A0A096NBJ9_PAPAN Loading...

Interferon beta

AlphaFold DB , UniProt , Accession A0A096NBJ9, Species PAPAN (Papio anubis, Olive baboon), Gene IFNB1, Length 187 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	56.1	Low	72.7	Confident	219 Å²	219	113.1 Å²	113.1	100%	1.079	60%	0.6	S	S	*	*				0	-30.9	0	-75.6	172.6	67.1	0	0	113.2
2	T	61.1	Low	73.2	Confident	114 Å²	114	113.7 Å²	113.7	70%	0.699	60%	0.603	S	S	*	*	H	α-helix	trans	-61.4	-42.3	179.7	11.7	0	0	0	0	115.1	K4 C5 L6	T2-K4 PolarHBondContact O-N 3.03Å; T2-C5 PolarHBondContact O-N 3.04Å; T2-L6 WeakPolarHBondContact O-CG 3.4Å; T2-L6 PolarHBondContact O-N 3.34Å
3	N	66	Low	73.2	Confident	137 Å²	137	113 Å²	113	73%	0.733	60%	0.599	S	S	*	*	H	α-helix	trans	-65.5	-34.1	-179.5	-105.4	-13.1	0	0	0	114.4	L7	N3-L7 WeakPolarHBondContact O-CB 3.41Å; N3-L7 PolarHBondContact O-N 3.34Å
4	K	72.6	Confident	72.7	Confident	155 Å²	155	110.4 Å²	110.4	67%	0.674	59%	0.593	S	S	*	*	H	α-helix	trans	-71.3	-36.2	179	-166.9	176.2	-179.9	179.9	0	111.5	T2 Q8	T2-K4 PolarHBondContact O-N 3.03Å; K4-Q8 PolarHBondContact O-N 2.91Å; K4-Q8 VanDerWaalsContact O-N 3.11Å
5	C	75.3	Confident	72.3	Confident	67 Å²	67	112.3 Å²	112.3	45%	0.453	59%	0.594	S	S	.	*	H	α-helix	trans	-69	-44.9	175.4	-164.1	0	0	0	0	111.3	T2 L7 Q8 I9	T2-C5 PolarHBondContact O-N 3.04Å; C5-L7 VanDerWaalsContact C-N 3.34Å; C5-L7 PolarHBondContact O-N 3.42Å; C5-Q8 PolarHBondContact O-N 3.36Å; C5-I9 VanDerWaalsContact O-CG1 3.26Å; C5-I9 WeakPolarHBondContact O-CG1 3.4Å; C5-I9 PolarHBondContact O-N 3.41Å
6	L	77.1	Confident	72.1	Confident	105 Å²	105	108.6 Å²	108.6	55%	0.55	58%	0.58	S	S	.	*	H	α-helix	trans	-60.7	-41.2	175	-70.9	170.4	0	0	0	112.3	T2 I9 A10	T2-L6 WeakPolarHBondContact O-CG 3.4Å; T2-L6 PolarHBondContact O-N 3.34Å; L6-I9 PolarHBondContact O-N 3.45Å; L6-A10 VanDerWaalsContact O-CB 3.31Å; L6-A10 WeakPolarHBondContact O-CB 3.23Å; L6-A10 PolarHBondContact O-N 2.95Å
7	L	81.8	Confident	71.8	Confident	116 Å²	116	107.1 Å²	107.1	61%	0.607	58%	0.576	S	S	*	*	H	α-helix	trans	-64	-42.9	176.6	-162	95.5	0	0	0	112	N3 C5 A10 L11	N3-L7 WeakPolarHBondContact O-CB 3.41Å; N3-L7 PolarHBondContact O-N 3.34Å; C5-L7 VanDerWaalsContact C-N 3.34Å; C5-L7 PolarHBondContact O-N 3.42Å; L7-A10 PolarHBondContact O-N 3.43Å; L7-L11 HydrophobicContact CD2-CD1 4.09Å; L7-L11 HydrophobicContact CG-CD1 4.18Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CD1 3.38Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.11Å
8	Q	76.8	Confident	71.5	Confident	112 Å²	112	105.8 Å²	105.8	52%	0.523	57%	0.572	S	S	.	*	H	α-helix	trans	-65.4	-42	177	-81.6	177	-46.3	0	0	112.2	K4 C5 L11 L12	K4-Q8 PolarHBondContact O-N 2.91Å; K4-Q8 VanDerWaalsContact O-N 3.11Å; C5-Q8 PolarHBondContact O-N 3.36Å; Q8-L11 PolarHBondContact O-N 3.42Å; Q8-L12 WeakPolarHBondContact O-CB 3.29Å; Q8-L12 VanDerWaalsContact O-CG 3.31Å; Q8-L12 WeakPolarHBondContact O-CG 3.47Å; Q8-L12 PolarHBondContact O-N 2.94Å
9	I	79.2	Confident	71.5	Confident	87 Å²	87	103.5 Å²	103.5	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-62.8	-46.2	175.2	-66.9	165	0	0	0	110.1	C5 L6 L11 L12 L13	C5-I9 VanDerWaalsContact O-CG1 3.26Å; C5-I9 WeakPolarHBondContact O-CG1 3.4Å; C5-I9 PolarHBondContact O-N 3.41Å; L6-I9 PolarHBondContact O-N 3.45Å; I9-L11 PolarHBondContact O-N 3.44Å; I9-L12 PolarHBondContact O-N 2.83Å; I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.45Å; I9-L13 VanDerWaalsContact O-CG 3.29Å; I9-L13 WeakPolarHBondContact O-CG 3.44Å; I9-L13 PolarHBondContact O-N 3.41Å
10	A	77.5	Confident	71.3	Confident	49 Å²	49	100.7 Å²	100.7	41%	0.405	55%	0.553	S	S	.	*	H	α-helix	trans	-60.9	-43.3	177.5	0	0	0	0	0	112.2	L6 L7 L13 C14	L6-A10 VanDerWaalsContact O-CB 3.31Å; L6-A10 WeakPolarHBondContact O-CB 3.23Å; L6-A10 PolarHBondContact O-N 2.95Å; L7-A10 PolarHBondContact O-N 3.43Å; A10-L13 PolarHBondContact O-N 2.9Å; A10-C14 PolarHBondContact O-N 3.27Å; A10-C14 PolarHBondContact O-SG 3.48Å; A10-C14 VanDerWaalsContact O-SG 3.34Å
11	L	76.8	Confident	71.2	Confident	83 Å²	83	97.5 Å²	97.5	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-47.4	175.6	-81.6	158.7	0	0	0	111.6	L7 Q8 I9 L13 C14 F15	L7-L11 HydrophobicContact CD2-CD1 4.09Å; L7-L11 HydrophobicContact CG-CD1 4.18Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CD1 3.38Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.11Å; Q8-L11 PolarHBondContact O-N 3.42Å; I9-L11 PolarHBondContact O-N 3.44Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.5Å; L11-C14 PolarHBondContact O-N 2.6Å; L11-F15 HydrophobicContact CB-CD2 4.47Å; L11-F15 HydrophobicContact CB-CE2 4.37Å; L11-F15 HydrophobicContact CD2-CE2 3.96Å; L11-F15 WeakPolarHBondContact O-CD2 3.29Å; L11-F15 PolarHBondContact O-N 2.73Å
12	L	78	Confident	72	Confident	120 Å²	120	92.7 Å²	92.7	63%	0.628	51%	0.514	S	S	*	.	H	α-helix	trans	-61.2	-38.9	178.1	-74.2	166.8	0	0	0	112.3	Q8 I9 S16	Q8-L12 WeakPolarHBondContact O-CB 3.29Å; Q8-L12 VanDerWaalsContact O-CG 3.31Å; Q8-L12 WeakPolarHBondContact O-CG 3.47Å; Q8-L12 PolarHBondContact O-N 2.94Å; I9-L12 PolarHBondContact O-N 2.83Å; L12-S16 WeakPolarHBondContact O-CB 3.26Å; L12-S16 PolarHBondContact O-N 3.47Å; L12-S16 PolarHBondContact O-OG 3.48Å
13	L	73.1	Confident	73	Confident	105 Å²	105	88.4 Å²	88.4	55%	0.55	49%	0.489	S	S	.	.	H	α-helix	trans	-66.5	-40.2	174.7	-69.8	170.5	0	0	0	111.9	I9 A10 L11 S16 T17	I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.45Å; I9-L13 VanDerWaalsContact O-CG 3.29Å; I9-L13 WeakPolarHBondContact O-CG 3.44Å; I9-L13 PolarHBondContact O-N 3.41Å; A10-L13 PolarHBondContact O-N 2.9Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.5Å; L13-S16 WeakPolarHBondContact CA-OG 3.36Å; L13-S16 PolarHBondContact O-OG 2.97Å; L13-T17 WeakPolarHBondContact O-CB 3.45Å; L13-T17 VanDerWaalsContact O-CG2 3.29Å; L13-T17 WeakPolarHBondContact O-CG2 3.41Å; L13-T17 PolarHBondContact O-N 3.08Å; L13-T17 PolarHBondContact O-OG1 3Å
14	C	66.6	Low	73.9	Confident	76 Å²	76	82.2 Å²	82.2	51%	0.514	46%	0.455	S	S	.	.	H	α-helix	trans	-66	-41.6	175	-72.7	0	0	0	0	112.7	A10 L11 T17 T18	A10-C14 PolarHBondContact O-N 3.27Å; A10-C14 PolarHBondContact O-SG 3.48Å; A10-C14 VanDerWaalsContact O-SG 3.34Å; L11-C14 PolarHBondContact O-N 2.6Å; C14-T17 WeakPolarHBondContact CA-OG1 3.41Å; C14-T17 PolarHBondContact O-OG1 2.78Å; C14-T18 WeakPolarHBondContact O-CB 3.43Å; C14-T18 VanDerWaalsContact O-CG2 3.29Å; C14-T18 WeakPolarHBondContact O-CG2 3.29Å; C14-T18 PolarHBondContact O-N 3.05Å; C14-T18 VanDerWaalsContact O-N 3.08Å; C14-T18 PolarHBondContact O-OG1 3.23Å
15	F	67.3	Low	74.6	Confident	140 Å²	140	77.2 Å²	77.2	61%	0.614	44%	0.436	S	S	*	.	H	α-helix	trans	-67.7	-40.5	177.8	-76.7	-66.1	0	0	0	112.3	L11 T18 A19	L11-F15 HydrophobicContact CB-CD2 4.47Å; L11-F15 HydrophobicContact CB-CE2 4.37Å; L11-F15 HydrophobicContact CD2-CE2 3.96Å; L11-F15 WeakPolarHBondContact O-CD2 3.29Å; L11-F15 PolarHBondContact O-N 2.73Å; F15-T18 WeakPolarHBondContact CA-OG1 3.05Å; F15-T18 PolarHBondContact O-OG1 2.91Å; F15-A19 VanDerWaalsContact O-CB 3.3Å; F15-A19 WeakPolarHBondContact O-CB 3.31Å; F15-A19 PolarHBondContact O-N 2.79Å
16	S	69.1	Low	75.2	Confident	52 Å²	52	78.3 Å²	78.3	36%	0.364	44%	0.437	S	S	.	.	H	α-helix	trans	-68.1	-41.6	178.5	52.6	0	0	0	0	112.6	L12 L13 L20	L12-S16 WeakPolarHBondContact O-CB 3.26Å; L12-S16 PolarHBondContact O-N 3.47Å; L12-S16 PolarHBondContact O-OG 3.48Å; L13-S16 WeakPolarHBondContact CA-OG 3.36Å; L13-S16 PolarHBondContact O-OG 2.97Å; S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 WeakPolarHBondContact O-CD1 3.26Å; S16-L20 WeakPolarHBondContact O-CG 3.44Å; S16-L20 PolarHBondContact O-N 3.18Å; S16-L20 VanDerWaalsContact O-N 3.07Å
