65Å; L32-I36 WeakPolarHBondContact O-CA 3.4Å; L32-I36 WeakPolarHBondContact O-CB 3.45Å; L32-I36 WeakPolarHBondContact O-CD1 3.5Å; L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.42Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 2.78Å; I36-S39 PolarHBondContact O-N 2.89Å; I36-I40 HydrophobicContact CG2-CD1 3.48Å; I36-I40 VanDerWaalsContact CG2-CD1 3.48Å; I36-I40 HydrophobicContact CG2-CG1 4.08Å; I36-I40 WeakPolarHBondContact O-CB 3.3Å; I36-I40 VanDerWaalsContact O-CG1 3.24Å; I36-I40 WeakPolarHBondContact O-CG1 3.36Å; I36-I40 PolarHBondContact O-N 3.44Å
37	K	50.1	Low	51.3	Low	127 Å²	127	93.1 Å²	93.1	55%	0.552	50%	0.496	S	S	*	.	H	α-helix	trans	-60	-44.5	176.5	-166.7	177	-175.8	-179.4	0	111	H33 L34 Q41	H33-K37 VanDerWaalsContact O-CB 3.24Å; H33-K37 WeakPolarHBondContact O-CB 3.4Å; H33-K37 PolarHBondContact O-N 2.92Å; L34-K37 PolarHBondContact O-N 3.4Å; K37-Q41 WeakPolarHBondContact O-CB 3.23Å; K37-Q41 VanDerWaalsContact O-CG 3.27Å; K37-Q41 WeakPolarHBondContact O-CG 3.38Å; K37-Q41 PolarHBondContact O-N 3.35Å
38	R	54.7	Low	51.5	Low	180 Å²	180	90.3 Å²	90.3	68%	0.679	48%	0.48	S	S	*	.	H	α-helix	trans	-64.5	-42.4	175.3	-165.7	173.1	-174.8	169.9	1.5	111.8	L34 N35 I36 Q41 T42	L34-R38 WeakPolarHBondContact O-CB 3.24Å; L34-R38 PolarHBondContact O-N 2.91Å; N35-R38 PolarHBondContact O-N 3.44Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 2.78Å; R38-Q41 PolarHBondContact O-N 3.18Å; R38-T42 PolarHBondContact O-N 3.12Å; R38-T42 PolarHBondContact O-OG1 3.36Å
39	S	52.3	Low	51.6	Low	53 Å²	53	90.9 Å²	90.9	37%	0.371	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-48.2	179.7	-175.6	0	0	0	0	111.7	N35 I36 Q41 T42 I43	N35-S39 WeakPolarHBondContact O-CB 3.38Å; N35-S39 PolarHBondContact O-N 2.83Å; I36-S39 PolarHBondContact O-N 2.89Å; S39-Q41 VanDerWaalsContact C-N 3.3Å; S39-Q41 PolarHBondContact O-N 2.94Å; S39-T42 VanDerWaalsContact CA-OG1 3.23Å; S39-T42 WeakPolarHBondContact CA-OG1 3.27Å; S39-T42 PolarHBondContact O-N 2.96Å; S39-T42 PolarHBondContact O-OG1 3.35Å; S39-I43 WeakPolarHBondContact O-CB 3.37Å; S39-I43 VanDerWaalsContact O-CG1 3.24Å; S39-I43 WeakPolarHBondContact O-CG1 3.18Å; S39-I43 PolarHBondContact O-N 3.23Å
40	I	54.2	Low	51.7	Low	89 Å²	89	90.4 Å²	90.4	46%	0.456	48%	0.477	S	S	.	.	H	α-helix	trans	-59.4	-43.2	175.1	-67.8	170.4	0	0	0	110.1	I36 I43 S44	I36-I40 HydrophobicContact CG2-CD1 3.48Å; I36-I40 VanDerWaalsContact CG2-CD1 3.48Å; I36-I40 HydrophobicContact CG2-CG1 4.08Å; I36-I40 WeakPolarHBondContact O-CB 3.3Å; I36-I40 VanDerWaalsContact O-CG1 3.24Å; I36-I40 WeakPolarHBondContact O-CG1 3.36Å; I36-I40 PolarHBondContact O-N 3.44Å; I40-I43 PolarHBondContact O-N 2.83Å; I40-S44 WeakPolarHBondContact O-CB 3.23Å; I40-S44 PolarHBondContact O-N 3.36Å; I40-S44 PolarHBondContact O-OG 3.05Å
41	Q	54.4	Low	51.9	Low	111 Å²	111	88.8 Å²	88.8	52%	0.519	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-45.3	174.9	-78.1	178.2	-29.9	0	0	112.2	K37 R38 S39 I43 S44 V45	K37-Q41 WeakPolarHBondContact O-CB 3.23Å; K37-Q41 VanDerWaalsContact O-CG 3.27Å; K37-Q41 WeakPolarHBondContact O-CG 3.38Å; K37-Q41 PolarHBondContact O-N 3.35Å; R38-Q41 PolarHBondContact O-N 3.18Å; S39-Q41 VanDerWaalsContact C-N 3.3Å; S39-Q41 PolarHBondContact O-N 2.94Å; Q41-I43 VanDerWaalsContact C-N 3.32Å; Q41-I43 PolarHBondContact O-N 3.44Å; Q41-S44 PolarHBondContact O-N 3.41Å; Q41-S44 PolarHBondContact O-OG 2.85Å; Q41-V45 WeakPolarHBondContact O-CB 3.24Å; Q41-V45 WeakPolarHBondContact O-CG2 3.47Å; Q41-V45 PolarHBondContact O-N 3.35Å
