A0A087YAC9_POEFO Loading...

Gap junction epsilon-1 protein

AlphaFold DB , UniProt , Accession A0A087YAC9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 205 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	52.5	Low	63.8	Low	205 Å²	205	113.4 Å²	113.4	100%	1.01	55%	0.549	S	S	*	.				0	113.1	0	-157.5	164.5	-172.3	0	0	106.7
2	S	62.3	Low	63.4	Low	71 Å²	71	104.8 Å²	104.8	50%	0.497	51%	0.513	S	S	.	.			trans	-70.2	137.9	-165.5	174	0	0	0	0	112.1	N4 Y5 I6	S2-N4 PolarHBondContact O-N 3.43Å; S2-N4 VanDerWaalsContact O-N 3.11Å; S2-N4 PolarHBondContact OG-N 2.96Å; S2-Y5 WeakPolarHBondContact O-CA 3.46Å; S2-Y5 VanDerWaalsContact O-CB 3.28Å; S2-Y5 WeakPolarHBondContact O-CB 3.46Å; S2-Y5 PolarHBondContact O-N 3.45Å; S2-I6 PolarHBondContact O-N 3.49Å
3	L	69.3	Low	63.2	Low	141 Å²	141	99.8 Å²	99.8	74%	0.738	49%	0.494	S	S	*	.	H	α-helix	trans	-52.6	-31.1	175.4	-162.9	78.7	0	0	0	112.2	Y5 I6 K7	L3-Y5 VanDerWaalsContact C-N 3.31Å; L3-Y5 PolarHBondContact O-N 3.26Å; L3-I6 PolarHBondContact O-N 3.31Å; L3-K7 WeakPolarHBondContact O-CB 3.33Å; L3-K7 PolarHBondContact O-N 3.36Å
4	N	68.1	Low	62.9	Low	106 Å²	106	96.4 Å²	96.4	57%	0.567	48%	0.478	S	S	*	.	H	α-helix	trans	-67.1	-31.4	175.9	-67.8	-15.1	0	0	0	112.5	S2 K7 N8	S2-N4 PolarHBondContact O-N 3.43Å; S2-N4 VanDerWaalsContact O-N 3.11Å; S2-N4 PolarHBondContact OG-N 2.96Å; N4-K7 PolarHBondContact O-N 3.38Å; N4-N8 WeakPolarHBondContact O-CB 3.2Å; N4-N8 PolarHBondContact O-N 2.97Å; N4-N8 PolarHBondContact O-OD1 3.39Å
5	Y	65.3	Low	63.1	Low	112 Å²	112	99.3 Å²	99.3	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-70.5	-40.3	176	-156.6	-93.1	0	0	0	111.1	S2 L3 K7 F9	S2-Y5 WeakPolarHBondContact O-CA 3.46Å; S2-Y5 VanDerWaalsContact O-CB 3.28Å; S2-Y5 WeakPolarHBondContact O-CB 3.46Å; S2-Y5 PolarHBondContact O-N 3.45Å; L3-Y5 VanDerWaalsContact C-N 3.31Å; L3-Y5 PolarHBondContact O-N 3.26Å; Y5-K7 VanDerWaalsContact C-N 3.35Å; Y5-F9 WeakPolarHBondContact O-CB 3.42Å; Y5-F9 PolarHBondContact O-N 3.06Å
6	I	67.6	Low	63.3	Low	95 Å²	95	93.6 Å²	93.6	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-39.9	175.3	-61.7	173.6	0	0	0	110.4	S2 L3 F9 Y10	S2-I6 PolarHBondContact O-N 3.49Å; L3-I6 PolarHBondContact O-N 3.31Å; I6-F9 PolarHBondContact O-N 3.49Å; I6-Y10 WeakPolarHBondContact O-CB 3.35Å; I6-Y10 PolarHBondContact O-N 3.45Å
7	K	66.4	Low	63.4	Low	122 Å²	122	89.9 Å²	89.9	53%	0.53	44%	0.44	S	S	.	.	H	α-helix	trans	-64.7	-46.8	177.3	-162.2	-177.9	178.8	-168.8	0	111.9	L3 N4 Y5 F9 Y10 E11	L3-K7 WeakPolarHBondContact O-CB 3.33Å; L3-K7 PolarHBondContact O-N 3.36Å; N4-K7 PolarHBondContact O-N 3.38Å; Y5-K7 VanDerWaalsContact C-N 3.35Å; K7-F9 VanDerWaalsContact C-N 3.31Å; K7-F9 PolarHBondContact O-N 3.41Å; K7-Y10 PolarHBondContact O-N 3.46Å; K7-E11 WeakPolarHBondContact CE-OE1 3.19Å; K7-E11 WeakPolarHBondContact O-CB 3.37Å; K7-E11 WeakPolarHBondContact O-CG 3.3Å; K7-E11 PolarHBondContact O-N 3.16Å
8	N	61.2	Low	64.2	Low	91 Å²	91	85.1 Å²	85.1	49%	0.487	42%	0.417	S	S	.	.	H	α-helix	trans	-64.4	-37.2	176.2	-66.7	0	0	0	0	111.8	N4 G12	N4-N8 WeakPolarHBondContact O-CB 3.2Å; N4-N8 PolarHBondContact O-N 2.97Å; N4-N8 PolarHBondContact O-OD1 3.39Å; N8-G12 PolarHBondContact O-N 3.33Å
9	F	63.2	Low	65	Low	90 Å²	90	85.8 Å²	85.8	40%	0.395	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-42	174	-174.7	-93.7	0	0	0	112.3	Y5 I6 K7 C13 L93 A96	Y5-F9 WeakPolarHBondContact O-CB 3.42Å; Y5-F9 PolarHBondContact O-N 3.06Å; I6-F9 PolarHBondContact O-N 3.49Å; K7-F9 VanDerWaalsContact C-N 3.31Å; K7-F9 PolarHBondContact O-N 3.41Å; F9-C13 VanDerWaalsContact O-CB 3.24Å; F9-C13 WeakPolarHBondContact O-CB 3.32Å; F9-C13 PolarHBondContact O-N 3.2Å; F9-C13 VanDerWaalsContact O-N 3.12Å; F9-L93 HydrophobicContact CE2-CD1 3.64Å; F9-L93 HydrophobicContact CZ-CD1 4.16Å; F9-A96 HydrophobicContact CD2-CB 4.29Å
10	Y	63.4	Low	65.8	Low	140 Å²	140	83.9 Å²	83.9	55%	0.549	42%	0.417	S	S	.	.	H	α-helix	trans	-67.8	-42.8	177.1	-163.9	-85.2	0	0	0	111.6	I6 K7 C13 L14	I6-Y10 WeakPolarHBondContact O-CB 3.35Å; I6-Y10 PolarHBondContact O-N 3.45Å; K7-Y10 PolarHBondContact O-N 3.46Å; Y10-C13 PolarHBondContact O-N 2.93Å; Y10-L14 HydrophobicContact CD1-CB 4.31Å; Y10-L14 HydrophobicContact CD1-CD1 4.08Å; Y10-L14 HydrophobicContact CD2-CD1 3.51Å; Y10-L14 HydrophobicContact CE1-CB 4.11Å; Y10-L14 HydrophobicContact CE1-CD1 4.1Å; Y10-L14 HydrophobicContact CE1-CD2 4.13Å; Y10-L14 HydrophobicContact CE1-CG 4.34Å; Y10-L14 HydrophobicContact CE2-CD1 3.52Å; Y10-L14 HydrophobicContact CE2-CD2 3.98Å; Y10-L14 HydrophobicContact CE2-CG 4.31Å; Y10-L14 HydrophobicContact CG-CD1 3.79Å; Y10-L14 WeakPolarHBondContact O-CB 3.5Å; Y10-L14 PolarHBondContact O-N 3.5Å
11	E	62.3	Low	66.3	Low	74 Å²	74	79.9 Å²	79.9	35%	0.346	40%	0.397	S	S	.	.	H	α-helix	trans	-65.1	-39.7	176	-75.4	174.1	177.1	0	0	111.8	K7 R15	K7-E11 WeakPolarHBondContact CE-OE1 3.19Å; K7-E11 WeakPolarHBondContact O-CB 3.37Å; K7-E11 WeakPolarHBondContact O-CG 3.3Å; K7-E11 PolarHBondContact O-N 3.16Å; E11-R15 WeakPolarHBondContact O-CB 3.38Å; E11-R15 PolarHBondContact O-N 2.96Å
12	G	59.3	Low	67.6	Low	11 Å²	11	73.3 Å²	73.3	11%	0.113	36%	0.364	C	S	.	.	H	α-helix	trans	-73	-26.3	178.2	0	0	0	0	0	115.3	N8 H92	N8-G12 PolarHBondContact O-N 3.33Å; G12-H92 PolarHBondContact O-ND1 3.02Å
13	C	60.3	Low	68.4	Low	40 Å²	40	74.8 Å²	74.8	27%	0.27	36%	0.362	S	S	.	.	H	α-helix	trans	-102.9	-33.6	-174.3	-160.1	0	0	0	0	114	F9 Y10	F9-C13 VanDerWaalsContact O-CB 3.24Å; F9-C13 WeakPolarHBondContact O-CB 3.32Å; F9-C13 PolarHBondContact O-N 3.2Å; F9-C13 VanDerWaalsContact O-N 3.12Å; Y10-C13 PolarHBondContact O-N 2.93Å
14	L	59.3	Low	69.1	Low	51 Å²	51	68.9 Å²	68.9	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-101.7	-11	179.9	-75	100.5	0	0	0	114.7	Y10 P16 L26	Y10-L14 HydrophobicContact CD1-CB 4.31Å; Y10-L14 HydrophobicContact CD1-CD1 4.08Å; Y10-L14 HydrophobicContact CD2-CD1 3.51Å; Y10-L14 HydrophobicContact CE1-CB 4.11Å; Y10-L14 HydrophobicContact CE1-CD1 4.1Å; Y10-L14 HydrophobicContact CE1-CD2 4.13Å; Y10-L14 HydrophobicContact CE1-CG 4.34Å; Y10-L14 HydrophobicContact CE2-CD1 3.52Å; Y10-L14 HydrophobicContact CE2-CD2 3.98Å; Y10-L14 HydrophobicContact CE2-CG 4.31Å; Y10-L14 HydrophobicContact CG-CD1 3.79Å; Y10-L14 WeakPolarHBondContact O-CB 3.5Å; Y10-L14 PolarHBondContact O-N 3.5Å; L14-P16 WeakPolarHBondContact O-CD 3.28Å; L14-L26 HydrophobicContact CB-CD2 4.48Å; L14-L26 HydrophobicContact CD2-CD2 3.85Å
15	R	65.8	Low	69.4	Low	141 Å²	141	66.2 Å²	66.2	53%	0.532	32%	0.318	S	S	.	.	S	Bend	trans	-117.1	83.6	172.8	-69.7	-173.4	178.6	166.7	-1	110.4	E11	E11-R15 WeakPolarHBondContact O-CB 3.38Å; E11-R15 PolarHBondContact O-N 2.96Å
16	P	66.9	Low	70.1	Confident	8 Å²	8	63.9 Å²	63.9	5%	0.052	31%	0.313	C	S	.	.			trans	-57.8	158.3	168.1	25.9	-34.2	0	0	0	110.9	L14 T18 Q22	L14-P16 WeakPolarHBondContact O-CD 3.28Å; P16-T18 PolarHBondContact O-N 2.96Å; P16-T18 VanDerWaalsContact O-N 3.1Å; P16-Q22 HydrophobicContact CG-CB 4.2Å; P16-Q22 VanDerWaalsContact CG-N 3.27Å
17	P	64.4	Low	71	Confident	31 Å²	31	64.6 Å²	64.6	20%	0.201	31%	0.312	C	S	.	.	S	Bend	trans	-70.1	-11.9	-170.7	27.7	-32.1	0	0	0	113.1	Q102 R197	P17-Q102 HydrophobicContact CB-CB 4.36Å; P17-R197 PolarHBondContact O-NH1 3.36Å; P17-R197 VanDerWaalsContact O-NH1 3.15Å
18	T	78.7	Confident	71.8	Confident	3 Å²	3	60 Å²	60	2%	0.018	29%	0.292	C	S	.	.	S	Bend	trans	-104.3	140.2	-179.8	57.3	0	0	0	0	111	P16 I20 G21 Q22 E190 E193 I194	P16-T18 PolarHBondContact O-N 2.96Å; P16-T18 VanDerWaalsContact O-N 3.1Å; T18-I20 PolarHBondContact O-N 3.37Å; T18-G21 PolarHBondContact O-N 3.31Å; T18-G21 WeakPolarHBondContact OG1-CA 3.47Å; T18-G21 PolarHBondContact OG1-N 2.9Å; T18-Q22 PolarHBondContact O-N 2.99Å; T18-Q22 VanDerWaalsContact O-N 3.11Å; T18-E190 HydrophobicContact CG2-CG 4.34Å; T18-E190 PolarHBondContact OG1-OE1 3.15Å; T18-E190 VanDerWaalsContact OG1-OE1 3.05Å; T18-E193 WeakPolarHBondContact CB-OE2 3Å; T18-I194 HydrophobicContact CG2-CD1 3.91Å; T18-I194 HydrophobicContact CG2-CG1 3.57Å
19	V	78.6	Confident	73	Confident	99 Å²	99	56.6 Å²	56.6	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-63.5	-36.7	174.7	179.2	0	0	0	0	109.6	Q22 F23	V19-Q22 PolarHBondContact O-N 2.9Å; V19-F23 PolarHBondContact O-N 3.29Å
20	I	81.8	Confident	74	Confident	46 Å²	46	56 Å²	56	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-43.7	177.3	-62.1	174.4	0	0	0	111.1	T18 Q22 F23 H24 L186 A189 E190 E193	T18-I20 PolarHBondContact O-N 3.37Å; I20-Q22 VanDerWaalsContact C-N 3.29Å; I20-Q22 PolarHBondContact O-N 3.39Å; I20-F23 PolarHBondContact O-N 3.35Å; I20-H24 WeakPolarHBondContact O-CB 3.37Å; I20-H24 PolarHBondContact O-N 3.45Å; I20-L186 HydrophobicContact CG2-CD2 4.21Å; I20-L186 WeakPolarHBondContact CG2-O 3.21Å; I20-A189 HydrophobicContact CD1-CB 3.91Å; I20-A189 HydrophobicContact CG2-CB 4.27Å; I20-E190 HydrophobicContact CB-CB 4.49Å; I20-E190 HydrophobicContact CG2-CB 4.06Å; I20-E193 HydrophobicContact CD1-CB 4.11Å; I20-E193 VanDerWaalsContact CD1-OE2 3.28Å; I20-E193 WeakPolarHBondContact CD1-OE2 2.99Å; I20-E193 WeakPolarHBondContact CG1-OE2 3.42Å
21	G	76	Confident	75.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-36.6	177.3	0	0	0	0	0	112.3	T18 T25	T18-G21 PolarHBondContact O-N 3.31Å; T18-G21 WeakPolarHBondContact OG1-CA 3.47Å; T18-G21 PolarHBondContact OG1-N 2.9Å; G21-T25 WeakPolarHBondContact O-CB 3.37Å; G21-T25 PolarHBondContact O-N 3.43Å; G21-T25 PolarHBondContact O-OG1 3.24Å
22	Q	78.6	Confident	76.6	Confident	67 Å²	67	48 Å²	48	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-68.8	-43.7	178	-173.7	-179.6	3	0	0	110.6	P16 T18 V19 I20 L26	P16-Q22 HydrophobicContact CG-CB 4.2Å; P16-Q22 VanDerWaalsContact CG-N 3.27Å; T18-Q22 PolarHBondContact O-N 2.99Å; T18-Q22 VanDerWaalsContact O-N 3.11Å; V19-Q22 PolarHBondContact O-N 2.9Å; I20-Q22 VanDerWaalsContact C-N 3.29Å; I20-Q22 PolarHBondContact O-N 3.39Å; Q22-L26 HydrophobicContact CG-CD1 3.63Å; Q22-L26 HydrophobicContact CG-CG 4.33Å; Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.48Å; Q22-L26 WeakPolarHBondContact O-CG 3.37Å; Q22-L26 PolarHBondContact O-N 3.12Å
23	F	80.8	Confident	78	Confident	103 Å²	103	52.7 Å²	52.7	45%	0.452	28%	0.276	S	S	.	.	I	π-helix	trans	-63.1	-44.7	175.2	-174	-114.8	0	0	0	111.8	V19 I20 F27 F28 L186	V19-F23 PolarHBondContact O-N 3.29Å; I20-F23 PolarHBondContact O-N 3.35Å; F23-F27 HydrophobicContact CD2-CB 3.97Å; F23-F27 HydrophobicContact CD2-CG 4.38Å; F23-F27 HydrophobicContact CE2-CB 3.96Å; F23-F27 AromaticContact CE2-CD1 3.8Å; F23-F27 HydrophobicContact CE2-CD1 3.8Å; F23-F27 HydrophobicContact CE2-CE1 4.46Å; F23-F27 AromaticContact CE2-CG 3.86Å; F23-F27 HydrophobicContact CE2-CG 3.86Å; F23-F27 AromaticContact CZ-CD1 3.77Å; F23-F27 HydrophobicContact CZ-CD1 3.77Å; F23-F27 HydrophobicContact CZ-CE1 4.21Å; F23-F27 HydrophobicContact CZ-CG 4.32Å; F23-F27 VanDerWaalsContact O-CB 3.27Å; F23-F27 WeakPolarHBondContact O-CB 3.36Å; F23-F27 PolarHBondContact O-N 2.95Å; F23-F28 HydrophobicContact CD1-CD2 4.27Å; F23-F28 HydrophobicContact CD1-CE2 4.12Å; F23-F28 HydrophobicContact CE1-CD2 4.03Å; F23-F28 AromaticContact CE1-CE2 3.46Å; F23-F28 HydrophobicContact CE1-CE2 3.46Å; F23-F28 VanDerWaalsContact CE1-CE2 3.46Å; F23-F28 AromaticContact CZ-CE2 3.92Å; F23-F28 HydrophobicContact CZ-CE2 3.92Å; F23-F28 PolarHBondContact O-N 3.29Å; F23-L186 HydrophobicContact CD1-CD2 4.3Å
24	H	82.8	Confident	79.5	Confident	16 Å²	16	55.9 Å²	55.9	7%	0.074	29%	0.285	C	S	.	.	I	π-helix	trans	-59	-51.6	176	175.9	-85	0	0	0	111.9	I20 F28 G29 R122 T183 L186	I20-H24 WeakPolarHBondContact O-CB 3.37Å; I20-H24 PolarHBondContact O-N 3.45Å; H24-F28 WeakPolarHBondContact O-CB 3.27Å; H24-F28 PolarHBondContact O-N 3.15Å; H24-G29 PolarHBondContact O-N 3.04Å; H24-G29 VanDerWaalsContact O-N 3.16Å; H24-R122 PolarHBondContact CE1-NH2 3.47Å; H24-R122 PolarHBondContact ND1-NH2 3.29Å; H24-T183 WeakPolarHBondContact NE2-CB 3.23Å; H24-L186 HydrophobicContact CB-CB 4.36Å; H24-L186 HydrophobicContact CB-CD1 4.27Å
25	T	75.1	Confident	81	Confident	50 Å²	50	55.6 Å²	55.6	31%	0.307	28%	0.282	S	S	.	.	I	π-helix	trans	-74.4	-41.2	-171.7	-51.7	0	0	0	0	112.2	G21	G21-T25 WeakPolarHBondContact O-CB 3.37Å; G21-T25 PolarHBondContact O-N 3.43Å; G21-T25 PolarHBondContact O-OG1 3.24Å
26	L	80.4	Confident	82.2	Confident	64 Å²	64	49.9 Å²	49.9	34%	0.335	26%	0.262	S	S	.	.	I	π-helix	trans	-82.8	-54.8	-177.8	-63.3	178.1	0	0	0	112.1	L14 Q22 S30	L14-L26 HydrophobicContact CB-CD2 4.48Å; L14-L26 HydrophobicContact CD2-CD2 3.85Å; Q22-L26 HydrophobicContact CG-CD1 3.63Å; Q22-L26 HydrophobicContact CG-CG 4.33Å; Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.48Å; Q22-L26 WeakPolarHBondContact O-CG 3.37Å; Q22-L26 PolarHBondContact O-N 3.12Å; L26-S30 WeakPolarHBondContact O-CB 3.28Å; L26-S30 PolarHBondContact O-N 3.27Å; L26-S30 PolarHBondContact O-OG 3.31Å
27	F	84.8	Confident	83.3	Confident	110 Å²	110	51.8 Å²	51.8	48%	0.482	28%	0.283	S	S	.	.	I	π-helix	trans	-76.8	-58.3	-172.2	-179.5	-99.7	0	0	0	111.6	F23 G29 S30 V31	F23-F27 HydrophobicContact CD2-CB 3.97Å; F23-F27 HydrophobicContact CD2-CG 4.38Å; F23-F27 HydrophobicContact CE2-CB 3.96Å; F23-F27 AromaticContact CE2-CD1 3.8Å; F23-F27 HydrophobicContact CE2-CD1 3.8Å; F23-F27 HydrophobicContact CE2-CE1 4.46Å; F23-F27 AromaticContact CE2-CG 3.86Å; F23-F27 HydrophobicContact CE2-CG 3.86Å; F23-F27 AromaticContact CZ-CD1 3.77Å; F23-F27 HydrophobicContact CZ-CD1 3.77Å; F23-F27 HydrophobicContact CZ-CE1 4.21Å; F23-F27 HydrophobicContact CZ-CG 4.32Å; F23-F27 VanDerWaalsContact O-CB 3.27Å; F23-F27 WeakPolarHBondContact O-CB 3.36Å; F23-F27 PolarHBondContact O-N 2.95Å; F27-G29 PolarHBondContact O-N 3.39Å; F27-S30 PolarHBondContact O-N 2.65Å; F27-V31 HydrophobicContact CE1-CG2 4.49Å; F27-V31 HydrophobicContact CE2-CG2 4.49Å; F27-V31 HydrophobicContact CZ-CG2 4.35Å; F27-V31 WeakPolarHBondContact O-CG2 3.49Å; F27-V31 PolarHBondContact O-N 3.1Å
28	F	85.1	Confident	84.7	Confident	25 Å²	25	54.2 Å²	54.2	11%	0.11	30%	0.297	C	S	.	.	I	π-helix	trans	-68.4	-36.7	-178	-83.8	-86.1	0	0	0	112.7	F23 H24 R32 F179 I182 L186	F23-F28 HydrophobicContact CD1-CD2 4.27Å; F23-F28 HydrophobicContact CD1-CE2 4.12Å; F23-F28 HydrophobicContact CE1-CD2 4.03Å; F23-F28 AromaticContact CE1-CE2 3.46Å; F23-F28 HydrophobicContact CE1-CE2 3.46Å; F23-F28 VanDerWaalsContact CE1-CE2 3.46Å; F23-F28 AromaticContact CZ-CE2 3.92Å; F23-F28 HydrophobicContact CZ-CE2 3.92Å; F23-F28 PolarHBondContact O-N 3.29Å; H24-F28 WeakPolarHBondContact O-CB 3.27Å; H24-F28 PolarHBondContact O-N 3.15Å; F28-R32 WeakPolarHBondContact O-CB 3.47Å; F28-R32 PolarHBondContact O-N 3.37Å; F28-F179 AromaticContact CD1-CD1 3.99Å; F28-F179 HydrophobicContact CD1-CD1 3.99Å; F28-F179 HydrophobicContact CD1-CE1 4.35Å; F28-F179 HydrophobicContact CE1-CD1 4.12Å; F28-F179 HydrophobicContact CE1-CE1 4.32Å; F28-I182 HydrophobicContact CD1-CG2 4.14Å; F28-I182 HydrophobicContact CE1-CB 4.11Å; F28-I182 HydrophobicContact CE1-CD1 4.18Å; F28-I182 HydrophobicContact CE1-CG2 3.41Å; F28-I182 VanDerWaalsContact CE1-CG2 3.41Å; F28-I182 HydrophobicContact CE2-CG2 4.12Å; F28-I182 HydrophobicContact CZ-CG2 3.41Å; F28-I182 VanDerWaalsContact CZ-CG2 3.41Å; F28-L186 HydrophobicContact CD2-CD1 3.43Å; F28-L186 VanDerWaalsContact CD2-CD1 3.43Å; F28-L186 HydrophobicContact CE2-CD1 3.61Å; F28-L186 HydrophobicContact CG-CD1 4.01Å; F28-L186 HydrophobicContact CZ-CD1 4.31Å
29	G	84.4	Confident	85.3	Confident	19 Å²	19	56.9 Å²	56.9	20%	0.196	31%	0.311	C	S	.	.	H	α-helix	trans	-58.3	-46.1	171.8	0	0	0	0	0	112.6	H24 F27 R32 M33	H24-G29 PolarHBondContact O-N 3.04Å; H24-G29 VanDerWaalsContact O-N 3.16Å; F27-G29 PolarHBondContact O-N 3.39Å; G29-R32 PolarHBondContact O-N 2.99Å; G29-M33 WeakPolarHBondContact O-CG 3.45Å; G29-M33 PolarHBondContact O-N 3.13Å
30	S	86.1	Confident	86	Confident	77 Å²	77	52.2 Å²	52.2	54%	0.538	28%	0.282	S	S	.	.	H	α-helix	trans	-67.9	-43.7	-179.4	-63.3	0	0	0	0	112.6	L26 F27 R32 M33 F34	L26-S30 WeakPolarHBondContact O-CB 3.28Å; L26-S30 PolarHBondContact O-N 3.27Å; L26-S30 PolarHBondContact O-OG 3.31Å; F27-S30 PolarHBondContact O-N 2.65Å; S30-R32 VanDerWaalsContact C-N 3.32Å; S30-R32 PolarHBondContact O-N 3.42Å; S30-M33 PolarHBondContact O-N 3.4Å; S30-F34 PolarHBondContact O-N 2.9Å
