A0A5K4FAJ7_SCHMA Loading...

Protein lifeguard 2

AlphaFold DB , UniProt , Accession A0A5K4FAJ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 144 aa.

						>A0A5K4FAJ7_SCHMA|A0A5K4FAJ7
MSPAQRYEKMISAPLAGMFCVLAIFLGLNLQLSKRKWKIILFTMSCVFAVAGFILYVLGLTLHMHVLQGSAWICCCCIMFIVSLFTAYYLNVHDKQGDCSISYLFFVWIYECIAFVIILQFILNSFIDCHSNGSNPNMTMIEQD
					

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	54	Low	58.5	Low	137 Å²	137	96.5 Å²	96.5	68%	0.675	49%	0.486	S	S	*	.				0	114.1	0	-169.9	173.6	178	0	0	108.1	Q5 R6 K9	M1-Q5 HydrophobicContact CG-CB 4.49Å; M1-R6 HydrophobicContact CE-CB 3.99Å; M1-R6 HydrophobicContact CE-CG 4.17Å; M1-K9 HydrophobicContact CE-CD 4.43Å
2	S	62.7	Low	58.8	Low	52 Å²	52	89.9 Å²	89.9	36%	0.364	46%	0.456	S	S	.	.			trans	-73.7	154	-177.6	79.4	0	0	0	0	110.8	A4 Q5 R6	S2-A4 PolarHBondContact O-N 2.91Å; S2-Q5 PolarHBondContact O-N 3.17Å; S2-Q5 WeakPolarHBondContact OG-CG 3.25Å; S2-Q5 PolarHBondContact OG-N 2.8Å; S2-R6 PolarHBondContact O-N 3.24Å
3	P	65.3	Low	58.9	Low	100 Å²	100	88.2 Å²	88.2	65%	0.649	46%	0.463	S	S	*	.	H	α-helix	trans	-55.9	-40.6	177.1	17.5	-28.6	0	0	0	111.9	Q5 R6 Y7	P3-Q5 PolarHBondContact O-N 3.26Å; P3-R6 PolarHBondContact O-N 2.9Å; P3-R6 VanDerWaalsContact O-N 3.14Å; P3-Y7 HydrophobicContact CB-CE2 4.47Å; P3-Y7 WeakPolarHBondContact O-CD2 3.49Å; P3-Y7 PolarHBondContact O-N 2.73Å
4	A	58.9	Low	59.2	Low	68 Å²	68	87.2 Å²	87.2	56%	0.562	47%	0.465	S	S	*	.	H	α-helix	trans	-57.2	-43.9	177.7	0	0	0	0	0	113.1	S2 R6 Y7 E8	S2-A4 PolarHBondContact O-N 2.91Å; A4-R6 VanDerWaalsContact C-N 3.3Å; A4-R6 PolarHBondContact O-N 2.58Å; A4-Y7 PolarHBondContact O-N 3.39Å; A4-E8 PolarHBondContact O-N 3.15Å; A4-E8 VanDerWaalsContact O-N 3.09Å
5	Q	51.9	Low	59.6	Low	31 Å²	31	86.5 Å²	86.5	15%	0.145	46%	0.461	C	S	.	.	H	α-helix	trans	-66.2	-31.9	178.6	-71.5	176.9	-39	0	0	113	M1 S2 P3 Y7 K9	M1-Q5 HydrophobicContact CG-CB 4.49Å; S2-Q5 PolarHBondContact O-N 3.17Å; S2-Q5 WeakPolarHBondContact OG-CG 3.25Å; S2-Q5 PolarHBondContact OG-N 2.8Å; P3-Q5 PolarHBondContact O-N 3.26Å; Q5-Y7 VanDerWaalsContact C-N 3.34Å; Q5-K9 PolarHBondContact O-N 2.91Å
6	R	61.5	Low	59.7	Low	157 Å²	157	83.9 Å²	83.9	59%	0.592	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-39.1	175.5	-164.5	-176.5	-79.4	-179.9	-4.4	110.6	M1 S2 P3 A4 M10	M1-R6 HydrophobicContact CE-CB 3.99Å; M1-R6 HydrophobicContact CE-CG 4.17Å; S2-R6 PolarHBondContact O-N 3.24Å; P3-R6 PolarHBondContact O-N 2.9Å; P3-R6 VanDerWaalsContact O-N 3.14Å; A4-R6 VanDerWaalsContact C-N 3.3Å; A4-R6 PolarHBondContact O-N 2.58Å; R6-M10 WeakPolarHBondContact O-CB 3.28Å; R6-M10 PolarHBondContact O-N 3.37Å
7	Y	59.4	Low	60.1	Low	154 Å²	154	81.1 Å²	81.1	60%	0.604	45%	0.45	S	S	*	.	H	α-helix	trans	-66.1	-42.8	175.9	-73.2	-71.8	0	0	0	112.6	P3 A4 Q5 K9 M10 I11	P3-Y7 HydrophobicContact CB-CE2 4.47Å; P3-Y7 WeakPolarHBondContact O-CD2 3.49Å; P3-Y7 PolarHBondContact O-N 2.73Å; A4-Y7 PolarHBondContact O-N 3.39Å; Q5-Y7 VanDerWaalsContact C-N 3.34Å; Y7-K9 PolarHBondContact O-N 2.84Å; Y7-M10 PolarHBondContact O-N 2.91Å; Y7-I11 WeakPolarHBondContact O-CB 3.3Å; Y7-I11 VanDerWaalsContact O-CG1 3.23Å; Y7-I11 WeakPolarHBondContact O-CG1 3.46Å; Y7-I11 PolarHBondContact O-N 3.41Å
8	E	51.4	Low	60.5	Low	79 Å²	79	83.4 Å²	83.4	37%	0.369	46%	0.458	S	S	.	.	H	α-helix	trans	-60.2	-45	178.3	-87.1	-167.7	124	0	0	112.8	A4 I11 S12 Q68	A4-E8 PolarHBondContact O-N 3.15Å; A4-E8 VanDerWaalsContact O-N 3.09Å; E8-I11 PolarHBondContact O-N 3.22Å; E8-S12 WeakPolarHBondContact O-CB 3.03Å; E8-S12 PolarHBondContact O-N 2.98Å; E8-S12 PolarHBondContact O-OG 3.16Å; E8-Q68 PolarHBondContact OE1-NE2 2.8Å
9	K	54.6	Low	60.8	Low	54 Å²	54	83.2 Å²	83.2	24%	0.235	45%	0.453	C	S	.	.	H	α-helix	trans	-67	-41.2	175.9	-69.4	-168.5	-166.7	-167.4	0	112.2	M1 Q5 Y7 I11 S12 A13 S125 C129	M1-K9 HydrophobicContact CE-CD 4.43Å; Q5-K9 PolarHBondContact O-N 2.91Å; Y7-K9 PolarHBondContact O-N 2.84Å; K9-I11 VanDerWaalsContact C-N 3.28Å; K9-I11 PolarHBondContact O-N 3.19Å; K9-S12 PolarHBondContact O-OG 2.99Å; K9-A13 PolarHBondContact O-N 3.16Å; K9-S125 WeakPolarHBondContact CE-O 3.37Å; K9-S125 PolarHBondContact NZ-O 3.38Å; K9-C129 VanDerWaalsContact CE-SG 3.53Å; K9-C129 PolarHBondContact NZ-SG 3.49Å
10	M	61.1	Low	61	Low	131 Å²	131	81 Å²	81	65%	0.645	44%	0.443	S	S	*	.	H	α-helix	trans	-65.8	-31.5	178.9	-102.6	-179.4	169	0	0	112.9	R6 Y7 P14	R6-M10 WeakPolarHBondContact O-CB 3.28Å; R6-M10 PolarHBondContact O-N 3.37Å; Y7-M10 PolarHBondContact O-N 2.91Å; M10-P14 WeakPolarHBondContact O-CD 3.4Å; M10-P14 WeakPolarHBondContact O-CG 3.13Å
11	I	62.7	Low	61.2	Low	99 Å²	99	81.3 Å²	81.3	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-87.3	-44.6	-178.5	-64.8	167.5	0	0	0	110.1	Y7 E8 K9 A13 P14 L15	Y7-I11 WeakPolarHBondContact O-CB 3.3Å; Y7-I11 VanDerWaalsContact O-CG1 3.23Å; Y7-I11 WeakPolarHBondContact O-CG1 3.46Å; Y7-I11 PolarHBondContact O-N 3.41Å; E8-I11 PolarHBondContact O-N 3.22Å; K9-I11 VanDerWaalsContact C-N 3.28Å; K9-I11 PolarHBondContact O-N 3.19Å; I11-A13 PolarHBondContact O-N 3.41Å; I11-P14 WeakPolarHBondContact O-CD 3.5Å; I11-L15 WeakPolarHBondContact O-CB 3.2Å; I11-L15 PolarHBondContact O-N 2.66Å; I11-L15 VanDerWaalsContact O-N 3.12Å
12	S	62.6	Low	61.7	Low	17 Å²	17	79.1 Å²	79.1	12%	0.119	44%	0.438	C	S	.	.	H	α-helix	trans	-63.7	-42.2	-173.9	56.6	0	0	0	0	113.9	E8 K9 L15 A16	E8-S12 WeakPolarHBondContact O-CB 3.03Å; E8-S12 PolarHBondContact O-N 2.98Å; E8-S12 PolarHBondContact O-OG 3.16Å; K9-S12 PolarHBondContact O-OG 2.99Å; S12-L15 PolarHBondContact O-N 2.93Å; S12-A16 WeakPolarHBondContact O-CB 3.32Å; S12-A16 PolarHBondContact O-N 3.18Å
13	A	59.2	Low	61.6	Low	67 Å²	67	78.2 Å²	78.2	55%	0.554	43%	0.433	S	S	*	.	H	α-helix	trans	-63.6	-52.7	-177.8	0	0	0	0	0	113.3	K9 I11 L15 A16 G17	K9-A13 PolarHBondContact O-N 3.16Å; I11-A13 PolarHBondContact O-N 3.41Å; A13-L15 VanDerWaalsContact C-N 3.34Å; A13-L15 PolarHBondContact O-N 2.88Å; A13-A16 PolarHBondContact O-N 3.49Å; A13-G17 PolarHBondContact O-N 2.92Å
14	P	63.9	Low	61.4	Low	75 Å²	75	77.4 Å²	77.4	49%	0.487	42%	0.423	S	S	.	.	H	α-helix	trans	-67.2	-33.1	175.8	19.1	-25.9	0	0	0	112.7	M10 I11 G17 M18	M10-P14 WeakPolarHBondContact O-CD 3.4Å; M10-P14 WeakPolarHBondContact O-CG 3.13Å; I11-P14 WeakPolarHBondContact O-CD 3.5Å; P14-G17 PolarHBondContact O-N 3.41Å; P14-M18 WeakPolarHBondContact O-CB 3.13Å; P14-M18 VanDerWaalsContact O-CG 3.25Å; P14-M18 WeakPolarHBondContact O-CG 3.45Å; P14-M18 PolarHBondContact O-N 2.87Å
15	L	65	Low	61.4	Low	77 Å²	77	80.4 Å²	80.4	40%	0.403	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-46.5	176	-136.1	80.2	0	0	0	111.1	I11 S12 A13 G17 M18 F19	I11-L15 WeakPolarHBondContact O-CB 3.2Å; I11-L15 PolarHBondContact O-N 2.66Å; I11-L15 VanDerWaalsContact O-N 3.12Å; S12-L15 PolarHBondContact O-N 2.93Å; A13-L15 VanDerWaalsContact C-N 3.34Å; A13-L15 PolarHBondContact O-N 2.88Å; L15-G17 VanDerWaalsContact C-N 3.34Å; L15-G17 PolarHBondContact O-N 3.48Å; L15-M18 PolarHBondContact O-N 2.82Å; L15-F19 HydrophobicContact CD2-CE2 3.8Å; L15-F19 HydrophobicContact CG-CD2 4.3Å; L15-F19 HydrophobicContact CG-CE2 3.83Å; L15-F19 WeakPolarHBondContact O-CD2 3.37Å; L15-F19 PolarHBondContact O-N 2.88Å
16	A	61.3	Low	61.5	Low	45 Å²	45	81.3 Å²	81.3	37%	0.372	43%	0.429	S	S	.	.	H	α-helix	trans	-61.9	-41.2	176.9	0	0	0	0	0	112	S12 A13 F19 C20	S12-A16 WeakPolarHBondContact O-CB 3.32Å; S12-A16 PolarHBondContact O-N 3.18Å; A13-A16 PolarHBondContact O-N 3.49Å; A16-F19 PolarHBondContact O-N 2.89Å; A16-C20 PolarHBondContact O-N 2.8Å; A16-C20 PolarHBondContact O-SG 2.87Å; A16-C20 VanDerWaalsContact O-SG 3.36Å
17	G	65.5	Low	61.2	Low	35 Å²	35	74.8 Å²	74.8	36%	0.361	41%	0.411	S	S	.	.	H	α-helix	trans	-60.9	-47.2	174.1	0	0	0	0	0	112.5	A13 P14 L15 F19 C20 V21	A13-G17 PolarHBondContact O-N 2.92Å; P14-G17 PolarHBondContact O-N 3.41Å; L15-G17 VanDerWaalsContact C-N 3.34Å; L15-G17 PolarHBondContact O-N 3.48Å; G17-F19 VanDerWaalsContact C-N 3.33Å; G17-F19 PolarHBondContact O-N 3.5Å; G17-C20 PolarHBondContact O-N 2.76Å; G17-V21 WeakPolarHBondContact O-CG2 3.21Å; G17-V21 PolarHBondContact O-N 2.84Å
18	M	68.2	Low	60.8	Low	123 Å²	123	72.6 Å²	72.6	61%	0.606	41%	0.409	S	S	*	.	H	α-helix	trans	-61.4	-40.5	177	-72.1	-66.5	-70.6	0	0	111.9	P14 L15 V21 L22	P14-M18 WeakPolarHBondContact O-CB 3.13Å; P14-M18 VanDerWaalsContact O-CG 3.25Å; P14-M18 WeakPolarHBondContact O-CG 3.45Å; P14-M18 PolarHBondContact O-N 2.87Å; L15-M18 PolarHBondContact O-N 2.82Å; M18-V21 PolarHBondContact O-N 3.37Å; M18-L22 WeakPolarHBondContact O-CB 3.46Å; M18-L22 WeakPolarHBondContact O-CG 3.5Å; M18-L22 PolarHBondContact O-N 3.47Å
19	F	66.9	Low	60.7	Low	80 Å²	80	72.3 Å²	72.3	35%	0.351	41%	0.41	S	S	.	.	H	α-helix	trans	-65.8	-39.4	174.9	-78.2	-59.8	0	0	0	112.6	L15 A16 G17 L22 A23 F48	L15-F19 HydrophobicContact CD2-CE2 3.8Å; L15-F19 HydrophobicContact CG-CD2 4.3Å; L15-F19 HydrophobicContact CG-CE2 3.83Å; L15-F19 WeakPolarHBondContact O-CD2 3.37Å; L15-F19 PolarHBondContact O-N 2.88Å; A16-F19 PolarHBondContact O-N 2.89Å; G17-F19 VanDerWaalsContact C-N 3.33Å; G17-F19 PolarHBondContact O-N 3.5Å; F19-L22 PolarHBondContact O-N 2.99Å; F19-A23 VanDerWaalsContact O-CB 3.32Å; F19-A23 WeakPolarHBondContact O-CB 3.28Å; F19-A23 PolarHBondContact O-N 3.37Å; F19-F48 AromaticContact CD1-CE1 3.59Å; F19-F48 HydrophobicContact CD1-CE1 3.59Å; F19-F48 AromaticContact CD1-CZ 3.57Å; F19-F48 HydrophobicContact CD1-CZ 3.57Å; F19-F48 AromaticContact CE1-CE1 3.71Å; F19-F48 HydrophobicContact CE1-CE1 3.71Å; F19-F48 AromaticContact CE1-CZ 3.91Å; F19-F48 HydrophobicContact CE1-CZ 3.91Å; F19-F48 HydrophobicContact CG-CE1 4.17Å; F19-F48 HydrophobicContact CG-CZ 4.38Å; F19-F48 HydrophobicContact CZ-CE1 4.39Å
20	C	64	Low	60.5	Low	38 Å²	38	70.6 Å²	70.6	26%	0.257	40%	0.403	S	S	.	.	H	α-helix	trans	-63.1	-47.2	174.3	-74.2	0	0	0	0	111.5	A16 G17 L22 A23 I24	A16-C20 PolarHBondContact O-N 2.8Å; A16-C20 PolarHBondContact O-SG 2.87Å; A16-C20 VanDerWaalsContact O-SG 3.36Å; G17-C20 PolarHBondContact O-N 2.76Å; C20-L22 PolarHBondContact O-N 3.23Å; C20-A23 PolarHBondContact O-N 3.42Å; C20-I24 VanDerWaalsContact O-CG1 3.32Å; C20-I24 WeakPolarHBondContact O-CG1 3.19Å; C20-I24 PolarHBondContact O-N 3.24Å