42	T	54.5	Low	52.2	Low	77 Å²	77	89.1 Å²	89.1	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-39.4	176	32	0	0	0	0	112	R38 S39 V45 S46	R38-T42 PolarHBondContact O-N 3.12Å; R38-T42 PolarHBondContact O-OG1 3.36Å; S39-T42 VanDerWaalsContact CA-OG1 3.23Å; S39-T42 WeakPolarHBondContact CA-OG1 3.27Å; S39-T42 PolarHBondContact O-N 2.96Å; S39-T42 PolarHBondContact O-OG1 3.35Å; T42-V45 PolarHBondContact O-N 3.35Å; T42-S46 WeakPolarHBondContact O-CB 3.36Å; T42-S46 PolarHBondContact O-N 3.23Å; T42-S46 PolarHBondContact O-OG 3.49Å; T42-S46 VanDerWaalsContact O-OG 3.05Å
43	I	52.9	Low	52.4	Low	48 Å²	48	91.2 Å²	91.2	25%	0.246	47%	0.473	C	S	.	.	H	α-helix	trans	-69.8	-42.7	179.6	-67.3	166.2	0	0	0	110.5	L15 S39 I40 Q41 V45 S46 I47	L15-I43 HydrophobicContact CD1-CD1 4.34Å; L15-I43 HydrophobicContact CD1-CG2 4.34Å; L15-I43 HydrophobicContact CD2-CD1 3.7Å; L15-I43 HydrophobicContact CG-CD1 4.32Å; S39-I43 WeakPolarHBondContact O-CB 3.37Å; S39-I43 VanDerWaalsContact O-CG1 3.24Å; S39-I43 WeakPolarHBondContact O-CG1 3.18Å; S39-I43 PolarHBondContact O-N 3.23Å; I40-I43 PolarHBondContact O-N 2.83Å; Q41-I43 VanDerWaalsContact C-N 3.32Å; Q41-I43 PolarHBondContact O-N 3.44Å; I43-V45 VanDerWaalsContact C-N 3.3Å; I43-V45 PolarHBondContact O-N 2.81Å; I43-S46 PolarHBondContact O-N 3.42Å; I43-I47 HydrophobicContact CG2-CD1 3.67Å; I43-I47 HydrophobicContact CG2-CG1 4.26Å; I43-I47 WeakPolarHBondContact O-CB 3.32Å; I43-I47 VanDerWaalsContact O-CG1 3.23Å; I43-I47 WeakPolarHBondContact O-CG1 3.21Å; I43-I47 PolarHBondContact O-N 3.17Å
44	S	51.7	Low	52.7	Low	53 Å²	53	89.4 Å²	89.4	37%	0.371	47%	0.465	S	S	.	.	H	α-helix	trans	-63.8	-38.2	176.1	66.8	0	0	0	0	111.4	I40 Q41 I47 L48	I40-S44 WeakPolarHBondContact O-CB 3.23Å; I40-S44 PolarHBondContact O-N 3.36Å; I40-S44 PolarHBondContact O-OG 3.05Å; Q41-S44 PolarHBondContact O-N 3.41Å; Q41-S44 PolarHBondContact O-OG 2.85Å; S44-I47 PolarHBondContact O-N 3.26Å; S44-L48 WeakPolarHBondContact O-CB 3.44Å; S44-L48 WeakPolarHBondContact O-CG 3.41Å; S44-L48 PolarHBondContact O-N 2.84Å
45	V	50.4	Low	52.8	Low	77 Å²	77	88.7 Å²	88.7	47%	0.467	46%	0.461	S	S	.	.	H	α-helix	trans	-65	-44.9	172.5	171.4	0	0	0	0	110.9	Q41 T42 I43 I47 L48 I49	Q41-V45 WeakPolarHBondContact O-CB 3.24Å; Q41-V45 WeakPolarHBondContact O-CG2 3.47Å; Q41-V45 PolarHBondContact O-N 3.35Å; T42-V45 PolarHBondContact O-N 3.35Å; I43-V45 VanDerWaalsContact C-N 3.3Å; I43-V45 PolarHBondContact O-N 2.81Å; V45-I47 VanDerWaalsContact C-N 3.33Å; V45-I47 PolarHBondContact O-N 2.63Å; V45-L48 PolarHBondContact O-N 3.39Å; V45-I49 HydrophobicContact CG1-CD1 3.64Å; V45-I49 HydrophobicContact CG1-CG1 4.28Å; V45-I49 WeakPolarHBondContact O-CB 3.41Å; V45-I49 WeakPolarHBondContact O-CG1 3.42Å; V45-I49 PolarHBondContact O-N 2.8Å