17	T	65.7	Low	75.7	Confident	84 Å²	84	73.5 Å²	73.5	52%	0.515	41%	0.412	S	S	.	.	H	α-helix	trans	-65.2	-42.6	176.3	48.5	0	0	0	0	112.5	L13 C14 L20 S21	L13-T17 WeakPolarHBondContact O-CB 3.45Å; L13-T17 VanDerWaalsContact O-CG2 3.29Å; L13-T17 WeakPolarHBondContact O-CG2 3.41Å; L13-T17 PolarHBondContact O-N 3.08Å; L13-T17 PolarHBondContact O-OG1 3Å; C14-T17 WeakPolarHBondContact CA-OG1 3.41Å; C14-T17 PolarHBondContact O-OG1 2.78Å; T17-L20 PolarHBondContact O-N 2.96Å; T17-S21 WeakPolarHBondContact O-CB 3.44Å; T17-S21 PolarHBondContact O-N 3.48Å
18	T	67.6	Low	76.2	Confident	84 Å²	84	68 Å²	68	52%	0.515	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-42.1	177.5	49.5	0	0	0	0	112.6	C14 F15 L20 S21 M22	C14-T18 WeakPolarHBondContact O-CB 3.43Å; C14-T18 VanDerWaalsContact O-CG2 3.29Å; C14-T18 WeakPolarHBondContact O-CG2 3.29Å; C14-T18 PolarHBondContact O-N 3.05Å; C14-T18 VanDerWaalsContact O-N 3.08Å; C14-T18 PolarHBondContact O-OG1 3.23Å; F15-T18 WeakPolarHBondContact CA-OG1 3.05Å; F15-T18 PolarHBondContact O-OG1 2.91Å; T18-L20 PolarHBondContact O-N 3Å; T18-S21 PolarHBondContact O-N 3.31Å; T18-M22 WeakPolarHBondContact O-CB 3.48Å; T18-M22 PolarHBondContact O-N 3Å
19	A	70.3	Confident	76.9	Confident	61 Å²	61	68.8 Å²	68.8	50%	0.504	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-44.3	175.7	0	0	0	0	0	112.1	F15 M22 S23	F15-A19 VanDerWaalsContact O-CB 3.3Å; F15-A19 WeakPolarHBondContact O-CB 3.31Å; F15-A19 PolarHBondContact O-N 2.79Å; A19-M22 PolarHBondContact O-N 2.98Å; A19-S23 PolarHBondContact O-N 2.99Å
20	L	67.4	Low	77.5	Confident	48 Å²	48	67.3 Å²	67.3	25%	0.251	38%	0.378	S	S	.	.	H	α-helix	trans	-67.6	-38.8	178	-73.7	170.5	0	0	0	113	S16 T17 T18 M22 S23 Y24 K126	S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 WeakPolarHBondContact O-CD1 3.26Å; S16-L20 WeakPolarHBondContact O-CG 3.44Å; S16-L20 PolarHBondContact O-N 3.18Å; S16-L20 VanDerWaalsContact O-N 3.07Å; T17-L20 PolarHBondContact O-N 2.96Å; T18-L20 PolarHBondContact O-N 3Å; L20-M22 VanDerWaalsContact C-N 3.3Å; L20-M22 PolarHBondContact O-N 3.4Å; L20-S23 PolarHBondContact O-N 2.97Å; L20-S23 PolarHBondContact O-OG 2.84Å; L20-Y24 VanDerWaalsContact O-CD2 3.31Å; L20-Y24 WeakPolarHBondContact O-CD2 3.41Å; L20-Y24 PolarHBondContact O-N 3.14Å; L20-Y24 VanDerWaalsContact O-N 3.11Å; L20-K126 HydrophobicContact CD2-CD 4.48Å
21	S	70.3	Confident	78.3	Confident	34 Å²	34	65.1 Å²	65.1	24%	0.238	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-41.6	173.2	138.1	0	0	0	0	111.1	T17 T18 N25 N187	T17-S21 WeakPolarHBondContact O-CB 3.44Å; T17-S21 PolarHBondContact O-N 3.48Å; T18-S21 PolarHBondContact O-N 3.31Å; S21-N25 PolarHBondContact O-N 2.96Å; S21-N25 VanDerWaalsContact O-N 3.11Å; S21-N25 PolarHBondContact O-ND2 2.97Å; S21-N25 VanDerWaalsContact O-ND2 3.09Å; S21-N187 WeakPolarHBondContact CB-ND2 3.16Å; S21-N187 PolarHBondContact OG-ND2 2.73Å
22	M	73.4	Confident	79.1	Confident	117 Å²	117	64.9 Å²	64.9	58%	0.576	35%	0.352	S	S	*	.	H	α-helix	trans	-66.2	-39	177.3	-167.8	61.8	-121.3	0	0	111.8	T18 A19 L20 N25 L26	T18-M22 WeakPolarHBondContact O-CB 3.48Å; T18-M22 PolarHBondContact O-N 3Å; A19-M22 PolarHBondContact O-N 2.98Å; L20-M22 VanDerWaalsContact C-N 3.3Å; L20-M22 PolarHBondContact O-N 3.4Å; M22-N25 HydrophobicContact CE-CB 4.41Å; M22-N25 PolarHBondContact O-N 3.12Å; M22-L26 WeakPolarHBondContact O-CB 3.4Å; M22-L26 PolarHBondContact O-N 2.77Å
23	S	81.6	Confident	79.9	Confident	25 Å²	25	62 Å²	62	18%	0.175	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-42.2	177.6	73.5	0	0	0	0	112.3	A19 L20 L26 L27	A19-S23 PolarHBondContact O-N 2.99Å; L20-S23 PolarHBondContact O-N 2.97Å; L20-S23 PolarHBondContact O-OG 2.84Å; S23-L26 PolarHBondContact O-N 2.81Å; S23-L27 VanDerWaalsContact O-CB 3.3Å; S23-L27 WeakPolarHBondContact O-CB 3.47Å; S23-L27 PolarHBondContact O-N 3.06Å
24	Y	84.1	Confident	80.9	Confident	6 Å²	6	58.1 Å²	58.1	2%	0.024	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-36	176.2	-82.9	-63.8	0	0	0	113.7	L20 L27 G28 K73 E74 A77 I122 L185	L20-Y24 VanDerWaalsContact O-CD2 3.31Å; L20-Y24 WeakPolarHBondContact O-CD2 3.41Å; L20-Y24 PolarHBondContact O-N 3.14Å; L20-Y24 VanDerWaalsContact O-N 3.11Å; Y24-L27 HydrophobicContact CD1-CD2 4.17Å; Y24-L27 HydrophobicContact CE1-CD2 4.5Å; Y24-L27 PolarHBondContact O-N 2.87Å; Y24-G28 PolarHBondContact O-N 3.11Å; Y24-K73 HydrophobicContact CD1-CB 4.2Å; Y24-K73 HydrophobicContact CD2-CB 4.43Å; Y24-K73 HydrophobicContact CD2-CD 3.96Å; Y24-K73 HydrophobicContact CE1-CB 3.92Å; Y24-K73 HydrophobicContact CE2-CB 4.13Å; Y24-K73 HydrophobicContact CE2-CD 4.34Å; Y24-K73 HydrophobicContact CG-CB 4.45Å; Y24-K73 HydrophobicContact CG-CD 4.05Å; Y24-E74 WeakPolarHBondContact OH-CG 3.27Å; Y24-E74 PolarHBondContact OH-OE1 3.27Å; Y24-A77 HydrophobicContact CE1-CB 4.35Å; Y24-I122 HydrophobicContact CE1-CG2 4.44Å; Y24-L185 WeakPolarHBondContact CB-O 3.25Å; Y24-L185 HydrophobicContact CD1-CD2 4.09Å; Y24-L185 HydrophobicContact CE1-CD2 4.32Å
25	N	87.2	Confident	82.3	Confident	50 Å²	50	54.5 Å²	54.5	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-65.7	-42.6	174.4	-75.4	-39	0	0	0	111.6	S21 M22 G28 F29 N187	S21-N25 PolarHBondContact O-N 2.96Å; S21-N25 VanDerWaalsContact O-N 3.11Å; S21-N25 PolarHBondContact O-ND2 2.97Å; S21-N25 VanDerWaalsContact O-ND2 3.09Å; M22-N25 HydrophobicContact CE-CB 4.41Å; M22-N25 PolarHBondContact O-N 3.12Å; N25-G28 PolarHBondContact O-N 2.98Å; N25-F29 PolarHBondContact O-N 3.33Å; N25-N187 PolarHBondContact ND2-ND2 3.21Å; N25-N187 PolarHBondContact OD1-N 3.28Å
26	L	88.2	Confident	83.7	Confident	91 Å²	91	53.7 Å²	53.7	48%	0.476	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-47.7	174.1	177.5	60.8	0	0	0	111	M22 S23 G28 F29 L30	M22-L26 WeakPolarHBondContact O-CB 3.4Å; M22-L26 PolarHBondContact O-N 2.77Å; S23-L26 PolarHBondContact O-N 2.81Å; L26-G28 VanDerWaalsContact C-N 3.31Å; L26-G28 PolarHBondContact O-N 3.43Å; L26-F29 WeakPolarHBondContact O-CB 3.45Å; L26-F29 PolarHBondContact O-N 3.14Å; L26-F29 VanDerWaalsContact O-N 3.11Å; L26-L30 HydrophobicContact CD1-CD1 4.21Å; L26-L30 HydrophobicContact CD1-CG 4.16Å; L26-L30 HydrophobicContact CG-CD1 4.05Å; L26-L30 HydrophobicContact CG-CG 4.41Å; L26-L30 WeakPolarHBondContact O-CG 3.5Å; L26-L30 PolarHBondContact O-N 3.43Å
27	L	88.7	Confident	85.1	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-55.7	-47.4	175.3	176.4	60.1	0	0	0	111.2	S23 Y24 F29 L30 Q31 L119 I122 L185	S23-L27 VanDerWaalsContact O-CB 3.3Å; S23-L27 WeakPolarHBondContact O-CB 3.47Å; S23-L27 PolarHBondContact O-N 3.06Å; Y24-L27 HydrophobicContact CD1-CD2 4.17Å; Y24-L27 HydrophobicContact CE1-CD2 4.5Å; Y24-L27 PolarHBondContact O-N 2.87Å; L27-F29 VanDerWaalsContact C-N 3.28Å; L27-F29 PolarHBondContact O-N 3.24Å; L27-L30 PolarHBondContact O-N 3.38Å; L27-Q31 WeakPolarHBondContact O-CB 3.47Å; L27-Q31 PolarHBondContact O-N 3.39Å; L27-L119 HydrophobicContact CD1-CD2 3.84Å; L27-L119 HydrophobicContact CD1-CG 4.07Å; L27-L119 HydrophobicContact CD2-CD2 3.72Å; L27-L119 HydrophobicContact CG-CD2 4.24Å; L27-I122 HydrophobicContact CB-CD1 3.71Å; L27-I122 HydrophobicContact CD1-CD1 3.96Å; L27-I122 HydrophobicContact CD2-CD1 3.81Å; L27-I122 HydrophobicContact CD2-CG2 4.35Å; L27-I122 HydrophobicContact CG-CD1 4.01Å; L27-L185 HydrophobicContact CD2-CD1 3.99Å; L27-L185 HydrophobicContact CG-CD1 3.97Å