21	V	65.1	Low	60.1	Low	89 Å²	89	70.7 Å²	70.7	54%	0.539	40%	0.402	S	S	.	.	H	α-helix	trans	-62.3	-44.6	178.3	174.3	0	0	0	0	110.7	G17 M18 A23 I24 F25	G17-V21 WeakPolarHBondContact O-CG2 3.21Å; G17-V21 PolarHBondContact O-N 2.84Å; M18-V21 PolarHBondContact O-N 3.37Å; V21-A23 VanDerWaalsContact C-N 3.33Å; V21-A23 PolarHBondContact O-N 3.23Å; V21-I24 PolarHBondContact O-N 3.36Å; V21-F25 VanDerWaalsContact O-CB 3.29Å; V21-F25 WeakPolarHBondContact O-CB 3.38Å; V21-F25 PolarHBondContact O-N 2.93Å
22	L	64	Low	59.7	Low	91 Å²	91	72.8 Å²	72.8	48%	0.476	41%	0.414	S	S	.	.	H	α-helix	trans	-59.6	-43.1	174.8	-82.2	163.2	0	0	0	111.6	M18 F19 C20 F25 L26	M18-L22 WeakPolarHBondContact O-CB 3.46Å; M18-L22 WeakPolarHBondContact O-CG 3.5Å; M18-L22 PolarHBondContact O-N 3.47Å; F19-L22 PolarHBondContact O-N 2.99Å; C20-L22 PolarHBondContact O-N 3.23Å; L22-F25 PolarHBondContact O-N 3.38Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 WeakPolarHBondContact O-CD1 3.29Å; L22-L26 VanDerWaalsContact O-CG 3.28Å; L22-L26 WeakPolarHBondContact O-CG 3.43Å; L22-L26 PolarHBondContact O-N 3.3Å
23	A	61.7	Low	59.4	Low	32 Å²	32	74.2 Å²	74.2	26%	0.264	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-42.6	177.8	0	0	0	0	0	112.1	F19 C20 V21 G27 M79	F19-A23 VanDerWaalsContact O-CB 3.32Å; F19-A23 WeakPolarHBondContact O-CB 3.28Å; F19-A23 PolarHBondContact O-N 3.37Å; C20-A23 PolarHBondContact O-N 3.42Å; V21-A23 VanDerWaalsContact C-N 3.33Å; V21-A23 PolarHBondContact O-N 3.23Å; A23-G27 PolarHBondContact O-N 3.3Å; A23-M79 HydrophobicContact CB-CE 3.76Å
24	I	61.1	Low	59.7	Low	84 Å²	84	78.2 Å²	78.2	43%	0.431	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-46	175.6	-67.7	164.8	0	0	0	110.6	C20 V21 L26 G27 L28	C20-I24 VanDerWaalsContact O-CG1 3.32Å; C20-I24 WeakPolarHBondContact O-CG1 3.19Å; C20-I24 PolarHBondContact O-N 3.24Å; V21-I24 PolarHBondContact O-N 3.36Å; I24-L26 VanDerWaalsContact C-N 3.34Å; I24-L26 PolarHBondContact O-N 3.46Å; I24-G27 CarbonylContact O-C 3.53Å; I24-G27 WeakPolarHBondContact O-CA 3.34Å; I24-G27 PolarHBondContact O-N 3.47Å; I24-G27 VanDerWaalsContact O-N 3.08Å; I24-L28 HydrophobicContact CG2-CD1 3.82Å; I24-L28 PolarHBondContact O-N 2.98Å
25	F	57.6	Low	59.6	Low	131 Å²	131	85.3 Å²	85.3	58%	0.575	45%	0.445	S	S	*	.	H	α-helix	trans	-67.2	-36.4	-178.7	-148.4	-92.5	0	0	0	112	V21 L22 N29	V21-F25 VanDerWaalsContact O-CB 3.29Å; V21-F25 WeakPolarHBondContact O-CB 3.38Å; V21-F25 PolarHBondContact O-N 2.93Å; L22-F25 PolarHBondContact O-N 3.38Å; F25-N29 WeakPolarHBondContact CD1-ND2 3.49Å; F25-N29 WeakPolarHBondContact CE1-ND2 3.25Å; F25-N29 WeakPolarHBondContact O-CB 3.27Å; F25-N29 PolarHBondContact O-N 2.91Å; F25-N29 PolarHBondContact O-ND2 2.89Å
26	L	55.6	Low	59.4	Low	49 Å²	49	89 Å²	89	26%	0.257	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-44.4	168.7	-79.8	157.1	0	0	0	110	L22 I24 L28 N29 L30 W37 M44	L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 WeakPolarHBondContact O-CD1 3.29Å; L22-L26 VanDerWaalsContact O-CG 3.28Å; L22-L26 WeakPolarHBondContact O-CG 3.43Å; L22-L26 PolarHBondContact O-N 3.3Å; I24-L26 VanDerWaalsContact C-N 3.34Å; I24-L26 PolarHBondContact O-N 3.46Å; L26-L28 PolarHBondContact O-N 2.9Å; L26-N29 PolarHBondContact O-N 2.99Å; L26-L30 WeakPolarHBondContact O-CA 3.32Å; L26-L30 WeakPolarHBondContact O-CB 3.14Å; L26-L30 WeakPolarHBondContact O-CD1 3.41Å; L26-L30 WeakPolarHBondContact O-CG 3.28Å; L26-L30 PolarHBondContact O-N 3.44Å; L26-W37 HydrophobicContact CD2-CH2 4.12Å; L26-W37 HydrophobicContact CD2-CZ3 3.74Å; L26-M44 HydrophobicContact CD1-CE 3.95Å
27	G	54.1	Low	59.3	Low	21 Å²	21	88.5 Å²	88.5	22%	0.216	45%	0.447	C	S	.	.	H	α-helix	trans	-57.3	-39.8	175.2	0	0	0	0	0	114.7	A23 I24 L30	A23-G27 PolarHBondContact O-N 3.3Å; I24-G27 CarbonylContact O-C 3.53Å; I24-G27 WeakPolarHBondContact O-CA 3.34Å; I24-G27 PolarHBondContact O-N 3.47Å; I24-G27 VanDerWaalsContact O-N 3.08Å; G27-L30 VanDerWaalsContact O-CB 3.32Å; G27-L30 WeakPolarHBondContact O-CB 3.47Å
28	L	51	Low	59.1	Low	108 Å²	108	93.1 Å²	93.1	57%	0.565	46%	0.457	S	S	*	.	H	α-helix	trans	-73.9	-46.1	176.5	-87.1	148.2	0	0	0	111.8	I24 L26 L30 Q31	I24-L28 HydrophobicContact CG2-CD1 3.82Å; I24-L28 PolarHBondContact O-N 2.98Å; L26-L28 PolarHBondContact O-N 2.9Å; L28-L30 PolarHBondContact O-N 3.27Å; L28-Q31 PolarHBondContact O-N 3.16Å
29	N	49.8	Very low	58.9	Low	73 Å²	73	93 Å²	93	39%	0.39	46%	0.457	S	S	.	.	H	α-helix	trans	-69	-22.5	176.3	-76.4	-54.6	0	0	0	112.8	F25 L26 Q31 L32 W37	F25-N29 WeakPolarHBondContact CD1-ND2 3.49Å; F25-N29 WeakPolarHBondContact CE1-ND2 3.25Å; F25-N29 WeakPolarHBondContact O-CB 3.27Å; F25-N29 PolarHBondContact O-N 2.91Å; F25-N29 PolarHBondContact O-ND2 2.89Å; L26-N29 PolarHBondContact O-N 2.99Å; N29-Q31 PolarHBondContact O-N 2.91Å; N29-L32 PolarHBondContact O-N 3.35Å; N29-L32 VanDerWaalsContact O-N 3.16Å; N29-W37 VanDerWaalsContact C-CZ2 3.42Å; N29-W37 HydrophobicContact CB-CH2 3.99Å; N29-W37 HydrophobicContact CB-CZ2 4.07Å; N29-W37 VanDerWaalsContact O-CZ2 3.26Å; N29-W37 WeakPolarHBondContact O-CZ2 3.39Å
30	L	49.8	Very low	58.9	Low	17 Å²	17	92.3 Å²	92.3	9%	0.089	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-57.8	-30	176.9	-98.3	159.7	0	0	0	113	L26 G27 L28 L32 W37 L41 L90	L26-L30 WeakPolarHBondContact O-CA 3.32Å; L26-L30 WeakPolarHBondContact O-CB 3.14Å; L26-L30 WeakPolarHBondContact O-CD1 3.41Å; L26-L30 WeakPolarHBondContact O-CG 3.28Å; L26-L30 PolarHBondContact O-N 3.44Å; G27-L30 VanDerWaalsContact O-CB 3.32Å; G27-L30 WeakPolarHBondContact O-CB 3.47Å; L28-L30 PolarHBondContact O-N 3.27Å; L30-L32 PolarHBondContact O-N 3.09Å; L30-L32 VanDerWaalsContact O-N 3.09Å; L30-W37 HydrophobicContact CB-CE3 4.44Å; L30-W37 HydrophobicContact CB-CH2 4.37Å; L30-W37 HydrophobicContact CB-CZ3 4.35Å; L30-W37 HydrophobicContact CD1-CE3 4.33Å; L30-W37 HydrophobicContact CD1-CZ3 4.22Å; L30-W37 HydrophobicContact CD2-CB 3.76Å; L30-W37 HydrophobicContact CD2-CD2 3.33Å; L30-W37 HydrophobicContact CD2-CE3 3.09Å; L30-W37 HydrophobicContact CD2-CG 3.71Å; L30-W37 HydrophobicContact CD2-CH2 4.42Å; L30-W37 HydrophobicContact CD2-CZ3 3.71Å; L30-W37 HydrophobicContact CG-CD2 3.87Å; L30-W37 HydrophobicContact CG-CE3 3.38Å; L30-W37 HydrophobicContact CG-CH2 3.86Å; L30-W37 HydrophobicContact CG-CZ2 4.35Å; L30-W37 HydrophobicContact CG-CZ3 3.38Å; L30-L41 HydrophobicContact CD1-CD1 4.39Å; L30-L41 HydrophobicContact CD1-CD2 4.15Å; L30-L41 HydrophobicContact CD2-CD1 3.87Å; L30-L41 HydrophobicContact CD2-CG 4.27Å; L30-L90 HydrophobicContact CB-CD1 4.42Å
31	Q	53.3	Low	59.1	Low	134 Å²	134	92 Å²	92	63%	0.626	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-59.8	-20.7	177.2	-93.6	-174.6	-23.9	0	0	113.3	L28 N29 L90	L28-Q31 PolarHBondContact O-N 3.16Å; N29-Q31 PolarHBondContact O-N 2.91Å; Q31-L90 HydrophobicContact CG-CD2 4.49Å
32	L	55.3	Low	59.1	Low	143 Å²	143	94.3 Å²	94.3	75%	0.749	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-96.8	-11.3	-167.1	-82.8	142	0	0	0	116.2	N29 L30	N29-L32 PolarHBondContact O-N 3.35Å; N29-L32 VanDerWaalsContact O-N 3.16Å; L30-L32 PolarHBondContact O-N 3.09Å; L30-L32 VanDerWaalsContact O-N 3.09Å
33	S	55.4	Low	59.5	Low	47 Å²	47	93.4 Å²	93.4	33%	0.329	45%	0.454	S	S	.	.			trans	-141.9	124.8	-177.7	156	0	0	0	0	114.1	W37	S33-W37 VanDerWaalsContact C-CD1 3.47Å; S33-W37 VanDerWaalsContact CB-CD1 3.43Å; S33-W37 PolarHBondContact O-NE1 2.91Å; S33-W37 VanDerWaalsContact OG-CD1 3.28Å; S33-W37 PolarHBondContact OG-NE1 3.15Å
34	K	65.5	Low	59.9	Low	150 Å²	150	95 Å²	95	65%	0.652	46%	0.457	S	S	*	.	S	Bend	trans	-88.1	-16.6	-161.5	-66.3	-171.8	-178	-159.2	0	115.8	D94	K34-D94 WeakPolarHBondContact CD-OD2 3.34Å; K34-D94 WeakPolarHBondContact CE-OD1 3.38Å; K34-D94 WeakPolarHBondContact CE-OD2 3.3Å; K34-D94 IonicContact NZ-OD1 2.98Å; K34-D94 PolarHBondContact NZ-OD1 3.42Å; K34-D94 IonicContact NZ-OD2 2.66Å; K34-D94 PolarHBondContact NZ-OD2 3.33Å
35	R	60.9	Low	60.1	Low	224 Å²	224	91.8 Å²	91.8	85%	0.845	44%	0.441	S	S	*	.	S	Bend	trans	-126.1	-38.7	-170	-137.2	179.5	-158.8	-178.5	5.6	115.3	W37	R35-W37 PolarHBondContact O-N 3.23Å
36	K	62.4	Low	60.4	Low	155 Å²	155	88.1 Å²	88.1	67%	0.674	43%	0.431	S	S	*	.	H	α-helix	trans	-68.9	-20.6	179.6	-66.6	-173.9	176.8	-178	0	112.4	I39 I40	K36-I39 PolarHBondContact O-N 3.37Å; K36-I40 PolarHBondContact O-N 3.48Å
37	W	59.4	Low	61.3	Low	35 Å²	35	89.9 Å²	89.9	13%	0.133	44%	0.444	C	S	.	.	H	α-helix	trans	-79.7	-27.9	-171	-77.1	87.3	0	0	0	115.9	L26 N29 L30 S33 R35 I39 I40 L41	L26-W37 HydrophobicContact CD2-CH2 4.12Å; L26-W37 HydrophobicContact CD2-CZ3 3.74Å; N29-W37 VanDerWaalsContact C-CZ2 3.42Å; N29-W37 HydrophobicContact CB-CH2 3.99Å; N29-W37 HydrophobicContact CB-CZ2 4.07Å; N29-W37 VanDerWaalsContact O-CZ2 3.26Å; N29-W37 WeakPolarHBondContact O-CZ2 3.39Å; L30-W37 HydrophobicContact CB-CE3 4.44Å; L30-W37 HydrophobicContact CB-CH2 4.37Å; L30-W37 HydrophobicContact CB-CZ3 4.35Å; L30-W37 HydrophobicContact CD1-CE3 4.33Å; L30-W37 HydrophobicContact CD1-CZ3 4.22Å; L30-W37 HydrophobicContact CD2-CB 3.76Å; L30-W37 HydrophobicContact CD2-CD2 3.33Å; L30-W37 HydrophobicContact CD2-CE3 3.09Å; L30-W37 HydrophobicContact CD2-CG 3.71Å; L30-W37 HydrophobicContact CD2-CH2 4.42Å; L30-W37 HydrophobicContact CD2-CZ3 3.71Å; L30-W37 HydrophobicContact CG-CD2 3.87Å; L30-W37 HydrophobicContact CG-CE3 3.38Å; L30-W37 HydrophobicContact CG-CH2 3.86Å; L30-W37 HydrophobicContact CG-CZ2 4.35Å; L30-W37 HydrophobicContact CG-CZ3 3.38Å; S33-W37 VanDerWaalsContact C-CD1 3.47Å; S33-W37 VanDerWaalsContact CB-CD1 3.43Å; S33-W37 PolarHBondContact O-NE1 2.91Å; S33-W37 VanDerWaalsContact OG-CD1 3.28Å; S33-W37 PolarHBondContact OG-NE1 3.15Å; R35-W37 PolarHBondContact O-N 3.23Å; W37-I39 PolarHBondContact O-N 3.3Å; W37-I40 HydrophobicContact CD2-CD1 4.27Å; W37-I40 HydrophobicContact CE3-CB 4.21Å; W37-I40 HydrophobicContact CE3-CD1 4.17Å; W37-I40 HydrophobicContact CE3-CG2 4.14Å; W37-I40 HydrophobicContact CZ3-CG2 4.3Å; W37-I40 PolarHBondContact O-N 3.5Å; W37-I40 VanDerWaalsContact O-N 3.17Å; W37-L41 WeakPolarHBondContact O-CB 3.31Å; W37-L41 PolarHBondContact O-N 3.27Å