46	S	52.6	Low	52.7	Low	71 Å²	71	90.2 Å²	90.2	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-62.3	-39.7	176.1	-66.6	0	0	0	0	112.3	T42 I43 I49 T50	T42-S46 WeakPolarHBondContact O-CB 3.36Å; T42-S46 PolarHBondContact O-N 3.23Å; T42-S46 PolarHBondContact O-OG 3.49Å; T42-S46 VanDerWaalsContact O-OG 3.05Å; I43-S46 PolarHBondContact O-N 3.42Å; S46-I49 PolarHBondContact O-N 2.8Å; S46-T50 PolarHBondContact O-N 3.43Å; S46-T50 PolarHBondContact O-OG1 2.85Å
47	I	53.4	Low	52.4	Low	53 Å²	53	93.2 Å²	93.2	27%	0.272	48%	0.476	S	S	.	.	H	α-helix	trans	-66.6	-43.5	175.3	-69.4	167.5	0	0	0	110.5	I43 S44 V45 T50 L51	I43-I47 HydrophobicContact CG2-CD1 3.67Å; I43-I47 HydrophobicContact CG2-CG1 4.26Å; I43-I47 WeakPolarHBondContact O-CB 3.32Å; I43-I47 VanDerWaalsContact O-CG1 3.23Å; I43-I47 WeakPolarHBondContact O-CG1 3.21Å; I43-I47 PolarHBondContact O-N 3.17Å; S44-I47 PolarHBondContact O-N 3.26Å; V45-I47 VanDerWaalsContact C-N 3.33Å; V45-I47 PolarHBondContact O-N 2.63Å; I47-T50 WeakPolarHBondContact CA-OG1 3.34Å; I47-T50 PolarHBondContact O-N 3.26Å; I47-T50 PolarHBondContact O-OG1 3.46Å; I47-L51 HydrophobicContact CG2-CD1 3.65Å; I47-L51 HydrophobicContact CG2-CG 4.33Å; I47-L51 VanDerWaalsContact O-CB 3.25Å; I47-L51 WeakPolarHBondContact O-CB 3.25Å; I47-L51 WeakPolarHBondContact O-CG 3.34Å; I47-L51 PolarHBondContact O-N 2.81Å
48	L	51.4	Low	52.4	Low	115 Å²	115	92 Å²	92	60%	0.602	48%	0.476	S	S	*	.	H	α-helix	trans	-63.1	-42	175.3	-80.7	166.2	0	0	0	111.6	S44 V45 L51 H52	S44-L48 WeakPolarHBondContact O-CB 3.44Å; S44-L48 WeakPolarHBondContact O-CG 3.41Å; S44-L48 PolarHBondContact O-N 2.84Å; V45-L48 PolarHBondContact O-N 3.39Å; L48-L51 PolarHBondContact O-N 2.78Å; L48-H52 WeakPolarHBondContact O-CB 3.33Å; L48-H52 PolarHBondContact O-N 3.43Å
49	I	53.3	Low	52.1	Low	92 Å²	92	89.9 Å²	89.9	47%	0.472	47%	0.471	S	S	.	.	H	α-helix	trans	-64	-48.4	175.4	-68.1	165.5	0	0	0	109.8	V45 S46 L51 H52 D53	V45-I49 HydrophobicContact CG1-CD1 3.64Å; V45-I49 HydrophobicContact CG1-CG1 4.28Å; V45-I49 WeakPolarHBondContact O-CB 3.41Å; V45-I49 WeakPolarHBondContact O-CG1 3.42Å; V45-I49 PolarHBondContact O-N 2.8Å; S46-I49 PolarHBondContact O-N 2.8Å; I49-L51 PolarHBondContact O-N 3.45Å; I49-H52 PolarHBondContact O-N 3.44Å; I49-D53 WeakPolarHBondContact O-CB 3.18Å; I49-D53 PolarHBondContact O-N 2.76Å
50	T	54.2	Low	51.7	Low	77 Å²	77	90 Å²	90	47%	0.472	47%	0.467	S	S	.	.	H	α-helix	trans	-65.4	-36.6	178.5	28.4	0	0	0	0	112.7	S46 I47 Q54	S46-T50 PolarHBondContact O-N 3.43Å; S46-T50 PolarHBondContact O-OG1 2.85Å; I47-T50 WeakPolarHBondContact CA-OG1 3.34Å; I47-T50 PolarHBondContact O-N 3.26Å; I47-T50 PolarHBondContact O-OG1 3.46Å; T50-Q54 WeakPolarHBondContact O-CB 3.16Å; T50-Q54 WeakPolarHBondContact O-CG 3.12Å; T50-Q54 PolarHBondContact O-N 2.8Å
51	L	53.5	Low	51.4	Low	85 Å²	85	89.5 Å²	89.5	45%	0.445	47%	0.471	S	S	.	.	H	α-helix	trans	-69.3	-38.6	173.5	-79.6	165.7	0	0	0	111.8	I47 L48 I49 Q54 N55	I47-L51 HydrophobicContact CG2-CD1 3.65Å; I47-L51 HydrophobicContact CG2-CG 4.33Å; I47-L51 VanDerWaalsContact O-CB 3.25Å; I47-L51 WeakPolarHBondContact O-CB 3.25Å; I47-L51 WeakPolarHBondContact O-CG 3.34Å; I47-L51 PolarHBondContact O-N 2.81Å; L48-L51 PolarHBondContact O-N 2.78Å; I49-L51 PolarHBondContact O-N 3.45Å; L51-Q54 PolarHBondContact O-N 3.31Å; L51-N55 VanDerWaalsContact O-CB 3.32Å; L51-N55 WeakPolarHBondContact O-CB 3.32Å; L51-N55 PolarHBondContact O-N 2.74Å