31	V	88.9	Confident	86.4	Confident	39 Å²	39	56.4 Å²	56.4	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-43.5	175.4	174.6	0	0	0	0	110.2	F27 M33 F34 F35 F179	F27-V31 HydrophobicContact CE1-CG2 4.49Å; F27-V31 HydrophobicContact CE2-CG2 4.49Å; F27-V31 HydrophobicContact CZ-CG2 4.35Å; F27-V31 WeakPolarHBondContact O-CG2 3.49Å; F27-V31 PolarHBondContact O-N 3.1Å; V31-M33 VanDerWaalsContact C-N 3.35Å; V31-M33 PolarHBondContact O-N 2.96Å; V31-F34 WeakPolarHBondContact O-CB 3.29Å; V31-F34 PolarHBondContact O-N 3.24Å; V31-F34 VanDerWaalsContact O-N 3.17Å; V31-F35 HydrophobicContact CG1-CD2 3.86Å; V31-F35 HydrophobicContact CG1-CE2 3.86Å; V31-F35 WeakPolarHBondContact O-CD2 3.43Å; V31-F35 PolarHBondContact O-N 3.02Å; V31-F179 HydrophobicContact CB-CE1 4.5Å; V31-F179 HydrophobicContact CG1-CE1 3.61Å; V31-F179 HydrophobicContact CG1-CE2 4.33Å; V31-F179 HydrophobicContact CG1-CZ 3.4Å
32	R	89.9	Confident	87.1	Confident	8 Å²	8	60 Å²	60	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-41.8	176.9	-173.9	169.2	178.5	156.4	9.4	112.2	F28 G29 S30 F34 F35 L36 Q80 E126 M176	F28-R32 WeakPolarHBondContact O-CB 3.47Å; F28-R32 PolarHBondContact O-N 3.37Å; G29-R32 PolarHBondContact O-N 2.99Å; S30-R32 VanDerWaalsContact C-N 3.32Å; S30-R32 PolarHBondContact O-N 3.42Å; R32-F34 VanDerWaalsContact C-N 3.35Å; R32-F34 PolarHBondContact O-N 3.21Å; R32-F35 PolarHBondContact O-N 3.08Å; R32-L36 HydrophobicContact CG-CD1 4.23Å; R32-L36 VanDerWaalsContact O-CG 3.32Å; R32-L36 WeakPolarHBondContact O-CG 3.3Å; R32-L36 PolarHBondContact O-N 3.45Å; R32-Q80 VanDerWaalsContact NH2-CG 3.27Å; R32-E126 IonicContact NH1-OE1 3.63Å; R32-E126 PolarHBondContact NH1-OE1 2.86Å; R32-E126 VanDerWaalsContact NH1-OE1 3.16Å; R32-E126 IonicContact NH1-OE2 3.67Å; R32-M176 HydrophobicContact CG-CE 4.44Å
33	M	88.6	Confident	87.7	Confident	109 Å²	109	57.7 Å²	57.7	54%	0.537	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-40.7	174	-77.7	-59.9	-67.2	0	0	112.7	G29 S30 V31 L36 G37 L81	G29-M33 WeakPolarHBondContact O-CG 3.45Å; G29-M33 PolarHBondContact O-N 3.13Å; S30-M33 PolarHBondContact O-N 3.4Å; V31-M33 VanDerWaalsContact C-N 3.35Å; V31-M33 PolarHBondContact O-N 2.96Å; M33-L36 PolarHBondContact O-N 3.33Å; M33-G37 PolarHBondContact O-N 3.13Å; M33-L81 HydrophobicContact CG-CD2 4.05Å; M33-L81 HydrophobicContact SD-CD2 3.12Å; M33-L81 WeakPolarHBondContact SD-CD2 3.24Å
34	F	92.1	Very high	88.2	Confident	107 Å²	107	53.3 Å²	53.3	47%	0.469	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-46.6	174.9	173.6	-96.5	0	0	0	111.8	S30 V31 R32 L36 V38 L39	S30-F34 PolarHBondContact O-N 2.9Å; V31-F34 WeakPolarHBondContact O-CB 3.29Å; V31-F34 PolarHBondContact O-N 3.24Å; V31-F34 VanDerWaalsContact O-N 3.17Å; R32-F34 VanDerWaalsContact C-N 3.35Å; R32-F34 PolarHBondContact O-N 3.21Å; F34-L36 VanDerWaalsContact C-N 3.35Å; F34-L36 PolarHBondContact O-N 3.05Å; F34-V38 HydrophobicContact CD2-CB 4.22Å; F34-V38 HydrophobicContact CD2-CG2 3.87Å; F34-V38 HydrophobicContact CE2-CB 3.98Å; F34-V38 HydrophobicContact CE2-CG1 4.19Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CB 4.39Å; F34-V38 HydrophobicContact CZ-CG1 4.4Å; F34-V38 PolarHBondContact O-N 3.49Å; F34-L39 HydrophobicContact CD1-CD1 4.33Å; F34-L39 HydrophobicContact CE1-CD1 3.83Å; F34-L39 HydrophobicContact CE1-CG 3.94Å; F34-L39 HydrophobicContact CZ-CG 4.45Å
35	F	92	Very high	88.5	Confident	45 Å²	45	54 Å²	54	20%	0.197	31%	0.312	C	S	.	.	I	π-helix	trans	-60.4	-44.2	177	-90.7	-106.6	0	0	0	111.3	V31 R32 L39 G40 F172 A175 M176 F179	V31-F35 HydrophobicContact CG1-CD2 3.86Å; V31-F35 HydrophobicContact CG1-CE2 3.86Å; V31-F35 WeakPolarHBondContact O-CD2 3.43Å; V31-F35 PolarHBondContact O-N 3.02Å; R32-F35 PolarHBondContact O-N 3.08Å; F35-L39 HydrophobicContact CD1-CD1 3.78Å; F35-L39 HydrophobicContact CD2-CD1 4.2Å; F35-L39 HydrophobicContact CE1-CD1 3.78Å; F35-L39 HydrophobicContact CE2-CD1 4.21Å; F35-L39 HydrophobicContact CG-CD1 4Å; F35-L39 HydrophobicContact CZ-CD1 4Å; F35-L39 CarbonylContact O-C 3.56Å; F35-L39 WeakPolarHBondContact O-CB 3.27Å; F35-L39 PolarHBondContact O-N 3.05Å; F35-G40 PolarHBondContact O-N 3.4Å; F35-F172 HydrophobicContact CB-CE2 4.44Å; F35-F172 HydrophobicContact CB-CZ 4.29Å; F35-F172 HydrophobicContact CD1-CD2 4.48Å; F35-F172 AromaticContact CD1-CE2 3.94Å; F35-F172 HydrophobicContact CD1-CE2 3.94Å; F35-F172 HydrophobicContact CD1-CZ 4.35Å; F35-F172 WeakPolarHBondContact O-CE2 3.29Å; F35-F172 VanDerWaalsContact O-CZ 3.28Å; F35-F172 WeakPolarHBondContact O-CZ 3.34Å; F35-A175 HydrophobicContact CE1-CB 3.99Å; F35-M176 HydrophobicContact CB-SD 4.16Å; F35-F179 AromaticContact CD1-CE2 3.96Å; F35-F179 HydrophobicContact CD1-CE2 3.96Å; F35-F179 AromaticContact CD2-CE2 3.87Å; F35-F179 HydrophobicContact CD2-CE2 3.87Å; F35-F179 HydrophobicContact CD2-CZ 4.12Å; F35-F179 AromaticContact CE1-CE2 3.87Å; F35-F179 HydrophobicContact CE1-CE2 3.87Å; F35-F179 AromaticContact CE2-CE2 3.78Å; F35-F179 HydrophobicContact CE2-CE2 3.78Å; F35-F179 AromaticContact CE2-CZ 3.79Å; F35-F179 HydrophobicContact CE2-CZ 3.79Å; F35-F179 AromaticContact CG-CE2 3.96Å; F35-F179 HydrophobicContact CG-CE2 3.96Å; F35-F179 AromaticContact CZ-CE2 3.78Å; F35-F179 HydrophobicContact CZ-CE2 3.78Å; F35-F179 HydrophobicContact CZ-CZ 4.05Å
36	L	90.4	Very high	89.1	Confident	22 Å²	22	56.6 Å²	56.6	12%	0.115	32%	0.323	C	S	.	.	I	π-helix	trans	-71.6	-42	-179.5	-66.5	178.3	0	0	0	113.6	R32 M33 F34 W77 L81 M176	R32-L36 HydrophobicContact CG-CD1 4.23Å; R32-L36 VanDerWaalsContact O-CG 3.32Å; R32-L36 WeakPolarHBondContact O-CG 3.3Å; R32-L36 PolarHBondContact O-N 3.45Å; M33-L36 PolarHBondContact O-N 3.33Å; F34-L36 VanDerWaalsContact C-N 3.35Å; F34-L36 PolarHBondContact O-N 3.05Å; L36-W77 HydrophobicContact CD1-CB 4.08Å; L36-W77 HydrophobicContact CD2-CB 3.3Å; L36-W77 HydrophobicContact CD2-CD2 4.12Å; L36-W77 HydrophobicContact CD2-CE3 3.85Å; L36-W77 HydrophobicContact CD2-CG 3.97Å; L36-W77 HydrophobicContact CG-CB 4.32Å; L36-L81 HydrophobicContact CD1-CB 4.47Å; L36-L81 HydrophobicContact CD1-CD2 4.32Å; L36-M176 HydrophobicContact CD2-CE 3.75Å; L36-M176 HydrophobicContact CD2-SD 4.43Å; L36-M176 HydrophobicContact CG-CE 4.28Å
37	G	90.8	Very high	89.6	Confident	47 Å²	47	53.7 Å²	53.7	49%	0.485	31%	0.308	S	S	.	.	I	π-helix	trans	-75.5	-57.1	-176	0	0	0	0	0	112.7	M33 F41	M33-G37 PolarHBondContact O-N 3.13Å; G37-F41 VanDerWaalsContact O-CB 3.23Å; G37-F41 WeakPolarHBondContact O-CB 3.16Å
38	V	92.4	Very high	89.7	Confident	83 Å²	83	50.9 Å²	50.9	50%	0.503	31%	0.305	S	S	.	.	I	π-helix	trans	-85.6	-60.6	-171.5	-179.3	0	0	0	0	110.4	F34 A42	F34-V38 HydrophobicContact CD2-CB 4.22Å; F34-V38 HydrophobicContact CD2-CG2 3.87Å; F34-V38 HydrophobicContact CE2-CB 3.98Å; F34-V38 HydrophobicContact CE2-CG1 4.19Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CB 4.39Å; F34-V38 HydrophobicContact CZ-CG1 4.4Å; F34-V38 PolarHBondContact O-N 3.49Å; V38-A42 PolarHBondContact O-N 2.69Å; V38-A42 VanDerWaalsContact O-N 3.15Å
39	L	92.6	Very high	89.9	Confident	59 Å²	59	55.6 Å²	55.6	31%	0.309	33%	0.331	S	S	.	.	I	π-helix	trans	-72.7	-38.4	-172.9	-65.2	179.2	0	0	0	111.7	F34 F35 F41 A42 V43 F172	F34-L39 HydrophobicContact CD1-CD1 4.33Å; F34-L39 HydrophobicContact CE1-CD1 3.83Å; F34-L39 HydrophobicContact CE1-CG 3.94Å; F34-L39 HydrophobicContact CZ-CG 4.45Å; F35-L39 HydrophobicContact CD1-CD1 3.78Å; F35-L39 HydrophobicContact CD2-CD1 4.2Å; F35-L39 HydrophobicContact CE1-CD1 3.78Å; F35-L39 HydrophobicContact CE2-CD1 4.21Å; F35-L39 HydrophobicContact CG-CD1 4Å; F35-L39 HydrophobicContact CZ-CD1 4Å; F35-L39 CarbonylContact O-C 3.56Å; F35-L39 WeakPolarHBondContact O-CB 3.27Å; F35-L39 PolarHBondContact O-N 3.05Å; L39-F41 VanDerWaalsContact C-N 3.34Å; L39-F41 PolarHBondContact O-N 3.34Å; L39-A42 PolarHBondContact O-N 3.22Å; L39-V43 WeakPolarHBondContact O-CG2 3.28Å; L39-V43 PolarHBondContact O-N 3.02Å; L39-F172 HydrophobicContact CB-CD2 4.17Å; L39-F172 HydrophobicContact CB-CE2 3.53Å
40	G	91.7	Very high	90.1	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-44.9	177.5	0	0	0	0	0	111.1	F35 V43 Y44 Q74	F35-G40 PolarHBondContact O-N 3.4Å; G40-V43 PolarHBondContact O-N 3.4Å; G40-Y44 WeakPolarHBondContact O-CB 3.46Å; G40-Y44 PolarHBondContact O-N 3.23Å; G40-Q74 PolarHBondContact O-NE2 3.31Å
41	F	90	Very high	90.5	Very high	135 Å²	135	56.2 Å²	56.2	59%	0.592	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-41.2	176.3	-175.5	-96.2	0	0	0	112.2	G37 L39 V43 G45 Q74	G37-F41 VanDerWaalsContact O-CB 3.23Å; G37-F41 WeakPolarHBondContact O-CB 3.16Å; L39-F41 VanDerWaalsContact C-N 3.34Å; L39-F41 PolarHBondContact O-N 3.34Å; F41-V43 PolarHBondContact O-N 2.9Å; F41-G45 VanDerWaalsContact O-CA 3.28Å; F41-G45 WeakPolarHBondContact O-CA 3.48Å; F41-G45 PolarHBondContact O-N 2.85Å; F41-Q74 VanDerWaalsContact CA-NE2 3.27Å; F41-Q74 VanDerWaalsContact N-NE2 3.17Å
42	A	91.2	Very high	90.6	Very high	76 Å²	76	56.4 Å²	56.4	63%	0.628	32%	0.323	S	S	*	.	H	α-helix	trans	-61.4	-43.2	176.1	0	0	0	0	0	112.5	V38 L39	V38-A42 PolarHBondContact O-N 2.69Å; V38-A42 VanDerWaalsContact O-N 3.15Å; L39-A42 PolarHBondContact O-N 3.22Å
43	V	92.2	Very high	90.7	Very high	18 Å²	18	57.1 Å²	57.1	11%	0.109	33%	0.329	C	S	.	.	H	α-helix	trans	-83.1	-38.3	-173.3	173.8	0	0	0	0	113.3	L39 G40 F41 K169 F172	L39-V43 WeakPolarHBondContact O-CG2 3.28Å; L39-V43 PolarHBondContact O-N 3.02Å; G40-V43 PolarHBondContact O-N 3.4Å; F41-V43 PolarHBondContact O-N 2.9Å; V43-K169 HydrophobicContact CG1-CB 4.39Å; V43-K169 HydrophobicContact CG1-CG 3.57Å; V43-F172 HydrophobicContact CG1-CB 4.47Å; V43-F172 HydrophobicContact CG2-CD2 4.26Å
44	Y	91.4	Very high	90.7	Very high	10 Å²	10	54.1 Å²	54.1	4%	0.039	32%	0.315	C	S	.	.	H	α-helix	trans	-115	-11.9	-170.9	-67.8	-75.7	0	0	0	114.1	G40 N46 E47 P73 Q74 W77 K169 F172	G40-Y44 WeakPolarHBondContact O-CB 3.46Å; G40-Y44 PolarHBondContact O-N 3.23Å; Y44-N46 VanDerWaalsContact C-N 3.28Å; Y44-N46 PolarHBondContact O-N 3.43Å; Y44-E47 WeakPolarHBondContact CD1-OE2 3.34Å; Y44-E47 WeakPolarHBondContact O-CB 3.34Å; Y44-E47 PolarHBondContact O-N 3.28Å; Y44-P73 HydrophobicContact CD1-CG 4.13Å; Y44-P73 HydrophobicContact CE1-CB 4.2Å; Y44-P73 HydrophobicContact CE1-CG 3.68Å; Y44-P73 HydrophobicContact CE2-CB 4.24Å; Y44-Q74 VanDerWaalsContact CB-CD 3.45Å; Y44-Q74 VanDerWaalsContact CB-OE1 3.29Å; Y44-Q74 HydrophobicContact CD2-CG 4.02Å; Y44-Q74 HydrophobicContact CG-CG 4.13Å; Y44-W77 HydrophobicContact CD2-CZ3 4.29Å; Y44-W77 AromaticContact CE2-CH2 3.96Å; Y44-W77 HydrophobicContact CE2-CH2 3.96Å; Y44-W77 AromaticContact CE2-CZ3 3.74Å; Y44-W77 HydrophobicContact CE2-CZ3 3.74Å; Y44-K169 HydrophobicContact CD1-CG 4.44Å; Y44-K169 HydrophobicContact CE1-CB 4.24Å; Y44-K169 HydrophobicContact CE1-CD 4.01Å; Y44-K169 HydrophobicContact CE1-CG 3.79Å; Y44-K169 PolarHBondContact OH-O 3.34Å; Y44-F172 AromaticContact CE2-CD1 3.69Å; Y44-F172 HydrophobicContact CE2-CD1 3.69Å; Y44-F172 HydrophobicContact CE2-CE1 4.2Å; Y44-F172 HydrophobicContact CE2-CG 4.17Å
45	G	88.1	Confident	90.5	Very high	32 Å²	32	54.2 Å²	54.2	33%	0.33	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.5	-172.1	0	0	0	0	0	114.6	F41	F41-G45 VanDerWaalsContact O-CA 3.28Å; F41-G45 WeakPolarHBondContact O-CA 3.48Å; F41-G45 PolarHBondContact O-N 2.85Å
46	N	88.8	Confident	90.3	Very high	103 Å²	103	59.2 Å²	59.2	55%	0.551	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	13.8	-178.9	-63.4	-35.1	0	0	0	113.3	Y44 A48 L49 H50	Y44-N46 VanDerWaalsContact C-N 3.28Å; Y44-N46 PolarHBondContact O-N 3.43Å; N46-A48 VanDerWaalsContact C-N 3.32Å; N46-A48 PolarHBondContact O-N 3.42Å; N46-L49 WeakPolarHBondContact O-CB 3.34Å; N46-L49 PolarHBondContact O-N 3.43Å; N46-L49 VanDerWaalsContact O-N 3.08Å; N46-H50 PolarHBondContact O-N 3.31Å
47	E	89.5	Confident	90.2	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.019	37%	0.373	C	S	.	.	H	α-helix	trans	-56.9	-43.9	-172.4	177.1	172.3	-139.7	0	0	112.6	Y44 L49 H50 F51 Y65 K169	Y44-E47 WeakPolarHBondContact CD1-OE2 3.34Å; Y44-E47 WeakPolarHBondContact O-CB 3.34Å; Y44-E47 PolarHBondContact O-N 3.28Å; E47-L49 PolarHBondContact O-N 2.89Å; E47-H50 PolarHBondContact O-N 3.31Å; E47-F51 PolarHBondContact O-N 3.15Å; E47-F51 VanDerWaalsContact O-N 3.11Å; E47-Y65 HydrophobicContact CG-CE2 3.8Å; E47-K169 VanDerWaalsContact CD-NZ 3.33Å; E47-K169 VanDerWaalsContact CG-NZ 3.34Å; E47-K169 VanDerWaalsContact OE1-CE 3.32Å; E47-K169 WeakPolarHBondContact OE1-CE 3.32Å; E47-K169 IonicContact OE1-NZ 3.16Å; E47-K169 PolarHBondContact OE1-NZ 2.85Å
48	A	88.1	Confident	90.1	Very high	51 Å²	51	71.5 Å²	71.5	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-27.3	-178.5	0	0	0	0	0	113.4	N46 Y65	N46-A48 VanDerWaalsContact C-N 3.32Å; N46-A48 PolarHBondContact O-N 3.42Å; A48-Y65 HydrophobicContact CB-CD1 3.9Å; A48-Y65 HydrophobicContact CB-CE1 3.56Å; A48-Y65 HydrophobicContact CB-CE2 4.34Å; A48-Y65 HydrophobicContact CB-CG 4.39Å
49	L	88.4	Confident	90	Very high	123 Å²	123	74.7 Å²	74.7	64%	0.644	40%	0.395	S	S	*	.	H	α-helix	trans	-77	-35.6	180	-175.8	68	0	0	0	111.7	N46 E47	N46-L49 WeakPolarHBondContact O-CB 3.34Å; N46-L49 PolarHBondContact O-N 3.43Å; N46-L49 VanDerWaalsContact O-N 3.08Å; E47-L49 PolarHBondContact O-N 2.89Å
50	H	89.9	Confident	89.8	Confident	107 Å²	107	72.2 Å²	72.2	50%	0.495	38%	0.382	S	S	.	.	H	α-helix	trans	-92.5	-6.5	-176.2	-69.4	-172.3	0	0	0	112.8	N46 E47 S52 P164	N46-H50 PolarHBondContact O-N 3.31Å; E47-H50 PolarHBondContact O-N 3.31Å; H50-S52 PolarHBondContact O-N 3.05Å; H50-P164 HydrophobicContact CB-CB 3.86Å; H50-P164 HydrophobicContact CB-CG 3.65Å
51	F	92.8	Very high	89.8	Confident	3 Å²	3	73.1 Å²	73.1	1%	0.013	39%	0.387	C	S	.	.			trans	-73.6	120.9	172.4	-175	-91.1	0	0	0	110.4	E47 C64 Y65 F68 Y145 C161 V163	E47-F51 PolarHBondContact O-N 3.15Å; E47-F51 VanDerWaalsContact O-N 3.11Å; F51-C64 HydrophobicContact CE1-CB 3.94Å; F51-C64 HydrophobicContact CZ-CB 4.41Å; F51-Y65 HydrophobicContact CB-CD2 3.97Å; F51-Y65 HydrophobicContact CD1-CD2 4.25Å; F51-Y65 HydrophobicContact CD1-CG 4.49Å; F51-Y65 HydrophobicContact CD2-CD2 4.1Å; F51-Y65 AromaticContact CG-CD2 3.85Å; F51-Y65 HydrophobicContact CG-CD2 3.85Å; F51-F68 HydrophobicContact CD2-CD1 4.45Å; F51-F68 AromaticContact CE2-CD1 3.99Å; F51-F68 HydrophobicContact CE2-CD1 3.99Å; F51-F68 HydrophobicContact CE2-CG 4.4Å; F51-Y145 HydrophobicContact CZ-CD1 4.18Å; F51-C161 HydrophobicContact CE1-CB 3.71Å; F51-C161 HydrophobicContact CE2-CB 3.93Å; F51-C161 HydrophobicContact CZ-CB 3.3Å; F51-V163 HydrophobicContact CD2-CG2 4.35Å; F51-V163 HydrophobicContact CE2-CG2 4.03Å
52	S	92.8	Very high	89.9	Confident	42 Å²	42	71 Å²	71	29%	0.294	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-138.6	125.4	-174.3	-171.1	0	0	0	0	112.1	H50 C161 M162	H50-S52 PolarHBondContact O-N 3.05Å; S52-C161 WeakPolarHBondContact O-CA 3.45Å; S52-M162 PolarHBondContact O-N 3.2Å
53	C	90.7	Very high	89.9	Confident	24 Å²	24	70.5 Å²	70.5	16%	0.162	37%	0.365	C	S	.	.	S	Bend	trans	-102	-43.3	167.6	-43.3	0	0	0	0	110	L60 N61 T159 C161	C53-L60 HydrophobicContact CB-CD2 4.37Å; C53-N61 WeakPolarHBondContact CA-OD1 3.45Å; C53-N61 WeakPolarHBondContact CB-OD1 3.28Å; C53-N61 PolarHBondContact N-OD1 3.31Å; C53-T159 HydrophobicContact CB-CG2 4.08Å; C53-C161 HydrophobicContact CB-CB 3.94Å; C53-C161 WeakPolarHBondContact CB-SG 3.32Å; C53-C161 WeakPolarHBondContact SG-CB 3.48Å; C53-C161 CovalentContact SG-SG 2.02Å; C53-C161 PolarHBondContact SG-SG 3.5Å
54	D	89.3	Confident	89.9	Confident	46 Å²	46	69.7 Å²	69.7	25%	0.246	36%	0.36	C	S	.	.			trans	-140	122	174.8	-178.7	-21.5	0	0	0	108.6	D56 R57 L60 N61	D54-D56 PolarHBondContact O-N 2.93Å; D54-D56 PolarHBondContact OD1-N 3.22Å; D54-R57 HydrophobicContact CB-CB 4.15Å; D54-R57 HydrophobicContact CB-CG 4.47Å; D54-R57 PolarHBondContact O-N 3.2Å; D54-R57 WeakPolarHBondContact OD2-CD 3.46Å; D54-R57 IonicContact OD2-NE 2.75Å; D54-L60 HydrophobicContact CB-CD2 4.22Å; D54-N61 PolarHBondContact N-OD1 3.18Å; D54-N61 VanDerWaalsContact N-OD1 3.1Å; D54-N61 PolarHBondContact O-ND2 3.11Å; D54-N61 PolarHBondContact O-OD1 3.12Å
