A0A087X3N6_POEFO Loading...

Oligosaccharyltransferase complex subunit

Specific component of the STT3A-containing form of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity.

AlphaFold DB (A0A3B3TKR0), UniProt , Accession A0A087X3N6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 183 aa.

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(Predicted Aligned Error values between residue pairs)

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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	40.1	Very low	50.8	Low	240 Å²	240	145.7 Å²	145.7	100%	1.182	72%	0.715	S	S	*	*				0	121.8	0	-146	167.5	-173.5	0	0	107.5	F3	M1-F3 PolarHBondContact O-N 3.32Å
2	Y	42	Very low	51.2	Low	231 Å²	231	148.8 Å²	148.8	91%	0.906	71%	0.713	S	S	*	*			trans	-65.5	118.1	-163.8	-83.7	-99.5	0	0	0	113.6	R4	Y2-R4 PolarHBondContact O-N 3.4Å
3	F	43.7	Very low	51.4	Low	215 Å²	215	152.8 Å²	152.8	94%	0.943	72%	0.716	S	S	*	*			trans	-81.4	99.2	168.5	-133.1	-95.7	0	0	0	108.3	M1	M1-F3 PolarHBondContact O-N 3.32Å
4	R	46.4	Very low	51.5	Low	223 Å²	223	155 Å²	155	84%	0.842	72%	0.715	S	S	*	*			trans	-94.7	114.9	-178.7	-129.4	-179.6	-168.7	173.6	4.7	110.2	Y2 T6	Y2-R4 PolarHBondContact O-N 3.4Å; R4-T6 PolarHBondContact O-N 3.03Å
5	D	54.8	Low	51.8	Low	106 Å²	106	149.6 Å²	149.6	57%	0.567	70%	0.701	S	S	*	*			trans	-58.7	92.6	177.1	-167.9	9.7	0	0	0	112.4	T8	D5-T8 WeakPolarHBondContact OD2-CG2 3.48Å; D5-T8 PolarHBondContact OD2-OG1 2.98Å
6	T	54.5	Low	52.1	Low	117 Å²	117	151.1 Å²	151.1	72%	0.718	70%	0.698	S	S	*	*			trans	-95.8	-10.3	176.3	46.8	0	0	0	0	113	R4	R4-T6 PolarHBondContact O-N 3.03Å
7	S	55.3	Low	52.5	Low	77 Å²	77	144.9 Å²	144.9	54%	0.538	68%	0.68	S	S	.	*	H	α-helix	trans	-74.5	-43.3	-175.5	-171.1	0	0	0	0	112	K9 S10 V11	S7-K9 PolarHBondContact O-N 3.3Å; S7-S10 PolarHBondContact O-N 3.31Å; S7-S10 PolarHBondContact O-OG 3.29Å; S7-V11 PolarHBondContact O-N 3.47Å
8	T	56.3	Low	52.6	Low	78 Å²	78	146 Å²	146	48%	0.479	68%	0.677	S	S	.	*	H	α-helix	trans	-65.9	-31.7	-172.7	51.3	0	0	0	0	114.4	D5 R12	D5-T8 WeakPolarHBondContact OD2-CG2 3.48Å; D5-T8 PolarHBondContact OD2-OG1 2.98Å; T8-R12 PolarHBondContact O-N 3.35Å
9	K	52.9	Low	53	Low	167 Å²	167	141.6 Å²	141.6	73%	0.726	67%	0.668	S	S	*	*	H	α-helix	trans	-76.3	-29.9	179.2	-69.1	-173.8	179.8	-179.8	0	113.6	S7 R13	S7-K9 PolarHBondContact O-N 3.3Å; K9-R13 PolarHBondContact O-N 3.44Å
10	S	54.4	Low	53.3	Low	65 Å²	65	136.7 Å²	136.7	46%	0.455	66%	0.657	S	S	.	*	H	α-helix	trans	-74.5	-39.6	-179.2	77.5	0	0	0	0	112	S7 R13 R14	S7-S10 PolarHBondContact O-N 3.31Å; S7-S10 PolarHBondContact O-OG 3.29Å; S10-R13 PolarHBondContact O-N 3.2Å; S10-R14 PolarHBondContact O-N 2.89Å; S10-R14 VanDerWaalsContact O-N 3.08Å
11	V	57.9	Low	53.4	Low	84 Å²	84	137.6 Å²	137.6	51%	0.509	65%	0.654	S	S	.	*	H	α-helix	trans	-65.8	-43.3	177.6	178.9	0	0	0	0	110.5	S7 R13 R14 S15	S7-V11 PolarHBondContact O-N 3.47Å; V11-R13 VanDerWaalsContact C-N 3.28Å; V11-R13 PolarHBondContact O-N 3.08Å; V11-R14 PolarHBondContact O-N 3.17Å; V11-S15 PolarHBondContact O-N 3.36Å; V11-S15 PolarHBondContact O-OG 3.31Å
12	R	55.7	Low	54.2	Low	183 Å²	183	129.4 Å²	129.4	69%	0.691	62%	0.62	S	S	*	*	H	α-helix	trans	-68.7	-23.5	179.7	-142.8	176.1	-170.6	-167.6	2.6	113.8	T8 R16	T8-R12 PolarHBondContact O-N 3.35Å; R12-R16 PolarHBondContact O-NE 2.93Å
13	R	54.8	Low	55.1	Low	200 Å²	200	120.7 Å²	120.7	76%	0.755	60%	0.596	S	S	*	*	H	α-helix	trans	-79.4	-39.4	171.7	-81.8	-173.6	170.9	-170.5	-1.9	111.7	K9 S10 V11 A17	K9-R13 PolarHBondContact O-N 3.44Å; S10-R13 PolarHBondContact O-N 3.2Å; V11-R13 VanDerWaalsContact C-N 3.28Å; V11-R13 PolarHBondContact O-N 3.08Å; R13-A17 PolarHBondContact O-N 3.29Å
14	R	52.7	Low	55.9	Low	184 Å²	184	113.3 Å²	113.3	69%	0.694	58%	0.575	S	S	*	*	H	α-helix	trans	-62.4	-51.6	172.1	-80.8	-177.9	176.3	-176.9	-0.1	110.6	S10 V11 R16 A17 W18	S10-R14 PolarHBondContact O-N 2.89Å; S10-R14 VanDerWaalsContact O-N 3.08Å; V11-R14 PolarHBondContact O-N 3.17Å; R14-R16 VanDerWaalsContact C-N 3.28Å; R14-R16 PolarHBondContact O-N 3.37Å; R14-A17 CarbonylContact O-C 3.41Å; R14-A17 WeakPolarHBondContact O-CA 3.5Å; R14-A17 PolarHBondContact O-N 2.87Å; R14-W18 PolarHBondContact O-N 3.43Å
15	S	55.3	Low	56.5	Low	74 Å²	74	112.2 Å²	112.2	52%	0.517	57%	0.571	S	S	.	*	H	α-helix	trans	-57.3	-37.1	-178.1	-61.8	0	0	0	0	113.8	V11 W18 A19	V11-S15 PolarHBondContact O-N 3.36Å; V11-S15 PolarHBondContact O-OG 3.31Å; S15-W18 PolarHBondContact O-N 2.99Å; S15-A19 WeakPolarHBondContact O-CB 3.41Å; S15-A19 PolarHBondContact O-N 3.47Å
16	R	56.5	Low	56.8	Low	173 Å²	173	113.7 Å²	113.7	65%	0.653	57%	0.574	S	S	*	*	H	α-helix	trans	-69.7	-38	174.6	-77.5	-171.2	-85.5	-168.7	-3.8	113.2	R12 R14 W18 A19 G20	R12-R16 PolarHBondContact O-NE 2.93Å; R14-R16 VanDerWaalsContact C-N 3.28Å; R14-R16 PolarHBondContact O-N 3.37Å; R16-W18 VanDerWaalsContact C-N 3.33Å; R16-A19 PolarHBondContact O-N 3.2Å; R16-G20 PolarHBondContact O-N 3.02Å
17	A	58.5	Low	57	Low	46 Å²	46	116 Å²	116	38%	0.38	57%	0.574	S	S	.	*	H	α-helix	trans	-70.6	-27.5	174.7	0	0	0	0	0	113.1	R13 R14 R21	R13-A17 PolarHBondContact O-N 3.29Å; R14-A17 CarbonylContact O-C 3.41Å; R14-A17 WeakPolarHBondContact O-CA 3.5Å; R14-A17 PolarHBondContact O-N 2.87Å; A17-R21 WeakPolarHBondContact O-CB 3.48Å; A17-R21 WeakPolarHBondContact O-CG 3.39Å; A17-R21 PolarHBondContact O-N 2.92Å; A17-R21 PolarHBondContact O-NE 3.12Å
18	W	54.7	Low	57.2	Low	165 Å²	165	121.9 Å²	121.9	63%	0.625	59%	0.585	S	S	*	*	H	α-helix	trans	-75.7	-44.9	172	-79.3	89.8	0	0	0	111.2	R14 S15 R16 G20 R21 S22	R14-W18 PolarHBondContact O-N 3.43Å; S15-W18 PolarHBondContact O-N 2.99Å; R16-W18 VanDerWaalsContact C-N 3.33Å; W18-G20 PolarHBondContact O-N 3.5Å; W18-R21 PolarHBondContact O-N 3.06Å; W18-S22 PolarHBondContact O-N 3.18Å; W18-S22 PolarHBondContact O-OG 3.39Å; W18-S22 VanDerWaalsContact O-OG 3.06Å
19	A	60	Low	57.5	Low	62 Å²	62	121.1 Å²	121.1	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-60.5	-42.6	176.2	0	0	0	0	0	113	S15 R16 R21 S22 A23	S15-A19 WeakPolarHBondContact O-CB 3.41Å; S15-A19 PolarHBondContact O-N 3.47Å; R16-A19 PolarHBondContact O-N 3.2Å; A19-R21 VanDerWaalsContact C-N 3.35Å; A19-R21 PolarHBondContact O-N 2.91Å; A19-S22 PolarHBondContact O-N 3.43Å; A19-A23 PolarHBondContact O-N 3.46Å
20	G	59.9	Low	57.9	Low	44 Å²	44	117.1 Å²	117.1	45%	0.454	58%	0.575	S	S	.	*	H	α-helix	trans	-65.9	-34.3	176	0	0	0	0	0	113.6	R16 W18 A24	R16-G20 PolarHBondContact O-N 3.02Å; W18-G20 PolarHBondContact O-N 3.5Å; G20-A24 WeakPolarHBondContact O-CB 3.46Å; G20-A24 PolarHBondContact O-N 3.31Å; G20-A24 VanDerWaalsContact O-N 3.12Å
21	R	55.8	Low	58.2	Low	155 Å²	155	120.5 Å²	120.5	59%	0.585	58%	0.582	S	S	*	*	H	α-helix	trans	-72.8	-34.3	174.2	-81	-178	-77.5	-158.7	2.7	112.4	A17 W18 A19 R25	A17-R21 WeakPolarHBondContact O-CB 3.48Å; A17-R21 WeakPolarHBondContact O-CG 3.39Å; A17-R21 PolarHBondContact O-N 2.92Å; A17-R21 PolarHBondContact O-NE 3.12Å; W18-R21 PolarHBondContact O-N 3.06Å; A19-R21 VanDerWaalsContact C-N 3.35Å; A19-R21 PolarHBondContact O-N 2.91Å; R21-R25 VanDerWaalsContact O-CB 3.26Å; R21-R25 WeakPolarHBondContact O-CB 3.46Å; R21-R25 PolarHBondContact O-N 3.2Å
22	S	56.1	Low	58.2	Low	69 Å²	69	120.1 Å²	120.1	48%	0.483	58%	0.583	S	S	.	*	H	α-helix	trans	-66	-45.4	173.9	-59.4	0	0	0	0	111.7	W18 A19 A24 R25 E26	W18-S22 PolarHBondContact O-N 3.18Å; W18-S22 PolarHBondContact O-OG 3.39Å; W18-S22 VanDerWaalsContact O-OG 3.06Å; A19-S22 PolarHBondContact O-N 3.43Å; S22-A24 PolarHBondContact O-N 3.08Å; S22-R25 PolarHBondContact O-N 2.99Å; S22-E26 WeakPolarHBondContact O-CB 3.43Å; S22-E26 PolarHBondContact O-N 3.05Å
23	A	60.6	Low	58.6	Low	48 Å²	48	114.5 Å²	114.5	40%	0.397	57%	0.571	S	S	.	*	H	α-helix	trans	-65.8	-37.1	177.8	0	0	0	0	0	112.8	A19 K27	A19-A23 PolarHBondContact O-N 3.46Å; A23-K27 WeakPolarHBondContact O-CG 3.49Å; A23-K27 PolarHBondContact O-N 3.02Å
24	A	60.5	Low	59.2	Low	59 Å²	59	108.9 Å²	108.9	49%	0.488	56%	0.559	S	S	.	*	H	α-helix	trans	-69.5	-32.8	174.1	0	0	0	0	0	112.6	G20 S22 R28	G20-A24 WeakPolarHBondContact O-CB 3.46Å; G20-A24 PolarHBondContact O-N 3.31Å; G20-A24 VanDerWaalsContact O-N 3.12Å; S22-A24 PolarHBondContact O-N 3.08Å; A24-R28 WeakPolarHBondContact O-CB 3.26Å; A24-R28 PolarHBondContact O-N 2.89Å; A24-R28 VanDerWaalsContact O-N 3.08Å
25	R	59.3	Low	59.9	Low	201 Å²	201	103.7 Å²	103.7	76%	0.758	54%	0.544	S	S	*	.	H	α-helix	trans	-71.6	-39	175.9	-164	-179.4	-135.7	-172.5	2.9	111.6	R21 S22 R28 A29	R21-R25 VanDerWaalsContact O-CB 3.26Å; R21-R25 WeakPolarHBondContact O-CB 3.46Å; R21-R25 PolarHBondContact O-N 3.2Å; S22-R25 PolarHBondContact O-N 2.99Å; R25-R28 PolarHBondContact O-N 3.47Å; R25-A29 WeakPolarHBondContact O-CB 3.41Å; R25-A29 PolarHBondContact O-N 2.9Å
26	E	61.4	Low	60.4	Low	136 Å²	136	107 Å²	107	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-64.4	-49.7	174.6	-171.8	172	-175.6	0	0	110.9	S22 R28 A29 T30	S22-E26 WeakPolarHBondContact O-CB 3.43Å; S22-E26 PolarHBondContact O-N 3.05Å; E26-R28 VanDerWaalsContact C-N 3.3Å; E26-R28 PolarHBondContact O-N 3.3Å; E26-A29 WeakPolarHBondContact O-CB 3.4Å; E26-A29 PolarHBondContact O-N 2.9Å; E26-T30 PolarHBondContact O-N 3.05Å; E26-T30 PolarHBondContact O-OG1 2.9Å
27	K	59	Low	60.9	Low	166 Å²	166	102.9 Å²	102.9	72%	0.722	55%	0.545	S	S	*	.	H	α-helix	trans	-60.3	-36.7	175.8	-71.3	-171.6	-178.9	-167.5	0	113.3	A23 F31	A23-K27 WeakPolarHBondContact O-CG 3.49Å; A23-K27 PolarHBondContact O-N 3.02Å; K27-F31 VanDerWaalsContact O-CB 3.31Å; K27-F31 WeakPolarHBondContact O-CB 3.31Å; K27-F31 PolarHBondContact O-N 2.89Å
28	R	59.3	Low	61.5	Low	201 Å²	201	106.7 Å²	106.7	76%	0.758	56%	0.559	S	S	*	*	H	α-helix	trans	-68	-38.7	172.9	-100.3	-176.8	175.2	-178.1	-1.6	112.6	A24 R25 E26 F31 C32	A24-R28 WeakPolarHBondContact O-CB 3.26Å; A24-R28 PolarHBondContact O-N 2.89Å; A24-R28 VanDerWaalsContact O-N 3.08Å; R25-R28 PolarHBondContact O-N 3.47Å; E26-R28 VanDerWaalsContact C-N 3.3Å; E26-R28 PolarHBondContact O-N 3.3Å; R28-F31 PolarHBondContact O-N 3.44Å; R28-C32 WeakPolarHBondContact O-CB 3.35Å; R28-C32 PolarHBondContact O-N 3.06Å
29	A	61.3	Low	61.9	Low	61 Å²	61	106.1 Å²	106.1	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-67.2	-42.5	178.1	0	0	0	0	0	111.5	R25 E26 C32 S33	R25-A29 WeakPolarHBondContact O-CB 3.41Å; R25-A29 PolarHBondContact O-N 2.9Å; E26-A29 WeakPolarHBondContact O-CB 3.4Å; E26-A29 PolarHBondContact O-N 2.9Å; A29-C32 PolarHBondContact O-N 3.19Å; A29-S33 WeakPolarHBondContact O-CB 3.49Å; A29-S33 PolarHBondContact O-N 3.08Å
30	T	62	Low	62.2	Low	83 Å²	83	106 Å²	106	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-65.7	-40.6	175.4	-35.4	0	0	0	0	111.4	E26 S33 T34	E26-T30 PolarHBondContact O-N 3.05Å; E26-T30 PolarHBondContact O-OG1 2.9Å; T30-S33 PolarHBondContact O-N 3.33Å; T30-T34 PolarHBondContact O-N 3.28Å; T30-T34 PolarHBondContact O-OG1 3.46Å