52	H	54.9	Low	51.1	Low	132 Å²	132	88.4 Å²	88.4	61%	0.611	47%	0.468	S	S	*	.	H	α-helix	trans	-66.7	-43.6	176.1	-173.6	-86.1	0	0	0	110.7	L48 I49 N55 Y56	L48-H52 WeakPolarHBondContact O-CB 3.33Å; L48-H52 PolarHBondContact O-N 3.43Å; I49-H52 PolarHBondContact O-N 3.44Å; H52-N55 PolarHBondContact O-N 3.28Å; H52-Y56 WeakPolarHBondContact O-CB 3.25Å; H52-Y56 PolarHBondContact O-N 3.25Å
53	D	53.3	Low	50.9	Low	80 Å²	80	89.5 Å²	89.5	43%	0.428	47%	0.468	S	S	.	.	H	α-helix	trans	-66.6	-39	174	-78.9	-18.1	0	0	0	111.6	I49 Y56 L57	I49-D53 WeakPolarHBondContact O-CB 3.18Å; I49-D53 PolarHBondContact O-N 2.76Å; D53-Y56 PolarHBondContact O-N 3.22Å; D53-L57 VanDerWaalsContact O-CB 3.26Å; D53-L57 WeakPolarHBondContact O-CB 3.47Å; D53-L57 VanDerWaalsContact O-CG 3.25Å; D53-L57 WeakPolarHBondContact O-CG 3.42Å; D53-L57 PolarHBondContact O-N 2.79Å
54	Q	53.8	Low	50.8	Low	95 Å²	95	92.5 Å²	92.5	44%	0.444	48%	0.483	S	S	.	.	H	α-helix	trans	-65.3	-40.6	173.1	-80.8	-180	-3.2	0	0	111.4	T50 L51 Y56 L57 L58	T50-Q54 WeakPolarHBondContact O-CB 3.16Å; T50-Q54 WeakPolarHBondContact O-CG 3.12Å; T50-Q54 PolarHBondContact O-N 2.8Å; L51-Q54 PolarHBondContact O-N 3.31Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Q54-L57 PolarHBondContact O-N 3.45Å; Q54-L58 WeakPolarHBondContact O-CA 3.11Å; Q54-L58 WeakPolarHBondContact O-CB 3.35Å; Q54-L58 PolarHBondContact O-N 2.72Å
55	N	52.3	Low	50.8	Low	105 Å²	105	94.9 Å²	94.9	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-65.8	-37.1	173.3	-85.4	-20.8	0	0	0	111.5	L51 H52 L58 K59	L51-N55 VanDerWaalsContact O-CB 3.32Å; L51-N55 WeakPolarHBondContact O-CB 3.32Å; L51-N55 PolarHBondContact O-N 2.74Å; H52-N55 PolarHBondContact O-N 3.28Å; N55-L58 PolarHBondContact O-N 2.76Å; N55-K59 WeakPolarHBondContact O-CB 3.49Å; N55-K59 PolarHBondContact O-N 3.5Å
56	Y	48.7	Very low	50.8	Low	135 Å²	135	97 Å²	97	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-67	-45.5	174.7	-177.6	-103.7	0	0	0	111.4	H52 D53 Q54 L58 K59 L60	H52-Y56 WeakPolarHBondContact O-CB 3.25Å; H52-Y56 PolarHBondContact O-N 3.25Å; D53-Y56 PolarHBondContact O-N 3.22Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; Y56-K59 CarbonylContact O-C 3.59Å; Y56-K59 PolarHBondContact O-N 2.77Å; Y56-L60 HydrophobicContact CD1-CD1 3.75Å; Y56-L60 HydrophobicContact CD1-CG 4.41Å; Y56-L60 HydrophobicContact CE1-CD1 3.27Å; Y56-L60 HydrophobicContact CE1-CG 4.03Å; Y56-L60 WeakPolarHBondContact O-CB 3.26Å; Y56-L60 WeakPolarHBondContact O-CG 3.3Å; Y56-L60 PolarHBondContact O-N 3.24Å
57	L	43.1	Very low	50.6	Low	102 Å²	102	97.2 Å²	97.2	53%	0.534	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-37.1	174	-75.5	170.6	0	0	0	112	D53 Q54 L60 C61	D53-L57 VanDerWaalsContact O-CB 3.26Å; D53-L57 WeakPolarHBondContact O-CB 3.47Å; D53-L57 VanDerWaalsContact O-CG 3.25Å; D53-L57 WeakPolarHBondContact O-CG 3.42Å; D53-L57 PolarHBondContact O-N 2.79Å; Q54-L57 PolarHBondContact O-N 3.45Å; L57-L60 PolarHBondContact O-N 2.79Å; L57-C61 VanDerWaalsContact O-CB 3.3Å; L57-C61 WeakPolarHBondContact O-CB 3.18Å; L57-C61 PolarHBondContact O-N 3.48Å; L57-C61 PolarHBondContact O-SG 3.39Å
