A0A060XZ11_ONCMY Loading...

Erythropoietin

Hormone involved in the regulation of erythrocyte proliferation and differentiation and the maintenance of a physiological level of circulating erythrocyte mass. Binds to EPOR leading to EPOR dimerization and JAK2 activation thereby activating specific downstream effectors, including STAT1 and STAT3.

AlphaFold DB , UniProt , Accession A0A060XZ11, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110533936, Length 184 aa.

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	48.2	Very low	67.6	Low	235 Å²	235	103.8 Å²	103.8	100%	1.158	63%	0.63	S	S	*	*				0	47.6	0	-65.8	149.6	68.9	0	0	111.5
2	S	54.8	Low	68.2	Low	104 Å²	104	103.2 Å²	103.2	73%	0.727	62%	0.62	S	S	*	*			trans	-121.6	-27.9	-174.7	-156.9	0	0	0	0	113.6	I4	S2-I4 PolarHBondContact O-N 3.46Å
3	S	56.8	Low	68.5	Low	108 Å²	108	100.6 Å²	100.6	76%	0.755	61%	0.605	S	S	*	*	H	α-helix	trans	-70.7	-28.6	179.8	-64.7	0	0	0	0	115.6	S5 L7	S3-S5 VanDerWaalsContact C-N 3.31Å; S3-S5 PolarHBondContact O-N 2.92Å; S3-L7 PolarHBondContact O-N 3.38Å
4	I	59	Low	68.5	Low	134 Å²	134	99.8 Å²	99.8	69%	0.687	60%	0.6	S	S	*	*	H	α-helix	trans	-69.9	-33.7	-175.5	-57.4	172.1	0	0	0	110.6	S2 V8	S2-I4 PolarHBondContact O-N 3.46Å; I4-V8 VanDerWaalsContact O-CG2 3.31Å; I4-V8 WeakPolarHBondContact O-CG2 3.26Å; I4-V8 PolarHBondContact O-N 3.48Å
5	S	66.1	Low	68.4	Low	94 Å²	94	100.7 Å²	100.7	66%	0.657	60%	0.6	S	S	*	*	H	α-helix	trans	-71.7	-36.7	-177.4	-164.3	0	0	0	0	112.3	S3 A9	S3-S5 VanDerWaalsContact C-N 3.31Å; S3-S5 PolarHBondContact O-N 2.92Å; S5-A9 PolarHBondContact O-N 2.96Å
6	G	72.2	Confident	68.2	Low	41 Å²	41	103.1 Å²	103.1	42%	0.423	60%	0.603	S	S	.	*	H	α-helix	trans	-68.9	-41.1	176.4	0	0	0	0	0	113.3	V8 A9 V10	G6-V8 VanDerWaalsContact C-N 3.35Å; G6-V8 PolarHBondContact O-N 3.37Å; G6-A9 PolarHBondContact O-N 2.97Å; G6-V10 WeakPolarHBondContact O-CG2 3.42Å; G6-V10 PolarHBondContact O-N 3.37Å
7	L	75.7	Confident	67.5	Low	117 Å²	117	108.4 Å²	108.4	61%	0.613	61%	0.611	S	S	*	*	H	α-helix	trans	-64.5	-40.5	179.2	-164.6	84.6	0	0	0	111.8	S3 V10 L11	S3-L7 PolarHBondContact O-N 3.38Å; L7-V10 PolarHBondContact O-N 2.88Å; L7-L11 HydrophobicContact CD2-CD1 4.38Å; L7-L11 HydrophobicContact CG-CD1 4.28Å; L7-L11 PolarHBondContact O-N 3.34Å
8	V	76.9	Confident	66.9	Low	74 Å²	74	106.4 Å²	106.4	45%	0.448	61%	0.61	S	S	.	*	H	α-helix	trans	-65.9	-39.8	177.5	173	0	0	0	0	111.1	I4 G6 V10 L11 L12	I4-V8 VanDerWaalsContact O-CG2 3.31Å; I4-V8 WeakPolarHBondContact O-CG2 3.26Å; I4-V8 PolarHBondContact O-N 3.48Å; G6-V8 VanDerWaalsContact C-N 3.35Å; G6-V8 PolarHBondContact O-N 3.37Å; V8-V10 PolarHBondContact O-N 2.94Å; V8-L11 PolarHBondContact O-N 3.47Å; V8-L12 HydrophobicContact CG1-CD1 3.92Å; V8-L12 HydrophobicContact CG1-CG 4.41Å; V8-L12 WeakPolarHBondContact O-CB 3.4Å; V8-L12 VanDerWaalsContact O-CG 3.27Å; V8-L12 WeakPolarHBondContact O-CG 3.45Å; V8-L12 PolarHBondContact O-N 3.06Å
9	A	78.8	Confident	66.1	Low	53 Å²	53	104.2 Å²	104.2	44%	0.438	61%	0.613	S	S	.	*	H	α-helix	trans	-64.4	-38.7	175.3	0	0	0	0	0	112.4	S5 G6 T13	S5-A9 PolarHBondContact O-N 2.96Å; G6-A9 PolarHBondContact O-N 2.97Å; A9-T13 WeakPolarHBondContact O-CG2 3.37Å; A9-T13 PolarHBondContact O-N 3.04Å; A9-T13 PolarHBondContact O-OG1 3.47Å
10	V	78.3	Confident	65.3	Low	88 Å²	88	108.8 Å²	108.8	53%	0.533	62%	0.619	S	S	.	*	H	α-helix	trans	-67.1	-42.6	174.8	174.6	0	0	0	0	111.2	G6 L7 V8 L12 T13 V14	G6-V10 WeakPolarHBondContact O-CG2 3.42Å; G6-V10 PolarHBondContact O-N 3.37Å; L7-V10 PolarHBondContact O-N 2.88Å; V8-V10 PolarHBondContact O-N 2.94Å; V10-L12 PolarHBondContact O-N 2.92Å; V10-T13 WeakPolarHBondContact CA-OG1 3.29Å; V10-T13 PolarHBondContact O-N 3.49Å; V10-T13 PolarHBondContact O-OG1 3.3Å; V10-V14 HydrophobicContact CG1-CG2 4.43Å; V10-V14 VanDerWaalsContact O-CG2 3.29Å; V10-V14 WeakPolarHBondContact O-CG2 3.42Å; V10-V14 PolarHBondContact O-N 3.41Å
11	L	76.9	Confident	64.4	Low	94 Å²	94	106.3 Å²	106.3	49%	0.492	62%	0.618	S	S	.	*	H	α-helix	trans	-61.2	-44.5	175.5	-90.1	152.8	0	0	0	112.1	L7 V8 T13 V14 L15	L7-L11 HydrophobicContact CD2-CD1 4.38Å; L7-L11 HydrophobicContact CG-CD1 4.28Å; L7-L11 PolarHBondContact O-N 3.34Å; V8-L11 PolarHBondContact O-N 3.47Å; L11-T13 PolarHBondContact O-N 3.21Å; L11-V14 PolarHBondContact O-N 3.46Å; L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CD1 3.4Å; L11-L15 WeakPolarHBondContact O-CG 3.37Å; L11-L15 PolarHBondContact O-N 2.98Å
12	L	74.6	Confident	64.3	Low	96 Å²	96	102.5 Å²	102.5	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-64.8	-38.2	178.9	-72.6	168.9	0	0	0	112.4	V8 V10 Q16	V8-L12 HydrophobicContact CG1-CD1 3.92Å; V8-L12 HydrophobicContact CG1-CG 4.41Å; V8-L12 WeakPolarHBondContact O-CB 3.4Å; V8-L12 VanDerWaalsContact O-CG 3.27Å; V8-L12 WeakPolarHBondContact O-CG 3.45Å; V8-L12 PolarHBondContact O-N 3.06Å; V10-L12 PolarHBondContact O-N 2.92Å; L12-Q16 WeakPolarHBondContact O-CB 3.36Å; L12-Q16 VanDerWaalsContact O-CG 3.26Å; L12-Q16 WeakPolarHBondContact O-CG 3.27Å; L12-Q16 PolarHBondContact O-N 3.34Å
13	T	72.1	Confident	64	Low	70 Å²	70	103.3 Å²	103.3	43%	0.429	60%	0.604	S	S	.	*	H	α-helix	trans	-70.2	-39.7	176.3	47.3	0	0	0	0	112	A9 V10 L11 Q16 W17	A9-T13 WeakPolarHBondContact O-CG2 3.37Å; A9-T13 PolarHBondContact O-N 3.04Å; A9-T13 PolarHBondContact O-OG1 3.47Å; V10-T13 WeakPolarHBondContact CA-OG1 3.29Å; V10-T13 PolarHBondContact O-N 3.49Å; V10-T13 PolarHBondContact O-OG1 3.3Å; L11-T13 PolarHBondContact O-N 3.21Å; T13-Q16 PolarHBondContact O-N 3.32Å; T13-W17 WeakPolarHBondContact O-CB 3.31Å; T13-W17 VanDerWaalsContact O-CD1 3.29Å; T13-W17 PolarHBondContact O-N 2.94Å
14	V	69	Low	63.8	Low	89 Å²	89	101 Å²	101	54%	0.539	59%	0.588	S	S	.	*	H	α-helix	trans	-65	-40.6	173.9	173.5	0	0	0	0	111.5	V10 L11 W17 A18	V10-V14 HydrophobicContact CG1-CG2 4.43Å; V10-V14 VanDerWaalsContact O-CG2 3.29Å; V10-V14 WeakPolarHBondContact O-CG2 3.42Å; V10-V14 PolarHBondContact O-N 3.41Å; L11-V14 PolarHBondContact O-N 3.46Å; V14-W17 PolarHBondContact O-N 3.4Å; V14-A18 VanDerWaalsContact O-CB 3.3Å; V14-A18 WeakPolarHBondContact O-CB 3.35Å; V14-A18 PolarHBondContact O-N 3.31Å
15	L	67	Low	63.7	Low	114 Å²	114	99.7 Å²	99.7	60%	0.597	59%	0.588	S	S	*	*	H	α-helix	trans	-65.3	-39.4	175.5	-81.4	155.2	0	0	0	112.3	L11 A18 G19	L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CD1 3.4Å; L11-L15 WeakPolarHBondContact O-CG 3.37Å; L11-L15 PolarHBondContact O-N 2.98Å; L15-A18 PolarHBondContact O-N 3.28Å; L15-G19 PolarHBondContact O-N 3.45Å
16	Q	64.4	Low	63.3	Low	138 Å²	138	101.5 Å²	101.5	65%	0.645	60%	0.595	S	S	*	*	H	α-helix	trans	-68.8	-34	174.3	-75.7	176.5	-17	0	0	112.6	L12 T13 R20	L12-Q16 WeakPolarHBondContact O-CB 3.36Å; L12-Q16 VanDerWaalsContact O-CG 3.26Å; L12-Q16 WeakPolarHBondContact O-CG 3.27Å; L12-Q16 PolarHBondContact O-N 3.34Å; T13-Q16 PolarHBondContact O-N 3.32Å; Q16-R20 PolarHBondContact O-N 2.8Å
17	W	56.4	Low	63.4	Low	194 Å²	194	103.2 Å²	103.2	74%	0.735	59%	0.589	S	S	*	*	H	α-helix	trans	-72.3	-39.1	173.3	-92.6	75.1	0	0	0	112.5	T13 V14 G19 R20	T13-W17 WeakPolarHBondContact O-CB 3.31Å; T13-W17 VanDerWaalsContact O-CD1 3.29Å; T13-W17 PolarHBondContact O-N 2.94Å; V14-W17 PolarHBondContact O-N 3.4Å; W17-G19 VanDerWaalsContact C-N 3.26Å; W17-G19 PolarHBondContact O-N 2.92Å; W17-R20 PolarHBondContact O-N 3.48Å
18	A	57.3	Low	63.5	Low	72 Å²	72	101.4 Å²	101.4	60%	0.595	58%	0.584	S	S	*	*	H	α-helix	trans	-68.2	-27	173.2	0	0	0	0	0	112.4	V14 L15	V14-A18 VanDerWaalsContact O-CB 3.3Å; V14-A18 WeakPolarHBondContact O-CB 3.35Å; V14-A18 PolarHBondContact O-N 3.31Å; L15-A18 PolarHBondContact O-N 3.28Å
19	G	52	Low	63.8	Low	65 Å²	65	98 Å²	98	67%	0.67	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-15.7	174.2	0	0	0	0	0	114.6	L15 W17 G21	L15-G19 PolarHBondContact O-N 3.45Å; W17-G19 VanDerWaalsContact C-N 3.26Å; W17-G19 PolarHBondContact O-N 2.92Å; G19-G21 PolarHBondContact O-N 2.89Å
20	R	48.9	Very low	64.1	Low	195 Å²	195	97.5 Å²	97.5	74%	0.736	56%	0.556	S	S	*	*	S	Bend	trans	-78.8	81.3	164.9	-71.1	-172.7	176.4	-179.7	-0.5	107.3	Q16 W17 L22	Q16-R20 PolarHBondContact O-N 2.8Å; W17-R20 PolarHBondContact O-N 3.48Å; R20-L22 PolarHBondContact O-N 3.32Å
21	G	47.3	Very low	64.5	Low	58 Å²	58	95.5 Å²	95.5	60%	0.598	54%	0.542	S	S	*	.			trans	-38.9	131.2	-170	0	0	0	0	0	112.9	G19	G19-G21 PolarHBondContact O-N 2.89Å
22	L	44.8	Very low	64.9	Low	154 Å²	154	95 Å²	95	81%	0.806	54%	0.544	S	S	*	.			trans	-45.9	138	160.3	-85.9	76.6	0	0	0	107.4	R20 S24	R20-L22 PolarHBondContact O-N 3.32Å; L22-S24 PolarHBondContact O-N 2.66Å
23	P	48.5	Very low	65.7	Low	122 Å²	122	98.9 Å²	98.9	79%	0.792	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-49.5	120.4	172.2	20.1	-30.1	0	0	0	107.2
24	S	52.7	Low	66.6	Low	60 Å²	60	97.7 Å²	97.7	42%	0.42	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-49.8	136.8	177.8	-165.2	0	0	0	0	107.2	L22 V26	L22-S24 PolarHBondContact O-N 2.66Å; S24-V26 PolarHBondContact O-N 2.93Å; S24-V26 VanDerWaalsContact O-N 3.09Å
25	P	57.8	Low	67.8	Low	105 Å²	105	93.7 Å²	93.7	68%	0.682	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-46.3	127.3	177.5	-25	31.6	0	0	0	108.5	R27	P25-R27 WeakPolarHBondContact O-CG 3.49Å; P25-R27 PolarHBondContact O-N 3.09Å
26	V	58.1	Low	69.1	Low	132 Å²	132	91.2 Å²	91.2	80%	0.8	51%	0.508	S	S	*	.			trans	-48.5	114.2	178.2	-178.7	0	0	0	0	106.4	S24 P28	S24-V26 PolarHBondContact O-N 2.93Å; S24-V26 VanDerWaalsContact O-N 3.09Å; V26-P28 WeakPolarHBondContact O-CD 3.23Å; V26-P28 WeakPolarHBondContact O-CG 3.24Å
27	R	73.8	Confident	70.6	Confident	77 Å²	77	91.1 Å²	91.1	29%	0.291	50%	0.502	S	S	.	.			trans	-87.2	91.8	-178.7	-64.4	-173	-177.2	-140.6	5.8	106.7	P25 I29 C30 L130	P25-R27 WeakPolarHBondContact O-CG 3.49Å; P25-R27 PolarHBondContact O-N 3.09Å; R27-I29 PolarHBondContact O-N 2.95Å; R27-I29 VanDerWaalsContact O-N 3.09Å; R27-C30 HydrophobicContact CB-CB 4.36Å; R27-C30 WeakPolarHBondContact O-CB 3.22Å; R27-C30 PolarHBondContact O-N 2.95Å; R27-L130 HydrophobicContact CB-CD2 4.38Å; R27-L130 HydrophobicContact CG-CD2 4.45Å; R27-L130 PolarHBondContact NH1-O 3.08Å
28	P	78.3	Confident	72.4	Confident	79 Å²	79	83.4 Å²	83.4	51%	0.513	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-66.3	-25.1	-166.3	-17.3	35.5	0	0	0	110.7	V26 C30 D31 V34	V26-P28 WeakPolarHBondContact O-CD 3.23Å; V26-P28 WeakPolarHBondContact O-CG 3.24Å; P28-C30 PolarHBondContact O-N 2.99Å; P28-D31 VanDerWaalsContact O-CB 3.22Å; P28-D31 WeakPolarHBondContact O-CB 3.34Å; P28-D31 PolarHBondContact O-N 2.98Å; P28-V34 HydrophobicContact CB-CG2 4.27Å; P28-V34 WeakPolarHBondContact O-CB 3.41Å; P28-V34 WeakPolarHBondContact O-CG2 3.46Å
29	I	82.2	Confident	74.3	Confident	4 Å²	4	80.5 Å²	80.5	2%	0.021	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-67.2	-20.9	176.2	-162.8	62.9	0	0	0	114.6	R27 D31 V34 L123 V126 L130 L173	R27-I29 PolarHBondContact O-N 2.95Å; R27-I29 VanDerWaalsContact O-N 3.09Å; I29-D31 PolarHBondContact O-N 3.5Å; I29-V34 HydrophobicContact CD1-CG1 3.95Å; I29-L123 HydrophobicContact CD1-CD1 4Å; I29-V126 HydrophobicContact CB-CG1 3.3Å; I29-V126 HydrophobicContact CD1-CG1 3.71Å; I29-V126 HydrophobicContact CG1-CG1 3.46Å; I29-V126 VanDerWaalsContact CG1-CG1 3.46Å; I29-V126 HydrophobicContact CG2-CG1 3.75Å; I29-L130 HydrophobicContact CG2-CD1 3.73Å; I29-L130 HydrophobicContact CG2-CD2 3.57Å; I29-L130 HydrophobicContact CG2-CG 3.85Å; I29-L173 HydrophobicContact CD1-CD1 3.96Å; I29-L173 HydrophobicContact CG1-CD1 3.75Å; I29-L173 HydrophobicContact CG1-CD2 3.62Å; I29-L173 HydrophobicContact CG1-CG 4.36Å; I29-L173 HydrophobicContact CG2-CD2 4.3Å
30	C	84.8	Confident	76.5	Confident	41 Å²	41	81.1 Å²	81.1	28%	0.277	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-76.3	-13.3	172.5	-59.7	0	0	0	0	111.7	R27 P28 P32 C179	R27-C30 HydrophobicContact CB-CB 4.36Å; R27-C30 WeakPolarHBondContact O-CB 3.22Å; R27-C30 PolarHBondContact O-N 2.95Å; P28-C30 PolarHBondContact O-N 2.99Å; C30-P32 WeakPolarHBondContact O-CD 2.98Å; C30-C179 VanDerWaalsContact CA-SG 3.51Å; C30-C179 HydrophobicContact CB-CB 3.55Å; C30-C179 WeakPolarHBondContact CB-SG 3.47Å; C30-C179 WeakPolarHBondContact SG-CA 3.34Å; C30-C179 WeakPolarHBondContact SG-CB 3.41Å; C30-C179 CovalentContact SG-SG 2.05Å; C30-C179 PolarHBondContact SG-SG 2.85Å
31	D	87.4	Confident	78.7	Confident	47 Å²	47	73.9 Å²	73.9	25%	0.251	41%	0.409	S	S	.	.	S	Bend	trans	-77	117.1	165.3	-175.1	-22.2	0	0	0	108.7	P28 I29 R33 V34	P28-D31 VanDerWaalsContact O-CB 3.22Å; P28-D31 WeakPolarHBondContact O-CB 3.34Å; P28-D31 PolarHBondContact O-N 2.98Å; I29-D31 PolarHBondContact O-N 3.5Å; D31-R33 PolarHBondContact O-N 3.42Å; D31-R33 VanDerWaalsContact OD1-CB 3.23Å; D31-R33 WeakPolarHBondContact OD1-CB 3.48Å; D31-R33 VanDerWaalsContact OD1-CG 3.24Å; D31-R33 WeakPolarHBondContact OD1-CG 3.35Å; D31-R33 IonicContact OD1-CZ 3.91Å; D31-R33 PolarHBondContact OD1-N 3.01Å; D31-R33 IonicContact OD1-NE 2.99Å; D31-R33 PolarHBondContact OD1-NE 3.35Å; D31-R33 IonicContact OD1-NH2 3.98Å; D31-R33 IonicContact OD2-CZ 3.21Å; D31-R33 IonicContact OD2-NE 2.95Å; D31-R33 PolarHBondContact OD2-NE 3.24Å; D31-R33 IonicContact OD2-NH2 2.66Å; D31-R33 PolarHBondContact OD2-NH2 2.96Å; D31-V34 HydrophobicContact CB-CG2 4.29Å; D31-V34 WeakPolarHBondContact O-CB 3.41Å; D31-V34 PolarHBondContact O-N 3.09Å