55	P	86.9	Confident	90	Very high	108 Å²	108	70 Å²	70	70%	0.701	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-27.3	-176.3	25.4	-34.5	0	0	0	114
56	D	88.8	Confident	90.2	Very high	151 Å²	151	72.7 Å²	72.7	81%	0.807	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-12.4	-176	-65.7	-40.6	0	0	0	112.7	D54	D54-D56 PolarHBondContact O-N 2.93Å; D54-D56 PolarHBondContact OD1-N 3.22Å
57	R	87.3	Confident	90.4	Very high	130 Å²	130	71.9 Å²	71.9	49%	0.491	36%	0.361	S	S	.	.			trans	-118.5	84.9	-170.9	-63	-171.3	176.6	-165.8	3.5	113.1	D54 E59 L60 N61 E153	D54-R57 HydrophobicContact CB-CB 4.15Å; D54-R57 HydrophobicContact CB-CG 4.47Å; D54-R57 PolarHBondContact O-N 3.2Å; D54-R57 WeakPolarHBondContact OD2-CD 3.46Å; D54-R57 IonicContact OD2-NE 2.75Å; R57-E59 PolarHBondContact O-N 3.5Å; R57-L60 HydrophobicContact CB-CB 4.11Å; R57-L60 PolarHBondContact O-N 2.91Å; R57-N61 PolarHBondContact O-N 3.46Å; R57-N61 PolarHBondContact O-ND2 3.43Å; R57-E153 IonicContact CZ-OE2 2.76Å; R57-E153 IonicContact NH1-OE2 3.73Å; R57-E153 PolarHBondContact NH1-OE2 3.01Å
58	R	89.9	Confident	90.5	Very high	197 Å²	197	72.9 Å²	72.9	74%	0.743	37%	0.365	S	S	*	.	H	α-helix	trans	-61	-39	179.3	-167.6	174.8	-175.6	168.6	1.7	114.3	L60 N61 L62	R58-L60 VanDerWaalsContact C-N 3.33Å; R58-L60 PolarHBondContact O-N 2.98Å; R58-N61 PolarHBondContact O-N 2.84Å; R58-L62 PolarHBondContact O-N 3.3Å
59	E	89.7	Confident	90.6	Very high	149 Å²	149	71.6 Å²	71.6	70%	0.696	35%	0.349	S	S	*	.	H	α-helix	trans	-59.7	-42.9	179.7	-62.7	-67.5	139.5	0	0	111.8	R57 L62 F63	R57-E59 PolarHBondContact O-N 3.5Å; E59-L62 PolarHBondContact O-N 3.02Å; E59-F63 WeakPolarHBondContact O-CB 3.39Å; E59-F63 PolarHBondContact O-N 3.41Å
60	L	89.5	Confident	90.7	Very high	7 Å²	7	70.5 Å²	70.5	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-65.1	-46.4	177.7	177.8	65.8	0	0	0	111.3	C53 D54 R57 R58 L62 F63 C64 A149 L152	C53-L60 HydrophobicContact CB-CD2 4.37Å; D54-L60 HydrophobicContact CB-CD2 4.22Å; R57-L60 HydrophobicContact CB-CB 4.11Å; R57-L60 PolarHBondContact O-N 2.91Å; R58-L60 VanDerWaalsContact C-N 3.33Å; R58-L60 PolarHBondContact O-N 2.98Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.39Å; L60-F63 PolarHBondContact O-N 3.33Å; L60-C64 WeakPolarHBondContact O-CB 3.43Å; L60-C64 PolarHBondContact O-N 3.36Å; L60-A149 HydrophobicContact CD1-CB 3.47Å; L60-A149 VanDerWaalsContact CD1-CB 3.47Å; L60-L152 HydrophobicContact CB-CD2 4.19Å; L60-L152 HydrophobicContact CD1-CD2 4Å
61	N	90.9	Very high	90.9	Very high	19 Å²	19	69 Å²	69	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-42.6	179.7	-63.6	-20.3	0	0	0	111.1	C53 D54 R57 R58 Y65	C53-N61 WeakPolarHBondContact CA-OD1 3.45Å; C53-N61 WeakPolarHBondContact CB-OD1 3.28Å; C53-N61 PolarHBondContact N-OD1 3.31Å; D54-N61 PolarHBondContact N-OD1 3.18Å; D54-N61 VanDerWaalsContact N-OD1 3.1Å; D54-N61 PolarHBondContact O-ND2 3.11Å; D54-N61 PolarHBondContact O-OD1 3.12Å; R57-N61 PolarHBondContact O-N 3.46Å; R57-N61 PolarHBondContact O-ND2 3.43Å; R58-N61 PolarHBondContact O-N 2.84Å; N61-Y65 WeakPolarHBondContact O-CB 3.44Å; N61-Y65 PolarHBondContact O-N 3.11Å
62	L	91.5	Very high	90.8	Very high	90 Å²	90	70.6 Å²	70.6	47%	0.471	36%	0.355	S	S	.	.	H	α-helix	trans	-67.9	-41.7	178.1	-173.1	64.5	0	0	0	112.1	R58 E59 L60 Y65 N66	R58-L62 PolarHBondContact O-N 3.3Å; E59-L62 PolarHBondContact O-N 3.02Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.39Å; L62-Y65 PolarHBondContact O-N 2.82Å; L62-N66 VanDerWaalsContact O-CG 3.3Å; L62-N66 PolarHBondContact O-N 3.01Å; L62-N66 PolarHBondContact O-ND2 3.24Å
63	F	91.6	Very high	90.8	Very high	67 Å²	67	68.7 Å²	68.7	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-51.5	175.8	178.6	-92.6	0	0	0	111.5	E59 L60 Y65 N66 Q67 S151 L152	E59-F63 WeakPolarHBondContact O-CB 3.39Å; E59-F63 PolarHBondContact O-N 3.41Å; L60-F63 PolarHBondContact O-N 3.33Å; F63-Y65 VanDerWaalsContact C-N 3.33Å; F63-Y65 PolarHBondContact O-N 2.93Å; F63-N66 PolarHBondContact O-N 3.28Å; F63-Q67 PolarHBondContact O-N 3.45Å; F63-Q67 VanDerWaalsContact O-N 3.13Å; F63-S151 WeakPolarHBondContact CZ-OG 3.41Å; F63-L152 HydrophobicContact CB-CD2 4.03Å; F63-L152 HydrophobicContact CG-CD2 4.28Å
64	C	92.3	Very high	90.8	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-35.1	179.6	-73	0	0	0	0	112.8	F51 L60 Q67 F68 C147	F51-C64 HydrophobicContact CE1-CB 3.94Å; F51-C64 HydrophobicContact CZ-CB 4.41Å; L60-C64 WeakPolarHBondContact O-CB 3.43Å; L60-C64 PolarHBondContact O-N 3.36Å; C64-Q67 PolarHBondContact O-N 2.96Å; C64-F68 WeakPolarHBondContact O-CB 3.47Å; C64-F68 PolarHBondContact O-N 2.93Å; C64-C147 WeakPolarHBondContact CA-SG 3.27Å; C64-C147 HydrophobicContact CB-CB 3.66Å; C64-C147 WeakPolarHBondContact CB-SG 3.24Å; C64-C147 WeakPolarHBondContact SG-CB 3.42Å; C64-C147 CovalentContact SG-SG 2.03Å; C64-C147 PolarHBondContact SG-SG 3.5Å
65	Y	93.1	Very high	91	Very high	16 Å²	16	71 Å²	71	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-45.3	174.1	179.3	-101.8	0	0	0	111.8	E47 A48 F51 N61 L62 F63 Q67 F68 R69	E47-Y65 HydrophobicContact CG-CE2 3.8Å; A48-Y65 HydrophobicContact CB-CD1 3.9Å; A48-Y65 HydrophobicContact CB-CE1 3.56Å; A48-Y65 HydrophobicContact CB-CE2 4.34Å; A48-Y65 HydrophobicContact CB-CG 4.39Å; F51-Y65 HydrophobicContact CB-CD2 3.97Å; F51-Y65 HydrophobicContact CD1-CD2 4.25Å; F51-Y65 HydrophobicContact CD1-CG 4.49Å; F51-Y65 HydrophobicContact CD2-CD2 4.1Å; F51-Y65 AromaticContact CG-CD2 3.85Å; F51-Y65 HydrophobicContact CG-CD2 3.85Å; N61-Y65 WeakPolarHBondContact O-CB 3.44Å; N61-Y65 PolarHBondContact O-N 3.11Å; L62-Y65 PolarHBondContact O-N 2.82Å; F63-Y65 VanDerWaalsContact C-N 3.33Å; F63-Y65 PolarHBondContact O-N 2.93Å; Y65-Q67 PolarHBondContact O-N 3.09Å; Y65-F68 HydrophobicContact CD2-CD1 4.41Å; Y65-F68 PolarHBondContact O-N 3.45Å; Y65-F68 VanDerWaalsContact O-N 3.13Å; Y65-R69 HydrophobicContact CE2-CB 4.41Å; Y65-R69 PolarHBondContact O-N 3.16Å
66	N	92.4	Very high	91.4	Very high	89 Å²	89	66.6 Å²	66.6	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-32.2	177.1	-73	-25.6	0	0	0	112.3	L62 F63 R69 P70	L62-N66 VanDerWaalsContact O-CG 3.3Å; L62-N66 PolarHBondContact O-N 3.01Å; L62-N66 PolarHBondContact O-ND2 3.24Å; F63-N66 PolarHBondContact O-N 3.28Å; N66-R69 CarbonylContact O-C 3.51Å; N66-P70 WeakPolarHBondContact O-CA 3.33Å
67	Q	92.4	Very high	91.7	Very high	87 Å²	87	59.4 Å²	59.4	41%	0.407	29%	0.285	S	S	.	.	H	α-helix	trans	-72.1	-39.6	173	-168.6	-179.6	-12.1	0	0	112.2	F63 C64 Y65 D148	F63-Q67 PolarHBondContact O-N 3.45Å; F63-Q67 VanDerWaalsContact O-N 3.13Å; C64-Q67 PolarHBondContact O-N 2.96Å; Y65-Q67 PolarHBondContact O-N 3.09Å; Q67-D148 PolarHBondContact OE1-O 3.44Å
68	F	91.8	Very high	92	Very high	24 Å²	24	55.4 Å²	55.4	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-67.8	-39.5	177.3	171.9	-122.5	0	0	0	113	F51 C64 Y65 Y145 V163	F51-F68 HydrophobicContact CD2-CD1 4.45Å; F51-F68 AromaticContact CE2-CD1 3.99Å; F51-F68 HydrophobicContact CE2-CD1 3.99Å; F51-F68 HydrophobicContact CE2-CG 4.4Å; C64-F68 WeakPolarHBondContact O-CB 3.47Å; C64-F68 PolarHBondContact O-N 2.93Å; Y65-F68 HydrophobicContact CD2-CD1 4.41Å; Y65-F68 PolarHBondContact O-N 3.45Å; Y65-F68 VanDerWaalsContact O-N 3.13Å; F68-Y145 HydrophobicContact CB-CD1 3.83Å; F68-Y145 HydrophobicContact CB-CD2 4.25Å; F68-Y145 HydrophobicContact CB-CE1 3.7Å; F68-Y145 HydrophobicContact CB-CE2 4.14Å; F68-Y145 HydrophobicContact CB-CG 4.08Å; F68-Y145 HydrophobicContact CD2-CD1 4.26Å; F68-Y145 AromaticContact CD2-CD2 3.3Å; F68-Y145 HydrophobicContact CD2-CD2 3.3Å; F68-Y145 AromaticContact CD2-CE2 3.67Å; F68-Y145 HydrophobicContact CD2-CE2 3.67Å; F68-Y145 AromaticContact CD2-CG 3.62Å; F68-Y145 HydrophobicContact CD2-CG 3.62Å; F68-Y145 AromaticContact CE2-CD2 3.97Å; F68-Y145 HydrophobicContact CE2-CD2 3.97Å; F68-Y145 HydrophobicContact CE2-CG 4.33Å; F68-Y145 HydrophobicContact CG-CD1 4.27Å; F68-Y145 HydrophobicContact CG-CD2 4.11Å; F68-Y145 HydrophobicContact CG-CE2 4.36Å; F68-Y145 HydrophobicContact CG-CG 4.03Å; F68-V163 HydrophobicContact CE1-CG1 4.25Å; F68-V163 HydrophobicContact CE1-CG2 4.12Å; F68-V163 HydrophobicContact CE2-CG2 4.48Å; F68-V163 HydrophobicContact CZ-CG1 4.23Å; F68-V163 HydrophobicContact CZ-CG2 3.93Å
69	R	91	Very high	92.2	Very high	24 Å²	24	51.2 Å²	51.2	9%	0.091	27%	0.271	C	S	.	.			trans	-139.8	79.3	-175.8	-69.6	-68.5	-177	-98.6	6.2	110.6	Y65 N66 I71	Y65-R69 HydrophobicContact CE2-CB 4.41Å; Y65-R69 PolarHBondContact O-N 3.16Å; N66-R69 CarbonylContact O-C 3.51Å; R69-I71 PolarHBondContact O-N 3.06Å
70	P	90.8	Very high	92.5	Very high	100 Å²	100	44.4 Å²	44.4	65%	0.649	24%	0.239	S	C	*	.	S	Bend	trans	-64.3	-29	175.2	25.7	-34.4	0	0	0	112.4	N66	N66-P70 WeakPolarHBondContact O-CA 3.33Å
71	I	92.8	Very high	92.6	Very high	76 Å²	76	45 Å²	45	39%	0.39	24%	0.243	S	C	.	.	S	Bend	trans	-126.2	131.2	170.5	-60.8	174.3	0	0	0	107.2	R69 V75 F76 F137	R69-I71 PolarHBondContact O-N 3.06Å; I71-V75 HydrophobicContact CG2-CB 4.36Å; I71-V75 HydrophobicContact CG2-CG1 4.31Å; I71-F76 HydrophobicContact CG2-CB 4.13Å; I71-F137 WeakPolarHBondContact O-CE1 3.33Å
72	T	91.9	Very high	92.6	Very high	37 Å²	37	48.5 Å²	48.5	23%	0.227	26%	0.264	C	S	.	.			trans	-75.2	146.5	176.2	62.5	0	0	0	0	110.7	Q74 V75 F76	T72-Q74 PolarHBondContact O-N 3.15Å; T72-V75 PolarHBondContact O-N 3.35Å; T72-V75 VanDerWaalsContact O-N 3.13Å; T72-V75 VanDerWaalsContact OG1-CG2 3.28Å; T72-V75 WeakPolarHBondContact OG1-CG2 3.41Å; T72-F76 PolarHBondContact O-N 2.88Å
73	P	92.4	Very high	92.7	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-54.9	-39.2	179.1	-27.6	35.8	0	0	0	113.5	Y44 V75 F76 W77 F137	Y44-P73 HydrophobicContact CD1-CG 4.13Å; Y44-P73 HydrophobicContact CE1-CB 4.2Å; Y44-P73 HydrophobicContact CE1-CG 3.68Å; Y44-P73 HydrophobicContact CE2-CB 4.24Å; P73-V75 PolarHBondContact O-N 3.47Å; P73-F76 WeakPolarHBondContact O-CB 3.48Å; P73-F76 PolarHBondContact O-N 2.86Å; P73-W77 HydrophobicContact CB-CD2 4.47Å; P73-W77 HydrophobicContact CB-CE3 3.9Å; P73-W77 HydrophobicContact CB-CH2 3.37Å; P73-W77 HydrophobicContact CB-CZ2 4.03Å; P73-W77 HydrophobicContact CB-CZ3 3.27Å; P73-W77 PolarHBondContact O-N 3.17Å; P73-F137 HydrophobicContact CB-CE1 4.27Å; P73-F137 HydrophobicContact CB-CZ 4.27Å; P73-F137 HydrophobicContact CG-CD1 3.85Å; P73-F137 HydrophobicContact CG-CE1 3.69Å; P73-F137 HydrophobicContact CG-CG 4.47Å; P73-F137 HydrophobicContact CG-CZ 4.19Å
74	Q	91	Very high	92.7	Very high	43 Å²	43	43.4 Å²	43.4	20%	0.201	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-46.9	176.8	-64.9	175.7	-72	0	0	113	G40 F41 Y44 T72 W77 A78	G40-Q74 PolarHBondContact O-NE2 3.31Å; F41-Q74 VanDerWaalsContact CA-NE2 3.27Å; F41-Q74 VanDerWaalsContact N-NE2 3.17Å; Y44-Q74 VanDerWaalsContact CB-CD 3.45Å; Y44-Q74 VanDerWaalsContact CB-OE1 3.29Å; Y44-Q74 HydrophobicContact CD2-CG 4.02Å; Y44-Q74 HydrophobicContact CG-CG 4.13Å; T72-Q74 PolarHBondContact O-N 3.15Å; Q74-W77 PolarHBondContact O-N 3.43Å; Q74-A78 WeakPolarHBondContact O-CB 3.4Å; Q74-A78 PolarHBondContact O-N 2.82Å
75	V	93.4	Very high	92.6	Very high	76 Å²	76	47.7 Å²	47.7	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-66	-43.8	179.3	171.6	0	0	0	0	109.9	I71 T72 P73 W77 A78 L79	I71-V75 HydrophobicContact CG2-CB 4.36Å; I71-V75 HydrophobicContact CG2-CG1 4.31Å; T72-V75 PolarHBondContact O-N 3.35Å; T72-V75 VanDerWaalsContact O-N 3.13Å; T72-V75 VanDerWaalsContact OG1-CG2 3.28Å; T72-V75 WeakPolarHBondContact OG1-CG2 3.41Å; P73-V75 PolarHBondContact O-N 3.47Å; V75-W77 PolarHBondContact O-N 3.49Å; V75-A78 PolarHBondContact O-N 3.4Å; V75-L79 HydrophobicContact CG1-CD1 4.01Å; V75-L79 HydrophobicContact CG1-CG 4.38Å; V75-L79 WeakPolarHBondContact O-CG 3.37Å; V75-L79 PolarHBondContact O-N 3.45Å
76	F	95.4	Very high	92.5	Very high	16 Å²	16	51 Å²	51	7%	0.07	29%	0.288	C	S	.	.	H	α-helix	trans	-54.9	-51.5	176.3	173.7	-91.5	0	0	0	111.8	I71 T72 P73 A78 L79 Q80 A129 L132 Q133 L136 F137	I71-F76 HydrophobicContact CG2-CB 4.13Å; T72-F76 PolarHBondContact O-N 2.88Å; P73-F76 WeakPolarHBondContact O-CB 3.48Å; P73-F76 PolarHBondContact O-N 2.86Å; F76-A78 VanDerWaalsContact C-N 3.34Å; F76-A78 PolarHBondContact O-N 3.04Å; F76-L79 PolarHBondContact O-N 2.97Å; F76-Q80 WeakPolarHBondContact O-CB 3.34Å; F76-Q80 PolarHBondContact O-N 2.52Å; F76-A129 HydrophobicContact CZ-CB 4.21Å; F76-A129 WeakPolarHBondContact CZ-O 3.4Å; F76-L132 HydrophobicContact CE2-CB 4.1Å; F76-L132 HydrophobicContact CE2-CD2 3.75Å; F76-L132 HydrophobicContact CE2-CG 3.77Å; F76-L132 HydrophobicContact CZ-CB 4.31Å; F76-L132 HydrophobicContact CZ-CG 4.46Å; F76-Q133 HydrophobicContact CE1-CB 3.74Å; F76-Q133 HydrophobicContact CE1-CG 4.03Å; F76-Q133 HydrophobicContact CZ-CB 3.93Å; F76-L136 HydrophobicContact CD2-CD1 4.26Å; F76-L136 HydrophobicContact CE2-CD1 4.42Å; F76-F137 HydrophobicContact CB-CE2 3.94Å; F76-F137 HydrophobicContact CB-CZ 3.79Å; F76-F137 AromaticContact CD1-CE2 3.75Å; F76-F137 HydrophobicContact CD1-CE2 3.75Å; F76-F137 HydrophobicContact CD1-CZ 4.48Å; F76-F137 HydrophobicContact CD2-CE2 4.2Å; F76-F137 HydrophobicContact CE1-CE2 4.36Å; F76-F137 AromaticContact CG-CE2 3.67Å; F76-F137 HydrophobicContact CG-CE2 3.67Å; F76-F137 HydrophobicContact CG-CZ 4.01Å
77	W	94.9	Very high	92.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.1	-28.7	-178.2	-65.3	-51.1	0	0	0	113.7	L36 Y44 P73 Q74 V75 Q80 L81 F172 L173 M176	L36-W77 HydrophobicContact CD1-CB 4.08Å; L36-W77 HydrophobicContact CD2-CB 3.3Å; L36-W77 HydrophobicContact CD2-CD2 4.12Å; L36-W77 HydrophobicContact CD2-CE3 3.85Å; L36-W77 HydrophobicContact CD2-CG 3.97Å; L36-W77 HydrophobicContact CG-CB 4.32Å; Y44-W77 HydrophobicContact CD2-CZ3 4.29Å; Y44-W77 AromaticContact CE2-CH2 3.96Å; Y44-W77 HydrophobicContact CE2-CH2 3.96Å; Y44-W77 AromaticContact CE2-CZ3 3.74Å; Y44-W77 HydrophobicContact CE2-CZ3 3.74Å; P73-W77 HydrophobicContact CB-CD2 4.47Å; P73-W77 HydrophobicContact CB-CE3 3.9Å; P73-W77 HydrophobicContact CB-CH2 3.37Å; P73-W77 HydrophobicContact CB-CZ2 4.03Å; P73-W77 HydrophobicContact CB-CZ3 3.27Å; P73-W77 PolarHBondContact O-N 3.17Å; Q74-W77 PolarHBondContact O-N 3.43Å; V75-W77 PolarHBondContact O-N 3.49Å; W77-Q80 PolarHBondContact O-N 2.81Å; W77-L81 WeakPolarHBondContact O-CB 3.28Å; W77-L81 PolarHBondContact O-N 3.05Å; W77-F172 AromaticContact CE3-CE1 3.81Å; W77-F172 HydrophobicContact CE3-CE1 3.81Å; W77-F172 AromaticContact CH2-CD1 3.54Å; W77-F172 HydrophobicContact CH2-CD1 3.54Å; W77-F172 AromaticContact CH2-CE1 3.61Å; W77-F172 HydrophobicContact CH2-CE1 3.61Å; W77-F172 HydrophobicContact CZ2-CD1 4.48Å; W77-F172 HydrophobicContact CZ2-CE1 4.47Å; W77-F172 AromaticContact CZ3-CD1 3.6Å; W77-F172 HydrophobicContact CZ3-CD1 3.6Å; W77-F172 AromaticContact CZ3-CE1 3.22Å; W77-F172 HydrophobicContact CZ3-CE1 3.22Å; W77-F172 HydrophobicContact CZ3-CZ 4.38Å; W77-L173 HydrophobicContact CH2-CD1 4.24Å; W77-L173 HydrophobicContact CZ2-CD1 3.69Å; W77-M176 HydrophobicContact CB-CE 4.02Å; W77-M176 HydrophobicContact CD2-CB 4.44Å; W77-M176 HydrophobicContact CD2-CE 3.9Å; W77-M176 HydrophobicContact CD2-CG 4.06Å; W77-M176 HydrophobicContact CE3-CG 4.33Å; W77-M176 HydrophobicContact CG-CE 3.65Å; W77-M176 HydrophobicContact CH2-CB 4.49Å; W77-M176 HydrophobicContact CH2-CG 4.06Å; W77-M176 HydrophobicContact CZ2-CB 3.7Å; W77-M176 HydrophobicContact CZ2-CG 3.71Å; W77-M176 HydrophobicContact CZ3-CG 4.37Å
78	A	93.8	Very high	92.2	Very high	45 Å²	45	43.9 Å²	43.9	37%	0.372	26%	0.256	S	S	.	.	H	α-helix	trans	-64.9	-45.5	171.3	0	0	0	0	0	110.9	Q74 V75 F76 Q80 L81 V82	Q74-A78 WeakPolarHBondContact O-CB 3.4Å; Q74-A78 PolarHBondContact O-N 2.82Å; V75-A78 PolarHBondContact O-N 3.4Å; F76-A78 VanDerWaalsContact C-N 3.34Å; F76-A78 PolarHBondContact O-N 3.04Å; A78-Q80 VanDerWaalsContact C-N 3.35Å; A78-Q80 PolarHBondContact O-N 2.94Å; A78-L81 PolarHBondContact O-N 3.49Å; A78-V82 WeakPolarHBondContact O-CG2 3.47Å; A78-V82 PolarHBondContact O-N 2.65Å