28	G	91.3	Very high	86.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-34.2	178	0	0	0	0	0	113.4	Y24 N25 L26 R32 T182	Y24-G28 PolarHBondContact O-N 3.11Å; N25-G28 PolarHBondContact O-N 2.98Å; L26-G28 VanDerWaalsContact C-N 3.31Å; L26-G28 PolarHBondContact O-N 3.43Å; G28-R32 VanDerWaalsContact O-CG 3.3Å; G28-R32 WeakPolarHBondContact O-CG 3.31Å; G28-R32 PolarHBondContact O-N 2.95Å; G28-T182 VanDerWaalsContact O-CG2 3.27Å; G28-T182 WeakPolarHBondContact O-CG2 3.49Å
29	F	91	Very high	88.1	Confident	130 Å²	130	48.1 Å²	48.1	57%	0.57	25%	0.252	S	S	*	.	H	α-helix	trans	-69	-50.3	173.6	171.9	-97.3	0	0	0	111.9	N25 L26 L27 Q31 R32 S33	N25-F29 PolarHBondContact O-N 3.33Å; L26-F29 WeakPolarHBondContact O-CB 3.45Å; L26-F29 PolarHBondContact O-N 3.14Å; L26-F29 VanDerWaalsContact O-N 3.11Å; L27-F29 VanDerWaalsContact C-N 3.28Å; L27-F29 PolarHBondContact O-N 3.24Å; F29-Q31 VanDerWaalsContact C-N 3.32Å; F29-Q31 PolarHBondContact O-N 3.44Å; F29-R32 PolarHBondContact O-N 3.13Å; F29-S33 PolarHBondContact O-N 3.4Å; F29-S33 VanDerWaalsContact O-N 3.07Å
30	L	91.6	Very high	89.4	Confident	56 Å²	56	50.4 Å²	50.4	29%	0.293	25%	0.251	S	S	.	.	H	α-helix	trans	-58.6	-46.3	178.4	-68.4	175.4	0	0	0	110.7	L26 L27 R32 S33 S34	L26-L30 HydrophobicContact CD1-CD1 4.21Å; L26-L30 HydrophobicContact CD1-CG 4.16Å; L26-L30 HydrophobicContact CG-CD1 4.05Å; L26-L30 HydrophobicContact CG-CG 4.41Å; L26-L30 WeakPolarHBondContact O-CG 3.5Å; L26-L30 PolarHBondContact O-N 3.43Å; L27-L30 PolarHBondContact O-N 3.38Å; L30-R32 VanDerWaalsContact C-N 3.33Å; L30-R32 PolarHBondContact O-N 3.41Å; L30-S33 PolarHBondContact O-N 3.11Å; L30-S33 VanDerWaalsContact O-N 3.15Å; L30-S34 PolarHBondContact O-N 2.84Å; L30-S34 PolarHBondContact O-OG 3.11Å
31	Q	94.1	Very high	90.9	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-39.8	-179.1	-170.4	58.8	26.8	0	0	112.5	L27 F29 S35 I80 I178 T182	L27-Q31 WeakPolarHBondContact O-CB 3.47Å; L27-Q31 PolarHBondContact O-N 3.39Å; F29-Q31 VanDerWaalsContact C-N 3.32Å; F29-Q31 PolarHBondContact O-N 3.44Å; Q31-S35 WeakPolarHBondContact O-CB 3.45Å; Q31-S35 PolarHBondContact O-N 3.09Å; Q31-S35 PolarHBondContact O-OG 3.48Å; Q31-I80 HydrophobicContact CG-CG2 4.27Å; Q31-I178 HydrophobicContact CG-CG2 4.48Å; Q31-T182 HydrophobicContact CB-CG2 3.82Å; Q31-T182 HydrophobicContact CG-CG2 3.96Å; Q31-T182 VanDerWaalsContact CG-OG1 3.32Å; Q31-T182 WeakPolarHBondContact CG-OG1 3.27Å
32	R	94.2	Very high	92.2	Very high	79 Å²	79	47.5 Å²	47.5	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-66.2	-45.8	174.4	-73.9	173.1	-163.9	-146.7	-1.1	112.1	G28 F29 L30 S35 F36 T182 R186	G28-R32 VanDerWaalsContact O-CG 3.3Å; G28-R32 WeakPolarHBondContact O-CG 3.31Å; G28-R32 PolarHBondContact O-N 2.95Å; F29-R32 PolarHBondContact O-N 3.13Å; L30-R32 VanDerWaalsContact C-N 3.33Å; L30-R32 PolarHBondContact O-N 3.41Å; R32-S35 PolarHBondContact O-N 2.89Å; R32-F36 WeakPolarHBondContact O-CB 3.42Å; R32-F36 PolarHBondContact O-N 3.5Å; R32-T182 HydrophobicContact CG-CG2 3.72Å; R32-R186 VanDerWaalsContact CZ-NE 3.35Å; R32-R186 VanDerWaalsContact CZ-NH2 3.33Å; R32-R186 VanDerWaalsContact NH2-CZ 3.33Å
33	S	94.6	Very high	93.3	Very high	58 Å²	58	50.5 Å²	50.5	41%	0.406	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-51.2	179.8	-173.8	0	0	0	0	110.6	F29 L30 F36 Q37	F29-S33 PolarHBondContact O-N 3.4Å; F29-S33 VanDerWaalsContact O-N 3.07Å; L30-S33 PolarHBondContact O-N 3.11Å; L30-S33 VanDerWaalsContact O-N 3.15Å; S33-F36 WeakPolarHBondContact O-CB 3.22Å; S33-F36 PolarHBondContact O-N 3.07Å; S33-Q37 WeakPolarHBondContact O-CG 3.39Å; S33-Q37 PolarHBondContact O-N 3.04Å
34	S	95.3	Very high	94.1	Very high	24 Å²	24	54 Å²	54	17%	0.168	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-40.6	179.3	-58.5	0	0	0	0	112.4	L30 F36 Q37 C38	L30-S34 PolarHBondContact O-N 2.84Å; L30-S34 PolarHBondContact O-OG 3.11Å; S34-F36 VanDerWaalsContact C-N 3.3Å; S34-F36 PolarHBondContact O-N 3Å; S34-Q37 PolarHBondContact O-N 2.94Å; S34-Q37 VanDerWaalsContact O-N 3.14Å; S34-C38 PolarHBondContact O-N 3.47Å; S34-C38 PolarHBondContact O-SG 2.67Å
35	S	96	Very high	94.6	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-40	175	-67.2	0	0	0	0	111.9	Q31 R32 C38 Q39 Q115 N179	Q31-S35 WeakPolarHBondContact O-CB 3.45Å; Q31-S35 PolarHBondContact O-N 3.09Å; Q31-S35 PolarHBondContact O-OG 3.48Å; R32-S35 PolarHBondContact O-N 2.89Å; S35-C38 PolarHBondContact O-N 3.35Å; S35-Q39 WeakPolarHBondContact O-CG 3.46Å; S35-Q39 PolarHBondContact O-N 3.06Å; S35-Q115 PolarHBondContact OG-OE1 3.39Å; S35-N179 VanDerWaalsContact CB-OD1 3.26Å; S35-N179 WeakPolarHBondContact CB-OD1 3.46Å
36	F	96.6	Very high	94.5	Very high	123 Å²	123	56.9 Å²	56.9	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-43.8	173.9	176.5	-95	0	0	0	111.8	R32 S33 S34 Q39 K40	R32-F36 WeakPolarHBondContact O-CB 3.42Å; R32-F36 PolarHBondContact O-N 3.5Å; S33-F36 WeakPolarHBondContact O-CB 3.22Å; S33-F36 PolarHBondContact O-N 3.07Å; S34-F36 VanDerWaalsContact C-N 3.3Å; S34-F36 PolarHBondContact O-N 3Å; F36-Q39 PolarHBondContact O-N 3.47Å; F36-K40 WeakPolarHBondContact O-CB 3.47Å; F36-K40 PolarHBondContact O-N 3.15Å
37	Q	97.9	Very high	94.2	Very high	70 Å²	70	53.2 Å²	53.2	33%	0.327	25%	0.251	S	S	.	.	H	α-helix	trans	-64.2	-42.8	175.8	-61.8	-51.3	-31.8	0	0	112.1	S33 S34 Q39 K40 L41	S33-Q37 WeakPolarHBondContact O-CG 3.39Å; S33-Q37 PolarHBondContact O-N 3.04Å; S34-Q37 PolarHBondContact O-N 2.94Å; S34-Q37 VanDerWaalsContact O-N 3.14Å; Q37-Q39 VanDerWaalsContact C-N 3.34Å; Q37-Q39 PolarHBondContact O-N 2.77Å; Q37-K40 WeakPolarHBondContact O-CB 3.3Å; Q37-K40 PolarHBondContact O-N 3.14Å; Q37-L41 WeakPolarHBondContact O-CG 2.92Å; Q37-L41 PolarHBondContact O-N 2.71Å
38	C	98.3	Very high	94.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-45.3	175.1	-69.2	0	0	0	0	111.7	S34 S35 K40 L41 L42 L108 Q115 F175	S34-C38 PolarHBondContact O-N 3.47Å; S34-C38 PolarHBondContact O-SG 2.67Å; S35-C38 PolarHBondContact O-N 3.35Å; C38-K40 PolarHBondContact O-N 3.27Å; C38-L41 PolarHBondContact O-N 3.02Å; C38-L42 WeakPolarHBondContact O-CB 3.44Å; C38-L42 VanDerWaalsContact O-CG 3.28Å; C38-L42 WeakPolarHBondContact O-CG 3.2Å; C38-L42 PolarHBondContact O-N 2.62Å; C38-L108 HydrophobicContact CB-CD1 3.7Å; C38-Q115 PolarHBondContact SG-NE2 3.09Å; C38-F175 HydrophobicContact CB-CD1 4.16Å; C38-F175 HydrophobicContact CB-CD2 4.43Å; C38-F175 HydrophobicContact CB-CE1 3.54Å; C38-F175 HydrophobicContact CB-CE2 3.86Å; C38-F175 HydrophobicContact CB-CZ 3.38Å
39	Q	98.1	Very high	93.9	Very high	33 Å²	33	64.2 Å²	64.2	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-43.2	175.9	-72.3	-179.7	-51.2	0	0	111.8	S35 F36 Q37 L41 L42 W43 L172 F175 N179	S35-Q39 WeakPolarHBondContact O-CG 3.46Å; S35-Q39 PolarHBondContact O-N 3.06Å; F36-Q39 PolarHBondContact O-N 3.47Å; Q37-Q39 VanDerWaalsContact C-N 3.34Å; Q37-Q39 PolarHBondContact O-N 2.77Å; Q39-L41 VanDerWaalsContact C-N 3.35Å; Q39-L41 PolarHBondContact O-N 3.49Å; Q39-L42 PolarHBondContact O-N 3.2Å; Q39-W43 PolarHBondContact O-N 3.38Å; Q39-L172 HydrophobicContact CB-CD2 4.33Å; Q39-L172 HydrophobicContact CG-CD2 4.37Å; Q39-F175 HydrophobicContact CG-CB 3.45Å; Q39-F175 VanDerWaalsContact CG-CB 3.45Å; Q39-F175 HydrophobicContact CG-CD2 4.4Å; Q39-F175 HydrophobicContact CG-CG 3.96Å; Q39-N179 PolarHBondContact OE1-ND2 3.27Å