32	P	86.1	Confident	81.1	Confident	82 Å²	82	71.1 Å²	71.1	53%	0.532	38%	0.381	S	S	.	.	H	α-helix	trans	-57.8	-25.7	-177.1	24	-34.6	0	0	0	112.8	C30 V34 L35 D36	C30-P32 WeakPolarHBondContact O-CD 2.98Å; P32-V34 PolarHBondContact O-N 2.89Å; P32-L35 PolarHBondContact O-N 2.58Å; P32-D36 PolarHBondContact O-N 2.72Å
33	R	90.8	Very high	83.5	Confident	178 Å²	178	70.3 Å²	70.3	67%	0.672	37%	0.367	S	S	*	.	H	α-helix	trans	-63.5	-29.6	178.1	-60.2	177.8	-68.4	-174.4	0.8	112.5	D31 D36 R37	D31-R33 PolarHBondContact O-N 3.42Å; D31-R33 VanDerWaalsContact OD1-CB 3.23Å; D31-R33 WeakPolarHBondContact OD1-CB 3.48Å; D31-R33 VanDerWaalsContact OD1-CG 3.24Å; D31-R33 WeakPolarHBondContact OD1-CG 3.35Å; D31-R33 IonicContact OD1-CZ 3.91Å; D31-R33 PolarHBondContact OD1-N 3.01Å; D31-R33 IonicContact OD1-NE 2.99Å; D31-R33 PolarHBondContact OD1-NE 3.35Å; D31-R33 IonicContact OD1-NH2 3.98Å; D31-R33 IonicContact OD2-CZ 3.21Å; D31-R33 IonicContact OD2-NE 2.95Å; D31-R33 PolarHBondContact OD2-NE 3.24Å; D31-R33 IonicContact OD2-NH2 2.66Å; D31-R33 PolarHBondContact OD2-NH2 2.96Å; R33-D36 PolarHBondContact O-N 2.92Å; R33-R37 PolarHBondContact O-N 3.42Å; R33-R37 VanDerWaalsContact O-N 3.14Å
34	V	91.7	Very high	85.7	Confident	46 Å²	46	68.6 Å²	68.6	28%	0.279	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-46.2	177.1	173.8	0	0	0	0	110.1	P28 I29 D31 P32 D36 R37 F38	P28-V34 HydrophobicContact CB-CG2 4.27Å; P28-V34 WeakPolarHBondContact O-CB 3.41Å; P28-V34 WeakPolarHBondContact O-CG2 3.46Å; I29-V34 HydrophobicContact CD1-CG1 3.95Å; D31-V34 HydrophobicContact CB-CG2 4.29Å; D31-V34 WeakPolarHBondContact O-CB 3.41Å; D31-V34 PolarHBondContact O-N 3.09Å; P32-V34 PolarHBondContact O-N 2.89Å; V34-D36 VanDerWaalsContact C-N 3.31Å; V34-D36 PolarHBondContact O-N 3.4Å; V34-R37 WeakPolarHBondContact O-CB 3.07Å; V34-R37 PolarHBondContact O-N 3.24Å; V34-F38 HydrophobicContact CG1-CE2 3.98Å; V34-F38 WeakPolarHBondContact O-CD2 3.4Å
35	L	93.3	Very high	87.6	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-39	173.9	-177.9	66.6	0	0	0	111.7	P32 R37 F38 I39 L123 V169 R170 L173	P32-L35 PolarHBondContact O-N 2.58Å; L35-R37 PolarHBondContact O-N 2.9Å; L35-F38 WeakPolarHBondContact O-CB 3.36Å; L35-F38 PolarHBondContact O-N 3.31Å; L35-I39 HydrophobicContact CD2-CD1 4.04Å; L35-I39 HydrophobicContact CG-CD1 3.78Å; L35-I39 HydrophobicContact CG-CG1 4.27Å; L35-I39 WeakPolarHBondContact O-CG1 3.06Å; L35-I39 PolarHBondContact O-N 3.44Å; L35-L123 HydrophobicContact CD1-CD1 4.37Å; L35-V169 HydrophobicContact CD1-CB 4.45Å; L35-V169 HydrophobicContact CD1-CG1 3.66Å; L35-R170 VanDerWaalsContact CD2-CA 3.44Å; L35-R170 HydrophobicContact CD2-CB 3.52Å; L35-R170 HydrophobicContact CD2-CG 3.93Å; L35-L173 HydrophobicContact CB-CD1 4.23Å; L35-L173 HydrophobicContact CD1-CD1 4.1Å; L35-L173 HydrophobicContact CD2-CD1 4Å; L35-L173 HydrophobicContact CG-CD1 4.32Å
36	D	95.3	Very high	89.3	Confident	62 Å²	62	62.2 Å²	62.2	33%	0.332	31%	0.306	S	S	.	.	H	α-helix	trans	-59.6	-33.8	178.9	-71.7	-12.6	0	0	0	112.4	P32 R33 V34 I39 M40 R170	P32-D36 PolarHBondContact O-N 2.72Å; R33-D36 PolarHBondContact O-N 2.92Å; V34-D36 VanDerWaalsContact C-N 3.31Å; V34-D36 PolarHBondContact O-N 3.4Å; D36-I39 PolarHBondContact O-N 3.45Å; D36-M40 VanDerWaalsContact O-CB 3.25Å; D36-M40 WeakPolarHBondContact O-CB 3.29Å; D36-M40 PolarHBondContact O-N 2.96Å; D36-R170 IonicContact OD1-CZ 3.79Å; D36-R170 IonicContact OD1-NH2 3.69Å; D36-R170 PolarHBondContact OD1-NH2 3.3Å; D36-R170 IonicContact OD2-NH2 3.15Å
37	R	94.9	Very high	90.9	Very high	137 Å²	137	59.7 Å²	59.7	52%	0.517	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-47.9	173	-176.2	66.6	-167.1	-174	5.9	111.7	R33 V34 L35 M40 E41	R33-R37 PolarHBondContact O-N 3.42Å; R33-R37 VanDerWaalsContact O-N 3.14Å; V34-R37 WeakPolarHBondContact O-CB 3.07Å; V34-R37 PolarHBondContact O-N 3.24Å; L35-R37 PolarHBondContact O-N 2.9Å; R37-M40 PolarHBondContact O-N 3.14Å; R37-E41 IonicContact CZ-OE1 2.61Å; R37-E41 IonicContact NE-OE1 3.37Å; R37-E41 PolarHBondContact NE-OE1 2.83Å; R37-E41 IonicContact NH2-OE1 2.73Å; R37-E41 PolarHBondContact NH2-OE1 2.87Å; R37-E41 WeakPolarHBondContact O-CG 3.07Å; R37-E41 PolarHBondContact O-N 2.97Å
38	F	95.3	Very high	91.7	Very high	31 Å²	31	59 Å²	59	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-42.1	177.1	-68.2	-77.1	0	0	0	112.1	V34 L35 M40 E41 A42 N119 L123	V34-F38 HydrophobicContact CG1-CE2 3.98Å; V34-F38 WeakPolarHBondContact O-CD2 3.4Å; L35-F38 WeakPolarHBondContact O-CB 3.36Å; L35-F38 PolarHBondContact O-N 3.31Å; F38-M40 VanDerWaalsContact C-N 3.33Å; F38-M40 PolarHBondContact O-N 3.24Å; F38-E41 PolarHBondContact O-N 3.03Å; F38-A42 WeakPolarHBondContact O-CB 3.39Å; F38-A42 PolarHBondContact O-N 3.31Å; F38-N119 HydrophobicContact CD1-CB 4.06Å; F38-N119 HydrophobicContact CE1-CB 4.36Å; F38-L123 HydrophobicContact CD1-CB 4.42Å; F38-L123 HydrophobicContact CD2-CD1 4.38Å; F38-L123 HydrophobicContact CE1-CB 4.33Å
39	I	96.6	Very high	92.1	Very high	12 Å²	12	55.8 Å²	55.8	6%	0.062	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-42.9	176.8	-69.3	166.1	0	0	0	110.8	L35 D36 R43 L165 R166	L35-I39 HydrophobicContact CD2-CD1 4.04Å; L35-I39 HydrophobicContact CG-CD1 3.78Å; L35-I39 HydrophobicContact CG-CG1 4.27Å; L35-I39 WeakPolarHBondContact O-CG1 3.06Å; L35-I39 PolarHBondContact O-N 3.44Å; D36-I39 PolarHBondContact O-N 3.45Å; I39-R43 WeakPolarHBondContact O-CB 3.33Å; I39-R43 PolarHBondContact O-N 3.37Å; I39-L165 HydrophobicContact CG1-CB 3.69Å; I39-L165 HydrophobicContact CG1-CD1 4.47Å; I39-R166 HydrophobicContact CD1-CG 3.99Å; I39-R166 HydrophobicContact CG1-CG 4.2Å; I39-R166 HydrophobicContact CG2-CG 3.62Å; I39-R166 VanDerWaalsContact CG2-NE 3.34Å
40	M	96.9	Very high	92.2	Very high	77 Å²	77	63.8 Å²	63.8	38%	0.379	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-48.6	179	-174.8	-177.4	74.9	0	0	110.8	D36 R37 F38 A42 R43 D44	D36-M40 VanDerWaalsContact O-CB 3.25Å; D36-M40 WeakPolarHBondContact O-CB 3.29Å; D36-M40 PolarHBondContact O-N 2.96Å; R37-M40 PolarHBondContact O-N 3.14Å; F38-M40 VanDerWaalsContact C-N 3.33Å; F38-M40 PolarHBondContact O-N 3.24Å; M40-A42 VanDerWaalsContact C-N 3.3Å; M40-A42 PolarHBondContact O-N 3.3Å; M40-R43 CarbonylContact O-C 3.58Å; M40-R43 WeakPolarHBondContact O-CA 3.46Å; M40-R43 WeakPolarHBondContact O-CB 3.25Å; M40-R43 PolarHBondContact O-N 3.49Å; M40-D44 VanDerWaalsContact O-CG 3.27Å; M40-D44 PolarHBondContact O-N 3.45Å
41	E	96.3	Very high	91.5	Very high	43 Å²	43	64.9 Å²	64.9	20%	0.201	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-34.5	179.3	-70.5	175.1	167.5	0	0	112.8	R37 F38 T45 N119	R37-E41 IonicContact CZ-OE1 2.61Å; R37-E41 IonicContact NE-OE1 3.37Å; R37-E41 PolarHBondContact NE-OE1 2.83Å; R37-E41 IonicContact NH2-OE1 2.73Å; R37-E41 PolarHBondContact NH2-OE1 2.87Å; R37-E41 WeakPolarHBondContact O-CG 3.07Å; R37-E41 PolarHBondContact O-N 2.97Å; F38-E41 PolarHBondContact O-N 3.03Å; E41-T45 WeakPolarHBondContact O-CB 3.42Å; E41-T45 PolarHBondContact O-N 3.34Å; E41-T45 VanDerWaalsContact O-N 3.09Å; E41-T45 PolarHBondContact O-OG1 2.05Å; E41-N119 PolarHBondContact OE2-ND2 3.07Å
42	A	96.5	Very high	90.7	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-43.4	171.1	0	0	0	0	0	112	F38 M40 T45 E46 L165	F38-A42 WeakPolarHBondContact O-CB 3.39Å; F38-A42 PolarHBondContact O-N 3.31Å; M40-A42 VanDerWaalsContact C-N 3.3Å; M40-A42 PolarHBondContact O-N 3.3Å; A42-T45 WeakPolarHBondContact O-CB 3.33Å; A42-T45 PolarHBondContact O-N 3.11Å; A42-E46 PolarHBondContact O-N 3.2Å; A42-L165 HydrophobicContact CB-CD1 3.74Å
43	R	95.9	Very high	89.9	Confident	137 Å²	137	69.4 Å²	69.4	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-66.2	-39.3	177.2	-169.6	-162	-174.4	172.1	-4.8	112.3	I39 M40 T45 E46 T47 T162	I39-R43 WeakPolarHBondContact O-CB 3.33Å; I39-R43 PolarHBondContact O-N 3.37Å; M40-R43 CarbonylContact O-C 3.58Å; M40-R43 WeakPolarHBondContact O-CA 3.46Å; M40-R43 WeakPolarHBondContact O-CB 3.25Å; M40-R43 PolarHBondContact O-N 3.49Å; R43-T45 VanDerWaalsContact C-N 3.3Å; R43-E46 WeakPolarHBondContact O-CB 3.47Å; R43-E46 PolarHBondContact O-N 3.31Å; R43-T47 WeakPolarHBondContact O-CB 3.16Å; R43-T47 PolarHBondContact O-N 2.84Å; R43-T47 PolarHBondContact O-OG1 3.39Å; R43-T162 HydrophobicContact CB-CG2 4.43Å
44	D	94.7	Very high	88.3	Confident	85 Å²	85	66.1 Å²	66.1	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-41.2	177.5	-69.4	-14.6	0	0	0	110.2	M40 T47 A48	M40-D44 VanDerWaalsContact O-CG 3.27Å; M40-D44 PolarHBondContact O-N 3.45Å; D44-T47 PolarHBondContact O-N 2.94Å; D44-A48 VanDerWaalsContact O-CB 3.32Å; D44-A48 WeakPolarHBondContact O-CB 3.37Å; D44-A48 PolarHBondContact O-N 3.48Å
45	T	93.4	Very high	86.6	Confident	10 Å²	10	65.3 Å²	65.3	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-47.1	172.7	-55.9	0	0	0	0	111.6	E41 A42 R43 T47 A48 L49 L112 N116 L158	E41-T45 WeakPolarHBondContact O-CB 3.42Å; E41-T45 PolarHBondContact O-N 3.34Å; E41-T45 VanDerWaalsContact O-N 3.09Å; E41-T45 PolarHBondContact O-OG1 2.05Å; A42-T45 WeakPolarHBondContact O-CB 3.33Å; A42-T45 PolarHBondContact O-N 3.11Å; R43-T45 VanDerWaalsContact C-N 3.3Å; T45-T47 VanDerWaalsContact C-N 3.3Å; T45-T47 PolarHBondContact O-N 2.94Å; T45-A48 PolarHBondContact O-N 3.45Å; T45-L49 HydrophobicContact CG2-CD1 3.82Å; T45-L49 WeakPolarHBondContact O-CB 3.39Å; T45-L49 WeakPolarHBondContact O-CG 3.49Å; T45-L49 PolarHBondContact O-N 2.99Å; T45-L49 VanDerWaalsContact O-N 3.09Å; T45-L112 HydrophobicContact CG2-CB 4.27Å; T45-N116 HydrophobicContact CG2-CB 4.46Å; T45-N116 PolarHBondContact OG1-ND2 3.15Å; T45-L158 HydrophobicContact CG2-CD1 4.46Å; T45-L158 HydrophobicContact CG2-CD2 4.13Å
46	E	92.6	Very high	85.3	Confident	22 Å²	22	65.5 Å²	65.5	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-56.1	-45.7	174.1	-172.4	-161.3	143.9	0	0	111.2	A42 R43 L49 R50 L158 T162	A42-E46 PolarHBondContact O-N 3.2Å; R43-E46 WeakPolarHBondContact O-CB 3.47Å; R43-E46 PolarHBondContact O-N 3.31Å; E46-L49 PolarHBondContact O-N 3.39Å; E46-R50 WeakPolarHBondContact O-CB 3.45Å; E46-R50 PolarHBondContact O-N 3.27Å; E46-R50 IonicContact OE1-NH2 2.78Å; E46-R50 PolarHBondContact OE1-NH2 3.05Å; E46-R50 VanDerWaalsContact OE1-NH2 3.15Å; E46-L158 HydrophobicContact CB-CB 4.03Å; E46-L158 HydrophobicContact CG-CB 4Å; E46-T162 PolarHBondContact OE2-OG1 3.42Å
47	T	92.3	Very high	83.6	Confident	79 Å²	79	64.6 Å²	64.6	49%	0.485	36%	0.36	S	S	.	.	H	α-helix	trans	-68.6	-44.5	-176.6	-55.7	0	0	0	0	111.5	R43 D44 T45 L49 R50	R43-T47 WeakPolarHBondContact O-CB 3.16Å; R43-T47 PolarHBondContact O-N 2.84Å; R43-T47 PolarHBondContact O-OG1 3.39Å; D44-T47 PolarHBondContact O-N 2.94Å; T45-T47 VanDerWaalsContact C-N 3.3Å; T45-T47 PolarHBondContact O-N 2.94Å; T47-L49 PolarHBondContact O-N 2.96Å; T47-R50 PolarHBondContact O-N 3.42Å
48	A	90	Very high	82.3	Confident	62 Å²	62	59.2 Å²	59.2	51%	0.512	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-34	176.6	0	0	0	0	0	112.1	D44 T45 L112	D44-A48 VanDerWaalsContact O-CB 3.32Å; D44-A48 WeakPolarHBondContact O-CB 3.37Å; D44-A48 PolarHBondContact O-N 3.48Å; T45-A48 PolarHBondContact O-N 3.45Å; A48-L112 HydrophobicContact CB-CD1 3.95Å
49	L	87.6	Confident	81	Confident	12 Å²	12	64 Å²	64	6%	0.063	37%	0.374	C	S	.	.	H	α-helix	trans	-96.7	-9.1	-176.6	-62.1	173.9	0	0	0	113.7	T45 E46 T47 G51 C52 V109 L112 I113 L154 L158	T45-L49 HydrophobicContact CG2-CD1 3.82Å; T45-L49 WeakPolarHBondContact O-CB 3.39Å; T45-L49 WeakPolarHBondContact O-CG 3.49Å; T45-L49 PolarHBondContact O-N 2.99Å; T45-L49 VanDerWaalsContact O-N 3.09Å; E46-L49 PolarHBondContact O-N 3.39Å; T47-L49 PolarHBondContact O-N 2.96Å; L49-G51 PolarHBondContact O-N 3.26Å; L49-C52 VanDerWaalsContact O-CB 3.22Å; L49-C52 WeakPolarHBondContact O-CB 3.39Å; L49-C52 PolarHBondContact O-N 3.04Å; L49-V109 HydrophobicContact CD2-CB 4.41Å; L49-V109 HydrophobicContact CD2-CG1 3.98Å; L49-V109 HydrophobicContact CD2-CG2 4.01Å; L49-L112 HydrophobicContact CD1-CB 4.38Å; L49-L112 HydrophobicContact CD1-CD1 4.35Å; L49-L112 HydrophobicContact CD2-CD1 3.79Å; L49-L112 HydrophobicContact CG-CD1 3.99Å; L49-I113 HydrophobicContact CD1-CD1 4.09Å; L49-L154 HydrophobicContact CB-CD2 4.41Å; L49-L154 HydrophobicContact CD1-CD2 4.17Å; L49-L158 HydrophobicContact CB-CD1 3.88Å; L49-L158 HydrophobicContact CD1-CD1 3.71Å; L49-L158 HydrophobicContact CG-CD1 4.39Å
50	R	84.1	Confident	79.9	Confident	172 Å²	172	64.8 Å²	64.8	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-57.4	-36.2	177.3	-177.7	177.6	-79.2	-170.1	-3.3	112.7	E46 T47 C52	E46-R50 WeakPolarHBondContact O-CB 3.45Å; E46-R50 PolarHBondContact O-N 3.27Å; E46-R50 IonicContact OE1-NH2 2.78Å; E46-R50 PolarHBondContact OE1-NH2 3.05Å; E46-R50 VanDerWaalsContact OE1-NH2 3.15Å; T47-R50 PolarHBondContact O-N 3.42Å; R50-C52 VanDerWaalsContact C-N 3.35Å
51	G	70.1	Confident	79.5	Confident	63 Å²	63	65.7 Å²	65.7	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	0.9	178.3	0	0	0	0	0	114.5	L49 K53	L49-G51 PolarHBondContact O-N 3.26Å; G51-K53 PolarHBondContact O-N 3.29Å