31	F	60.9	Low	62.6	Low	136 Å²	136	111.3 Å²	111.3	60%	0.596	56%	0.564	S	S	*	*	H	α-helix	trans	-65	-44.3	176	-173.7	-97	0	0	0	112.2	K27 R28 T34 M35	K27-F31 VanDerWaalsContact O-CB 3.31Å; K27-F31 WeakPolarHBondContact O-CB 3.31Å; K27-F31 PolarHBondContact O-N 2.89Å; R28-F31 PolarHBondContact O-N 3.44Å; F31-T34 PolarHBondContact O-N 3.12Å; F31-M35 HydrophobicContact CD1-CG 4.33Å; F31-M35 HydrophobicContact CE1-CG 4Å; F31-M35 HydrophobicContact CE1-SD 3.73Å; F31-M35 HydrophobicContact CZ-CG 4.21Å; F31-M35 HydrophobicContact CZ-SD 3.92Å; F31-M35 WeakPolarHBondContact O-CG 3.39Å; F31-M35 PolarHBondContact O-N 2.82Å
32	C	58.6	Low	63	Low	77 Å²	77	107.1 Å²	107.1	52%	0.52	56%	0.556	S	S	.	*	H	α-helix	trans	-59.3	-46.2	172.2	-97.4	0	0	0	0	111.8	R28 A29 T34 M35 E36	R28-C32 WeakPolarHBondContact O-CB 3.35Å; R28-C32 PolarHBondContact O-N 3.06Å; A29-C32 PolarHBondContact O-N 3.19Å; C32-T34 VanDerWaalsContact C-N 3.31Å; C32-T34 PolarHBondContact O-N 3.28Å; C32-M35 PolarHBondContact O-N 3Å; C32-E36 WeakPolarHBondContact O-CG 3.36Å; C32-E36 PolarHBondContact O-N 3.34Å
33	S	63.8	Low	63.1	Low	65 Å²	65	110.6 Å²	110.6	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-62.4	-38.4	178.8	175.5	0	0	0	0	112.2	A29 T30 E36 T37	A29-S33 WeakPolarHBondContact O-CB 3.49Å; A29-S33 PolarHBondContact O-N 3.08Å; T30-S33 PolarHBondContact O-N 3.33Å; S33-E36 PolarHBondContact O-N 3.45Å; S33-T37 WeakPolarHBondContact O-CB 3.43Å; S33-T37 PolarHBondContact O-N 2.71Å; S33-T37 PolarHBondContact O-OG1 3.26Å
34	T	67.6	Low	63.1	Low	81 Å²	81	111.4 Å²	111.4	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-70.1	-38.7	179	-45.6	0	0	0	0	110.9	T30 F31 C32 T37 L38	T30-T34 PolarHBondContact O-N 3.28Å; T30-T34 PolarHBondContact O-OG1 3.46Å; F31-T34 PolarHBondContact O-N 3.12Å; C32-T34 VanDerWaalsContact C-N 3.31Å; C32-T34 PolarHBondContact O-N 3.28Å; T34-T37 PolarHBondContact O-N 2.93Å; T34-L38 WeakPolarHBondContact O-CB 3.38Å; T34-L38 PolarHBondContact O-N 3.39Å
35	M	65.8	Low	63	Low	76 Å²	76	114.1 Å²	114.1	37%	0.374	58%	0.58	S	S	.	*	H	α-helix	trans	-66.9	-41.8	174.5	-68.8	-139.4	90.3	0	0	112	F31 C32 T37 L38 Y39	F31-M35 HydrophobicContact CD1-CG 4.33Å; F31-M35 HydrophobicContact CE1-CG 4Å; F31-M35 HydrophobicContact CE1-SD 3.73Å; F31-M35 HydrophobicContact CZ-CG 4.21Å; F31-M35 HydrophobicContact CZ-SD 3.92Å; F31-M35 WeakPolarHBondContact O-CG 3.39Å; F31-M35 PolarHBondContact O-N 2.82Å; C32-M35 PolarHBondContact O-N 3Å; M35-T37 VanDerWaalsContact C-N 3.3Å; M35-T37 PolarHBondContact O-N 3.38Å; M35-L38 PolarHBondContact O-N 2.9Å; M35-Y39 HydrophobicContact CE-CE2 3.87Å; M35-Y39 WeakPolarHBondContact O-CB 3.49Å; M35-Y39 WeakPolarHBondContact O-CD2 3.39Å; M35-Y39 PolarHBondContact O-N 2.95Å
36	E	66.1	Low	62.9	Low	143 Å²	143	110.5 Å²	110.5	67%	0.668	58%	0.575	S	S	*	*	H	α-helix	trans	-61.5	-39.7	175.1	-74.1	-175	163.8	0	0	111.8	C32 S33 S40	C32-E36 WeakPolarHBondContact O-CG 3.36Å; C32-E36 PolarHBondContact O-N 3.34Å; S33-E36 PolarHBondContact O-N 3.45Å; E36-S40 VanDerWaalsContact O-CB 3.23Å; E36-S40 WeakPolarHBondContact O-CB 3.27Å; E36-S40 PolarHBondContact O-N 2.64Å; E36-S40 PolarHBondContact O-OG 3.48Å
37	T	68.3	Low	62.8	Low	87 Å²	87	111.2 Å²	111.2	53%	0.534	58%	0.579	S	S	.	*	H	α-helix	trans	-68.6	-37.1	177.2	-44.9	0	0	0	0	112.1	S33 T34 M35 S40 F41	S33-T37 WeakPolarHBondContact O-CB 3.43Å; S33-T37 PolarHBondContact O-N 2.71Å; S33-T37 PolarHBondContact O-OG1 3.26Å; T34-T37 PolarHBondContact O-N 2.93Å; M35-T37 VanDerWaalsContact C-N 3.3Å; M35-T37 PolarHBondContact O-N 3.38Å; T37-S40 PolarHBondContact O-OG 2.89Å; T37-S40 VanDerWaalsContact O-OG 3.11Å; T37-F41 PolarHBondContact O-N 3.45Å
38	L	69.8	Low	62.4	Low	125 Å²	125	108.7 Å²	108.7	65%	0.654	58%	0.58	S	S	*	*	H	α-helix	trans	-72.2	-37.7	179.2	-154.4	109.4	0	0	0	111.8	T34 M35 P42	T34-L38 WeakPolarHBondContact O-CB 3.38Å; T34-L38 PolarHBondContact O-N 3.39Å; M35-L38 PolarHBondContact O-N 2.9Å; L38-P42 WeakPolarHBondContact O-CD 3.33Å
39	Y	64.6	Low	62.2	Low	153 Å²	153	103.6 Å²	103.6	60%	0.6	57%	0.574	S	S	*	*	H	α-helix	trans	-75.1	-31.8	174.5	-82.8	-70.4	0	0	0	112.5	M35 F41 P42 F43	M35-Y39 HydrophobicContact CE-CE2 3.87Å; M35-Y39 WeakPolarHBondContact O-CB 3.49Å; M35-Y39 WeakPolarHBondContact O-CD2 3.39Å; M35-Y39 PolarHBondContact O-N 2.95Å; Y39-F41 VanDerWaalsContact C-N 3.34Å; Y39-F41 PolarHBondContact O-N 3.46Å; Y39-P42 VanDerWaalsContact O-CD 3.29Å; Y39-P42 WeakPolarHBondContact O-CD 3.49Å; Y39-P42 WeakPolarHBondContact O-CG 3.47Å; Y39-F43 VanDerWaalsContact O-CD2 3.23Å; Y39-F43 WeakPolarHBondContact O-CD2 3.22Å
40	S	64.9	Low	62.1	Low	60 Å²	60	107.3 Å²	107.3	42%	0.42	59%	0.585	S	S	.	*	H	α-helix	trans	-74	-22.3	-179.9	70.8	0	0	0	0	113.8	E36 T37 F43 A44	E36-S40 VanDerWaalsContact O-CB 3.23Å; E36-S40 WeakPolarHBondContact O-CB 3.27Å; E36-S40 PolarHBondContact O-N 2.64Å; E36-S40 PolarHBondContact O-OG 3.48Å; T37-S40 PolarHBondContact O-OG 2.89Å; T37-S40 VanDerWaalsContact O-OG 3.11Å; S40-F43 CarbonylContact O-C 3.58Å; S40-F43 PolarHBondContact O-N 3.34Å; S40-A44 WeakPolarHBondContact O-CB 3.43Å; S40-A44 PolarHBondContact O-N 3.28Å
41	F	68.8	Low	62.1	Low	156 Å²	156	108.6 Å²	108.6	68%	0.684	59%	0.588	S	S	*	*	H	α-helix	trans	-60.7	-49	-177.8	-166.4	-95.6	0	0	0	114.2	T37 Y39 F43 A44 V45	T37-F41 PolarHBondContact O-N 3.45Å; Y39-F41 VanDerWaalsContact C-N 3.34Å; Y39-F41 PolarHBondContact O-N 3.46Å; F41-F43 VanDerWaalsContact C-N 3.31Å; F41-F43 PolarHBondContact O-N 2.91Å; F41-A44 PolarHBondContact O-N 3.43Å; F41-V45 PolarHBondContact O-N 3.13Å
42	P	64.6	Low	62	Low	66 Å²	66	110.6 Å²	110.6	43%	0.429	60%	0.596	S	S	.	*	H	α-helix	trans	-66.6	-31.2	173.8	25.6	-34.7	0	0	0	112.8	L38 Y39 V45 L46	L38-P42 WeakPolarHBondContact O-CD 3.33Å; Y39-P42 VanDerWaalsContact O-CD 3.29Å; Y39-P42 WeakPolarHBondContact O-CD 3.49Å; Y39-P42 WeakPolarHBondContact O-CG 3.47Å; P42-V45 PolarHBondContact O-N 3.27Å; P42-L46 WeakPolarHBondContact O-CB 3.34Å; P42-L46 WeakPolarHBondContact O-CD1 3.46Å; P42-L46 PolarHBondContact O-N 2.89Å
43	F	57.6	Low	62	Low	142 Å²	142	113.4 Å²	113.4	62%	0.623	61%	0.605	S	S	*	*	H	α-helix	trans	-76.9	-16.9	175.9	-72	-69.4	0	0	0	114	Y39 S40 F41 L46 E47	Y39-F43 VanDerWaalsContact O-CD2 3.23Å; Y39-F43 WeakPolarHBondContact O-CD2 3.22Å; S40-F43 CarbonylContact O-C 3.58Å; S40-F43 PolarHBondContact O-N 3.34Å; F41-F43 VanDerWaalsContact C-N 3.31Å; F41-F43 PolarHBondContact O-N 2.91Å; F43-L46 CarbonylContact O-C 3.41Å; F43-E47 PolarHBondContact O-N 2.93Å
44	A	60	Low	61.7	Low	65 Å²	65	119.4 Å²	119.4	54%	0.537	62%	0.623	S	S	.	*	H	α-helix	trans	-77.1	-30.5	170.3	0	0	0	0	0	111.8	S40 F41	S40-A44 WeakPolarHBondContact O-CB 3.43Å; S40-A44 PolarHBondContact O-N 3.28Å; F41-A44 PolarHBondContact O-N 3.43Å
45	V	59.5	Low	61.3	Low	117 Å²	117	124.3 Å²	124.3	71%	0.709	64%	0.637	S	S	*	*	H	α-helix	trans	-81.7	-30.9	172.7	-178.6	0	0	0	0	111.1	F41 P42	F41-V45 PolarHBondContact O-N 3.13Å; P42-V45 PolarHBondContact O-N 3.27Å
46	L	56.7	Low	61.1	Low	125 Å²	125	124.8 Å²	124.8	65%	0.654	65%	0.646	S	S	*	*	S	Bend	trans	-89.3	9.7	170.5	-94.9	88.4	0	0	0	113.9	P42 F43 C48	P42-L46 WeakPolarHBondContact O-CB 3.34Å; P42-L46 WeakPolarHBondContact O-CD1 3.46Å; P42-L46 PolarHBondContact O-N 2.89Å; F43-L46 CarbonylContact O-C 3.41Å; L46-C48 PolarHBondContact O-N 3.46Å
47	E	59	Low	61	Low	151 Å²	151	123.8 Å²	123.8	71%	0.706	66%	0.655	S	S	*	*	S	Bend	trans	-61.3	102.1	165.1	-105.5	-168.9	168.2	0	0	105	F43 P49	F43-E47 PolarHBondContact O-N 2.93Å; E47-P49 WeakPolarHBondContact O-CD 3.36Å
48	C	51.2	Low	60.8	Low	112 Å²	112	130.8 Å²	130.8	76%	0.757	67%	0.672	S	S	*	*			trans	-44.8	113.5	177.9	-63.7	0	0	0	0	105.2	L46 N50	L46-C48 PolarHBondContact O-N 3.46Å; C48-N50 PolarHBondContact O-N 3.5Å
49	P	56.2	Low	60.6	Low	95 Å²	95	131 Å²	131	62%	0.617	67%	0.673	S	S	*	*			trans	-49.9	126.6	-178.2	19	-31.5	0	0	0	104.7	E47 I51	E47-P49 WeakPolarHBondContact O-CD 3.36Å; P49-I51 HydrophobicContact CB-CD1 4.32Å; P49-I51 HydrophobicContact CB-CG1 3.91Å; P49-I51 HydrophobicContact CG-CD1 3.73Å; P49-I51 HydrophobicContact CG-CG1 3.89Å; P49-I51 WeakPolarHBondContact O-CG1 3.46Å; P49-I51 PolarHBondContact O-N 3.44Å
50	N	58.6	Low	61	Low	139 Å²	139	131.8 Å²	131.8	74%	0.743	68%	0.682	S	S	*	*			trans	-69.3	69.8	178.7	-169.2	-7	0	0	0	106.6	C48 K52	C48-N50 PolarHBondContact O-N 3.5Å; N50-K52 PolarHBondContact O-N 3.01Å
51	I	61.3	Low	61.5	Low	110 Å²	110	136.9 Å²	136.9	56%	0.564	70%	0.701	S	S	*	*			trans	-70.7	89.2	174.2	-60.3	163.2	0	0	0	101.5	P49 L53	P49-I51 HydrophobicContact CB-CD1 4.32Å; P49-I51 HydrophobicContact CB-CG1 3.91Å; P49-I51 HydrophobicContact CG-CD1 3.73Å; P49-I51 HydrophobicContact CG-CG1 3.89Å; P49-I51 WeakPolarHBondContact O-CG1 3.46Å; P49-I51 PolarHBondContact O-N 3.44Å; I51-L53 HydrophobicContact CB-CD1 4.43Å; I51-L53 HydrophobicContact CG2-CB 4.13Å; I51-L53 HydrophobicContact CG2-CD1 3.64Å; I51-L53 HydrophobicContact CG2-CG 3.48Å; I51-L53 VanDerWaalsContact CG2-CG 3.48Å; I51-L53 PolarHBondContact O-N 3.34Å
52	K	58.5	Low	62.3	Low	177 Å²	177	133 Å²	133	77%	0.77	69%	0.692	S	S	*	*			trans	-60.9	74.9	153.4	-64.5	179.6	-178.5	177.4	0	105.6	N50 K54	N50-K52 PolarHBondContact O-N 3.01Å; K52-K54 PolarHBondContact O-N 2.97Å
53	L	58.8	Low	63.5	Low	136 Å²	136	133.3 Å²	133.3	71%	0.712	70%	0.696	S	S	*	*			trans	-59.5	92.6	165.1	-100.3	141.1	0	0	0	103.2	I51 K55	I51-L53 HydrophobicContact CB-CD1 4.43Å; I51-L53 HydrophobicContact CG2-CB 4.13Å; I51-L53 HydrophobicContact CG2-CD1 3.64Å; I51-L53 HydrophobicContact CG2-CG 3.48Å; I51-L53 VanDerWaalsContact CG2-CG 3.48Å; I51-L53 PolarHBondContact O-N 3.34Å; L53-K55 PolarHBondContact O-N 2.99Å
54	K	56.9	Low	65	Low	191 Å²	191	130.3 Å²	130.3	83%	0.83	70%	0.697	S	S	*	*			trans	-58	99.1	166.3	-160.9	-177.7	-172.1	-173.6	0	102.7	K52	K52-K54 PolarHBondContact O-N 2.97Å
55	K	61.1	Low	66.4	Low	184 Å²	184	134 Å²	134	80%	0.8	71%	0.705	S	S	*	*			trans	-44.5	122.8	176.8	-54.7	177.4	-172.3	178	0	104.7	L53 S57	L53-K55 PolarHBondContact O-N 2.99Å; K55-S57 PolarHBondContact O-N 3.46Å
56	P	61.3	Low	67.9	Low	87 Å²	87	132.1 Å²	132.1	57%	0.565	69%	0.693	S	S	*	*			trans	-53.2	116.3	-174.1	20.2	-30.9	0	0	0	106.6	W58 L59	P56-W58 PolarHBondContact O-N 3.33Å; P56-L59 HydrophobicContact CG-CB 4.45Å; P56-L59 PolarHBondContact O-N 3.2Å
57	S	62.5	Low	69.6	Low	122 Å²	122	129.5 Å²	129.5	85%	0.853	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-5	-179.3	54.3	0	0	0	0	112.2	K55	K55-S57 PolarHBondContact O-N 3.46Å
58	W	65.1	Low	71.1	Confident	233 Å²	233	126.9 Å²	126.9	88%	0.883	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-30.5	173.3	-167.9	74	0	0	0	113.4	P56 H60	P56-W58 PolarHBondContact O-N 3.33Å; W58-H60 PolarHBondContact O-N 3.4Å
59	L	65.5	Low	73	Confident	131 Å²	131	124 Å²	124	69%	0.686	65%	0.651	S	S	*	*	S	Bend	trans	-93.7	79.6	176.6	-160.5	86.3	0	0	0	109.2	P56 M61	P56-L59 HydrophobicContact CG-CB 4.45Å; P56-L59 PolarHBondContact O-N 3.2Å; L59-M61 PolarHBondContact O-N 2.99Å
60	H	73.8	Confident	74.8	Confident	169 Å²	169	123.9 Å²	123.9	78%	0.782	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-63.2	124.1	168.8	-167.1	-109.2	0	0	0	108.4	W58 P62	W58-H60 PolarHBondContact O-N 3.4Å; H60-P62 WeakPolarHBondContact O-CD 3.48Å
61	M	74.7	Confident	76.5	Confident	166 Å²	166	121.1 Å²	121.1	82%	0.818	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-61.2	121.4	178.5	-167.9	167.5	170.5	0	0	108	L59	L59-M61 PolarHBondContact O-N 2.99Å