58	L	50.5	Low	50.2	Low	103 Å²	103	97.6 Å²	97.6	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-43.3	173.6	-167.4	88.6	0	0	0	109.8	Q54 N55 Y56 C61 I62	Q54-L58 WeakPolarHBondContact O-CA 3.11Å; Q54-L58 WeakPolarHBondContact O-CB 3.35Å; Q54-L58 PolarHBondContact O-N 2.72Å; N55-L58 PolarHBondContact O-N 2.76Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; L58-C61 CarbonylContact O-C 3.59Å; L58-C61 PolarHBondContact O-N 2.76Å; L58-I62 HydrophobicContact CD2-CD1 4.15Å; L58-I62 HydrophobicContact CG-CD1 4.1Å; L58-I62 WeakPolarHBondContact O-CB 3.25Å; L58-I62 VanDerWaalsContact O-CG1 3.25Å; L58-I62 WeakPolarHBondContact O-CG1 3.2Å; L58-I62 PolarHBondContact O-N 2.74Å
59	K	49.6	Very low	50	Low	134 Å²	134	101 Å²	101	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-64.5	-41.2	176.4	-167.3	172.7	-175.7	178.2	0	111.3	N55 Y56 I62 Q63	N55-K59 WeakPolarHBondContact O-CB 3.49Å; N55-K59 PolarHBondContact O-N 3.5Å; Y56-K59 CarbonylContact O-C 3.59Å; Y56-K59 PolarHBondContact O-N 2.77Å; K59-I62 PolarHBondContact O-N 3.44Å; K59-Q63 WeakPolarHBondContact O-CB 3.2Å; K59-Q63 VanDerWaalsContact O-CG 3.28Å; K59-Q63 WeakPolarHBondContact O-CG 3.4Å; K59-Q63 PolarHBondContact O-N 3.46Å
60	L	43.9	Very low	49.5	Very low	55 Å²	55	100.6 Å²	100.6	29%	0.288	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-42.1	170.6	-81.2	173.7	0	0	0	111.5	Y56 L57 Q63 L64	Y56-L60 HydrophobicContact CD1-CD1 3.75Å; Y56-L60 HydrophobicContact CD1-CG 4.41Å; Y56-L60 HydrophobicContact CE1-CD1 3.27Å; Y56-L60 HydrophobicContact CE1-CG 4.03Å; Y56-L60 WeakPolarHBondContact O-CB 3.26Å; Y56-L60 WeakPolarHBondContact O-CG 3.3Å; Y56-L60 PolarHBondContact O-N 3.24Å; L57-L60 PolarHBondContact O-N 2.79Å; L60-Q63 PolarHBondContact O-N 2.79Å; L60-L64 WeakPolarHBondContact O-CB 3.43Å; L60-L64 WeakPolarHBondContact O-CG 3.12Å; L60-L64 PolarHBondContact O-N 3.19Å
61	C	47.3	Very low	48.9	Very low	79 Å²	79	106.1 Å²	106.1	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-40.4	175.8	-78.9	0	0	0	0	111.6	L57 L58 L64 N65	L57-C61 VanDerWaalsContact O-CB 3.3Å; L57-C61 WeakPolarHBondContact O-CB 3.18Å; L57-C61 PolarHBondContact O-N 3.48Å; L57-C61 PolarHBondContact O-SG 3.39Å; L58-C61 CarbonylContact O-C 3.59Å; L58-C61 PolarHBondContact O-N 2.76Å; C61-L64 PolarHBondContact O-N 3.38Å; C61-N65 WeakPolarHBondContact O-CB 3.4Å; C61-N65 PolarHBondContact O-N 3.27Å
62	I	49.1	Very low	48.6	Very low	88 Å²	88	106 Å²	106	45%	0.451	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-46.5	175.2	-68.4	164.1	0	0	0	109.4	L58 K59 L64 N65 E66	L58-I62 HydrophobicContact CD2-CD1 4.15Å; L58-I62 HydrophobicContact CG-CD1 4.1Å; L58-I62 WeakPolarHBondContact O-CB 3.25Å; L58-I62 VanDerWaalsContact O-CG1 3.25Å; L58-I62 WeakPolarHBondContact O-CG1 3.2Å; L58-I62 PolarHBondContact O-N 2.74Å; K59-I62 PolarHBondContact O-N 3.44Å; I62-L64 VanDerWaalsContact C-N 3.35Å; I62-L64 PolarHBondContact O-N 2.75Å; I62-N65 CarbonylContact O-C 3.6Å; I62-N65 PolarHBondContact O-N 2.79Å; I62-E66 HydrophobicContact CG2-CG 4.45Å; I62-E66 WeakPolarHBondContact O-CB 3.34Å; I62-E66 WeakPolarHBondContact O-CG 3.48Å; I62-E66 PolarHBondContact O-N 2.82Å