38	K	61.1	Low	62.2	Low	131 Å²	131	91.2 Å²	91.2	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-58.6	-39.1	171.9	-72.4	-174.5	-179.7	179.5	0	110.7	F42	K38-F42 WeakPolarHBondContact O-CB 3.12Å; K38-F42 PolarHBondContact O-N 3.26Å
39	I	62.6	Low	62.9	Low	120 Å²	120	88.8 Å²	88.8	62%	0.615	44%	0.44	S	S	*	.	H	α-helix	trans	-66.6	-49.7	175.9	-58	173.6	0	0	0	109.5	K36 W37 L41 F42 T43	K36-I39 PolarHBondContact O-N 3.37Å; W37-I39 PolarHBondContact O-N 3.3Å; I39-L41 PolarHBondContact O-N 2.91Å; I39-F42 PolarHBondContact O-N 3.05Å; I39-T43 WeakPolarHBondContact O-CB 3.49Å; I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 PolarHBondContact O-OG1 3.44Å
40	I	68.2	Low	63.9	Low	66 Å²	66	89.5 Å²	89.5	34%	0.338	45%	0.446	S	S	.	.	H	α-helix	trans	-60.1	-47.7	-179.3	-64	168.7	0	0	0	111.7	K36 W37 F42 T43 M44	K36-I40 PolarHBondContact O-N 3.48Å; W37-I40 HydrophobicContact CD2-CD1 4.27Å; W37-I40 HydrophobicContact CE3-CB 4.21Å; W37-I40 HydrophobicContact CE3-CD1 4.17Å; W37-I40 HydrophobicContact CE3-CG2 4.14Å; W37-I40 HydrophobicContact CZ3-CG2 4.3Å; W37-I40 PolarHBondContact O-N 3.5Å; W37-I40 VanDerWaalsContact O-N 3.17Å; I40-F42 VanDerWaalsContact C-N 3.33Å; I40-F42 PolarHBondContact O-N 3.17Å; I40-T43 WeakPolarHBondContact O-CB 3.42Å; I40-T43 PolarHBondContact O-N 2.94Å; I40-M44 HydrophobicContact CG2-CG 4.21Å; I40-M44 WeakPolarHBondContact O-CB 3.43Å; I40-M44 VanDerWaalsContact O-CG 3.28Å; I40-M44 WeakPolarHBondContact O-CG 2.86Å; I40-M44 PolarHBondContact O-N 3.29Å
41	L	66.9	Low	65.1	Low	32 Å²	32	90.6 Å²	90.6	17%	0.168	46%	0.458	C	S	.	.	H	α-helix	trans	-62.2	-41.4	178.3	-81	170.6	0	0	0	112	L30 W37 I39 M44 S45 A87	L30-L41 HydrophobicContact CD1-CD1 4.39Å; L30-L41 HydrophobicContact CD1-CD2 4.15Å; L30-L41 HydrophobicContact CD2-CD1 3.87Å; L30-L41 HydrophobicContact CD2-CG 4.27Å; W37-L41 WeakPolarHBondContact O-CB 3.31Å; W37-L41 PolarHBondContact O-N 3.27Å; I39-L41 PolarHBondContact O-N 2.91Å; L41-M44 PolarHBondContact O-N 3.45Å; L41-S45 VanDerWaalsContact O-CB 3.26Å; L41-S45 WeakPolarHBondContact O-CB 3.29Å; L41-S45 PolarHBondContact O-N 3.28Å; L41-A87 HydrophobicContact CD1-CB 3.76Å
42	F	65	Low	65.9	Low	138 Å²	138	84.4 Å²	84.4	61%	0.605	43%	0.43	S	S	*	.	H	α-helix	trans	-62.7	-44	174	-177.2	-98.8	0	0	0	111.5	K38 I39 I40 S45 C46	K38-F42 WeakPolarHBondContact O-CB 3.12Å; K38-F42 PolarHBondContact O-N 3.26Å; I39-F42 PolarHBondContact O-N 3.05Å; I40-F42 VanDerWaalsContact C-N 3.33Å; I40-F42 PolarHBondContact O-N 3.17Å; F42-S45 WeakPolarHBondContact O-CB 3.42Å; F42-S45 PolarHBondContact O-N 3.4Å; F42-C46 PolarHBondContact O-N 3.2Å
43	T	72	Confident	66.6	Low	71 Å²	71	84 Å²	84	44%	0.436	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-48.6	176.1	-57.5	0	0	0	0	111.3	I39 I40 S45 C46 V47	I39-T43 WeakPolarHBondContact O-CB 3.49Å; I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 PolarHBondContact O-OG1 3.44Å; I40-T43 WeakPolarHBondContact O-CB 3.42Å; I40-T43 PolarHBondContact O-N 2.94Å; T43-S45 VanDerWaalsContact C-N 3.33Å; T43-S45 PolarHBondContact O-N 2.83Å; T43-C46 WeakPolarHBondContact O-CB 3.19Å; T43-C46 PolarHBondContact O-N 3.39Å; T43-C46 VanDerWaalsContact O-N 3.17Å; T43-V47 WeakPolarHBondContact O-CG2 3.49Å; T43-V47 PolarHBondContact O-N 3.31Å
44	M	70.3	Confident	67.5	Low	66 Å²	66	86 Å²	86	33%	0.325	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-44.9	178.4	-69.6	-60.1	-69.7	0	0	110.9	L26 I40 L41 C46 V47 F48	L26-M44 HydrophobicContact CD1-CE 3.95Å; I40-M44 HydrophobicContact CG2-CG 4.21Å; I40-M44 WeakPolarHBondContact O-CB 3.43Å; I40-M44 VanDerWaalsContact O-CG 3.28Å; I40-M44 WeakPolarHBondContact O-CG 2.86Å; I40-M44 PolarHBondContact O-N 3.29Å; L41-M44 PolarHBondContact O-N 3.45Å; M44-C46 PolarHBondContact O-N 2.82Å; M44-V47 PolarHBondContact O-N 2.93Å; M44-F48 HydrophobicContact CE-CE2 3.97Å; M44-F48 WeakPolarHBondContact O-CD2 3.14Å; M44-F48 PolarHBondContact O-N 3.4Å
45	S	66.9	Low	67.7	Low	16 Å²	16	82.1 Å²	82.1	11%	0.112	41%	0.414	C	S	.	.	H	α-helix	trans	-54.3	-50.8	172.2	162.4	0	0	0	0	112.3	L41 F42 T43 V47 F48 A49 F80	L41-S45 VanDerWaalsContact O-CB 3.26Å; L41-S45 WeakPolarHBondContact O-CB 3.29Å; L41-S45 PolarHBondContact O-N 3.28Å; F42-S45 WeakPolarHBondContact O-CB 3.42Å; F42-S45 PolarHBondContact O-N 3.4Å; T43-S45 VanDerWaalsContact C-N 3.33Å; T43-S45 PolarHBondContact O-N 2.83Å; S45-V47 VanDerWaalsContact C-N 3.3Å; S45-V47 PolarHBondContact O-N 3.47Å; S45-F48 PolarHBondContact O-N 2.82Å; S45-A49 WeakPolarHBondContact O-CB 3.3Å; S45-A49 PolarHBondContact O-N 2.97Å; S45-F80 VanDerWaalsContact CB-CD2 3.43Å; S45-F80 WeakPolarHBondContact OG-CD2 3.32Å; S45-F80 WeakPolarHBondContact OG-CE2 3.28Å
46	C	63.8	Low	67.9	Low	54 Å²	54	75.4 Å²	75.4	37%	0.365	39%	0.39	S	S	.	.	H	α-helix	trans	-58.9	-43.3	178.5	-79.9	0	0	0	0	111.4	F42 T43 M44 F48 A49 V50	F42-C46 PolarHBondContact O-N 3.2Å; T43-C46 WeakPolarHBondContact O-CB 3.19Å; T43-C46 PolarHBondContact O-N 3.39Å; T43-C46 VanDerWaalsContact O-N 3.17Å; M44-C46 PolarHBondContact O-N 2.82Å; C46-F48 PolarHBondContact O-N 3.18Å; C46-A49 PolarHBondContact O-N 3.1Å; C46-V50 WeakPolarHBondContact O-CB 2.81Å; C46-V50 VanDerWaalsContact O-CG2 3.24Å; C46-V50 WeakPolarHBondContact O-CG2 3.27Å; C46-V50 PolarHBondContact O-N 2.84Å
47	V	74.8	Confident	68.3	Low	86 Å²	86	70.9 Å²	70.9	52%	0.521	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-45.6	177.5	173.2	0	0	0	0	110.9	T43 M44 S45 V50 A51	T43-V47 WeakPolarHBondContact O-CG2 3.49Å; T43-V47 PolarHBondContact O-N 3.31Å; M44-V47 PolarHBondContact O-N 2.93Å; S45-V47 VanDerWaalsContact C-N 3.3Å; S45-V47 PolarHBondContact O-N 3.47Å; V47-V50 PolarHBondContact O-N 3.47Å; V47-A51 VanDerWaalsContact O-CB 3.32Å; V47-A51 WeakPolarHBondContact O-CB 3.47Å; V47-A51 PolarHBondContact O-N 3.34Å
48	F	71.4	Confident	68.8	Low	49 Å²	49	73.4 Å²	73.4	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-65.4	-40.8	177.1	-80.6	-66.6	0	0	0	112.8	F19 M44 S45 C46 A51 G52	F19-F48 AromaticContact CD1-CE1 3.59Å; F19-F48 HydrophobicContact CD1-CE1 3.59Å; F19-F48 AromaticContact CD1-CZ 3.57Å; F19-F48 HydrophobicContact CD1-CZ 3.57Å; F19-F48 AromaticContact CE1-CE1 3.71Å; F19-F48 HydrophobicContact CE1-CE1 3.71Å; F19-F48 AromaticContact CE1-CZ 3.91Å; F19-F48 HydrophobicContact CE1-CZ 3.91Å; F19-F48 HydrophobicContact CG-CE1 4.17Å; F19-F48 HydrophobicContact CG-CZ 4.38Å; F19-F48 HydrophobicContact CZ-CE1 4.39Å; M44-F48 HydrophobicContact CE-CE2 3.97Å; M44-F48 WeakPolarHBondContact O-CD2 3.14Å; M44-F48 PolarHBondContact O-N 3.4Å; S45-F48 PolarHBondContact O-N 2.82Å; C46-F48 PolarHBondContact O-N 3.18Å; F48-A51 PolarHBondContact O-N 2.79Å; F48-G52 PolarHBondContact O-N 3.04Å
49	A	65.3	Low	69	Low	58 Å²	58	67.8 Å²	67.8	48%	0.479	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-44.2	176.8	0	0	0	0	0	111.4	S45 C46 F53	S45-A49 WeakPolarHBondContact O-CB 3.3Å; S45-A49 PolarHBondContact O-N 2.97Å; C46-A49 PolarHBondContact O-N 3.1Å; A49-F53 VanDerWaalsContact O-CB 3.32Å; A49-F53 WeakPolarHBondContact O-CB 3.36Å; A49-F53 PolarHBondContact O-N 3.08Å
50	V	72.3	Confident	69.1	Low	87 Å²	87	65.7 Å²	65.7	53%	0.527	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-46.4	176.5	172	0	0	0	0	110.8	C46 V47 F53 I54	C46-V50 WeakPolarHBondContact O-CB 2.81Å; C46-V50 VanDerWaalsContact O-CG2 3.24Å; C46-V50 WeakPolarHBondContact O-CG2 3.27Å; C46-V50 PolarHBondContact O-N 2.84Å; V47-V50 PolarHBondContact O-N 3.47Å; V50-F53 PolarHBondContact O-N 2.73Å; V50-I54 HydrophobicContact CG1-CD1 3.83Å; V50-I54 HydrophobicContact CG1-CG1 4.48Å; V50-I54 VanDerWaalsContact O-CG1 3.29Å; V50-I54 WeakPolarHBondContact O-CG1 3.37Å; V50-I54 PolarHBondContact O-N 2.83Å
51	A	75	Confident	69.3	Low	41 Å²	41	68.1 Å²	68.1	34%	0.339	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-45	178.2	0	0	0	0	0	112.1	V47 F48 F53 I54 L55	V47-A51 VanDerWaalsContact O-CB 3.32Å; V47-A51 WeakPolarHBondContact O-CB 3.47Å; V47-A51 PolarHBondContact O-N 3.34Å; F48-A51 PolarHBondContact O-N 2.79Å; A51-F53 VanDerWaalsContact C-N 3.33Å; A51-F53 PolarHBondContact O-N 3.39Å; A51-I54 PolarHBondContact O-N 3.04Å; A51-L55 WeakPolarHBondContact O-CB 3.28Å; A51-L55 WeakPolarHBondContact O-CG 3.25Å; A51-L55 PolarHBondContact O-N 3.44Å
52	G	69.6	Low	69.5	Low	3 Å²	3	72 Å²	72	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-61.6	-40.4	175.8	0	0	0	0	0	112.4	F48 L55 Y56	F48-G52 PolarHBondContact O-N 3.04Å; G52-L55 PolarHBondContact O-N 3.45Å; G52-Y56 WeakPolarHBondContact O-CB 3.33Å; G52-Y56 PolarHBondContact O-N 2.93Å
53	F	69.9	Low	69.6	Low	135 Å²	135	73 Å²	73	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-64.2	-45	174.8	-177.2	-98.8	0	0	0	112.4	A49 V50 A51 L55 Y56 V57	A49-F53 VanDerWaalsContact O-CB 3.32Å; A49-F53 WeakPolarHBondContact O-CB 3.36Å; A49-F53 PolarHBondContact O-N 3.08Å; V50-F53 PolarHBondContact O-N 2.73Å; A51-F53 VanDerWaalsContact C-N 3.33Å; A51-F53 PolarHBondContact O-N 3.39Å; F53-L55 PolarHBondContact O-N 2.98Å; F53-Y56 WeakPolarHBondContact O-CB 3.32Å; F53-Y56 PolarHBondContact O-N 3.37Å; F53-V57 HydrophobicContact CD1-CG2 4.27Å; F53-V57 HydrophobicContact CE1-CG2 3.86Å; F53-V57 HydrophobicContact CE2-CG2 4.36Å; F53-V57 HydrophobicContact CZ-CG2 3.91Å; F53-V57 WeakPolarHBondContact O-CG2 3.1Å; F53-V57 PolarHBondContact O-N 3.49Å
54	I	73.9	Confident	69	Low	89 Å²	89	76.8 Å²	76.8	46%	0.456	42%	0.419	S	S	.	.	H	α-helix	trans	-59.7	-48.5	176.8	-70.8	167.7	0	0	0	110.3	V50 A51 Y56 V57 L58	V50-I54 HydrophobicContact CG1-CD1 3.83Å; V50-I54 HydrophobicContact CG1-CG1 4.48Å; V50-I54 VanDerWaalsContact O-CG1 3.29Å; V50-I54 WeakPolarHBondContact O-CG1 3.37Å; V50-I54 PolarHBondContact O-N 2.83Å; A51-I54 PolarHBondContact O-N 3.04Å; I54-Y56 VanDerWaalsContact C-N 3.3Å; I54-Y56 PolarHBondContact O-N 3.28Å; I54-V57 PolarHBondContact O-N 3.3Å; I54-L58 HydrophobicContact CG2-CD1 3.58Å; I54-L58 WeakPolarHBondContact O-CB 3.44Å; I54-L58 WeakPolarHBondContact O-CD1 3.26Å; I54-L58 PolarHBondContact O-N 3.49Å