62	P	84.8	Confident	78	Confident	76 Å²	76	117.9 Å²	117.9	49%	0.494	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-63.2	143.5	-176.3	25.4	-33.4	0	0	0	109.8	H60 V67	H60-P62 WeakPolarHBondContact O-CD 3.48Å; P62-V67 HydrophobicContact CB-CG2 4.04Å; P62-V67 HydrophobicContact CG-CG2 3.81Å
63	S	89.8	Confident	79.5	Confident	72 Å²	72	113.4 Å²	113.4	50%	0.503	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-60.3	144.8	174.8	176.7	0	0	0	0	110.1	M65 T66 V67	S63-M65 PolarHBondContact O-N 3.17Å; S63-M65 VanDerWaalsContact O-N 3.11Å; S63-T66 WeakPolarHBondContact O-CA 3.23Å; S63-T66 WeakPolarHBondContact O-CB 3.29Å; S63-T66 PolarHBondContact O-N 2.91Å; S63-V67 PolarHBondContact O-N 3.27Å; S63-V67 VanDerWaalsContact O-N 3.13Å
64	A	88.8	Confident	81.2	Confident	79 Å²	79	109.2 Å²	109.2	65%	0.653	59%	0.589	S	S	*	*	H	α-helix	trans	-52.9	-35.2	178.5	0	0	0	0	0	112.4	V67 Y68	A64-V67 PolarHBondContact O-N 2.87Å; A64-Y68 WeakPolarHBondContact O-CB 3.23Å; A64-Y68 PolarHBondContact O-N 3.09Å
65	M	90.6	Very high	82.8	Confident	142 Å²	142	105.8 Å²	105.8	70%	0.7	57%	0.572	S	S	*	*	H	α-helix	trans	-71.1	-31.2	177.1	-66.1	-64.5	159.7	0	0	113.1	S63 Y68 A69	S63-M65 PolarHBondContact O-N 3.17Å; S63-M65 VanDerWaalsContact O-N 3.11Å; M65-Y68 WeakPolarHBondContact O-CB 3.36Å; M65-Y68 PolarHBondContact O-N 2.96Å; M65-A69 PolarHBondContact O-N 3.42Å
66	T	89.6	Confident	84.3	Confident	77 Å²	77	99.6 Å²	99.6	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-69.7	-44	175.3	-51.9	0	0	0	0	110.5	S63 Y68 A69 V70	S63-T66 WeakPolarHBondContact O-CA 3.23Å; S63-T66 WeakPolarHBondContact O-CB 3.29Å; S63-T66 PolarHBondContact O-N 2.91Å; T66-Y68 VanDerWaalsContact C-N 3.28Å; T66-Y68 PolarHBondContact O-N 3.42Å; T66-A69 PolarHBondContact O-N 2.99Å; T66-V70 WeakPolarHBondContact O-CG2 3.38Å; T66-V70 PolarHBondContact O-N 3.48Å
67	V	93.4	Very high	85.6	Confident	71 Å²	71	98.9 Å²	98.9	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-60.2	-43.4	175	-179.6	0	0	0	0	110.1	P62 S63 A64 A69 V70 V71	P62-V67 HydrophobicContact CB-CG2 4.04Å; P62-V67 HydrophobicContact CG-CG2 3.81Å; S63-V67 PolarHBondContact O-N 3.27Å; S63-V67 VanDerWaalsContact O-N 3.13Å; A64-V67 PolarHBondContact O-N 2.87Å; V67-A69 PolarHBondContact O-N 2.66Å; V67-V70 PolarHBondContact O-N 3.23Å; V67-V71 WeakPolarHBondContact O-CG2 3.49Å; V67-V71 PolarHBondContact O-N 3.34Å
68	Y	91.3	Very high	86.9	Confident	96 Å²	96	98.2 Å²	98.2	38%	0.376	52%	0.522	S	S	.	.	H	α-helix	trans	-58.4	-46.4	175.9	-178.2	-109.5	0	0	0	113.3	A64 M65 T66 V70 V71 I72 I136	A64-Y68 WeakPolarHBondContact O-CB 3.23Å; A64-Y68 PolarHBondContact O-N 3.09Å; M65-Y68 WeakPolarHBondContact O-CB 3.36Å; M65-Y68 PolarHBondContact O-N 2.96Å; T66-Y68 VanDerWaalsContact C-N 3.28Å; T66-Y68 PolarHBondContact O-N 3.42Å; Y68-V70 PolarHBondContact O-N 2.87Å; Y68-V71 PolarHBondContact O-N 3.18Å; Y68-I72 HydrophobicContact CD1-CD1 4.18Å; Y68-I72 HydrophobicContact CE1-CD1 3.5Å; Y68-I72 HydrophobicContact CE1-CG1 4.45Å; Y68-I72 HydrophobicContact CE2-CD1 4.2Å; Y68-I72 PolarHBondContact O-N 2.9Å; Y68-I136 WeakPolarHBondContact OH-CD1 3.33Å; Y68-I136 VanDerWaalsContact OH-CG1 3.24Å; Y68-I136 WeakPolarHBondContact OH-CG1 3.48Å
69	A	90.5	Very high	87.9	Confident	51 Å²	51	89.1 Å²	89.1	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-43.2	176.3	0	0	0	0	0	112	M65 T66 V67 V71 I72 V73	M65-A69 PolarHBondContact O-N 3.42Å; T66-A69 PolarHBondContact O-N 2.99Å; V67-A69 PolarHBondContact O-N 2.66Å; A69-V71 VanDerWaalsContact C-N 3.31Å; A69-V71 PolarHBondContact O-N 3.2Å; A69-I72 PolarHBondContact O-N 3.29Å; A69-V73 WeakPolarHBondContact O-CG2 3.48Å; A69-V73 PolarHBondContact O-N 2.99Å
70	V	93.3	Very high	88.9	Confident	92 Å²	92	83.1 Å²	83.1	56%	0.558	46%	0.462	S	S	*	.	H	α-helix	trans	-60.8	-41.4	176.3	171.1	0	0	0	0	111.1	T66 V67 Y68 V73 S74	T66-V70 WeakPolarHBondContact O-CG2 3.38Å; T66-V70 PolarHBondContact O-N 3.48Å; V67-V70 PolarHBondContact O-N 3.23Å; Y68-V70 PolarHBondContact O-N 2.87Å; V70-V73 PolarHBondContact O-N 3.02Å; V70-S74 WeakPolarHBondContact O-CB 3.33Å; V70-S74 PolarHBondContact O-N 3.07Å; V70-S74 PolarHBondContact O-OG 3.47Å
71	V	94	Very high	89.4	Confident	82 Å²	82	75.5 Å²	75.5	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-62.9	-46.7	177.1	171.8	0	0	0	0	111	V67 Y68 A69 V73 S74 Y75	V67-V71 WeakPolarHBondContact O-CG2 3.49Å; V67-V71 PolarHBondContact O-N 3.34Å; Y68-V71 PolarHBondContact O-N 3.18Å; A69-V71 VanDerWaalsContact C-N 3.31Å; A69-V71 PolarHBondContact O-N 3.2Å; V71-V73 VanDerWaalsContact C-N 3.34Å; V71-V73 PolarHBondContact O-N 2.92Å; V71-S74 WeakPolarHBondContact CA-OG 3.21Å; V71-S74 PolarHBondContact O-N 3.31Å; V71-S74 PolarHBondContact O-OG 3.35Å; V71-Y75 WeakPolarHBondContact O-CB 3.47Å; V71-Y75 PolarHBondContact O-N 3.09Å
72	I	92.8	Very high	89.9	Confident	42 Å²	42	70.6 Å²	70.6	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-61.3	-42.9	177.4	-68.6	-175.4	0	0	0	111.6	Y68 A69 Y75 F76 T129 L133 I136	Y68-I72 HydrophobicContact CD1-CD1 4.18Å; Y68-I72 HydrophobicContact CE1-CD1 3.5Å; Y68-I72 HydrophobicContact CE1-CG1 4.45Å; Y68-I72 HydrophobicContact CE2-CD1 4.2Å; Y68-I72 PolarHBondContact O-N 2.9Å; A69-I72 PolarHBondContact O-N 3.29Å; I72-Y75 PolarHBondContact O-N 3.48Å; I72-F76 PolarHBondContact O-N 3.36Å; I72-T129 HydrophobicContact CG2-CG2 4.4Å; I72-L133 HydrophobicContact CD1-CD2 3.93Å; I72-I136 HydrophobicContact CD1-CD1 4.37Å
73	V	91.6	Very high	89.7	Confident	82 Å²	82	71.5 Å²	71.5	50%	0.497	41%	0.405	S	S	.	.	H	α-helix	trans	-65	-43.1	177.5	172.4	0	0	0	0	111	A69 V70 V71 Y75 F76 L77	A69-V73 WeakPolarHBondContact O-CG2 3.48Å; A69-V73 PolarHBondContact O-N 2.99Å; V70-V73 PolarHBondContact O-N 3.02Å; V71-V73 VanDerWaalsContact C-N 3.34Å; V71-V73 PolarHBondContact O-N 2.92Å; V73-Y75 VanDerWaalsContact C-N 3.31Å; V73-Y75 PolarHBondContact O-N 3.26Å; V73-F76 WeakPolarHBondContact O-CB 3.24Å; V73-F76 PolarHBondContact O-N 3.44Å; V73-L77 HydrophobicContact CG1-CD1 4.13Å; V73-L77 WeakPolarHBondContact O-CG 3.29Å; V73-L77 PolarHBondContact O-N 3.41Å
74	S	93.3	Very high	89.1	Confident	49 Å²	49	75.7 Å²	75.7	34%	0.343	41%	0.411	S	S	.	.	H	α-helix	trans	-62.6	-40	176.4	72.3	0	0	0	0	111.7	V70 V71 F76 L77 I78	V70-S74 WeakPolarHBondContact O-CB 3.33Å; V70-S74 PolarHBondContact O-N 3.07Å; V70-S74 PolarHBondContact O-OG 3.47Å; V71-S74 WeakPolarHBondContact CA-OG 3.21Å; V71-S74 PolarHBondContact O-N 3.31Å; V71-S74 PolarHBondContact O-OG 3.35Å; S74-F76 PolarHBondContact O-N 3.29Å; S74-L77 PolarHBondContact O-N 2.87Å; S74-I78 WeakPolarHBondContact O-CB 3.24Å; S74-I78 WeakPolarHBondContact O-CD1 3.29Å; S74-I78 VanDerWaalsContact O-CG1 3.22Å; S74-I78 WeakPolarHBondContact O-CG1 3.5Å; S74-I78 PolarHBondContact O-N 3.47Å
75	Y	91.8	Very high	88.5	Confident	119 Å²	119	74 Å²	74	47%	0.467	39%	0.391	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.1	178.9	-97.7	0	0	0	111.3	V71 I72 V73 L77 T79 F128 T129	V71-Y75 WeakPolarHBondContact O-CB 3.47Å; V71-Y75 PolarHBondContact O-N 3.09Å; I72-Y75 PolarHBondContact O-N 3.48Å; V73-Y75 VanDerWaalsContact C-N 3.31Å; V73-Y75 PolarHBondContact O-N 3.26Å; Y75-L77 PolarHBondContact O-N 2.84Å; Y75-T79 HydrophobicContact CD1-CG2 4.37Å; Y75-T79 HydrophobicContact CD2-CG2 4.02Å; Y75-T79 HydrophobicContact CE1-CG2 4.03Å; Y75-T79 HydrophobicContact CE2-CG2 3.65Å; Y75-T79 HydrophobicContact CG-CG2 4.37Å; Y75-T79 WeakPolarHBondContact O-CB 3.34Å; Y75-T79 WeakPolarHBondContact O-CG2 3.22Å; Y75-T79 PolarHBondContact O-N 3.41Å; Y75-T79 PolarHBondContact O-OG1 3.47Å; Y75-F128 HydrophobicContact CE1-CB 4.3Å; Y75-T129 HydrophobicContact CD1-CG2 3.98Å; Y75-T129 HydrophobicContact CE1-CG2 4.43Å
76	F	91	Very high	87.9	Confident	54 Å²	54	73 Å²	73	24%	0.237	39%	0.393	C	S	.	.	H	α-helix	trans	-57.4	-46.9	175.2	174.3	-103.1	0	0	0	112.5	I72 V73 S74 T79 G80 L122 S125 F126 T129	I72-F76 PolarHBondContact O-N 3.36Å; V73-F76 WeakPolarHBondContact O-CB 3.24Å; V73-F76 PolarHBondContact O-N 3.44Å; S74-F76 PolarHBondContact O-N 3.29Å; F76-T79 PolarHBondContact O-OG1 3.36Å; F76-G80 WeakPolarHBondContact O-CA 3.43Å; F76-G80 PolarHBondContact O-N 2.9Å; F76-L122 HydrophobicContact CE1-CD2 4.43Å; F76-L122 HydrophobicContact CZ-CD2 4.22Å; F76-S125 WeakPolarHBondContact CD2-OG 3.2Å; F76-S125 WeakPolarHBondContact CE2-OG 3.36Å; F76-S125 VanDerWaalsContact O-CB 3.3Å; F76-S125 WeakPolarHBondContact O-CB 3.37Å; F76-S125 PolarHBondContact O-OG 2.99Å; F76-F126 HydrophobicContact CE2-CB 3.96Å; F76-T129 HydrophobicContact CB-CG2 3.85Å; F76-T129 HydrophobicContact CD2-CG2 4.16Å; F76-T129 HydrophobicContact CG-CG2 4.49Å
77	L	88.7	Confident	87.2	Confident	72 Å²	72	75.3 Å²	75.3	38%	0.377	40%	0.401	S	S	.	.	H	α-helix	trans	-70.2	-41	-177.1	-67	173.7	0	0	0	112.3	V73 S74 Y75 I82	V73-L77 HydrophobicContact CG1-CD1 4.13Å; V73-L77 WeakPolarHBondContact O-CG 3.29Å; V73-L77 PolarHBondContact O-N 3.41Å; S74-L77 PolarHBondContact O-N 2.87Å; Y75-L77 PolarHBondContact O-N 2.84Å; L77-I82 HydrophobicContact CB-CG1 4.15Å; L77-I82 HydrophobicContact CD2-CD1 4.07Å; L77-I82 HydrophobicContact CD2-CG1 4Å; L77-I82 WeakPolarHBondContact O-CB 3.35Å; L77-I82 WeakPolarHBondContact O-CG1 3.46Å; L77-I82 PolarHBondContact O-N 2.92Å
78	I	90.4	Very high	86.2	Confident	107 Å²	107	76.7 Å²	76.7	55%	0.549	41%	0.409	S	S	.	.	H	α-helix	trans	-69.1	-47.2	179.7	-66	166.5	0	0	0	110.4	S74 G80 G81	S74-I78 WeakPolarHBondContact O-CB 3.24Å; S74-I78 WeakPolarHBondContact O-CD1 3.29Å; S74-I78 VanDerWaalsContact O-CG1 3.22Å; S74-I78 WeakPolarHBondContact O-CG1 3.5Å; S74-I78 PolarHBondContact O-N 3.47Å; I78-G80 VanDerWaalsContact C-N 3.29Å; I78-G80 PolarHBondContact O-N 3.38Å; I78-G81 PolarHBondContact O-N 2.87Å
79	T	86.7	Confident	85.1	Confident	43 Å²	43	80.1 Å²	80.1	26%	0.264	43%	0.429	S	S	.	.	H	α-helix	trans	-68.9	-28.2	177.6	54.6	0	0	0	0	112.9	Y75 F76 G81 S125	Y75-T79 HydrophobicContact CD1-CG2 4.37Å; Y75-T79 HydrophobicContact CD2-CG2 4.02Å; Y75-T79 HydrophobicContact CE1-CG2 4.03Å; Y75-T79 HydrophobicContact CE2-CG2 3.65Å; Y75-T79 HydrophobicContact CG-CG2 4.37Å; Y75-T79 WeakPolarHBondContact O-CB 3.34Å; Y75-T79 WeakPolarHBondContact O-CG2 3.22Å; Y75-T79 PolarHBondContact O-N 3.41Å; Y75-T79 PolarHBondContact O-OG1 3.47Å; F76-T79 PolarHBondContact O-OG1 3.36Å; T79-G81 PolarHBondContact O-N 2.91Å; T79-S125 WeakPolarHBondContact OG1-CB 3.32Å
80	G	85.2	Confident	84.1	Confident	5 Å²	5	79 Å²	79	5%	0.052	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-8.5	174.2	0	0	0	0	0	113.8	F76 I78 G121 S125	F76-G80 WeakPolarHBondContact O-CA 3.43Å; F76-G80 PolarHBondContact O-N 2.9Å; I78-G80 VanDerWaalsContact C-N 3.29Å; I78-G80 PolarHBondContact O-N 3.38Å; G80-G121 CarbonylContact O-C 3.51Å; G80-G121 WeakPolarHBondContact O-CA 3.39Å; G80-S125 WeakPolarHBondContact CA-OG 3.33Å