40	K	98.2	Very high	93.8	Very high	109 Å²	109	64.2 Å²	64.2	47%	0.474	30%	0.299	S	S	.	.	H	α-helix	trans	-58.5	-46.1	176.5	-175.5	-178	176.4	-174.5	0	111.6	F36 Q37 C38 W43 Q44	F36-K40 WeakPolarHBondContact O-CB 3.47Å; F36-K40 PolarHBondContact O-N 3.15Å; Q37-K40 WeakPolarHBondContact O-CB 3.3Å; Q37-K40 PolarHBondContact O-N 3.14Å; C38-K40 PolarHBondContact O-N 3.27Å; K40-W43 PolarHBondContact O-N 2.86Å; K40-Q44 WeakPolarHBondContact O-CG 3.44Å; K40-Q44 PolarHBondContact O-N 2.87Å
41	L	98.4	Very high	93.7	Very high	21 Å²	21	69.8 Å²	69.8	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-44.2	177.1	-68.5	164.4	0	0	0	111.4	Q37 C38 Q39 W43 Q44 L45 I104 N107 L108	Q37-L41 WeakPolarHBondContact O-CG 2.92Å; Q37-L41 PolarHBondContact O-N 2.71Å; C38-L41 PolarHBondContact O-N 3.02Å; Q39-L41 VanDerWaalsContact C-N 3.35Å; Q39-L41 PolarHBondContact O-N 3.49Å; L41-W43 VanDerWaalsContact C-N 3.29Å; L41-W43 PolarHBondContact O-N 3.1Å; L41-Q44 WeakPolarHBondContact O-CB 3.41Å; L41-Q44 PolarHBondContact O-N 3.35Å; L41-Q44 VanDerWaalsContact O-N 3.08Å; L41-L45 PolarHBondContact O-N 2.9Å; L41-I104 HydrophobicContact CB-CG2 4.12Å; L41-I104 HydrophobicContact CD2-CG2 3.96Å; L41-I104 WeakPolarHBondContact O-CG2 2.92Å; L41-N107 HydrophobicContact CD1-CB 4.06Å; L41-N107 HydrophobicContact CD2-CB 4.07Å; L41-L108 HydrophobicContact CB-CB 4.35Å; L41-L108 HydrophobicContact CB-CD1 4.5Å; L41-L108 HydrophobicContact CD1-CB 4.24Å
42	L	97.9	Very high	93.8	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-37.5	176.3	-74.3	164.7	0	0	0	112.8	C38 Q39 Q44 L45 F91 L108 R168 I171 L172 F175	C38-L42 WeakPolarHBondContact O-CB 3.44Å; C38-L42 VanDerWaalsContact O-CG 3.28Å; C38-L42 WeakPolarHBondContact O-CG 3.2Å; C38-L42 PolarHBondContact O-N 2.62Å; Q39-L42 PolarHBondContact O-N 3.2Å; L42-Q44 VanDerWaalsContact C-N 3.29Å; L42-Q44 PolarHBondContact O-N 3.25Å; L42-L45 HydrophobicContact CD2-CD1 4.17Å; L42-L45 PolarHBondContact O-N 3.02Å; L42-F91 HydrophobicContact CD2-CE1 4.05Å; L42-F91 HydrophobicContact CD2-CE2 4.22Å; L42-F91 HydrophobicContact CD2-CZ 3.43Å; L42-F91 VanDerWaalsContact CD2-CZ 3.43Å; L42-L108 HydrophobicContact CD2-CD2 3.63Å; L42-L108 HydrophobicContact CG-CD1 4.18Å; L42-L108 HydrophobicContact CG-CD2 4.04Å; L42-R168 HydrophobicContact CD2-CG 4.11Å; L42-R168 WeakPolarHBondContact O-CD 3.45Å; L42-R168 PolarHBondContact O-NH1 2.72Å; L42-I171 HydrophobicContact CD1-CG2 3.89Å; L42-I171 HydrophobicContact CD2-CG2 4.35Å; L42-L172 HydrophobicContact CB-CD2 3.61Å; L42-L172 HydrophobicContact CB-CG 3.95Å; L42-L172 HydrophobicContact CD1-CD2 3.97Å; L42-L172 HydrophobicContact CD1-CG 4.18Å; L42-L172 HydrophobicContact CG-CD2 4.45Å; L42-F175 HydrophobicContact CD1-CD2 3.63Å; L42-F175 HydrophobicContact CD1-CE2 3.67Å
43	W	97	Very high	93.8	Very high	180 Å²	180	70.5 Å²	70.5	68%	0.682	33%	0.327	S	S	*	.	H	α-helix	trans	-68.1	-27	176.2	-81.9	117.4	0	0	0	113.5	Q39 K40 L41 L45 L172	Q39-W43 PolarHBondContact O-N 3.38Å; K40-W43 PolarHBondContact O-N 2.86Å; L41-W43 VanDerWaalsContact C-N 3.29Å; L41-W43 PolarHBondContact O-N 3.1Å; W43-L45 VanDerWaalsContact C-N 3.3Å; W43-L172 HydrophobicContact CD2-CD1 4.16Å; W43-L172 HydrophobicContact CD2-CD2 4.48Å; W43-L172 HydrophobicContact CE3-CD1 4.42Å; W43-L172 HydrophobicContact CG-CD2 4.38Å; W43-L172 HydrophobicContact CH2-CD1 4.35Å; W43-L172 HydrophobicContact CZ2-CD1 4.09Å
44	Q	96.9	Very high	93.8	Very high	98 Å²	98	76.2 Å²	76.2	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-76.5	-17.3	177.3	-67.7	172.6	-22.7	0	0	113.3	K40 L41 L42 I104	K40-Q44 WeakPolarHBondContact O-CG 3.44Å; K40-Q44 PolarHBondContact O-N 2.87Å; L41-Q44 WeakPolarHBondContact O-CB 3.41Å; L41-Q44 PolarHBondContact O-N 3.35Å; L41-Q44 VanDerWaalsContact O-N 3.08Å; L42-Q44 VanDerWaalsContact C-N 3.29Å; L42-Q44 PolarHBondContact O-N 3.25Å; Q44-I104 HydrophobicContact CB-CD1 3.87Å; Q44-I104 HydrophobicContact CB-CG2 4.38Å
45	L	95.1	Very high	93.7	Very high	6 Å²	6	76.1 Å²	76.1	3%	0.031	34%	0.342	C	S	.	.	S	Bend	trans	-69.7	143.6	176.3	-58	172.4	0	0	0	110.5	L41 L42 W43 F91 W100 I104 V105 R168	L41-L45 PolarHBondContact O-N 2.9Å; L42-L45 HydrophobicContact CD2-CD1 4.17Å; L42-L45 PolarHBondContact O-N 3.02Å; W43-L45 VanDerWaalsContact C-N 3.3Å; L45-F91 HydrophobicContact CD1-CE1 4.3Å; L45-W100 HydrophobicContact CB-CD2 3.95Å; L45-W100 HydrophobicContact CB-CG 4.13Å; L45-W100 HydrophobicContact CB-CZ2 4.36Å; L45-W100 HydrophobicContact CD1-CD2 3.99Å; L45-W100 HydrophobicContact CD1-CE3 3.72Å; L45-W100 HydrophobicContact CD1-CH2 4.2Å; L45-W100 HydrophobicContact CD1-CZ2 4.43Å; L45-W100 HydrophobicContact CD1-CZ3 3.84Å; L45-W100 HydrophobicContact CD2-CB 3.93Å; L45-W100 HydrophobicContact CD2-CD2 3.99Å; L45-W100 HydrophobicContact CD2-CE3 4.18Å; L45-W100 HydrophobicContact CD2-CG 3.9Å; L45-W100 HydrophobicContact CG-CD2 4.19Å; L45-W100 HydrophobicContact CG-CE3 4.37Å; L45-W100 HydrophobicContact CG-CG 4.46Å; L45-I104 HydrophobicContact CD2-CB 4.05Å; L45-I104 HydrophobicContact CD2-CG2 3.66Å; L45-I104 HydrophobicContact CG-CG2 4.24Å; L45-V105 HydrophobicContact CD2-CG2 4.02Å; L45-R168 PolarHBondContact O-NH1 2.85Å
46	N	85.1	Confident	93.6	Very high	111 Å²	111	85.6 Å²	85.6	59%	0.594	38%	0.377	S	S	*	.			trans	-74.2	167.4	179.7	-73.7	-26.3	0	0	0	112	W100	N46-W100 PolarHBondContact O-NE1 3.29Å
47	G	82.8	Confident	93.5	Very high	14 Å²	14	83.4 Å²	83.4	14%	0.144	37%	0.37	C	S	.	.			trans	125.4	94.7	176.6	0	0	0	0	0	111.6	R168	G47-R168 PolarHBondContact O-NH2 3.26Å
48	R	85.9	Confident	93.4	Very high	171 Å²	171	84.8 Å²	84.8	65%	0.645	38%	0.38	S	S	*	.			trans	-76.6	122.1	176.1	-73.2	-169.9	-172.7	-176	2.2	109.4	E50 Y51	R48-E50 WeakPolarHBondContact CB-OE2 2.91Å; R48-E50 PolarHBondContact O-N 3.05Å; R48-Y51 HydrophobicContact CB-CD2 3.83Å; R48-Y51 HydrophobicContact CB-CE2 4.09Å; R48-Y51 PolarHBondContact O-N 3.46Å
49	L	86.3	Confident	93.4	Very high	64 Å²	64	84.8 Å²	84.8	34%	0.335	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-63.4	-30.9	-173.4	-177.5	61.2	0	0	0	111.9	Y51 C52 L53 T165 I166 V169	L49-Y51 PolarHBondContact O-N 2.94Å; L49-C52 CarbonylContact O-C 3.58Å; L49-C52 PolarHBondContact O-N 3.49Å; L49-L53 HydrophobicContact CG-CD2 4.02Å; L49-L53 WeakPolarHBondContact O-CG 3.23Å; L49-L53 PolarHBondContact O-N 3.06Å; L49-T165 HydrophobicContact CD1-CG2 4.49Å; L49-I166 HydrophobicContact CD1-CD1 3.59Å; L49-V169 HydrophobicContact CD1-CG2 4.39Å
50	E	89.6	Confident	93.2	Very high	130 Å²	130	86.9 Å²	86.9	61%	0.607	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-56.3	-37.3	-177.5	-62.4	79.3	-173.3	0	0	112.4	R48 C52 L53	R48-E50 WeakPolarHBondContact CB-OE2 2.91Å; R48-E50 PolarHBondContact O-N 3.05Å; E50-C52 VanDerWaalsContact C-N 3.3Å; E50-C52 PolarHBondContact O-N 3.39Å; E50-L53 WeakPolarHBondContact O-CG 3.45Å
51	Y	90.4	Very high	93	Very high	172 Å²	172	81.8 Å²	81.8	68%	0.675	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-79	-14.8	179.6	-59.3	-52.8	0	0	0	113.6	R48 L49	R48-Y51 HydrophobicContact CB-CD2 3.83Å; R48-Y51 HydrophobicContact CB-CE2 4.09Å; R48-Y51 PolarHBondContact O-N 3.46Å; L49-Y51 PolarHBondContact O-N 2.94Å