79	L	94.3	Very high	92	Very high	110 Å²	110	45.1 Å²	45.1	58%	0.576	27%	0.27	S	S	*	.	H	α-helix	trans	-63	-41	174.9	-68.8	173.9	0	0	0	111.8	V75 F76 V82 S83	V75-L79 HydrophobicContact CG1-CD1 4.01Å; V75-L79 HydrophobicContact CG1-CG 4.38Å; V75-L79 WeakPolarHBondContact O-CG 3.37Å; V75-L79 PolarHBondContact O-N 3.45Å; F76-L79 PolarHBondContact O-N 2.97Å; L79-V82 PolarHBondContact O-N 2.99Å; L79-S83 WeakPolarHBondContact O-CB 3.33Å; L79-S83 PolarHBondContact O-N 3.01Å; L79-S83 PolarHBondContact O-OG 3.38Å
80	Q	94.9	Very high	91.9	Very high	6 Å²	6	52 Å²	52	3%	0.028	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-44.7	174.4	-177.4	-174.5	-5.1	0	0	111.5	R32 F76 W77 A78 S83 V84 E126 A129 T180	R32-Q80 VanDerWaalsContact NH2-CG 3.27Å; F76-Q80 WeakPolarHBondContact O-CB 3.34Å; F76-Q80 PolarHBondContact O-N 2.52Å; W77-Q80 PolarHBondContact O-N 2.81Å; A78-Q80 VanDerWaalsContact C-N 3.35Å; A78-Q80 PolarHBondContact O-N 2.94Å; Q80-S83 PolarHBondContact O-N 3.34Å; Q80-S83 PolarHBondContact O-OG 2.99Å; Q80-V84 HydrophobicContact CG-CG2 4.47Å; Q80-V84 WeakPolarHBondContact O-CB 3.4Å; Q80-V84 WeakPolarHBondContact O-CG2 3.39Å; Q80-V84 PolarHBondContact O-N 3.22Å; Q80-E126 PolarHBondContact NE2-OE2 3.18Å; Q80-A129 HydrophobicContact CB-CB 4.36Å; Q80-A129 VanDerWaalsContact CD-CB 3.42Å; Q80-A129 HydrophobicContact CG-CB 3.5Å; Q80-A129 VanDerWaalsContact CG-CB 3.5Å; Q80-T180 PolarHBondContact NE2-OG1 2.88Å
81	L	91.9	Very high	91.8	Very high	20 Å²	20	47.9 Å²	47.9	11%	0.105	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-47.9	178.7	178.5	67	0	0	0	111.3	M33 L36 W77 A78 S83 V84 L85	M33-L81 HydrophobicContact CG-CD2 4.05Å; M33-L81 HydrophobicContact SD-CD2 3.12Å; M33-L81 WeakPolarHBondContact SD-CD2 3.24Å; L36-L81 HydrophobicContact CD1-CB 4.47Å; L36-L81 HydrophobicContact CD1-CD2 4.32Å; W77-L81 WeakPolarHBondContact O-CB 3.28Å; W77-L81 PolarHBondContact O-N 3.05Å; A78-L81 PolarHBondContact O-N 3.49Å; L81-S83 PolarHBondContact O-N 3.35Å; L81-V84 PolarHBondContact O-N 2.96Å; L81-L85 HydrophobicContact CD1-CD1 4.02Å; L81-L85 HydrophobicContact CD1-CG 4.24Å; L81-L85 HydrophobicContact CG-CD1 3.99Å; L81-L85 VanDerWaalsContact O-CG 3.27Å; L81-L85 WeakPolarHBondContact O-CG 3.27Å; L81-L85 PolarHBondContact O-N 2.95Å; L81-L85 VanDerWaalsContact O-N 3.08Å
82	V	92	Very high	91.3	Very high	92 Å²	92	45 Å²	45	56%	0.558	25%	0.253	S	S	*	.	H	α-helix	trans	-60.8	-47.5	179.3	172.5	0	0	0	0	110.6	A78 L79 V84 L85 V86	A78-V82 WeakPolarHBondContact O-CG2 3.47Å; A78-V82 PolarHBondContact O-N 2.65Å; L79-V82 PolarHBondContact O-N 2.99Å; V82-V84 VanDerWaalsContact C-N 3.33Å; V82-V84 PolarHBondContact O-N 3.44Å; V82-L85 PolarHBondContact O-N 3.46Å; V82-V86 HydrophobicContact CG1-CG2 4.5Å; V82-V86 VanDerWaalsContact O-CG2 3.32Å; V82-V86 WeakPolarHBondContact O-CG2 3.48Å; V82-V86 PolarHBondContact O-N 3.33Å
83	S	93.4	Very high	91	Very high	44 Å²	44	46.3 Å²	46.3	31%	0.308	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-38.2	-178	68.5	0	0	0	0	112.6	L79 Q80 L81 P87 L125	L79-S83 WeakPolarHBondContact O-CB 3.33Å; L79-S83 PolarHBondContact O-N 3.01Å; L79-S83 PolarHBondContact O-OG 3.38Å; Q80-S83 PolarHBondContact O-N 3.34Å; Q80-S83 PolarHBondContact O-OG 2.99Å; L81-S83 PolarHBondContact O-N 3.35Å; S83-P87 WeakPolarHBondContact O-CD 3.49Å; S83-L125 WeakPolarHBondContact O-CD1 3.48Å
84	V	91.7	Very high	90.7	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-72.3	-29.2	178	172.8	0	0	0	0	112.3	Q80 L81 V82 R122 L125 E126	Q80-V84 HydrophobicContact CG-CG2 4.47Å; Q80-V84 WeakPolarHBondContact O-CB 3.4Å; Q80-V84 WeakPolarHBondContact O-CG2 3.39Å; Q80-V84 PolarHBondContact O-N 3.22Å; L81-V84 PolarHBondContact O-N 2.96Å; V82-V84 VanDerWaalsContact C-N 3.33Å; V82-V84 PolarHBondContact O-N 3.44Å; V84-R122 HydrophobicContact CG1-CB 4.47Å; V84-R122 HydrophobicContact CG1-CG 4.48Å; V84-R122 WeakPolarHBondContact O-CG 3.34Å; V84-L125 HydrophobicContact CG2-CB 4.21Å; V84-E126 HydrophobicContact CG1-CG 4.11Å; V84-E126 HydrophobicContact CG2-CG 3.74Å
85	L	88.5	Confident	90.4	Very high	89 Å²	89	48.9 Å²	48.9	47%	0.466	27%	0.267	S	S	.	.	H	α-helix	trans	-76.2	-29.6	177.4	-70.4	175.1	0	0	0	113	L81 V82 G88 A89	L81-L85 HydrophobicContact CD1-CD1 4.02Å; L81-L85 HydrophobicContact CD1-CG 4.24Å; L81-L85 HydrophobicContact CG-CD1 3.99Å; L81-L85 VanDerWaalsContact O-CG 3.27Å; L81-L85 WeakPolarHBondContact O-CG 3.27Å; L81-L85 PolarHBondContact O-N 2.95Å; L81-L85 VanDerWaalsContact O-N 3.08Å; V82-L85 PolarHBondContact O-N 3.46Å; L85-G88 PolarHBondContact O-N 3.44Å; L85-A89 VanDerWaalsContact O-CB 3.23Å; L85-A89 WeakPolarHBondContact O-CB 3.4Å; L85-A89 PolarHBondContact O-N 3.42Å
86	V	90.8	Very high	89.8	Confident	86 Å²	86	45.9 Å²	45.9	52%	0.521	25%	0.251	S	S	.	.	H	α-helix	trans	-57.7	-50	-173.1	164.8	0	0	0	0	114	V82 G88 A89 W90	V82-V86 HydrophobicContact CG1-CG2 4.5Å; V82-V86 VanDerWaalsContact O-CG2 3.32Å; V82-V86 WeakPolarHBondContact O-CG2 3.48Å; V82-V86 PolarHBondContact O-N 3.33Å; V86-G88 PolarHBondContact O-N 2.96Å; V86-A89 PolarHBondContact O-N 3.17Å; V86-W90 WeakPolarHBondContact O-CB 3.31Å; V86-W90 PolarHBondContact O-N 2.93Å
87	P	92.1	Very high	89.3	Confident	19 Å²	19	49 Å²	49	12%	0.123	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-42	-177.7	-23	32.1	0	0	0	113.1	S83 F91 L121 R122 L125	S83-P87 WeakPolarHBondContact O-CD 3.49Å; P87-F91 PolarHBondContact O-N 3.3Å; P87-F91 VanDerWaalsContact O-N 3.15Å; P87-L121 HydrophobicContact CB-CB 4.3Å; P87-L121 HydrophobicContact CG-CB 4.27Å; P87-R122 HydrophobicContact CB-CG 4.11Å; P87-R122 HydrophobicContact CG-CG 4.15Å; P87-L125 HydrophobicContact CG-CD1 4.02Å
88	G	87.4	Confident	88.7	Confident	8 Å²	8	55.4 Å²	55.4	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-48	177.5	0	0	0	0	0	111.4	L85 V86 W90 F91 H92	L85-G88 PolarHBondContact O-N 3.44Å; V86-G88 PolarHBondContact O-N 2.96Å; G88-W90 VanDerWaalsContact C-N 3.29Å; G88-W90 PolarHBondContact O-N 3.36Å; G88-F91 PolarHBondContact O-N 2.94Å; G88-H92 WeakPolarHBondContact O-CB 3.38Å; G88-H92 PolarHBondContact O-CD2 3.49Å; G88-H92 PolarHBondContact O-N 3.28Å
89	A	86.6	Confident	88.1	Confident	49 Å²	49	58.7 Å²	58.7	41%	0.405	31%	0.313	S	S	.	.	H	α-helix	trans	-59.4	-40.5	177.9	0	0	0	0	0	111.9	L85 V86 L93	L85-A89 VanDerWaalsContact O-CB 3.23Å; L85-A89 WeakPolarHBondContact O-CB 3.4Å; L85-A89 PolarHBondContact O-N 3.42Å; V86-A89 PolarHBondContact O-N 3.17Å; A89-L93 WeakPolarHBondContact O-CB 3.38Å; A89-L93 PolarHBondContact O-N 3.02Å
90	W	89.6	Confident	87.4	Confident	168 Å²	168	54.3 Å²	54.3	64%	0.636	29%	0.29	S	S	*	.	H	α-helix	trans	-62.1	-48.2	175.7	170.7	-122.7	0	0	0	112.1	V86 G88 L93 Y94	V86-W90 WeakPolarHBondContact O-CB 3.31Å; V86-W90 PolarHBondContact O-N 2.93Å; G88-W90 VanDerWaalsContact C-N 3.29Å; G88-W90 PolarHBondContact O-N 3.36Å; W90-L93 PolarHBondContact O-N 3.35Å; W90-Y94 WeakPolarHBondContact O-CB 3.1Å; W90-Y94 PolarHBondContact O-N 2.9Å
91	F	88.8	Confident	86.6	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.066	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-48.4	178	175.5	-85.2	0	0	0	111.6	P87 G88 L93 Y94 A95 I105 F114 Y115	P87-F91 PolarHBondContact O-N 3.3Å; P87-F91 VanDerWaalsContact O-N 3.15Å; G88-F91 PolarHBondContact O-N 2.94Å; F91-L93 PolarHBondContact O-N 3.42Å; F91-Y94 WeakPolarHBondContact O-CB 3.22Å; F91-Y94 PolarHBondContact O-N 2.96Å; F91-A95 PolarHBondContact O-N 2.96Å; F91-I105 HydrophobicContact CE1-CD1 3.97Å; F91-I105 HydrophobicContact CE1-CG2 4.36Å; F91-I105 HydrophobicContact CZ-CD1 4.2Å; F91-I105 HydrophobicContact CZ-CG1 4.37Å; F91-I105 HydrophobicContact CZ-CG2 3.86Å; F91-F114 HydrophobicContact CD2-CB 4.25Å; F91-F114 HydrophobicContact CE2-CB 4.03Å; F91-Y115 AromaticContact CD1-CD2 3.51Å; F91-Y115 HydrophobicContact CD1-CD2 3.51Å; F91-Y115 HydrophobicContact CD1-CE2 4.02Å; F91-Y115 HydrophobicContact CD2-CD2 4.46Å; F91-Y115 AromaticContact CE1-CD2 3.32Å; F91-Y115 HydrophobicContact CE1-CD2 3.32Å; F91-Y115 HydrophobicContact CE1-CE2 4Å; F91-Y115 HydrophobicContact CE1-CG 4.29Å; F91-Y115 HydrophobicContact CE2-CD2 4.28Å; F91-Y115 HydrophobicContact CG-CD2 4.11Å; F91-Y115 AromaticContact CZ-CD2 3.73Å; F91-Y115 HydrophobicContact CZ-CD2 3.73Å; F91-Y115 HydrophobicContact CZ-CG 4.28Å
92	H	82.9	Confident	85.7	Confident	14 Å²	14	62 Å²	62	7%	0.065	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-37.5	-179.2	-77.5	-69.3	0	0	0	112.4	G12 G88 A95 A96 Y115	G12-H92 PolarHBondContact O-ND1 3.02Å; G88-H92 WeakPolarHBondContact O-CB 3.38Å; G88-H92 PolarHBondContact O-CD2 3.49Å; G88-H92 PolarHBondContact O-N 3.28Å; H92-A95 PolarHBondContact O-N 3.43Å; H92-A96 WeakPolarHBondContact O-CB 3.46Å; H92-A96 PolarHBondContact O-N 3.04Å; H92-Y115 AromaticContact NE2-CE2 3.78Å
93	L	84.6	Confident	84.9	Confident	66 Å²	66	65.1 Å²	65.1	35%	0.346	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-42.1	173.4	-179.9	62	0	0	0	111.3	F9 A89 W90 F91 A96 C97	F9-L93 HydrophobicContact CE2-CD1 3.64Å; F9-L93 HydrophobicContact CZ-CD1 4.16Å; A89-L93 WeakPolarHBondContact O-CB 3.38Å; A89-L93 PolarHBondContact O-N 3.02Å; W90-L93 PolarHBondContact O-N 3.35Å; F91-L93 PolarHBondContact O-N 3.42Å; L93-A96 PolarHBondContact O-N 3.3Å; L93-C97 VanDerWaalsContact O-CB 3.32Å; L93-C97 WeakPolarHBondContact O-CB 3.38Å; L93-C97 PolarHBondContact O-N 2.91Å; L93-C97 PolarHBondContact O-SG 3.45Å; L93-C97 VanDerWaalsContact O-SG 3.34Å
94	Y	86.4	Confident	84.2	Confident	95 Å²	95	66.3 Å²	66.3	37%	0.373	34%	0.335	S	S	.	.	H	α-helix	trans	-60.2	-47.2	174.5	172.2	-93.6	0	0	0	111.3	W90 F91 A96 C97 K98 I100	W90-Y94 WeakPolarHBondContact O-CB 3.1Å; W90-Y94 PolarHBondContact O-N 2.9Å; F91-Y94 WeakPolarHBondContact O-CB 3.22Å; F91-Y94 PolarHBondContact O-N 2.96Å; Y94-A96 PolarHBondContact O-N 3.22Å; Y94-C97 PolarHBondContact O-N 2.95Å; Y94-K98 HydrophobicContact CE1-CG 4.43Å; Y94-K98 HydrophobicContact CE2-CG 4.17Å; Y94-K98 WeakPolarHBondContact O-CB 3.46Å; Y94-K98 WeakPolarHBondContact O-CG 3.46Å; Y94-K98 PolarHBondContact O-N 3.16Å; Y94-I100 HydrophobicContact CE1-CD1 4.14Å
95	A	84.7	Confident	83.7	Confident	2 Å²	2	66.3 Å²	66.3	2%	0.017	33%	0.334	C	S	.	.	H	α-helix	trans	-60.2	-45.1	176.7	0	0	0	0	0	111.7	F91 H92 K98 N99 I100	F91-A95 PolarHBondContact O-N 2.96Å; H92-A95 PolarHBondContact O-N 3.43Å; A95-K98 CarbonylContact O-C 3.49Å; A95-K98 PolarHBondContact O-N 3.42Å; A95-N99 PolarHBondContact O-N 2.97Å; A95-I100 HydrophobicContact CB-CB 4.27Å; A95-I100 PolarHBondContact O-N 3.06Å
96	A	81.9	Confident	83.3	Confident	14 Å²	14	63.3 Å²	63.3	12%	0.116	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-44.7	177	0	0	0	0	0	112.5	F9 H92 L93 Y94 K98 N99	F9-A96 HydrophobicContact CD2-CB 4.29Å; H92-A96 WeakPolarHBondContact O-CB 3.46Å; H92-A96 PolarHBondContact O-N 3.04Å; L93-A96 PolarHBondContact O-N 3.3Å; Y94-A96 PolarHBondContact O-N 3.22Å; A96-K98 PolarHBondContact O-N 3.43Å; A96-N99 PolarHBondContact O-N 3.31Å; A96-N99 PolarHBondContact O-OD1 3.26Å
97	C	83.1	Confident	82.9	Confident	82 Å²	82	65.6 Å²	65.6	55%	0.554	32%	0.323	S	S	*	.	H	α-helix	trans	-62.8	-28.1	176.6	-78.6	0	0	0	0	112.9	L93 Y94	L93-C97 VanDerWaalsContact O-CB 3.32Å; L93-C97 WeakPolarHBondContact O-CB 3.38Å; L93-C97 PolarHBondContact O-N 2.91Å; L93-C97 PolarHBondContact O-SG 3.45Å; L93-C97 VanDerWaalsContact O-SG 3.34Å; Y94-C97 PolarHBondContact O-N 2.95Å
98	K	84.3	Confident	82.6	Confident	134 Å²	134	71 Å²	71	58%	0.583	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.6	175.9	-69	-63.7	-173.2	-179.8	0	113.6	Y94 A95 A96 I100	Y94-K98 HydrophobicContact CE1-CG 4.43Å; Y94-K98 HydrophobicContact CE2-CG 4.17Å; Y94-K98 WeakPolarHBondContact O-CB 3.46Å; Y94-K98 WeakPolarHBondContact O-CG 3.46Å; Y94-K98 PolarHBondContact O-N 3.16Å; A95-K98 CarbonylContact O-C 3.49Å; A95-K98 PolarHBondContact O-N 3.42Å; A96-K98 PolarHBondContact O-N 3.43Å; K98-I100 HydrophobicContact CB-CD1 3.79Å; K98-I100 HydrophobicContact CB-CG1 3.73Å; K98-I100 PolarHBondContact O-N 2.9Å
99	N	79.6	Confident	82.5	Confident	114 Å²	114	73.9 Å²	73.9	61%	0.61	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.4	-172.8	-63.3	-44.5	0	0	0	112.8	A95 A96 E101	A95-N99 PolarHBondContact O-N 2.97Å; A96-N99 PolarHBondContact O-N 3.31Å; A96-N99 PolarHBondContact O-OD1 3.26Å; N99-E101 PolarHBondContact O-N 3.43Å
100	I	80.6	Confident	82.5	Confident	18 Å²	18	77 Å²	77	9%	0.092	37%	0.367	C	S	.	.			trans	-76.5	122.5	176.1	-63.7	172.1	0	0	0	108	Y94 A95 K98 E104 I105 Y111	Y94-I100 HydrophobicContact CE1-CD1 4.14Å; A95-I100 HydrophobicContact CB-CB 4.27Å; A95-I100 PolarHBondContact O-N 3.06Å; K98-I100 HydrophobicContact CB-CD1 3.79Å; K98-I100 HydrophobicContact CB-CG1 3.73Å; K98-I100 PolarHBondContact O-N 2.9Å; I100-E104 HydrophobicContact CG2-CB 4.13Å; I100-E104 HydrophobicContact CG2-CG 4.44Å; I100-I105 HydrophobicContact CG2-CG1 3.86Å; I100-Y111 HydrophobicContact CD1-CD1 4.23Å; I100-Y111 HydrophobicContact CD1-CE1 3.83Å; I100-Y111 HydrophobicContact CD1-CE2 4.39Å
101	E	76.8	Confident	82.5	Confident	142 Å²	142	72.1 Å²	72.1	66%	0.664	35%	0.349	S	S	*	.			trans	-70.6	147.2	175.5	-65.8	-176.8	142.2	0	0	110.7	N99 E103 E104 I105	N99-E101 PolarHBondContact O-N 3.43Å; E101-E103 PolarHBondContact O-N 2.94Å; E101-E103 VanDerWaalsContact O-N 3.17Å; E101-E104 WeakPolarHBondContact O-CB 3.46Å; E101-E104 PolarHBondContact O-N 3.23Å; E101-I105 PolarHBondContact O-N 3.16Å
102	Q	73.9	Confident	82.5	Confident	46 Å²	46	71.5 Å²	71.5	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-60.5	-29.6	-176.2	-66.9	-64.9	-43.7	0	0	112.8	P17 I105	P17-Q102 HydrophobicContact CB-CB 4.36Å; Q102-I105 WeakPolarHBondContact O-CB 3.48Å; Q102-I105 PolarHBondContact O-N 2.87Å
103	E	74.4	Confident	82.8	Confident	156 Å²	156	73.9 Å²	73.9	73%	0.729	36%	0.362	S	S	*	.	H	α-helix	trans	-69.1	-36.6	176.3	-62.5	-178.9	119.9	0	0	111.6	E101 I105 L106 E107	E101-E103 PolarHBondContact O-N 2.94Å; E101-E103 VanDerWaalsContact O-N 3.17Å; E103-I105 VanDerWaalsContact C-N 3.27Å; E103-I105 PolarHBondContact O-N 2.76Å; E103-L106 PolarHBondContact O-N 3.07Å; E103-L106 VanDerWaalsContact O-N 3.13Å; E103-E107 PolarHBondContact O-N 3.12Å; E103-E107 VanDerWaalsContact O-N 3.08Å
104	E	80.4	Confident	83.2	Confident	70 Å²	70	76.6 Å²	76.6	33%	0.327	37%	0.371	S	S	.	.	H	α-helix	trans	-66.4	-29	178.5	-170.1	175.4	83	0	0	112.2	I100 E101 L106 E107 R108 Y111	I100-E104 HydrophobicContact CG2-CB 4.13Å; I100-E104 HydrophobicContact CG2-CG 4.44Å; E101-E104 WeakPolarHBondContact O-CB 3.46Å; E101-E104 PolarHBondContact O-N 3.23Å; E104-L106 PolarHBondContact O-N 3.43Å; E104-E107 PolarHBondContact O-N 3.41Å; E104-R108 HydrophobicContact CG-CG 3.92Å; E104-R108 PolarHBondContact O-N 3.21Å; E104-Y111 HydrophobicContact CG-CD2 4.4Å; E104-Y111 HydrophobicContact CG-CE2 4.35Å
105	I	80.6	Confident	83.3	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-35.5	175.2	-59.9	170.9	0	0	0	111.2	F91 I100 E101 Q102 E103 T112	F91-I105 HydrophobicContact CE1-CD1 3.97Å; F91-I105 HydrophobicContact CE1-CG2 4.36Å; F91-I105 HydrophobicContact CZ-CD1 4.2Å; F91-I105 HydrophobicContact CZ-CG1 4.37Å; F91-I105 HydrophobicContact CZ-CG2 3.86Å; I100-I105 HydrophobicContact CG2-CG1 3.86Å; E101-I105 PolarHBondContact O-N 3.16Å; Q102-I105 WeakPolarHBondContact O-CB 3.48Å; Q102-I105 PolarHBondContact O-N 2.87Å; E103-I105 VanDerWaalsContact C-N 3.27Å; E103-I105 PolarHBondContact O-N 2.76Å; I105-T112 WeakPolarHBondContact O-CA 3.2Å; I105-T112 PolarHBondContact O-N 2.94Å; I105-T112 PolarHBondContact O-OG1 2.89Å
106	L	79.6	Confident	83.7	Confident	26 Å²	26	73.5 Å²	73.5	14%	0.136	36%	0.36	C	S	.	.	H	α-helix	trans	-89.4	-28.8	-178.3	-170.4	60.9	0	0	0	112.4	E103 E104 I194 R197 Y201	E103-L106 PolarHBondContact O-N 3.07Å; E103-L106 VanDerWaalsContact O-N 3.13Å; E104-L106 PolarHBondContact O-N 3.43Å; L106-I194 HydrophobicContact CD1-CG2 4.4Å; L106-R197 HydrophobicContact CD1-CB 4.25Å; L106-R197 HydrophobicContact CD2-CB 3.98Å; L106-Y201 HydrophobicContact CD2-CE2 3.76Å; L106-Y201 HydrophobicContact CG-CD2 4.47Å; L106-Y201 HydrophobicContact CG-CE2 4.06Å
107	E	82.6	Confident	84.2	Confident	133 Å²	133	76.6 Å²	76.6	62%	0.621	37%	0.374	S	S	*	.	H	α-helix	trans	-74.2	-41.7	177.8	-168.2	-179.7	99.3	0	0	112.4	E103 E104	E103-E107 PolarHBondContact O-N 3.12Å; E103-E107 VanDerWaalsContact O-N 3.08Å; E104-E107 PolarHBondContact O-N 3.41Å