63	Q	49.8	Very low	48	Very low	101 Å²	101	105.4 Å²	105.4	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-39.1	176.3	-76.9	-176.9	-33.9	0	0	112.6	K59 L60 C67	K59-Q63 WeakPolarHBondContact O-CB 3.2Å; K59-Q63 VanDerWaalsContact O-CG 3.28Å; K59-Q63 WeakPolarHBondContact O-CG 3.4Å; K59-Q63 PolarHBondContact O-N 3.46Å; L60-Q63 PolarHBondContact O-N 2.79Å; Q63-C67 VanDerWaalsContact O-CB 3.26Å; Q63-C67 WeakPolarHBondContact O-CB 3.46Å; Q63-C67 PolarHBondContact O-N 2.88Å; Q63-C67 PolarHBondContact O-SG 3.23Å
64	L	49.7	Very low	47.5	Very low	110 Å²	110	105 Å²	105	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-69.6	-37.2	175	-77.4	170.6	0	0	0	111.1	L60 C61 I62 C67 S68	L60-L64 WeakPolarHBondContact O-CB 3.43Å; L60-L64 WeakPolarHBondContact O-CG 3.12Å; L60-L64 PolarHBondContact O-N 3.19Å; C61-L64 PolarHBondContact O-N 3.38Å; I62-L64 VanDerWaalsContact C-N 3.35Å; I62-L64 PolarHBondContact O-N 2.75Å; L64-C67 CarbonylContact O-C 3.59Å; L64-C67 PolarHBondContact O-N 3.43Å; L64-S68 VanDerWaalsContact O-CB 3.28Å; L64-S68 WeakPolarHBondContact O-CB 3.42Å; L64-S68 PolarHBondContact O-N 3.3Å; L64-S68 PolarHBondContact O-OG 3.43Å
65	N	52	Low	47	Very low	104 Å²	104	108 Å²	108	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-72.6	-37.1	177.3	-161.1	12.3	0	0	0	111.2	C61 I62 S68 R69	C61-N65 WeakPolarHBondContact O-CB 3.4Å; C61-N65 PolarHBondContact O-N 3.27Å; I62-N65 CarbonylContact O-C 3.6Å; I62-N65 PolarHBondContact O-N 2.79Å; N65-S68 PolarHBondContact O-N 3.2Å; N65-R69 WeakPolarHBondContact O-CB 3.28Å; N65-R69 PolarHBondContact O-N 2.77Å
66	E	51.3	Low	46.5	Very low	120 Å²	120	109.4 Å²	109.4	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-63.9	-45.9	168.6	-75.9	-174.4	164.6	0	0	110.7	I62 S68 R69 V70	I62-E66 HydrophobicContact CG2-CG 4.45Å; I62-E66 WeakPolarHBondContact O-CB 3.34Å; I62-E66 WeakPolarHBondContact O-CG 3.48Å; I62-E66 PolarHBondContact O-N 2.82Å; E66-S68 VanDerWaalsContact C-N 3.25Å; E66-S68 PolarHBondContact O-N 3.31Å; E66-R69 PolarHBondContact O-N 2.84Å; E66-V70 WeakPolarHBondContact O-CB 3.27Å; E66-V70 VanDerWaalsContact O-CG2 3.24Å; E66-V70 WeakPolarHBondContact O-CG2 3.28Å; E66-V70 PolarHBondContact O-N 2.66Å
67	C	47.5	Very low	46.2	Very low	77 Å²	77	107.7 Å²	107.7	52%	0.52	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-35.4	172.4	-85.6	0	0	0	0	112.4	Q63 L64 R71	Q63-C67 VanDerWaalsContact O-CB 3.26Å; Q63-C67 WeakPolarHBondContact O-CB 3.46Å; Q63-C67 PolarHBondContact O-N 2.88Å; Q63-C67 PolarHBondContact O-SG 3.23Å; L64-C67 CarbonylContact O-C 3.59Å; L64-C67 PolarHBondContact O-N 3.43Å; C67-R71 WeakPolarHBondContact O-CB 3.34Å; C67-R71 WeakPolarHBondContact O-CG 3.26Å; C67-R71 PolarHBondContact O-N 3.1Å
68	S	46	Very low	46.2	Very low	60 Å²	60	108.1 Å²	108.1	42%	0.42	54%	0.539	S	S	.	.	H	α-helix	trans	-71.6	-42.5	177.2	-59.4	0	0	0	0	110.9	L64 N65 E66 R71 V72	L64-S68 VanDerWaalsContact O-CB 3.28Å; L64-S68 WeakPolarHBondContact O-CB 3.42Å; L64-S68 PolarHBondContact O-N 3.3Å; L64-S68 PolarHBondContact O-OG 3.43Å; N65-S68 PolarHBondContact O-N 3.2Å; E66-S68 VanDerWaalsContact C-N 3.25Å; E66-S68 PolarHBondContact O-N 3.31Å; S68-R71 PolarHBondContact O-N 2.77Å; S68-V72 VanDerWaalsContact O-CG2 3.27Å; S68-V72 WeakPolarHBondContact O-CG2 3.37Å; S68-V72 PolarHBondContact O-N 2.81Å