52	C	95.7	Very high	92.8	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.007	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-113.5	10.7	-173.3	-61.2	0	0	0	0	113.2	L49 E50 K54 D55 C162 T165	L49-C52 CarbonylContact O-C 3.58Å; L49-C52 PolarHBondContact O-N 3.49Å; E50-C52 VanDerWaalsContact C-N 3.3Å; E50-C52 PolarHBondContact O-N 3.39Å; C52-K54 PolarHBondContact O-N 2.95Å; C52-D55 PolarHBondContact O-N 2.69Å; C52-C162 WeakPolarHBondContact CA-SG 3.2Å; C52-C162 HydrophobicContact CB-CB 3.51Å; C52-C162 WeakPolarHBondContact CB-SG 3.1Å; C52-C162 WeakPolarHBondContact SG-CA 3.42Å; C52-C162 WeakPolarHBondContact SG-CB 3.49Å; C52-C162 CovalentContact SG-SG 2.05Å; C52-C162 PolarHBondContact SG-SG 3.32Å; C52-T165 HydrophobicContact CB-CG2 4.35Å
53	L	93.5	Very high	92.4	Very high	96 Å²	96	85.8 Å²	85.8	50%	0.503	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.8	-31.6	-178.7	-66.3	177.4	0	0	0	113.3	L49 E50 D55 R56	L49-L53 HydrophobicContact CG-CD2 4.02Å; L49-L53 WeakPolarHBondContact O-CG 3.23Å; L49-L53 PolarHBondContact O-N 3.06Å; E50-L53 WeakPolarHBondContact O-CG 3.45Å; L53-D55 PolarHBondContact O-N 3.34Å; L53-R56 VanDerWaalsContact O-CB 3.23Å; L53-R56 WeakPolarHBondContact O-CB 3.19Å; L53-R56 PolarHBondContact O-N 3.15Å
54	K	94.8	Very high	91.9	Very high	177 Å²	177	80 Å²	80	77%	0.77	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-63.6	-24.5	176.7	69.5	176.7	-176.3	176.8	0	113.5	C52	C52-K54 PolarHBondContact O-N 2.95Å
55	D	94.1	Very high	91.7	Very high	22 Å²	22	75.4 Å²	75.4	12%	0.118	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-98.3	3.5	-178.3	-67	-48.5	0	0	0	112.1	C52 L53 M57 Y153 K157 C162 I166	C52-D55 PolarHBondContact O-N 2.69Å; L53-D55 PolarHBondContact O-N 3.34Å; D55-M57 PolarHBondContact O-N 2.82Å; D55-Y153 WeakPolarHBondContact O-CE2 3.41Å; D55-Y153 PolarHBondContact O-OH 2.05Å; D55-K157 WeakPolarHBondContact OD1-CE 3.39Å; D55-K157 IonicContact OD1-NZ 2.62Å; D55-K157 PolarHBondContact OD1-NZ 3.2Å; D55-C162 HydrophobicContact CB-CB 4.36Å; D55-C162 VanDerWaalsContact OD2-CB 3.3Å; D55-C162 WeakPolarHBondContact OD2-CB 3.45Å; D55-I166 HydrophobicContact CB-CG1 4.46Å
56	R	94	Very high	91.3	Very high	200 Å²	200	77.7 Å²	77.7	76%	0.755	36%	0.358	S	S	*	.			trans	-56	130	179.7	-174.5	-179.6	-177.1	-172.2	1.3	110.5	L53 I166	L53-R56 VanDerWaalsContact O-CB 3.23Å; L53-R56 WeakPolarHBondContact O-CB 3.19Å; L53-R56 PolarHBondContact O-N 3.15Å; R56-I166 HydrophobicContact CB-CD1 4.31Å
57	M	94.3	Very high	91.3	Very high	76 Å²	76	78 Å²	78	37%	0.374	36%	0.356	S	S	.	.			trans	-129.2	140.3	175.3	-175.7	169.8	-178.9	0	0	109.2	D55 F59 Y153	D55-M57 PolarHBondContact O-N 2.82Å; M57-F59 HydrophobicContact CB-CE1 4.17Å; M57-F59 HydrophobicContact CB-CE2 4.42Å; M57-F59 HydrophobicContact CB-CZ 4.02Å; M57-F59 HydrophobicContact CE-CD1 4.46Å; M57-F59 HydrophobicContact CG-CD1 4.21Å; M57-F59 HydrophobicContact CG-CE1 3.99Å; M57-F59 HydrophobicContact CG-CZ 4.35Å; M57-F59 HydrophobicContact SD-CD1 4.09Å; M57-F59 HydrophobicContact SD-CE1 3.67Å; M57-F59 HydrophobicContact SD-CZ 4.39Å; M57-Y153 HydrophobicContact CB-CD2 4.03Å; M57-Y153 HydrophobicContact CB-CE2 3.87Å; M57-Y153 HydrophobicContact CG-CD2 4.35Å; M57-Y153 HydrophobicContact SD-CD2 3.33Å; M57-Y153 WeakPolarHBondContact SD-CD2 3.36Å; M57-Y153 HydrophobicContact SD-CE2 4.12Å; M57-Y153 HydrophobicContact SD-CG 3.87Å
58	N	95.8	Very high	91.1	Very high	100 Å²	100	78.3 Å²	78.3	54%	0.535	36%	0.355	S	S	.	.			trans	-90	119.1	164.7	-178.1	12.6	0	0	0	108.1	D60	N58-D60 VanDerWaalsContact C-N 3.33Å; N58-D60 PolarHBondContact ND2-OD1 3.29Å; N58-D60 PolarHBondContact OD1-N 2.83Å; N58-D60 VanDerWaalsContact OD1-N 3.1Å; N58-D60 PolarHBondContact OD1-OD1 3.34Å
59	F	96.9	Very high	90.5	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	36%	0.36	C	S	.	.			trans	-88.1	-1.8	-179	-62.2	-73.3	0	0	0	113.3	M57 Y146 R149 I150 Y153 I166 V167 E170	M57-F59 HydrophobicContact CB-CE1 4.17Å; M57-F59 HydrophobicContact CB-CE2 4.42Å; M57-F59 HydrophobicContact CB-CZ 4.02Å; M57-F59 HydrophobicContact CE-CD1 4.46Å; M57-F59 HydrophobicContact CG-CD1 4.21Å; M57-F59 HydrophobicContact CG-CE1 3.99Å; M57-F59 HydrophobicContact CG-CZ 4.35Å; M57-F59 HydrophobicContact SD-CD1 4.09Å; M57-F59 HydrophobicContact SD-CE1 3.67Å; M57-F59 HydrophobicContact SD-CZ 4.39Å; F59-Y146 HydrophobicContact CB-CD2 4.16Å; F59-Y146 HydrophobicContact CB-CE2 3.67Å; F59-Y146 VanDerWaalsContact O-CD2 3.31Å; F59-Y146 WeakPolarHBondContact O-CD2 3.39Å; F59-R149 PolarHBondContact O-NH1 3.01Å; F59-R149 PolarHBondContact O-NH2 3.2Å; F59-R149 VanDerWaalsContact O-NH2 3.14Å; F59-I150 HydrophobicContact CB-CG1 4.16Å; F59-I150 HydrophobicContact CD1-CB 4.4Å; F59-I150 HydrophobicContact CD1-CG1 3.59Å; F59-I150 HydrophobicContact CD2-CG1 4.22Å; F59-I150 HydrophobicContact CE1-CB 4.43Å; F59-I150 HydrophobicContact CE1-CG1 3.98Å; F59-I150 HydrophobicContact CG-CD1 4.5Å; F59-I150 HydrophobicContact CG-CG1 3.72Å; F59-I150 HydrophobicContact CZ-CG1 4.43Å; F59-Y153 AromaticContact CE1-CD1 3.94Å; F59-Y153 HydrophobicContact CE1-CD1 3.94Å; F59-Y153 HydrophobicContact CE1-CD2 4.33Å; F59-Y153 AromaticContact CE1-CG 3.72Å; F59-Y153 HydrophobicContact CE1-CG 3.72Å; F59-Y153 AromaticContact CZ-CD1 3.66Å; F59-Y153 HydrophobicContact CZ-CD1 3.66Å; F59-Y153 HydrophobicContact CZ-CD2 4.41Å; F59-Y153 HydrophobicContact CZ-CE1 4.03Å; F59-Y153 AromaticContact CZ-CG 3.86Å; F59-Y153 HydrophobicContact CZ-CG 3.86Å; F59-I166 HydrophobicContact CE2-CG2 3.85Å; F59-I166 HydrophobicContact CZ-CG2 4.08Å; F59-V167 HydrophobicContact CZ-CG2 4.34Å; F59-E170 HydrophobicContact CB-CG 4.48Å; F59-E170 HydrophobicContact CD2-CB 3.89Å; F59-E170 HydrophobicContact CD2-CG 3.56Å; F59-E170 HydrophobicContact CE2-CB 4.02Å; F59-E170 HydrophobicContact CE2-CG 4.2Å; F59-E170 HydrophobicContact CG-CG 4.35Å
60	D	94.7	Very high	89.9	Confident	77 Å²	77	83.6 Å²	83.6	41%	0.412	39%	0.385	S	S	.	.			trans	38.8	74.7	-174.5	-37.6	-67	0	0	0	113.1	N58 R149	N58-D60 VanDerWaalsContact C-N 3.33Å; N58-D60 PolarHBondContact ND2-OD1 3.29Å; N58-D60 PolarHBondContact OD1-N 2.83Å; N58-D60 VanDerWaalsContact OD1-N 3.1Å; N58-D60 PolarHBondContact OD1-OD1 3.34Å; D60-R149 PolarHBondContact O-NH2 3.39Å; D60-R149 IonicContact OD2-NH1 3.69Å; D60-R149 PolarHBondContact OD2-NH1 3.3Å
61	I	94.7	Very high	89.5	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.01	36%	0.364	C	S	.	.			trans	-50.5	145	167.3	-168.2	172.6	0	0	0	109.9	I65 K66 Y146 F177	I61-I65 HydrophobicContact CD1-CB 4.25Å; I61-I65 HydrophobicContact CD1-CG2 3.68Å; I61-I65 HydrophobicContact CG1-CB 4.21Å; I61-I65 HydrophobicContact CG1-CG2 4.18Å; I61-K66 HydrophobicContact CG2-CD 3.57Å; I61-K66 HydrophobicContact CG2-CG 3.49Å; I61-K66 VanDerWaalsContact CG2-CG 3.49Å; I61-K66 WeakPolarHBondContact O-CE 3.39Å; I61-K66 PolarHBondContact O-NZ 3.39Å; I61-Y146 VanDerWaalsContact CA-CD2 3.4Å; I61-Y146 HydrophobicContact CB-CD2 4.05Å; I61-Y146 HydrophobicContact CB-CE2 3.67Å; I61-Y146 HydrophobicContact CG1-CD2 4.42Å; I61-Y146 HydrophobicContact CG1-CE1 4.27Å; I61-Y146 HydrophobicContact CG1-CE2 4.15Å; I61-F177 HydrophobicContact CD1-CD2 3.21Å; I61-F177 HydrophobicContact CD1-CE2 3.42Å; I61-F177 VanDerWaalsContact CD1-CE2 3.42Å; I61-F177 HydrophobicContact CD1-CG 3.98Å; I61-F177 HydrophobicContact CD1-CZ 4.37Å; I61-F177 HydrophobicContact CG2-CE2 3.94Å; I61-F177 HydrophobicContact CG2-CZ 4.16Å