55	L	69.4	Low	68.5	Low	68 Å²	68	76.1 Å²	76.1	36%	0.356	42%	0.415	S	S	.	.	H	α-helix	trans	-64.4	-35.2	179.6	-71.5	170.8	0	0	0	112.5	A51 G52 F53 G59 W72	A51-L55 WeakPolarHBondContact O-CB 3.28Å; A51-L55 WeakPolarHBondContact O-CG 3.25Å; A51-L55 PolarHBondContact O-N 3.44Å; G52-L55 PolarHBondContact O-N 3.45Å; F53-L55 PolarHBondContact O-N 2.98Å; L55-G59 PolarHBondContact O-N 3.29Å; L55-W72 HydrophobicContact CD1-CD2 3.93Å; L55-W72 HydrophobicContact CD1-CE3 3.18Å; L55-W72 HydrophobicContact CD1-CH2 3.86Å; L55-W72 HydrophobicContact CD1-CZ3 3.14Å
56	Y	66.1	Low	67.9	Low	83 Å²	83	79 Å²	79	33%	0.325	43%	0.432	S	S	.	.	H	α-helix	trans	-63.1	-48.2	172.4	174.1	-110.3	0	0	0	112.2	G52 F53 I54 L58 G59 L60 I73	G52-Y56 WeakPolarHBondContact O-CB 3.33Å; G52-Y56 PolarHBondContact O-N 2.93Å; F53-Y56 WeakPolarHBondContact O-CB 3.32Å; F53-Y56 PolarHBondContact O-N 3.37Å; I54-Y56 VanDerWaalsContact C-N 3.3Å; I54-Y56 PolarHBondContact O-N 3.28Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; Y56-L58 PolarHBondContact O-N 3.16Å; Y56-G59 PolarHBondContact O-N 2.86Å; Y56-L60 HydrophobicContact CD1-CD1 3.97Å; Y56-L60 HydrophobicContact CD2-CG 4.47Å; Y56-L60 HydrophobicContact CE1-CD1 3.38Å; Y56-L60 HydrophobicContact CE1-CG 4.17Å; Y56-L60 HydrophobicContact CE2-CD1 4.18Å; Y56-L60 HydrophobicContact CE2-CD2 4.33Å; Y56-L60 HydrophobicContact CE2-CG 4.12Å; Y56-L60 WeakPolarHBondContact O-CG 3.42Å; Y56-L60 PolarHBondContact O-N 2.9Å; Y56-I73 HydrophobicContact CD1-CD1 4.18Å; Y56-I73 HydrophobicContact CD2-CD1 3.18Å; Y56-I73 HydrophobicContact CD2-CG1 4.4Å; Y56-I73 HydrophobicContact CE2-CD1 3.79Å; Y56-I73 HydrophobicContact CG-CD1 3.39Å; Y56-I73 HydrophobicContact CG-CG1 4.42Å
57	V	70.6	Confident	67.6	Low	61 Å²	61	82 Å²	82	37%	0.37	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-42	178.1	173.4	0	0	0	0	111	F53 I54 L60 T61	F53-V57 HydrophobicContact CD1-CG2 4.27Å; F53-V57 HydrophobicContact CE1-CG2 3.86Å; F53-V57 HydrophobicContact CE2-CG2 4.36Å; F53-V57 HydrophobicContact CZ-CG2 3.91Å; F53-V57 WeakPolarHBondContact O-CG2 3.1Å; F53-V57 PolarHBondContact O-N 3.49Å; I54-V57 PolarHBondContact O-N 3.3Å; V57-L60 PolarHBondContact O-N 3.44Å; V57-T61 WeakPolarHBondContact O-CB 3.47Å; V57-T61 PolarHBondContact O-N 3.45Å; V57-T61 PolarHBondContact O-OG1 2.96Å
58	L	69.7	Low	66.8	Low	88 Å²	88	80 Å²	80	46%	0.461	43%	0.428	S	S	.	.	H	α-helix	trans	-59.3	-46.7	172.3	-96.9	130.6	0	0	0	111.7	I54 Y56 L60 T61 L62	I54-L58 HydrophobicContact CG2-CD1 3.58Å; I54-L58 WeakPolarHBondContact O-CB 3.44Å; I54-L58 WeakPolarHBondContact O-CD1 3.26Å; I54-L58 PolarHBondContact O-N 3.49Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; Y56-L58 PolarHBondContact O-N 3.16Å; L58-L60 VanDerWaalsContact C-N 3.34Å; L58-L60 PolarHBondContact O-N 3.4Å; L58-T61 PolarHBondContact O-N 3.46Å; L58-L62 HydrophobicContact CD2-CD1 4.11Å; L58-L62 WeakPolarHBondContact O-CB 3.4Å; L58-L62 WeakPolarHBondContact O-CD1 3.49Å; L58-L62 PolarHBondContact O-N 3.45Å
59	G	65.7	Low	66.3	Low	13 Å²	13	78 Å²	78	13%	0.134	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-40.4	177	0	0	0	0	0	113.1	L55 Y56 H63	L55-G59 PolarHBondContact O-N 3.29Å; Y56-G59 PolarHBondContact O-N 2.86Å; G59-H63 PolarHBondContact O-N 2.8Å
60	L	63.8	Low	66.1	Low	76 Å²	76	78.1 Å²	78.1	40%	0.398	42%	0.419	S	S	.	.	H	α-helix	trans	-64	-44.2	172.9	-75.1	178.6	0	0	0	112	Y56 V57 L58 H63	Y56-L60 HydrophobicContact CD1-CD1 3.97Å; Y56-L60 HydrophobicContact CD2-CG 4.47Å; Y56-L60 HydrophobicContact CE1-CD1 3.38Å; Y56-L60 HydrophobicContact CE1-CG 4.17Å; Y56-L60 HydrophobicContact CE2-CD1 4.18Å; Y56-L60 HydrophobicContact CE2-CD2 4.33Å; Y56-L60 HydrophobicContact CE2-CG 4.12Å; Y56-L60 WeakPolarHBondContact O-CG 3.42Å; Y56-L60 PolarHBondContact O-N 2.9Å; V57-L60 PolarHBondContact O-N 3.44Å; L58-L60 VanDerWaalsContact C-N 3.34Å; L58-L60 PolarHBondContact O-N 3.4Å; L60-H63 PolarHBondContact O-N 3.2Å
61	T	72.9	Confident	65.8	Low	116 Å²	116	75.4 Å²	75.4	71%	0.712	41%	0.405	S	S	*	.	H	α-helix	trans	-68.2	-39.2	-176.6	-54.1	0	0	0	0	111.3	V57 L58 H63	V57-T61 WeakPolarHBondContact O-CB 3.47Å; V57-T61 PolarHBondContact O-N 3.45Å; V57-T61 PolarHBondContact O-OG1 2.96Å; L58-T61 PolarHBondContact O-N 3.46Å; T61-H63 VanDerWaalsContact C-N 3.25Å; T61-H63 PolarHBondContact O-N 2.84Å
62	L	72.2	Confident	65.3	Low	114 Å²	114	76.8 Å²	76.8	60%	0.597	40%	0.402	S	S	*	.	H	α-helix	trans	-75.1	-14.3	178.3	-80.7	151	0	0	0	112.8	L58 M64	L58-L62 HydrophobicContact CD2-CD1 4.11Å; L58-L62 WeakPolarHBondContact O-CB 3.4Å; L58-L62 WeakPolarHBondContact O-CD1 3.49Å; L58-L62 PolarHBondContact O-N 3.45Å; L62-M64 VanDerWaalsContact O-CG 3.23Å; L62-M64 WeakPolarHBondContact O-CG 3.28Å; L62-M64 PolarHBondContact O-N 3.25Å
63	H	65.3	Low	65.1	Low	159 Å²	159	79.4 Å²	79.4	74%	0.736	41%	0.414	S	S	*	.			trans	54.8	-4.4	179.2	-143.5	-75.1	0	0	0	116.2	G59 L60 T61	G59-H63 PolarHBondContact O-N 2.8Å; L60-H63 PolarHBondContact O-N 3.2Å; T61-H63 VanDerWaalsContact C-N 3.25Å; T61-H63 PolarHBondContact O-N 2.84Å
64	M	61.1	Low	64.9	Low	151 Å²	151	76.1 Å²	76.1	74%	0.744	41%	0.407	S	S	*	.	S	Bend	trans	-89.2	-21.9	-170.6	-72.4	-79.2	-177.7	0	0	113	L62	L62-M64 VanDerWaalsContact O-CG 3.23Å; L62-M64 WeakPolarHBondContact O-CG 3.28Å; L62-M64 PolarHBondContact O-N 3.25Å
65	H	58.2	Low	64.5	Low	52 Å²	52	74.1 Å²	74.1	24%	0.241	40%	0.401	C	S	.	.			trans	-147.6	50.5	-168.4	-67.2	-74.1	0	0	0	114	L67 Q68 G69 D128	H65-L67 PolarHBondContact O-N 3.4Å; H65-Q68 HydrophobicContact CB-CB 3.79Å; H65-Q68 WeakPolarHBondContact O-CB 3.49Å; H65-Q68 PolarHBondContact O-N 3.17Å; H65-G69 PolarHBondContact O-N 2.91Å; H65-G69 VanDerWaalsContact O-N 3.14Å; H65-D128 IonicContact CE1-OD2 3.98Å; H65-D128 IonicContact ND1-OD2 3.88Å
66	V	54.8	Low	64.2	Low	77 Å²	77	72 Å²	72	47%	0.467	39%	0.392	S	S	.	.	H	α-helix	trans	-54.3	-36	175.2	-178.9	0	0	0	0	111.7	Q68 G69 S70	V66-Q68 VanDerWaalsContact C-N 3.35Å; V66-Q68 PolarHBondContact O-N 2.9Å; V66-G69 PolarHBondContact O-N 2.87Å; V66-S70 PolarHBondContact O-N 3.35Å; V66-S70 VanDerWaalsContact O-N 3.12Å; V66-S70 PolarHBondContact O-OG 3.33Å
67	L	56.7	Low	64.2	Low	116 Å²	116	71.1 Å²	71.1	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-64.6	-35.7	175.2	-109.3	85.3	0	0	0	113.3	H65 S70 A71	H65-L67 PolarHBondContact O-N 3.4Å; L67-S70 PolarHBondContact O-OG 2.85Å; L67-A71 WeakPolarHBondContact O-CB 3.26Å; L67-A71 PolarHBondContact O-N 3.36Å
68	Q	59.7	Low	64	Low	44 Å²	44	70 Å²	70	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-72.6	-40.5	179.9	-160.8	168	-49.9	0	0	110.1	E8 H65 V66 S70 A71 W72 F121	E8-Q68 PolarHBondContact OE1-NE2 2.8Å; H65-Q68 HydrophobicContact CB-CB 3.79Å; H65-Q68 WeakPolarHBondContact O-CB 3.49Å; H65-Q68 PolarHBondContact O-N 3.17Å; V66-Q68 VanDerWaalsContact C-N 3.35Å; V66-Q68 PolarHBondContact O-N 2.9Å; Q68-S70 PolarHBondContact O-N 2.91Å; Q68-A71 PolarHBondContact O-N 2.91Å; Q68-W72 PolarHBondContact O-N 3.2Å; Q68-W72 VanDerWaalsContact O-N 3.11Å; Q68-F121 HydrophobicContact CG-CE2 3.63Å; Q68-F121 HydrophobicContact CG-CZ 3.85Å
69	G	60.2	Low	64	Low	7 Å²	7	67.4 Å²	67.4	7%	0.072	37%	0.374	C	S	.	.	H	α-helix	trans	-61.6	-42.7	175.7	0	0	0	0	0	113.1	H65 V66 W72 I73	H65-G69 PolarHBondContact O-N 2.91Å; H65-G69 VanDerWaalsContact O-N 3.14Å; V66-G69 PolarHBondContact O-N 2.87Å; G69-W72 PolarHBondContact O-N 3.48Å; G69-I73 PolarHBondContact O-N 3.3Å
70	S	62.1	Low	64	Low	61 Å²	61	70.8 Å²	70.8	43%	0.427	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-38.7	178.9	66	0	0	0	0	112.6	V66 L67 Q68 W72 I73 C74	V66-S70 PolarHBondContact O-N 3.35Å; V66-S70 VanDerWaalsContact O-N 3.12Å; V66-S70 PolarHBondContact O-OG 3.33Å; L67-S70 PolarHBondContact O-OG 2.85Å; Q68-S70 PolarHBondContact O-N 2.91Å; S70-W72 VanDerWaalsContact C-N 3.29Å; S70-W72 PolarHBondContact O-N 3.31Å; S70-I73 PolarHBondContact O-N 2.94Å; S70-C74 WeakPolarHBondContact O-CB 3.38Å; S70-C74 PolarHBondContact O-N 3.47Å
71	A	64.6	Low	64.2	Low	29 Å²	29	71.5 Å²	71.5	24%	0.24	39%	0.389	C	S	.	.	H	α-helix	trans	-61	-39.9	174.3	0	0	0	0	0	111.6	L67 Q68 C74 C75	L67-A71 WeakPolarHBondContact O-CB 3.26Å; L67-A71 PolarHBondContact O-N 3.36Å; Q68-A71 PolarHBondContact O-N 2.91Å; A71-C74 PolarHBondContact O-N 3.49Å; A71-C75 WeakPolarHBondContact O-CB 3.39Å; A71-C75 PolarHBondContact O-N 3.48Å
72	W	64.9	Low	63.9	Low	71 Å²	71	67 Å²	67	27%	0.269	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-45.3	176.4	-86.8	66.2	0	0	0	112.6	L55 Q68 G69 S70 C74 C75 C76 F121	L55-W72 HydrophobicContact CD1-CD2 3.93Å; L55-W72 HydrophobicContact CD1-CE3 3.18Å; L55-W72 HydrophobicContact CD1-CH2 3.86Å; L55-W72 HydrophobicContact CD1-CZ3 3.14Å; Q68-W72 PolarHBondContact O-N 3.2Å; Q68-W72 VanDerWaalsContact O-N 3.11Å; G69-W72 PolarHBondContact O-N 3.48Å; S70-W72 VanDerWaalsContact C-N 3.29Å; S70-W72 PolarHBondContact O-N 3.31Å; W72-C74 VanDerWaalsContact C-N 3.32Å; W72-C74 PolarHBondContact O-N 2.9Å; W72-C75 WeakPolarHBondContact O-CB 3.49Å; W72-C75 PolarHBondContact O-N 2.93Å; W72-C76 PolarHBondContact O-N 3.39Å; W72-C76 PolarHBondContact O-SG 2.83Å; W72-F121 AromaticContact CD1-CE2 3.82Å; W72-F121 AromaticContact NE1-CE2 3.44Å; W72-F121 AromaticContact NE1-CZ 3.85Å
73	I	65.4	Low	63.7	Low	57 Å²	57	63.2 Å²	63.2	29%	0.292	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-47.4	174.1	-71.8	162.9	0	0	0	110.5	Y56 G69 S70 C75 C76 C77	Y56-I73 HydrophobicContact CD1-CD1 4.18Å; Y56-I73 HydrophobicContact CD2-CD1 3.18Å; Y56-I73 HydrophobicContact CD2-CG1 4.4Å; Y56-I73 HydrophobicContact CE2-CD1 3.79Å; Y56-I73 HydrophobicContact CG-CD1 3.39Å; Y56-I73 HydrophobicContact CG-CG1 4.42Å; G69-I73 PolarHBondContact O-N 3.3Å; S70-I73 PolarHBondContact O-N 2.94Å; I73-C75 VanDerWaalsContact C-N 3.29Å; I73-C75 PolarHBondContact O-N 3.44Å; I73-C76 WeakPolarHBondContact O-CB 3.49Å; I73-C76 PolarHBondContact O-N 2.9Å; I73-C76 VanDerWaalsContact O-N 3.16Å; I73-C77 PolarHBondContact O-N 2.82Å; I73-C77 PolarHBondContact O-SG 2.9Å