108	R	85.3	Confident	84.7	Confident	133 Å²	133	73.1 Å²	73.1	50%	0.502	35%	0.351	S	S	.	.	S	Bend	trans	-93.1	122.5	-175.2	-63.5	-65.5	-171.6	168.7	-0.2	111.7	E104 I110 Y111 T112	E104-R108 HydrophobicContact CG-CG 3.92Å; E104-R108 PolarHBondContact O-N 3.21Å; R108-I110 PolarHBondContact O-N 2.79Å; R108-I110 VanDerWaalsContact O-N 3.11Å; R108-Y111 HydrophobicContact CB-CD2 3.56Å; R108-Y111 HydrophobicContact CB-CE2 4.05Å; R108-Y111 HydrophobicContact CB-CG 4.43Å; R108-Y111 HydrophobicContact CG-CD2 4.05Å; R108-Y111 HydrophobicContact CG-CE2 4.12Å; R108-Y111 PolarHBondContact O-N 3.27Å; R108-T112 PolarHBondContact O-N 3.3Å; R108-T112 PolarHBondContact O-OG1 3.39Å; R108-T112 VanDerWaalsContact O-OG1 3.05Å
109	P	85.3	Confident	85.1	Confident	68 Å²	68	66.7 Å²	66.7	44%	0.442	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-30.1	-174.4	26.6	-36.3	0	0	0	113.1	V113	P109-V113 WeakPolarHBondContact O-CB 3.09Å; P109-V113 WeakPolarHBondContact O-CG2 3.25Å; P109-V113 PolarHBondContact O-N 3.42Å
110	I	88.4	Confident	85.9	Confident	114 Å²	114	65.1 Å²	65.1	59%	0.585	31%	0.314	S	S	*	.	H	α-helix	trans	-64.9	-51	179.9	-62.2	172	0	0	0	110.2	R108 V113 F114	R108-I110 PolarHBondContact O-N 2.79Å; R108-I110 VanDerWaalsContact O-N 3.11Å; I110-V113 PolarHBondContact O-N 3.4Å; I110-F114 HydrophobicContact CG2-CD2 3.95Å; I110-F114 HydrophobicContact CG2-CE2 3.7Å; I110-F114 WeakPolarHBondContact O-CD2 3.32Å; I110-F114 PolarHBondContact O-N 3.35Å; I110-F114 VanDerWaalsContact O-N 3.15Å
111	Y	88.6	Confident	86.6	Confident	66 Å²	66	68.3 Å²	68.3	26%	0.259	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-38	-179.1	-58	-48.5	0	0	0	112.1	I100 E104 R108 V113 F114 Y115	I100-Y111 HydrophobicContact CD1-CD1 4.23Å; I100-Y111 HydrophobicContact CD1-CE1 3.83Å; I100-Y111 HydrophobicContact CD1-CE2 4.39Å; E104-Y111 HydrophobicContact CG-CD2 4.4Å; E104-Y111 HydrophobicContact CG-CE2 4.35Å; R108-Y111 HydrophobicContact CB-CD2 3.56Å; R108-Y111 HydrophobicContact CB-CE2 4.05Å; R108-Y111 HydrophobicContact CB-CG 4.43Å; R108-Y111 HydrophobicContact CG-CD2 4.05Å; R108-Y111 HydrophobicContact CG-CE2 4.12Å; R108-Y111 PolarHBondContact O-N 3.27Å; Y111-V113 VanDerWaalsContact C-N 3.33Å; Y111-V113 PolarHBondContact O-N 3.14Å; Y111-F114 PolarHBondContact O-N 3.21Å; Y111-Y115 PolarHBondContact O-N 3.4Å
112	T	88.3	Confident	87.4	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-41.1	174.5	-40.5	0	0	0	0	111.7	I105 R108 Y115 I116 I194	I105-T112 WeakPolarHBondContact O-CA 3.2Å; I105-T112 PolarHBondContact O-N 2.94Å; I105-T112 PolarHBondContact O-OG1 2.89Å; R108-T112 PolarHBondContact O-N 3.3Å; R108-T112 PolarHBondContact O-OG1 3.39Å; R108-T112 VanDerWaalsContact O-OG1 3.05Å; T112-Y115 PolarHBondContact O-N 2.73Å; T112-I116 HydrophobicContact CG2-CD1 4.05Å; T112-I116 VanDerWaalsContact O-CG1 3.28Å; T112-I116 WeakPolarHBondContact O-CG1 3.22Å; T112-I116 PolarHBondContact O-N 3.4Å; T112-I194 HydrophobicContact CG2-CG2 3.75Å
113	V	90.4	Very high	88.4	Confident	65 Å²	65	60.9 Å²	60.9	39%	0.394	30%	0.296	S	S	.	.	H	α-helix	trans	-64.4	-44.6	177.6	167.5	0	0	0	0	111	P109 I110 Y111 Y115 I116 I117	P109-V113 WeakPolarHBondContact O-CB 3.09Å; P109-V113 WeakPolarHBondContact O-CG2 3.25Å; P109-V113 PolarHBondContact O-N 3.42Å; I110-V113 PolarHBondContact O-N 3.4Å; Y111-V113 VanDerWaalsContact C-N 3.33Å; Y111-V113 PolarHBondContact O-N 3.14Å; V113-Y115 VanDerWaalsContact C-N 3.31Å; V113-Y115 PolarHBondContact O-N 2.91Å; V113-I116 PolarHBondContact O-N 2.91Å; V113-I117 HydrophobicContact CG1-CD1 3.81Å; V113-I117 HydrophobicContact CG1-CG1 4.44Å; V113-I117 VanDerWaalsContact O-CG1 3.27Å; V113-I117 WeakPolarHBondContact O-CG1 3.49Å; V113-I117 PolarHBondContact O-N 2.91Å
114	F	91.4	Very high	89.5	Confident	123 Å²	123	57.6 Å²	57.6	54%	0.539	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-40.1	174.7	-79.6	-68.5	0	0	0	112.4	F91 I110 Y111 I117 S118	F91-F114 HydrophobicContact CD2-CB 4.25Å; F91-F114 HydrophobicContact CE2-CB 4.03Å; I110-F114 HydrophobicContact CG2-CD2 3.95Å; I110-F114 HydrophobicContact CG2-CE2 3.7Å; I110-F114 WeakPolarHBondContact O-CD2 3.32Å; I110-F114 PolarHBondContact O-N 3.35Å; I110-F114 VanDerWaalsContact O-N 3.15Å; Y111-F114 PolarHBondContact O-N 3.21Å; F114-I117 PolarHBondContact O-N 3.3Å; F114-S118 PolarHBondContact O-N 3.01Å
115	Y	90.3	Very high	90.3	Very high	4 Å²	4	57 Å²	57	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-49.6	174.5	-170.2	-96.6	0	0	0	111.6	F91 H92 Y111 T112 V113 I117 S118 V119 E190 I194	F91-Y115 AromaticContact CD1-CD2 3.51Å; F91-Y115 HydrophobicContact CD1-CD2 3.51Å; F91-Y115 HydrophobicContact CD1-CE2 4.02Å; F91-Y115 HydrophobicContact CD2-CD2 4.46Å; F91-Y115 AromaticContact CE1-CD2 3.32Å; F91-Y115 HydrophobicContact CE1-CD2 3.32Å; F91-Y115 HydrophobicContact CE1-CE2 4Å; F91-Y115 HydrophobicContact CE1-CG 4.29Å; F91-Y115 HydrophobicContact CE2-CD2 4.28Å; F91-Y115 HydrophobicContact CG-CD2 4.11Å; F91-Y115 AromaticContact CZ-CD2 3.73Å; F91-Y115 HydrophobicContact CZ-CD2 3.73Å; F91-Y115 HydrophobicContact CZ-CG 4.28Å; H92-Y115 AromaticContact NE2-CE2 3.78Å; Y111-Y115 PolarHBondContact O-N 3.4Å; T112-Y115 PolarHBondContact O-N 2.73Å; V113-Y115 VanDerWaalsContact C-N 3.31Å; V113-Y115 PolarHBondContact O-N 2.91Å; Y115-I117 VanDerWaalsContact C-N 3.29Å; Y115-I117 PolarHBondContact O-N 2.87Å; Y115-S118 WeakPolarHBondContact O-CA 3.37Å; Y115-S118 WeakPolarHBondContact O-CB 3.31Å; Y115-S118 PolarHBondContact O-N 3.38Å; Y115-S118 PolarHBondContact O-OG 3.04Å; Y115-V119 HydrophobicContact CD1-CG2 3.93Å; Y115-V119 HydrophobicContact CE1-CG2 3.57Å; Y115-V119 WeakPolarHBondContact O-CG2 3.35Å; Y115-V119 PolarHBondContact O-N 3.49Å; Y115-E190 HydrophobicContact CE1-CG 4.48Å; Y115-E190 PolarHBondContact OH-OE1 3Å; Y115-I194 HydrophobicContact CD1-CD1 3.48Å; Y115-I194 VanDerWaalsContact CD1-CD1 3.48Å; Y115-I194 HydrophobicContact CE1-CD1 3.3Å
116	I	92.1	Very high	91	Very high	28 Å²	28	56.8 Å²	56.8	14%	0.144	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-43.7	177.7	-70	166.7	0	0	0	110.5	T112 V113 S118 V119 L120 I194 L195	T112-I116 HydrophobicContact CG2-CD1 4.05Å; T112-I116 VanDerWaalsContact O-CG1 3.28Å; T112-I116 WeakPolarHBondContact O-CG1 3.22Å; T112-I116 PolarHBondContact O-N 3.4Å; V113-I116 PolarHBondContact O-N 2.91Å; I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 3.26Å; I116-V119 PolarHBondContact O-N 3.49Å; I116-L120 HydrophobicContact CG2-CD1 3.85Å; I116-L120 HydrophobicContact CG2-CG 4.21Å; I116-L120 WeakPolarHBondContact O-CB 3.42Å; I116-L120 VanDerWaalsContact O-CG 3.29Å; I116-L120 WeakPolarHBondContact O-CG 3.5Å; I116-L120 PolarHBondContact O-N 2.97Å; I116-I194 HydrophobicContact CD1-CG2 4.36Å; I116-I194 HydrophobicContact CG1-CG2 4.35Å; I116-L195 HydrophobicContact CD1-CD2 4.47Å
117	I	93.3	Very high	91.9	Very high	78 Å²	78	59.8 Å²	59.8	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-43.6	175.2	-68.9	165.9	0	0	0	110.6	V113 F114 Y115 V119 L120 L121	V113-I117 HydrophobicContact CG1-CD1 3.81Å; V113-I117 HydrophobicContact CG1-CG1 4.44Å; V113-I117 VanDerWaalsContact O-CG1 3.27Å; V113-I117 WeakPolarHBondContact O-CG1 3.49Å; V113-I117 PolarHBondContact O-N 2.91Å; F114-I117 PolarHBondContact O-N 3.3Å; Y115-I117 VanDerWaalsContact C-N 3.29Å; Y115-I117 PolarHBondContact O-N 2.87Å; I117-V119 VanDerWaalsContact C-N 3.33Å; I117-V119 PolarHBondContact O-N 3.26Å; I117-L120 PolarHBondContact O-N 3.46Å; I117-L121 HydrophobicContact CG2-CD1 4.15Å; I117-L121 HydrophobicContact CG2-CG 4.42Å; I117-L121 WeakPolarHBondContact O-CG 3.36Å; I117-L121 PolarHBondContact O-N 2.89Å
118	S	93.3	Very high	92.6	Very high	9 Å²	9	57.9 Å²	57.9	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-40	177.5	82	0	0	0	0	112.5	F114 Y115 I116 R122	F114-S118 PolarHBondContact O-N 3.01Å; Y115-S118 WeakPolarHBondContact O-CA 3.37Å; Y115-S118 WeakPolarHBondContact O-CB 3.31Å; Y115-S118 PolarHBondContact O-N 3.38Å; Y115-S118 PolarHBondContact O-OG 3.04Å; I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 3.26Å; S118-R122 WeakPolarHBondContact O-CG 3.33Å; S118-R122 PolarHBondContact O-N 2.9Å; S118-R122 VanDerWaalsContact O-N 3.17Å
119	V	93	Very high	93.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-71.7	-39.6	177.3	-178	0	0	0	0	111.1	Y115 I116 I117 L121 R122 I123 C187 I191	Y115-V119 HydrophobicContact CD1-CG2 3.93Å; Y115-V119 HydrophobicContact CE1-CG2 3.57Å; Y115-V119 WeakPolarHBondContact O-CG2 3.35Å; Y115-V119 PolarHBondContact O-N 3.49Å; I116-V119 PolarHBondContact O-N 3.49Å; I117-V119 VanDerWaalsContact C-N 3.33Å; I117-V119 PolarHBondContact O-N 3.26Å; V119-L121 PolarHBondContact O-N 2.89Å; V119-R122 WeakPolarHBondContact O-CB 3.29Å; V119-R122 PolarHBondContact O-N 3.32Å; V119-I123 HydrophobicContact CG1-CD1 4.4Å; V119-I123 WeakPolarHBondContact O-CG1 3.42Å; V119-I123 PolarHBondContact O-N 2.61Å; V119-C187 HydrophobicContact CG1-CB 4.19Å; V119-I191 HydrophobicContact CB-CD1 4.44Å; V119-I191 HydrophobicContact CB-CG1 4.21Å; V119-I191 HydrophobicContact CG1-CD1 3.91Å; V119-I191 HydrophobicContact CG1-CG1 3.66Å
120	L	94.8	Very high	93.6	Very high	80 Å²	80	51.8 Å²	51.8	42%	0.419	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-42.5	174.5	-74.1	173.5	0	0	0	112	I116 I117 R122 I123 I124 I191	I116-L120 HydrophobicContact CG2-CD1 3.85Å; I116-L120 HydrophobicContact CG2-CG 4.21Å; I116-L120 WeakPolarHBondContact O-CB 3.42Å; I116-L120 VanDerWaalsContact O-CG 3.29Å; I116-L120 WeakPolarHBondContact O-CG 3.5Å; I116-L120 PolarHBondContact O-N 2.97Å; I117-L120 PolarHBondContact O-N 3.46Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 3.15Å; L120-I123 PolarHBondContact O-N 3.22Å; L120-I124 WeakPolarHBondContact O-CG1 3.33Å; L120-I124 PolarHBondContact O-N 2.75Å; L120-I191 HydrophobicContact CD2-CD1 3.67Å; L120-I191 HydrophobicContact CG-CD1 4.1Å
121	L	95.7	Very high	94	Very high	85 Å²	85	54.3 Å²	54.3	45%	0.445	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-41.2	173.9	-73.6	172.3	0	0	0	111.3	P87 I117 V119 I124 L125	P87-L121 HydrophobicContact CB-CB 4.3Å; P87-L121 HydrophobicContact CG-CB 4.27Å; I117-L121 HydrophobicContact CG2-CD1 4.15Å; I117-L121 HydrophobicContact CG2-CG 4.42Å; I117-L121 WeakPolarHBondContact O-CG 3.36Å; I117-L121 PolarHBondContact O-N 2.89Å; V119-L121 PolarHBondContact O-N 2.89Å; L121-I124 PolarHBondContact O-N 3.04Å; L121-L125 WeakPolarHBondContact O-CB 3.32Å; L121-L125 VanDerWaalsContact O-CG 3.24Å; L121-L125 WeakPolarHBondContact O-CG 3.46Å; L121-L125 PolarHBondContact O-N 3.14Å
122	R	94.1	Very high	94.3	Very high	14 Å²	14	54.1 Å²	54.1	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-44.9	174.7	-70.6	169.5	53.4	-152.9	-13.4	112.1	H24 V84 P87 S118 V119 L120 L125 E126 C187 E190	H24-R122 PolarHBondContact CE1-NH2 3.47Å; H24-R122 PolarHBondContact ND1-NH2 3.29Å; V84-R122 HydrophobicContact CG1-CB 4.47Å; V84-R122 HydrophobicContact CG1-CG 4.48Å; V84-R122 WeakPolarHBondContact O-CG 3.34Å; P87-R122 HydrophobicContact CB-CG 4.11Å; P87-R122 HydrophobicContact CG-CG 4.15Å; S118-R122 WeakPolarHBondContact O-CG 3.33Å; S118-R122 PolarHBondContact O-N 2.9Å; S118-R122 VanDerWaalsContact O-N 3.17Å; V119-R122 WeakPolarHBondContact O-CB 3.29Å; V119-R122 PolarHBondContact O-N 3.32Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 3.15Å; R122-L125 PolarHBondContact O-N 2.88Å; R122-E126 WeakPolarHBondContact O-CG 3.47Å; R122-E126 PolarHBondContact O-N 2.99Å; R122-C187 PolarHBondContact NH2-SG 2.02Å; R122-C187 VanDerWaalsContact NH2-SG 3.45Å; R122-E190 IonicContact NH1-OE2 4Å
123	I	95.8	Very high	94.7	Very high	18 Å²	18	54 Å²	54	9%	0.092	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-46.7	176.7	-67.4	168.7	0	0	0	110.8	V119 L120 L125 E126 I127 C187 I188 I191	V119-I123 HydrophobicContact CG1-CD1 4.4Å; V119-I123 WeakPolarHBondContact O-CG1 3.42Å; V119-I123 PolarHBondContact O-N 2.61Å; L120-I123 PolarHBondContact O-N 3.22Å; I123-L125 VanDerWaalsContact C-N 3.34Å; I123-L125 PolarHBondContact O-N 3.05Å; I123-E126 PolarHBondContact O-N 3.43Å; I123-I127 HydrophobicContact CG2-CD1 3.71Å; I123-I127 HydrophobicContact CG2-CG1 4.38Å; I123-I127 VanDerWaalsContact O-CG1 3.3Å; I123-I127 WeakPolarHBondContact O-CG1 3.35Å; I123-I127 PolarHBondContact O-N 3.42Å; I123-C187 HydrophobicContact CD1-CB 3.88Å; I123-C187 HydrophobicContact CG1-CB 3.46Å; I123-C187 VanDerWaalsContact CG1-CB 3.46Å; I123-I188 HydrophobicContact CD1-CG1 4.17Å; I123-I191 HydrophobicContact CD1-CD1 3.54Å
124	I	97.4	Very high	94.8	Very high	88 Å²	88	52.2 Å²	52.2	45%	0.451	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-45.5	178.9	-68.7	165.8	0	0	0	110.5	L120 L121 I127 I128	L120-I124 WeakPolarHBondContact O-CG1 3.33Å; L120-I124 PolarHBondContact O-N 2.75Å; L121-I124 PolarHBondContact O-N 3.04Å; I124-I127 PolarHBondContact O-N 3.13Å; I124-I128 HydrophobicContact CG2-CD1 3.73Å; I124-I128 HydrophobicContact CG2-CG1 4.44Å; I124-I128 VanDerWaalsContact O-CG1 3.28Å; I124-I128 WeakPolarHBondContact O-CG1 3.19Å; I124-I128 PolarHBondContact O-N 2.91Å
125	L	96.6	Very high	95	Very high	58 Å²	58	53 Å²	53	30%	0.304	26%	0.26	S	S	.	.	H	α-helix	trans	-62.7	-42.7	177.8	-70.2	170.3	0	0	0	112.3	S83 V84 P87 L121 R122 I123 I128 A129	S83-L125 WeakPolarHBondContact O-CD1 3.48Å; V84-L125 HydrophobicContact CG2-CB 4.21Å; P87-L125 HydrophobicContact CG-CD1 4.02Å; L121-L125 WeakPolarHBondContact O-CB 3.32Å; L121-L125 VanDerWaalsContact O-CG 3.24Å; L121-L125 WeakPolarHBondContact O-CG 3.46Å; L121-L125 PolarHBondContact O-N 3.14Å; R122-L125 PolarHBondContact O-N 2.88Å; I123-L125 VanDerWaalsContact C-N 3.34Å; I123-L125 PolarHBondContact O-N 3.05Å; L125-I128 PolarHBondContact O-N 3.29Å; L125-A129 VanDerWaalsContact O-CB 3.31Å; L125-A129 WeakPolarHBondContact O-CB 3.12Å; L125-A129 PolarHBondContact O-N 3.34Å
126	E	95.8	Very high	95.1	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-39.3	176.1	-72.2	-79	-146.9	0	0	111.9	R32 Q80 V84 R122 I123 A129 F130 T183 I184	R32-E126 IonicContact NH1-OE1 3.63Å; R32-E126 PolarHBondContact NH1-OE1 2.86Å; R32-E126 VanDerWaalsContact NH1-OE1 3.16Å; R32-E126 IonicContact NH1-OE2 3.67Å; Q80-E126 PolarHBondContact NE2-OE2 3.18Å; V84-E126 HydrophobicContact CG1-CG 4.11Å; V84-E126 HydrophobicContact CG2-CG 3.74Å; R122-E126 WeakPolarHBondContact O-CG 3.47Å; R122-E126 PolarHBondContact O-N 2.99Å; I123-E126 PolarHBondContact O-N 3.43Å; E126-A129 PolarHBondContact O-N 3.1Å; E126-F130 WeakPolarHBondContact O-CB 3.44Å; E126-F130 PolarHBondContact O-N 2.97Å; E126-T183 PolarHBondContact OE1-OG1 3.49Å; E126-I184 HydrophobicContact CB-CD1 4.07Å; E126-I184 HydrophobicContact CB-CG1 3.62Å; E126-I184 HydrophobicContact CG-CG1 4.44Å
127	I	97.4	Very high	95.1	Very high	89 Å²	89	54.9 Å²	54.9	46%	0.456	27%	0.27	S	S	.	.	H	α-helix	trans	-65.2	-45.9	176.2	-69.5	168.7	0	0	0	110.9	I123 I124 A129 F130 W131 I184	I123-I127 HydrophobicContact CG2-CD1 3.71Å; I123-I127 HydrophobicContact CG2-CG1 4.38Å; I123-I127 VanDerWaalsContact O-CG1 3.3Å; I123-I127 WeakPolarHBondContact O-CG1 3.35Å; I123-I127 PolarHBondContact O-N 3.42Å; I124-I127 PolarHBondContact O-N 3.13Å; I127-A129 VanDerWaalsContact C-N 3.3Å; I127-A129 PolarHBondContact O-N 2.89Å; I127-F130 PolarHBondContact O-N 3.43Å; I127-W131 PolarHBondContact O-N 3.49Å; I127-I184 HydrophobicContact CG1-CD1 4.14Å
128	I	97.2	Very high	95.1	Very high	93 Å²	93	52.4 Å²	52.4	48%	0.477	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-44.2	176.8	-69.6	167.8	0	0	0	110	I124 L125 W131 L132	I124-I128 HydrophobicContact CG2-CD1 3.73Å; I124-I128 HydrophobicContact CG2-CG1 4.44Å; I124-I128 VanDerWaalsContact O-CG1 3.28Å; I124-I128 WeakPolarHBondContact O-CG1 3.19Å; I124-I128 PolarHBondContact O-N 2.91Å; L125-I128 PolarHBondContact O-N 3.29Å; I128-W131 PolarHBondContact O-N 2.96Å; I128-L132 WeakPolarHBondContact O-CB 3.14Å; I128-L132 PolarHBondContact O-N 3.39Å