62	P	93.2	Very high	89.3	Confident	12 Å²	12	77.2 Å²	77.2	8%	0.078	36%	0.361	C	S	.	.			trans	-60.6	148.4	-176.7	-23.7	35.1	0	0	0	112.8	E64 I65 K66 H142 L143	P62-E64 VanDerWaalsContact C-N 3.33Å; P62-E64 HydrophobicContact CB-CG 4.13Å; P62-E64 WeakPolarHBondContact CB-OE2 3.37Å; P62-E64 PolarHBondContact O-N 3.41Å; P62-I65 HydrophobicContact CB-CG1 4.12Å; P62-I65 HydrophobicContact CG-CG1 4.38Å; P62-I65 PolarHBondContact O-N 3.34Å; P62-I65 VanDerWaalsContact O-N 3.14Å; P62-K66 WeakPolarHBondContact O-CE 3.38Å; P62-K66 PolarHBondContact O-N 2.84Å; P62-K66 VanDerWaalsContact O-N 3.15Å; P62-H142 HydrophobicContact CB-CB 3.9Å; P62-H142 HydrophobicContact CG-CB 3.71Å; P62-L143 HydrophobicContact CG-CD2 4.2Å
63	E	90	Very high	88.8	Confident	92 Å²	92	79 Å²	79	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-68.1	-36	-174.1	-163.5	60	-141.7	0	0	112	I65 K66 Q67	E63-I65 PolarHBondContact O-N 3.43Å; E63-I65 VanDerWaalsContact O-N 3.14Å; E63-K66 PolarHBondContact O-N 2.81Å; E63-K66 WeakPolarHBondContact OE2-CE 3.32Å; E63-K66 IonicContact OE2-NZ 3.62Å; E63-K66 PolarHBondContact OE2-NZ 3.15Å; E63-Q67 PolarHBondContact O-N 3.39Å; E63-Q67 PolarHBondContact OE1-NE2 2.9Å
64	E	86.9	Confident	88.4	Confident	60 Å²	60	76.2 Å²	76.2	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-59.6	-22.4	173.3	62.3	-90.5	-140.9	0	0	113.3	P62 P68 H142	P62-E64 VanDerWaalsContact C-N 3.33Å; P62-E64 HydrophobicContact CB-CG 4.13Å; P62-E64 WeakPolarHBondContact CB-OE2 3.37Å; P62-E64 PolarHBondContact O-N 3.41Å; E64-P68 VanDerWaalsContact O-CA 3.26Å; E64-P68 WeakPolarHBondContact O-CA 3.48Å; E64-H142 IonicContact OE1-CE1 3.88Å; E64-H142 IonicContact OE1-CG 3.8Å; E64-H142 IonicContact OE1-ND1 3.7Å; E64-H142 PolarHBondContact OE1-ND1 3.3Å; E64-H142 IonicContact OE2-ND1 3.22Å
65	I	91	Very high	87.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-91	-34.5	174.8	-52.6	-58.6	0	0	0	111.4	I61 P62 E63 T79 M83 L143 F177 L181	I61-I65 HydrophobicContact CD1-CB 4.25Å; I61-I65 HydrophobicContact CD1-CG2 3.68Å; I61-I65 HydrophobicContact CG1-CB 4.21Å; I61-I65 HydrophobicContact CG1-CG2 4.18Å; P62-I65 HydrophobicContact CB-CG1 4.12Å; P62-I65 HydrophobicContact CG-CG1 4.38Å; P62-I65 PolarHBondContact O-N 3.34Å; P62-I65 VanDerWaalsContact O-N 3.14Å; E63-I65 PolarHBondContact O-N 3.43Å; E63-I65 VanDerWaalsContact O-N 3.14Å; I65-T79 HydrophobicContact CD1-CG2 3.34Å; I65-M83 HydrophobicContact CG2-CE 4.27Å; I65-M83 HydrophobicContact CG2-SD 4.19Å; I65-L143 HydrophobicContact CD1-CD2 4.37Å; I65-L143 HydrophobicContact CG1-CD2 4.03Å; I65-F177 HydrophobicContact CG2-CB 3.74Å; I65-F177 HydrophobicContact CG2-CD1 4.48Å; I65-F177 HydrophobicContact CG2-CG 4.05Å; I65-F177 WeakPolarHBondContact O-CD1 3.32Å; I65-L181 HydrophobicContact CD1-CD1 4.48Å
66	K	88.3	Confident	87.7	Confident	55 Å²	55	69.2 Å²	69.2	24%	0.239	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-45	176.5	-82.8	173.2	-71.6	-179.4	0	111.9	I61 P62 E63 F177	I61-K66 HydrophobicContact CG2-CD 3.57Å; I61-K66 HydrophobicContact CG2-CG 3.49Å; I61-K66 VanDerWaalsContact CG2-CG 3.49Å; I61-K66 WeakPolarHBondContact O-CE 3.39Å; I61-K66 PolarHBondContact O-NZ 3.39Å; P62-K66 WeakPolarHBondContact O-CE 3.38Å; P62-K66 PolarHBondContact O-N 2.84Å; P62-K66 VanDerWaalsContact O-N 3.15Å; E63-K66 PolarHBondContact O-N 2.81Å; E63-K66 WeakPolarHBondContact OE2-CE 3.32Å; E63-K66 IonicContact OE2-NZ 3.62Å; E63-K66 PolarHBondContact OE2-NZ 3.15Å; K66-F177 HydrophobicContact CB-CE1 4.34Å; K66-F177 HydrophobicContact CG-CE1 3.96Å; K66-F177 HydrophobicContact CG-CZ 3.81Å
67	Q	85.2	Confident	87.5	Confident	118 Å²	118	59.7 Å²	59.7	55%	0.551	29%	0.288	S	S	*	.	S	Bend	trans	-128.4	71.9	-176.5	-61.1	-173.8	46.5	0	0	108.7	E63 Q69	E63-Q67 PolarHBondContact O-N 3.39Å; E63-Q67 PolarHBondContact OE1-NE2 2.9Å; Q67-Q69 PolarHBondContact O-N 3.07Å; Q67-Q69 VanDerWaalsContact O-N 3.11Å
68	P	76.8	Confident	87.2	Confident	19 Å²	19	57.6 Å²	57.6	12%	0.123	28%	0.278	C	S	.	.			trans	-63.4	118.1	178.6	25.9	-32	0	0	0	108.7	E64 F71 L181 Y184	E64-P68 VanDerWaalsContact O-CA 3.26Å; E64-P68 WeakPolarHBondContact O-CA 3.48Å; P68-F71 HydrophobicContact CB-CD2 3.5Å; P68-F71 VanDerWaalsContact CB-CD2 3.5Å; P68-F71 HydrophobicContact CB-CE2 3.53Å; P68-L181 HydrophobicContact CB-CD2 4.15Å; P68-Y184 HydrophobicContact CB-CE2 3.86Å; P68-Y184 HydrophobicContact CG-CE2 3.83Å; P68-Y184 PolarHBondContact O-OH 3.11Å
69	Q	74.5	Confident	87	Confident	162 Å²	162	53 Å²	53	76%	0.757	25%	0.253	S	S	*	.			trans	-107.9	118.7	171.8	-66.1	-174.7	8.2	0	0	108.3	Q67	Q67-Q69 PolarHBondContact O-N 3.07Å; Q67-Q69 VanDerWaalsContact O-N 3.11Å
70	Q	73.3	Confident	86.8	Confident	185 Å²	185	53 Å²	53	86%	0.864	25%	0.253	S	S	*	.	S	Bend	trans	54.1	57.9	172.5	-64	179.9	-19.8	0	0	115.4	Q72	Q70-Q72 PolarHBondContact O-N 3.22Å
71	F	81.9	Confident	86.8	Confident	38 Å²	38	51.4 Å²	51.4	17%	0.167	24%	0.242	C	C	.	.			trans	-72.2	126.3	169	-91.5	-102.9	0	0	0	111.2	P68 D75 A76 T79 L181 Y184	P68-F71 HydrophobicContact CB-CD2 3.5Å; P68-F71 VanDerWaalsContact CB-CD2 3.5Å; P68-F71 HydrophobicContact CB-CE2 3.53Å; F71-D75 HydrophobicContact CD1-CB 3.69Å; F71-D75 HydrophobicContact CE1-CB 4.18Å; F71-A76 HydrophobicContact CB-CB 4.26Å; F71-A76 HydrophobicContact CD1-CB 4.12Å; F71-T79 HydrophobicContact CE1-CG2 4.36Å; F71-T79 WeakPolarHBondContact CE1-OG1 3.38Å; F71-L181 HydrophobicContact CD1-CD2 4.24Å; F71-L181 HydrophobicContact CD2-CD2 4.3Å; F71-L181 HydrophobicContact CE1-CD2 4.11Å; F71-L181 HydrophobicContact CE2-CD2 4.16Å; F71-L181 HydrophobicContact CG-CD2 4.32Å; F71-L181 HydrophobicContact CZ-CD2 4.05Å; F71-Y184 HydrophobicContact CB-CD1 3.85Å; F71-Y184 HydrophobicContact CB-CD2 4.09Å; F71-Y184 HydrophobicContact CB-CE1 4.25Å; F71-Y184 HydrophobicContact CB-CE2 4.45Å; F71-Y184 HydrophobicContact CB-CG 3.77Å
72	Q	85.4	Confident	86.7	Confident	129 Å²	129	53.2 Å²	53.2	60%	0.603	25%	0.251	S	S	*	.			trans	-64.4	156.8	159.3	-61.9	-94.7	-22.4	0	0	109	Q70 E74 D75 A76	Q70-Q72 PolarHBondContact O-N 3.22Å; Q72-E74 VanDerWaalsContact C-N 3.27Å; Q72-E74 PolarHBondContact O-N 3.37Å; Q72-D75 HydrophobicContact CB-CB 4.33Å; Q72-D75 WeakPolarHBondContact CB-OD2 3.16Å; Q72-D75 PolarHBondContact O-N 2.71Å; Q72-D75 VanDerWaalsContact O-N 3.12Å; Q72-A76 PolarHBondContact O-N 3.1Å
73	K	86.6	Confident	86.9	Confident	39 Å²	39	52.7 Å²	52.7	17%	0.17	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-41.4	-178	-55.7	-161.9	170.2	-159.5	0	111.7	Y24 D75 A76 A77 Y184 L185 R186 N187	Y24-K73 HydrophobicContact CD1-CB 4.2Å; Y24-K73 HydrophobicContact CD2-CB 4.43Å; Y24-K73 HydrophobicContact CD2-CD 3.96Å; Y24-K73 HydrophobicContact CE1-CB 3.92Å; Y24-K73 HydrophobicContact CE2-CB 4.13Å; Y24-K73 HydrophobicContact CE2-CD 4.34Å; Y24-K73 HydrophobicContact CG-CB 4.45Å; Y24-K73 HydrophobicContact CG-CD 4.05Å; K73-D75 VanDerWaalsContact C-N 3.32Å; K73-D75 PolarHBondContact O-N 3.36Å; K73-A76 PolarHBondContact O-N 3.42Å; K73-A77 WeakPolarHBondContact O-CB 3.47Å; K73-A77 PolarHBondContact O-N 2.8Å; K73-Y184 WeakPolarHBondContact CG-O 3.26Å; K73-L185 PolarHBondContact NZ-O 2.81Å; K73-L185 WeakPolarHBondContact O-CD2 3.26Å; K73-R186 VanDerWaalsContact CE-O 3.23Å; K73-R186 WeakPolarHBondContact CE-O 3.36Å; K73-R186 PolarHBondContact NZ-O 2.64Å; K73-N187 VanDerWaalsContact NZ-N 3.19Å; K73-N187 PolarHBondContact NZ-OD1 2.98Å