74	C	65.7	Low	63.7	Low	66 Å²	66	60 Å²	60	45%	0.446	33%	0.332	S	S	.	.	H	α-helix	trans	-58.1	-44.9	179.5	-167.9	0	0	0	0	110.9	S70 A71 W72 C76 C77 I78	S70-C74 WeakPolarHBondContact O-CB 3.38Å; S70-C74 PolarHBondContact O-N 3.47Å; A71-C74 PolarHBondContact O-N 3.49Å; W72-C74 VanDerWaalsContact C-N 3.32Å; W72-C74 PolarHBondContact O-N 2.9Å; C74-C76 PolarHBondContact O-N 3.19Å; C74-C77 PolarHBondContact O-N 3.41Å; C74-I78 VanDerWaalsContact O-CG1 3.28Å; C74-I78 WeakPolarHBondContact O-CG1 3.42Å; C74-I78 PolarHBondContact O-N 3.01Å
75	C	65.1	Low	63.9	Low	48 Å²	48	58.2 Å²	58.2	32%	0.324	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-46	176	-158.9	0	0	0	0	111.6	A71 W72 I73 C77 I78 M79 I117	A71-C75 WeakPolarHBondContact O-CB 3.39Å; A71-C75 PolarHBondContact O-N 3.48Å; W72-C75 WeakPolarHBondContact O-CB 3.49Å; W72-C75 PolarHBondContact O-N 2.93Å; I73-C75 VanDerWaalsContact C-N 3.29Å; I73-C75 PolarHBondContact O-N 3.44Å; C75-C77 PolarHBondContact O-N 3.43Å; C75-I78 PolarHBondContact O-N 2.92Å; C75-M79 WeakPolarHBondContact O-CB 3.4Å; C75-M79 VanDerWaalsContact O-CG 3.25Å; C75-M79 WeakPolarHBondContact O-CG 3.32Å; C75-M79 PolarHBondContact O-N 3.28Å; C75-I117 HydrophobicContact CB-CG2 4.3Å
76	C	63.8	Low	64.4	Low	23 Å²	23	56.7 Å²	56.7	16%	0.155	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-43.6	175.7	-68.7	0	0	0	0	112.4	W72 I73 C74 I78 M79 F80	W72-C76 PolarHBondContact O-N 3.39Å; W72-C76 PolarHBondContact O-SG 2.83Å; I73-C76 WeakPolarHBondContact O-CB 3.49Å; I73-C76 PolarHBondContact O-N 2.9Å; I73-C76 VanDerWaalsContact O-N 3.16Å; C74-C76 PolarHBondContact O-N 3.19Å; C76-I78 VanDerWaalsContact C-N 3.35Å; C76-I78 PolarHBondContact O-N 3.44Å; C76-M79 PolarHBondContact O-N 2.88Å; C76-F80 WeakPolarHBondContact O-CB 3.34Å; C76-F80 PolarHBondContact O-N 3.35Å
77	C	65.1	Low	64.9	Low	64 Å²	64	54.4 Å²	54.4	43%	0.432	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-43.1	177.7	-69.7	0	0	0	0	111.7	I73 C74 C75 F80 I81	I73-C77 PolarHBondContact O-N 2.82Å; I73-C77 PolarHBondContact O-SG 2.9Å; C74-C77 PolarHBondContact O-N 3.41Å; C75-C77 PolarHBondContact O-N 3.43Å; C77-F80 WeakPolarHBondContact O-CB 3.44Å; C77-F80 PolarHBondContact O-N 3.25Å; C77-I81 VanDerWaalsContact O-CG1 3.29Å; C77-I81 WeakPolarHBondContact O-CG1 3.21Å; C77-I81 PolarHBondContact O-N 3.11Å
78	I	67.5	Low	65.3	Low	39 Å²	39	56.1 Å²	56.1	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-46.4	179.5	-69.1	168.7	0	0	0	110.3	C74 C75 C76 F80 I81 V82 I113 I117	C74-I78 VanDerWaalsContact O-CG1 3.28Å; C74-I78 WeakPolarHBondContact O-CG1 3.42Å; C74-I78 PolarHBondContact O-N 3.01Å; C75-I78 PolarHBondContact O-N 2.92Å; C76-I78 VanDerWaalsContact C-N 3.35Å; C76-I78 PolarHBondContact O-N 3.44Å; I78-F80 PolarHBondContact O-N 3.41Å; I78-I81 PolarHBondContact O-N 3.05Å; I78-V82 HydrophobicContact CG2-CG2 4.29Å; I78-V82 WeakPolarHBondContact O-CB 3.45Å; I78-V82 WeakPolarHBondContact O-CG2 3.25Å; I78-V82 PolarHBondContact O-N 3.22Å; I78-I113 HydrophobicContact CD1-CG2 4.07Å; I78-I113 HydrophobicContact CG2-CG2 3.99Å; I78-I117 HydrophobicContact CD1-CD1 3.47Å; I78-I117 VanDerWaalsContact CD1-CD1 3.47Å
79	M	69.5	Low	65.6	Low	33 Å²	33	56 Å²	56	16%	0.163	30%	0.301	C	S	.	.	H	α-helix	trans	-56.3	-39.1	174.3	-71.2	-63.1	-70.1	0	0	112	A23 C75 C76 S83 Y110	A23-M79 HydrophobicContact CB-CE 3.76Å; C75-M79 WeakPolarHBondContact O-CB 3.4Å; C75-M79 VanDerWaalsContact O-CG 3.25Å; C75-M79 WeakPolarHBondContact O-CG 3.32Å; C75-M79 PolarHBondContact O-N 3.28Å; C76-M79 PolarHBondContact O-N 2.88Å; M79-S83 VanDerWaalsContact O-CB 3.32Å; M79-S83 WeakPolarHBondContact O-CB 3.24Å; M79-S83 PolarHBondContact O-N 3.12Å; M79-S83 PolarHBondContact O-OG 2.92Å; M79-Y110 HydrophobicContact SD-CE2 3.98Å; M79-Y110 PolarHBondContact SD-OH 2.89Å
80	F	66.3	Low	65.8	Low	83 Å²	83	58 Å²	58	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-67.5	-48.7	177.1	-179.8	-119.9	0	0	0	112.7	S45 C76 C77 I78 V82 S83 L84	S45-F80 VanDerWaalsContact CB-CD2 3.43Å; S45-F80 WeakPolarHBondContact OG-CD2 3.32Å; S45-F80 WeakPolarHBondContact OG-CE2 3.28Å; C76-F80 WeakPolarHBondContact O-CB 3.34Å; C76-F80 PolarHBondContact O-N 3.35Å; C77-F80 WeakPolarHBondContact O-CB 3.44Å; C77-F80 PolarHBondContact O-N 3.25Å; I78-F80 PolarHBondContact O-N 3.41Å; F80-V82 VanDerWaalsContact C-N 3.25Å; F80-V82 PolarHBondContact O-N 3.46Å; F80-S83 WeakPolarHBondContact O-CB 3.18Å; F80-S83 PolarHBondContact O-N 3.48Å; F80-S83 VanDerWaalsContact O-N 3.15Å; F80-L84 HydrophobicContact CD1-CD1 4.02Å; F80-L84 HydrophobicContact CD2-CG 4.35Å; F80-L84 HydrophobicContact CE1-CD1 3.47Å; F80-L84 VanDerWaalsContact CE1-CD1 3.47Å; F80-L84 HydrophobicContact CE1-CG 4.23Å; F80-L84 HydrophobicContact CE2-CD1 4.05Å; F80-L84 HydrophobicContact CE2-CD2 4.15Å; F80-L84 HydrophobicContact CE2-CG 3.92Å; F80-L84 HydrophobicContact CZ-CD1 3.51Å; F80-L84 HydrophobicContact CZ-CD2 4.14Å; F80-L84 HydrophobicContact CZ-CG 3.9Å; F80-L84 WeakPolarHBondContact O-CG 3.32Å; F80-L84 PolarHBondContact O-N 2.83Å
81	I	66.5	Low	65.9	Low	92 Å²	92	59.7 Å²	59.7	47%	0.472	31%	0.314	S	S	.	.	H	α-helix	trans	-57.8	-43.8	177.3	-68.9	164.5	0	0	0	110	C77 I78 L84 F85	C77-I81 VanDerWaalsContact O-CG1 3.29Å; C77-I81 WeakPolarHBondContact O-CG1 3.21Å; C77-I81 PolarHBondContact O-N 3.11Å; I78-I81 PolarHBondContact O-N 3.05Å; I81-L84 PolarHBondContact O-N 3.32Å; I81-F85 HydrophobicContact CG2-CD2 3.94Å; I81-F85 HydrophobicContact CG2-CE2 4.32Å; I81-F85 WeakPolarHBondContact O-CB 3.48Å; I81-F85 PolarHBondContact O-N 2.89Å
82	V	67.9	Low	65.9	Low	22 Å²	22	61.5 Å²	61.5	13%	0.133	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-45.2	177.8	172.8	0	0	0	0	110.8	I78 F80 L84 F85 T86 F106 Y110	I78-V82 HydrophobicContact CG2-CG2 4.29Å; I78-V82 WeakPolarHBondContact O-CB 3.45Å; I78-V82 WeakPolarHBondContact O-CG2 3.25Å; I78-V82 PolarHBondContact O-N 3.22Å; F80-V82 VanDerWaalsContact C-N 3.25Å; F80-V82 PolarHBondContact O-N 3.46Å; V82-L84 VanDerWaalsContact C-N 3.29Å; V82-L84 PolarHBondContact O-N 2.91Å; V82-F85 PolarHBondContact O-N 3.43Å; V82-T86 VanDerWaalsContact O-CB 3.31Å; V82-T86 WeakPolarHBondContact O-CB 3.29Å; V82-T86 PolarHBondContact O-N 3.31Å; V82-T86 PolarHBondContact O-OG1 2.92Å; V82-F106 HydrophobicContact CG1-CE1 4.11Å; V82-F106 HydrophobicContact CG1-CZ 4.26Å; V82-F106 HydrophobicContact CG2-CZ 4.45Å; V82-Y110 HydrophobicContact CB-CD2 4.07Å; V82-Y110 HydrophobicContact CB-CE2 4.18Å; V82-Y110 HydrophobicContact CG1-CD2 3.72Å; V82-Y110 HydrophobicContact CG1-CE2 3.88Å; V82-Y110 HydrophobicContact CG1-CG 4.16Å; V82-Y110 HydrophobicContact CG2-CD2 3.35Å; V82-Y110 HydrophobicContact CG2-CE2 3.78Å; V82-Y110 HydrophobicContact CG2-CG 4.31Å
83	S	67.5	Low	65.9	Low	34 Å²	34	60.6 Å²	60.6	24%	0.238	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-42.5	176.9	-63.4	0	0	0	0	111.6	M79 F80 A87	M79-S83 VanDerWaalsContact O-CB 3.32Å; M79-S83 WeakPolarHBondContact O-CB 3.24Å; M79-S83 PolarHBondContact O-N 3.12Å; M79-S83 PolarHBondContact O-OG 2.92Å; F80-S83 WeakPolarHBondContact O-CB 3.18Å; F80-S83 PolarHBondContact O-N 3.48Å; F80-S83 VanDerWaalsContact O-N 3.15Å; S83-A87 VanDerWaalsContact O-CB 3.25Å; S83-A87 WeakPolarHBondContact O-CB 3.34Å; S83-A87 PolarHBondContact O-N 2.81Å
84	L	64.7	Low	65.6	Low	91 Å²	91	61.8 Å²	61.8	48%	0.476	33%	0.328	S	S	.	.	H	α-helix	trans	-65.6	-45.7	175.9	-73.5	178	0	0	0	112.2	F80 I81 V82 A87 Y88	F80-L84 HydrophobicContact CD1-CD1 4.02Å; F80-L84 HydrophobicContact CD2-CG 4.35Å; F80-L84 HydrophobicContact CE1-CD1 3.47Å; F80-L84 VanDerWaalsContact CE1-CD1 3.47Å; F80-L84 HydrophobicContact CE1-CG 4.23Å; F80-L84 HydrophobicContact CE2-CD1 4.05Å; F80-L84 HydrophobicContact CE2-CD2 4.15Å; F80-L84 HydrophobicContact CE2-CG 3.92Å; F80-L84 HydrophobicContact CZ-CD1 3.51Å; F80-L84 HydrophobicContact CZ-CD2 4.14Å; F80-L84 HydrophobicContact CZ-CG 3.9Å; F80-L84 WeakPolarHBondContact O-CG 3.32Å; F80-L84 PolarHBondContact O-N 2.83Å; I81-L84 PolarHBondContact O-N 3.32Å; V82-L84 VanDerWaalsContact C-N 3.29Å; V82-L84 PolarHBondContact O-N 2.91Å; L84-A87 PolarHBondContact O-N 2.94Å; L84-Y88 VanDerWaalsContact O-CB 3.32Å; L84-Y88 WeakPolarHBondContact O-CB 3.14Å; L84-Y88 PolarHBondContact O-N 3.41Å
85	F	66.3	Low	65.3	Low	113 Å²	113	68 Å²	68	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-45	179.5	-101.4	-85	0	0	0	112	I81 V82 A87 Y88 Y89 F106	I81-F85 HydrophobicContact CG2-CD2 3.94Å; I81-F85 HydrophobicContact CG2-CE2 4.32Å; I81-F85 WeakPolarHBondContact O-CB 3.48Å; I81-F85 PolarHBondContact O-N 2.89Å; V82-F85 PolarHBondContact O-N 3.43Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 2.92Å; F85-Y88 PolarHBondContact O-N 3.35Å; F85-Y89 WeakPolarHBondContact O-CB 3.32Å; F85-Y89 PolarHBondContact O-N 3.5Å; F85-F106 HydrophobicContact CB-CE1 4.31Å; F85-F106 HydrophobicContact CB-CE2 3.85Å; F85-F106 HydrophobicContact CB-CZ 3.5Å; F85-F106 VanDerWaalsContact CB-CZ 3.5Å; F85-F106 HydrophobicContact CD1-CE2 4.37Å; F85-F106 HydrophobicContact CG-CE2 4.14Å; F85-F106 HydrophobicContact CG-CZ 4.27Å
86	T	69	Low	64.9	Low	20 Å²	20	71.6 Å²	71.6	12%	0.123	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-43.7	174.4	-61.7	0	0	0	0	110.7	V82 Y89 L90 Y103	V82-T86 VanDerWaalsContact O-CB 3.31Å; V82-T86 WeakPolarHBondContact O-CB 3.29Å; V82-T86 PolarHBondContact O-N 3.31Å; V82-T86 PolarHBondContact O-OG1 2.92Å; T86-Y89 PolarHBondContact O-N 3.28Å; T86-L90 HydrophobicContact CG2-CD1 3.88Å; T86-L90 HydrophobicContact CG2-CG 4.44Å; T86-L90 VanDerWaalsContact O-CB 3.27Å; T86-L90 WeakPolarHBondContact O-CB 3.29Å; T86-L90 VanDerWaalsContact O-CG 3.28Å; T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 3.48Å; T86-Y103 HydrophobicContact CG2-CE2 4.45Å
87	A	65.3	Low	64.6	Low	29 Å²	29	74.6 Å²	74.6	24%	0.24	39%	0.394	C	S	.	.	H	α-helix	trans	-63.4	-44	175.9	0	0	0	0	0	112.6	L41 S83 L84 F85 N91	L41-A87 HydrophobicContact CD1-CB 3.76Å; S83-A87 VanDerWaalsContact O-CB 3.25Å; S83-A87 WeakPolarHBondContact O-CB 3.34Å; S83-A87 PolarHBondContact O-N 2.81Å; L84-A87 PolarHBondContact O-N 2.94Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 2.92Å; A87-N91 WeakPolarHBondContact O-CB 3.33Å; A87-N91 PolarHBondContact O-N 2.92Å