52	C	71.5	Confident	79.2	Confident	36 Å²	36	64.2 Å²	64.2	24%	0.243	39%	0.389	C	S	.	.			trans	-76.4	98.1	-173.7	-158.9	0	0	0	0	111.1	L49 R50 C56	L49-C52 VanDerWaalsContact O-CB 3.22Å; L49-C52 WeakPolarHBondContact O-CB 3.39Å; L49-C52 PolarHBondContact O-N 3.04Å; R50-C52 VanDerWaalsContact C-N 3.35Å; C52-C56 HydrophobicContact CB-CB 3.78Å; C52-C56 WeakPolarHBondContact CB-SG 3.23Å; C52-C56 WeakPolarHBondContact SG-CB 3.49Å; C52-C56 CovalentContact SG-SG 2Å; C52-C56 PolarHBondContact SG-SG 2.69Å
53	K	67.8	Low	79	Confident	188 Å²	188	67 Å²	67	82%	0.817	41%	0.406	S	S	*	.			trans	-80.3	-142.4	175.2	-62.9	-176.9	179.9	179	0	111.1	G51 G55 C56	G51-K53 PolarHBondContact O-N 3.29Å; K53-G55 PolarHBondContact O-N 2.78Å; K53-C56 PolarHBondContact O-N 2.75Å
54	A	57	Low	78.8	Confident	109 Å²	109	60.5 Å²	60.5	90%	0.901	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-10.9	-171.5	0	0	0	0	0	117.8
55	G	56	Low	78.7	Confident	30 Å²	30	56.8 Å²	56.8	31%	0.309	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-6.6	174.8	0	0	0	0	0	115.8	K53 R106	K53-G55 PolarHBondContact O-N 2.78Å; G55-R106 WeakPolarHBondContact O-CD 3.42Å; G55-R106 WeakPolarHBondContact O-CG 3.49Å
56	C	66.5	Low	78.6	Confident	7 Å²	7	58.5 Å²	58.5	5%	0.047	37%	0.37	C	S	.	.	S	Bend	trans	-87.2	-17.6	172.3	-91.3	0	0	0	0	113.4	C52 K53 V58 V104	C52-C56 HydrophobicContact CB-CB 3.78Å; C52-C56 WeakPolarHBondContact CB-SG 3.23Å; C52-C56 WeakPolarHBondContact SG-CB 3.49Å; C52-C56 CovalentContact SG-SG 2Å; C52-C56 PolarHBondContact SG-SG 2.69Å; K53-C56 PolarHBondContact O-N 2.75Å; C56-V58 HydrophobicContact CB-CG2 4.47Å; C56-V58 WeakPolarHBondContact O-CG2 3.41Å; C56-V58 PolarHBondContact O-N 2.87Å; C56-V104 WeakPolarHBondContact O-CG1 3.5Å
57	G	59.7	Low	78.5	Confident	44 Å²	44	59.1 Å²	59.1	45%	0.454	38%	0.375	S	S	.	.			trans	50.6	19.1	166.1	0	0	0	0	0	116.7	T59	G57-T59 VanDerWaalsContact C-N 3.34Å; G57-T59 PolarHBondContact O-N 3.47Å
58	V	67.4	Low	78.2	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.145	38%	0.379	C	S	.	.			trans	-81.6	88	-174.5	-175.3	0	0	0	0	108.1	C56 F62 V100 V104 L154	C56-V58 HydrophobicContact CB-CG2 4.47Å; C56-V58 WeakPolarHBondContact O-CG2 3.41Å; C56-V58 PolarHBondContact O-N 2.87Å; V58-F62 HydrophobicContact CG1-CE2 3.51Å; V58-F62 HydrophobicContact CG1-CZ 3.32Å; V58-V100 HydrophobicContact CG1-CG2 3.94Å; V58-V100 HydrophobicContact CG2-CG1 3.94Å; V58-V104 HydrophobicContact CG2-CG1 3.87Å; V58-L154 HydrophobicContact CB-CB 4.14Å; V58-L154 HydrophobicContact CG1-CB 4.23Å; V58-L154 HydrophobicContact CG2-CB 3.97Å; V58-L154 HydrophobicContact CG2-CD2 3.86Å; V58-L154 HydrophobicContact CG2-CG 4.38Å
59	T	67.6	Low	77.9	Confident	130 Å²	130	59.2 Å²	59.2	80%	0.798	37%	0.366	S	S	*	.			trans	-99.9	106.8	168.5	53.3	0	0	0	0	107.8	G57	G57-T59 VanDerWaalsContact C-N 3.34Å; G57-T59 PolarHBondContact O-N 3.47Å
60	G	73.6	Confident	77.8	Confident	30 Å²	30	62.8 Å²	62.8	31%	0.309	39%	0.385	S	S	.	.			trans	-178.5	150.1	-178.9	0	0	0	0	0	111.3	F62	G60-F62 VanDerWaalsContact O-CE2 3.32Å; G60-F62 WeakPolarHBondContact O-CE2 3.26Å
61	T	88.8	Confident	77.8	Confident	96 Å²	96	60.8 Å²	60.8	59%	0.589	38%	0.381	S	S	*	.			trans	-99.8	119.4	167.6	-61.8	0	0	0	0	107.7	K150 V151	T61-K150 HydrophobicContact CG2-CB 3.68Å; T61-K150 HydrophobicContact CG2-CD 3.85Å; T61-K150 HydrophobicContact CG2-CG 3.88Å; T61-V151 WeakPolarHBondContact CA-O 3.4Å
62	F	90.4	Very high	78.5	Confident	12 Å²	12	62.9 Å²	62.9	5%	0.053	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.8	-178.1	-50.2	-78.7	0	0	0	110	V58 G60 A96 A99 V100 K150 V151 L157	V58-F62 HydrophobicContact CG1-CE2 3.51Å; V58-F62 HydrophobicContact CG1-CZ 3.32Å; G60-F62 VanDerWaalsContact O-CE2 3.32Å; G60-F62 WeakPolarHBondContact O-CE2 3.26Å; F62-A96 HydrophobicContact CB-CB 4Å; F62-A96 HydrophobicContact CD1-CB 4.1Å; F62-A96 HydrophobicContact CG-CB 4.35Å; F62-A99 HydrophobicContact CD1-CB 4.45Å; F62-A99 HydrophobicContact CE1-CB 4.01Å; F62-V100 HydrophobicContact CD1-CG2 4.4Å; F62-V100 HydrophobicContact CE1-CG2 3.71Å; F62-V100 HydrophobicContact CE2-CG2 4.31Å; F62-V100 HydrophobicContact CZ-CG2 3.67Å; F62-K150 CarbonylContact O-C 3.53Å; F62-K150 VanDerWaalsContact O-CA 3.3Å; F62-K150 WeakPolarHBondContact O-CA 3.38Å; F62-V151 HydrophobicContact CB-CG2 3.85Å; F62-V151 HydrophobicContact CD2-CG2 4.33Å; F62-V151 PolarHBondContact N-O 3.37Å; F62-V151 PolarHBondContact O-N 3.44Å; F62-L157 HydrophobicContact CD2-CD2 4.48Å; F62-L157 HydrophobicContact CG-CD2 4.34Å
63	V	92	Very high	79	Confident	60 Å²	60	64.8 Å²	64.8	36%	0.364	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.7	171.2	-178	0	0	0	0	108	L92 T148 K150	V63-L92 HydrophobicContact CG1-CD2 4.41Å; V63-T148 HydrophobicContact CG1-CG2 4.2Å; V63-K150 HydrophobicContact CG2-CG 4.43Å
64	V	92.8	Very high	79.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.2	-179	-62.5	0	0	0	0	109.9	F93 T148 R149 V151 L157 V160	V64-F93 HydrophobicContact CB-CE1 4.11Å; V64-F93 HydrophobicContact CG1-CD1 4.39Å; V64-F93 HydrophobicContact CG1-CE1 4.08Å; V64-T148 CarbonylContact O-C 3.54Å; V64-T148 WeakPolarHBondContact O-CA 3.4Å; V64-T148 WeakPolarHBondContact O-CB 3.46Å; V64-R149 HydrophobicContact CG2-CG 3.66Å; V64-R149 WeakPolarHBondContact CG2-O 3.27Å; V64-R149 PolarHBondContact N-O 3.17Å; V64-R149 PolarHBondContact O-N 3.01Å; V64-V151 HydrophobicContact CG1-CG2 3.79Å; V64-V151 HydrophobicContact CG2-CG1 3.67Å; V64-V151 HydrophobicContact CG2-CG2 4.13Å; V64-L157 HydrophobicContact CG1-CD1 3.34Å; V64-V160 HydrophobicContact CB-CG1 4.09Å; V64-V160 HydrophobicContact CG2-CB 4.48Å; V64-V160 HydrophobicContact CG2-CG1 3.85Å
65	P	92.4	Very high	80.8	Confident	7 Å²	7	60 Å²	60	5%	0.045	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	152.2	175	29.9	-37.4	0	0	0	110.7	L92 F93 F164	P65-L92 HydrophobicContact CB-CD1 4.43Å; P65-F93 HydrophobicContact CG-CD2 4.16Å; P65-F93 HydrophobicContact CG-CE1 4.37Å; P65-F93 HydrophobicContact CG-CE2 3.35Å; P65-F93 HydrophobicContact CG-CZ 3.48Å; P65-F93 VanDerWaalsContact CG-CZ 3.48Å; P65-F164 HydrophobicContact CB-CD2 4.38Å; P65-F164 HydrophobicContact CB-CE2 4.08Å; P65-F164 HydrophobicContact CG-CD2 3.9Å; P65-F164 HydrophobicContact CG-CE2 3.87Å; P65-F164 HydrophobicContact CG-CZ 4.47Å
66	L	91.1	Very high	82.1	Confident	46 Å²	46	64.2 Å²	64.2	24%	0.241	37%	0.374	C	S	.	.			trans	-64.6	145.9	163.8	-71.2	-168.8	0	0	0	110.6	N68 S146 A147 R149 K168	L66-N68 WeakPolarHBondContact CB-OD1 3.39Å; L66-S146 WeakPolarHBondContact CD1-O 3.46Å; L66-A147 PolarHBondContact N-O 3.42Å; L66-R149 HydrophobicContact CD2-CB 3.79Å; L66-R149 HydrophobicContact CD2-CG 3.87Å; L66-K168 WeakPolarHBondContact O-CE 3.32Å; L66-K168 PolarHBondContact O-NZ 3.27Å
67	T	89.3	Confident	82.8	Confident	34 Å²	34	66 Å²	66	21%	0.209	38%	0.381	C	S	.	.			trans	-114.6	-5.5	-177.5	49	0	0	0	0	113.7	V160 N163 F164	T67-V160 HydrophobicContact CG2-CG1 3.66Å; T67-V160 WeakPolarHBondContact CG2-O 3.41Å; T67-N163 HydrophobicContact CG2-CB 4.24Å; T67-F164 HydrophobicContact CG2-CB 3.74Å; T67-F164 HydrophobicContact CG2-CD2 4.2Å; T67-F164 HydrophobicContact CG2-CG 4.49Å
68	N	85.9	Confident	83.9	Confident	104 Å²	104	68.5 Å²	68.5	56%	0.556	38%	0.384	S	S	*	.			trans	-62.7	143	172.6	62	-39.2	0	0	0	110	L66 K168	L66-N68 WeakPolarHBondContact CB-OD1 3.39Å; N68-K168 WeakPolarHBondContact O-CE 3.4Å; N68-K168 PolarHBondContact O-NZ 3.24Å
69	V	84.1	Confident	84.6	Confident	39 Å²	39	69.2 Å²	69.2	24%	0.236	39%	0.388	C	S	.	.			trans	-119.7	116.8	174.7	177.9	0	0	0	0	105.7	F71 L74 K168 L171	V69-F71 HydrophobicContact CG1-CD1 4.21Å; V69-F71 HydrophobicContact CG1-CE1 4.12Å; V69-F71 HydrophobicContact CG1-CZ 4.34Å; V69-L74 HydrophobicContact CG1-CB 4.43Å; V69-L74 HydrophobicContact CG1-CD2 3.84Å; V69-K168 HydrophobicContact CG2-CG 3.96Å; V69-L171 HydrophobicContact CB-CD1 4.18Å; V69-L171 HydrophobicContact CG1-CD1 3.57Å; V69-L171 HydrophobicContact CG2-CD1 3.73Å
70	D	85.8	Confident	85.2	Confident	88 Å²	88	66.3 Å²	66.3	47%	0.471	37%	0.366	S	S	.	.			trans	-89.8	112.1	165.2	-175	-34.8	0	0	0	107.1	V72 V73 L74	D70-V72 VanDerWaalsContact C-N 3.3Å; D70-V72 PolarHBondContact O-N 3.17Å; D70-V72 WeakPolarHBondContact OD1-CB 3.5Å; D70-V72 PolarHBondContact OD1-N 2.98Å; D70-V73 HydrophobicContact CB-CB 4.06Å; D70-V73 HydrophobicContact CB-CG2 3.99Å; D70-V73 PolarHBondContact O-N 3.25Å; D70-V73 PolarHBondContact OD1-N 3.04Å; D70-L74 VanDerWaalsContact O-CB 3.26Å; D70-L74 WeakPolarHBondContact O-CB 3.49Å; D70-L74 PolarHBondContact O-N 3.03Å
71	F	84.7	Confident	85.7	Confident	129 Å²	129	69 Å²	69	57%	0.566	37%	0.37	S	S	*	.	H	α-helix	trans	-67.7	-30.4	-176	-69	-79.3	0	0	0	112.5	V69 L74 E75 L171	V69-F71 HydrophobicContact CG1-CD1 4.21Å; V69-F71 HydrophobicContact CG1-CE1 4.12Å; V69-F71 HydrophobicContact CG1-CZ 4.34Å; F71-L74 HydrophobicContact CD1-CD2 4.19Å; F71-L74 PolarHBondContact O-N 2.62Å; F71-E75 WeakPolarHBondContact O-CG 3.48Å; F71-E75 PolarHBondContact O-N 3.45Å; F71-L171 HydrophobicContact CE1-CD1 4.41Å; F71-L171 HydrophobicContact CE1-CD2 4.38Å
72	V	84.1	Confident	85.5	Confident	107 Å²	107	64.9 Å²	64.9	65%	0.648	35%	0.345	S	S	*	.	H	α-helix	trans	-67.9	-43.6	177.6	-179	0	0	0	0	109.8	D70	D70-V72 VanDerWaalsContact C-N 3.3Å; D70-V72 PolarHBondContact O-N 3.17Å; D70-V72 WeakPolarHBondContact OD1-CB 3.5Å; D70-V72 PolarHBondContact OD1-N 2.98Å
73	V	82.8	Confident	85.3	Confident	76 Å²	76	64.4 Å²	64.4	46%	0.461	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-44.2	173.9	178.7	0	0	0	0	110.2	D70 E75 T76 K77	D70-V73 HydrophobicContact CB-CB 4.06Å; D70-V73 HydrophobicContact CB-CG2 3.99Å; D70-V73 PolarHBondContact O-N 3.25Å; D70-V73 PolarHBondContact OD1-N 3.04Å; V73-E75 PolarHBondContact O-N 3.46Å; V73-T76 PolarHBondContact O-N 3.1Å; V73-T76 PolarHBondContact O-OG1 3.23Å; V73-T76 VanDerWaalsContact O-OG1 3.08Å; V73-K77 VanDerWaalsContact O-CB 3.27Å; V73-K77 WeakPolarHBondContact O-CB 3.37Å; V73-K77 PolarHBondContact O-N 3.16Å
74	L	82.4	Confident	84.9	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.141	34%	0.342	C	S	.	.	H	α-helix	trans	-59	-42	-177.8	-174.2	73.2	0	0	0	113	V69 D70 F71 T76 K77 Q82 L171	V69-L74 HydrophobicContact CG1-CB 4.43Å; V69-L74 HydrophobicContact CG1-CD2 3.84Å; D70-L74 VanDerWaalsContact O-CB 3.26Å; D70-L74 WeakPolarHBondContact O-CB 3.49Å; D70-L74 PolarHBondContact O-N 3.03Å; F71-L74 HydrophobicContact CD1-CD2 4.19Å; F71-L74 PolarHBondContact O-N 2.62Å; L74-T76 PolarHBondContact O-N 3.23Å; L74-K77 PolarHBondContact O-N 3.4Å; L74-Q82 VanDerWaalsContact CD1-CD 3.43Å; L74-Q82 HydrophobicContact CD1-CG 4.07Å; L74-Q82 PolarHBondContact O-NE2 2.95Å; L74-L171 HydrophobicContact CD2-CB 4.32Å; L74-L171 HydrophobicContact CD2-CD1 3.87Å; L74-L171 HydrophobicContact CD2-CD2 4.22Å; L74-L171 HydrophobicContact CD2-CG 4.37Å
75	E	79.8	Confident	84.7	Confident	169 Å²	169	67.3 Å²	67.3	79%	0.79	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-32.2	180	-79.2	178.1	173.8	0	0	112.9	F71 V73	F71-E75 WeakPolarHBondContact O-CG 3.48Å; F71-E75 PolarHBondContact O-N 3.45Å; V73-E75 PolarHBondContact O-N 3.46Å
76	T	82.9	Confident	84.6	Confident	120 Å²	120	67.1 Å²	67.1	74%	0.736	35%	0.353	S	S	*	.	H	α-helix	trans	-96.1	-8.6	-179	61.2	0	0	0	0	113.2	V73 L74	V73-T76 PolarHBondContact O-N 3.1Å; V73-T76 PolarHBondContact O-OG1 3.23Å; V73-T76 VanDerWaalsContact O-OG1 3.08Å; L74-T76 PolarHBondContact O-N 3.23Å
77	K	81.4	Confident	84.5	Confident	43 Å²	43	66.6 Å²	66.6	19%	0.187	35%	0.349	C	S	.	.	S	Bend	trans	-84.4	130.9	-173.7	-169.7	170.9	-168.5	171.4	0	111.7	V73 L74 E81 Q82 E85	V73-K77 VanDerWaalsContact O-CB 3.27Å; V73-K77 WeakPolarHBondContact O-CB 3.37Å; V73-K77 PolarHBondContact O-N 3.16Å; L74-K77 PolarHBondContact O-N 3.4Å; K77-E81 WeakPolarHBondContact CE-OE1 3.43Å; K77-E81 HydrophobicContact CG-CB 4.11Å; K77-E81 HydrophobicContact CG-CG 4.45Å; K77-E81 IonicContact NZ-OE1 2.85Å; K77-E81 PolarHBondContact NZ-OE1 3.35Å; K77-Q82 HydrophobicContact CB-CG 4.34Å; K77-Q82 HydrophobicContact CD-CG 3.96Å; K77-Q82 HydrophobicContact CG-CG 3.97Å; K77-Q82 PolarHBondContact O-NE2 2.85Å; K77-E85 IonicContact NZ-OE2 2.62Å; K77-E85 PolarHBondContact NZ-OE2 2.99Å
78	D	83.3	Confident	84.5	Confident	97 Å²	97	66.9 Å²	66.9	52%	0.519	35%	0.352	S	S	.	.			trans	-61.6	145.9	179.3	-178.3	62.7	0	0	0	112.5	E80 E81 Q82	D78-E80 VanDerWaalsContact C-N 3.27Å; D78-E80 PolarHBondContact O-N 2.98Å; D78-E80 WeakPolarHBondContact OD2-CA 3.37Å; D78-E80 WeakPolarHBondContact OD2-CB 3.34Å; D78-E80 PolarHBondContact OD2-N 3.39Å; D78-E81 HydrophobicContact CB-CB 4.43Å; D78-E81 WeakPolarHBondContact O-CB 3.4Å; D78-E81 PolarHBondContact O-N 3.46Å; D78-E81 VanDerWaalsContact O-N 3.12Å; D78-Q82 WeakPolarHBondContact O-CG 3.42Å; D78-Q82 PolarHBondContact O-N 3.32Å
79	T	81.3	Confident	84.8	Confident	39 Å²	39	61.9 Å²	61.9	24%	0.239	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-32.1	-178.1	-57.1	0	0	0	0	111.6	E81 A83 L172	T79-E81 VanDerWaalsContact C-N 3.33Å; T79-A83 WeakPolarHBondContact O-CB 3.35Å; T79-A83 PolarHBondContact O-N 3.05Å; T79-L172 HydrophobicContact CG2-CD1 4.11Å