129	A	96.2	Very high	95	Very high	9 Å²	9	58.7 Å²	58.7	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-42.7	177.5	0	0	0	0	0	112	F76 Q80 L125 E126 I127 W131 L132 Q133	F76-A129 HydrophobicContact CZ-CB 4.21Å; F76-A129 WeakPolarHBondContact CZ-O 3.4Å; Q80-A129 HydrophobicContact CB-CB 4.36Å; Q80-A129 VanDerWaalsContact CD-CB 3.42Å; Q80-A129 HydrophobicContact CG-CB 3.5Å; Q80-A129 VanDerWaalsContact CG-CB 3.5Å; L125-A129 VanDerWaalsContact O-CB 3.31Å; L125-A129 WeakPolarHBondContact O-CB 3.12Å; L125-A129 PolarHBondContact O-N 3.34Å; E126-A129 PolarHBondContact O-N 3.1Å; I127-A129 VanDerWaalsContact C-N 3.3Å; I127-A129 PolarHBondContact O-N 2.89Å; A129-W131 VanDerWaalsContact C-N 3.31Å; A129-W131 PolarHBondContact O-N 3.11Å; A129-L132 PolarHBondContact O-N 3.33Å; A129-Q133 VanDerWaalsContact O-CB 3.25Å; A129-Q133 WeakPolarHBondContact O-CB 3.43Å; A129-Q133 PolarHBondContact O-N 2.95Å
130	F	96.2	Very high	94.9	Very high	63 Å²	63	63.7 Å²	63.7	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-44.2	175.6	-178.2	-90.2	0	0	0	111.9	E126 I127 S134 Y177 T180 V181	E126-F130 WeakPolarHBondContact O-CB 3.44Å; E126-F130 PolarHBondContact O-N 2.97Å; I127-F130 PolarHBondContact O-N 3.43Å; F130-S134 WeakPolarHBondContact O-CB 3.44Å; F130-S134 PolarHBondContact O-N 2.96Å; F130-S134 PolarHBondContact O-OG 2.86Å; F130-Y177 AromaticContact CD2-CD1 3.8Å; F130-Y177 HydrophobicContact CD2-CD1 3.8Å; F130-Y177 HydrophobicContact CD2-CE1 4.36Å; F130-Y177 AromaticContact CE2-CD1 3.48Å; F130-Y177 HydrophobicContact CE2-CD1 3.48Å; F130-Y177 VanDerWaalsContact CE2-CD1 3.48Å; F130-Y177 HydrophobicContact CE2-CE1 4.19Å; F130-Y177 HydrophobicContact CE2-CG 4.37Å; F130-Y177 HydrophobicContact CZ-CD1 4.19Å; F130-T180 HydrophobicContact CB-CG2 4.03Å; F130-T180 HydrophobicContact CD2-CG2 4.09Å; F130-V181 HydrophobicContact CD2-CG2 4.32Å; F130-V181 HydrophobicContact CE2-CG2 3.75Å; F130-V181 HydrophobicContact CZ-CG2 4.44Å
131	W	96.3	Very high	94.8	Very high	167 Å²	167	60 Å²	60	63%	0.633	29%	0.294	S	S	*	.	H	α-helix	trans	-63.8	-47.3	176.4	-178.4	84.8	0	0	0	111.7	I127 I128 A129 Q133 S134 H135	I127-W131 PolarHBondContact O-N 3.49Å; I128-W131 PolarHBondContact O-N 2.96Å; A129-W131 VanDerWaalsContact C-N 3.31Å; A129-W131 PolarHBondContact O-N 3.11Å; W131-Q133 VanDerWaalsContact C-N 3.35Å; W131-Q133 PolarHBondContact O-N 3.17Å; W131-S134 WeakPolarHBondContact O-CB 3.42Å; W131-S134 PolarHBondContact O-N 3.23Å; W131-H135 PolarHBondContact O-N 3.44Å
132	L	95.7	Very high	94.5	Very high	63 Å²	63	61.8 Å²	61.8	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-38.5	-179.8	-174.3	56.5	0	0	0	111.8	F76 I128 A129 S134 H135 L136	F76-L132 HydrophobicContact CE2-CB 4.1Å; F76-L132 HydrophobicContact CE2-CD2 3.75Å; F76-L132 HydrophobicContact CE2-CG 3.77Å; F76-L132 HydrophobicContact CZ-CB 4.31Å; F76-L132 HydrophobicContact CZ-CG 4.46Å; I128-L132 WeakPolarHBondContact O-CB 3.14Å; I128-L132 PolarHBondContact O-N 3.39Å; A129-L132 PolarHBondContact O-N 3.33Å; L132-S134 VanDerWaalsContact C-N 3.35Å; L132-H135 PolarHBondContact O-N 3.22Å; L132-L136 HydrophobicContact CD1-CD1 3.71Å; L132-L136 HydrophobicContact CD1-CD2 4.48Å; L132-L136 HydrophobicContact CD1-CG 3.83Å; L132-L136 HydrophobicContact CD2-CD1 4.4Å; L132-L136 HydrophobicContact CG-CD1 3.69Å; L132-L136 HydrophobicContact CG-CG 4.23Å; L132-L136 WeakPolarHBondContact O-CB 3.28Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.45Å; L132-L136 PolarHBondContact O-N 2.96Å
133	Q	95.3	Very high	94.4	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-46.9	173.3	-168.2	-176.3	-44.7	0	0	110.8	F76 A129 W131 H135 L136 F137 L173 Y177	F76-Q133 HydrophobicContact CE1-CB 3.74Å; F76-Q133 HydrophobicContact CE1-CG 4.03Å; F76-Q133 HydrophobicContact CZ-CB 3.93Å; A129-Q133 VanDerWaalsContact O-CB 3.25Å; A129-Q133 WeakPolarHBondContact O-CB 3.43Å; A129-Q133 PolarHBondContact O-N 2.95Å; W131-Q133 VanDerWaalsContact C-N 3.35Å; W131-Q133 PolarHBondContact O-N 3.17Å; Q133-H135 VanDerWaalsContact C-N 3.3Å; Q133-H135 PolarHBondContact O-N 2.91Å; Q133-L136 PolarHBondContact O-N 2.87Å; Q133-F137 HydrophobicContact CB-CD2 4.38Å; Q133-F137 HydrophobicContact CG-CD2 3.71Å; Q133-F137 HydrophobicContact CG-CE2 4.27Å; Q133-F137 WeakPolarHBondContact O-CD2 3.32Å; Q133-F137 PolarHBondContact O-N 3.49Å; Q133-L173 HydrophobicContact CG-CD1 4.37Å; Q133-Y177 HydrophobicContact CB-CE1 3.87Å; Q133-Y177 VanDerWaalsContact CD-CE1 3.44Å; Q133-Y177 HydrophobicContact CG-CD1 4.43Å; Q133-Y177 HydrophobicContact CG-CE1 3.65Å; Q133-Y177 VanDerWaalsContact NE2-CD1 3.28Å; Q133-Y177 VanDerWaalsContact NE2-CZ 3.3Å; Q133-Y177 PolarHBondContact O-OH 2.95Å; Q133-Y177 VanDerWaalsContact O-OH 3.07Å
134	S	93.9	Very high	94.2	Very high	27 Å²	27	66.5 Å²	66.5	19%	0.189	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-39.7	178.3	-57.2	0	0	0	0	112.2	F130 W131 L132 G138 Y177	F130-S134 WeakPolarHBondContact O-CB 3.44Å; F130-S134 PolarHBondContact O-N 2.96Å; F130-S134 PolarHBondContact O-OG 2.86Å; W131-S134 WeakPolarHBondContact O-CB 3.42Å; W131-S134 PolarHBondContact O-N 3.23Å; L132-S134 VanDerWaalsContact C-N 3.35Å; S134-G138 WeakPolarHBondContact O-CA 3.47Å; S134-G138 PolarHBondContact O-N 3.29Å; S134-Y177 WeakPolarHBondContact CA-OH 3.41Å; S134-Y177 PolarHBondContact N-OH 3.34Å; S134-Y177 VanDerWaalsContact N-OH 3.12Å
135	H	94.1	Very high	94	Very high	138 Å²	138	64.7 Å²	64.7	64%	0.639	32%	0.32	S	S	*	.	H	α-helix	trans	-75.3	-41.5	179.8	-169.6	65.7	0	0	0	113	W131 L132 Q133	W131-H135 PolarHBondContact O-N 3.44Å; L132-H135 PolarHBondContact O-N 3.22Å; Q133-H135 VanDerWaalsContact C-N 3.3Å; Q133-H135 PolarHBondContact O-N 2.91Å
136	L	93.3	Very high	93.8	Very high	61 Å²	61	65.8 Å²	65.8	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-78.4	-42.4	-175.9	-71.3	174.4	0	0	0	113.4	F76 L132 Q133	F76-L136 HydrophobicContact CD2-CD1 4.26Å; F76-L136 HydrophobicContact CE2-CD1 4.42Å; L132-L136 HydrophobicContact CD1-CD1 3.71Å; L132-L136 HydrophobicContact CD1-CD2 4.48Å; L132-L136 HydrophobicContact CD1-CG 3.83Å; L132-L136 HydrophobicContact CD2-CD1 4.4Å; L132-L136 HydrophobicContact CG-CD1 3.69Å; L132-L136 HydrophobicContact CG-CG 4.23Å; L132-L136 WeakPolarHBondContact O-CB 3.28Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.45Å; L132-L136 PolarHBondContact O-N 2.96Å; Q133-L136 PolarHBondContact O-N 2.87Å
137	F	92.6	Very high	93.6	Very high	12 Å²	12	65.7 Å²	65.7	5%	0.053	33%	0.329	C	S	.	.	H	α-helix	trans	-109.6	-15	-169.8	-51.1	-59.7	0	0	0	113.3	I71 P73 F76 Q133 L173	I71-F137 WeakPolarHBondContact O-CE1 3.33Å; P73-F137 HydrophobicContact CB-CE1 4.27Å; P73-F137 HydrophobicContact CB-CZ 4.27Å; P73-F137 HydrophobicContact CG-CD1 3.85Å; P73-F137 HydrophobicContact CG-CE1 3.69Å; P73-F137 HydrophobicContact CG-CG 4.47Å; P73-F137 HydrophobicContact CG-CZ 4.19Å; F76-F137 HydrophobicContact CB-CE2 3.94Å; F76-F137 HydrophobicContact CB-CZ 3.79Å; F76-F137 AromaticContact CD1-CE2 3.75Å; F76-F137 HydrophobicContact CD1-CE2 3.75Å; F76-F137 HydrophobicContact CD1-CZ 4.48Å; F76-F137 HydrophobicContact CD2-CE2 4.2Å; F76-F137 HydrophobicContact CE1-CE2 4.36Å; F76-F137 AromaticContact CG-CE2 3.67Å; F76-F137 HydrophobicContact CG-CE2 3.67Å; F76-F137 HydrophobicContact CG-CZ 4.01Å; Q133-F137 HydrophobicContact CB-CD2 4.38Å; Q133-F137 HydrophobicContact CG-CD2 3.71Å; Q133-F137 HydrophobicContact CG-CE2 4.27Å; Q133-F137 WeakPolarHBondContact O-CD2 3.32Å; Q133-F137 PolarHBondContact O-N 3.49Å; F137-L173 HydrophobicContact CB-CD1 3.99Å; F137-L173 HydrophobicContact CB-CD2 4.19Å
138	G	92.3	Very high	93.2	Very high	25 Å²	25	65 Å²	65	26%	0.258	33%	0.326	S	S	.	.			trans	67.6	-166.1	-171.1	0	0	0	0	0	112.3	S134 L173 Y177	S134-G138 WeakPolarHBondContact O-CA 3.47Å; S134-G138 PolarHBondContact O-N 3.29Å; G138-L173 WeakPolarHBondContact O-CD2 3.39Å; G138-Y177 WeakPolarHBondContact O-CE2 3.32Å; G138-Y177 PolarHBondContact O-OH 3.44Å
139	F	90.8	Very high	92.6	Very high	141 Å²	141	60.7 Å²	60.7	62%	0.618	30%	0.304	S	S	*	.	S	Bend	trans	-97.7	-21.3	176	-65.7	-75.2	0	0	0	113	Y177	F139-Y177 HydrophobicContact CD1-CD2 4.49Å; F139-Y177 HydrophobicContact CD1-CE2 4.08Å
140	Q	91.4	Very high	92	Very high	106 Å²	106	62.6 Å²	62.6	50%	0.495	32%	0.317	S	S	.	.	S	Bend	trans	-139.3	138.2	-177.1	-178.4	172	5	0	0	110.5	T170	Q140-T170 HydrophobicContact CB-CG2 4.32Å; Q140-T170 HydrophobicContact CG-CG2 4Å
141	V	92.1	Very high	91.1	Very high	2 Å²	2	64 Å²	64	1%	0.012	33%	0.334	C	S	.	.			trans	-88.3	114.8	173.3	-176.3	0	0	0	0	108.5	V163 H166 K169 T170 L173	V141-V163 HydrophobicContact CG1-CG1 3.84Å; V141-H166 HydrophobicContact CG1-CB 4.18Å; V141-K169 HydrophobicContact CB-CB 4.36Å; V141-K169 HydrophobicContact CG2-CB 3.97Å; V141-T170 PolarHBondContact N-OG1 3.2Å; V141-L173 HydrophobicContact CG2-CD2 4.31Å
142	H	90.7	Very high	90.2	Very high	122 Å²	122	60 Å²	60	57%	0.565	33%	0.325	S	S	*	.			trans	-75.9	145.6	175	-70.6	-62.2	0	0	0	111.3	V144	H142-V144 PolarHBondContact O-N 3.12Å
143	P	91.6	Very high	88.8	Confident	58 Å²	58	59.1 Å²	59.1	38%	0.377	32%	0.319	S	S	.	.	S	Bend	trans	-69.2	-17.8	-178.6	26.7	-34.8	0	0	0	114	V163	P143-V163 PolarHBondContact O-N 3.21Å
144	V	92.4	Very high	87	Confident	74 Å²	74	69.8 Å²	69.8	45%	0.448	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.6	-177.5	-178.3	0	0	0	0	109.4	H142 K160 C161	H142-V144 PolarHBondContact O-N 3.12Å; V144-K160 HydrophobicContact CG1-CB 3.99Å; V144-K160 HydrophobicContact CG1-CD 4.5Å; V144-K160 HydrophobicContact CG1-CG 4.3Å; V144-C161 WeakPolarHBondContact CA-O 3.12Å
145	Y	92.5	Very high	85.4	Confident	50 Å²	50	70.7 Å²	70.7	20%	0.196	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.9	170.6	178.8	-107	0	0	0	109.9	F51 F68 C147 C161	F51-Y145 HydrophobicContact CZ-CD1 4.18Å; F68-Y145 HydrophobicContact CB-CD1 3.83Å; F68-Y145 HydrophobicContact CB-CD2 4.25Å; F68-Y145 HydrophobicContact CB-CE1 3.7Å; F68-Y145 HydrophobicContact CB-CE2 4.14Å; F68-Y145 HydrophobicContact CB-CG 4.08Å; F68-Y145 HydrophobicContact CD2-CD1 4.26Å; F68-Y145 AromaticContact CD2-CD2 3.3Å; F68-Y145 HydrophobicContact CD2-CD2 3.3Å; F68-Y145 AromaticContact CD2-CE2 3.67Å; F68-Y145 HydrophobicContact CD2-CE2 3.67Å; F68-Y145 AromaticContact CD2-CG 3.62Å; F68-Y145 HydrophobicContact CD2-CG 3.62Å; F68-Y145 AromaticContact CE2-CD2 3.97Å; F68-Y145 HydrophobicContact CE2-CD2 3.97Å; F68-Y145 HydrophobicContact CE2-CG 4.33Å; F68-Y145 HydrophobicContact CG-CD1 4.27Å; F68-Y145 HydrophobicContact CG-CD2 4.11Å; F68-Y145 HydrophobicContact CG-CE2 4.36Å; F68-Y145 HydrophobicContact CG-CG 4.03Å; Y145-C147 HydrophobicContact CD1-CB 4.19Å; Y145-C147 HydrophobicContact CE1-CB 3.96Å; Y145-C161 PolarHBondContact N-O 3.46Å; Y145-C161 PolarHBondContact O-N 2.91Å
146	V	92	Very high	83.4	Confident	80 Å²	80	73.2 Å²	73.2	49%	0.485	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.8	179	-178.8	0	0	0	0	107.9	V158	V146-V158 HydrophobicContact CG1-CG1 3.12Å
147	C	90.9	Very high	82.2	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.6	-176.5	-179.5	0	0	0	0	111.1	C64 Y145 T159	C64-C147 WeakPolarHBondContact CA-SG 3.27Å; C64-C147 HydrophobicContact CB-CB 3.66Å; C64-C147 WeakPolarHBondContact CB-SG 3.24Å; C64-C147 WeakPolarHBondContact SG-CB 3.42Å; C64-C147 CovalentContact SG-SG 2.03Å; C64-C147 PolarHBondContact SG-SG 3.5Å; Y145-C147 HydrophobicContact CD1-CB 4.19Å; Y145-C147 HydrophobicContact CE1-CB 3.96Å; C147-T159 PolarHBondContact N-O 3.04Å; C147-T159 PolarHBondContact O-N 2.91Å
148	D	89.6	Confident	81.6	Confident	75 Å²	75	78.2 Å²	78.2	40%	0.401	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	98	168.5	-175.3	-10.2	0	0	0	108.8	Q67 S150	Q67-D148 PolarHBondContact OE1-O 3.44Å; D148-S150 VanDerWaalsContact C-N 3.34Å; D148-S150 WeakPolarHBondContact OD1-CB 3.49Å; D148-S150 PolarHBondContact OD1-N 3.27Å; D148-S150 VanDerWaalsContact OD1-N 3.09Å; D148-S150 PolarHBondContact OD1-OG 3.47Å
149	A	85.4	Confident	81.4	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.008	41%	0.412	C	S	.	.			trans	-95.1	18.2	-178.8	0	0	0	0	0	113.1	L60 S151 L152 E153	L60-A149 HydrophobicContact CD1-CB 3.47Å; L60-A149 VanDerWaalsContact CD1-CB 3.47Å; A149-S151 PolarHBondContact O-N 2.95Å; A149-S151 VanDerWaalsContact O-N 3.11Å; A149-L152 PolarHBondContact O-N 3.45Å; A149-E153 PolarHBondContact O-N 2.88Å
150	S	82.6	Confident	81.4	Confident	50 Å²	50	79.1 Å²	79.1	35%	0.35	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.8	-175.7	55.5	0	0	0	0	114.9	D148 E153	D148-S150 VanDerWaalsContact C-N 3.34Å; D148-S150 WeakPolarHBondContact OD1-CB 3.49Å; D148-S150 PolarHBondContact OD1-N 3.27Å; D148-S150 VanDerWaalsContact OD1-N 3.09Å; D148-S150 PolarHBondContact OD1-OG 3.47Å; S150-E153 CarbonylContact C-O 3.59Å
151	S	78.7	Confident	81.4	Confident	91 Å²	91	74.1 Å²	74.1	64%	0.636	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-23.6	175.8	58.6	0	0	0	0	113.5	F63 A149	F63-S151 WeakPolarHBondContact CZ-OG 3.41Å; A149-S151 PolarHBondContact O-N 2.95Å; A149-S151 VanDerWaalsContact O-N 3.11Å
152	L	75.6	Confident	81.4	Confident	85 Å²	85	80.8 Å²	80.8	45%	0.445	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-38.6	-179.1	-168.7	73.1	0	0	0	111.4	L60 F63 A149	L60-L152 HydrophobicContact CB-CD2 4.19Å; L60-L152 HydrophobicContact CD1-CD2 4Å; F63-L152 HydrophobicContact CB-CD2 4.03Å; F63-L152 HydrophobicContact CG-CD2 4.28Å; A149-L152 PolarHBondContact O-N 3.45Å
153	E	66.6	Low	81.5	Confident	44 Å²	44	75.3 Å²	75.3	21%	0.206	40%	0.398	C	S	.	.	S	Bend	trans	-105.7	125.8	-179.8	-157.4	158.1	108.7	0	0	109.2	R57 A149 S150 A155 N157	R57-E153 IonicContact CZ-OE2 2.76Å; R57-E153 IonicContact NH1-OE2 3.73Å; R57-E153 PolarHBondContact NH1-OE2 3.01Å; A149-E153 PolarHBondContact O-N 2.88Å; S150-E153 CarbonylContact C-O 3.59Å; E153-A155 PolarHBondContact O-N 3.02Å; E153-N157 PolarHBondContact OE1-ND2 3.28Å
154	K	58.9	Low	81.5	Confident	224 Å²	224	73.6 Å²	73.6	97%	0.974	39%	0.387	S	S	*	.	S	Bend	trans	-65.2	11.9	-179.5	-72.9	-178.9	178.1	176.8	0	114.4
155	A	58.8	Low	81.4	Confident	46 Å²	46	74.5 Å²	74.5	38%	0.38	39%	0.387	S	S	.	.	S	Bend	trans	-129	142	178.3	0	0	0	0	0	109.5	E153 N157	E153-A155 PolarHBondContact O-N 3.02Å; A155-N157 PolarHBondContact O-N 3.45Å
156	F	53.1	Low	81.3	Confident	191 Å²	191	74 Å²	74	84%	0.838	39%	0.386	S	S	*	.			trans	-68.1	75.6	175.6	-88.6	-86.8	0	0	0	111
157	N	68.4	Low	81.2	Confident	76 Å²	76	76.7 Å²	76.7	41%	0.406	39%	0.392	S	S	.	.			trans	-111.2	106	178.1	-71.3	-16.6	0	0	0	109.3	E153 A155 T159	E153-N157 PolarHBondContact OE1-ND2 3.28Å; A155-N157 PolarHBondContact O-N 3.45Å; N157-T159 PolarHBondContact O-N 3Å
158	V	79.9	Confident	81.3	Confident	101 Å²	101	81.6 Å²	81.6	61%	0.612	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	112.4	165.4	174.7	0	0	0	0	107.3	V146	V146-V158 HydrophobicContact CG1-CG1 3.12Å
159	T	86.9	Confident	81.5	Confident	31 Å²	31	78 Å²	78	19%	0.19	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.2	-173.5	-46.6	0	0	0	0	110.3	C53 C147 N157	C53-T159 HydrophobicContact CB-CG2 4.08Å; C147-T159 PolarHBondContact N-O 3.04Å; C147-T159 PolarHBondContact O-N 2.91Å; N157-T159 PolarHBondContact O-N 3Å
160	K	90.6	Very high	81.9	Confident	155 Å²	155	79.2 Å²	79.2	67%	0.674	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	127.2	175.7	-66.3	178.4	-178.2	174.5	0	109.2	V144	V144-K160 HydrophobicContact CG1-CB 3.99Å; V144-K160 HydrophobicContact CG1-CD 4.5Å; V144-K160 HydrophobicContact CG1-CG 4.3Å
161	C	91.8	Very high	82.5	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.5	179.7	-51.2	0	0	0	0	109.9	F51 S52 C53 V144 Y145	F51-C161 HydrophobicContact CE1-CB 3.71Å; F51-C161 HydrophobicContact CE2-CB 3.93Å; F51-C161 HydrophobicContact CZ-CB 3.3Å; S52-C161 WeakPolarHBondContact O-CA 3.45Å; C53-C161 HydrophobicContact CB-CB 3.94Å; C53-C161 WeakPolarHBondContact CB-SG 3.32Å; C53-C161 WeakPolarHBondContact SG-CB 3.48Å; C53-C161 CovalentContact SG-SG 2.02Å; C53-C161 PolarHBondContact SG-SG 3.5Å; V144-C161 WeakPolarHBondContact CA-O 3.12Å; Y145-C161 PolarHBondContact N-O 3.46Å; Y145-C161 PolarHBondContact O-N 2.91Å
162	M	92.9	Very high	83.2	Confident	142 Å²	142	78.8 Å²	78.8	70%	0.7	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	131.4	178	-61.2	-173.1	-169.9	0	0	110.4	S52	S52-M162 PolarHBondContact O-N 3.2Å