88	Y	64.6	Low	64.2	Low	153 Å²	153	77.2 Å²	77.2	60%	0.6	40%	0.404	S	S	*	.	H	α-helix	trans	-62.9	-48.4	177.5	176.9	-95.9	0	0	0	110.9	L84 F85 N91 V92	L84-Y88 VanDerWaalsContact O-CB 3.32Å; L84-Y88 WeakPolarHBondContact O-CB 3.14Å; L84-Y88 PolarHBondContact O-N 3.41Å; F85-Y88 PolarHBondContact O-N 3.35Å; Y88-N91 WeakPolarHBondContact O-CB 3.34Å; Y88-N91 PolarHBondContact O-N 3.49Å; Y88-N91 VanDerWaalsContact O-N 3.16Å; Y88-V92 HydrophobicContact CD1-CG2 4.31Å; Y88-V92 HydrophobicContact CE1-CG2 3.87Å; Y88-V92 HydrophobicContact CE2-CG2 4.12Å; Y88-V92 WeakPolarHBondContact O-CG2 3.29Å; Y88-V92 PolarHBondContact O-N 3.46Å
89	Y	64.7	Low	63.7	Low	42 Å²	42	80 Å²	80	17%	0.165	43%	0.425	C	S	.	.	H	α-helix	trans	-63.2	-48	-178.7	-168.3	-86.1	0	0	0	111.5	F85 T86 N91 V92 H93 S100 Y103	F85-Y89 WeakPolarHBondContact O-CB 3.32Å; F85-Y89 PolarHBondContact O-N 3.5Å; T86-Y89 PolarHBondContact O-N 3.28Å; Y89-N91 VanDerWaalsContact C-N 3.28Å; Y89-N91 PolarHBondContact O-N 2.91Å; Y89-V92 PolarHBondContact O-N 3.23Å; Y89-H93 HydrophobicContact CD1-CB 4.35Å; Y89-H93 AromaticContact CD1-CD2 3.96Å; Y89-H93 AromaticContact CD2-CD2 3.7Å; Y89-H93 HydrophobicContact CE1-CB 3.9Å; Y89-H93 AromaticContact CE1-CD2 3.49Å; Y89-H93 VanDerWaalsContact CE1-CD2 3.49Å; Y89-H93 WeakPolarHBondContact CE1-CD2 3.32Å; Y89-H93 AromaticContact CE1-CG 3.74Å; Y89-H93 AromaticContact CE2-CD2 3.2Å; Y89-H93 WeakPolarHBondContact CE2-CD2 3.24Å; Y89-H93 AromaticContact CE2-NE2 3.3Å; Y89-H93 VanDerWaalsContact CE2-NE2 3.3Å; Y89-H93 WeakPolarHBondContact CE2-NE2 3.44Å; Y89-H93 AromaticContact CZ-CD2 3.06Å; Y89-H93 AromaticContact CZ-CG 3.6Å; Y89-H93 AromaticContact CZ-NE2 3.36Å; Y89-H93 WeakPolarHBondContact O-CB 3.46Å; Y89-H93 PolarHBondContact O-N 3.2Å; Y89-H93 PolarHBondContact OH-CD2 3.45Å; Y89-H93 VanDerWaalsContact OH-CD2 3.22Å; Y89-H93 PolarHBondContact OH-CE1 2.86Å; Y89-H93 PolarHBondContact OH-NE2 3.44Å; Y89-H93 VanDerWaalsContact OH-NE2 3.15Å; Y89-S100 VanDerWaalsContact OH-CB 3.28Å; Y89-S100 WeakPolarHBondContact OH-CB 3.39Å; Y89-S100 PolarHBondContact OH-OG 2.96Å; Y89-Y103 AromaticContact CD1-CD2 3.66Å; Y89-Y103 HydrophobicContact CD1-CD2 3.66Å; Y89-Y103 HydrophobicContact CD1-CG 4.31Å; Y89-Y103 AromaticContact CE1-CD2 3.95Å; Y89-Y103 HydrophobicContact CE1-CD2 3.95Å; Y89-Y103 HydrophobicContact CE1-CG 4.13Å; Y89-Y103 HydrophobicContact CG-CD2 4.41Å
90	L	65	Low	63.3	Low	47 Å²	47	79.7 Å²	79.7	25%	0.246	43%	0.427	C	S	.	.	H	α-helix	trans	-56.8	-43.3	172.6	-77.5	168.4	0	0	0	110.9	L30 Q31 T86 V92 D94	L30-L90 HydrophobicContact CB-CD1 4.42Å; Q31-L90 HydrophobicContact CG-CD2 4.49Å; T86-L90 HydrophobicContact CG2-CD1 3.88Å; T86-L90 HydrophobicContact CG2-CG 4.44Å; T86-L90 VanDerWaalsContact O-CB 3.27Å; T86-L90 WeakPolarHBondContact O-CB 3.29Å; T86-L90 VanDerWaalsContact O-CG 3.28Å; T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 3.48Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.22Å; L90-D94 WeakPolarHBondContact O-CB 3.37Å; L90-D94 PolarHBondContact O-N 3.29Å
91	N	64.8	Low	63.1	Low	97 Å²	97	82.7 Å²	82.7	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-30.3	179.8	-175.2	81.3	0	0	0	113.5	A87 Y88 Y89	A87-N91 WeakPolarHBondContact O-CB 3.33Å; A87-N91 PolarHBondContact O-N 2.92Å; Y88-N91 WeakPolarHBondContact O-CB 3.34Å; Y88-N91 PolarHBondContact O-N 3.49Å; Y88-N91 VanDerWaalsContact O-N 3.16Å; Y89-N91 VanDerWaalsContact C-N 3.28Å; Y89-N91 PolarHBondContact O-N 2.91Å
92	V	65.3	Low	63	Low	68 Å²	68	81.8 Å²	81.8	41%	0.412	45%	0.447	S	S	.	.	H	α-helix	trans	-81.6	-45.2	177.3	172.3	0	0	0	0	111.3	Y88 Y89 L90	Y88-V92 HydrophobicContact CD1-CG2 4.31Å; Y88-V92 HydrophobicContact CE1-CG2 3.87Å; Y88-V92 HydrophobicContact CE2-CG2 4.12Å; Y88-V92 WeakPolarHBondContact O-CG2 3.29Å; Y88-V92 PolarHBondContact O-N 3.46Å; Y89-V92 PolarHBondContact O-N 3.23Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.22Å
93	H	64.4	Low	62.9	Low	51 Å²	51	83.5 Å²	83.5	24%	0.236	45%	0.451	C	S	.	.	H	α-helix	trans	-90.9	-9.3	-173.2	-76.8	-84.4	0	0	0	115	Y89 K95 Q96	Y89-H93 HydrophobicContact CD1-CB 4.35Å; Y89-H93 AromaticContact CD1-CD2 3.96Å; Y89-H93 AromaticContact CD2-CD2 3.7Å; Y89-H93 HydrophobicContact CE1-CB 3.9Å; Y89-H93 AromaticContact CE1-CD2 3.49Å; Y89-H93 VanDerWaalsContact CE1-CD2 3.49Å; Y89-H93 WeakPolarHBondContact CE1-CD2 3.32Å; Y89-H93 AromaticContact CE1-CG 3.74Å; Y89-H93 AromaticContact CE2-CD2 3.2Å; Y89-H93 WeakPolarHBondContact CE2-CD2 3.24Å; Y89-H93 AromaticContact CE2-NE2 3.3Å; Y89-H93 VanDerWaalsContact CE2-NE2 3.3Å; Y89-H93 WeakPolarHBondContact CE2-NE2 3.44Å; Y89-H93 AromaticContact CZ-CD2 3.06Å; Y89-H93 AromaticContact CZ-CG 3.6Å; Y89-H93 AromaticContact CZ-NE2 3.36Å; Y89-H93 WeakPolarHBondContact O-CB 3.46Å; Y89-H93 PolarHBondContact O-N 3.2Å; Y89-H93 PolarHBondContact OH-CD2 3.45Å; Y89-H93 VanDerWaalsContact OH-CD2 3.22Å; Y89-H93 PolarHBondContact OH-CE1 2.86Å; Y89-H93 PolarHBondContact OH-NE2 3.44Å; Y89-H93 VanDerWaalsContact OH-NE2 3.15Å; H93-K95 PolarHBondContact O-N 2.94Å; H93-Q96 CarbonylContact O-C 3.51Å; H93-Q96 PolarHBondContact O-N 3.46Å
94	D	58.4	Low	62.8	Low	83 Å²	83	88.2 Å²	88.2	44%	0.444	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-16.3	174	173.6	65.4	0	0	0	113.8	K34 L90	K34-D94 WeakPolarHBondContact CD-OD2 3.34Å; K34-D94 WeakPolarHBondContact CE-OD1 3.38Å; K34-D94 WeakPolarHBondContact CE-OD2 3.3Å; K34-D94 IonicContact NZ-OD1 2.98Å; K34-D94 PolarHBondContact NZ-OD1 3.42Å; K34-D94 IonicContact NZ-OD2 2.66Å; K34-D94 PolarHBondContact NZ-OD2 3.33Å; L90-D94 WeakPolarHBondContact O-CB 3.37Å; L90-D94 PolarHBondContact O-N 3.29Å
95	K	59.8	Low	63	Low	195 Å²	195	89.8 Å²	89.8	85%	0.848	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-19	174.1	-70	-162.7	176.9	-175.6	0	115.2	H93	H93-K95 PolarHBondContact O-N 2.94Å
96	Q	57	Low	63	Low	124 Å²	124	87.2 Å²	87.2	58%	0.579	47%	0.465	S	S	*	.	S	Bend	trans	-115.1	110.9	179.6	-89.1	164	-19.3	0	0	107.4	H93 D98	H93-Q96 CarbonylContact O-C 3.51Å; H93-Q96 PolarHBondContact O-N 3.46Å; Q96-D98 PolarHBondContact O-N 3.06Å
97	G	56.3	Low	63	Low	86 Å²	86	88.6 Å²	88.6	89%	0.887	47%	0.473	S	S	*	.	S	Bend	trans	-57.8	2.6	176.3	0	0	0	0	0	115.1	C99	G97-C99 PolarHBondContact O-N 3.37Å; G97-C99 VanDerWaalsContact O-N 3.17Å
98	D	57.8	Low	63.2	Low	119 Å²	119	94.7 Å²	94.7	64%	0.636	49%	0.491	S	S	*	.			trans	-80.2	90	168.3	-58.1	-36.7	0	0	0	108.4	Q96 S100	Q96-D98 PolarHBondContact O-N 3.06Å; D98-S100 PolarHBondContact O-N 2.89Å
99	C	56.2	Low	63.5	Low	97 Å²	97	91 Å²	91	66%	0.655	48%	0.48	S	S	*	.			trans	-58	87.7	161.5	-161	0	0	0	0	107.1	G97	G97-C99 PolarHBondContact O-N 3.37Å; G97-C99 VanDerWaalsContact O-N 3.17Å
100	S	61.1	Low	63.7	Low	28 Å²	28	90.7 Å²	90.7	20%	0.196	48%	0.479	C	S	.	.			trans	-71.6	146	-162.7	100.8	0	0	0	0	110	Y89 D98 S102 Y103	Y89-S100 VanDerWaalsContact OH-CB 3.28Å; Y89-S100 WeakPolarHBondContact OH-CB 3.39Å; Y89-S100 PolarHBondContact OH-OG 2.96Å; D98-S100 PolarHBondContact O-N 2.89Å; S100-S102 PolarHBondContact O-N 3.49Å; S100-S102 VanDerWaalsContact OG-CB 3.25Å; S100-S102 WeakPolarHBondContact OG-CB 3.49Å; S100-S102 PolarHBondContact OG-N 3.44Å; S100-S102 PolarHBondContact OG-OG 3.14Å; S100-Y103 WeakPolarHBondContact O-CB 3.49Å; S100-Y103 PolarHBondContact O-N 3.19Å
101	I	63.6	Low	63.9	Low	146 Å²	146	93.9 Å²	93.9	75%	0.749	49%	0.493	S	S	*	.	H	α-helix	trans	-43.2	-31.5	172.9	-68.2	163.2	0	0	0	112	Y103 L104 F105	I101-Y103 VanDerWaalsContact C-N 3.35Å; I101-Y103 PolarHBondContact O-N 2.94Å; I101-L104 WeakPolarHBondContact O-CB 3.46Å; I101-L104 PolarHBondContact O-N 3.48Å; I101-L104 VanDerWaalsContact O-N 3.16Å; I101-F105 WeakPolarHBondContact O-CB 3.07Å; I101-F105 PolarHBondContact O-N 2.95Å
102	S	62.4	Low	63.9	Low	73 Å²	73	91.9 Å²	91.9	51%	0.51	49%	0.486	S	S	.	.	H	α-helix	trans	-60	-37.5	176.1	-48.1	0	0	0	0	113.7	S100 F105 F106	S100-S102 PolarHBondContact O-N 3.49Å; S100-S102 VanDerWaalsContact OG-CB 3.25Å; S100-S102 WeakPolarHBondContact OG-CB 3.49Å; S100-S102 PolarHBondContact OG-N 3.44Å; S100-S102 PolarHBondContact OG-OG 3.14Å; S102-F105 PolarHBondContact O-N 3.31Å; S102-F106 VanDerWaalsContact O-CB 3.29Å; S102-F106 WeakPolarHBondContact O-CB 3.35Å; S102-F106 PolarHBondContact O-N 2.87Å
103	Y	66.5	Low	64.1	Low	57 Å²	57	92.1 Å²	92.1	22%	0.224	48%	0.484	C	S	.	.	H	α-helix	trans	-64.8	-43.7	174.1	-178.1	-103.9	0	0	0	111	T86 Y89 S100 I101 F105 F106 V107	T86-Y103 HydrophobicContact CG2-CE2 4.45Å; Y89-Y103 AromaticContact CD1-CD2 3.66Å; Y89-Y103 HydrophobicContact CD1-CD2 3.66Å; Y89-Y103 HydrophobicContact CD1-CG 4.31Å; Y89-Y103 AromaticContact CE1-CD2 3.95Å; Y89-Y103 HydrophobicContact CE1-CD2 3.95Å; Y89-Y103 HydrophobicContact CE1-CG 4.13Å; Y89-Y103 HydrophobicContact CG-CD2 4.41Å; S100-Y103 WeakPolarHBondContact O-CB 3.49Å; S100-Y103 PolarHBondContact O-N 3.19Å; I101-Y103 VanDerWaalsContact C-N 3.35Å; I101-Y103 PolarHBondContact O-N 2.94Å; Y103-F105 VanDerWaalsContact C-N 3.33Å; Y103-F105 PolarHBondContact O-N 3.46Å; Y103-F106 WeakPolarHBondContact O-CB 3.46Å; Y103-F106 PolarHBondContact O-N 2.72Å; Y103-V107 HydrophobicContact CD1-CG2 4.08Å; Y103-V107 HydrophobicContact CE1-CG2 3.62Å; Y103-V107 HydrophobicContact CE2-CG2 4.1Å; Y103-V107 WeakPolarHBondContact O-CG2 3.41Å; Y103-V107 PolarHBondContact O-N 2.85Å
104	L	65.5	Low	64.3	Low	134 Å²	134	90.5 Å²	90.5	70%	0.702	48%	0.48	S	S	*	.	H	α-helix	trans	-64.2	-42.2	179.8	-145.6	129.9	0	0	0	110.6	I101 F106 V107 W108	I101-L104 WeakPolarHBondContact O-CB 3.46Å; I101-L104 PolarHBondContact O-N 3.48Å; I101-L104 VanDerWaalsContact O-N 3.16Å; L104-F106 VanDerWaalsContact C-N 3.34Å; L104-F106 PolarHBondContact O-N 2.9Å; L104-V107 PolarHBondContact O-N 2.96Å; L104-W108 VanDerWaalsContact O-CB 3.28Å; L104-W108 WeakPolarHBondContact O-CB 3.38Å; L104-W108 PolarHBondContact O-N 3.2Å