80	E	80.8	Confident	85.3	Confident	69 Å²	69	60.3 Å²	60.3	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-37.6	174.7	-161.1	173.3	152.6	0	0	110.6	D78 A83 L84 K133 L135	D78-E80 VanDerWaalsContact C-N 3.27Å; D78-E80 PolarHBondContact O-N 2.98Å; D78-E80 WeakPolarHBondContact OD2-CA 3.37Å; D78-E80 WeakPolarHBondContact OD2-CB 3.34Å; D78-E80 PolarHBondContact OD2-N 3.39Å; E80-A83 WeakPolarHBondContact O-CB 3.5Å; E80-A83 PolarHBondContact O-N 3.08Å; E80-L84 WeakPolarHBondContact O-CB 3.21Å; E80-L84 WeakPolarHBondContact O-CG 3.45Å; E80-L84 PolarHBondContact O-N 2.9Å; E80-K133 IonicContact OE1-NZ 3.18Å; E80-K133 PolarHBondContact OE1-NZ 3.49Å; E80-K133 IonicContact OE2-NZ 2.58Å; E80-K133 PolarHBondContact OE2-NZ 3.36Å; E80-L135 HydrophobicContact CG-CD1 4.2Å
81	E	83.4	Confident	85.6	Confident	86 Å²	86	61 Å²	61	40%	0.402	32%	0.315	S	S	.	.	H	α-helix	trans	-71	-41.4	177.2	-157.7	-169	152.5	0	0	112.3	K77 D78 T79 A83 L84 E85	K77-E81 WeakPolarHBondContact CE-OE1 3.43Å; K77-E81 HydrophobicContact CG-CB 4.11Å; K77-E81 HydrophobicContact CG-CG 4.45Å; K77-E81 IonicContact NZ-OE1 2.85Å; K77-E81 PolarHBondContact NZ-OE1 3.35Å; D78-E81 HydrophobicContact CB-CB 4.43Å; D78-E81 WeakPolarHBondContact O-CB 3.4Å; D78-E81 PolarHBondContact O-N 3.46Å; D78-E81 VanDerWaalsContact O-N 3.12Å; T79-E81 VanDerWaalsContact C-N 3.33Å; E81-A83 VanDerWaalsContact C-N 3.29Å; E81-A83 PolarHBondContact O-N 3.21Å; E81-L84 WeakPolarHBondContact O-CB 3.48Å; E81-L84 PolarHBondContact O-N 2.81Å; E81-E85 WeakPolarHBondContact O-CB 3.31Å; E81-E85 PolarHBondContact O-N 2.85Å
82	Q	85.4	Confident	86	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-40.6	173.2	-66.8	-178.9	37.7	0	0	111.5	L74 K77 D78 E85 V86 L172	L74-Q82 VanDerWaalsContact CD1-CD 3.43Å; L74-Q82 HydrophobicContact CD1-CG 4.07Å; L74-Q82 PolarHBondContact O-NE2 2.95Å; K77-Q82 HydrophobicContact CB-CG 4.34Å; K77-Q82 HydrophobicContact CD-CG 3.96Å; K77-Q82 HydrophobicContact CG-CG 3.97Å; K77-Q82 PolarHBondContact O-NE2 2.85Å; D78-Q82 WeakPolarHBondContact O-CG 3.42Å; D78-Q82 PolarHBondContact O-N 3.32Å; Q82-E85 PolarHBondContact O-N 3.25Å; Q82-V86 WeakPolarHBondContact O-CG2 3.38Å; Q82-V86 PolarHBondContact O-N 3.32Å; Q82-L172 HydrophobicContact CB-CD1 3.91Å
83	A	85.4	Confident	86.6	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-46.4	175.4	0	0	0	0	0	113.5	T79 E80 E81 E85 V86 Q87 I132 L172	T79-A83 WeakPolarHBondContact O-CB 3.35Å; T79-A83 PolarHBondContact O-N 3.05Å; E80-A83 WeakPolarHBondContact O-CB 3.5Å; E80-A83 PolarHBondContact O-N 3.08Å; E81-A83 VanDerWaalsContact C-N 3.29Å; E81-A83 PolarHBondContact O-N 3.21Å; A83-E85 VanDerWaalsContact C-N 3.29Å; A83-E85 PolarHBondContact O-N 2.78Å; A83-V86 PolarHBondContact O-N 2.85Å; A83-Q87 WeakPolarHBondContact O-CG 2.95Å; A83-Q87 PolarHBondContact O-N 3.28Å; A83-I132 HydrophobicContact CB-CB 4.24Å; A83-I132 HydrophobicContact CB-CD1 4.33Å; A83-I132 HydrophobicContact CB-CG1 4.34Å; A83-I132 HydrophobicContact CB-CG2 3.03Å; A83-L172 HydrophobicContact CB-CD1 4.14Å; A83-L172 HydrophobicContact CB-CD2 4.35Å
84	L	84.6	Confident	87.1	Confident	65 Å²	65	48.6 Å²	48.6	34%	0.34	25%	0.253	S	S	.	.	H	α-helix	trans	-56.6	-46.1	174.9	-88.4	173.8	0	0	0	111.7	E80 E81 V86 Q87 S88 L135	E80-L84 WeakPolarHBondContact O-CB 3.21Å; E80-L84 WeakPolarHBondContact O-CG 3.45Å; E80-L84 PolarHBondContact O-N 2.9Å; E81-L84 WeakPolarHBondContact O-CB 3.48Å; E81-L84 PolarHBondContact O-N 2.81Å; L84-V86 VanDerWaalsContact C-N 3.31Å; L84-V86 PolarHBondContact O-N 3.34Å; L84-Q87 PolarHBondContact O-N 3.43Å; L84-S88 VanDerWaalsContact O-CB 3.28Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 3.3Å; L84-L135 HydrophobicContact CD1-CD1 3.88Å; L84-L135 HydrophobicContact CD1-CD2 4.3Å; L84-L135 HydrophobicContact CD2-CB 3.47Å; L84-L135 VanDerWaalsContact CD2-CB 3.47Å; L84-L135 HydrophobicContact CD2-CD1 3.46Å; L84-L135 VanDerWaalsContact CD2-CD1 3.46Å; L84-L135 HydrophobicContact CD2-CD2 4.03Å; L84-L135 HydrophobicContact CD2-CG 3.78Å; L84-L135 HydrophobicContact CG-CD1 3.62Å; L84-L135 HydrophobicContact CG-CG 4.43Å
85	E	87.8	Confident	87.6	Confident	56 Å²	56	52.3 Å²	52.3	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-42.2	176.6	-178.1	173.4	-174.9	0	0	111.6	K77 E81 Q82 A83 G89 K168	K77-E85 IonicContact NZ-OE2 2.62Å; K77-E85 PolarHBondContact NZ-OE2 2.99Å; E81-E85 WeakPolarHBondContact O-CB 3.31Å; E81-E85 PolarHBondContact O-N 2.85Å; Q82-E85 PolarHBondContact O-N 3.25Å; A83-E85 VanDerWaalsContact C-N 3.29Å; A83-E85 PolarHBondContact O-N 2.78Å; E85-G89 PolarHBondContact O-N 3.06Å; E85-K168 HydrophobicContact CG-CD 4.41Å; E85-K168 VanDerWaalsContact OE1-CE 3.25Å; E85-K168 WeakPolarHBondContact OE1-CE 3.35Å; E85-K168 IonicContact OE1-NZ 2.75Å; E85-K168 PolarHBondContact OE1-NZ 2Å
86	V	90.5	Very high	88.2	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-47.6	175.9	167.9	0	0	0	0	111.7	Q82 A83 L84 G89 L90 L127 F164 K168 V169 L172	Q82-V86 WeakPolarHBondContact O-CG2 3.38Å; Q82-V86 PolarHBondContact O-N 3.32Å; A83-V86 PolarHBondContact O-N 2.85Å; L84-V86 VanDerWaalsContact C-N 3.31Å; L84-V86 PolarHBondContact O-N 3.34Å; V86-G89 PolarHBondContact O-N 3.1Å; V86-L90 HydrophobicContact CG1-CD1 4.2Å; V86-L90 HydrophobicContact CG1-CG 4.4Å; V86-L90 WeakPolarHBondContact O-CG 3.05Å; V86-L90 PolarHBondContact O-N 2.82Å; V86-L127 HydrophobicContact CG1-CD1 3.53Å; V86-F164 HydrophobicContact CB-CZ 4.45Å; V86-F164 HydrophobicContact CG1-CE1 4.39Å; V86-F164 HydrophobicContact CG1-CZ 4.49Å; V86-F164 HydrophobicContact CG2-CZ 4.41Å; V86-F164 WeakPolarHBondContact O-CZ 3.32Å; V86-K168 HydrophobicContact CG2-CB 4.15Å; V86-V169 HydrophobicContact CG1-CG2 3.87Å; V86-V169 HydrophobicContact CG2-CG2 4.4Å; V86-L172 HydrophobicContact CB-CD2 3.74Å; V86-L172 HydrophobicContact CG1-CD2 3.98Å; V86-L172 HydrophobicContact CG2-CB 4.23Å; V86-L172 HydrophobicContact CG2-CD2 3.72Å
87	Q	89.4	Confident	88.7	Confident	35 Å²	35	39 Å²	39	16%	0.164	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-45.5	179.6	-70.5	-68.2	-21.8	0	0	111.8	A83 L84 G89 L90 F91 G124	A83-Q87 WeakPolarHBondContact O-CG 2.95Å; A83-Q87 PolarHBondContact O-N 3.28Å; L84-Q87 PolarHBondContact O-N 3.43Å; Q87-G89 VanDerWaalsContact C-N 3.33Å; Q87-G89 PolarHBondContact O-N 3.02Å; Q87-L90 PolarHBondContact O-N 2.84Å; Q87-F91 WeakPolarHBondContact O-CB 3.34Å; Q87-F91 PolarHBondContact O-N 3.11Å; Q87-G124 PolarHBondContact NE2-O 3.3Å
88	S	89.5	Confident	89.3	Confident	40 Å²	40	37.3 Å²	37.3	28%	0.28	20%	0.196	S	C	.	.	H	α-helix	trans	-60.2	-43.4	175.2	-177.3	0	0	0	0	111.4	L84 F91 L92	L84-S88 VanDerWaalsContact O-CB 3.28Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 3.3Å; S88-F91 WeakPolarHBondContact O-CB 3.48Å; S88-F91 PolarHBondContact O-N 3.19Å; S88-L92 WeakPolarHBondContact O-CG 3.48Å; S88-L92 PolarHBondContact O-N 3.12Å
89	G	92.5	Very high	89.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-45.4	176.3	0	0	0	0	0	113.3	E85 V86 Q87 F91 L92 F93	E85-G89 PolarHBondContact O-N 3.06Å; V86-G89 PolarHBondContact O-N 3.1Å; Q87-G89 VanDerWaalsContact C-N 3.33Å; Q87-G89 PolarHBondContact O-N 3.02Å; G89-F91 VanDerWaalsContact C-N 3.3Å; G89-F91 PolarHBondContact O-N 3.09Å; G89-L92 PolarHBondContact O-N 3Å; G89-F93 WeakPolarHBondContact O-CD2 3.3Å; G89-F93 PolarHBondContact O-N 2.95Å
90	L	93.7	Very high	90.1	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-40.8	174.5	-70.5	179.8	0	0	0	111.8	V86 Q87 F93 G94 I120 L123 L127 F164 L165	V86-L90 HydrophobicContact CG1-CD1 4.2Å; V86-L90 HydrophobicContact CG1-CG 4.4Å; V86-L90 WeakPolarHBondContact O-CG 3.05Å; V86-L90 PolarHBondContact O-N 2.82Å; Q87-L90 PolarHBondContact O-N 2.84Å; L90-F93 PolarHBondContact O-N 3.43Å; L90-G94 PolarHBondContact O-N 3.45Å; L90-I120 HydrophobicContact CB-CG2 4.07Å; L90-I120 HydrophobicContact CD2-CG2 4.25Å; L90-I120 WeakPolarHBondContact O-CG2 3.5Å; L90-L123 HydrophobicContact CD1-CD2 4.28Å; L90-L123 HydrophobicContact CD1-CG 4.21Å; L90-L123 HydrophobicContact CD2-CD2 4.01Å; L90-L127 HydrophobicContact CD1-CD1 3.78Å; L90-F164 HydrophobicContact CD2-CD1 4.44Å; L90-F164 HydrophobicContact CD2-CE1 4Å; L90-F164 HydrophobicContact CG-CE1 4.12Å; L90-L165 HydrophobicContact CD2-CD2 4.4Å
91	F	91.9	Very high	90.7	Very high	104 Å²	104	33.9 Å²	33.9	46%	0.456	18%	0.177	S	C	.	.	H	α-helix	trans	-62	-46.1	175.5	175.8	-107.6	0	0	0	112.3	Q87 S88 G89 F93 G94 Q95 L137	Q87-F91 WeakPolarHBondContact O-CB 3.34Å; Q87-F91 PolarHBondContact O-N 3.11Å; S88-F91 WeakPolarHBondContact O-CB 3.48Å; S88-F91 PolarHBondContact O-N 3.19Å; G89-F91 VanDerWaalsContact C-N 3.3Å; G89-F91 PolarHBondContact O-N 3.09Å; F91-F93 VanDerWaalsContact C-N 3.35Å; F91-F93 PolarHBondContact O-N 3.43Å; F91-G94 PolarHBondContact O-N 3.02Å; F91-Q95 HydrophobicContact CE1-CG 4.33Å; F91-Q95 HydrophobicContact CE2-CG 4.35Å; F91-Q95 HydrophobicContact CZ-CG 4.12Å; F91-Q95 PolarHBondContact O-N 2.92Å; F91-L137 HydrophobicContact CB-CD1 4.39Å; F91-L137 HydrophobicContact CD2-CD1 4.22Å; F91-L137 HydrophobicContact CG-CD1 4.21Å
92	L	94.1	Very high	91	Very high	28 Å²	28	37.4 Å²	37.4	15%	0.147	19%	0.194	C	C	.	.	H	α-helix	trans	-59.8	-42.6	175.7	-71.3	174	0	0	0	112.1	V63 P65 S88 G89 Q95 A96 T148	V63-L92 HydrophobicContact CG1-CD2 4.41Å; P65-L92 HydrophobicContact CB-CD1 4.43Å; S88-L92 WeakPolarHBondContact O-CG 3.48Å; S88-L92 PolarHBondContact O-N 3.12Å; G89-L92 PolarHBondContact O-N 3Å; L92-Q95 PolarHBondContact O-N 3.17Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.45Å; L92-T148 HydrophobicContact CD1-CG2 3.72Å
93	F	95.3	Very high	91.1	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-40.6	174.6	-70.3	-59.9	0	0	0	112.3	V64 P65 G89 L90 F91 Q95 A96 L97 I120 L157 V160 H161 F164	V64-F93 HydrophobicContact CB-CE1 4.11Å; V64-F93 HydrophobicContact CG1-CD1 4.39Å; V64-F93 HydrophobicContact CG1-CE1 4.08Å; P65-F93 HydrophobicContact CG-CD2 4.16Å; P65-F93 HydrophobicContact CG-CE1 4.37Å; P65-F93 HydrophobicContact CG-CE2 3.35Å; P65-F93 HydrophobicContact CG-CZ 3.48Å; P65-F93 VanDerWaalsContact CG-CZ 3.48Å; G89-F93 WeakPolarHBondContact O-CD2 3.3Å; G89-F93 PolarHBondContact O-N 2.95Å; L90-F93 PolarHBondContact O-N 3.43Å; F91-F93 VanDerWaalsContact C-N 3.35Å; F91-F93 PolarHBondContact O-N 3.43Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.36Å; F93-A96 PolarHBondContact O-N 2.96Å; F93-L97 WeakPolarHBondContact O-CB 3.37Å; F93-L97 VanDerWaalsContact O-CG 3.29Å; F93-L97 WeakPolarHBondContact O-CG 3.03Å; F93-L97 PolarHBondContact O-N 3.37Å; F93-I120 HydrophobicContact CB-CD1 3.76Å; F93-L157 HydrophobicContact CD1-CD1 3.96Å; F93-L157 HydrophobicContact CE1-CD1 4.28Å; F93-V160 HydrophobicContact CE1-CB 4.45Å; F93-V160 HydrophobicContact CE1-CG1 4.04Å; F93-V160 HydrophobicContact CZ-CG1 3.94Å; F93-H161 HydrophobicContact CD1-CB 3.9Å; F93-H161 AromaticContact CD2-CD2 3.95Å; F93-H161 HydrophobicContact CE1-CB 3.77Å; F93-H161 HydrophobicContact CG-CB 4.41Å; F93-H161 HydrophobicContact CZ-CB 4.17Å; F93-F164 HydrophobicContact CD2-CD1 4.26Å; F93-F164 HydrophobicContact CE2-CB 3.66Å; F93-F164 AromaticContact CE2-CD1 3.63Å; F93-F164 HydrophobicContact CE2-CD1 3.63Å; F93-F164 HydrophobicContact CE2-CD2 4.07Å; F93-F164 HydrophobicContact CE2-CE1 4.17Å; F93-F164 AromaticContact CE2-CG 3.54Å; F93-F164 HydrophobicContact CE2-CG 3.54Å; F93-F164 HydrophobicContact CZ-CB 3.87Å; F93-F164 HydrophobicContact CZ-CG 4.18Å
94	G	93.8	Very high	91.2	Very high	21 Å²	21	39.2 Å²	39.2	22%	0.216	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-43.4	175	0	0	0	0	0	112.6	L90 F91 G98	L90-G94 PolarHBondContact O-N 3.45Å; F91-G94 PolarHBondContact O-N 3.02Å; G94-G98 PolarHBondContact O-N 3.12Å
95	Q	93.1	Very high	91.2	Very high	105 Å²	105	41 Å²	41	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-65.9	-49.4	174.9	-71.3	-172.6	90	0	0	112.2	F91 L92 F93 L97 G98 A99	F91-Q95 HydrophobicContact CE1-CG 4.33Å; F91-Q95 HydrophobicContact CE2-CG 4.35Å; F91-Q95 HydrophobicContact CZ-CG 4.12Å; F91-Q95 PolarHBondContact O-N 2.92Å; L92-Q95 PolarHBondContact O-N 3.17Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.36Å; Q95-L97 VanDerWaalsContact C-N 3.35Å; Q95-L97 PolarHBondContact O-N 3.44Å; Q95-G98 WeakPolarHBondContact O-CA 3.4Å; Q95-G98 PolarHBondContact O-N 2.93Å; Q95-A99 PolarHBondContact O-N 3.47Å
96	A	93.2	Very high	91.2	Very high	7 Å²	7	44.7 Å²	44.7	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-45.1	-179.6	0	0	0	0	0	111.8	F62 L92 F93 G98 A99 V100 L157	F62-A96 HydrophobicContact CB-CB 4Å; F62-A96 HydrophobicContact CD1-CB 4.1Å; F62-A96 HydrophobicContact CG-CB 4.35Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.45Å; F93-A96 PolarHBondContact O-N 2.96Å; A96-G98 VanDerWaalsContact C-N 3.31Å; A96-G98 PolarHBondContact O-N 2.81Å; A96-A99 PolarHBondContact O-N 3.48Å; A96-V100 WeakPolarHBondContact O-CG2 3.36Å; A96-V100 PolarHBondContact O-N 3.46Å; A96-L157 HydrophobicContact CB-CD1 3.73Å; A96-L157 HydrophobicContact CB-CD2 3.98Å