69	R	46.7	Very low	46	Very low	187 Å²	187	108.4 Å²	108.4	71%	0.706	54%	0.544	S	S	*	.	H	α-helix	trans	-60.6	-47.9	172.2	-95.2	-176.1	160.4	-170	-5.5	111.4	N65 E66 R71 V72 E73	N65-R69 WeakPolarHBondContact O-CB 3.28Å; N65-R69 PolarHBondContact O-N 2.77Å; E66-R69 PolarHBondContact O-N 2.84Å; R69-R71 VanDerWaalsContact C-N 3.33Å; R69-R71 PolarHBondContact O-N 2.8Å; R69-V72 CarbonylContact O-C 3.56Å; R69-V72 PolarHBondContact O-N 2.88Å; R69-V72 VanDerWaalsContact O-N 3.1Å; R69-E73 WeakPolarHBondContact O-CB 3.24Å; R69-E73 PolarHBondContact O-N 3.43Å
70	V	43.7	Very low	45.6	Very low	83 Å²	83	111.7 Å²	111.7	50%	0.503	56%	0.555	S	S	.	*	H	α-helix	trans	-62	-40.8	175.8	174.4	0	0	0	0	110.5	E66 V72 E73 V74	E66-V70 WeakPolarHBondContact O-CB 3.27Å; E66-V70 VanDerWaalsContact O-CG2 3.24Å; E66-V70 WeakPolarHBondContact O-CG2 3.28Å; E66-V70 PolarHBondContact O-N 2.66Å; V70-V72 VanDerWaalsContact C-N 3.33Å; V70-V72 PolarHBondContact O-N 3.43Å; V70-E73 PolarHBondContact O-N 2.83Å; V70-V74 HydrophobicContact CG1-CG2 4.06Å; V70-V74 VanDerWaalsContact O-CB 3.3Å; V70-V74 WeakPolarHBondContact O-CB 3.37Å; V70-V74 WeakPolarHBondContact O-CG2 3.48Å; V70-V74 PolarHBondContact O-N 3.39Å
71	R	41.2	Very low	45.7	Very low	194 Å²	194	116.3 Å²	116.3	73%	0.732	58%	0.579	S	S	*	*	H	α-helix	trans	-62.2	-38.7	172.9	-88.8	-174.4	-179.6	-176.4	1.5	112.8	C67 S68 R69 K75	C67-R71 WeakPolarHBondContact O-CB 3.34Å; C67-R71 WeakPolarHBondContact O-CG 3.26Å; C67-R71 PolarHBondContact O-N 3.1Å; S68-R71 PolarHBondContact O-N 2.77Å; R69-R71 VanDerWaalsContact C-N 3.33Å; R69-R71 PolarHBondContact O-N 2.8Å; R71-K75 VanDerWaalsContact O-CB 3.27Å; R71-K75 WeakPolarHBondContact O-CB 3.25Å; R71-K75 PolarHBondContact O-N 2.78Å
72	V	46.3	Very low	45.4	Very low	81 Å²	81	126.2 Å²	126.2	49%	0.491	61%	0.605	S	S	.	*	H	α-helix	trans	-68.8	-39.3	176.5	171.4	0	0	0	0	110.5	S68 R69 V70 K75 K76	S68-V72 VanDerWaalsContact O-CG2 3.27Å; S68-V72 WeakPolarHBondContact O-CG2 3.37Å; S68-V72 PolarHBondContact O-N 2.81Å; R69-V72 CarbonylContact O-C 3.56Å; R69-V72 PolarHBondContact O-N 2.88Å; R69-V72 VanDerWaalsContact O-N 3.1Å; V70-V72 VanDerWaalsContact C-N 3.33Å; V70-V72 PolarHBondContact O-N 3.43Å; V72-K75 PolarHBondContact O-N 3.21Å; V72-K76 WeakPolarHBondContact O-CB 3.19Å; V72-K76 WeakPolarHBondContact O-CG 3.3Å; V72-K76 PolarHBondContact O-N 3.27Å
73	E	42.1	Very low	45.2	Very low	120 Å²	120	128.2 Å²	128.2	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-72.6	-40	179.6	-161.3	152.7	-167.2	0	0	111.8	R69 V70 K76 N77	R69-E73 WeakPolarHBondContact O-CB 3.24Å; R69-E73 PolarHBondContact O-N 3.43Å; V70-E73 PolarHBondContact O-N 2.83Å; E73-K76 PolarHBondContact O-N 2.86Å; E73-N77 WeakPolarHBondContact O-CB 3.27Å; E73-N77 PolarHBondContact O-N 2.76Å
74	V	43.6	Very low	44.9	Very low	73 Å²	73	129.6 Å²	129.6	44%	0.442	62%	0.62	S	S	.	*	H	α-helix	trans	-65.7	-39.5	170.4	173.6	0	0	0	0	110.9	V70 N77 L78	V70-V74 HydrophobicContact CG1-CG2 4.06Å; V70-V74 VanDerWaalsContact O-CB 3.3Å; V70-V74 WeakPolarHBondContact O-CB 3.37Å; V70-V74 WeakPolarHBondContact O-CG2 3.48Å; V70-V74 PolarHBondContact O-N 3.39Å; V74-N77 PolarHBondContact O-N 3.28Å; V74-L78 HydrophobicContact CG1-CD1 3.88Å; V74-L78 HydrophobicContact CG1-CG 4.39Å; V74-L78 WeakPolarHBondContact O-CB 3.35Å; V74-L78 WeakPolarHBondContact O-CG 3.34Å; V74-L78 PolarHBondContact O-N 3.42Å