105	F	68.6	Low	64.8	Low	123 Å²	123	92.8 Å²	92.8	54%	0.539	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-38.8	174.1	-152.3	-98.6	0	0	0	112.1	I101 S102 Y103 W108 I109	I101-F105 WeakPolarHBondContact O-CB 3.07Å; I101-F105 PolarHBondContact O-N 2.95Å; S102-F105 PolarHBondContact O-N 3.31Å; Y103-F105 VanDerWaalsContact C-N 3.33Å; Y103-F105 PolarHBondContact O-N 3.46Å; F105-W108 PolarHBondContact O-N 3.44Å; F105-I109 HydrophobicContact CD1-CD1 3.61Å; F105-I109 HydrophobicContact CD1-CG1 4.21Å; F105-I109 HydrophobicContact CE1-CD1 3.61Å; F105-I109 HydrophobicContact CE1-CG1 4.24Å; F105-I109 WeakPolarHBondContact O-CG1 3.46Å; F105-I109 PolarHBondContact O-N 3.36Å
106	F	66.9	Low	65.2	Low	59 Å²	59	87.6 Å²	87.6	26%	0.259	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-48.3	176.5	178.4	-96.1	0	0	0	112.3	V82 F85 S102 Y103 L104 W108 I109 Y110	V82-F106 HydrophobicContact CG1-CE1 4.11Å; V82-F106 HydrophobicContact CG1-CZ 4.26Å; V82-F106 HydrophobicContact CG2-CZ 4.45Å; F85-F106 HydrophobicContact CB-CE1 4.31Å; F85-F106 HydrophobicContact CB-CE2 3.85Å; F85-F106 HydrophobicContact CB-CZ 3.5Å; F85-F106 VanDerWaalsContact CB-CZ 3.5Å; F85-F106 HydrophobicContact CD1-CE2 4.37Å; F85-F106 HydrophobicContact CG-CE2 4.14Å; F85-F106 HydrophobicContact CG-CZ 4.27Å; S102-F106 VanDerWaalsContact O-CB 3.29Å; S102-F106 WeakPolarHBondContact O-CB 3.35Å; S102-F106 PolarHBondContact O-N 2.87Å; Y103-F106 WeakPolarHBondContact O-CB 3.46Å; Y103-F106 PolarHBondContact O-N 2.72Å; L104-F106 VanDerWaalsContact C-N 3.34Å; L104-F106 PolarHBondContact O-N 2.9Å; F106-W108 PolarHBondContact O-N 3.47Å; F106-I109 PolarHBondContact O-N 3.01Å; F106-Y110 WeakPolarHBondContact O-CB 3.42Å; F106-Y110 PolarHBondContact O-N 2.93Å
107	V	69.8	Low	65.8	Low	49 Å²	49	83.1 Å²	83.1	30%	0.297	45%	0.45	S	S	.	.	H	α-helix	trans	-59.5	-40.3	175	173.3	0	0	0	0	110.4	Y103 L104 Y110 E111	Y103-V107 HydrophobicContact CD1-CG2 4.08Å; Y103-V107 HydrophobicContact CE1-CG2 3.62Å; Y103-V107 HydrophobicContact CE2-CG2 4.1Å; Y103-V107 WeakPolarHBondContact O-CG2 3.41Å; Y103-V107 PolarHBondContact O-N 2.85Å; L104-V107 PolarHBondContact O-N 2.96Å; V107-Y110 WeakPolarHBondContact O-CB 3.47Å; V107-Y110 PolarHBondContact O-N 3.23Å; V107-E111 PolarHBondContact O-N 2.96Å
108	W	69.1	Low	66.5	Low	158 Å²	158	82.4 Å²	82.4	60%	0.598	43%	0.425	S	S	*	.	H	α-helix	trans	-64.9	-48	178.3	-169.9	70.2	0	0	0	112.8	L104 F105 F106 Y110 E111 C112	L104-W108 VanDerWaalsContact O-CB 3.28Å; L104-W108 WeakPolarHBondContact O-CB 3.38Å; L104-W108 PolarHBondContact O-N 3.2Å; F105-W108 PolarHBondContact O-N 3.44Å; F106-W108 PolarHBondContact O-N 3.47Å; W108-Y110 VanDerWaalsContact C-N 3.25Å; W108-Y110 PolarHBondContact O-N 3.41Å; W108-E111 PolarHBondContact O-N 3.29Å; W108-C112 PolarHBondContact O-N 3.49Å; W108-C112 PolarHBondContact O-SG 2.89Å
109	I	69.9	Low	67.1	Low	74 Å²	74	80 Å²	80	38%	0.379	41%	0.412	S	S	.	.	H	α-helix	trans	-58.5	-41.7	173.6	-71.9	173.9	0	0	0	110.6	F105 F106 C112 I113	F105-I109 HydrophobicContact CD1-CD1 3.61Å; F105-I109 HydrophobicContact CD1-CG1 4.21Å; F105-I109 HydrophobicContact CE1-CD1 3.61Å; F105-I109 HydrophobicContact CE1-CG1 4.24Å; F105-I109 WeakPolarHBondContact O-CG1 3.46Å; F105-I109 PolarHBondContact O-N 3.36Å; F106-I109 PolarHBondContact O-N 3.01Å; I109-C112 WeakPolarHBondContact O-CB 3.19Å; I109-C112 PolarHBondContact O-N 3.42Å; I109-I113 HydrophobicContact CG2-CD1 3.72Å; I109-I113 HydrophobicContact CG2-CG1 4.32Å; I109-I113 WeakPolarHBondContact O-CG1 3.4Å; I109-I113 PolarHBondContact O-N 3.29Å
110	Y	68.5	Low	67.6	Low	37 Å²	37	80.8 Å²	80.8	15%	0.145	41%	0.406	C	S	.	.	H	α-helix	trans	-60.4	-47.7	176.9	165.2	-101.6	0	0	0	112	M79 V82 F106 V107 W108 C112 I113 A114	M79-Y110 HydrophobicContact SD-CE2 3.98Å; M79-Y110 PolarHBondContact SD-OH 2.89Å; V82-Y110 HydrophobicContact CB-CD2 4.07Å; V82-Y110 HydrophobicContact CB-CE2 4.18Å; V82-Y110 HydrophobicContact CG1-CD2 3.72Å; V82-Y110 HydrophobicContact CG1-CE2 3.88Å; V82-Y110 HydrophobicContact CG1-CG 4.16Å; V82-Y110 HydrophobicContact CG2-CD2 3.35Å; V82-Y110 HydrophobicContact CG2-CE2 3.78Å; V82-Y110 HydrophobicContact CG2-CG 4.31Å; F106-Y110 WeakPolarHBondContact O-CB 3.42Å; F106-Y110 PolarHBondContact O-N 2.93Å; V107-Y110 WeakPolarHBondContact O-CB 3.47Å; V107-Y110 PolarHBondContact O-N 3.23Å; W108-Y110 VanDerWaalsContact C-N 3.25Å; W108-Y110 PolarHBondContact O-N 3.41Å; Y110-C112 VanDerWaalsContact C-N 3.28Å; Y110-C112 PolarHBondContact O-N 3.48Å; Y110-I113 PolarHBondContact O-N 3.11Å; Y110-A114 WeakPolarHBondContact O-CB 3.46Å; Y110-A114 PolarHBondContact O-N 3.45Å
111	E	69.2	Low	67.9	Low	113 Å²	113	81.4 Å²	81.4	53%	0.528	41%	0.405	S	S	.	.	H	α-helix	trans	-61	-39.8	176.4	-72.3	-146	164.5	0	0	111.5	V107 W108 A114 F115	V107-E111 PolarHBondContact O-N 2.96Å; W108-E111 PolarHBondContact O-N 3.29Å; E111-A114 PolarHBondContact O-N 3.42Å; E111-F115 WeakPolarHBondContact O-CB 3.37Å; E111-F115 PolarHBondContact O-N 3.39Å
112	C	65.3	Low	68.1	Low	55 Å²	55	78.2 Å²	78.2	37%	0.372	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-45.7	173.6	-71.1	0	0	0	0	112.3	W108 I109 Y110 F115 V116	W108-C112 PolarHBondContact O-N 3.49Å; W108-C112 PolarHBondContact O-SG 2.89Å; I109-C112 WeakPolarHBondContact O-CB 3.19Å; I109-C112 PolarHBondContact O-N 3.42Å; Y110-C112 VanDerWaalsContact C-N 3.28Å; Y110-C112 PolarHBondContact O-N 3.48Å; C112-F115 PolarHBondContact O-N 3.01Å; C112-V116 VanDerWaalsContact O-CG2 3.27Å; C112-V116 WeakPolarHBondContact O-CG2 3.26Å; C112-V116 PolarHBondContact O-N 3.2Å
113	I	69	Low	68.3	Low	73 Å²	73	79.2 Å²	79.2	37%	0.374	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-47.4	178.6	-68.5	169.3	0	0	0	110.6	I78 I109 Y110 F115 V116 I117	I78-I113 HydrophobicContact CD1-CG2 4.07Å; I78-I113 HydrophobicContact CG2-CG2 3.99Å; I109-I113 HydrophobicContact CG2-CD1 3.72Å; I109-I113 HydrophobicContact CG2-CG1 4.32Å; I109-I113 WeakPolarHBondContact O-CG1 3.4Å; I109-I113 PolarHBondContact O-N 3.29Å; Y110-I113 PolarHBondContact O-N 3.11Å; I113-F115 VanDerWaalsContact C-N 3.28Å; I113-F115 PolarHBondContact O-N 2.99Å; I113-V116 PolarHBondContact O-N 3.43Å; I113-I117 HydrophobicContact CG2-CD1 3.84Å; I113-I117 HydrophobicContact CG2-CG1 4.5Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 2.98Å; I113-I117 PolarHBondContact O-N 2.72Å
114	A	70.6	Confident	68.1	Low	18 Å²	18	78.9 Å²	78.9	15%	0.149	39%	0.39	C	S	.	.	H	α-helix	trans	-58.5	-43.1	177	0	0	0	0	0	111	Y110 E111 I117 I118	Y110-A114 WeakPolarHBondContact O-CB 3.46Å; Y110-A114 PolarHBondContact O-N 3.45Å; E111-A114 PolarHBondContact O-N 3.42Å; A114-I117 PolarHBondContact O-N 3.12Å; A114-I118 VanDerWaalsContact O-CG1 3.24Å; A114-I118 WeakPolarHBondContact O-CG1 3.44Å; A114-I118 PolarHBondContact O-N 3.26Å
115	F	67.1	Low	68	Low	130 Å²	130	73.4 Å²	73.4	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-61.9	-44.5	175.9	-176.6	-106.6	0	0	0	112.3	E111 C112 I113 I117 I118 L119	E111-F115 WeakPolarHBondContact O-CB 3.37Å; E111-F115 PolarHBondContact O-N 3.39Å; C112-F115 PolarHBondContact O-N 3.01Å; I113-F115 VanDerWaalsContact C-N 3.28Å; I113-F115 PolarHBondContact O-N 2.99Å; F115-I117 VanDerWaalsContact C-N 3.34Å; F115-I117 PolarHBondContact O-N 3.21Å; F115-I118 PolarHBondContact O-N 3.25Å; F115-L119 HydrophobicContact CD1-CD1 3.69Å; F115-L119 HydrophobicContact CE1-CD1 3.2Å; F115-L119 HydrophobicContact CE1-CG 4.25Å; F115-L119 HydrophobicContact CE2-CD1 4.46Å; F115-L119 HydrophobicContact CZ-CD1 3.64Å; F115-L119 HydrophobicContact CZ-CG 4.3Å; F115-L119 WeakPolarHBondContact O-CB 3.25Å; F115-L119 PolarHBondContact O-N 3.42Å
116	V	69.7	Low	67.6	Low	86 Å²	86	73.9 Å²	73.9	52%	0.521	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-42.5	176.3	169.6	0	0	0	0	111.4	C112 I113 L119 Q120	C112-V116 VanDerWaalsContact O-CG2 3.27Å; C112-V116 WeakPolarHBondContact O-CG2 3.26Å; C112-V116 PolarHBondContact O-N 3.2Å; I113-V116 PolarHBondContact O-N 3.43Å; V116-L119 WeakPolarHBondContact O-CB 3.14Å; V116-L119 PolarHBondContact O-N 3.43Å; V116-Q120 WeakPolarHBondContact O-CB 3.21Å; V116-Q120 PolarHBondContact O-N 2.9Å
117	I	68.3	Low	67.1	Low	30 Å²	30	76 Å²	76	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-45.3	177.3	-66	163.6	0	0	0	110.7	C75 I78 I113 A114 F115 L119 Q120 F121	C75-I117 HydrophobicContact CB-CG2 4.3Å; I78-I117 HydrophobicContact CD1-CD1 3.47Å; I78-I117 VanDerWaalsContact CD1-CD1 3.47Å; I113-I117 HydrophobicContact CG2-CD1 3.84Å; I113-I117 HydrophobicContact CG2-CG1 4.5Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 2.98Å; I113-I117 PolarHBondContact O-N 2.72Å; A114-I117 PolarHBondContact O-N 3.12Å; F115-I117 VanDerWaalsContact C-N 3.34Å; F115-I117 PolarHBondContact O-N 3.21Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.89Å; I117-Q120 PolarHBondContact O-N 3.12Å; I117-F121 PolarHBondContact O-N 2.74Å
118	I	71.7	Confident	66.4	Low	72 Å²	72	77.1 Å²	77.1	37%	0.369	38%	0.382	S	S	.	.	H	α-helix	trans	-61.2	-44.5	177.2	-69.2	165.4	0	0	0	110.2	A114 F115 Q120 F121 I122	A114-I118 VanDerWaalsContact O-CG1 3.24Å; A114-I118 WeakPolarHBondContact O-CG1 3.44Å; A114-I118 PolarHBondContact O-N 3.26Å; F115-I118 PolarHBondContact O-N 3.25Å; I118-Q120 VanDerWaalsContact C-N 3.33Å; I118-Q120 PolarHBondContact O-N 3.22Å; I118-F121 WeakPolarHBondContact O-CB 3.35Å; I118-F121 PolarHBondContact O-N 3.43Å; I118-I122 HydrophobicContact CG2-CD1 3.78Å; I118-I122 HydrophobicContact CG2-CG1 4.43Å; I118-I122 VanDerWaalsContact O-CG1 3.29Å; I118-I122 WeakPolarHBondContact O-CG1 3.49Å; I118-I122 PolarHBondContact O-N 3.1Å
119	L	69.5	Low	65.7	Low	67 Å²	67	71.2 Å²	71.2	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-58.1	-45.4	174.5	-102	163.3	0	0	0	111.8	F115 V116 I117 F121 I122 L123	F115-L119 HydrophobicContact CD1-CD1 3.69Å; F115-L119 HydrophobicContact CE1-CD1 3.2Å; F115-L119 HydrophobicContact CE1-CG 4.25Å; F115-L119 HydrophobicContact CE2-CD1 4.46Å; F115-L119 HydrophobicContact CZ-CD1 3.64Å; F115-L119 HydrophobicContact CZ-CG 4.3Å; F115-L119 WeakPolarHBondContact O-CB 3.25Å; F115-L119 PolarHBondContact O-N 3.42Å; V116-L119 WeakPolarHBondContact O-CB 3.14Å; V116-L119 PolarHBondContact O-N 3.43Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.89Å; L119-F121 VanDerWaalsContact C-N 3.3Å; L119-F121 PolarHBondContact O-N 3.19Å; L119-I122 PolarHBondContact O-N 3.42Å; L119-L123 HydrophobicContact CD2-CD1 4.4Å; L119-L123 WeakPolarHBondContact O-CB 3.38Å; L119-L123 VanDerWaalsContact O-CG 3.27Å; L119-L123 WeakPolarHBondContact O-CG 2.93Å; L119-L123 PolarHBondContact O-N 2.93Å