81	G	85.3	Confident	83	Confident	9 Å²	9	78.8 Å²	78.8	9%	0.093	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	21.2	176.4	0	0	0	0	0	114	I78 T79 I83 Y84 D85	I78-G81 PolarHBondContact O-N 2.87Å; T79-G81 PolarHBondContact O-N 2.91Å; G81-I83 PolarHBondContact O-N 3.37Å; G81-I83 VanDerWaalsContact O-N 3.12Å; G81-Y84 CarbonylContact O-C 3.59Å; G81-Y84 WeakPolarHBondContact O-CA 3.29Å; G81-Y84 WeakPolarHBondContact O-CB 3.47Å; G81-Y84 PolarHBondContact O-N 3.11Å; G81-D85 PolarHBondContact O-N 3.45Å
82	I	84.4	Confident	81.7	Confident	63 Å²	63	78.4 Å²	78.4	32%	0.323	42%	0.418	S	S	.	.	H	α-helix	trans	-53.7	-34.3	177.4	-63.5	-88.4	0	0	0	111.4	L77 Y84 D85 V86	L77-I82 HydrophobicContact CB-CG1 4.15Å; L77-I82 HydrophobicContact CD2-CD1 4.07Å; L77-I82 HydrophobicContact CD2-CG1 4Å; L77-I82 WeakPolarHBondContact O-CB 3.35Å; L77-I82 WeakPolarHBondContact O-CG1 3.46Å; L77-I82 PolarHBondContact O-N 2.92Å; I82-Y84 VanDerWaalsContact C-N 3.34Å; I82-D85 WeakPolarHBondContact O-CB 3.29Å; I82-D85 PolarHBondContact O-N 3.24Å; I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 3.41Å
83	I	81.5	Confident	80.5	Confident	95 Å²	95	79.7 Å²	79.7	49%	0.487	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-39.3	176.3	-58.9	174.2	0	0	0	111	G81 I87	G81-I83 PolarHBondContact O-N 3.37Å; G81-I83 VanDerWaalsContact O-N 3.12Å; I83-I87 HydrophobicContact CG2-CD1 3.82Å; I83-I87 WeakPolarHBondContact O-CD1 3.41Å; I83-I87 VanDerWaalsContact O-CG1 3.26Å; I83-I87 WeakPolarHBondContact O-CG1 3.48Å; I83-I87 PolarHBondContact O-N 3.45Å
84	Y	76.8	Confident	79.5	Confident	159 Å²	159	76.2 Å²	76.2	62%	0.624	41%	0.409	S	S	*	.	H	α-helix	trans	-72	-32.9	175.5	-68.2	-79	0	0	0	111.9	G81 I82 I87 V88	G81-Y84 CarbonylContact O-C 3.59Å; G81-Y84 WeakPolarHBondContact O-CA 3.29Å; G81-Y84 WeakPolarHBondContact O-CB 3.47Å; G81-Y84 PolarHBondContact O-N 3.11Å; I82-Y84 VanDerWaalsContact C-N 3.34Å; Y84-I87 PolarHBondContact O-N 3.31Å; Y84-V88 WeakPolarHBondContact O-CB 3.35Å; Y84-V88 PolarHBondContact O-N 2.87Å
85	D	76.6	Confident	78.3	Confident	45 Å²	45	77.1 Å²	77.1	24%	0.241	42%	0.415	C	S	.	.	H	α-helix	trans	-60.2	-49.3	173.5	-166.7	22.9	0	0	0	111	G81 I82 I87 E89 I118	G81-D85 PolarHBondContact O-N 3.45Å; I82-D85 WeakPolarHBondContact O-CB 3.29Å; I82-D85 PolarHBondContact O-N 3.24Å; D85-I87 PolarHBondContact O-N 2.83Å; D85-E89 WeakPolarHBondContact O-CA 3.45Å; D85-E89 PolarHBondContact O-N 2.95Å; D85-I118 WeakPolarHBondContact OD1-CD1 3.42Å; D85-I118 WeakPolarHBondContact OD1-CG1 3.46Å
86	V	77	Confident	77	Confident	119 Å²	119	77 Å²	77	72%	0.721	42%	0.421	S	S	*	.	H	α-helix	trans	-66.3	-33.4	179.9	173.3	0	0	0	0	113.4	I82	I82-V86 WeakPolarHBondContact O-CG2 3.46Å; I82-V86 PolarHBondContact O-N 3.41Å
87	I	76.7	Confident	75.7	Confident	127 Å²	127	79.4 Å²	79.4	65%	0.651	44%	0.44	S	S	*	.	H	α-helix	trans	-87.7	-40.4	-173.9	-65.1	169.8	0	0	0	112.2	I83 Y84 D85	I83-I87 HydrophobicContact CG2-CD1 3.82Å; I83-I87 WeakPolarHBondContact O-CD1 3.41Å; I83-I87 VanDerWaalsContact O-CG1 3.26Å; I83-I87 WeakPolarHBondContact O-CG1 3.48Å; I83-I87 PolarHBondContact O-N 3.45Å; Y84-I87 PolarHBondContact O-N 3.31Å; D85-I87 PolarHBondContact O-N 2.83Å
88	V	72.3	Confident	74.8	Confident	99 Å²	99	78.6 Å²	78.6	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-111.3	-12.8	-168.3	-171.7	0	0	0	0	111.9	Y84	Y84-V88 WeakPolarHBondContact O-CB 3.35Å; Y84-V88 PolarHBondContact O-N 2.87Å
89	E	66.8	Low	73.9	Confident	169 Å²	169	82.7 Å²	82.7	79%	0.79	45%	0.452	S	S	*	.			trans	41.6	57.2	-177.6	-152.1	171.2	-178.7	0	0	112	D85	D85-E89 WeakPolarHBondContact O-CA 3.45Å; D85-E89 PolarHBondContact O-N 2.95Å
90	P	69.3	Low	73.4	Confident	28 Å²	28	87.8 Å²	87.8	18%	0.182	47%	0.473	C	S	.	.			trans	-65	149.9	-179	29.7	-32.3	0	0	0	110.2	S92 I118	P90-S92 PolarHBondContact O-N 2.76Å; P90-I118 HydrophobicContact CG-CG1 4.2Å
91	P	70.7	Confident	72.7	Confident	87 Å²	87	90.1 Å²	90.1	57%	0.565	50%	0.497	S	S	*	.			trans	-55.7	142.4	175.9	23.5	-34.5	0	0	0	111.3	V93 Y117	P91-V93 PolarHBondContact O-N 3.22Å; P91-Y117 HydrophobicContact CG-CD1 4.22Å; P91-Y117 HydrophobicContact CG-CE1 3.89Å; P91-Y117 VanDerWaalsContact O-CD1 3.29Å; P91-Y117 WeakPolarHBondContact O-CD1 2.77Å
92	S	66.3	Low	72.2	Confident	73 Å²	73	96.3 Å²	96.3	51%	0.51	52%	0.523	S	S	.	.	S	Bend	trans	-70.1	-34.9	-172.7	-41.9	0	0	0	0	113.5	P90 M119	P90-S92 PolarHBondContact O-N 2.76Å; S92-M119 WeakPolarHBondContact O-CG 3.32Å
93	V	68.9	Low	71.1	Confident	69 Å²	69	99.9 Å²	99.9	42%	0.418	54%	0.539	S	S	.	.	S	Bend	trans	-148.3	139.9	-178.9	-179.4	0	0	0	0	109.1	P91 P105 M119	P91-V93 PolarHBondContact O-N 3.22Å; V93-P105 HydrophobicContact CG1-CB 4.08Å; V93-M119 HydrophobicContact CG2-CG 3.79Å
94	G	69	Low	70.4	Confident	9 Å²	9	102.9 Å²	102.9	9%	0.093	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	161.6	172.3	0	0	0	0	0	112.6	V106 Y117	G94-V106 PolarHBondContact N-O 3.48Å; G94-V106 PolarHBondContact O-N 3.36Å; G94-Y117 VanDerWaalsContact CA-OH 3.32Å; G94-Y117 WeakPolarHBondContact CA-OH 3.37Å
95	S	68.6	Low	69.8	Low	69 Å²	69	100.5 Å²	100.5	48%	0.483	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.6	165.4	57.1	0	0	0	0	109.8	Q103 R104	S95-Q103 PolarHBondContact OG-OE1 3.11Å; S95-R104 WeakPolarHBondContact CA-O 3.3Å
96	M	64.8	Low	69.1	Low	117 Å²	117	100.3 Å²	100.3	58%	0.576	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	132.6	162.9	-77.7	-150.5	-150.5	0	0	108.2	R104 V106	M96-R104 PolarHBondContact N-O 3.03Å; M96-R104 PolarHBondContact O-N 3.11Å; M96-V106 HydrophobicContact CB-CG2 3.86Å; M96-V106 HydrophobicContact CG-CG2 3.85Å
97	T	64.2	Low	68.2	Low	104 Å²	104	96.4 Å²	96.4	64%	0.638	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.2	170.4	48.6	0	0	0	0	108.7	Q103	T97-Q103 HydrophobicContact CG2-CG 4.2Å
98	D	68.8	Low	67.6	Low	55 Å²	55	93.2 Å²	93.2	29%	0.294	51%	0.51	S	S	.	.			trans	-64.6	163.9	168	-156.2	-12	0	0	0	110.1	H100 G101 H102 R104	D98-H100 PolarHBondContact O-N 3.34Å; D98-G101 PolarHBondContact O-N 3.01Å; D98-H102 HydrophobicContact CB-CB 4.5Å; D98-H102 WeakPolarHBondContact CB-O 3.23Å; D98-H102 PolarHBondContact N-O 3.49Å; D98-R104 IonicContact OD2-CZ 3.19Å; D98-R104 IonicContact OD2-NE 2.98Å; D98-R104 PolarHBondContact OD2-NE 2.75Å; D98-R104 IonicContact OD2-NH2 2.7Å; D98-R104 PolarHBondContact OD2-NH2 3.03Å
99	E	72.1	Confident	67.2	Low	192 Å²	192	90.4 Å²	90.4	90%	0.897	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.1	179	-70.4	-169.8	145.2	0	0	112.9
100	H	76.4	Confident	67.1	Low	150 Å²	150	84.1 Å²	84.1	69%	0.694	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	9.3	176.1	-64.4	77.7	0	0	0	113.6	D98 H102	D98-H100 PolarHBondContact O-N 3.34Å; H100-H102 VanDerWaalsContact C-N 3.25Å; H100-H102 PolarHBondContact O-CD2 3.06Å; H100-H102 PolarHBondContact O-N 3.4Å
101	G	70	Confident	66.9	Low	54 Å²	54	91.7 Å²	91.7	56%	0.557	50%	0.495	S	S	*	.	S	Bend	trans	77.2	2.8	178	0	0	0	0	0	115.2	D98	D98-G101 PolarHBondContact O-N 3.01Å
102	H	75.7	Confident	66.8	Low	139 Å²	139	95.2 Å²	95.2	64%	0.644	50%	0.497	S	S	*	.			trans	-77.9	126.9	176.9	-70.8	-163.3	0	0	0	110.2	D98 H100 R104	D98-H102 HydrophobicContact CB-CB 4.5Å; D98-H102 WeakPolarHBondContact CB-O 3.23Å; D98-H102 PolarHBondContact N-O 3.49Å; H100-H102 VanDerWaalsContact C-N 3.25Å; H100-H102 PolarHBondContact O-CD2 3.06Å; H100-H102 PolarHBondContact O-N 3.4Å; H102-R104 PolarHBondContact O-N 3.28Å
103	Q	61.2	Low	67	Low	139 Å²	139	95.5 Å²	95.5	65%	0.65	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	112.3	175.3	-65.8	-171.3	37.1	0	0	109.7	S95 T97	S95-Q103 PolarHBondContact OG-OE1 3.11Å; T97-Q103 HydrophobicContact CG2-CG 4.2Å
104	R	67.3	Low	66.9	Low	157 Å²	157	100 Å²	100	59%	0.592	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.6	169.2	-62.7	-168.9	-173	-155.5	3.8	108.7	S95 M96 D98 H102 V106	S95-R104 WeakPolarHBondContact CA-O 3.3Å; M96-R104 PolarHBondContact N-O 3.03Å; M96-R104 PolarHBondContact O-N 3.11Å; D98-R104 IonicContact OD2-CZ 3.19Å; D98-R104 IonicContact OD2-NE 2.98Å; D98-R104 PolarHBondContact OD2-NE 2.75Å; D98-R104 IonicContact OD2-NH2 2.7Å; D98-R104 PolarHBondContact OD2-NH2 3.03Å; H102-R104 PolarHBondContact O-N 3.28Å; R104-V106 PolarHBondContact O-N 2.95Å
105	P	64.3	Low	66.9	Low	110 Å²	110	100 Å²	100	71%	0.714	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	127	176	27.2	-32.6	0	0	0	109.1	V93	V93-P105 HydrophobicContact CG1-CB 4.08Å
106	V	61.1	Low	67	Low	40 Å²	40	99.9 Å²	99.9	24%	0.242	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	112.2	176.9	-173	0	0	0	0	107.6	G94 M96 R104 F108	G94-V106 PolarHBondContact N-O 3.48Å; G94-V106 PolarHBondContact O-N 3.36Å; M96-V106 HydrophobicContact CB-CG2 3.86Å; M96-V106 HydrophobicContact CG-CG2 3.85Å; R104-V106 PolarHBondContact O-N 2.95Å; V106-F108 VanDerWaalsContact CG1-O 3.23Å; V106-F108 WeakPolarHBondContact CG1-O 3.21Å; V106-F108 PolarHBondContact O-N 2.83Å
107	A	58.3	Low	67.7	Low	38 Å²	38	96 Å²	96	31%	0.314	49%	0.488	S	S	.	.			trans	-77.1	-3.9	179.9	0	0	0	0	0	113.4
108	F	62.9	Low	68.4	Low	59 Å²	59	92.8 Å²	92.8	26%	0.259	47%	0.466	S	S	.	.	S	Bend	trans	-130.3	130.5	-171.6	-66.4	-64.4	0	0	0	112.9	V106 A110 E120 F172 M175	V106-F108 VanDerWaalsContact CG1-O 3.23Å; V106-F108 WeakPolarHBondContact CG1-O 3.21Å; V106-F108 PolarHBondContact O-N 2.83Å; F108-A110 PolarHBondContact O-N 3.43Å; F108-E120 HydrophobicContact CD1-CB 3.93Å; F108-E120 HydrophobicContact CD1-CG 3.71Å; F108-E120 HydrophobicContact CE1-CB 4.01Å; F108-E120 HydrophobicContact CE1-CG 3.88Å; F108-F172 HydrophobicContact CD1-CD1 4.27Å; F108-F172 HydrophobicContact CD1-CE1 4.34Å; F108-F172 AromaticContact CE1-CD1 3.4Å; F108-F172 HydrophobicContact CE1-CD1 3.4Å; F108-F172 VanDerWaalsContact CE1-CD1 3.4Å; F108-F172 AromaticContact CE1-CE1 3.13Å; F108-F172 HydrophobicContact CE1-CE1 3.13Å; F108-F172 HydrophobicContact CE1-CZ 4.15Å; F108-F172 HydrophobicContact CE2-CE1 4.42Å; F108-F172 AromaticContact CZ-CD1 3.79Å; F108-F172 HydrophobicContact CZ-CD1 3.79Å; F108-F172 AromaticContact CZ-CE1 3.17Å; F108-F172 HydrophobicContact CZ-CE1 3.17Å; F108-F172 AromaticContact CZ-CZ 3.74Å; F108-F172 HydrophobicContact CZ-CZ 3.74Å; F108-M175 HydrophobicContact CD2-SD 4.41Å
109	L	65.4	Low	68.9	Low	40 Å²	40	94.9 Å²	94.9	21%	0.209	48%	0.476	C	S	.	.			trans	-87.5	95.6	174.4	-161.8	80.2	0	0	0	109.4	R112 Y117 E120	L109-R112 HydrophobicContact CD2-CB 3.71Å; L109-R112 HydrophobicContact CD2-CG 4.16Å; L109-R112 HydrophobicContact CG-CB 4.29Å; L109-Y117 HydrophobicContact CB-CD2 3.85Å; L109-Y117 HydrophobicContact CB-CE2 3.64Å; L109-Y117 HydrophobicContact CD1-CD2 4.5Å; L109-Y117 HydrophobicContact CD1-CE1 4.16Å; L109-Y117 HydrophobicContact CD1-CE2 3.58Å; L109-Y117 WeakPolarHBondContact CD1-OH 3.27Å; L109-Y117 HydrophobicContact CG-CE2 4.23Å; L109-E120 PolarHBondContact N-OE2 3.2Å
110	A	64.3	Low	69.4	Low	38 Å²	38	86.3 Å²	86.3	31%	0.314	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	149.3	176.3	0	0	0	0	0	111.4	F108 R112	F108-A110 PolarHBondContact O-N 3.43Å; A110-R112 PolarHBondContact O-N 2.85Å
111	Y	64	Low	69.8	Low	187 Å²	187	79.1 Å²	79.1	73%	0.733	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-4.9	173.4	-57	-86.9	0	0	0	117.6	K176 P178	Y111-K176 PolarHBondContact N-O 3.48Å; Y111-P178 HydrophobicContact CD1-CG 3.88Å; Y111-P178 HydrophobicContact CE1-CG 3.26Å; Y111-P178 HydrophobicContact CE2-CG 4.13Å