75	K	42.1	Very low	44.7	Very low	156 Å²	156	130.7 Å²	130.7	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-63.2	-41.5	172.3	-92.5	-173.2	170.6	-175.5	0	111.9	R71 V72 L78 V79	R71-K75 VanDerWaalsContact O-CB 3.27Å; R71-K75 WeakPolarHBondContact O-CB 3.25Å; R71-K75 PolarHBondContact O-N 2.78Å; V72-K75 PolarHBondContact O-N 3.21Å; K75-L78 PolarHBondContact O-N 3.49Å; K75-V79 VanDerWaalsContact O-CG2 3.25Å; K75-V79 WeakPolarHBondContact O-CG2 3.4Å; K75-V79 PolarHBondContact O-N 3.11Å
76	K	41.9	Very low	44.2	Very low	135 Å²	135	132.2 Å²	132.2	59%	0.587	63%	0.626	S	S	*	*	H	α-helix	trans	-64.6	-43.5	175.4	-77.9	-178.6	177.6	-175.1	0	111.3	V72 E73 L78 V79 Y80	V72-K76 WeakPolarHBondContact O-CB 3.19Å; V72-K76 WeakPolarHBondContact O-CG 3.3Å; V72-K76 PolarHBondContact O-N 3.27Å; E73-K76 PolarHBondContact O-N 2.86Å; K76-L78 PolarHBondContact O-N 3.05Å; K76-V79 PolarHBondContact O-N 3.48Å; K76-Y80 PolarHBondContact O-N 3.41Å; K76-Y80 VanDerWaalsContact O-N 3.11Å
77	N	43.1	Very low	43.8	Very low	99 Å²	99	133 Å²	133	53%	0.529	63%	0.631	S	S	.	*	H	α-helix	trans	-68.1	-33.9	178.4	-73.6	-15.5	0	0	0	112.7	E73 V74 V79 Y80 L81	E73-N77 WeakPolarHBondContact O-CB 3.27Å; E73-N77 PolarHBondContact O-N 2.76Å; V74-N77 PolarHBondContact O-N 3.28Å; N77-V79 VanDerWaalsContact C-N 3.35Å; N77-Y80 PolarHBondContact O-N 3.36Å; N77-L81 PolarHBondContact O-N 3.34Å
78	L	42.6	Very low	43.5	Very low	112 Å²	112	136.7 Å²	136.7	59%	0.586	64%	0.638	S	S	*	*	H	α-helix	trans	-70.3	-30.4	172.7	-78.6	167.5	0	0	0	112.8	V74 K75 K76 Y80 L81	V74-L78 HydrophobicContact CG1-CD1 3.88Å; V74-L78 HydrophobicContact CG1-CG 4.39Å; V74-L78 WeakPolarHBondContact O-CB 3.35Å; V74-L78 WeakPolarHBondContact O-CG 3.34Å; V74-L78 PolarHBondContact O-N 3.42Å; K75-L78 PolarHBondContact O-N 3.49Å; K76-L78 PolarHBondContact O-N 3.05Å; L78-Y80 VanDerWaalsContact C-N 3.33Å; L78-L81 PolarHBondContact O-N 2.85Å
79	V	46.2	Very low	43.4	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.655	65%	0.654	S	S	*	*	H	α-helix	trans	-72.1	-28.9	173.6	171.8	0	0	0	0	111.4	K75 K76 N77 L81	K75-V79 VanDerWaalsContact O-CG2 3.25Å; K75-V79 WeakPolarHBondContact O-CG2 3.4Å; K75-V79 PolarHBondContact O-N 3.11Å; K76-V79 PolarHBondContact O-N 3.48Å; N77-V79 VanDerWaalsContact C-N 3.35Å; V79-L81 VanDerWaalsContact C-N 3.31Å
80	Y	42	Very low	43.1	Very low	204 Å²	204	138.8 Å²	138.8	80%	0.8	65%	0.65	S	S	*	*	H	α-helix	trans	-77.4	-12.5	174	-93.8	-81	0	0	0	114.5	K76 N77 L78	K76-Y80 PolarHBondContact O-N 3.41Å; K76-Y80 VanDerWaalsContact O-N 3.11Å; N77-Y80 PolarHBondContact O-N 3.36Å; L78-Y80 VanDerWaalsContact C-N 3.33Å
81	L	44.9	Very low	43.1	Very low	152 Å²	152	143.4 Å²	143.4	80%	0.796	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	13.6	176.9	-76.6	168	0	0	0	113.4	N77 L78 V79	N77-L81 PolarHBondContact O-N 3.34Å; L78-L81 PolarHBondContact O-N 2.85Å; V79-L81 VanDerWaalsContact C-N 3.31Å
82	R	40.7	Very low	43.2	Very low	287 Å²	287	138.8 Å²	138.8	100%	1.083	66%	0.655	S	S	*	*			trans	-116.3	0	176.1	-134.5	-175.2	-164.4	179.8	3.4	110.7

Retrieved 82 of 82 residues in 51.2 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).