97	L	93.3	Very high	91.2	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-30.7	175.6	-69.2	173.5	0	0	0	112.4	F93 Q95 V100 R101 I113 N116 K117 I120 L157 L158	F93-L97 WeakPolarHBondContact O-CB 3.37Å; F93-L97 VanDerWaalsContact O-CG 3.29Å; F93-L97 WeakPolarHBondContact O-CG 3.03Å; F93-L97 PolarHBondContact O-N 3.37Å; Q95-L97 VanDerWaalsContact C-N 3.35Å; Q95-L97 PolarHBondContact O-N 3.44Å; L97-V100 PolarHBondContact O-N 2.86Å; L97-R101 WeakPolarHBondContact O-CB 3.47Å; L97-R101 PolarHBondContact O-N 3.3Å; L97-I113 HydrophobicContact CB-CG2 4Å; L97-I113 HydrophobicContact CD2-CD1 3.86Å; L97-I113 HydrophobicContact CD2-CG2 4.33Å; L97-I113 WeakPolarHBondContact O-CG2 3.49Å; L97-N116 HydrophobicContact CD1-CB 4.22Å; L97-K117 HydrophobicContact CB-CD 4.16Å; L97-K117 HydrophobicContact CB-CG 3.71Å; L97-K117 HydrophobicContact CD1-CG 4.27Å; L97-I120 HydrophobicContact CD1-CD1 3.41Å; L97-I120 VanDerWaalsContact CD1-CD1 3.41Å; L97-L157 HydrophobicContact CD2-CD2 4.06Å; L97-L158 HydrophobicContact CD2-CD2 4.1Å
98	G	93.1	Very high	91.1	Very high	9 Å²	9	49.8 Å²	49.8	9%	0.093	29%	0.285	C	S	.	.	H	α-helix	trans	-58.1	-51.3	169.2	0	0	0	0	0	112.3	G94 Q95 A96 V100 R101 E102	G94-G98 PolarHBondContact O-N 3.12Å; Q95-G98 WeakPolarHBondContact O-CA 3.4Å; Q95-G98 PolarHBondContact O-N 2.93Å; A96-G98 VanDerWaalsContact C-N 3.31Å; A96-G98 PolarHBondContact O-N 2.81Å; G98-V100 VanDerWaalsContact C-N 3.35Å; G98-V100 PolarHBondContact O-N 3.48Å; G98-R101 WeakPolarHBondContact O-CB 3.47Å; G98-R101 PolarHBondContact O-N 3.46Å; G98-R101 VanDerWaalsContact O-N 3.16Å; G98-E102 PolarHBondContact O-N 3.17Å; G98-E102 VanDerWaalsContact O-N 3.12Å
99	A	91.6	Very high	91.1	Very high	43 Å²	43	48.1 Å²	48.1	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-38.6	177.4	0	0	0	0	0	112.6	F62 Q95 A96 E102 S103	F62-A99 HydrophobicContact CD1-CB 4.45Å; F62-A99 HydrophobicContact CE1-CB 4.01Å; Q95-A99 PolarHBondContact O-N 3.47Å; A96-A99 PolarHBondContact O-N 3.48Å; A99-E102 PolarHBondContact O-N 3.45Å; A99-S103 PolarHBondContact O-N 3.46Å; A99-S103 VanDerWaalsContact O-N 3.15Å; A99-S103 PolarHBondContact O-OG 2.85Å; A99-S103 VanDerWaalsContact O-OG 3.06Å
100	V	90.9	Very high	91.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-47.4	172.2	169.2	0	0	0	0	110.9	V58 F62 A96 L97 G98 E102 S103 V104 I113 L154 L157	V58-V100 HydrophobicContact CG1-CG2 3.94Å; V58-V100 HydrophobicContact CG2-CG1 3.94Å; F62-V100 HydrophobicContact CD1-CG2 4.4Å; F62-V100 HydrophobicContact CE1-CG2 3.71Å; F62-V100 HydrophobicContact CE2-CG2 4.31Å; F62-V100 HydrophobicContact CZ-CG2 3.67Å; A96-V100 WeakPolarHBondContact O-CG2 3.36Å; A96-V100 PolarHBondContact O-N 3.46Å; L97-V100 PolarHBondContact O-N 2.86Å; G98-V100 VanDerWaalsContact C-N 3.35Å; G98-V100 PolarHBondContact O-N 3.48Å; V100-E102 VanDerWaalsContact C-N 3.26Å; V100-E102 PolarHBondContact O-N 3.22Å; V100-S103 WeakPolarHBondContact CA-OG 3.37Å; V100-S103 PolarHBondContact O-N 2.91Å; V100-S103 PolarHBondContact O-OG 3.45Å; V100-V104 HydrophobicContact CG1-CG1 4.16Å; V100-V104 WeakPolarHBondContact O-CG1 3.44Å; V100-V104 WeakPolarHBondContact O-CG2 3.25Å; V100-V104 PolarHBondContact O-N 3.47Å; V100-V104 VanDerWaalsContact O-N 3.07Å; V100-I113 HydrophobicContact CG1-CD1 3.79Å; V100-I113 HydrophobicContact CG1-CG1 3.99Å; V100-L154 HydrophobicContact CB-CD1 4.45Å; V100-L154 HydrophobicContact CG1-CD1 3.72Å; V100-L154 HydrophobicContact CG1-CD2 4.36Å; V100-L154 HydrophobicContact CG2-CD1 3.92Å; V100-L157 HydrophobicContact CG2-CD2 3.75Å
101	R	91.7	Very high	91.1	Very high	89 Å²	89	54.1 Å²	54.1	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-58.5	-39.2	-179.1	-171.4	-159.3	-178.2	-91.5	-3.4	112.4	L97 G98 V104 I113 D114	L97-R101 WeakPolarHBondContact O-CB 3.47Å; L97-R101 PolarHBondContact O-N 3.3Å; G98-R101 WeakPolarHBondContact O-CB 3.47Å; G98-R101 PolarHBondContact O-N 3.46Å; G98-R101 VanDerWaalsContact O-N 3.16Å; R101-V104 WeakPolarHBondContact O-CG2 3.01Å; R101-I113 HydrophobicContact CB-CG2 3.86Å; R101-I113 HydrophobicContact CG-CG2 4.46Å; R101-D114 WeakPolarHBondContact CD-OD1 3.46Å; R101-D114 IonicContact CZ-OD1 3.73Å; R101-D114 IonicContact CZ-OD2 3.47Å; R101-D114 IonicContact NE-OD1 2.67Å; R101-D114 PolarHBondContact NE-OD1 3.36Å; R101-D114 IonicContact NE-OD2 3Å; R101-D114 PolarHBondContact NE-OD2 3.4Å; R101-D114 IonicContact NH2-OD1 3.94Å; R101-D114 IonicContact NH2-OD2 3.02Å; R101-D114 PolarHBondContact NH2-OD2 2.85Å
102	E	90.5	Very high	91.1	Very high	160 Å²	160	51.5 Å²	51.5	75%	0.748	30%	0.297	S	S	*	.	H	α-helix	trans	-71.7	-32.8	179.8	-71.5	171.9	-173.2	0	0	112.5	G98 A99 V100	G98-E102 PolarHBondContact O-N 3.17Å; G98-E102 VanDerWaalsContact O-N 3.12Å; A99-E102 PolarHBondContact O-N 3.45Å; V100-E102 VanDerWaalsContact C-N 3.26Å; V100-E102 PolarHBondContact O-N 3.22Å
103	S	86.8	Confident	91.1	Very high	48 Å²	48	50.1 Å²	50.1	34%	0.336	29%	0.29	S	S	.	.	H	α-helix	trans	-82.2	-24.6	179.9	54.5	0	0	0	0	114.4	A99 V100	A99-S103 PolarHBondContact O-N 3.46Å; A99-S103 VanDerWaalsContact O-N 3.15Å; A99-S103 PolarHBondContact O-OG 2.85Å; A99-S103 VanDerWaalsContact O-OG 3.06Å; V100-S103 WeakPolarHBondContact CA-OG 3.37Å; V100-S103 PolarHBondContact O-N 2.91Å; V100-S103 PolarHBondContact O-OG 3.45Å
104	V	87.3	Confident	91.1	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.018	30%	0.304	C	S	.	.			trans	-81.2	141.2	178.8	-61.8	0	0	0	0	111.3	C56 V58 V100 R101 V109 K110	C56-V104 WeakPolarHBondContact O-CG1 3.5Å; V58-V104 HydrophobicContact CG2-CG1 3.87Å; V100-V104 HydrophobicContact CG1-CG1 4.16Å; V100-V104 WeakPolarHBondContact O-CG1 3.44Å; V100-V104 WeakPolarHBondContact O-CG2 3.25Å; V100-V104 PolarHBondContact O-N 3.47Å; V100-V104 VanDerWaalsContact O-N 3.07Å; R101-V104 WeakPolarHBondContact O-CG2 3.01Å; V104-V109 HydrophobicContact CB-CB 4.48Å; V104-V109 HydrophobicContact CB-CG1 4.11Å; V104-V109 HydrophobicContact CG1-CG1 3.73Å; V104-V109 HydrophobicContact CG2-CB 4.48Å; V104-V109 HydrophobicContact CG2-CG1 4.14Å; V104-K110 HydrophobicContact CG2-CG 3.56Å; V104-K110 WeakPolarHBondContact O-CE 3.41Å; V104-K110 PolarHBondContact O-NZ 2.82Å
105	S	85.1	Confident	91.2	Very high	102 Å²	102	56 Å²	56	71%	0.713	32%	0.317	S	S	*	.			trans	-97.5	-29	173.9	58.6	0	0	0	0	113.1	A107	S105-A107 PolarHBondContact O-N 3.34Å
106	R	87.9	Confident	91.3	Very high	134 Å²	134	51 Å²	51	51%	0.506	29%	0.293	S	S	.	.			trans	-69.8	121.8	-175.4	-67.6	-178.5	66	165.7	-0.8	112.3	G55 A108 V109 K110	G55-R106 WeakPolarHBondContact O-CD 3.42Å; G55-R106 WeakPolarHBondContact O-CG 3.49Å; R106-A108 VanDerWaalsContact C-N 3.34Å; R106-A108 PolarHBondContact O-N 2.85Å; R106-V109 HydrophobicContact CB-CB 4.25Å; R106-V109 HydrophobicContact CB-CG2 3.87Å; R106-V109 PolarHBondContact O-N 3.3Å; R106-V109 VanDerWaalsContact O-N 3.08Å; R106-K110 PolarHBondContact O-N 3.03Å
107	A	89.5	Confident	91.4	Very high	78 Å²	78	54 Å²	54	65%	0.645	31%	0.305	S	S	*	.	H	α-helix	trans	-57.5	-41	179.8	0	0	0	0	0	113.7	S105 V109 K110 S111	S105-A107 PolarHBondContact O-N 3.34Å; A107-V109 VanDerWaalsContact C-N 3.3Å; A107-V109 PolarHBondContact O-N 2.92Å; A107-K110 PolarHBondContact O-N 3.46Å; A107-S111 PolarHBondContact O-N 3.37Å
108	A	89	Confident	91.5	Very high	66 Å²	66	57 Å²	57	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-38.5	177.1	0	0	0	0	0	112.5	R106 L112	R106-A108 VanDerWaalsContact C-N 3.34Å; R106-A108 PolarHBondContact O-N 2.85Å; A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 3.38Å
109	V	89.3	Confident	91.7	Very high	5 Å²	5	58 Å²	58	3%	0.03	33%	0.33	C	S	.	.	H	α-helix	trans	-70.4	-44.2	176.4	-178.2	0	0	0	0	109.9	L49 V104 R106 A107 S111 L112 I113	L49-V109 HydrophobicContact CD2-CB 4.41Å; L49-V109 HydrophobicContact CD2-CG1 3.98Å; L49-V109 HydrophobicContact CD2-CG2 4.01Å; V104-V109 HydrophobicContact CB-CB 4.48Å; V104-V109 HydrophobicContact CB-CG1 4.11Å; V104-V109 HydrophobicContact CG1-CG1 3.73Å; V104-V109 HydrophobicContact CG2-CB 4.48Å; V104-V109 HydrophobicContact CG2-CG1 4.14Å; R106-V109 HydrophobicContact CB-CB 4.25Å; R106-V109 HydrophobicContact CB-CG2 3.87Å; R106-V109 PolarHBondContact O-N 3.3Å; R106-V109 VanDerWaalsContact O-N 3.08Å; A107-V109 VanDerWaalsContact C-N 3.3Å; A107-V109 PolarHBondContact O-N 2.92Å; V109-S111 VanDerWaalsContact C-N 3.31Å; V109-S111 PolarHBondContact O-N 3.15Å; V109-L112 PolarHBondContact O-N 3.32Å; V109-I113 HydrophobicContact CG1-CG1 4.3Å; V109-I113 VanDerWaalsContact O-CG1 3.28Å; V109-I113 WeakPolarHBondContact O-CG1 3.01Å; V109-I113 PolarHBondContact O-N 3.49Å
110	K	91.9	Very high	91.8	Very high	68 Å²	68	56.6 Å²	56.6	30%	0.296	32%	0.316	S	S	.	.	H	α-helix	trans	-54.7	-46.4	175.5	-71.3	-176.2	178.1	-178.7	0	112.2	V104 R106 A107 L112 I113 D114	V104-K110 HydrophobicContact CG2-CG 3.56Å; V104-K110 WeakPolarHBondContact O-CE 3.41Å; V104-K110 PolarHBondContact O-NZ 2.82Å; R106-K110 PolarHBondContact O-N 3.03Å; A107-K110 PolarHBondContact O-N 3.46Å; K110-L112 PolarHBondContact O-N 3.35Å; K110-I113 PolarHBondContact O-N 2.82Å; K110-D114 WeakPolarHBondContact O-CB 3.49Å; K110-D114 PolarHBondContact O-N 3.03Å
111	S	93.4	Very high	91.9	Very high	63 Å²	63	61.8 Å²	61.8	44%	0.441	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-43.1	179.2	176.5	0	0	0	0	112.4	A107 V109 I113 D114 N115	A107-S111 PolarHBondContact O-N 3.37Å; V109-S111 VanDerWaalsContact C-N 3.31Å; V109-S111 PolarHBondContact O-N 3.15Å; S111-I113 VanDerWaalsContact C-N 3.34Å; S111-I113 PolarHBondContact O-N 3.31Å; S111-D114 PolarHBondContact O-N 3.39Å; S111-N115 WeakPolarHBondContact O-CB 3.36Å; S111-N115 PolarHBondContact O-N 3Å; S111-N115 PolarHBondContact O-ND2 3.14Å
112	L	93.3	Very high	91.9	Very high	49 Å²	49	59.7 Å²	59.7	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-43.3	175.4	-72.8	171	0	0	0	111.9	T45 A48 L49 A108 V109 K110 N116	T45-L112 HydrophobicContact CG2-CB 4.27Å; A48-L112 HydrophobicContact CB-CD1 3.95Å; L49-L112 HydrophobicContact CD1-CB 4.38Å; L49-L112 HydrophobicContact CD1-CD1 4.35Å; L49-L112 HydrophobicContact CD2-CD1 3.79Å; L49-L112 HydrophobicContact CG-CD1 3.99Å; A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 3.38Å; V109-L112 PolarHBondContact O-N 3.32Å; K110-L112 PolarHBondContact O-N 3.35Å; L112-N116 WeakPolarHBondContact O-CB 3.36Å; L112-N116 PolarHBondContact O-N 2.95Å
113	I	93.6	Very high	91.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-41.2	178.3	-60.9	-64.6	0	0	0	111.3	L49 L97 V100 R101 V109 K110 S111 N116 K117 L154	L49-I113 HydrophobicContact CD1-CD1 4.09Å; L97-I113 HydrophobicContact CB-CG2 4Å; L97-I113 HydrophobicContact CD2-CD1 3.86Å; L97-I113 HydrophobicContact CD2-CG2 4.33Å; L97-I113 WeakPolarHBondContact O-CG2 3.49Å; V100-I113 HydrophobicContact CG1-CD1 3.79Å; V100-I113 HydrophobicContact CG1-CG1 3.99Å; R101-I113 HydrophobicContact CB-CG2 3.86Å; R101-I113 HydrophobicContact CG-CG2 4.46Å; V109-I113 HydrophobicContact CG1-CG1 4.3Å; V109-I113 VanDerWaalsContact O-CG1 3.28Å; V109-I113 WeakPolarHBondContact O-CG1 3.01Å; V109-I113 PolarHBondContact O-N 3.49Å; K110-I113 PolarHBondContact O-N 2.82Å; S111-I113 VanDerWaalsContact C-N 3.34Å; S111-I113 PolarHBondContact O-N 3.31Å; I113-N116 PolarHBondContact O-N 3.49Å; I113-K117 HydrophobicContact CG2-CD 4.24Å; I113-K117 HydrophobicContact CG2-CG 4.49Å; I113-K117 WeakPolarHBondContact O-CG 3.28Å; I113-K117 PolarHBondContact O-N 3.09Å; I113-L154 HydrophobicContact CD1-CD1 4.25Å
114	D	95.5	Very high	92.1	Very high	53 Å²	53	50 Å²	50	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-42.5	177.3	-79.5	-24.4	0	0	0	111.9	R101 K110 S111 N116 K117 S118	R101-D114 WeakPolarHBondContact CD-OD1 3.46Å; R101-D114 IonicContact CZ-OD1 3.73Å; R101-D114 IonicContact CZ-OD2 3.47Å; R101-D114 IonicContact NE-OD1 2.67Å; R101-D114 PolarHBondContact NE-OD1 3.36Å; R101-D114 IonicContact NE-OD2 3Å; R101-D114 PolarHBondContact NE-OD2 3.4Å; R101-D114 IonicContact NH2-OD1 3.94Å; R101-D114 IonicContact NH2-OD2 3.02Å; R101-D114 PolarHBondContact NH2-OD2 2.85Å; K110-D114 WeakPolarHBondContact O-CB 3.49Å; K110-D114 PolarHBondContact O-N 3.03Å; S111-D114 PolarHBondContact O-N 3.39Å; D114-N116 VanDerWaalsContact C-N 3.34Å; D114-N116 PolarHBondContact O-N 3.3Å; D114-K117 PolarHBondContact O-N 2.91Å; D114-S118 WeakPolarHBondContact O-CB 3.48Å; D114-S118 PolarHBondContact O-N 3.46Å
115	N	95.8	Very high	92	Very high	91 Å²	91	53.9 Å²	53.9	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-45.1	172.9	-69.6	-12	0	0	0	111.1	S111 K117 S118 N119	S111-N115 WeakPolarHBondContact O-CB 3.36Å; S111-N115 PolarHBondContact O-N 3Å; S111-N115 PolarHBondContact O-ND2 3.14Å; N115-K117 PolarHBondContact O-N 2.93Å; N115-S118 WeakPolarHBondContact O-CB 3.43Å; N115-S118 PolarHBondContact O-N 3.37Å; N115-N119 VanDerWaalsContact O-CG 3.29Å; N115-N119 PolarHBondContact O-N 2.76Å; N115-N119 PolarHBondContact O-OD1 3.11Å
116	N	94.8	Very high	92	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-38.6	-180	-144.2	-111	0	0	0	112.3	T45 L97 L112 I113 D114 N119 I120 H161	T45-N116 HydrophobicContact CG2-CB 4.46Å; T45-N116 PolarHBondContact OG1-ND2 3.15Å; L97-N116 HydrophobicContact CD1-CB 4.22Å; L112-N116 WeakPolarHBondContact O-CB 3.36Å; L112-N116 PolarHBondContact O-N 2.95Å; I113-N116 PolarHBondContact O-N 3.49Å; D114-N116 VanDerWaalsContact C-N 3.34Å; D114-N116 PolarHBondContact O-N 3.3Å; N116-N119 WeakPolarHBondContact O-CB 3.46Å; N116-N119 PolarHBondContact O-N 2.61Å; N116-I120 WeakPolarHBondContact O-CG1 3.43Å; N116-I120 PolarHBondContact O-N 3.1Å; N116-H161 PolarHBondContact OD1-CE1 2.89Å; N116-H161 PolarHBondContact OD1-ND1 3.41Å; N116-H161 VanDerWaalsContact OD1-ND1 3.1Å