163	V	92.9	Very high	84.1	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.042	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-98.3	119.3	175.9	-177.7	0	0	0	0	108.8	F51 F68 V141 P143	F51-V163 HydrophobicContact CD2-CG2 4.35Å; F51-V163 HydrophobicContact CE2-CG2 4.03Å; F68-V163 HydrophobicContact CE1-CG1 4.25Å; F68-V163 HydrophobicContact CE1-CG2 4.12Å; F68-V163 HydrophobicContact CE2-CG2 4.48Å; F68-V163 HydrophobicContact CZ-CG1 4.23Å; F68-V163 HydrophobicContact CZ-CG2 3.93Å; V141-V163 HydrophobicContact CG1-CG1 3.84Å; P143-V163 PolarHBondContact O-N 3.21Å
164	P	90.1	Very high	85.4	Confident	22 Å²	22	75.7 Å²	75.7	14%	0.143	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	150.9	-177.9	26.7	-31.7	0	0	0	111.4	H50 H166 K169	H50-P164 HydrophobicContact CB-CB 3.86Å; H50-P164 HydrophobicContact CB-CG 3.65Å; P164-H166 PolarHBondContact O-N 3.38Å; P164-K169 VanDerWaalsContact O-CE 3.29Å; P164-K169 WeakPolarHBondContact O-CE 3.23Å; P164-K169 PolarHBondContact O-NZ 3.08Å
165	E	90.8	Very high	87	Confident	94 Å²	94	66.2 Å²	66.2	44%	0.439	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	37.9	167.6	-63.5	155.3	143.3	0	0	114.2	F167 E168 K169	E165-F167 PolarHBondContact O-N 3.42Å; E165-F167 VanDerWaalsContact O-N 3.13Å; E165-E168 HydrophobicContact CB-CB 4.41Å; E165-E168 PolarHBondContact O-N 2.84Å; E165-E168 VanDerWaalsContact O-N 3.1Å; E165-K169 PolarHBondContact O-N 3.45Å; E165-K169 VanDerWaalsContact O-N 3.11Å
166	H	89.9	Confident	88.7	Confident	39 Å²	39	64 Å²	64	18%	0.181	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-29.4	-171.8	70.4	92.5	0	0	0	113.7	V141 P164 T170	V141-H166 HydrophobicContact CG1-CB 4.18Å; P164-H166 PolarHBondContact O-N 3.38Å; H166-T170 WeakPolarHBondContact O-CB 3.38Å; H166-T170 PolarHBondContact O-N 3.27Å; H166-T170 PolarHBondContact O-OG1 2.86Å
167	F	91.7	Very high	90.7	Very high	136 Å²	136	55.7 Å²	55.7	60%	0.596	29%	0.286	S	S	*	.	H	α-helix	trans	-69.7	-46.7	174.3	-76.6	-68.1	0	0	0	112.7	E165 K169 T170 I171	E165-F167 PolarHBondContact O-N 3.42Å; E165-F167 VanDerWaalsContact O-N 3.13Å; F167-K169 VanDerWaalsContact C-N 3.3Å; F167-K169 PolarHBondContact O-N 3.49Å; F167-T170 PolarHBondContact O-N 3.05Å; F167-T170 VanDerWaalsContact O-N 3.14Å; F167-I171 WeakPolarHBondContact O-CG1 3.32Å; F167-I171 PolarHBondContact O-N 2.93Å
168	E	92.8	Very high	91.9	Very high	104 Å²	104	55.7 Å²	55.7	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-43.4	178.3	-62.2	-173.9	-165.3	0	0	110.9	E165 T170 I171 F172	E165-E168 HydrophobicContact CB-CB 4.41Å; E165-E168 PolarHBondContact O-N 2.84Å; E165-E168 VanDerWaalsContact O-N 3.1Å; E168-T170 VanDerWaalsContact C-N 3.33Å; E168-T170 PolarHBondContact O-N 3.38Å; E168-I171 PolarHBondContact O-N 3.47Å; E168-F172 WeakPolarHBondContact O-CB 3.49Å; E168-F172 PolarHBondContact O-N 3.46Å
169	K	93.2	Very high	92.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-39.1	175	-68.2	172.8	-176.4	168.3	0	112.6	V43 Y44 E47 V141 P164 E165 F167 L173	V43-K169 HydrophobicContact CG1-CB 4.39Å; V43-K169 HydrophobicContact CG1-CG 3.57Å; Y44-K169 HydrophobicContact CD1-CG 4.44Å; Y44-K169 HydrophobicContact CE1-CB 4.24Å; Y44-K169 HydrophobicContact CE1-CD 4.01Å; Y44-K169 HydrophobicContact CE1-CG 3.79Å; Y44-K169 PolarHBondContact OH-O 3.34Å; E47-K169 VanDerWaalsContact CD-NZ 3.33Å; E47-K169 VanDerWaalsContact CG-NZ 3.34Å; E47-K169 VanDerWaalsContact OE1-CE 3.32Å; E47-K169 WeakPolarHBondContact OE1-CE 3.32Å; E47-K169 IonicContact OE1-NZ 3.16Å; E47-K169 PolarHBondContact OE1-NZ 2.85Å; V141-K169 HydrophobicContact CB-CB 4.36Å; V141-K169 HydrophobicContact CG2-CB 3.97Å; P164-K169 VanDerWaalsContact O-CE 3.29Å; P164-K169 WeakPolarHBondContact O-CE 3.23Å; P164-K169 PolarHBondContact O-NZ 3.08Å; E165-K169 PolarHBondContact O-N 3.45Å; E165-K169 VanDerWaalsContact O-N 3.11Å; F167-K169 VanDerWaalsContact C-N 3.3Å; F167-K169 PolarHBondContact O-N 3.49Å; K169-L173 WeakPolarHBondContact O-CB 3.08Å; K169-L173 PolarHBondContact O-N 3.02Å
170	T	94.4	Very high	92.8	Very high	25 Å²	25	50.9 Å²	50.9	15%	0.153	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-43.4	176.9	-61.9	0	0	0	0	111.3	Q140 V141 H166 F167 E168 L173 S174	Q140-T170 HydrophobicContact CB-CG2 4.32Å; Q140-T170 HydrophobicContact CG-CG2 4Å; V141-T170 PolarHBondContact N-OG1 3.2Å; H166-T170 WeakPolarHBondContact O-CB 3.38Å; H166-T170 PolarHBondContact O-N 3.27Å; H166-T170 PolarHBondContact O-OG1 2.86Å; F167-T170 PolarHBondContact O-N 3.05Å; F167-T170 VanDerWaalsContact O-N 3.14Å; E168-T170 VanDerWaalsContact C-N 3.33Å; E168-T170 PolarHBondContact O-N 3.38Å; T170-L173 PolarHBondContact O-N 3.37Å; T170-S174 WeakPolarHBondContact O-CB 3.28Å; T170-S174 PolarHBondContact O-N 2.74Å
171	I	94.5	Very high	93.1	Very high	121 Å²	121	46.6 Å²	46.6	62%	0.621	24%	0.244	S	C	*	.	H	α-helix	trans	-62.6	-46	176.8	-66.5	166.2	0	0	0	110.2	F167 E168 S174 A175	F167-I171 WeakPolarHBondContact O-CG1 3.32Å; F167-I171 PolarHBondContact O-N 2.93Å; E168-I171 PolarHBondContact O-N 3.47Å; I171-S174 PolarHBondContact O-N 2.72Å; I171-A175 PolarHBondContact O-N 2.94Å
172	F	93.9	Very high	93.2	Very high	12 Å²	12	49.2 Å²	49.2	5%	0.053	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-47.6	178	-168.7	-80.2	0	0	0	111.7	F35 L39 V43 Y44 W77 E168 S174 A175 M176	F35-F172 HydrophobicContact CB-CE2 4.44Å; F35-F172 HydrophobicContact CB-CZ 4.29Å; F35-F172 HydrophobicContact CD1-CD2 4.48Å; F35-F172 AromaticContact CD1-CE2 3.94Å; F35-F172 HydrophobicContact CD1-CE2 3.94Å; F35-F172 HydrophobicContact CD1-CZ 4.35Å; F35-F172 WeakPolarHBondContact O-CE2 3.29Å; F35-F172 VanDerWaalsContact O-CZ 3.28Å; F35-F172 WeakPolarHBondContact O-CZ 3.34Å; L39-F172 HydrophobicContact CB-CD2 4.17Å; L39-F172 HydrophobicContact CB-CE2 3.53Å; V43-F172 HydrophobicContact CG1-CB 4.47Å; V43-F172 HydrophobicContact CG2-CD2 4.26Å; Y44-F172 AromaticContact CE2-CD1 3.69Å; Y44-F172 HydrophobicContact CE2-CD1 3.69Å; Y44-F172 HydrophobicContact CE2-CE1 4.2Å; Y44-F172 HydrophobicContact CE2-CG 4.17Å; W77-F172 AromaticContact CE3-CE1 3.81Å; W77-F172 HydrophobicContact CE3-CE1 3.81Å; W77-F172 AromaticContact CH2-CD1 3.54Å; W77-F172 HydrophobicContact CH2-CD1 3.54Å; W77-F172 AromaticContact CH2-CE1 3.61Å; W77-F172 HydrophobicContact CH2-CE1 3.61Å; W77-F172 HydrophobicContact CZ2-CD1 4.48Å; W77-F172 HydrophobicContact CZ2-CE1 4.47Å; W77-F172 AromaticContact CZ3-CD1 3.6Å; W77-F172 HydrophobicContact CZ3-CD1 3.6Å; W77-F172 AromaticContact CZ3-CE1 3.22Å; W77-F172 HydrophobicContact CZ3-CE1 3.22Å; W77-F172 HydrophobicContact CZ3-CZ 4.38Å; E168-F172 WeakPolarHBondContact O-CB 3.49Å; E168-F172 PolarHBondContact O-N 3.46Å; F172-S174 VanDerWaalsContact C-N 3.35Å; F172-S174 PolarHBondContact O-N 2.96Å; F172-A175 PolarHBondContact O-N 3.46Å; F172-M176 HydrophobicContact CD1-CG 3.91Å; F172-M176 HydrophobicContact CE1-CG 3.51Å; F172-M176 HydrophobicContact CE1-SD 4.09Å; F172-M176 HydrophobicContact CZ-CG 4.24Å; F172-M176 HydrophobicContact CZ-SD 4.28Å; F172-M176 WeakPolarHBondContact O-CG 3.42Å; F172-M176 PolarHBondContact O-N 2.86Å
173	L	94	Very high	93.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-44.8	177.4	-178.1	63.5	0	0	0	111.6	W77 Q133 F137 G138 V141 K169 T170 M176 Y177	W77-L173 HydrophobicContact CH2-CD1 4.24Å; W77-L173 HydrophobicContact CZ2-CD1 3.69Å; Q133-L173 HydrophobicContact CG-CD1 4.37Å; F137-L173 HydrophobicContact CB-CD1 3.99Å; F137-L173 HydrophobicContact CB-CD2 4.19Å; G138-L173 WeakPolarHBondContact O-CD2 3.39Å; V141-L173 HydrophobicContact CG2-CD2 4.31Å; K169-L173 WeakPolarHBondContact O-CB 3.08Å; K169-L173 PolarHBondContact O-N 3.02Å; T170-L173 PolarHBondContact O-N 3.37Å; L173-M176 PolarHBondContact O-N 3.41Å; L173-Y177 HydrophobicContact CD1-CD2 4.46Å; L173-Y177 HydrophobicContact CD1-CE2 3.87Å; L173-Y177 HydrophobicContact CD2-CE2 4.31Å; L173-Y177 HydrophobicContact CG-CD2 4.18Å; L173-Y177 HydrophobicContact CG-CE2 3.71Å; L173-Y177 WeakPolarHBondContact O-CD2 3.38Å; L173-Y177 PolarHBondContact O-N 3.48Å
174	S	93.8	Very high	93.2	Very high	63 Å²	63	43.6 Å²	43.6	44%	0.441	23%	0.23	S	C	.	.	H	α-helix	trans	-60.6	-44.4	175.3	-174.8	0	0	0	0	112	T170 I171 F172 M176 Y177 T178	T170-S174 WeakPolarHBondContact O-CB 3.28Å; T170-S174 PolarHBondContact O-N 2.74Å; I171-S174 PolarHBondContact O-N 2.72Å; F172-S174 VanDerWaalsContact C-N 3.35Å; F172-S174 PolarHBondContact O-N 2.96Å; S174-M176 VanDerWaalsContact C-N 3.31Å; S174-M176 PolarHBondContact O-N 3.41Å; S174-Y177 PolarHBondContact O-N 3.25Å; S174-T178 PolarHBondContact O-N 3.46Å; S174-T178 PolarHBondContact O-OG1 2.76Å; S174-T178 VanDerWaalsContact O-OG1 3.12Å
175	A	93.4	Very high	93.4	Very high	25 Å²	25	47.5 Å²	47.5	21%	0.207	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-41.8	177.7	0	0	0	0	0	111.6	F35 I171 F172 T178 F179	F35-A175 HydrophobicContact CE1-CB 3.99Å; I171-A175 PolarHBondContact O-N 2.94Å; F172-A175 PolarHBondContact O-N 3.46Å; A175-T178 WeakPolarHBondContact O-CB 3.17Å; A175-T178 PolarHBondContact O-N 2.86Å; A175-F179 WeakPolarHBondContact O-CD2 3.5Å; A175-F179 PolarHBondContact O-N 3.22Å
176	M	93.3	Very high	93.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.3	-35.9	177.4	-67.4	-58.1	-63	0	0	113.1	R32 F35 L36 W77 F172 L173 S174 F179 T180	R32-M176 HydrophobicContact CG-CE 4.44Å; F35-M176 HydrophobicContact CB-SD 4.16Å; L36-M176 HydrophobicContact CD2-CE 3.75Å; L36-M176 HydrophobicContact CD2-SD 4.43Å; L36-M176 HydrophobicContact CG-CE 4.28Å; W77-M176 HydrophobicContact CB-CE 4.02Å; W77-M176 HydrophobicContact CD2-CB 4.44Å; W77-M176 HydrophobicContact CD2-CE 3.9Å; W77-M176 HydrophobicContact CD2-CG 4.06Å; W77-M176 HydrophobicContact CE3-CG 4.33Å; W77-M176 HydrophobicContact CG-CE 3.65Å; W77-M176 HydrophobicContact CH2-CB 4.49Å; W77-M176 HydrophobicContact CH2-CG 4.06Å; W77-M176 HydrophobicContact CZ2-CB 3.7Å; W77-M176 HydrophobicContact CZ2-CG 3.71Å; W77-M176 HydrophobicContact CZ3-CG 4.37Å; F172-M176 HydrophobicContact CD1-CG 3.91Å; F172-M176 HydrophobicContact CE1-CG 3.51Å; F172-M176 HydrophobicContact CE1-SD 4.09Å; F172-M176 HydrophobicContact CZ-CG 4.24Å; F172-M176 HydrophobicContact CZ-SD 4.28Å; F172-M176 WeakPolarHBondContact O-CG 3.42Å; F172-M176 PolarHBondContact O-N 2.86Å; L173-M176 PolarHBondContact O-N 3.41Å; S174-M176 VanDerWaalsContact C-N 3.31Å; S174-M176 PolarHBondContact O-N 3.41Å; M176-F179 PolarHBondContact O-N 2.87Å; M176-F179 HydrophobicContact SD-CD2 4.31Å; M176-T180 PolarHBondContact O-N 3.06Å; M176-T180 PolarHBondContact O-OG1 3Å
177	Y	94.8	Very high	93.6	Very high	16 Å²	16	42.4 Å²	42.4	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-47.3	169.3	-78.8	-62.4	0	0	0	111.7	F130 Q133 S134 G138 F139 L173 S174 F179 T180 V181	F130-Y177 AromaticContact CD2-CD1 3.8Å; F130-Y177 HydrophobicContact CD2-CD1 3.8Å; F130-Y177 HydrophobicContact CD2-CE1 4.36Å; F130-Y177 AromaticContact CE2-CD1 3.48Å; F130-Y177 HydrophobicContact CE2-CD1 3.48Å; F130-Y177 VanDerWaalsContact CE2-CD1 3.48Å; F130-Y177 HydrophobicContact CE2-CE1 4.19Å; F130-Y177 HydrophobicContact CE2-CG 4.37Å; F130-Y177 HydrophobicContact CZ-CD1 4.19Å; Q133-Y177 HydrophobicContact CB-CE1 3.87Å; Q133-Y177 VanDerWaalsContact CD-CE1 3.44Å; Q133-Y177 HydrophobicContact CG-CD1 4.43Å; Q133-Y177 HydrophobicContact CG-CE1 3.65Å; Q133-Y177 VanDerWaalsContact NE2-CD1 3.28Å; Q133-Y177 VanDerWaalsContact NE2-CZ 3.3Å; Q133-Y177 PolarHBondContact O-OH 2.95Å; Q133-Y177 VanDerWaalsContact O-OH 3.07Å; S134-Y177 WeakPolarHBondContact CA-OH 3.41Å; S134-Y177 PolarHBondContact N-OH 3.34Å; S134-Y177 VanDerWaalsContact N-OH 3.12Å; G138-Y177 WeakPolarHBondContact O-CE2 3.32Å; G138-Y177 PolarHBondContact O-OH 3.44Å; F139-Y177 HydrophobicContact CD1-CD2 4.49Å; F139-Y177 HydrophobicContact CD1-CE2 4.08Å; L173-Y177 HydrophobicContact CD1-CD2 4.46Å; L173-Y177 HydrophobicContact CD1-CE2 3.87Å; L173-Y177 HydrophobicContact CD2-CE2 4.31Å; L173-Y177 HydrophobicContact CG-CD2 4.18Å; L173-Y177 HydrophobicContact CG-CE2 3.71Å; L173-Y177 WeakPolarHBondContact O-CD2 3.38Å; L173-Y177 PolarHBondContact O-N 3.48Å; S174-Y177 PolarHBondContact O-N 3.25Å; Y177-F179 VanDerWaalsContact C-N 3.32Å; Y177-F179 PolarHBondContact O-N 2.8Å; Y177-T180 PolarHBondContact O-N 3.13Å; Y177-T180 VanDerWaalsContact O-N 3.16Å; Y177-V181 WeakPolarHBondContact O-CG2 3.38Å; Y177-V181 PolarHBondContact O-N 2.84Å
178	T	94.2	Very high	93.6	Very high	76 Å²	76	40 Å²	40	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-58.9	-44	178.1	-56.3	0	0	0	0	111.4	S174 A175 T180 V181 I182	S174-T178 PolarHBondContact O-N 3.46Å; S174-T178 PolarHBondContact O-OG1 2.76Å; S174-T178 VanDerWaalsContact O-OG1 3.12Å; A175-T178 WeakPolarHBondContact O-CB 3.17Å; A175-T178 PolarHBondContact O-N 2.86Å; T178-T180 PolarHBondContact O-N 3.11Å; T178-V181 PolarHBondContact O-N 3.37Å; T178-I182 HydrophobicContact CG2-CD1 3.82Å; T178-I182 HydrophobicContact CG2-CG1 4.47Å; T178-I182 VanDerWaalsContact O-CG1 3.28Å; T178-I182 WeakPolarHBondContact O-CG1 3.28Å; T178-I182 PolarHBondContact O-N 2.9Å
179	F	93	Very high	93.6	Very high	31 Å²	31	36.8 Å²	36.8	14%	0.136	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-45.3	174.9	-77.4	-58.2	0	0	0	112.2	F28 V31 F35 A175 M176 Y177 V181 I182 T183	F28-F179 AromaticContact CD1-CD1 3.99Å; F28-F179 HydrophobicContact CD1-CD1 3.99Å; F28-F179 HydrophobicContact CD1-CE1 4.35Å; F28-F179 HydrophobicContact CE1-CD1 4.12Å; F28-F179 HydrophobicContact CE1-CE1 4.32Å; V31-F179 HydrophobicContact CB-CE1 4.5Å; V31-F179 HydrophobicContact CG1-CE1 3.61Å; V31-F179 HydrophobicContact CG1-CE2 4.33Å; V31-F179 HydrophobicContact CG1-CZ 3.4Å; F35-F179 AromaticContact CD1-CE2 3.96Å; F35-F179 HydrophobicContact CD1-CE2 3.96Å; F35-F179 AromaticContact CD2-CE2 3.87Å; F35-F179 HydrophobicContact CD2-CE2 3.87Å; F35-F179 HydrophobicContact CD2-CZ 4.12Å; F35-F179 AromaticContact CE1-CE2 3.87Å; F35-F179 HydrophobicContact CE1-CE2 3.87Å; F35-F179 AromaticContact CE2-CE2 3.78Å; F35-F179 HydrophobicContact CE2-CE2 3.78Å; F35-F179 AromaticContact CE2-CZ 3.79Å; F35-F179 HydrophobicContact CE2-CZ 3.79Å; F35-F179 AromaticContact CG-CE2 3.96Å; F35-F179 HydrophobicContact CG-CE2 3.96Å; F35-F179 AromaticContact CZ-CE2 3.78Å; F35-F179 HydrophobicContact CZ-CE2 3.78Å; F35-F179 HydrophobicContact CZ-CZ 4.05Å; A175-F179 WeakPolarHBondContact O-CD2 3.5Å; A175-F179 PolarHBondContact O-N 3.22Å; M176-F179 PolarHBondContact O-N 2.87Å; M176-F179 HydrophobicContact SD-CD2 4.31Å; Y177-F179 VanDerWaalsContact C-N 3.32Å; Y177-F179 PolarHBondContact O-N 2.8Å; F179-V181 VanDerWaalsContact C-N 3.35Å; F179-V181 PolarHBondContact O-N 3.13Å; F179-I182 PolarHBondContact O-N 3.15Å; F179-T183 WeakPolarHBondContact O-CG2 3.39Å; F179-T183 PolarHBondContact O-N 3.29Å; F179-T183 PolarHBondContact O-OG1 3.44Å
180	T	93.7	Very high	93.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-40.3	179.2	-55.3	0	0	0	0	111.9	Q80 F130 M176 Y177 T178 T183 I184	Q80-T180 PolarHBondContact NE2-OG1 2.88Å; F130-T180 HydrophobicContact CB-CG2 4.03Å; F130-T180 HydrophobicContact CD2-CG2 4.09Å; M176-T180 PolarHBondContact O-N 3.06Å; M176-T180 PolarHBondContact O-OG1 3Å; Y177-T180 PolarHBondContact O-N 3.13Å; Y177-T180 VanDerWaalsContact O-N 3.16Å; T178-T180 PolarHBondContact O-N 3.11Å; T180-T183 WeakPolarHBondContact CA-OG1 3.33Å; T180-T183 PolarHBondContact O-N 3.29Å; T180-T183 PolarHBondContact O-OG1 3.01Å; T180-I184 HydrophobicContact CG2-CD1 4.24Å; T180-I184 VanDerWaalsContact O-CG1 3.28Å; T180-I184 WeakPolarHBondContact O-CG1 3.4Å; T180-I184 PolarHBondContact O-N 2.95Å; T180-I184 VanDerWaalsContact O-N 3.09Å
181	V	95.2	Very high	93.4	Very high	64 Å²	64	36.8 Å²	36.8	39%	0.388	21%	0.208	S	C	.	.	H	α-helix	trans	-64.8	-43.9	175.5	173	0	0	0	0	110.9	F130 Y177 T178 F179 I184 L185	F130-V181 HydrophobicContact CD2-CG2 4.32Å; F130-V181 HydrophobicContact CE2-CG2 3.75Å; F130-V181 HydrophobicContact CZ-CG2 4.44Å; Y177-V181 WeakPolarHBondContact O-CG2 3.38Å; Y177-V181 PolarHBondContact O-N 2.84Å; T178-V181 PolarHBondContact O-N 3.37Å; F179-V181 VanDerWaalsContact C-N 3.35Å; F179-V181 PolarHBondContact O-N 3.13Å; V181-I184 PolarHBondContact O-N 2.93Å; V181-L185 HydrophobicContact CG1-CD1 4.26Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 3.31Å