74	E	83.6	Confident	87.3	Confident	37 Å²	37	48.3 Å²	48.3	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-38.2	178.1	-66.9	64.9	-148.9	0	0	111.3	Y24 Q72 L78 K126 K136	Y24-E74 WeakPolarHBondContact OH-CG 3.27Å; Y24-E74 PolarHBondContact OH-OE1 3.27Å; Q72-E74 VanDerWaalsContact C-N 3.27Å; Q72-E74 PolarHBondContact O-N 3.37Å; E74-L78 WeakPolarHBondContact O-CB 3.3Å; E74-L78 PolarHBondContact O-N 3.46Å; E74-K126 IonicContact OE1-NZ 3.89Å; E74-K136 PolarHBondContact O-NZ 3.46Å
75	D	84.9	Confident	87.7	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-70.1	-41.1	176.7	-63.3	-26.6	0	0	0	110.7	F71 Q72 K73 T79 K136	F71-D75 HydrophobicContact CD1-CB 3.69Å; F71-D75 HydrophobicContact CE1-CB 4.18Å; Q72-D75 HydrophobicContact CB-CB 4.33Å; Q72-D75 WeakPolarHBondContact CB-OD2 3.16Å; Q72-D75 PolarHBondContact O-N 2.71Å; Q72-D75 VanDerWaalsContact O-N 3.12Å; K73-D75 VanDerWaalsContact C-N 3.32Å; K73-D75 PolarHBondContact O-N 3.36Å; D75-T79 VanDerWaalsContact O-CB 3.23Å; D75-T79 WeakPolarHBondContact O-CB 3.4Å; D75-T79 PolarHBondContact O-N 3.24Å; D75-T79 PolarHBondContact O-OG1 3Å; D75-K136 WeakPolarHBondContact OD1-CE 3.44Å; D75-K136 IonicContact OD1-NZ 2.67Å; D75-K136 PolarHBondContact OD1-NZ 3.35Å
76	A	89.5	Confident	88	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-46	178.2	0	0	0	0	0	110.4	F71 Q72 K73 T79 I80 L185	F71-A76 HydrophobicContact CB-CB 4.26Å; F71-A76 HydrophobicContact CD1-CB 4.12Å; Q72-A76 PolarHBondContact O-N 3.1Å; K73-A76 PolarHBondContact O-N 3.42Å; A76-T79 PolarHBondContact O-N 3.33Å; A76-I80 WeakPolarHBondContact O-CB 3.3Å; A76-I80 WeakPolarHBondContact O-CD1 3.38Å; A76-I80 WeakPolarHBondContact O-CG1 3.45Å; A76-I80 PolarHBondContact O-N 3.33Å; A76-L185 HydrophobicContact CB-CD2 3.99Å
77	A	89.9	Confident	88.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-47.8	177.8	0	0	0	0	0	111.9	Y24 K73 T79 I80 Y81 L119 L123 L185	Y24-A77 HydrophobicContact CE1-CB 4.35Å; K73-A77 WeakPolarHBondContact O-CB 3.47Å; K73-A77 PolarHBondContact O-N 2.8Å; A77-T79 PolarHBondContact O-N 3.2Å; A77-I80 PolarHBondContact O-N 2.72Å; A77-Y81 VanDerWaalsContact O-CB 3.3Å; A77-Y81 WeakPolarHBondContact O-CB 3.28Å; A77-Y81 PolarHBondContact O-N 3.37Å; A77-L119 HydrophobicContact CB-CD2 4.1Å; A77-L123 HydrophobicContact CB-CD2 4Å; A77-L185 HydrophobicContact CB-CD2 4.06Å
78	L	88	Confident	89.1	Confident	31 Å²	31	45.5 Å²	45.5	16%	0.162	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-39.4	177.8	-85	159.3	0	0	0	112.5	E74 Y81 E82 L123 K136	E74-L78 WeakPolarHBondContact O-CB 3.3Å; E74-L78 PolarHBondContact O-N 3.46Å; L78-Y81 WeakPolarHBondContact O-CB 3.48Å; L78-Y81 PolarHBondContact O-N 3.08Å; L78-E82 WeakPolarHBondContact O-CG 3.44Å; L78-E82 PolarHBondContact O-N 3Å; L78-L123 HydrophobicContact CD1-CD2 4.19Å; L78-L123 HydrophobicContact CD2-CD1 3.69Å; L78-L123 HydrophobicContact CD2-CD2 4.17Å; L78-L123 HydrophobicContact CD2-CG 4.47Å; L78-L123 HydrophobicContact CG-CD1 3.95Å; L78-L123 HydrophobicContact CG-CD2 3.68Å; L78-L123 HydrophobicContact CG-CG 4.44Å; L78-K136 HydrophobicContact CD1-CD 4.02Å
79	T	91	Very high	90.1	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-45.3	177.3	-60.3	0	0	0	0	111.4	I65 F71 D75 A76 A77 Y81 E82 M83 L143 L181	I65-T79 HydrophobicContact CD1-CG2 3.34Å; F71-T79 HydrophobicContact CE1-CG2 4.36Å; F71-T79 WeakPolarHBondContact CE1-OG1 3.38Å; D75-T79 VanDerWaalsContact O-CB 3.23Å; D75-T79 WeakPolarHBondContact O-CB 3.4Å; D75-T79 PolarHBondContact O-N 3.24Å; D75-T79 PolarHBondContact O-OG1 3Å; A76-T79 PolarHBondContact O-N 3.33Å; A77-T79 PolarHBondContact O-N 3.2Å; T79-Y81 VanDerWaalsContact C-N 3.31Å; T79-Y81 PolarHBondContact O-N 3.49Å; T79-E82 PolarHBondContact O-N 2.77Å; T79-M83 HydrophobicContact CG2-SD 4.39Å; T79-M83 VanDerWaalsContact O-CG 3.28Å; T79-M83 WeakPolarHBondContact O-CG 3.31Å; T79-M83 PolarHBondContact O-N 3.48Å; T79-L143 HydrophobicContact CG2-CD1 4.1Å; T79-L181 HydrophobicContact CG2-CD1 3.67Å
80	I	94.1	Very high	91.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-44.5	175.1	-67.2	164.1	0	0	0	110	Q31 A76 A77 E82 M83 L84 L119 I178 L181 L185	Q31-I80 HydrophobicContact CG-CG2 4.27Å; A76-I80 WeakPolarHBondContact O-CB 3.3Å; A76-I80 WeakPolarHBondContact O-CD1 3.38Å; A76-I80 WeakPolarHBondContact O-CG1 3.45Å; A76-I80 PolarHBondContact O-N 3.33Å; A77-I80 PolarHBondContact O-N 2.72Å; I80-E82 PolarHBondContact O-N 2.75Å; I80-M83 PolarHBondContact O-N 3Å; I80-L84 HydrophobicContact CG2-CD1 3.75Å; I80-L84 HydrophobicContact CG2-CG 4.21Å; I80-L84 VanDerWaalsContact O-CG 3.29Å; I80-L84 WeakPolarHBondContact O-CG 3.34Å; I80-L84 PolarHBondContact O-N 3.47Å; I80-L119 HydrophobicContact CB-CD1 4.37Å; I80-L119 HydrophobicContact CG2-CD1 3.71Å; I80-I178 HydrophobicContact CG1-CG2 4.4Å; I80-I178 HydrophobicContact CG2-CG2 3.95Å; I80-L181 HydrophobicContact CD1-CB 3.84Å; I80-L181 HydrophobicContact CG1-CB 3.73Å; I80-L181 HydrophobicContact CG1-CD1 4.14Å; I80-L185 HydrophobicContact CD1-CD1 4.18Å
81	Y	93.6	Very high	92.5	Very high	45 Å²	45	30.1 Å²	30.1	18%	0.176	15%	0.148	C	C	.	.	H	α-helix	trans	-56.4	-50.8	177.4	176.7	-103.6	0	0	0	111.7	A77 L78 T79 M83 L84 Q85 I116 L119 K120 L123	A77-Y81 VanDerWaalsContact O-CB 3.3Å; A77-Y81 WeakPolarHBondContact O-CB 3.28Å; A77-Y81 PolarHBondContact O-N 3.37Å; L78-Y81 WeakPolarHBondContact O-CB 3.48Å; L78-Y81 PolarHBondContact O-N 3.08Å; T79-Y81 VanDerWaalsContact C-N 3.31Å; T79-Y81 PolarHBondContact O-N 3.49Å; Y81-M83 PolarHBondContact O-N 3.48Å; Y81-L84 PolarHBondContact O-N 3.34Å; Y81-Q85 VanDerWaalsContact CE1-CD 3.43Å; Y81-Q85 HydrophobicContact CE1-CG 4.32Å; Y81-Q85 HydrophobicContact CE2-CG 4.42Å; Y81-Q85 VanDerWaalsContact CZ-NE2 3.32Å; Y81-Q85 WeakPolarHBondContact O-CG 3.22Å; Y81-Q85 PolarHBondContact O-N 2.72Å; Y81-Q85 PolarHBondContact OH-NE2 2.98Å; Y81-Q85 VanDerWaalsContact OH-NE2 3.07Å; Y81-I116 HydrophobicContact CD2-CG2 4.14Å; Y81-I116 HydrophobicContact CE2-CB 4.5Å; Y81-I116 HydrophobicContact CE2-CG2 3.54Å; Y81-L119 HydrophobicContact CD2-CB 3.85Å; Y81-K120 HydrophobicContact CE2-CB 3.98Å; Y81-L123 HydrophobicContact CD1-CD1 4.39Å; Y81-L123 HydrophobicContact CD2-CD1 4.45Å; Y81-L123 HydrophobicContact CG-CD1 4.04Å
82	E	93.5	Very high	93.2	Very high	40 Å²	40	36.5 Å²	36.5	19%	0.187	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-42.4	177	-72.6	-173.6	172.2	0	0	112.5	L78 T79 I80 Q85 N86 S140 L143	L78-E82 WeakPolarHBondContact O-CG 3.44Å; L78-E82 PolarHBondContact O-N 3Å; T79-E82 PolarHBondContact O-N 2.77Å; I80-E82 PolarHBondContact O-N 2.75Å; E82-Q85 PolarHBondContact O-N 2.91Å; E82-N86 PolarHBondContact O-N 3.49Å; E82-N86 VanDerWaalsContact O-N 3.11Å; E82-N86 PolarHBondContact O-ND2 2.94Å; E82-S140 VanDerWaalsContact OE1-CB 3.27Å; E82-S140 WeakPolarHBondContact OE1-CB 3.42Å; E82-S140 VanDerWaalsContact OE2-CA 3.28Å; E82-S140 WeakPolarHBondContact OE2-CA 3.32Å; E82-L143 HydrophobicContact CB-CD1 4.22Å