112	R	69.3	Low	70.6	Confident	160 Å²	160	79.1 Å²	79.1	60%	0.604	39%	0.39	S	S	*	.			trans	-121.2	99.3	177.2	-167	-175.3	-155.2	-123	5.5	111.4	L109 A110 N114 G115	L109-R112 HydrophobicContact CD2-CB 3.71Å; L109-R112 HydrophobicContact CD2-CG 4.16Å; L109-R112 HydrophobicContact CG-CB 4.29Å; A110-R112 PolarHBondContact O-N 2.85Å; R112-N114 VanDerWaalsContact C-N 3.34Å; R112-N114 PolarHBondContact O-N 2.91Å; R112-G115 PolarHBondContact O-N 2.88Å
113	V	69.6	Low	71.2	Confident	80 Å²	80	74.1 Å²	74.1	49%	0.485	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-36.5	-175.3	-170	0	0	0	0	112.8	G115 K176 L177	V113-G115 VanDerWaalsContact C-N 3.3Å; V113-G115 PolarHBondContact O-N 2.96Å; V113-K176 VanDerWaalsContact O-CE 3.27Å; V113-K176 WeakPolarHBondContact O-CE 3.31Å; V113-K176 PolarHBondContact O-NZ 3.44Å; V113-L177 HydrophobicContact CG2-CD1 4.35Å; V113-L177 HydrophobicContact CG2-CD2 3.67Å; V113-L177 HydrophobicContact CG2-CG 4.15Å
114	N	67.3	Low	72.4	Confident	163 Å²	163	68.4 Å²	68.4	87%	0.872	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.6	-178.5	-60.7	-26.4	0	0	0	113.5	R112	R112-N114 VanDerWaalsContact C-N 3.34Å; R112-N114 PolarHBondContact O-N 2.91Å
115	G	68.8	Low	73.5	Confident	8 Å²	8	61 Å²	61	8%	0.082	32%	0.319	C	S	.	.			trans	-99.5	142.4	172.1	0	0	0	0	0	109.7	R112 V113 K176	R112-G115 PolarHBondContact O-N 2.88Å; V113-G115 VanDerWaalsContact C-N 3.3Å; V113-G115 PolarHBondContact O-N 2.96Å; G115-K176 PolarHBondContact O-NZ 3.21Å
116	Q	70.4	Confident	74.8	Confident	68 Å²	68	61 Å²	61	32%	0.318	31%	0.308	S	S	.	.			trans	-145.9	127.5	178.7	-173.9	163.1	5.2	0	0	108.3	E120	Q116-E120 HydrophobicContact CG-CB 4.38Å; Q116-E120 HydrophobicContact CG-CG 4.23Å
117	Y	79.7	Confident	76.2	Confident	36 Å²	36	59.9 Å²	59.9	14%	0.141	30%	0.301	C	S	.	.			trans	-75.3	150.8	167.7	-68	-55.3	0	0	0	109.7	P91 G94 L109 M119 E120 G121	P91-Y117 HydrophobicContact CG-CD1 4.22Å; P91-Y117 HydrophobicContact CG-CE1 3.89Å; P91-Y117 VanDerWaalsContact O-CD1 3.29Å; P91-Y117 WeakPolarHBondContact O-CD1 2.77Å; G94-Y117 VanDerWaalsContact CA-OH 3.32Å; G94-Y117 WeakPolarHBondContact CA-OH 3.37Å; L109-Y117 HydrophobicContact CB-CD2 3.85Å; L109-Y117 HydrophobicContact CB-CE2 3.64Å; L109-Y117 HydrophobicContact CD1-CD2 4.5Å; L109-Y117 HydrophobicContact CD1-CE1 4.16Å; L109-Y117 HydrophobicContact CD1-CE2 3.58Å; L109-Y117 WeakPolarHBondContact CD1-OH 3.27Å; L109-Y117 HydrophobicContact CG-CE2 4.23Å; Y117-M119 PolarHBondContact O-N 3.46Å; Y117-E120 WeakPolarHBondContact O-CB 3.48Å; Y117-E120 PolarHBondContact O-N 3.45Å; Y117-E120 VanDerWaalsContact O-N 3.1Å; Y117-G121 PolarHBondContact O-N 2.93Å
118	I	79.4	Confident	77.7	Confident	35 Å²	35	62.7 Å²	62.7	18%	0.179	31%	0.306	C	S	.	.	H	α-helix	trans	-56.6	-44.7	177.7	-57.3	173.7	0	0	0	109.9	D85 P90 E120 G121 L122	D85-I118 WeakPolarHBondContact OD1-CD1 3.42Å; D85-I118 WeakPolarHBondContact OD1-CG1 3.46Å; P90-I118 HydrophobicContact CG-CG1 4.2Å; I118-E120 VanDerWaalsContact C-N 3.33Å; I118-E120 PolarHBondContact O-N 2.77Å; I118-G121 PolarHBondContact O-N 2.85Å; I118-L122 HydrophobicContact CG2-CD1 3.84Å; I118-L122 HydrophobicContact CG2-CG 4.28Å; I118-L122 WeakPolarHBondContact O-CG 3.18Å; I118-L122 PolarHBondContact O-N 2.6Å
119	M	79.4	Confident	79.1	Confident	99 Å²	99	60.6 Å²	60.6	49%	0.488	30%	0.299	S	S	.	.	H	α-helix	trans	-65.8	-33.3	179	-67.1	-60.3	-70.1	0	0	113.3	S92 V93 Y117 A123	S92-M119 WeakPolarHBondContact O-CG 3.32Å; V93-M119 HydrophobicContact CG2-CG 3.79Å; Y117-M119 PolarHBondContact O-N 3.46Å; M119-A123 WeakPolarHBondContact O-CB 3.06Å; M119-A123 PolarHBondContact O-N 2.79Å
120	E	83.4	Confident	80.4	Confident	12 Å²	12	60.9 Å²	60.9	6%	0.056	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-46.3	174.3	172.2	-179.2	170	0	0	110.8	F108 L109 Q116 Y117 I118 S124 K176	F108-E120 HydrophobicContact CD1-CB 3.93Å; F108-E120 HydrophobicContact CD1-CG 3.71Å; F108-E120 HydrophobicContact CE1-CB 4.01Å; F108-E120 HydrophobicContact CE1-CG 3.88Å; L109-E120 PolarHBondContact N-OE2 3.2Å; Q116-E120 HydrophobicContact CG-CB 4.38Å; Q116-E120 HydrophobicContact CG-CG 4.23Å; Y117-E120 WeakPolarHBondContact O-CB 3.48Å; Y117-E120 PolarHBondContact O-N 3.45Å; Y117-E120 VanDerWaalsContact O-N 3.1Å; I118-E120 VanDerWaalsContact C-N 3.33Å; I118-E120 PolarHBondContact O-N 2.77Å; E120-S124 WeakPolarHBondContact O-CB 3.36Å; E120-S124 PolarHBondContact O-N 3.02Å; E120-S124 PolarHBondContact O-OG 2.9Å; E120-K176 WeakPolarHBondContact OE1-CD 3.29Å; E120-K176 WeakPolarHBondContact OE1-CE 3.48Å; E120-K176 IonicContact OE1-NZ 2.71Å; E120-K176 PolarHBondContact OE1-NZ 2.85Å
121	G	84.8	Confident	81.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-51.8	176.5	0	0	0	0	0	113.4	G80 Y117 I118 A123 S124 S125	G80-G121 CarbonylContact O-C 3.51Å; G80-G121 WeakPolarHBondContact O-CA 3.39Å; Y117-G121 PolarHBondContact O-N 2.93Å; I118-G121 PolarHBondContact O-N 2.85Å; G121-A123 VanDerWaalsContact C-N 3.32Å; G121-A123 PolarHBondContact O-N 3.28Å; G121-S124 PolarHBondContact O-N 3.43Å; G121-S124 PolarHBondContact O-OG 3.34Å; G121-S125 PolarHBondContact O-N 2.97Å; G121-S125 PolarHBondContact O-OG 2.97Å
122	L	86.8	Confident	83.2	Confident	54 Å²	54	52 Å²	52	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-38.8	178.6	-67.2	177.2	0	0	0	112.7	F76 I118 S125 F126	F76-L122 HydrophobicContact CE1-CD2 4.43Å; F76-L122 HydrophobicContact CZ-CD2 4.22Å; I118-L122 HydrophobicContact CG2-CD1 3.84Å; I118-L122 HydrophobicContact CG2-CG 4.28Å; I118-L122 WeakPolarHBondContact O-CG 3.18Å; I118-L122 PolarHBondContact O-N 2.6Å; L122-S125 PolarHBondContact O-OG 2.71Å; L122-S125 VanDerWaalsContact O-OG 3.13Å; L122-F126 VanDerWaalsContact O-CB 3.31Å; L122-F126 WeakPolarHBondContact O-CB 3.26Å; L122-F126 PolarHBondContact O-N 2.81Å; L122-F126 VanDerWaalsContact O-N 3.09Å
123	A	87.2	Confident	84.3	Confident	33 Å²	33	47.8 Å²	47.8	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-66.2	-42.2	176.1	0	0	0	0	0	111.8	M119 G121 F126 L127 F172	M119-A123 WeakPolarHBondContact O-CB 3.06Å; M119-A123 PolarHBondContact O-N 2.79Å; G121-A123 VanDerWaalsContact C-N 3.32Å; G121-A123 PolarHBondContact O-N 3.28Å; A123-F126 PolarHBondContact O-N 3.3Å; A123-L127 WeakPolarHBondContact O-CG 3.46Å; A123-L127 PolarHBondContact O-N 3.05Å; A123-L127 VanDerWaalsContact O-N 3.16Å; A123-F172 HydrophobicContact CB-CE1 3.97Å; A123-F172 HydrophobicContact CB-CZ 3.97Å
124	S	87.8	Confident	85.5	Confident	20 Å²	20	44 Å²	44	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-43.6	179.3	71.9	0	0	0	0	112.6	E120 G121 F126 L127 F128	E120-S124 WeakPolarHBondContact O-CB 3.36Å; E120-S124 PolarHBondContact O-N 3.02Å; E120-S124 PolarHBondContact O-OG 2.9Å; G121-S124 PolarHBondContact O-N 3.43Å; G121-S124 PolarHBondContact O-OG 3.34Å; S124-F126 VanDerWaalsContact C-N 3.33Å; S124-F126 PolarHBondContact O-N 3.38Å; S124-L127 PolarHBondContact O-N 2.98Å; S124-F128 WeakPolarHBondContact O-CD2 3.42Å; S124-F128 WeakPolarHBondContact O-CG 3.37Å; S124-F128 PolarHBondContact O-N 2.87Å
125	S	90.6	Very high	86.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-34.7	178.2	61.1	0	0	0	0	112.2	F76 T79 G80 G121 L122 F128 T129	F76-S125 WeakPolarHBondContact CD2-OG 3.2Å; F76-S125 WeakPolarHBondContact CE2-OG 3.36Å; F76-S125 VanDerWaalsContact O-CB 3.3Å; F76-S125 WeakPolarHBondContact O-CB 3.37Å; F76-S125 PolarHBondContact O-OG 2.99Å; T79-S125 WeakPolarHBondContact OG1-CB 3.32Å; G80-S125 WeakPolarHBondContact CA-OG 3.33Å; G121-S125 PolarHBondContact O-N 2.97Å; G121-S125 PolarHBondContact O-OG 2.97Å; L122-S125 PolarHBondContact O-OG 2.71Å; L122-S125 VanDerWaalsContact O-OG 3.13Å; S125-F128 PolarHBondContact O-N 3.27Å; S125-T129 WeakPolarHBondContact O-CG2 3.48Å; S125-T129 PolarHBondContact O-N 3.26Å; S125-T129 PolarHBondContact O-OG1 2.99Å
126	F	90.3	Very high	87.8	Confident	110 Å²	110	45.1 Å²	45.1	48%	0.482	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-42.6	173.6	-179	-113.5	0	0	0	112	F76 L122 A123 S124 T129 M130	F76-F126 HydrophobicContact CE2-CB 3.96Å; L122-F126 VanDerWaalsContact O-CB 3.31Å; L122-F126 WeakPolarHBondContact O-CB 3.26Å; L122-F126 PolarHBondContact O-N 2.81Å; L122-F126 VanDerWaalsContact O-N 3.09Å; A123-F126 PolarHBondContact O-N 3.3Å; S124-F126 VanDerWaalsContact C-N 3.33Å; S124-F126 PolarHBondContact O-N 3.38Å; F126-T129 PolarHBondContact O-N 2.94Å; F126-T129 PolarHBondContact O-OG1 3.47Å; F126-M130 HydrophobicContact CD1-CE 3.55Å; F126-M130 HydrophobicContact CD1-SD 4.2Å; F126-M130 HydrophobicContact CD2-CG 4.46Å; F126-M130 HydrophobicContact CE1-CE 3.19Å; F126-M130 HydrophobicContact CE1-CG 4.15Å; F126-M130 HydrophobicContact CE1-SD 3.4Å; F126-M130 WeakPolarHBondContact CE1-SD 3.43Å; F126-M130 HydrophobicContact CE2-CG 4.04Å; F126-M130 HydrophobicContact CE2-SD 4.14Å; F126-M130 HydrophobicContact CG-CE 4.45Å; F126-M130 HydrophobicContact CZ-CE 3.85Å; F126-M130 HydrophobicContact CZ-CG 3.88Å; F126-M130 HydrophobicContact CZ-SD 3.36Å; F126-M130 WeakPolarHBondContact CZ-SD 3.34Å; F126-M130 WeakPolarHBondContact O-CB 3.36Å; F126-M130 WeakPolarHBondContact O-CG 3.4Å; F126-M130 PolarHBondContact O-N 3Å
127	L	91.1	Very high	88.8	Confident	17 Å²	17	44.6 Å²	44.6	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-38.8	177.1	-70.9	164.7	0	0	0	111.9	A123 S124 M130 G131 S165 M168 F172	A123-L127 WeakPolarHBondContact O-CG 3.46Å; A123-L127 PolarHBondContact O-N 3.05Å; A123-L127 VanDerWaalsContact O-N 3.16Å; S124-L127 PolarHBondContact O-N 2.98Å; L127-M130 HydrophobicContact CD2-CE 3.74Å; L127-G131 PolarHBondContact O-N 3.43Å; L127-S165 WeakPolarHBondContact O-CB 3.42Å; L127-M168 HydrophobicContact CD1-CB 3.8Å; L127-M168 HydrophobicContact CD2-CB 3.9Å; L127-M168 HydrophobicContact CD2-CG 4.27Å; L127-M168 HydrophobicContact CG-CB 4.48Å; L127-F172 HydrophobicContact CD1-CD2 3.68Å; L127-F172 HydrophobicContact CD1-CE2 3.02Å; L127-F172 HydrophobicContact CD1-CZ 3.54Å
128	F	90.5	Very high	89.4	Confident	97 Å²	97	44.9 Å²	44.9	43%	0.425	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-40.7	175.8	-64.5	-38.5	0	0	0	112.6	Y75 S124 S125 G131 G132 A169	Y75-F128 HydrophobicContact CE1-CB 4.3Å; S124-F128 WeakPolarHBondContact O-CD2 3.42Å; S124-F128 WeakPolarHBondContact O-CG 3.37Å; S124-F128 PolarHBondContact O-N 2.87Å; S125-F128 PolarHBondContact O-N 3.27Å; F128-G131 PolarHBondContact O-N 3.43Å; F128-G132 PolarHBondContact O-N 3.13Å; F128-A169 HydrophobicContact CE1-CB 3.89Å
129	T	92	Very high	89.9	Confident	16 Å²	16	49.1 Å²	49.1	10%	0.098	26%	0.257	C	S	.	.	H	α-helix	trans	-70.3	-39.4	176.4	54	0	0	0	0	112.6	I72 Y75 F76 S125 F126 G131 G132 L133	I72-T129 HydrophobicContact CG2-CG2 4.4Å; Y75-T129 HydrophobicContact CD1-CG2 3.98Å; Y75-T129 HydrophobicContact CE1-CG2 4.43Å; F76-T129 HydrophobicContact CB-CG2 3.85Å; F76-T129 HydrophobicContact CD2-CG2 4.16Å; F76-T129 HydrophobicContact CG-CG2 4.49Å; S125-T129 WeakPolarHBondContact O-CG2 3.48Å; S125-T129 PolarHBondContact O-N 3.26Å; S125-T129 PolarHBondContact O-OG1 2.99Å; F126-T129 PolarHBondContact O-N 2.94Å; F126-T129 PolarHBondContact O-OG1 3.47Å; T129-G131 VanDerWaalsContact C-N 3.33Å; T129-G131 PolarHBondContact O-N 3.48Å; T129-G132 PolarHBondContact O-N 2.89Å; T129-L133 VanDerWaalsContact O-CB 3.31Å; T129-L133 WeakPolarHBondContact O-CB 3.34Å; T129-L133 VanDerWaalsContact O-CG 3.27Å; T129-L133 WeakPolarHBondContact O-CG 3.36Å; T129-L133 PolarHBondContact O-N 3.26Å