117	K	95.6	Very high	91.8	Very high	69 Å²	69	44.7 Å²	44.7	30%	0.3	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-43.8	172.5	-72.8	175.6	69.3	-178.8	0	112.1	L97 I113 D114 N115 N119 I120 H121	L97-K117 HydrophobicContact CB-CD 4.16Å; L97-K117 HydrophobicContact CB-CG 3.71Å; L97-K117 HydrophobicContact CD1-CG 4.27Å; I113-K117 HydrophobicContact CG2-CD 4.24Å; I113-K117 HydrophobicContact CG2-CG 4.49Å; I113-K117 WeakPolarHBondContact O-CG 3.28Å; I113-K117 PolarHBondContact O-N 3.09Å; D114-K117 PolarHBondContact O-N 2.91Å; N115-K117 PolarHBondContact O-N 2.93Å; K117-N119 VanDerWaalsContact C-N 3.28Å; K117-N119 PolarHBondContact O-N 2.73Å; K117-I120 PolarHBondContact O-N 2.91Å; K117-H121 PolarHBondContact O-N 3.33Å
118	S	95.9	Very high	91.3	Very high	65 Å²	65	44.4 Å²	44.4	46%	0.455	24%	0.244	S	C	.	.	H	α-helix	trans	-59.2	-42	175.7	-173.3	0	0	0	0	111.5	D114 N115 H121 S122	D114-S118 WeakPolarHBondContact O-CB 3.48Å; D114-S118 PolarHBondContact O-N 3.46Å; N115-S118 WeakPolarHBondContact O-CB 3.43Å; N115-S118 PolarHBondContact O-N 3.37Å; S118-H121 PolarHBondContact O-N 3.36Å; S118-S122 WeakPolarHBondContact O-CB 3.35Å; S118-S122 PolarHBondContact O-N 2.92Å; S118-S122 PolarHBondContact O-OG 3.46Å
119	N	95.6	Very high	90.6	Very high	32 Å²	32	44.8 Å²	44.8	17%	0.171	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-45.1	176.5	-74.1	-3.1	0	0	0	112.6	F38 E41 N115 N116 K117 H121 S122 L123	F38-N119 HydrophobicContact CD1-CB 4.06Å; F38-N119 HydrophobicContact CE1-CB 4.36Å; E41-N119 PolarHBondContact OE2-ND2 3.07Å; N115-N119 VanDerWaalsContact O-CG 3.29Å; N115-N119 PolarHBondContact O-N 2.76Å; N115-N119 PolarHBondContact O-OD1 3.11Å; N116-N119 WeakPolarHBondContact O-CB 3.46Å; N116-N119 PolarHBondContact O-N 2.61Å; K117-N119 VanDerWaalsContact C-N 3.28Å; K117-N119 PolarHBondContact O-N 2.73Å; N119-H121 VanDerWaalsContact C-N 3.33Å; N119-H121 PolarHBondContact O-N 3.37Å; N119-S122 PolarHBondContact O-N 3.34Å; N119-L123 WeakPolarHBondContact O-CB 3.21Å; N119-L123 PolarHBondContact O-N 2.94Å
120	I	94.6	Very high	89.8	Confident	12 Å²	12	45 Å²	45	6%	0.062	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-46.4	174.8	-74.4	163.4	0	0	0	110.8	L90 F93 L97 N116 K117 L123 G124	L90-I120 HydrophobicContact CB-CG2 4.07Å; L90-I120 HydrophobicContact CD2-CG2 4.25Å; L90-I120 WeakPolarHBondContact O-CG2 3.5Å; F93-I120 HydrophobicContact CB-CD1 3.76Å; L97-I120 HydrophobicContact CD1-CD1 3.41Å; L97-I120 VanDerWaalsContact CD1-CD1 3.41Å; N116-I120 WeakPolarHBondContact O-CG1 3.43Å; N116-I120 PolarHBondContact O-N 3.1Å; K117-I120 PolarHBondContact O-N 2.91Å; I120-L123 PolarHBondContact O-N 3.04Å; I120-G124 PolarHBondContact O-N 3.35Å
121	H	92.6	Very high	88.5	Confident	110 Å²	110	49.3 Å²	49.3	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-47.8	177.4	178.1	-94.6	0	0	0	111.2	K117 S118 N119 L123 G124 Q125	K117-H121 PolarHBondContact O-N 3.33Å; S118-H121 PolarHBondContact O-N 3.36Å; N119-H121 VanDerWaalsContact C-N 3.33Å; N119-H121 PolarHBondContact O-N 3.37Å; H121-L123 PolarHBondContact O-N 2.87Å; H121-G124 PolarHBondContact O-N 3.22Å; H121-G124 VanDerWaalsContact O-N 3.17Å; H121-Q125 PolarHBondContact CE1-NE2 3.22Å; H121-Q125 PolarHBondContact NE2-NE2 3.05Å; H121-Q125 WeakPolarHBondContact O-CG 3.45Å; H121-Q125 PolarHBondContact O-N 3.29Å
122	S	92.5	Very high	86.9	Confident	44 Å²	44	47.3 Å²	47.3	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-45.8	179.7	-58.7	0	0	0	0	111.6	S118 N119 G124 Q125 V126	S118-S122 WeakPolarHBondContact O-CB 3.35Å; S118-S122 PolarHBondContact O-N 2.92Å; S118-S122 PolarHBondContact O-OG 3.46Å; N119-S122 PolarHBondContact O-N 3.34Å; S122-G124 VanDerWaalsContact C-N 3.34Å; S122-G124 PolarHBondContact O-N 3.24Å; S122-Q125 PolarHBondContact O-N 3.35Å; S122-V126 WeakPolarHBondContact O-CB 2.94Å; S122-V126 VanDerWaalsContact O-CG2 3.23Å; S122-V126 WeakPolarHBondContact O-CG2 3.22Å; S122-V126 PolarHBondContact O-N 3.48Å
123	L	90.9	Very high	84.7	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-44	174.4	179	61.8	0	0	0	111.4	I29 L35 F38 L90 N119 I120 H121 Q125 V126 L127 L165 V169	I29-L123 HydrophobicContact CD1-CD1 4Å; L35-L123 HydrophobicContact CD1-CD1 4.37Å; F38-L123 HydrophobicContact CD1-CB 4.42Å; F38-L123 HydrophobicContact CD2-CD1 4.38Å; F38-L123 HydrophobicContact CE1-CB 4.33Å; L90-L123 HydrophobicContact CD1-CD2 4.28Å; L90-L123 HydrophobicContact CD1-CG 4.21Å; L90-L123 HydrophobicContact CD2-CD2 4.01Å; N119-L123 WeakPolarHBondContact O-CB 3.21Å; N119-L123 PolarHBondContact O-N 2.94Å; I120-L123 PolarHBondContact O-N 3.04Å; H121-L123 PolarHBondContact O-N 2.87Å; L123-Q125 PolarHBondContact O-N 3.37Å; L123-V126 PolarHBondContact O-N 3.48Å; L123-L127 HydrophobicContact CD1-CD1 4.35Å; L123-L127 HydrophobicContact CD1-CG 4.23Å; L123-L127 HydrophobicContact CG-CD1 4.15Å; L123-L127 HydrophobicContact CG-CG 4.45Å; L123-L127 VanDerWaalsContact O-CG 3.31Å; L123-L127 WeakPolarHBondContact O-CG 2.91Å; L123-L127 PolarHBondContact O-N 2.88Å; L123-L165 HydrophobicContact CD2-CD2 3.48Å; L123-L165 VanDerWaalsContact CD2-CD2 3.48Å; L123-V169 HydrophobicContact CD1-CG1 4.36Å; L123-V169 HydrophobicContact CD2-CG1 4.15Å
124	G	89.1	Confident	82.3	Confident	3 Å²	3	57.3 Å²	57.3	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-43.6	176.3	0	0	0	0	0	113.1	Q87 I120 H121 S122 L127 R128	Q87-G124 PolarHBondContact NE2-O 3.3Å; I120-G124 PolarHBondContact O-N 3.35Å; H121-G124 PolarHBondContact O-N 3.22Å; H121-G124 VanDerWaalsContact O-N 3.17Å; S122-G124 VanDerWaalsContact C-N 3.34Å; S122-G124 PolarHBondContact O-N 3.24Å; G124-L127 PolarHBondContact O-N 3.01Å; G124-R128 WeakPolarHBondContact O-CG 3.35Å; G124-R128 PolarHBondContact O-N 3.36Å; G124-R128 PolarHBondContact O-NE 2.95Å
125	Q	86.4	Confident	80.1	Confident	84 Å²	84	58.5 Å²	58.5	39%	0.393	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-45.4	174.3	-66.1	-66	-24.5	0	0	111.6	H121 S122 L123 R128 S129	H121-Q125 PolarHBondContact CE1-NE2 3.22Å; H121-Q125 PolarHBondContact NE2-NE2 3.05Å; H121-Q125 WeakPolarHBondContact O-CG 3.45Å; H121-Q125 PolarHBondContact O-N 3.29Å; S122-Q125 PolarHBondContact O-N 3.35Å; L123-Q125 PolarHBondContact O-N 3.37Å; Q125-R128 PolarHBondContact O-N 3.46Å; Q125-S129 PolarHBondContact O-N 2.95Å
126	V	85.3	Confident	77.6	Confident	44 Å²	44	59.1 Å²	59.1	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-42.4	-179	172.7	0	0	0	0	111	I29 S122 L123 R128 S129	I29-V126 HydrophobicContact CB-CG1 3.3Å; I29-V126 HydrophobicContact CD1-CG1 3.71Å; I29-V126 HydrophobicContact CG1-CG1 3.46Å; I29-V126 VanDerWaalsContact CG1-CG1 3.46Å; I29-V126 HydrophobicContact CG2-CG1 3.75Å; S122-V126 WeakPolarHBondContact O-CB 2.94Å; S122-V126 VanDerWaalsContact O-CG2 3.23Å; S122-V126 WeakPolarHBondContact O-CG2 3.22Å; S122-V126 PolarHBondContact O-N 3.48Å; L123-V126 PolarHBondContact O-N 3.48Å; V126-R128 VanDerWaalsContact C-N 3.33Å; V126-R128 PolarHBondContact O-N 3.22Å; V126-S129 WeakPolarHBondContact O-CB 3.33Å; V126-S129 PolarHBondContact O-N 3.44Å; V126-S129 PolarHBondContact O-OG 2.93Å
127	L	82.7	Confident	75.4	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-39.2	174.6	-70.1	174.2	0	0	0	112.1	V86 L90 L123 G124 S129 L130 V169 L172 L173	V86-L127 HydrophobicContact CG1-CD1 3.53Å; L90-L127 HydrophobicContact CD1-CD1 3.78Å; L123-L127 HydrophobicContact CD1-CD1 4.35Å; L123-L127 HydrophobicContact CD1-CG 4.23Å; L123-L127 HydrophobicContact CG-CD1 4.15Å; L123-L127 HydrophobicContact CG-CG 4.45Å; L123-L127 VanDerWaalsContact O-CG 3.31Å; L123-L127 WeakPolarHBondContact O-CG 2.91Å; L123-L127 PolarHBondContact O-N 2.88Å; G124-L127 PolarHBondContact O-N 3.01Å; L127-S129 VanDerWaalsContact C-N 3.3Å; L127-S129 PolarHBondContact O-N 3.31Å; L127-L130 HydrophobicContact CD2-CD1 4.31Å; L127-L130 WeakPolarHBondContact O-CB 3.29Å; L127-L130 PolarHBondContact O-N 3.36Å; L127-V169 HydrophobicContact CD1-CG1 4.49Å; L127-L172 HydrophobicContact CD2-CD2 4.34Å; L127-L173 HydrophobicContact CD2-CD1 4.45Å; L127-L173 HydrophobicContact CD2-CD2 3.59Å; L127-L173 HydrophobicContact CD2-CG 4.05Å
128	R	80	Confident	72.8	Confident	71 Å²	71	64.7 Å²	64.7	27%	0.268	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-35.8	174.2	-79.1	-176.4	-95.8	104.6	-3.8	112.5	G124 Q125 V126 L130 H131 D134	G124-R128 WeakPolarHBondContact O-CG 3.35Å; G124-R128 PolarHBondContact O-N 3.36Å; G124-R128 PolarHBondContact O-NE 2.95Å; Q125-R128 PolarHBondContact O-N 3.46Å; V126-R128 VanDerWaalsContact C-N 3.33Å; V126-R128 PolarHBondContact O-N 3.22Å; R128-L130 PolarHBondContact O-N 2.96Å; R128-L130 VanDerWaalsContact O-N 3.16Å; R128-H131 PolarHBondContact O-N 2.94Å; R128-D134 WeakPolarHBondContact CD-OD1 3.42Å
129	S	74.8	Confident	70.2	Confident	75 Å²	75	67.2 Å²	67.2	52%	0.524	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-17.3	176.9	77.8	0	0	0	0	114.2	Q125 V126 L127 H131	Q125-S129 PolarHBondContact O-N 2.95Å; V126-S129 WeakPolarHBondContact O-CB 3.33Å; V126-S129 PolarHBondContact O-N 3.44Å; V126-S129 PolarHBondContact O-OG 2.93Å; L127-S129 VanDerWaalsContact C-N 3.3Å; L127-S129 PolarHBondContact O-N 3.31Å; S129-H131 PolarHBondContact O-N 3.26Å; S129-H131 VanDerWaalsContact O-N 3.1Å; S129-H131 PolarHBondContact O-ND1 3.02Å; S129-H131 VanDerWaalsContact O-ND1 3.11Å
130	L	72	Confident	67.7	Low	9 Å²	9	70.9 Å²	70.9	5%	0.047	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	2.5	175.8	-66.2	177.3	0	0	0	114	R27 I29 L127 R128 I132 L173 A178	R27-L130 HydrophobicContact CB-CD2 4.38Å; R27-L130 HydrophobicContact CG-CD2 4.45Å; R27-L130 PolarHBondContact NH1-O 3.08Å; I29-L130 HydrophobicContact CG2-CD1 3.73Å; I29-L130 HydrophobicContact CG2-CD2 3.57Å; I29-L130 HydrophobicContact CG2-CG 3.85Å; L127-L130 HydrophobicContact CD2-CD1 4.31Å; L127-L130 WeakPolarHBondContact O-CB 3.29Å; L127-L130 PolarHBondContact O-N 3.36Å; R128-L130 PolarHBondContact O-N 2.96Å; R128-L130 VanDerWaalsContact O-N 3.16Å; L130-I132 HydrophobicContact CB-CD1 4.06Å; L130-I132 HydrophobicContact CB-CG1 4.07Å; L130-I132 HydrophobicContact CD1-CD1 4.18Å; L130-I132 PolarHBondContact O-N 2.91Å; L130-L173 HydrophobicContact CD1-CD2 3.5Å; L130-L173 VanDerWaalsContact CD1-CD2 3.5Å; L130-A178 HydrophobicContact CD2-CB 4.13Å
131	H	63.8	Low	65.1	Low	158 Å²	158	75.3 Å²	75.3	73%	0.731	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	20.9	-171.5	-57.9	62.2	0	0	0	112.8	R128 S129 K133	R128-H131 PolarHBondContact O-N 2.94Å; S129-H131 PolarHBondContact O-N 3.26Å; S129-H131 VanDerWaalsContact O-N 3.1Å; S129-H131 PolarHBondContact O-ND1 3.02Å; S129-H131 VanDerWaalsContact O-ND1 3.11Å; H131-K133 VanDerWaalsContact C-N 3.31Å; H131-K133 PolarHBondContact O-N 3.08Å
132	I	60.2	Low	62.7	Low	21 Å²	21	74.4 Å²	74.4	11%	0.108	43%	0.432	C	S	.	.			trans	-62	101.9	152	-70	174.7	0	0	0	104.6	A83 L130 D134 L172	A83-I132 HydrophobicContact CB-CB 4.24Å; A83-I132 HydrophobicContact CB-CD1 4.33Å; A83-I132 HydrophobicContact CB-CG1 4.34Å; A83-I132 HydrophobicContact CB-CG2 3.03Å; L130-I132 HydrophobicContact CB-CD1 4.06Å; L130-I132 HydrophobicContact CB-CG1 4.07Å; L130-I132 HydrophobicContact CD1-CD1 4.18Å; L130-I132 PolarHBondContact O-N 2.91Å; I132-D134 PolarHBondContact O-N 3.23Å; I132-L172 HydrophobicContact CD1-CD1 4.3Å; I132-L172 HydrophobicContact CD1-CD2 4.13Å; I132-L172 HydrophobicContact CD1-CG 4.31Å
133	K	46.3	Very low	60.5	Low	131 Å²	131	77 Å²	77	57%	0.57	45%	0.446	S	S	*	.			trans	-44.2	139.5	-167.2	-74.5	-178.1	-166	139.7	0	111.9	E80 H131 L135	E80-K133 IonicContact OE1-NZ 3.18Å; E80-K133 PolarHBondContact OE1-NZ 3.49Å; E80-K133 IonicContact OE2-NZ 2.58Å; E80-K133 PolarHBondContact OE2-NZ 3.36Å; H131-K133 VanDerWaalsContact C-N 3.31Å; H131-K133 PolarHBondContact O-N 3.08Å; K133-L135 HydrophobicContact CB-CD1 4.47Å; K133-L135 PolarHBondContact O-N 3.29Å
134	D	44	Very low	58.1	Low	129 Å²	129	79 Å²	79	69%	0.69	47%	0.466	S	S	*	.			trans	-61.1	90.2	162.9	-94.2	-46.2	0	0	0	108.6	R128 I132 S136	R128-D134 WeakPolarHBondContact CD-OD1 3.42Å; I132-D134 PolarHBondContact O-N 3.23Å; D134-S136 PolarHBondContact O-N 3.38Å; D134-S136 VanDerWaalsContact O-N 3.08Å
135	L	48.8	Very low	56	Low	77 Å²	77	87.4 Å²	87.4	40%	0.403	51%	0.511	S	S	.	.			trans	-76.7	92.1	151.6	-75.4	115.1	0	0	0	105.6	E80 L84 K133 L137	E80-L135 HydrophobicContact CG-CD1 4.2Å; L84-L135 HydrophobicContact CD1-CD1 3.88Å; L84-L135 HydrophobicContact CD1-CD2 4.3Å; L84-L135 HydrophobicContact CD2-CB 3.47Å; L84-L135 VanDerWaalsContact CD2-CB 3.47Å; L84-L135 HydrophobicContact CD2-CD1 3.46Å; L84-L135 VanDerWaalsContact CD2-CD1 3.46Å; L84-L135 HydrophobicContact CD2-CD2 4.03Å; L84-L135 HydrophobicContact CD2-CG 3.78Å; L84-L135 HydrophobicContact CG-CD1 3.62Å; L84-L135 HydrophobicContact CG-CG 4.43Å; K133-L135 HydrophobicContact CB-CD1 4.47Å; K133-L135 PolarHBondContact O-N 3.29Å; L135-L137 PolarHBondContact O-N 3.16Å
136	S	43	Very low	54.6	Low	104 Å²	104	87.6 Å²	87.6	73%	0.727	52%	0.522	S	S	*	.			trans	-29.2	110.2	145.5	162.5	0	0	0	0	107	D134 S138	D134-S136 PolarHBondContact O-N 3.38Å; D134-S136 VanDerWaalsContact O-N 3.08Å; S136-S138 PolarHBondContact O-N 2.62Å