182	I	93.8	Very high	93.3	Very high	55 Å²	55	37.7 Å²	37.7	28%	0.282	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-41.1	178.2	-64.7	165.3	0	0	0	111.1	F28 T178 F179 I184 L185 L186	F28-I182 HydrophobicContact CD1-CG2 4.14Å; F28-I182 HydrophobicContact CE1-CB 4.11Å; F28-I182 HydrophobicContact CE1-CD1 4.18Å; F28-I182 HydrophobicContact CE1-CG2 3.41Å; F28-I182 VanDerWaalsContact CE1-CG2 3.41Å; F28-I182 HydrophobicContact CE2-CG2 4.12Å; F28-I182 HydrophobicContact CZ-CG2 3.41Å; F28-I182 VanDerWaalsContact CZ-CG2 3.41Å; T178-I182 HydrophobicContact CG2-CD1 3.82Å; T178-I182 HydrophobicContact CG2-CG1 4.47Å; T178-I182 VanDerWaalsContact O-CG1 3.28Å; T178-I182 WeakPolarHBondContact O-CG1 3.28Å; T178-I182 PolarHBondContact O-N 2.9Å; F179-I182 PolarHBondContact O-N 3.15Å; I182-I184 VanDerWaalsContact C-N 3.35Å; I182-I184 PolarHBondContact O-N 3.36Å; I182-L185 PolarHBondContact O-N 2.87Å; I182-L186 HydrophobicContact CG2-CD1 3.92Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 WeakPolarHBondContact O-CB 3.48Å; I182-L186 WeakPolarHBondContact O-CG 3.5Å; I182-L186 PolarHBondContact O-N 3.11Å
183	T	92.4	Very high	93	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-39	177.7	56.2	0	0	0	0	112.1	H24 E126 F179 T180 L186 C187	H24-T183 WeakPolarHBondContact NE2-CB 3.23Å; E126-T183 PolarHBondContact OE1-OG1 3.49Å; F179-T183 WeakPolarHBondContact O-CG2 3.39Å; F179-T183 PolarHBondContact O-N 3.29Å; F179-T183 PolarHBondContact O-OG1 3.44Å; T180-T183 WeakPolarHBondContact CA-OG1 3.33Å; T180-T183 PolarHBondContact O-N 3.29Å; T180-T183 PolarHBondContact O-OG1 3.01Å; T183-L186 PolarHBondContact O-N 3.28Å; T183-C187 PolarHBondContact O-N 3.24Å; T183-C187 PolarHBondContact O-SG 2.9Å
184	I	94.4	Very high	92.8	Very high	26 Å²	26	39 Å²	39	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-49	172.1	-68.9	166	0	0	0	110.8	E126 I127 T180 V181 I182 L186 C187 I188	E126-I184 HydrophobicContact CB-CD1 4.07Å; E126-I184 HydrophobicContact CB-CG1 3.62Å; E126-I184 HydrophobicContact CG-CG1 4.44Å; I127-I184 HydrophobicContact CG1-CD1 4.14Å; T180-I184 HydrophobicContact CG2-CD1 4.24Å; T180-I184 VanDerWaalsContact O-CG1 3.28Å; T180-I184 WeakPolarHBondContact O-CG1 3.4Å; T180-I184 PolarHBondContact O-N 2.95Å; T180-I184 VanDerWaalsContact O-N 3.09Å; V181-I184 PolarHBondContact O-N 2.93Å; I182-I184 VanDerWaalsContact C-N 3.35Å; I182-I184 PolarHBondContact O-N 3.36Å; I184-L186 VanDerWaalsContact C-N 3.33Å; I184-L186 PolarHBondContact O-N 3.26Å; I184-C187 PolarHBondContact O-N 2.96Å; I184-I188 HydrophobicContact CG2-CD1 3.94Å; I184-I188 WeakPolarHBondContact O-CG1 3.5Å; I184-I188 PolarHBondContact O-N 2.94Å
185	L	94.4	Very high	92.5	Very high	104 Å²	104	39.8 Å²	39.8	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-61.2	-41.2	179.1	-69.5	174.5	0	0	0	112.2	V181 I182 I188 A189	V181-L185 HydrophobicContact CG1-CD1 4.26Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 3.31Å; I182-L185 PolarHBondContact O-N 2.87Å; L185-I188 PolarHBondContact O-N 3.47Å; L185-A189 WeakPolarHBondContact O-CB 3.03Å; L185-A189 PolarHBondContact O-N 3.32Å
186	L	92	Very high	92.2	Very high	27 Å²	27	41.3 Å²	41.3	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-39	176.1	-72.2	172.5	0	0	0	112	I20 F23 H24 F28 I182 T183 I184 I188 A189 E190	I20-L186 HydrophobicContact CG2-CD2 4.21Å; I20-L186 WeakPolarHBondContact CG2-O 3.21Å; F23-L186 HydrophobicContact CD1-CD2 4.3Å; H24-L186 HydrophobicContact CB-CB 4.36Å; H24-L186 HydrophobicContact CB-CD1 4.27Å; F28-L186 HydrophobicContact CD2-CD1 3.43Å; F28-L186 VanDerWaalsContact CD2-CD1 3.43Å; F28-L186 HydrophobicContact CE2-CD1 3.61Å; F28-L186 HydrophobicContact CG-CD1 4.01Å; F28-L186 HydrophobicContact CZ-CD1 4.31Å; I182-L186 HydrophobicContact CG2-CD1 3.92Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 WeakPolarHBondContact O-CB 3.48Å; I182-L186 WeakPolarHBondContact O-CG 3.5Å; I182-L186 PolarHBondContact O-N 3.11Å; T183-L186 PolarHBondContact O-N 3.28Å; I184-L186 VanDerWaalsContact C-N 3.33Å; I184-L186 PolarHBondContact O-N 3.26Å; L186-I188 VanDerWaalsContact C-N 3.34Å; L186-A189 PolarHBondContact O-N 3.35Å; L186-E190 WeakPolarHBondContact O-CB 3.09Å; L186-E190 PolarHBondContact O-N 3.13Å
187	C	91.8	Very high	91.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-37.3	175.3	-67.1	0	0	0	0	111.8	V119 R122 I123 T183 I184 E190 I191	V119-C187 HydrophobicContact CG1-CB 4.19Å; R122-C187 PolarHBondContact NH2-SG 2.02Å; R122-C187 VanDerWaalsContact NH2-SG 3.45Å; I123-C187 HydrophobicContact CD1-CB 3.88Å; I123-C187 HydrophobicContact CG1-CB 3.46Å; I123-C187 VanDerWaalsContact CG1-CB 3.46Å; T183-C187 PolarHBondContact O-N 3.24Å; T183-C187 PolarHBondContact O-SG 2.9Å; I184-C187 PolarHBondContact O-N 2.96Å; C187-E190 PolarHBondContact O-N 3.28Å; C187-I191 WeakPolarHBondContact O-CG1 3.35Å; C187-I191 PolarHBondContact O-N 3.2Å; C187-I191 VanDerWaalsContact O-N 3.13Å
188	I	93.6	Very high	91.3	Very high	86 Å²	86	48.3 Å²	48.3	44%	0.441	25%	0.248	S	C	.	.	H	α-helix	trans	-65.2	-44.8	173.5	-66.6	165.9	0	0	0	110.4	I123 I184 L185 L186 E190 I191 F192	I123-I188 HydrophobicContact CD1-CG1 4.17Å; I184-I188 HydrophobicContact CG2-CD1 3.94Å; I184-I188 WeakPolarHBondContact O-CG1 3.5Å; I184-I188 PolarHBondContact O-N 2.94Å; L185-I188 PolarHBondContact O-N 3.47Å; L186-I188 VanDerWaalsContact C-N 3.34Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.42Å; I188-I191 PolarHBondContact O-N 2.03Å; I188-F192 PolarHBondContact O-N 2.93Å
189	A	92.3	Very high	90.8	Very high	36 Å²	36	50.3 Å²	50.3	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-35.9	178.1	0	0	0	0	0	112	I20 L185 L186 F192 E193	I20-A189 HydrophobicContact CD1-CB 3.91Å; I20-A189 HydrophobicContact CG2-CB 4.27Å; L185-A189 WeakPolarHBondContact O-CB 3.03Å; L185-A189 PolarHBondContact O-N 3.32Å; L186-A189 PolarHBondContact O-N 3.35Å; A189-F192 PolarHBondContact O-N 3.44Å; A189-E193 PolarHBondContact O-N 2.66Å
190	E	91.4	Very high	90.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-45.5	172.9	172.9	167.6	-150.2	0	0	111.9	T18 I20 Y115 R122 L186 C187 I188 F192 E193 I194	T18-E190 HydrophobicContact CG2-CG 4.34Å; T18-E190 PolarHBondContact OG1-OE1 3.15Å; T18-E190 VanDerWaalsContact OG1-OE1 3.05Å; I20-E190 HydrophobicContact CB-CB 4.49Å; I20-E190 HydrophobicContact CG2-CB 4.06Å; Y115-E190 HydrophobicContact CE1-CG 4.48Å; Y115-E190 PolarHBondContact OH-OE1 3Å; R122-E190 IonicContact NH1-OE2 4Å; L186-E190 WeakPolarHBondContact O-CB 3.09Å; L186-E190 PolarHBondContact O-N 3.13Å; C187-E190 PolarHBondContact O-N 3.28Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.42Å; E190-F192 VanDerWaalsContact C-N 3.31Å; E190-F192 PolarHBondContact O-N 2.89Å; E190-E193 PolarHBondContact O-N 3.46Å; E190-I194 HydrophobicContact CG-CD1 4.01Å; E190-I194 WeakPolarHBondContact O-CD1 3.28Å; E190-I194 VanDerWaalsContact O-CG1 3.27Å; E190-I194 WeakPolarHBondContact O-CG1 3.17Å; E190-I194 PolarHBondContact O-N 3.44Å; E190-I194 VanDerWaalsContact O-N 3.12Å
191	I	91.4	Very high	89.4	Confident	25 Å²	25	57.3 Å²	57.3	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-44.6	174.1	-68.2	175.5	0	0	0	110.4	V119 L120 I123 C187 I188 I194 L195	V119-I191 HydrophobicContact CB-CD1 4.44Å; V119-I191 HydrophobicContact CB-CG1 4.21Å; V119-I191 HydrophobicContact CG1-CD1 3.91Å; V119-I191 HydrophobicContact CG1-CG1 3.66Å; L120-I191 HydrophobicContact CD2-CD1 3.67Å; L120-I191 HydrophobicContact CG-CD1 4.1Å; I123-I191 HydrophobicContact CD1-CD1 3.54Å; C187-I191 WeakPolarHBondContact O-CG1 3.35Å; C187-I191 PolarHBondContact O-N 3.2Å; C187-I191 VanDerWaalsContact O-N 3.13Å; I188-I191 PolarHBondContact O-N 2.03Å; I191-I194 PolarHBondContact O-N 3.08Å; I191-L195 HydrophobicContact CG2-CD1 3.81Å; I191-L195 HydrophobicContact CG2-CG 4.21Å; I191-L195 VanDerWaalsContact O-CG 3.3Å; I191-L195 WeakPolarHBondContact O-CG 3.14Å; I191-L195 PolarHBondContact O-N 3.44Å
192	F	91.5	Very high	88.5	Confident	140 Å²	140	59.3 Å²	59.3	61%	0.614	30%	0.301	S	S	*	.	H	α-helix	trans	-61.4	-45.3	179.6	-174.7	-99.9	0	0	0	112	I188 A189 E190 I194 L195 C196	I188-F192 PolarHBondContact O-N 2.93Å; A189-F192 PolarHBondContact O-N 3.44Å; E190-F192 VanDerWaalsContact C-N 3.31Å; E190-F192 PolarHBondContact O-N 2.89Å; F192-I194 VanDerWaalsContact C-N 3.29Å; F192-I194 PolarHBondContact O-N 2.79Å; F192-L195 PolarHBondContact O-N 3.09Å; F192-C196 VanDerWaalsContact CE1-SG 3.53Å; F192-C196 VanDerWaalsContact CZ-SG 3.57Å; F192-C196 WeakPolarHBondContact O-CB 3.15Å; F192-C196 PolarHBondContact O-N 3.26Å; F192-C196 PolarHBondContact O-SG 3.1Å; F192-C196 VanDerWaalsContact O-SG 3.38Å
193	E	89.6	Confident	87.8	Confident	33 Å²	33	61.4 Å²	61.4	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-57	-43.4	176	-174.1	-178.9	175.2	0	0	111.4	T18 I20 A189 E190 C196 R197	T18-E193 WeakPolarHBondContact CB-OE2 3Å; I20-E193 HydrophobicContact CD1-CB 4.11Å; I20-E193 VanDerWaalsContact CD1-OE2 3.28Å; I20-E193 WeakPolarHBondContact CD1-OE2 2.99Å; I20-E193 WeakPolarHBondContact CG1-OE2 3.42Å; A189-E193 PolarHBondContact O-N 2.66Å; E190-E193 PolarHBondContact O-N 3.46Å; E193-C196 PolarHBondContact O-N 3.29Å; E193-R197 WeakPolarHBondContact O-CG 3.48Å; E193-R197 PolarHBondContact O-N 2.84Å; E193-R197 IonicContact OE1-CZ 3.24Å; E193-R197 VanDerWaalsContact OE1-CZ 3.24Å; E193-R197 IonicContact OE1-NE 3.37Å; E193-R197 PolarHBondContact OE1-NE 3.41Å; E193-R197 IonicContact OE1-NH2 2.65Å; E193-R197 PolarHBondContact OE1-NH2 3.48Å
194	I	88.4	Confident	86.8	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-44.5	-179.9	-67.3	163.2	0	0	0	111.4	T18 L106 T112 Y115 I116 E190 I191 F192 R197 R198	T18-I194 HydrophobicContact CG2-CD1 3.91Å; T18-I194 HydrophobicContact CG2-CG1 3.57Å; L106-I194 HydrophobicContact CD1-CG2 4.4Å; T112-I194 HydrophobicContact CG2-CG2 3.75Å; Y115-I194 HydrophobicContact CD1-CD1 3.48Å; Y115-I194 VanDerWaalsContact CD1-CD1 3.48Å; Y115-I194 HydrophobicContact CE1-CD1 3.3Å; I116-I194 HydrophobicContact CD1-CG2 4.36Å; I116-I194 HydrophobicContact CG1-CG2 4.35Å; E190-I194 HydrophobicContact CG-CD1 4.01Å; E190-I194 WeakPolarHBondContact O-CD1 3.28Å; E190-I194 VanDerWaalsContact O-CG1 3.27Å; E190-I194 WeakPolarHBondContact O-CG1 3.17Å; E190-I194 PolarHBondContact O-N 3.44Å; E190-I194 VanDerWaalsContact O-N 3.12Å; I191-I194 PolarHBondContact O-N 3.08Å; F192-I194 VanDerWaalsContact C-N 3.29Å; F192-I194 PolarHBondContact O-N 2.79Å; I194-R197 PolarHBondContact O-N 3.48Å; I194-R198 WeakPolarHBondContact O-CB 3.41Å; I194-R198 PolarHBondContact O-N 3Å
195	L	87.8	Confident	85	Confident	80 Å²	80	77.8 Å²	77.8	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-45.4	177.2	-69.9	174.3	0	0	0	111	I116 I191 F192 R198 L199	I116-L195 HydrophobicContact CD1-CD2 4.47Å; I191-L195 HydrophobicContact CG2-CD1 3.81Å; I191-L195 HydrophobicContact CG2-CG 4.21Å; I191-L195 VanDerWaalsContact O-CG 3.3Å; I191-L195 WeakPolarHBondContact O-CG 3.14Å; I191-L195 PolarHBondContact O-N 3.44Å; F192-L195 PolarHBondContact O-N 3.09Å; L195-R198 PolarHBondContact O-N 3.32Å; L195-L199 WeakPolarHBondContact O-CG 3.38Å; L195-L199 PolarHBondContact O-N 3.29Å
196	C	88	Confident	84.6	Confident	58 Å²	58	76.5 Å²	76.5	39%	0.392	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-47.5	176.8	-74.1	0	0	0	0	112.2	F192 E193 R198 L199 G200	F192-C196 VanDerWaalsContact CE1-SG 3.53Å; F192-C196 VanDerWaalsContact CZ-SG 3.57Å; F192-C196 WeakPolarHBondContact O-CB 3.15Å; F192-C196 PolarHBondContact O-N 3.26Å; F192-C196 PolarHBondContact O-SG 3.1Å; F192-C196 VanDerWaalsContact O-SG 3.38Å; E193-C196 PolarHBondContact O-N 3.29Å; C196-R198 VanDerWaalsContact C-N 3.34Å; C196-R198 PolarHBondContact O-N 3.25Å; C196-L199 PolarHBondContact O-N 3.4Å; C196-G200 PolarHBondContact O-N 2.84Å
197	R	84.7	Confident	84.2	Confident	92 Å²	92	79.1 Å²	79.1	35%	0.347	41%	0.407	S	S	.	.	H	α-helix	trans	-60.8	-44.1	177.8	-72.1	-178.2	-177.5	-163.1	3.2	111.4	P17 L106 E193 I194 G200 Y201	P17-R197 PolarHBondContact O-NH1 3.36Å; P17-R197 VanDerWaalsContact O-NH1 3.15Å; L106-R197 HydrophobicContact CD1-CB 4.25Å; L106-R197 HydrophobicContact CD2-CB 3.98Å; E193-R197 WeakPolarHBondContact O-CG 3.48Å; E193-R197 PolarHBondContact O-N 2.84Å; E193-R197 IonicContact OE1-CZ 3.24Å; E193-R197 VanDerWaalsContact OE1-CZ 3.24Å; E193-R197 IonicContact OE1-NE 3.37Å; E193-R197 PolarHBondContact OE1-NE 3.41Å; E193-R197 IonicContact OE1-NH2 2.65Å; E193-R197 PolarHBondContact OE1-NH2 3.48Å; I194-R197 PolarHBondContact O-N 3.48Å; R197-G200 PolarHBondContact O-N 3.29Å; R197-Y201 WeakPolarHBondContact O-CD2 3.5Å; R197-Y201 PolarHBondContact O-N 2.96Å; R197-Y201 VanDerWaalsContact O-N 3.16Å
198	R	83	Confident	83.7	Confident	71 Å²	71	83.5 Å²	83.5	27%	0.268	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-40.5	179.2	-171	176.4	-178.4	-177.4	-2.8	113	I194 L195 C196 G200 Y201 L202	I194-R198 WeakPolarHBondContact O-CB 3.41Å; I194-R198 PolarHBondContact O-N 3Å; L195-R198 PolarHBondContact O-N 3.32Å; C196-R198 VanDerWaalsContact C-N 3.34Å; C196-R198 PolarHBondContact O-N 3.25Å; R198-G200 VanDerWaalsContact C-N 3.3Å; R198-G200 PolarHBondContact O-N 2.91Å; R198-Y201 PolarHBondContact O-N 3.11Å; R198-L202 PolarHBondContact O-N 2.81Å; R198-L202 VanDerWaalsContact O-N 3.15Å
199	L	83.9	Confident	83.2	Confident	117 Å²	117	83.4 Å²	83.4	61%	0.613	43%	0.429	S	S	*	.	H	α-helix	trans	-63.1	-37.9	174.1	-72.5	171.3	0	0	0	111.7	L195 C196 Y201 L202 S203	L195-L199 WeakPolarHBondContact O-CG 3.38Å; L195-L199 PolarHBondContact O-N 3.29Å; C196-L199 PolarHBondContact O-N 3.4Å; L199-Y201 PolarHBondContact O-N 3.3Å; L199-L202 PolarHBondContact O-N 2.98Å; L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 3.01Å
200	G	82.3	Confident	82.6	Confident	34 Å²	34	86.3 Å²	86.3	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-60.3	-41.8	174.2	0	0	0	0	0	113.3	C196 R197 R198 S203 N204	C196-G200 PolarHBondContact O-N 2.84Å; R197-G200 PolarHBondContact O-N 3.29Å; R198-G200 VanDerWaalsContact C-N 3.3Å; R198-G200 PolarHBondContact O-N 2.91Å; G200-S203 PolarHBondContact O-N 2.75Å; G200-N204 PolarHBondContact O-N 2.89Å
201	Y	75.2	Confident	82	Confident	144 Å²	144	92.1 Å²	92.1	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-63.7	-43.9	174.3	-79.8	-77	0	0	0	112.4	L106 R197 R198 L199 S203 N204 Q205	L106-Y201 HydrophobicContact CD2-CE2 3.76Å; L106-Y201 HydrophobicContact CG-CD2 4.47Å; L106-Y201 HydrophobicContact CG-CE2 4.06Å; R197-Y201 WeakPolarHBondContact O-CD2 3.5Å; R197-Y201 PolarHBondContact O-N 2.96Å; R197-Y201 VanDerWaalsContact O-N 3.16Å; R198-Y201 PolarHBondContact O-N 3.11Å; L199-Y201 PolarHBondContact O-N 3.3Å; Y201-S203 VanDerWaalsContact C-N 3.32Å; Y201-S203 PolarHBondContact O-N 3.44Å; Y201-N204 PolarHBondContact O-N 3.34Å; Y201-Q205 PolarHBondContact O-N 3.38Å
202	L	76.4	Confident	81.3	Confident	107 Å²	107	96.9 Å²	96.9	56%	0.56	49%	0.49	S	S	*	.	H	α-helix	trans	-67.1	-30.4	178.4	-70.8	171.8	0	0	0	113.3	R198 L199	R198-L202 PolarHBondContact O-N 2.81Å; R198-L202 VanDerWaalsContact O-N 3.15Å; L199-L202 PolarHBondContact O-N 2.98Å
203	S	80.1	Confident	80.5	Confident	99 Å²	99	93.5 Å²	93.5	69%	0.692	48%	0.481	S	S	*	.	H	α-helix	trans	-78.6	-20.4	178.4	-174.2	0	0	0	0	113.6	L199 G200 Y201	L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 3.01Å; G200-S203 PolarHBondContact O-N 2.75Å; Y201-S203 VanDerWaalsContact C-N 3.32Å; Y201-S203 PolarHBondContact O-N 3.44Å
204	N	70.4	Confident	79.8	Confident	155 Å²	155	98.6 Å²	98.6	83%	0.829	51%	0.508	S	S	*	.			trans	-95.4	-0.9	-179.8	-88.8	-5.9	0	0	0	113.3	G200 Y201	G200-N204 PolarHBondContact O-N 2.89Å; Y201-N204 PolarHBondContact O-N 3.34Å
205	Q	57.1	Low	79	Confident	220 Å²	220	107 Å²	107	100%	1.028	55%	0.551	S	S	*	*			trans	-102.7	0	177.5	-168.8	174.1	13.1	0	0	110.6	Y201	Y201-Q205 PolarHBondContact O-N 3.38Å

Retrieved 205 of 205 residues in 180.8 ms (Link to these results)

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