130	M	93	Very high	90.3	Very high	46 Å²	46	51.8 Å²	51.8	23%	0.227	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-39.3	172.1	-77.2	-162	-58.3	0	0	112.5	F126 L127 G134 S161	F126-M130 HydrophobicContact CD1-CE 3.55Å; F126-M130 HydrophobicContact CD1-SD 4.2Å; F126-M130 HydrophobicContact CD2-CG 4.46Å; F126-M130 HydrophobicContact CE1-CE 3.19Å; F126-M130 HydrophobicContact CE1-CG 4.15Å; F126-M130 HydrophobicContact CE1-SD 3.4Å; F126-M130 WeakPolarHBondContact CE1-SD 3.43Å; F126-M130 HydrophobicContact CE2-CG 4.04Å; F126-M130 HydrophobicContact CE2-SD 4.14Å; F126-M130 HydrophobicContact CG-CE 4.45Å; F126-M130 HydrophobicContact CZ-CE 3.85Å; F126-M130 HydrophobicContact CZ-CG 3.88Å; F126-M130 HydrophobicContact CZ-SD 3.36Å; F126-M130 WeakPolarHBondContact CZ-SD 3.34Å; F126-M130 WeakPolarHBondContact O-CB 3.36Å; F126-M130 WeakPolarHBondContact O-CG 3.4Å; F126-M130 PolarHBondContact O-N 3Å; L127-M130 HydrophobicContact CD2-CE 3.74Å; M130-G134 PolarHBondContact O-N 3.27Å; M130-S161 PolarHBondContact O-OG 2.99Å
131	G	93.9	Very high	90.4	Very high	7 Å²	7	51.4 Å²	51.4	7%	0.072	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-47	174.5	0	0	0	0	0	112.3	L127 F128 T129 G134 F135 S165	L127-G131 PolarHBondContact O-N 3.43Å; F128-G131 PolarHBondContact O-N 3.43Å; T129-G131 VanDerWaalsContact C-N 3.33Å; T129-G131 PolarHBondContact O-N 3.48Å; G131-G134 PolarHBondContact O-N 3.49Å; G131-F135 WeakPolarHBondContact O-CD2 3.35Å; G131-F135 PolarHBondContact O-N 2.84Å; G131-S165 WeakPolarHBondContact CA-OG 3.4Å
132	G	92.1	Very high	90.4	Very high	32 Å²	32	57.6 Å²	57.6	33%	0.33	29%	0.294	S	S	.	.	H	α-helix	trans	-59.6	-50.1	174.6	0	0	0	0	0	112.4	F128 T129 G134 F135 I136	F128-G132 PolarHBondContact O-N 3.13Å; T129-G132 PolarHBondContact O-N 2.89Å; G132-G134 PolarHBondContact O-N 3.06Å; G132-F135 WeakPolarHBondContact O-CB 3.18Å; G132-F135 PolarHBondContact O-N 2.98Å; G132-F135 VanDerWaalsContact O-N 3.09Å; G132-I136 VanDerWaalsContact O-CD1 3.29Å; G132-I136 WeakPolarHBondContact O-CD1 3.48Å; G132-I136 WeakPolarHBondContact O-CG1 3.37Å; G132-I136 PolarHBondContact O-N 3.09Å
133	L	92.8	Very high	90.4	Very high	71 Å²	71	56.2 Å²	56.2	37%	0.372	29%	0.29	S	S	.	.	H	α-helix	trans	-58.2	-35.6	174.8	-73.4	174.1	0	0	0	112.1	I72 T129 F135 I136 I137	I72-L133 HydrophobicContact CD1-CD2 3.93Å; T129-L133 VanDerWaalsContact O-CB 3.31Å; T129-L133 WeakPolarHBondContact O-CB 3.34Å; T129-L133 VanDerWaalsContact O-CG 3.27Å; T129-L133 WeakPolarHBondContact O-CG 3.36Å; T129-L133 PolarHBondContact O-N 3.26Å; L133-F135 VanDerWaalsContact C-N 3.34Å; L133-F135 PolarHBondContact O-N 3.28Å; L133-I136 HydrophobicContact CD2-CD1 4.08Å; L133-I136 PolarHBondContact O-N 3.39Å; L133-I137 WeakPolarHBondContact O-CB 3.33Å; L133-I137 VanDerWaalsContact O-CG1 3.24Å; L133-I137 WeakPolarHBondContact O-CG1 3.37Å; L133-I137 PolarHBondContact O-N 3.38Å
134	G	93.8	Very high	89.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.9	-44.8	173.4	0	0	0	0	0	112.7	M130 G131 G132 I137 L138	M130-G134 PolarHBondContact O-N 3.27Å; G131-G134 PolarHBondContact O-N 3.49Å; G132-G134 PolarHBondContact O-N 3.06Å; G134-I137 PolarHBondContact O-N 3.05Å; G134-L138 WeakPolarHBondContact O-CG 3.27Å; G134-L138 PolarHBondContact O-N 2.96Å
135	F	92.7	Very high	89.4	Confident	131 Å²	131	66.2 Å²	66.2	58%	0.575	34%	0.344	S	S	*	.	H	α-helix	trans	-65.4	-39.2	174.9	-77.7	-71.3	0	0	0	113.1	G131 G132 L133 I137 L138 D139 V162	G131-F135 WeakPolarHBondContact O-CD2 3.35Å; G131-F135 PolarHBondContact O-N 2.84Å; G132-F135 WeakPolarHBondContact O-CB 3.18Å; G132-F135 PolarHBondContact O-N 2.98Å; G132-F135 VanDerWaalsContact O-N 3.09Å; L133-F135 VanDerWaalsContact C-N 3.34Å; L133-F135 PolarHBondContact O-N 3.28Å; F135-I137 VanDerWaalsContact C-N 3.34Å; F135-L138 HydrophobicContact CD1-CD1 4.46Å; F135-L138 WeakPolarHBondContact O-CB 3.43Å; F135-L138 PolarHBondContact O-N 3.37Å; F135-D139 PolarHBondContact O-N 3.45Å; F135-V162 HydrophobicContact CD1-CG2 4.23Å; F135-V162 HydrophobicContact CD2-CG1 4.48Å; F135-V162 HydrophobicContact CD2-CG2 3.81Å; F135-V162 HydrophobicContact CE1-CG1 4.14Å; F135-V162 HydrophobicContact CE1-CG2 4.26Å; F135-V162 HydrophobicContact CE2-CB 4.44Å; F135-V162 HydrophobicContact CE2-CG1 3.67Å; F135-V162 HydrophobicContact CE2-CG2 3.85Å; F135-V162 HydrophobicContact CG-CG2 4.01Å; F135-V162 HydrophobicContact CZ-CB 4.47Å; F135-V162 HydrophobicContact CZ-CG1 3.48Å; F135-V162 VanDerWaalsContact CZ-CG1 3.48Å; F135-V162 HydrophobicContact CZ-CG2 4.08Å
136	I	92.6	Very high	88.9	Confident	64 Å²	64	67.6 Å²	67.6	33%	0.328	35%	0.351	S	S	.	.	H	α-helix	trans	-66.5	-39.4	178.2	-62.6	145.5	0	0	0	110.8	Y68 I72 G132 L133 D139 R140	Y68-I136 WeakPolarHBondContact OH-CD1 3.33Å; Y68-I136 VanDerWaalsContact OH-CG1 3.24Å; Y68-I136 WeakPolarHBondContact OH-CG1 3.48Å; I72-I136 HydrophobicContact CD1-CD1 4.37Å; G132-I136 VanDerWaalsContact O-CD1 3.29Å; G132-I136 WeakPolarHBondContact O-CD1 3.48Å; G132-I136 WeakPolarHBondContact O-CG1 3.37Å; G132-I136 PolarHBondContact O-N 3.09Å; L133-I136 HydrophobicContact CD2-CD1 4.08Å; L133-I136 PolarHBondContact O-N 3.39Å; I136-D139 PolarHBondContact O-N 3.16Å; I136-R140 VanDerWaalsContact O-CB 3.29Å; I136-R140 WeakPolarHBondContact O-CB 3.48Å; I136-R140 PolarHBondContact O-N 3.03Å
137	I	91.6	Very high	88.7	Confident	56 Å²	56	66.7 Å²	66.7	29%	0.287	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-42.2	174.8	-68.9	164.8	0	0	0	110.4	L133 G134 F135 R140 S141 L154	L133-I137 WeakPolarHBondContact O-CB 3.33Å; L133-I137 VanDerWaalsContact O-CG1 3.24Å; L133-I137 WeakPolarHBondContact O-CG1 3.37Å; L133-I137 PolarHBondContact O-N 3.38Å; G134-I137 PolarHBondContact O-N 3.05Å; F135-I137 VanDerWaalsContact C-N 3.34Å; I137-R140 PolarHBondContact O-N 2.96Å; I137-S141 WeakPolarHBondContact O-CB 3.2Å; I137-S141 PolarHBondContact O-N 3.43Å; I137-L154 HydrophobicContact CG2-CB 4.47Å; I137-L154 HydrophobicContact CG2-CD2 3.85Å
138	L	91.6	Very high	88.4	Confident	42 Å²	42	74.9 Å²	74.9	22%	0.22	39%	0.391	C	S	.	.	H	α-helix	trans	-60	-48.2	175.9	-76.8	167.8	0	0	0	111.5	G134 F135 R140 S141 L155 F159 V162	G134-L138 WeakPolarHBondContact O-CG 3.27Å; G134-L138 PolarHBondContact O-N 2.96Å; F135-L138 HydrophobicContact CD1-CD1 4.46Å; F135-L138 WeakPolarHBondContact O-CB 3.43Å; F135-L138 PolarHBondContact O-N 3.37Å; L138-R140 PolarHBondContact O-N 3.04Å; L138-S141 WeakPolarHBondContact O-CB 3.46Å; L138-S141 PolarHBondContact O-N 3.36Å; L138-S141 PolarHBondContact O-OG 3.26Å; L138-L155 HydrophobicContact CD2-CG 4.19Å; L138-L155 WeakPolarHBondContact CD2-O 3.17Å; L138-F159 HydrophobicContact CD2-CB 4.42Å; L138-V162 HydrophobicContact CD1-CG2 4.05Å
139	D	90	Very high	88.2	Confident	124 Å²	124	76.8 Å²	76.8	66%	0.663	41%	0.405	S	S	*	.	H	α-helix	trans	-61.7	-44.8	176.7	-175.4	52.2	0	0	0	111.4	F135 I136 S141 N142	F135-D139 PolarHBondContact O-N 3.45Å; I136-D139 PolarHBondContact O-N 3.16Å; D139-S141 VanDerWaalsContact C-N 3.26Å; D139-S141 PolarHBondContact O-N 2.84Å; D139-N142 WeakPolarHBondContact O-CB 3.44Å; D139-N142 PolarHBondContact O-N 3.16Å; D139-N142 VanDerWaalsContact O-N 3.13Å
140	R	87.4	Confident	88	Confident	156 Å²	156	79.5 Å²	79.5	59%	0.589	42%	0.419	S	S	*	.	H	α-helix	trans	-66	-28.8	179.8	-169.9	60.1	-176.5	79.6	-3.4	113.3	I136 I137 L138 N142 A143 I146	I136-R140 VanDerWaalsContact O-CB 3.29Å; I136-R140 WeakPolarHBondContact O-CB 3.48Å; I136-R140 PolarHBondContact O-N 3.03Å; I137-R140 PolarHBondContact O-N 2.96Å; L138-R140 PolarHBondContact O-N 3.04Å; R140-N142 PolarHBondContact O-N 2.94Å; R140-A143 WeakPolarHBondContact O-CB 3.22Å; R140-A143 PolarHBondContact O-N 2.74Å; R140-I146 WeakPolarHBondContact O-CD1 3.43Å
141	S	86.4	Confident	87.8	Confident	4 Å²	4	81.2 Å²	81.2	3%	0.028	42%	0.423	C	S	.	.	H	α-helix	trans	-67.3	-24.8	177.4	80.2	0	0	0	0	112.8	I137 L138 D139 A143 R151	I137-S141 WeakPolarHBondContact O-CB 3.2Å; I137-S141 PolarHBondContact O-N 3.43Å; L138-S141 WeakPolarHBondContact O-CB 3.46Å; L138-S141 PolarHBondContact O-N 3.36Å; L138-S141 PolarHBondContact O-OG 3.26Å; D139-S141 VanDerWaalsContact C-N 3.26Å; D139-S141 PolarHBondContact O-N 2.84Å; S141-A143 PolarHBondContact O-N 3Å; S141-R151 WeakPolarHBondContact O-CG 3.36Å; S141-R151 PolarHBondContact O-NE 3.25Å
142	N	85.1	Confident	87.5	Confident	129 Å²	129	88.3 Å²	88.3	69%	0.69	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-7.9	178	-167.8	39.8	0	0	0	113.3	D139 R140	D139-N142 WeakPolarHBondContact O-CB 3.44Å; D139-N142 PolarHBondContact O-N 3.16Å; D139-N142 VanDerWaalsContact O-N 3.13Å; R140-N142 PolarHBondContact O-N 2.94Å
143	A	85.6	Confident	87.4	Confident	25 Å²	25	90.9 Å²	90.9	21%	0.207	46%	0.458	C	S	.	.			trans	-62.5	138.1	-179.9	0	0	0	0	0	112.1	R140 S141 N145 I146 R151	R140-A143 WeakPolarHBondContact O-CB 3.22Å; R140-A143 PolarHBondContact O-N 2.74Å; S141-A143 PolarHBondContact O-N 3Å; A143-N145 VanDerWaalsContact C-N 3.26Å; A143-N145 PolarHBondContact O-N 2.92Å; A143-I146 HydrophobicContact CB-CD1 4.17Å; A143-I146 HydrophobicContact CB-CG1 4.49Å; A143-R151 PolarHBondContact O-NH2 3.04Å
144	P	75.1	Confident	87.3	Confident	109 Å²	109	89.8 Å²	89.8	71%	0.708	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.6	-172.4	23.1	-32.3	0	0	0	114.1	I146 R151	P144-I146 PolarHBondContact O-N 2.88Å; P144-R151 PolarHBondContact O-NH2 2.71Å; P144-R151 VanDerWaalsContact O-NH2 3.12Å
145	N	80	Confident	87.2	Confident	155 Å²	155	93.8 Å²	93.8	83%	0.829	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	29.1	-170.6	-63.9	-30.6	0	0	0	115.5	A143	A143-N145 VanDerWaalsContact C-N 3.26Å; A143-N145 PolarHBondContact O-N 2.92Å
146	I	80.5	Confident	87.1	Confident	28 Å²	28	93.5 Å²	93.5	14%	0.144	47%	0.471	C	S	.	.	S	Bend	trans	-117.4	135.9	-175.3	-53.5	176.9	0	0	0	110.2	R140 A143 P144 N150 R151 L154	R140-I146 WeakPolarHBondContact O-CD1 3.43Å; A143-I146 HydrophobicContact CB-CD1 4.17Å; A143-I146 HydrophobicContact CB-CG1 4.49Å; P144-I146 PolarHBondContact O-N 2.88Å; I146-N150 HydrophobicContact CG2-CB 3.89Å; I146-R151 HydrophobicContact CG2-CB 4.18Å; I146-L154 HydrophobicContact CG2-CD1 4.42Å
147	P	86.1	Confident	87.2	Confident	91 Å²	91	94.5 Å²	94.5	59%	0.591	48%	0.477	S	S	*	.			trans	-61.4	144.4	174.4	24.3	-32.8	0	0	0	111.6	L149 N150 R151	P147-L149 VanDerWaalsContact C-N 3.3Å; P147-L149 PolarHBondContact O-N 3.49Å; P147-L149 VanDerWaalsContact O-N 3.17Å; P147-N150 HydrophobicContact CG-CB 3.9Å; P147-N150 PolarHBondContact O-N 3.19Å; P147-N150 VanDerWaalsContact O-N 3.09Å; P147-R151 PolarHBondContact O-N 2.73Å