137	L	49	Very low	54.2	Low	103 Å²	103	87.7 Å²	87.7	54%	0.539	53%	0.527	S	S	.	.			trans	-64.8	77.3	177.9	-74.7	160.5	0	0	0	107.8	F91 L135	F91-L137 HydrophobicContact CB-CD1 4.39Å; F91-L137 HydrophobicContact CD2-CD1 4.22Å; F91-L137 HydrophobicContact CG-CD1 4.21Å; L135-L137 PolarHBondContact O-N 3.16Å
138	S	41.2	Very low	54.5	Low	85 Å²	85	90.9 Å²	90.9	59%	0.594	55%	0.547	S	S	*	.			trans	-57.9	141.8	152.9	-169.1	0	0	0	0	106.6	S136 V140	S136-S138 PolarHBondContact O-N 2.62Å; S138-V140 PolarHBondContact O-N 3Å
139	P	40.8	Very low	55.1	Low	118 Å²	118	91.6 Å²	91.6	77%	0.766	55%	0.549	S	S	*	.	S	Bend	trans	-54.1	111.5	-177	21.4	-31.5	0	0	0	108.7
140	V	44.2	Very low	55.9	Low	109 Å²	109	95.7 Å²	95.7	66%	0.661	56%	0.557	S	S	*	*			trans	11.9	101.8	163.4	-178.4	0	0	0	0	112.3	S138 A142	S138-V140 PolarHBondContact O-N 3Å; V140-A142 PolarHBondContact O-N 3.01Å; V140-A142 VanDerWaalsContact O-N 3.09Å
141	P	38.7	Very low	56.8	Low	104 Å²	104	95.3 Å²	95.3	68%	0.675	56%	0.556	S	S	*	*			trans	-59.7	123.9	152.1	27.5	-26.1	0	0	0	104.2	V143	P141-V143 PolarHBondContact O-N 3.41Å
142	A	42.8	Very low	57.9	Low	92 Å²	92	91.9 Å²	91.9	76%	0.76	55%	0.55	S	S	*	.			trans	-56.2	86.5	174.9	0	0	0	0	0	108.6	V140 G144	V140-A142 PolarHBondContact O-N 3.01Å; V140-A142 VanDerWaalsContact O-N 3.09Å; A142-G144 PolarHBondContact O-N 2.94Å
143	V	46.2	Very low	59.2	Low	98 Å²	98	92.8 Å²	92.8	59%	0.594	56%	0.557	S	S	*	*			trans	-78.1	71.6	163.6	-176.4	0	0	0	0	105.3	P141	P141-V143 PolarHBondContact O-N 3.41Å
144	G	40.8	Very low	61.2	Low	43 Å²	43	87.1 Å²	87.1	44%	0.443	53%	0.534	S	S	.	.			trans	62.1	144.3	176.7	0	0	0	0	0	115.5	A142 S146	A142-G144 PolarHBondContact O-N 2.94Å; G144-S146 PolarHBondContact O-N 3.31Å
145	D	45.3	Very low	63.3	Low	180 Å²	180	84.1 Å²	84.1	96%	0.963	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	6	163.9	-88.9	-34	0	0	0	114.3
146	S	55.7	Low	65.3	Low	89 Å²	89	82.7 Å²	82.7	62%	0.622	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-4.5	-173.4	58.8	0	0	0	0	115.6	L66 G144	L66-S146 WeakPolarHBondContact CD1-O 3.46Å; G144-S146 PolarHBondContact O-N 3.31Å
147	A	78.5	Confident	67.6	Low	46 Å²	46	77.7 Å²	77.7	38%	0.38	48%	0.479	S	S	.	.	S	Bend	trans	-89.1	-8.5	-173.9	0	0	0	0	0	115.4	L66	L66-A147 PolarHBondContact N-O 3.42Å
148	T	89.1	Confident	69.7	Low	67 Å²	67	72.9 Å²	72.9	41%	0.411	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	159	-177.1	67.5	0	0	0	0	111.4	V63 V64 L92	V63-T148 HydrophobicContact CG1-CG2 4.2Å; V64-T148 CarbonylContact O-C 3.54Å; V64-T148 WeakPolarHBondContact O-CA 3.4Å; V64-T148 WeakPolarHBondContact O-CB 3.46Å; L92-T148 HydrophobicContact CD1-CG2 3.72Å
149	R	91.4	Very high	72.2	Confident	86 Å²	86	74.3 Å²	74.3	33%	0.325	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.1	172.5	67.2	179.3	-133.1	135.4	8.1	110.8	V64 L66 E156	V64-R149 HydrophobicContact CG2-CG 3.66Å; V64-R149 WeakPolarHBondContact CG2-O 3.27Å; V64-R149 PolarHBondContact N-O 3.17Å; V64-R149 PolarHBondContact O-N 3.01Å; L66-R149 HydrophobicContact CD2-CB 3.79Å; L66-R149 HydrophobicContact CD2-CG 3.87Å; R149-E156 IonicContact CZ-OE1 3.68Å; R149-E156 VanDerWaalsContact NH2-CD 3.31Å; R149-E156 IonicContact NH2-OE1 3.45Å; R149-E156 PolarHBondContact NH2-OE1 3Å
150	K	92.3	Very high	74.8	Confident	160 Å²	160	68.9 Å²	68.9	70%	0.696	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.4	175.9	-69.9	176.3	-177.7	177.1	0	110.4	T61 F62 V63	T61-K150 HydrophobicContact CG2-CB 3.68Å; T61-K150 HydrophobicContact CG2-CD 3.85Å; T61-K150 HydrophobicContact CG2-CG 3.88Å; F62-K150 CarbonylContact O-C 3.53Å; F62-K150 VanDerWaalsContact O-CA 3.3Å; F62-K150 WeakPolarHBondContact O-CA 3.38Å; V63-K150 HydrophobicContact CG2-CG 4.43Å
151	V	90.8	Very high	77.3	Confident	2 Å²	2	64 Å²	64	1%	0.012	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.9	173.5	-61.6	0	0	0	0	109.6	T61 F62 V64 E156 L157 V160	T61-V151 WeakPolarHBondContact CA-O 3.4Å; F62-V151 HydrophobicContact CB-CG2 3.85Å; F62-V151 HydrophobicContact CD2-CG2 4.33Å; F62-V151 PolarHBondContact N-O 3.37Å; F62-V151 PolarHBondContact O-N 3.44Å; V64-V151 HydrophobicContact CG1-CG2 3.79Å; V64-V151 HydrophobicContact CG2-CG1 3.67Å; V64-V151 HydrophobicContact CG2-CG2 4.13Å; V151-E156 HydrophobicContact CB-CB 4.23Å; V151-E156 HydrophobicContact CB-CG 3.94Å; V151-E156 WeakPolarHBondContact CB-OE2 3.08Å; V151-E156 HydrophobicContact CG1-CB 4.46Å; V151-E156 HydrophobicContact CG1-CG 3.67Å; V151-L157 HydrophobicContact CG2-CB 4.08Å; V151-V160 HydrophobicContact CG1-CG2 4.41Å
152	S	87.2	Confident	80	Confident	86 Å²	86	59.1 Å²	59.1	60%	0.601	35%	0.349	S	S	*	.			trans	-109.8	-0.3	-172.1	56.5	0	0	0	0	113.9
153	S	86.6	Confident	82.6	Confident	39 Å²	39	57.7 Å²	57.7	27%	0.273	33%	0.329	S	S	.	.	S	Bend	trans	-133.6	149.5	179.2	78.8	0	0	0	0	112.7	S155 E156 L157	S153-S155 VanDerWaalsContact C-N 3.29Å; S153-S155 PolarHBondContact O-N 3.33Å; S153-S155 PolarHBondContact OG-OG 3.42Å; S153-S155 VanDerWaalsContact OG-OG 3.08Å; S153-E156 PolarHBondContact O-N 3.46Å; S153-E156 VanDerWaalsContact OG-CB 3.26Å; S153-E156 WeakPolarHBondContact OG-CB 3.28Å; S153-E156 PolarHBondContact OG-N 2.95Å; S153-E156 VanDerWaalsContact OG-N 3.16Å; S153-L157 PolarHBondContact O-N 2.94Å
154	L	88.4	Confident	85	Confident	13 Å²	13	53 Å²	53	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-59.3	-40.7	174.2	-179.7	57.3	0	0	0	112.1	L49 V58 V100 I113 E156 L157 L158	L49-L154 HydrophobicContact CB-CD2 4.41Å; L49-L154 HydrophobicContact CD1-CD2 4.17Å; V58-L154 HydrophobicContact CB-CB 4.14Å; V58-L154 HydrophobicContact CG1-CB 4.23Å; V58-L154 HydrophobicContact CG2-CB 3.97Å; V58-L154 HydrophobicContact CG2-CD2 3.86Å; V58-L154 HydrophobicContact CG2-CG 4.38Å; V100-L154 HydrophobicContact CB-CD1 4.45Å; V100-L154 HydrophobicContact CG1-CD1 3.72Å; V100-L154 HydrophobicContact CG1-CD2 4.36Å; V100-L154 HydrophobicContact CG2-CD1 3.92Å; I113-L154 HydrophobicContact CD1-CD1 4.25Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 3.28Å; L154-L157 HydrophobicContact CD1-CD2 4.28Å; L154-L157 PolarHBondContact O-N 3.01Å; L154-L158 HydrophobicContact CD1-CD1 3.96Å; L154-L158 HydrophobicContact CD1-CG 3.99Å; L154-L158 HydrophobicContact CG-CD1 3.88Å; L154-L158 HydrophobicContact CG-CG 4.35Å; L154-L158 WeakPolarHBondContact O-CG 3.26Å; L154-L158 PolarHBondContact O-N 2.91Å
155	S	88.5	Confident	87.6	Confident	66 Å²	66	51.1 Å²	51.1	46%	0.462	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-39.6	178.7	69.9	0	0	0	0	112	S153 R159	S153-S155 VanDerWaalsContact C-N 3.29Å; S153-S155 PolarHBondContact O-N 3.33Å; S153-S155 PolarHBondContact OG-OG 3.42Å; S153-S155 VanDerWaalsContact OG-OG 3.08Å; S155-R159 VanDerWaalsContact O-CB 3.3Å; S155-R159 WeakPolarHBondContact O-CB 3.37Å; S155-R159 PolarHBondContact O-N 3.26Å
156	E	90.2	Very high	90	Very high	46 Å²	46	47.3 Å²	47.3	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-72.3	-41.7	178.4	-169.4	177	-155.1	0	0	111.4	R149 V151 S153 L154 L158 R159 V160	R149-E156 IonicContact CZ-OE1 3.68Å; R149-E156 VanDerWaalsContact NH2-CD 3.31Å; R149-E156 IonicContact NH2-OE1 3.45Å; R149-E156 PolarHBondContact NH2-OE1 3Å; V151-E156 HydrophobicContact CB-CB 4.23Å; V151-E156 HydrophobicContact CB-CG 3.94Å; V151-E156 WeakPolarHBondContact CB-OE2 3.08Å; V151-E156 HydrophobicContact CG1-CB 4.46Å; V151-E156 HydrophobicContact CG1-CG 3.67Å; S153-E156 PolarHBondContact O-N 3.46Å; S153-E156 VanDerWaalsContact OG-CB 3.26Å; S153-E156 WeakPolarHBondContact OG-CB 3.28Å; S153-E156 PolarHBondContact OG-N 2.95Å; S153-E156 VanDerWaalsContact OG-N 3.16Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 3.28Å; E156-L158 PolarHBondContact O-N 3.31Å; E156-R159 PolarHBondContact O-N 3.35Å; E156-V160 HydrophobicContact CG-CG2 4.47Å; E156-V160 WeakPolarHBondContact O-CB 3.21Å; E156-V160 WeakPolarHBondContact O-CG2 3.32Å; E156-V160 PolarHBondContact O-N 3.02Å
157	L	92.6	Very high	91.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-55	-51.6	172.9	171.3	62	0	0	0	111.6	F62 V64 F93 A96 L97 V100 V151 S153 L154 R159 V160 H161	F62-L157 HydrophobicContact CD2-CD2 4.48Å; F62-L157 HydrophobicContact CG-CD2 4.34Å; V64-L157 HydrophobicContact CG1-CD1 3.34Å; F93-L157 HydrophobicContact CD1-CD1 3.96Å; F93-L157 HydrophobicContact CE1-CD1 4.28Å; A96-L157 HydrophobicContact CB-CD1 3.73Å; A96-L157 HydrophobicContact CB-CD2 3.98Å; L97-L157 HydrophobicContact CD2-CD2 4.06Å; V100-L157 HydrophobicContact CG2-CD2 3.75Å; V151-L157 HydrophobicContact CG2-CB 4.08Å; S153-L157 PolarHBondContact O-N 2.94Å; L154-L157 HydrophobicContact CD1-CD2 4.28Å; L154-L157 PolarHBondContact O-N 3.01Å; L157-R159 PolarHBondContact O-N 3.24Å; L157-V160 PolarHBondContact O-N 3.37Å; L157-H161 PolarHBondContact O-N 3.08Å
158	L	93	Very high	92.4	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-38.9	-178.8	-66.7	171.9	0	0	0	111.9	T45 E46 L49 L97 L154 E156 H161 T162	T45-L158 HydrophobicContact CG2-CD1 4.46Å; T45-L158 HydrophobicContact CG2-CD2 4.13Å; E46-L158 HydrophobicContact CB-CB 4.03Å; E46-L158 HydrophobicContact CG-CB 4Å; L49-L158 HydrophobicContact CB-CD1 3.88Å; L49-L158 HydrophobicContact CD1-CD1 3.71Å; L49-L158 HydrophobicContact CG-CD1 4.39Å; L97-L158 HydrophobicContact CD2-CD2 4.1Å; L154-L158 HydrophobicContact CD1-CD1 3.96Å; L154-L158 HydrophobicContact CD1-CG 3.99Å; L154-L158 HydrophobicContact CG-CD1 3.88Å; L154-L158 HydrophobicContact CG-CG 4.35Å; L154-L158 WeakPolarHBondContact O-CG 3.26Å; L154-L158 PolarHBondContact O-N 2.91Å; E156-L158 PolarHBondContact O-N 3.31Å; L158-H161 WeakPolarHBondContact O-CB 3.32Å; L158-H161 PolarHBondContact O-N 2.82Å; L158-T162 PolarHBondContact O-N 3.42Å; L158-T162 PolarHBondContact O-OG1 3.01Å
159	R	93.3	Very high	92.6	Very high	115 Å²	115	39.5 Å²	39.5	43%	0.434	20%	0.197	S	C	.	.	H	α-helix	trans	-62.3	-44.4	174.4	-174.8	178.8	69.5	110.1	-1.6	111.9	S155 E156 L157 H161 T162 N163	S155-R159 VanDerWaalsContact O-CB 3.3Å; S155-R159 WeakPolarHBondContact O-CB 3.37Å; S155-R159 PolarHBondContact O-N 3.26Å; E156-R159 PolarHBondContact O-N 3.35Å; L157-R159 PolarHBondContact O-N 3.24Å; R159-H161 VanDerWaalsContact C-N 3.32Å; R159-T162 PolarHBondContact O-N 3.23Å; R159-N163 WeakPolarHBondContact O-CB 2.98Å; R159-N163 VanDerWaalsContact O-CG 3.3Å; R159-N163 PolarHBondContact O-N 3.03Å
160	V	95.3	Very high	92.7	Very high	4 Å²	4	40 Å²	40	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-39.8	177.2	175.7	0	0	0	0	110.3	V64 T67 F93 V151 E156 L157 N163 F164	V64-V160 HydrophobicContact CB-CG1 4.09Å; V64-V160 HydrophobicContact CG2-CB 4.48Å; V64-V160 HydrophobicContact CG2-CG1 3.85Å; T67-V160 HydrophobicContact CG2-CG1 3.66Å; T67-V160 WeakPolarHBondContact CG2-O 3.41Å; F93-V160 HydrophobicContact CE1-CB 4.45Å; F93-V160 HydrophobicContact CE1-CG1 4.04Å; F93-V160 HydrophobicContact CZ-CG1 3.94Å; V151-V160 HydrophobicContact CG1-CG2 4.41Å; E156-V160 HydrophobicContact CG-CG2 4.47Å; E156-V160 WeakPolarHBondContact O-CB 3.21Å; E156-V160 WeakPolarHBondContact O-CG2 3.32Å; E156-V160 PolarHBondContact O-N 3.02Å; L157-V160 PolarHBondContact O-N 3.37Å; V160-N163 PolarHBondContact O-N 2.99Å; V160-F164 WeakPolarHBondContact O-CB 3.3Å; V160-F164 PolarHBondContact O-N 3.02Å
161	H	96	Very high	92.7	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.028	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-50.9	173.3	176.3	-135.4	0	0	0	112.3	F93 N116 L157 L158 R159 N163 F164 L165	F93-H161 HydrophobicContact CD1-CB 3.9Å; F93-H161 AromaticContact CD2-CD2 3.95Å; F93-H161 HydrophobicContact CE1-CB 3.77Å; F93-H161 HydrophobicContact CG-CB 4.41Å; F93-H161 HydrophobicContact CZ-CB 4.17Å; N116-H161 PolarHBondContact OD1-CE1 2.89Å; N116-H161 PolarHBondContact OD1-ND1 3.41Å; N116-H161 VanDerWaalsContact OD1-ND1 3.1Å; L157-H161 PolarHBondContact O-N 3.08Å; L158-H161 WeakPolarHBondContact O-CB 3.32Å; L158-H161 PolarHBondContact O-N 2.82Å; R159-H161 VanDerWaalsContact C-N 3.32Å; H161-N163 VanDerWaalsContact C-N 3.3Å; H161-N163 PolarHBondContact O-N 3.18Å; H161-F164 WeakPolarHBondContact O-CB 3.47Å; H161-F164 PolarHBondContact O-N 3Å; H161-F164 VanDerWaalsContact O-N 3.15Å; H161-L165 WeakPolarHBondContact O-CG 3.37Å; H161-L165 PolarHBondContact O-N 2.67Å; H161-L165 VanDerWaalsContact O-N 3.11Å
162	T	96.4	Very high	92.6	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-42	177.4	-57.1	0	0	0	0	112	R43 E46 L158 R159 L165 R166	R43-T162 HydrophobicContact CB-CG2 4.43Å; E46-T162 PolarHBondContact OE2-OG1 3.42Å; L158-T162 PolarHBondContact O-N 3.42Å; L158-T162 PolarHBondContact O-OG1 3.01Å; R159-T162 PolarHBondContact O-N 3.23Å; T162-L165 PolarHBondContact O-N 2.68Å; T162-R166 WeakPolarHBondContact O-CG 3.47Å; T162-R166 PolarHBondContact O-N 2.76Å; T162-R166 VanDerWaalsContact O-N 3.1Å
163	N	96.7	Very high	92.7	Very high	62 Å²	62	30.7 Å²	30.7	33%	0.332	15%	0.15	S	C	.	.	H	α-helix	trans	-65.8	-38.5	177.7	-73.8	-11.3	0	0	0	112.4	T67 R159 V160 H161 R166 G167	T67-N163 HydrophobicContact CG2-CB 4.24Å; R159-N163 WeakPolarHBondContact O-CB 2.98Å; R159-N163 VanDerWaalsContact O-CG 3.3Å; R159-N163 PolarHBondContact O-N 3.03Å; V160-N163 PolarHBondContact O-N 2.99Å; H161-N163 VanDerWaalsContact C-N 3.3Å; H161-N163 PolarHBondContact O-N 3.18Å; N163-R166 PolarHBondContact O-N 2.95Å; N163-G167 PolarHBondContact O-N 3.34Å