120	Q	67	Low	64.9	Low	114 Å²	114	74.9 Å²	74.9	53%	0.533	38%	0.38	S	S	.	.	H	α-helix	trans	-64.6	-37.5	178.9	-165.8	162.4	19.1	0	0	111.5	V116 I117 I118 L123 N124	V116-Q120 WeakPolarHBondContact O-CB 3.21Å; V116-Q120 PolarHBondContact O-N 2.9Å; I117-Q120 PolarHBondContact O-N 3.12Å; I118-Q120 VanDerWaalsContact C-N 3.33Å; I118-Q120 PolarHBondContact O-N 3.22Å; Q120-L123 PolarHBondContact O-N 3.37Å; Q120-N124 VanDerWaalsContact O-CB 3.3Å; Q120-N124 WeakPolarHBondContact O-CB 3.22Å; Q120-N124 VanDerWaalsContact O-CG 3.28Å; Q120-N124 PolarHBondContact O-N 3.29Å
121	F	68.1	Low	63.9	Low	41 Å²	41	76.7 Å²	76.7	18%	0.18	40%	0.398	C	S	.	.	H	α-helix	trans	-64.1	-46.2	174.2	-161.3	-89.3	0	0	0	111.9	Q68 W72 I117 I118 L119 S125	Q68-F121 HydrophobicContact CG-CE2 3.63Å; Q68-F121 HydrophobicContact CG-CZ 3.85Å; W72-F121 AromaticContact CD1-CE2 3.82Å; W72-F121 AromaticContact NE1-CE2 3.44Å; W72-F121 AromaticContact NE1-CZ 3.85Å; I117-F121 PolarHBondContact O-N 2.74Å; I118-F121 WeakPolarHBondContact O-CB 3.35Å; I118-F121 PolarHBondContact O-N 3.43Å; L119-F121 VanDerWaalsContact C-N 3.3Å; L119-F121 PolarHBondContact O-N 3.19Å; F121-S125 WeakPolarHBondContact O-CB 3.23Å; F121-S125 PolarHBondContact O-N 3.47Å; F121-S125 PolarHBondContact O-OG 3.14Å; F121-S125 VanDerWaalsContact O-OG 3.11Å
122	I	68.5	Low	62.9	Low	79 Å²	79	76.8 Å²	76.8	41%	0.405	40%	0.402	S	S	.	.	H	α-helix	trans	-61.7	-47	176.8	-68.7	168.2	0	0	0	110.3	I118 L119 S125 F126	I118-I122 HydrophobicContact CG2-CD1 3.78Å; I118-I122 HydrophobicContact CG2-CG1 4.43Å; I118-I122 VanDerWaalsContact O-CG1 3.29Å; I118-I122 WeakPolarHBondContact O-CG1 3.49Å; I118-I122 PolarHBondContact O-N 3.1Å; L119-I122 PolarHBondContact O-N 3.42Å; I122-S125 VanDerWaalsContact O-CB 3.26Å; I122-S125 WeakPolarHBondContact O-CB 3.47Å; I122-S125 PolarHBondContact O-N 3.35Å; I122-F126 HydrophobicContact CG2-CD2 3.71Å; I122-F126 HydrophobicContact CG2-CE2 3.68Å; I122-F126 WeakPolarHBondContact O-CD2 3.43Å; I122-F126 PolarHBondContact O-N 2.72Å
123	L	66.1	Low	62.1	Low	95 Å²	95	77.3 Å²	77.3	50%	0.497	42%	0.417	S	S	.	.	H	α-helix	trans	-66.3	-45.6	-178.7	-73.8	170.1	0	0	0	112.3	L119 Q120 S125 F126 I127	L119-L123 HydrophobicContact CD2-CD1 4.4Å; L119-L123 WeakPolarHBondContact O-CB 3.38Å; L119-L123 VanDerWaalsContact O-CG 3.27Å; L119-L123 WeakPolarHBondContact O-CG 2.93Å; L119-L123 PolarHBondContact O-N 2.93Å; Q120-L123 PolarHBondContact O-N 3.37Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 3.1Å; L123-F126 WeakPolarHBondContact O-CA 3.23Å; L123-F126 WeakPolarHBondContact O-CB 2.91Å; L123-F126 PolarHBondContact O-N 3.02Å; L123-I127 WeakPolarHBondContact O-CG1 3.42Å; L123-I127 PolarHBondContact O-N 3.05Å
124	N	61.8	Low	61.2	Low	50 Å²	50	77 Å²	77	27%	0.267	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-43.9	175.3	-76.5	-7.2	0	0	0	111	Q120 F126 I127 D128	Q120-N124 VanDerWaalsContact O-CB 3.3Å; Q120-N124 WeakPolarHBondContact O-CB 3.22Å; Q120-N124 VanDerWaalsContact O-CG 3.28Å; Q120-N124 PolarHBondContact O-N 3.29Å; N124-F126 PolarHBondContact O-N 3.26Å; N124-I127 PolarHBondContact O-N 3.43Å; N124-D128 PolarHBondContact O-N 3.09Å
125	S	64.3	Low	59.9	Low	19 Å²	19	82.3 Å²	82.3	13%	0.133	45%	0.447	C	S	.	.	H	α-helix	trans	-55.4	-38.5	171.8	-85.9	0	0	0	0	112.7	K9 F121 I122 L123 C129	K9-S125 WeakPolarHBondContact CE-O 3.37Å; K9-S125 PolarHBondContact NZ-O 3.38Å; F121-S125 WeakPolarHBondContact O-CB 3.23Å; F121-S125 PolarHBondContact O-N 3.47Å; F121-S125 PolarHBondContact O-OG 3.14Å; F121-S125 VanDerWaalsContact O-OG 3.11Å; I122-S125 VanDerWaalsContact O-CB 3.26Å; I122-S125 WeakPolarHBondContact O-CB 3.47Å; I122-S125 PolarHBondContact O-N 3.35Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 3.1Å; S125-C129 PolarHBondContact O-N 3.39Å; S125-C129 PolarHBondContact O-SG 3.18Å; S125-C129 VanDerWaalsContact O-SG 3.38Å
126	F	58.4	Low	59.1	Low	132 Å²	132	80.5 Å²	80.5	58%	0.579	45%	0.449	S	S	*	.	H	α-helix	trans	-71.4	-42.7	176.2	-91.8	-73.8	0	0	0	112.7	I122 L123 N124 C129 H130	I122-F126 HydrophobicContact CG2-CD2 3.71Å; I122-F126 HydrophobicContact CG2-CE2 3.68Å; I122-F126 WeakPolarHBondContact O-CD2 3.43Å; I122-F126 PolarHBondContact O-N 2.72Å; L123-F126 WeakPolarHBondContact O-CA 3.23Å; L123-F126 WeakPolarHBondContact O-CB 2.91Å; L123-F126 PolarHBondContact O-N 3.02Å; N124-F126 PolarHBondContact O-N 3.26Å; F126-C129 WeakPolarHBondContact O-CB 3.33Å; F126-C129 PolarHBondContact O-N 3.43Å; F126-H130 PolarHBondContact O-N 3.34Å; F126-H130 VanDerWaalsContact O-N 3.12Å
127	I	57.7	Low	58	Low	105 Å²	105	83.3 Å²	83.3	54%	0.538	46%	0.46	S	S	.	.	H	α-helix	trans	-62.8	-45.3	-179.9	-67.1	166.2	0	0	0	110.7	L123 N124 C129 H130 S131	L123-I127 WeakPolarHBondContact O-CG1 3.42Å; L123-I127 PolarHBondContact O-N 3.05Å; N124-I127 PolarHBondContact O-N 3.43Å; I127-C129 PolarHBondContact O-N 3.46Å; I127-H130 PolarHBondContact O-N 2.85Å; I127-S131 PolarHBondContact O-N 3.14Å
128	D	55.5	Low	56.8	Low	72 Å²	72	90.6 Å²	90.6	39%	0.385	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-34.6	177.2	-79.9	-9.6	0	0	0	112.1	H65 N124 N132	H65-D128 IonicContact CE1-OD2 3.98Å; H65-D128 IonicContact ND1-OD2 3.88Å; N124-D128 PolarHBondContact O-N 3.09Å; D128-N132 PolarHBondContact O-N 3.32Å
129	C	53.8	Low	55.4	Low	34 Å²	34	93 Å²	93	23%	0.23	52%	0.515	C	S	.	.	H	α-helix	trans	-67.8	-35.9	175	-79	0	0	0	0	112.7	K9 S125 F126 I127 G133	K9-C129 VanDerWaalsContact CE-SG 3.53Å; K9-C129 PolarHBondContact NZ-SG 3.49Å; S125-C129 PolarHBondContact O-N 3.39Å; S125-C129 PolarHBondContact O-SG 3.18Å; S125-C129 VanDerWaalsContact O-SG 3.38Å; F126-C129 WeakPolarHBondContact O-CB 3.33Å; F126-C129 PolarHBondContact O-N 3.43Å; I127-C129 PolarHBondContact O-N 3.46Å; C129-G133 PolarHBondContact O-N 3.22Å
130	H	52.1	Low	54	Low	151 Å²	151	98.3 Å²	98.3	70%	0.699	54%	0.539	S	S	*	.	H	α-helix	trans	-78.7	-38.9	-179.4	-155	-70.9	0	0	0	111.8	F126 I127 N132 G133 S134	F126-H130 PolarHBondContact O-N 3.34Å; F126-H130 VanDerWaalsContact O-N 3.12Å; I127-H130 PolarHBondContact O-N 2.85Å; H130-N132 VanDerWaalsContact C-N 3.34Å; H130-N132 PolarHBondContact O-N 3.4Å; H130-G133 PolarHBondContact O-N 3.2Å; H130-G133 VanDerWaalsContact O-N 3.1Å; H130-S134 PolarHBondContact O-N 3.38Å
131	S	48.8	Very low	53	Low	75 Å²	75	101 Å²	101	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-35.6	179.6	-167.1	0	0	0	0	112.7	I127 G133 S134	I127-S131 PolarHBondContact O-N 3.14Å; S131-G133 VanDerWaalsContact C-N 3.34Å; S131-S134 PolarHBondContact O-OG 3.37Å; S131-S134 VanDerWaalsContact O-OG 3.1Å
132	N	47.2	Very low	51.8	Low	114 Å²	114	108 Å²	108	61%	0.61	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-16.1	174.5	-96.4	7.3	0	0	0	113.8	D128 H130	D128-N132 PolarHBondContact O-N 3.32Å; H130-N132 VanDerWaalsContact C-N 3.34Å; H130-N132 PolarHBondContact O-N 3.4Å
133	G	49.7	Very low	50.5	Low	66 Å²	66	113.1 Å²	113.1	68%	0.68	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-23	174	0	0	0	0	0	113.1	C129 H130 S131 N135	C129-G133 PolarHBondContact O-N 3.22Å; H130-G133 PolarHBondContact O-N 3.2Å; H130-G133 VanDerWaalsContact O-N 3.1Å; S131-G133 VanDerWaalsContact C-N 3.34Å; G133-N135 PolarHBondContact O-N 3.31Å
134	S	49.2	Very low	49.3	Very low	68 Å²	68	120.2 Å²	120.2	48%	0.476	65%	0.65	S	S	.	*			trans	-97.1	49.6	-178.5	60.7	0	0	0	0	112.8	H130 S131 P136	H130-S134 PolarHBondContact O-N 3.38Å; S131-S134 PolarHBondContact O-OG 3.37Å; S131-S134 VanDerWaalsContact O-OG 3.1Å; S134-P136 WeakPolarHBondContact O-CD 3.02Å
135	N	43.9	Very low	48.7	Very low	128 Å²	128	123.7 Å²	123.7	68%	0.684	67%	0.669	S	S	*	*			trans	-93.4	87.1	158.5	-99.4	-5.2	0	0	0	108.7	G133 N137	G133-N135 PolarHBondContact O-N 3.31Å; N135-N137 PolarHBondContact O-N 3.13Å
136	P	50.4	Low	47.8	Very low	93 Å²	93	129.2 Å²	129.2	60%	0.604	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-2.9	173.4	28.6	-34.8	0	0	0	113.7	S134 M138 T139	S134-P136 WeakPolarHBondContact O-CD 3.02Å; P136-M138 PolarHBondContact O-N 3.41Å; P136-M138 VanDerWaalsContact O-N 3.13Å; P136-T139 PolarHBondContact O-OG1 3.06Å; P136-T139 VanDerWaalsContact O-OG1 3.06Å
137	N	45.7	Very low	47.3	Very low	144 Å²	144	129.1 Å²	129.1	77%	0.77	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	7.4	-177	-76	7.8	0	0	0	115.1	N135 T139	N135-N137 PolarHBondContact O-N 3.13Å; N137-T139 PolarHBondContact O-N 3.22Å
138	M	44	Very low	46.6	Very low	184 Å²	184	130.5 Å²	130.5	91%	0.906	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	30.6	169.5	-149.3	164.9	-160.3	0	0	112.8	P136	P136-M138 PolarHBondContact O-N 3.41Å; P136-M138 VanDerWaalsContact O-N 3.13Å
139	T	41.4	Very low	46.1	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	13.7	172.7	50.1	0	0	0	0	114.6	P136 N137	P136-T139 PolarHBondContact O-OG1 3.06Å; P136-T139 VanDerWaalsContact O-OG1 3.06Å; N137-T139 PolarHBondContact O-N 3.22Å
140	M	40.7	Very low	45.6	Very low	177 Å²	177	140.8 Å²	140.8	87%	0.872	77%	0.767	S	S	*	*	S	Bend	trans	-131.8	37	177.8	-84	-164.3	168.4	0	0	114.9
141	I	45.2	Very low	45.1	Very low	171 Å²	171	140.1 Å²	140.1	88%	0.877	77%	0.772	S	S	*	*	S	Bend	trans	-136	59	159.1	-44.9	177.1	0	0	0	108.5
142	E	43.9	Very low	44.8	Very low	187 Å²	187	145.1 Å²	145.1	87%	0.874	79%	0.791	S	S	*	*	S	Bend	trans	-148.2	52.8	159.8	-156.8	165.7	134.9	0	0	109
143	Q	41.8	Very low	44.6	Very low	187 Å²	187	147.7 Å²	147.7	87%	0.874	81%	0.806	S	S	*	*			trans	-152.7	79.5	160.7	-77.6	-158.1	-57.3	0	0	108.4
144	D	39.7	Very low	44.2	Very low	244 Å²	244	155.1 Å²	155.1	100%	1.305	82%	0.818	S	S	*	*			trans	-176.1	0	139.6	-92.4	-18.3	0	0	0	108.4

Retrieved 144 of 144 residues in 228.4 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).