148	K	84.3	Confident	87.3	Confident	189 Å²	189	91.9 Å²	91.9	82%	0.822	46%	0.463	S	S	*	.	H	α-helix	trans	-53.5	-41.3	-169.6	-61	-178.8	-176.5	177.3	0	113.8	F152	K148-F152 PolarHBondContact O-N 3.47Å; K148-F152 VanDerWaalsContact O-N 3.08Å
149	L	85.3	Confident	87.3	Confident	137 Å²	137	95 Å²	95	72%	0.717	48%	0.475	S	S	*	.	H	α-helix	trans	-65	-49.6	179	-166.9	167.5	0	0	0	111.2	P147 R151 F152 L153	P147-L149 VanDerWaalsContact C-N 3.3Å; P147-L149 PolarHBondContact O-N 3.49Å; P147-L149 VanDerWaalsContact O-N 3.17Å; L149-R151 VanDerWaalsContact C-N 3.31Å; L149-R151 PolarHBondContact O-N 3.32Å; L149-F152 PolarHBondContact O-N 2.9Å; L149-L153 PolarHBondContact O-N 3.33Å
150	N	87.8	Confident	87.5	Confident	74 Å²	74	92.1 Å²	92.1	40%	0.396	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-39.2	179.9	-167.9	25.6	0	0	0	111.2	I146 P147 F152 L153 L154	I146-N150 HydrophobicContact CG2-CB 3.89Å; P147-N150 HydrophobicContact CG-CB 3.9Å; P147-N150 PolarHBondContact O-N 3.19Å; P147-N150 VanDerWaalsContact O-N 3.09Å; N150-F152 PolarHBondContact O-N 3.2Å; N150-L153 PolarHBondContact O-N 2.64Å; N150-L154 WeakPolarHBondContact O-CB 3.48Å; N150-L154 WeakPolarHBondContact O-CD1 3.43Å; N150-L154 WeakPolarHBondContact O-CG 3.39Å; N150-L154 PolarHBondContact O-N 3.44Å; N150-L154 WeakPolarHBondContact OD1-CD1 3.5Å
151	R	88.3	Confident	87.8	Confident	82 Å²	82	86 Å²	86	31%	0.309	44%	0.442	S	S	.	.	H	α-helix	trans	-57.7	-47.8	173.9	179.7	177.6	-66.6	157.3	6	111.7	S141 A143 P144 I146 P147 L149 L155	S141-R151 WeakPolarHBondContact O-CG 3.36Å; S141-R151 PolarHBondContact O-NE 3.25Å; A143-R151 PolarHBondContact O-NH2 3.04Å; P144-R151 PolarHBondContact O-NH2 2.71Å; P144-R151 VanDerWaalsContact O-NH2 3.12Å; I146-R151 HydrophobicContact CG2-CB 4.18Å; P147-R151 PolarHBondContact O-N 2.73Å; L149-R151 VanDerWaalsContact C-N 3.31Å; L149-R151 PolarHBondContact O-N 3.32Å; R151-L155 WeakPolarHBondContact O-CB 3.35Å; R151-L155 PolarHBondContact O-N 2.94Å
152	F	88	Confident	88.2	Confident	156 Å²	156	86.9 Å²	86.9	68%	0.684	45%	0.448	S	S	*	.	H	α-helix	trans	-63.7	-41.9	179.6	-171.3	-99.2	0	0	0	111.9	K148 L149 N150 L155 F156	K148-F152 PolarHBondContact O-N 3.47Å; K148-F152 VanDerWaalsContact O-N 3.08Å; L149-F152 PolarHBondContact O-N 2.9Å; N150-F152 PolarHBondContact O-N 3.2Å; F152-L155 PolarHBondContact O-N 2.96Å; F152-F156 WeakPolarHBondContact O-CB 3.3Å; F152-F156 PolarHBondContact O-N 3.4Å
153	L	90	Very high	88.6	Confident	86 Å²	86	84 Å²	84	45%	0.45	43%	0.432	S	S	.	.	H	α-helix	trans	-66.5	-44.2	178.8	-173.6	136.6	0	0	0	112.4	L149 N150 L155 F156 I157	L149-L153 PolarHBondContact O-N 3.33Å; N150-L153 PolarHBondContact O-N 2.64Å; L153-L155 PolarHBondContact O-N 3.46Å; L153-F156 PolarHBondContact O-N 3.49Å; L153-I157 HydrophobicContact CD2-CD1 3.42Å; L153-I157 VanDerWaalsContact CD2-CD1 3.42Å; L153-I157 HydrophobicContact CD2-CG1 4.5Å; L153-I157 HydrophobicContact CG-CD1 4Å; L153-I157 WeakPolarHBondContact O-CB 3.4Å; L153-I157 VanDerWaalsContact O-CG1 3.29Å; L153-I157 WeakPolarHBondContact O-CG1 3.42Å; L153-I157 PolarHBondContact O-N 3.24Å
154	L	90.6	Very high	88.9	Confident	47 Å²	47	86.8 Å²	86.8	25%	0.246	44%	0.443	C	S	.	.	H	α-helix	trans	-61.7	-41.9	174.9	-80.3	153.1	0	0	0	112	I137 I146 N150 G158	I137-L154 HydrophobicContact CG2-CB 4.47Å; I137-L154 HydrophobicContact CG2-CD2 3.85Å; I146-L154 HydrophobicContact CG2-CD1 4.42Å; N150-L154 WeakPolarHBondContact O-CB 3.48Å; N150-L154 WeakPolarHBondContact O-CD1 3.43Å; N150-L154 WeakPolarHBondContact O-CG 3.39Å; N150-L154 PolarHBondContact O-N 3.44Å; N150-L154 WeakPolarHBondContact OD1-CD1 3.5Å; L154-G158 PolarHBondContact O-N 3.43Å
155	L	91.4	Very high	89.7	Confident	85 Å²	85	82.1 Å²	82.1	45%	0.445	41%	0.413	S	S	.	.	H	α-helix	trans	-63.5	-45.9	177	-168.6	158.5	0	0	0	110.7	L138 R151 F152 L153 G158 F159	L138-L155 HydrophobicContact CD2-CG 4.19Å; L138-L155 WeakPolarHBondContact CD2-O 3.17Å; R151-L155 WeakPolarHBondContact O-CB 3.35Å; R151-L155 PolarHBondContact O-N 2.94Å; F152-L155 PolarHBondContact O-N 2.96Å; L153-L155 PolarHBondContact O-N 3.46Å; L155-G158 PolarHBondContact O-N 3.31Å; L155-F159 VanDerWaalsContact O-CB 3.27Å; L155-F159 WeakPolarHBondContact O-CB 3.31Å; L155-F159 PolarHBondContact O-N 3.04Å
156	F	92.4	Very high	90.2	Very high	125 Å²	125	80.6 Å²	80.6	55%	0.548	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-47.5	177.5	-175.1	-103.2	0	0	0	112.1	F152 L153 F159 V160	F152-F156 WeakPolarHBondContact O-CB 3.3Å; F152-F156 PolarHBondContact O-N 3.4Å; L153-F156 PolarHBondContact O-N 3.49Å; F156-F159 PolarHBondContact O-N 2.84Å; F156-V160 HydrophobicContact CD1-CG2 4.25Å; F156-V160 HydrophobicContact CD2-CG2 4.45Å; F156-V160 HydrophobicContact CE1-CG2 3.9Å; F156-V160 HydrophobicContact CE2-CG2 4.11Å; F156-V160 HydrophobicContact CZ-CG2 3.82Å; F156-V160 WeakPolarHBondContact O-CB 3.15Å; F156-V160 VanDerWaalsContact O-CG2 3.29Å; F156-V160 WeakPolarHBondContact O-CG2 3.17Å; F156-V160 PolarHBondContact O-N 3.03Å
157	I	93.6	Very high	90.7	Very high	85 Å²	85	85.4 Å²	85.4	44%	0.436	42%	0.419	S	S	.	.	H	α-helix	trans	-62.2	-46.1	178.5	-70.3	169.6	0	0	0	111.2	L153 F159 V160 S161	L153-I157 HydrophobicContact CD2-CD1 3.42Å; L153-I157 VanDerWaalsContact CD2-CD1 3.42Å; L153-I157 HydrophobicContact CD2-CG1 4.5Å; L153-I157 HydrophobicContact CG-CD1 4Å; L153-I157 WeakPolarHBondContact O-CB 3.4Å; L153-I157 VanDerWaalsContact O-CG1 3.29Å; L153-I157 WeakPolarHBondContact O-CG1 3.42Å; L153-I157 PolarHBondContact O-N 3.24Å; I157-F159 VanDerWaalsContact C-N 3.34Å; I157-F159 PolarHBondContact O-N 3.32Å; I157-V160 PolarHBondContact O-N 2.95Å; I157-S161 VanDerWaalsContact O-CB 3.32Å; I157-S161 WeakPolarHBondContact O-CB 3.4Å; I157-S161 PolarHBondContact O-N 3.18Å
158	G	92.9	Very high	90.7	Very high	0 Å²	0	84.9 Å²	84.9	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-61.6	-43.2	178.4	0	0	0	0	0	112	L154 L155 S161 V162	L154-G158 PolarHBondContact O-N 3.43Å; L155-G158 PolarHBondContact O-N 3.31Å; G158-S161 PolarHBondContact O-N 3.38Å; G158-V162 WeakPolarHBondContact O-CG2 3.4Å; G158-V162 PolarHBondContact O-N 3.09Å
159	F	93.2	Very high	90.9	Very high	109 Å²	109	77 Å²	77	48%	0.478	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-46.7	177.1	-175.2	-108	0	0	0	112.4	L138 L155 F156 I157 S161 V162 L163	L138-F159 HydrophobicContact CD2-CB 4.42Å; L155-F159 VanDerWaalsContact O-CB 3.27Å; L155-F159 WeakPolarHBondContact O-CB 3.31Å; L155-F159 PolarHBondContact O-N 3.04Å; F156-F159 PolarHBondContact O-N 2.84Å; I157-F159 VanDerWaalsContact C-N 3.34Å; I157-F159 PolarHBondContact O-N 3.32Å; F159-S161 VanDerWaalsContact C-N 3.34Å; F159-S161 PolarHBondContact O-N 3.34Å; F159-V162 PolarHBondContact O-N 3.13Å; F159-L163 HydrophobicContact CD1-CD1 3.85Å; F159-L163 HydrophobicContact CE1-CD1 3.29Å; F159-L163 HydrophobicContact CE1-CG 4.18Å; F159-L163 HydrophobicContact CE2-CD1 4.35Å; F159-L163 HydrophobicContact CE2-CG 4.46Å; F159-L163 HydrophobicContact CZ-CD1 3.59Å; F159-L163 HydrophobicContact CZ-CG 4.15Å; F159-L163 PolarHBondContact O-N 3.4Å
160	V	94.1	Very high	90.9	Very high	62 Å²	62	75.4 Å²	75.4	38%	0.376	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-41.1	176.4	171.5	0	0	0	0	111.1	F156 I157 V162 L163 L164	F156-V160 HydrophobicContact CD1-CG2 4.25Å; F156-V160 HydrophobicContact CD2-CG2 4.45Å; F156-V160 HydrophobicContact CE1-CG2 3.9Å; F156-V160 HydrophobicContact CE2-CG2 4.11Å; F156-V160 HydrophobicContact CZ-CG2 3.82Å; F156-V160 WeakPolarHBondContact O-CB 3.15Å; F156-V160 VanDerWaalsContact O-CG2 3.29Å; F156-V160 WeakPolarHBondContact O-CG2 3.17Å; F156-V160 PolarHBondContact O-N 3.03Å; I157-V160 PolarHBondContact O-N 2.95Å; V160-V162 PolarHBondContact O-N 3.22Å; V160-L163 PolarHBondContact O-N 2.86Å; V160-L164 VanDerWaalsContact O-CB 3.22Å; V160-L164 WeakPolarHBondContact O-CB 3.38Å; V160-L164 PolarHBondContact O-N 2.78Å
161	S	93.6	Very high	90.7	Very high	27 Å²	27	75 Å²	75	19%	0.189	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-44.4	177.4	-170.1	0	0	0	0	112.2	M130 I157 G158 F159 S165	M130-S161 PolarHBondContact O-OG 2.99Å; I157-S161 VanDerWaalsContact O-CB 3.32Å; I157-S161 WeakPolarHBondContact O-CB 3.4Å; I157-S161 PolarHBondContact O-N 3.18Å; G158-S161 PolarHBondContact O-N 3.38Å; F159-S161 VanDerWaalsContact C-N 3.34Å; F159-S161 PolarHBondContact O-N 3.34Å; S161-S165 WeakPolarHBondContact O-CB 3.23Å; S161-S165 PolarHBondContact O-N 3.33Å; S161-S165 PolarHBondContact O-OG 3.07Å
162	V	93.9	Very high	90.3	Very high	24 Å²	24	73 Å²	73	15%	0.145	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-44.8	177.3	172.5	0	0	0	0	111.3	F135 L138 G158 F159 V160 S165 F166	F135-V162 HydrophobicContact CD1-CG2 4.23Å; F135-V162 HydrophobicContact CD2-CG1 4.48Å; F135-V162 HydrophobicContact CD2-CG2 3.81Å; F135-V162 HydrophobicContact CE1-CG1 4.14Å; F135-V162 HydrophobicContact CE1-CG2 4.26Å; F135-V162 HydrophobicContact CE2-CB 4.44Å; F135-V162 HydrophobicContact CE2-CG1 3.67Å; F135-V162 HydrophobicContact CE2-CG2 3.85Å; F135-V162 HydrophobicContact CG-CG2 4.01Å; F135-V162 HydrophobicContact CZ-CB 4.47Å; F135-V162 HydrophobicContact CZ-CG1 3.48Å; F135-V162 VanDerWaalsContact CZ-CG1 3.48Å; F135-V162 HydrophobicContact CZ-CG2 4.08Å; L138-V162 HydrophobicContact CD1-CG2 4.05Å; G158-V162 WeakPolarHBondContact O-CG2 3.4Å; G158-V162 PolarHBondContact O-N 3.09Å; F159-V162 PolarHBondContact O-N 3.13Å; V160-V162 PolarHBondContact O-N 3.22Å; V162-S165 WeakPolarHBondContact CA-OG 3.36Å; V162-S165 PolarHBondContact O-OG 3.49Å; V162-F166 WeakPolarHBondContact O-CB 3.35Å; V162-F166 PolarHBondContact O-N 3.26Å
163	L	93.6	Very high	90	Very high	67 Å²	67	69.3 Å²	69.3	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-47.6	178	-74.8	-178.2	0	0	0	111.9	F159 V160 S165 F166 F167	F159-L163 HydrophobicContact CD1-CD1 3.85Å; F159-L163 HydrophobicContact CE1-CD1 3.29Å; F159-L163 HydrophobicContact CE1-CG 4.18Å; F159-L163 HydrophobicContact CE2-CD1 4.35Å; F159-L163 HydrophobicContact CE2-CG 4.46Å; F159-L163 HydrophobicContact CZ-CD1 3.59Å; F159-L163 HydrophobicContact CZ-CG 4.15Å; F159-L163 PolarHBondContact O-N 3.4Å; V160-L163 PolarHBondContact O-N 2.86Å; L163-S165 PolarHBondContact O-N 3.12Å; L163-F166 PolarHBondContact O-N 3.07Å; L163-F167 HydrophobicContact CB-CD2 4.47Å; L163-F167 HydrophobicContact CD2-CE2 4.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.37Å; L163-F167 PolarHBondContact O-N 3.33Å
164	L	91.8	Very high	89.5	Confident	84 Å²	84	70.5 Å²	70.5	44%	0.44	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-48.7	-179.6	-170.8	89.9	0	0	0	110.8	V160 F166 F167 M168	V160-L164 VanDerWaalsContact O-CB 3.22Å; V160-L164 WeakPolarHBondContact O-CB 3.38Å; V160-L164 PolarHBondContact O-N 2.78Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 3.29Å; L164-F167 PolarHBondContact O-N 3.27Å; L164-M168 HydrophobicContact CD1-CE 4.31Å; L164-M168 HydrophobicContact CG-CG 4.34Å; L164-M168 VanDerWaalsContact O-CB 3.26Å; L164-M168 WeakPolarHBondContact O-CB 3.49Å; L164-M168 WeakPolarHBondContact O-CG 3.19Å; L164-M168 PolarHBondContact O-N 3.1Å