164	F	96.1	Very high	92.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-45.4	176.2	-175	-102.2	0	0	0	112	P65 T67 V86 L90 F93 V160 H161 G167 K168 V169	P65-F164 HydrophobicContact CB-CD2 4.38Å; P65-F164 HydrophobicContact CB-CE2 4.08Å; P65-F164 HydrophobicContact CG-CD2 3.9Å; P65-F164 HydrophobicContact CG-CE2 3.87Å; P65-F164 HydrophobicContact CG-CZ 4.47Å; T67-F164 HydrophobicContact CG2-CB 3.74Å; T67-F164 HydrophobicContact CG2-CD2 4.2Å; T67-F164 HydrophobicContact CG2-CG 4.49Å; V86-F164 HydrophobicContact CB-CZ 4.45Å; V86-F164 HydrophobicContact CG1-CE1 4.39Å; V86-F164 HydrophobicContact CG1-CZ 4.49Å; V86-F164 HydrophobicContact CG2-CZ 4.41Å; V86-F164 WeakPolarHBondContact O-CZ 3.32Å; L90-F164 HydrophobicContact CD2-CD1 4.44Å; L90-F164 HydrophobicContact CD2-CE1 4Å; L90-F164 HydrophobicContact CG-CE1 4.12Å; F93-F164 HydrophobicContact CD2-CD1 4.26Å; F93-F164 HydrophobicContact CE2-CB 3.66Å; F93-F164 AromaticContact CE2-CD1 3.63Å; F93-F164 HydrophobicContact CE2-CD1 3.63Å; F93-F164 HydrophobicContact CE2-CD2 4.07Å; F93-F164 HydrophobicContact CE2-CE1 4.17Å; F93-F164 AromaticContact CE2-CG 3.54Å; F93-F164 HydrophobicContact CE2-CG 3.54Å; F93-F164 HydrophobicContact CZ-CB 3.87Å; F93-F164 HydrophobicContact CZ-CG 4.18Å; V160-F164 WeakPolarHBondContact O-CB 3.3Å; V160-F164 PolarHBondContact O-N 3.02Å; H161-F164 WeakPolarHBondContact O-CB 3.47Å; H161-F164 PolarHBondContact O-N 3Å; H161-F164 VanDerWaalsContact O-N 3.15Å; F164-G167 PolarHBondContact O-N 2.73Å; F164-K168 HydrophobicContact CD2-CB 4.28Å; F164-K168 HydrophobicContact CD2-CD 4.14Å; F164-K168 HydrophobicContact CE2-CB 4.21Å; F164-K168 HydrophobicContact CE2-CD 3.95Å; F164-K168 PolarHBondContact O-N 2.95Å; F164-K168 VanDerWaalsContact O-N 3.12Å; F164-V169 HydrophobicContact CD1-CG2 3.7Å; F164-V169 HydrophobicContact CE1-CG2 3.64Å; F164-V169 PolarHBondContact O-N 2.87Å
165	L	96.1	Very high	92.6	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	18%	0.175	C	C	.	.	I	π-helix	trans	-63.5	-43.7	177.4	-62.7	-178.5	0	0	0	112	I39 A42 L90 L123 H161 T162 V169 R170	I39-L165 HydrophobicContact CG1-CB 3.69Å; I39-L165 HydrophobicContact CG1-CD1 4.47Å; A42-L165 HydrophobicContact CB-CD1 3.74Å; L90-L165 HydrophobicContact CD2-CD2 4.4Å; L123-L165 HydrophobicContact CD2-CD2 3.48Å; L123-L165 VanDerWaalsContact CD2-CD2 3.48Å; H161-L165 WeakPolarHBondContact O-CG 3.37Å; H161-L165 PolarHBondContact O-N 2.67Å; H161-L165 VanDerWaalsContact O-N 3.11Å; T162-L165 PolarHBondContact O-N 2.68Å; L165-V169 HydrophobicContact CD2-CG2 3.95Å; L165-R170 PolarHBondContact O-N 2.9Å
166	R	95.2	Very high	92.3	Very high	100 Å²	100	32.2 Å²	32.2	38%	0.377	15%	0.154	S	C	.	.	I	π-helix	trans	-70.8	-29.6	-179.9	-72.5	176.9	-179.5	175.6	4.2	113.9	I39 T162 N163 R170	I39-R166 HydrophobicContact CD1-CG 3.99Å; I39-R166 HydrophobicContact CG1-CG 4.2Å; I39-R166 HydrophobicContact CG2-CG 3.62Å; I39-R166 VanDerWaalsContact CG2-NE 3.34Å; T162-R166 WeakPolarHBondContact O-CG 3.47Å; T162-R166 PolarHBondContact O-N 2.76Å; T162-R166 VanDerWaalsContact O-N 3.1Å; N163-R166 PolarHBondContact O-N 2.95Å; R166-R170 WeakPolarHBondContact O-CB 3.12Å
167	G	94	Very high	91.8	Very high	16 Å²	16	34 Å²	34	17%	0.165	17%	0.169	C	C	.	.	I	π-helix	trans	-95.1	-95.9	179.9	0	0	0	0	0	111.2	N163 F164 V169 R170 L171	N163-G167 PolarHBondContact O-N 3.34Å; F164-G167 PolarHBondContact O-N 2.73Å; G167-V169 PolarHBondContact O-N 2.87Å; G167-R170 PolarHBondContact O-N 2.76Å; G167-L171 WeakPolarHBondContact O-CG 3.35Å; G167-L171 PolarHBondContact O-N 3.47Å
168	K	92.3	Very high	91.1	Very high	23 Å²	23	35.1 Å²	35.1	10%	0.1	18%	0.178	C	C	.	.	I	π-helix	trans	-55.9	-44.8	-169.1	-67.2	-174.8	174.8	176.4	0	113.6	L66 N68 V69 E85 V86 F164 L171 L172	L66-K168 WeakPolarHBondContact O-CE 3.32Å; L66-K168 PolarHBondContact O-NZ 3.27Å; N68-K168 WeakPolarHBondContact O-CE 3.4Å; N68-K168 PolarHBondContact O-NZ 3.24Å; V69-K168 HydrophobicContact CG2-CG 3.96Å; E85-K168 HydrophobicContact CG-CD 4.41Å; E85-K168 VanDerWaalsContact OE1-CE 3.25Å; E85-K168 WeakPolarHBondContact OE1-CE 3.35Å; E85-K168 IonicContact OE1-NZ 2.75Å; E85-K168 PolarHBondContact OE1-NZ 2Å; V86-K168 HydrophobicContact CG2-CB 4.15Å; F164-K168 HydrophobicContact CD2-CB 4.28Å; F164-K168 HydrophobicContact CD2-CD 4.14Å; F164-K168 HydrophobicContact CE2-CB 4.21Å; F164-K168 HydrophobicContact CE2-CD 3.95Å; F164-K168 PolarHBondContact O-N 2.95Å; F164-K168 VanDerWaalsContact O-N 3.12Å; K168-L171 PolarHBondContact O-N 2.66Å; K168-L172 WeakPolarHBondContact O-CB 3.2Å; K168-L172 PolarHBondContact O-N 3.43Å
169	V	92.9	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-66.1	-45.6	-179.9	-177.3	0	0	0	0	111.5	L35 V86 L123 L127 F164 L165 G167 L171 L172 L173	L35-V169 HydrophobicContact CD1-CB 4.45Å; L35-V169 HydrophobicContact CD1-CG1 3.66Å; V86-V169 HydrophobicContact CG1-CG2 3.87Å; V86-V169 HydrophobicContact CG2-CG2 4.4Å; L123-V169 HydrophobicContact CD1-CG1 4.36Å; L123-V169 HydrophobicContact CD2-CG1 4.15Å; L127-V169 HydrophobicContact CD1-CG1 4.49Å; F164-V169 HydrophobicContact CD1-CG2 3.7Å; F164-V169 HydrophobicContact CE1-CG2 3.64Å; F164-V169 PolarHBondContact O-N 2.87Å; L165-V169 HydrophobicContact CD2-CG2 3.95Å; G167-V169 PolarHBondContact O-N 2.87Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 3.09Å; V169-L172 PolarHBondContact O-N 3.31Å; V169-L173 HydrophobicContact CG1-CD1 4.17Å; V169-L173 WeakPolarHBondContact O-CG 3.33Å; V169-L173 PolarHBondContact O-N 2.82Å
170	R	93.3	Very high	89.6	Confident	97 Å²	97	36.3 Å²	36.3	37%	0.366	19%	0.192	S	C	.	.	H	α-helix	trans	-61.6	-43.5	177.9	-176.9	174.6	-93.9	-175.1	-12	111.9	L35 D36 L165 R166 G167 L173 T174	L35-R170 VanDerWaalsContact CD2-CA 3.44Å; L35-R170 HydrophobicContact CD2-CB 3.52Å; L35-R170 HydrophobicContact CD2-CG 3.93Å; D36-R170 IonicContact OD1-CZ 3.79Å; D36-R170 IonicContact OD1-NH2 3.69Å; D36-R170 PolarHBondContact OD1-NH2 3.3Å; D36-R170 IonicContact OD2-NH2 3.15Å; L165-R170 PolarHBondContact O-N 2.9Å; R166-R170 WeakPolarHBondContact O-CB 3.12Å; G167-R170 PolarHBondContact O-N 2.76Å; R170-L173 PolarHBondContact O-N 2.98Å; R170-T174 WeakPolarHBondContact O-CB 3.45Å; R170-T174 PolarHBondContact O-N 3.4Å; R170-T174 PolarHBondContact O-OG1 3.16Å
171	L	91.9	Very high	87.8	Confident	38 Å²	38	43.6 Å²	43.6	20%	0.199	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-44.2	179.2	-70.8	165.7	0	0	0	111.6	V69 F71 L74 G167 K168 V169 L173 T174 N175	V69-L171 HydrophobicContact CB-CD1 4.18Å; V69-L171 HydrophobicContact CG1-CD1 3.57Å; V69-L171 HydrophobicContact CG2-CD1 3.73Å; F71-L171 HydrophobicContact CE1-CD1 4.41Å; F71-L171 HydrophobicContact CE1-CD2 4.38Å; L74-L171 HydrophobicContact CD2-CB 4.32Å; L74-L171 HydrophobicContact CD2-CD1 3.87Å; L74-L171 HydrophobicContact CD2-CD2 4.22Å; L74-L171 HydrophobicContact CD2-CG 4.37Å; G167-L171 WeakPolarHBondContact O-CG 3.35Å; G167-L171 PolarHBondContact O-N 3.47Å; K168-L171 PolarHBondContact O-N 2.66Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 3.09Å; L171-L173 VanDerWaalsContact C-N 3.32Å; L171-L173 PolarHBondContact O-N 3.39Å; L171-T174 PolarHBondContact O-N 3.12Å; L171-N175 WeakPolarHBondContact O-CB 3.13Å; L171-N175 PolarHBondContact O-N 2.91Å; L171-N175 PolarHBondContact O-ND2 3.07Å
172	L	89.4	Confident	85.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-55.2	-48.2	173.4	174.4	65.6	0	0	0	111.3	T79 Q82 A83 V86 L127 I132 K168 V169 N175 A176	T79-L172 HydrophobicContact CG2-CD1 4.11Å; Q82-L172 HydrophobicContact CB-CD1 3.91Å; A83-L172 HydrophobicContact CB-CD1 4.14Å; A83-L172 HydrophobicContact CB-CD2 4.35Å; V86-L172 HydrophobicContact CB-CD2 3.74Å; V86-L172 HydrophobicContact CG1-CD2 3.98Å; V86-L172 HydrophobicContact CG2-CB 4.23Å; V86-L172 HydrophobicContact CG2-CD2 3.72Å; L127-L172 HydrophobicContact CD2-CD2 4.34Å; I132-L172 HydrophobicContact CD1-CD1 4.3Å; I132-L172 HydrophobicContact CD1-CD2 4.13Å; I132-L172 HydrophobicContact CD1-CG 4.31Å; K168-L172 WeakPolarHBondContact O-CB 3.2Å; K168-L172 PolarHBondContact O-N 3.43Å; V169-L172 PolarHBondContact O-N 3.31Å; L172-N175 PolarHBondContact O-N 3.19Å; L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 2.8Å; L172-A176 PolarHBondContact O-N 3.44Å
173	L	89	Confident	82.7	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.058	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-37.3	-179.9	-73.6	173.7	0	0	0	113	I29 L35 L127 L130 V169 R170 L171 N175 C179	I29-L173 HydrophobicContact CD1-CD1 3.96Å; I29-L173 HydrophobicContact CG1-CD1 3.75Å; I29-L173 HydrophobicContact CG1-CD2 3.62Å; I29-L173 HydrophobicContact CG1-CG 4.36Å; I29-L173 HydrophobicContact CG2-CD2 4.3Å; L35-L173 HydrophobicContact CB-CD1 4.23Å; L35-L173 HydrophobicContact CD1-CD1 4.1Å; L35-L173 HydrophobicContact CD2-CD1 4Å; L35-L173 HydrophobicContact CG-CD1 4.32Å; L127-L173 HydrophobicContact CD2-CD1 4.45Å; L127-L173 HydrophobicContact CD2-CD2 3.59Å; L127-L173 HydrophobicContact CD2-CG 4.05Å; L130-L173 HydrophobicContact CD1-CD2 3.5Å; L130-L173 VanDerWaalsContact CD1-CD2 3.5Å; V169-L173 HydrophobicContact CG1-CD1 4.17Å; V169-L173 WeakPolarHBondContact O-CG 3.33Å; V169-L173 PolarHBondContact O-N 2.82Å; R170-L173 PolarHBondContact O-N 2.98Å; L171-L173 VanDerWaalsContact C-N 3.32Å; L171-L173 PolarHBondContact O-N 3.39Å; L173-N175 VanDerWaalsContact C-N 3.34Å; L173-C179 WeakPolarHBondContact O-CB 3.48Å
174	T	87.9	Confident	79.6	Confident	89 Å²	89	63.4 Å²	63.4	55%	0.546	35%	0.348	S	S	.	.	H	α-helix	trans	-66.6	-38.4	177.5	-54.4	0	0	0	0	111.2	R170 L171	R170-T174 WeakPolarHBondContact O-CB 3.45Å; R170-T174 PolarHBondContact O-N 3.4Å; R170-T174 PolarHBondContact O-OG1 3.16Å; L171-T174 PolarHBondContact O-N 3.12Å
175	N	83.6	Confident	78.8	Confident	60 Å²	60	66.6 Å²	66.6	32%	0.321	37%	0.365	S	S	.	.	H	α-helix	trans	-91.1	-9.2	-177.3	-64.8	-20.9	0	0	0	113.4	L171 L172 L173 P177 Q180	L171-N175 WeakPolarHBondContact O-CB 3.13Å; L171-N175 PolarHBondContact O-N 2.91Å; L171-N175 PolarHBondContact O-ND2 3.07Å; L172-N175 PolarHBondContact O-N 3.19Å; L173-N175 VanDerWaalsContact C-N 3.34Å; N175-P177 WeakPolarHBondContact O-CD 3.33Å; N175-Q180 PolarHBondContact O-NE2 3.06Å
176	A	83.1	Confident	77.9	Confident	2 Å²	2	69.9 Å²	69.9	2%	0.017	38%	0.384	C	S	.	.			trans	-62.1	124.9	-178.4	0	0	0	0	0	110.3	L172 A178 C179 Q180	L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 2.8Å; L172-A176 PolarHBondContact O-N 3.44Å; A176-A178 PolarHBondContact O-N 3.46Å; A176-C179 HydrophobicContact CB-CB 4.38Å; A176-C179 PolarHBondContact O-N 3.06Å; A176-Q180 PolarHBondContact O-N 2.83Å
177	P	79.6	Confident	76.9	Confident	83 Å²	83	68.3 Å²	68.3	54%	0.539	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-55.2	-32.5	177.4	-27.2	34.3	0	0	0	112.7	N175 C179 Q180	N175-P177 WeakPolarHBondContact O-CD 3.33Å; P177-C179 PolarHBondContact O-N 3Å; P177-Q180 PolarHBondContact O-N 2.94Å
178	A	78.4	Confident	75.9	Confident	24 Å²	24	71.4 Å²	71.4	20%	0.198	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-57.8	-26.7	173.4	0	0	0	0	0	115	L130 A176	L130-A178 HydrophobicContact CD2-CB 4.13Å; A176-A178 PolarHBondContact O-N 3.46Å
179	C	80.1	Confident	74.9	Confident	30 Å²	30	74.4 Å²	74.4	20%	0.203	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-105.4	-3.9	-175.9	-63.7	0	0	0	0	113.4	C30 L173 A176 P177 Q181	C30-C179 VanDerWaalsContact CA-SG 3.51Å; C30-C179 HydrophobicContact CB-CB 3.55Å; C30-C179 WeakPolarHBondContact CB-SG 3.47Å; C30-C179 WeakPolarHBondContact SG-CA 3.34Å; C30-C179 WeakPolarHBondContact SG-CB 3.41Å; C30-C179 CovalentContact SG-SG 2.05Å; C30-C179 PolarHBondContact SG-SG 2.85Å; L173-C179 WeakPolarHBondContact O-CB 3.48Å; A176-C179 HydrophobicContact CB-CB 4.38Å; A176-C179 PolarHBondContact O-N 3.06Å; P177-C179 PolarHBondContact O-N 3Å; C179-Q181 VanDerWaalsContact C-N 3.31Å; C179-Q181 PolarHBondContact O-N 2.91Å
180	Q	74	Confident	73.7	Confident	112 Å²	112	79.3 Å²	79.3	52%	0.523	44%	0.443	S	S	.	.			trans	-83.9	4.6	-179.3	-70.2	179.7	-5.1	0	0	114.3	N175 A176 P177 N182	N175-Q180 PolarHBondContact O-NE2 3.06Å; A176-Q180 PolarHBondContact O-N 2.83Å; P177-Q180 PolarHBondContact O-N 2.94Å; Q180-N182 PolarHBondContact O-N 3.15Å
181	Q	58.6	Low	72.3	Confident	156 Å²	156	78.1 Å²	78.1	73%	0.729	45%	0.449	S	S	*	.			trans	-78.1	33.6	-172.5	-65.4	-150.2	5.9	0	0	116.2	C179	C179-Q181 VanDerWaalsContact C-N 3.31Å; C179-Q181 PolarHBondContact O-N 2.91Å
182	N	46.1	Very low	70.8	Confident	167 Å²	167	81.2 Å²	81.2	89%	0.893	47%	0.468	S	S	*	.			trans	-142.1	49.7	176.1	-84.3	-23.6	0	0	0	112.6	Q180	Q180-N182 PolarHBondContact O-N 3.15Å
183	S	39.3	Very low	69.3	Low	106 Å²	106	87.8 Å²	87.8	74%	0.741	51%	0.506	S	S	*	.			trans	-142.9	66	168.2	57.9	0	0	0	0	111.2
184	T	31.7	Very low	67.5	Low	213 Å²	213	94.7 Å²	94.7	100%	1.307	55%	0.547	S	S	*	.			trans	-141	0	157.9	40.5	0	0	0	0	108.7

Retrieved 184 of 184 residues in 43.1 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).