165	S	92.8	Very high	88.8	Confident	12 Å²	12	72.9 Å²	72.9	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-41.2	178.4	53.7	0	0	0	0	112.3	L127 G131 S161 V162 L163 A169	L127-S165 WeakPolarHBondContact O-CB 3.42Å; G131-S165 WeakPolarHBondContact CA-OG 3.4Å; S161-S165 WeakPolarHBondContact O-CB 3.23Å; S161-S165 PolarHBondContact O-N 3.33Å; S161-S165 PolarHBondContact O-OG 3.07Å; V162-S165 WeakPolarHBondContact CA-OG 3.36Å; V162-S165 PolarHBondContact O-OG 3.49Å; L163-S165 PolarHBondContact O-N 3.12Å; S165-A169 WeakPolarHBondContact O-CB 3.46Å; S165-A169 PolarHBondContact O-N 3.41Å
166	F	90.8	Very high	88	Confident	123 Å²	123	70.3 Å²	70.3	54%	0.539	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-50.7	176.8	-179.5	-101.5	0	0	0	112.5	V162 L163 L164 A169 R170	V162-F166 WeakPolarHBondContact O-CB 3.35Å; V162-F166 PolarHBondContact O-N 3.26Å; L163-F166 PolarHBondContact O-N 3.07Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 3.29Å; F166-A169 PolarHBondContact O-N 3.32Å; F166-R170 HydrophobicContact CD1-CG 4.5Å; F166-R170 HydrophobicContact CE1-CG 4.2Å; F166-R170 HydrophobicContact CE2-CG 4.43Å; F166-R170 HydrophobicContact CZ-CG 4.17Å; F166-R170 VanDerWaalsContact O-CG 3.23Å; F166-R170 WeakPolarHBondContact O-CG 3.48Å; F166-R170 PolarHBondContact O-N 3.35Å
167	F	90.1	Very high	87.2	Confident	128 Å²	128	67.1 Å²	67.1	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-63.4	-44.5	179.2	-82.7	-67.8	0	0	0	111.7	L163 L164 R170 V171	L163-F167 HydrophobicContact CB-CD2 4.47Å; L163-F167 HydrophobicContact CD2-CE2 4.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.37Å; L163-F167 PolarHBondContact O-N 3.33Å; L164-F167 PolarHBondContact O-N 3.27Å; F167-R170 WeakPolarHBondContact O-CB 3.26Å; F167-R170 PolarHBondContact O-N 2.98Å; F167-V171 WeakPolarHBondContact O-CG2 3.38Å; F167-V171 PolarHBondContact O-N 3.01Å
168	M	86.9	Confident	86	Confident	81 Å²	81	66.3 Å²	66.3	40%	0.399	33%	0.327	S	S	.	.	H	α-helix	trans	-61.2	-52.8	177.1	-69.5	-60.8	161.6	0	0	109.9	L127 L164 R170 V171 F172	L127-M168 HydrophobicContact CD1-CB 3.8Å; L127-M168 HydrophobicContact CD2-CB 3.9Å; L127-M168 HydrophobicContact CD2-CG 4.27Å; L127-M168 HydrophobicContact CG-CB 4.48Å; L164-M168 HydrophobicContact CD1-CE 4.31Å; L164-M168 HydrophobicContact CG-CG 4.34Å; L164-M168 VanDerWaalsContact O-CB 3.26Å; L164-M168 WeakPolarHBondContact O-CB 3.49Å; L164-M168 WeakPolarHBondContact O-CG 3.19Å; L164-M168 PolarHBondContact O-N 3.1Å; M168-R170 PolarHBondContact O-N 3.38Å; M168-R170 VanDerWaalsContact O-N 3.11Å; M168-V171 CarbonylContact O-C 3.58Å; M168-V171 WeakPolarHBondContact O-CA 3.2Å; M168-V171 WeakPolarHBondContact O-CB 3.39Å; M168-V171 PolarHBondContact O-N 2.96Å; M168-F172 HydrophobicContact CB-CD2 4.47Å; M168-F172 HydrophobicContact CB-CE2 4.31Å; M168-F172 WeakPolarHBondContact O-CD2 3.47Å; M168-F172 PolarHBondContact O-N 2.91Å
169	A	87.1	Confident	84.6	Confident	22 Å²	22	68.2 Å²	68.2	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-53.6	-37.5	178	0	0	0	0	0	113.1	F128 S165 F166 F172 M173	F128-A169 HydrophobicContact CE1-CB 3.89Å; S165-A169 WeakPolarHBondContact O-CB 3.46Å; S165-A169 PolarHBondContact O-N 3.41Å; F166-A169 PolarHBondContact O-N 3.32Å; A169-F172 PolarHBondContact O-N 2.94Å; A169-M173 WeakPolarHBondContact O-CG 3.17Å; A169-M173 PolarHBondContact O-N 3.47Å
170	R	85.5	Confident	83.2	Confident	104 Å²	104	67.8 Å²	67.8	39%	0.392	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-40.3	173.5	-69.8	-73.1	-66.2	173.2	-0.3	112.6	F166 F167 M168 M173 R174	F166-R170 HydrophobicContact CD1-CG 4.5Å; F166-R170 HydrophobicContact CE1-CG 4.2Å; F166-R170 HydrophobicContact CE2-CG 4.43Å; F166-R170 HydrophobicContact CZ-CG 4.17Å; F166-R170 VanDerWaalsContact O-CG 3.23Å; F166-R170 WeakPolarHBondContact O-CG 3.48Å; F166-R170 PolarHBondContact O-N 3.35Å; F167-R170 WeakPolarHBondContact O-CB 3.26Å; F167-R170 PolarHBondContact O-N 2.98Å; M168-R170 PolarHBondContact O-N 3.38Å; M168-R170 VanDerWaalsContact O-N 3.11Å; R170-M173 PolarHBondContact O-N 3.48Å; R170-R174 VanDerWaalsContact O-CG 3.3Å; R170-R174 WeakPolarHBondContact O-CG 3.32Å; R170-R174 PolarHBondContact O-N 3.24Å
171	V	84	Confident	81.5	Confident	65 Å²	65	70 Å²	70	39%	0.394	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-43	172.6	172.7	0	0	0	0	111	F167 M168 M173 R174 M175	F167-V171 WeakPolarHBondContact O-CG2 3.38Å; F167-V171 PolarHBondContact O-N 3.01Å; M168-V171 CarbonylContact O-C 3.58Å; M168-V171 WeakPolarHBondContact O-CA 3.2Å; M168-V171 WeakPolarHBondContact O-CB 3.39Å; M168-V171 PolarHBondContact O-N 2.96Å; V171-M173 VanDerWaalsContact C-N 3.32Å; V171-M173 PolarHBondContact O-N 3.04Å; V171-R174 PolarHBondContact O-N 3.05Å; V171-R174 VanDerWaalsContact O-N 3.09Å; V171-M175 HydrophobicContact CG1-CE 3.44Å; V171-M175 VanDerWaalsContact CG1-CE 3.44Å; V171-M175 HydrophobicContact CG1-CG 4.23Å; V171-M175 HydrophobicContact CG1-SD 3.91Å; V171-M175 WeakPolarHBondContact O-CG 3.38Å; V171-M175 PolarHBondContact O-N 2.7Å
172	F	81.1	Confident	79.8	Confident	42 Å²	42	76.5 Å²	76.5	18%	0.184	38%	0.381	C	S	.	.	H	α-helix	trans	-56.1	-46.6	174.3	-82.6	-97.4	0	0	0	111.2	F108 A123 L127 M168 A169 R174 M175 K176	F108-F172 HydrophobicContact CD1-CD1 4.27Å; F108-F172 HydrophobicContact CD1-CE1 4.34Å; F108-F172 AromaticContact CE1-CD1 3.4Å; F108-F172 HydrophobicContact CE1-CD1 3.4Å; F108-F172 VanDerWaalsContact CE1-CD1 3.4Å; F108-F172 AromaticContact CE1-CE1 3.13Å; F108-F172 HydrophobicContact CE1-CE1 3.13Å; F108-F172 HydrophobicContact CE1-CZ 4.15Å; F108-F172 HydrophobicContact CE2-CE1 4.42Å; F108-F172 AromaticContact CZ-CD1 3.79Å; F108-F172 HydrophobicContact CZ-CD1 3.79Å; F108-F172 AromaticContact CZ-CE1 3.17Å; F108-F172 HydrophobicContact CZ-CE1 3.17Å; F108-F172 AromaticContact CZ-CZ 3.74Å; F108-F172 HydrophobicContact CZ-CZ 3.74Å; A123-F172 HydrophobicContact CB-CE1 3.97Å; A123-F172 HydrophobicContact CB-CZ 3.97Å; L127-F172 HydrophobicContact CD1-CD2 3.68Å; L127-F172 HydrophobicContact CD1-CE2 3.02Å; L127-F172 HydrophobicContact CD1-CZ 3.54Å; M168-F172 HydrophobicContact CB-CD2 4.47Å; M168-F172 HydrophobicContact CB-CE2 4.31Å; M168-F172 WeakPolarHBondContact O-CD2 3.47Å; M168-F172 PolarHBondContact O-N 2.91Å; A169-F172 PolarHBondContact O-N 2.94Å; F172-R174 VanDerWaalsContact C-N 3.31Å; F172-R174 PolarHBondContact O-N 2.8Å; F172-M175 PolarHBondContact O-N 2.98Å; F172-K176 WeakPolarHBondContact O-CB 3.07Å; F172-K176 PolarHBondContact O-N 3.29Å
173	M	81.2	Confident	77.5	Confident	77 Å²	77	82 Å²	82	38%	0.379	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-38.5	177	-69.4	-61.7	-68.7	0	0	112.4	A169 R170 V171 L177 Y180	A169-M173 WeakPolarHBondContact O-CG 3.17Å; A169-M173 PolarHBondContact O-N 3.47Å; R170-M173 PolarHBondContact O-N 3.48Å; V171-M173 VanDerWaalsContact C-N 3.32Å; V171-M173 PolarHBondContact O-N 3.04Å; M173-L177 PolarHBondContact O-N 2.98Å; M173-Y180 HydrophobicContact CB-CD1 4.47Å; M173-Y180 HydrophobicContact CE-CE1 4.29Å
174	R	79	Confident	76.7	Confident	111 Å²	111	82.8 Å²	82.8	42%	0.419	45%	0.448	S	S	.	.	H	α-helix	trans	-72	-32.8	177.9	-69.9	-79.1	-80	169.6	-0.9	112.9	R170 V171 F172 L177 Y180	R170-R174 VanDerWaalsContact O-CG 3.3Å; R170-R174 WeakPolarHBondContact O-CG 3.32Å; R170-R174 PolarHBondContact O-N 3.24Å; V171-R174 PolarHBondContact O-N 3.05Å; V171-R174 VanDerWaalsContact O-N 3.09Å; F172-R174 VanDerWaalsContact C-N 3.31Å; F172-R174 PolarHBondContact O-N 2.8Å; R174-L177 CarbonylContact O-C 3.51Å; R174-Y180 WeakPolarHBondContact CD-O 3.44Å; R174-Y180 PolarHBondContact NH1-O 3.34Å
175	M	76.1	Confident	75.9	Confident	98 Å²	98	82.7 Å²	82.7	48%	0.483	45%	0.449	S	S	.	.	H	α-helix	trans	-70.6	-39.5	173.9	-72.1	175.6	173.9	0	0	111.5	F108 V171 F172	F108-M175 HydrophobicContact CD2-SD 4.41Å; V171-M175 HydrophobicContact CG1-CE 3.44Å; V171-M175 VanDerWaalsContact CG1-CE 3.44Å; V171-M175 HydrophobicContact CG1-CG 4.23Å; V171-M175 HydrophobicContact CG1-SD 3.91Å; V171-M175 WeakPolarHBondContact O-CG 3.38Å; V171-M175 PolarHBondContact O-N 2.7Å; F172-M175 PolarHBondContact O-N 2.98Å
176	K	74.4	Confident	75	Confident	30 Å²	30	86.7 Å²	86.7	13%	0.13	47%	0.469	C	S	.	.	H	α-helix	trans	-72.3	-37.6	178.7	-164.3	167.7	-172.5	134.7	0	112.5	Y111 V113 G115 E120 F172	Y111-K176 PolarHBondContact N-O 3.48Å; V113-K176 VanDerWaalsContact O-CE 3.27Å; V113-K176 WeakPolarHBondContact O-CE 3.31Å; V113-K176 PolarHBondContact O-NZ 3.44Å; G115-K176 PolarHBondContact O-NZ 3.21Å; E120-K176 WeakPolarHBondContact OE1-CD 3.29Å; E120-K176 WeakPolarHBondContact OE1-CE 3.48Å; E120-K176 IonicContact OE1-NZ 2.71Å; E120-K176 PolarHBondContact OE1-NZ 2.85Å; F172-K176 WeakPolarHBondContact O-CB 3.07Å; F172-K176 PolarHBondContact O-N 3.29Å
177	L	76.7	Confident	74	Confident	59 Å²	59	84.5 Å²	84.5	31%	0.309	47%	0.465	S	S	.	.	S	Bend	trans	-127.4	82.5	-178.8	-73	154.6	0	0	0	110.8	V113 M173 R174 G179 Y180	V113-L177 HydrophobicContact CG2-CD1 4.35Å; V113-L177 HydrophobicContact CG2-CD2 3.67Å; V113-L177 HydrophobicContact CG2-CG 4.15Å; M173-L177 PolarHBondContact O-N 2.98Å; R174-L177 CarbonylContact O-C 3.51Å; L177-G179 PolarHBondContact O-N 2.92Å; L177-Y180 HydrophobicContact CD1-CD2 4.32Å; L177-Y180 WeakPolarHBondContact O-CB 3.5Å; L177-Y180 PolarHBondContact O-N 3.31Å
178	P	66.8	Low	73	Confident	67 Å²	67	81.8 Å²	81.8	44%	0.435	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	109.7	174.4	26.4	-31.6	0	0	0	109	Y111	Y111-P178 HydrophobicContact CD1-CG 3.88Å; Y111-P178 HydrophobicContact CE1-CG 3.26Å; Y111-P178 HydrophobicContact CE2-CG 4.13Å
179	G	65.2	Low	72.1	Confident	40 Å²	40	81.9 Å²	81.9	41%	0.412	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.7	-9	-171	0	0	0	0	0	114.2	L177 L181 M182	L177-G179 PolarHBondContact O-N 2.92Å; G179-L181 PolarHBondContact O-N 2.88Å; G179-M182 PolarHBondContact O-N 3.47Å
180	Y	62	Low	71	Confident	101 Å²	101	86.1 Å²	86.1	40%	0.396	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	119.3	174.9	-164.9	-112.6	0	0	0	110.7	M173 R174 L177	M173-Y180 HydrophobicContact CB-CD1 4.47Å; M173-Y180 HydrophobicContact CE-CE1 4.29Å; R174-Y180 WeakPolarHBondContact CD-O 3.44Å; R174-Y180 PolarHBondContact NH1-O 3.34Å; L177-Y180 HydrophobicContact CD1-CD2 4.32Å; L177-Y180 WeakPolarHBondContact O-CB 3.5Å; L177-Y180 PolarHBondContact O-N 3.31Å
181	L	59.4	Low	69.9	Low	108 Å²	108	84.8 Å²	84.8	57%	0.565	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	39.7	-175.9	-71	138.7	0	0	0	115.8	G179 G183	G179-L181 PolarHBondContact O-N 2.88Å; L181-G183 VanDerWaalsContact C-N 3.32Å; L181-G183 PolarHBondContact O-N 3.3Å
182	M	57.4	Low	68.8	Low	163 Å²	163	86.4 Å²	86.4	80%	0.803	50%	0.498	S	S	*	.			trans	-82.8	83.4	153	-73.8	-178.4	169.1	0	0	108.3	G179	G179-M182 PolarHBondContact O-N 3.47Å
183	G	45.8	Very low	67.6	Low	141 Å²	141	90.5 Å²	90.5	100%	1.454	53%	0.526	S	S	*	.			trans	-165.4	0	178.7	0	0	0	0	0	109.7	L181	L181-G183 VanDerWaalsContact C-N 3.32Å; L181-G183 PolarHBondContact O-N 3.3Å

Retrieved 183 of 183 residues in 217.4 ms (Link to these results)

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