83	M	96.8	Very high	93.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.4	-47	177.2	-72.2	-177.9	74.7	0	0	111.5	I65 T79 I80 Y81 N86 I87 L143 Y147 N174 F177 I178 L181	I65-M83 HydrophobicContact CG2-CE 4.27Å; I65-M83 HydrophobicContact CG2-SD 4.19Å; T79-M83 HydrophobicContact CG2-SD 4.39Å; T79-M83 VanDerWaalsContact O-CG 3.28Å; T79-M83 WeakPolarHBondContact O-CG 3.31Å; T79-M83 PolarHBondContact O-N 3.48Å; I80-M83 PolarHBondContact O-N 3Å; Y81-M83 PolarHBondContact O-N 3.48Å; M83-N86 PolarHBondContact O-N 3.14Å; M83-I87 VanDerWaalsContact O-CG1 3.25Å; M83-I87 WeakPolarHBondContact O-CG1 3.47Å; M83-I87 PolarHBondContact O-N 3.12Å; M83-L143 HydrophobicContact CG-CD1 4.19Å; M83-L143 HydrophobicContact CG-CD2 4.05Å; M83-Y147 WeakPolarHBondContact CA-OH 3.35Å; M83-Y147 WeakPolarHBondContact CB-OH 3.46Å; M83-Y147 WeakPolarHBondContact CE-OH 3.34Å; M83-Y147 HydrophobicContact CG-CE2 4.33Å; M83-Y147 WeakPolarHBondContact CG-OH 3.46Å; M83-N174 HydrophobicContact CE-CB 4.04Å; M83-N174 WeakPolarHBondContact CE-OD1 3.43Å; M83-F177 HydrophobicContact CE-CB 4.37Å; M83-I178 HydrophobicContact CB-CD1 4.21Å; M83-I178 HydrophobicContact CB-CG1 4.32Å; M83-I178 HydrophobicContact CE-CD1 4.32Å; M83-I178 HydrophobicContact CE-CG1 3.84Å; M83-I178 HydrophobicContact SD-CG1 3.96Å; M83-L181 HydrophobicContact SD-CD1 3.85Å
84	L	97.7	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-41.2	179.5	-69.4	168.7	0	0	0	112.1	I80 Y81 N86 I87 F88 V112 Q115 I116 L119 F175 I178	I80-L84 HydrophobicContact CG2-CD1 3.75Å; I80-L84 HydrophobicContact CG2-CG 4.21Å; I80-L84 VanDerWaalsContact O-CG 3.29Å; I80-L84 WeakPolarHBondContact O-CG 3.34Å; I80-L84 PolarHBondContact O-N 3.47Å; Y81-L84 PolarHBondContact O-N 3.34Å; L84-N86 VanDerWaalsContact C-N 3.3Å; L84-N86 PolarHBondContact O-N 3.39Å; L84-I87 PolarHBondContact O-N 3.34Å; L84-F88 WeakPolarHBondContact O-CB 3.5Å; L84-F88 PolarHBondContact O-N 2.89Å; L84-V112 HydrophobicContact CB-CG1 4.26Å; L84-V112 HydrophobicContact CD2-CG1 4.26Å; L84-V112 WeakPolarHBondContact O-CG1 3.45Å; L84-Q115 HydrophobicContact CD1-CB 3.61Å; L84-I116 HydrophobicContact CB-CD1 4.16Å; L84-I116 HydrophobicContact CB-CG1 3.64Å; L84-I116 HydrophobicContact CD1-CG1 4.48Å; L84-L119 HydrophobicContact CD1-CD1 3.57Å; L84-F175 HydrophobicContact CD2-CE1 4.09Å; L84-F175 HydrophobicContact CD2-CZ 4.43Å; L84-I178 HydrophobicContact CD2-CD1 4.02Å; L84-I178 HydrophobicContact CG-CD1 4.4Å
85	Q	96.4	Very high	94.9	Very high	79 Å²	79	35.2 Å²	35.2	37%	0.369	17%	0.169	S	C	.	.	H	α-helix	trans	-58.3	-43.4	174.9	-74.3	-173.2	-48.7	0	0	111.9	Y81 E82 F88 A89 I116	Y81-Q85 VanDerWaalsContact CE1-CD 3.43Å; Y81-Q85 HydrophobicContact CE1-CG 4.32Å; Y81-Q85 HydrophobicContact CE2-CG 4.42Å; Y81-Q85 VanDerWaalsContact CZ-NE2 3.32Å; Y81-Q85 WeakPolarHBondContact O-CG 3.22Å; Y81-Q85 PolarHBondContact O-N 2.72Å; Y81-Q85 PolarHBondContact OH-NE2 2.98Å; Y81-Q85 VanDerWaalsContact OH-NE2 3.07Å; E82-Q85 PolarHBondContact O-N 2.91Å; Q85-F88 PolarHBondContact O-N 3.39Å; Q85-A89 PolarHBondContact O-N 2.81Å; Q85-I116 HydrophobicContact CG-CD1 4.19Å; Q85-I116 HydrophobicContact CG-CG1 4.4Å; Q85-I116 HydrophobicContact CG-CG2 4.21Å
86	N	97.5	Very high	95.3	Very high	38 Å²	38	37.1 Å²	37.1	20%	0.203	19%	0.187	C	C	.	.	H	α-helix	trans	-70.6	-38.3	178.2	-77.3	-84.3	0	0	0	112.4	E82 M83 L84 F88 A89 I90 Y147	E82-N86 PolarHBondContact O-N 3.49Å; E82-N86 VanDerWaalsContact O-N 3.11Å; E82-N86 PolarHBondContact O-ND2 2.94Å; M83-N86 PolarHBondContact O-N 3.14Å; L84-N86 VanDerWaalsContact C-N 3.3Å; L84-N86 PolarHBondContact O-N 3.39Å; N86-F88 VanDerWaalsContact C-N 3.32Å; N86-F88 PolarHBondContact O-N 3.47Å; N86-A89 PolarHBondContact O-N 3.33Å; N86-I90 WeakPolarHBondContact O-CG1 3.28Å; N86-I90 PolarHBondContact O-N 3.33Å; N86-Y147 HydrophobicContact CB-CD1 3.67Å; N86-Y147 HydrophobicContact CB-CD2 3.21Å; N86-Y147 HydrophobicContact CB-CE1 3.93Å; N86-Y147 HydrophobicContact CB-CE2 3.5Å; N86-Y147 HydrophobicContact CB-CG 3.3Å; N86-Y147 WeakPolarHBondContact OD1-CB 3.44Å
87	I	98.5	Very high	95.6	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-46.3	172.6	-68.5	165.7	0	0	0	109.8	M83 L84 A89 I90 F91 V112 Y147 I171 N174 F175 I178	M83-I87 VanDerWaalsContact O-CG1 3.25Å; M83-I87 WeakPolarHBondContact O-CG1 3.47Å; M83-I87 PolarHBondContact O-N 3.12Å; L84-I87 PolarHBondContact O-N 3.34Å; I87-A89 PolarHBondContact O-N 3.14Å; I87-I90 WeakPolarHBondContact O-CB 3.39Å; I87-I90 PolarHBondContact O-N 3.33Å; I87-F91 HydrophobicContact CG2-CD2 4.12Å; I87-F91 HydrophobicContact CG2-CE2 4.32Å; I87-F91 WeakPolarHBondContact O-CD2 3.32Å; I87-F91 PolarHBondContact O-N 3.34Å; I87-F91 VanDerWaalsContact O-N 3.07Å; I87-V112 HydrophobicContact CG2-CG2 4.39Å; I87-Y147 HydrophobicContact CG1-CE1 4.3Å; I87-I171 HydrophobicContact CD1-CG2 4.47Å; I87-I171 HydrophobicContact CG1-CD1 3.89Å; I87-I171 HydrophobicContact CG1-CG2 4.36Å; I87-I171 HydrophobicContact CG2-CD1 4.47Å; I87-I171 HydrophobicContact CG2-CG2 3.97Å; I87-N174 HydrophobicContact CD1-CB 4.16Å; I87-F175 HydrophobicContact CD1-CE2 4.18Å; I87-F175 HydrophobicContact CD1-CZ 4.21Å; I87-F175 HydrophobicContact CG2-CE2 4.38Å; I87-F175 HydrophobicContact CG2-CZ 4.48Å; I87-I178 HydrophobicContact CD1-CD1 3.79Å
88	F	98.3	Very high	95.8	Very high	56 Å²	56	40 Å²	40	25%	0.246	21%	0.206	C	C	.	.	H	α-helix	trans	-57.6	-47.7	176	-171.5	-91.2	0	0	0	111.4	L84 Q85 N86 I90 F91 R92 L109 V112 Y113 I116	L84-F88 WeakPolarHBondContact O-CB 3.5Å; L84-F88 PolarHBondContact O-N 2.89Å; Q85-F88 PolarHBondContact O-N 3.39Å; N86-F88 VanDerWaalsContact C-N 3.32Å; N86-F88 PolarHBondContact O-N 3.47Å; F88-I90 VanDerWaalsContact C-N 3.29Å; F88-I90 PolarHBondContact O-N 3.09Å; F88-F91 PolarHBondContact O-N 3.01Å; F88-R92 HydrophobicContact CD1-CG 4.02Å; F88-R92 HydrophobicContact CE1-CG 3.81Å; F88-R92 HydrophobicContact CZ-CG 4.39Å; F88-R92 VanDerWaalsContact O-CG 3.25Å; F88-R92 WeakPolarHBondContact O-CG 3.45Å; F88-R92 PolarHBondContact O-N 3.17Å; F88-R92 VanDerWaalsContact O-N 3.16Å; F88-L109 HydrophobicContact CD2-CB 4.46Å; F88-L109 HydrophobicContact CD2-CD2 3.58Å; F88-L109 HydrophobicContact CE2-CB 4.03Å; F88-L109 HydrophobicContact CE2-CD2 3.72Å; F88-L109 HydrophobicContact CE2-CG 4.46Å; F88-L109 HydrophobicContact CG-CD2 4.14Å; F88-L109 HydrophobicContact CZ-CD2 4.36Å; F88-V112 HydrophobicContact CB-CG1 3.91Å; F88-V112 HydrophobicContact CD2-CB 4.48Å; F88-V112 HydrophobicContact CD2-CG1 4.19Å; F88-Y113 HydrophobicContact CE2-CD2 4.37Å; F88-Y113 HydrophobicContact CZ-CD2 4.46Å; F88-I116 HydrophobicContact CB-CD1 4.05Å; F88-I116 HydrophobicContact CG-CD1 4.46Å
89	A	97.7	Very high	96.2	Very high	39 Å²	39	41.5 Å²	41.5	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-33.3	178.3	0	0	0	0	0	113.6	Q85 N86 I87 Q93	Q85-A89 PolarHBondContact O-N 2.81Å; N86-A89 PolarHBondContact O-N 3.33Å; I87-A89 PolarHBondContact O-N 3.14Å; A89-Q93 PolarHBondContact O-NE2 3.19Å
90	I	98.6	Very high	96.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-52.1	173.9	-74.3	164.8	0	0	0	110.2	N86 I87 F88 R92 Q93 Y147 I150 L151 L154 W164 V167 I171	N86-I90 WeakPolarHBondContact O-CG1 3.28Å; N86-I90 PolarHBondContact O-N 3.33Å; I87-I90 WeakPolarHBondContact O-CB 3.39Å; I87-I90 PolarHBondContact O-N 3.33Å; F88-I90 VanDerWaalsContact C-N 3.29Å; F88-I90 PolarHBondContact O-N 3.09Å; I90-R92 PolarHBondContact O-N 2.94Å; I90-R92 VanDerWaalsContact O-N 3.08Å; I90-Q93 WeakPolarHBondContact O-CB 3.3Å; I90-Q93 VanDerWaalsContact O-CG 3.27Å; I90-Q93 WeakPolarHBondContact O-CG 3.21Å; I90-Q93 PolarHBondContact O-N 3.16Å; I90-Y147 HydrophobicContact CD1-CD1 3.64Å; I90-Y147 HydrophobicContact CD1-CE1 4.28Å; I90-I150 HydrophobicContact CD1-CB 4.22Å; I90-I150 HydrophobicContact CD1-CD1 4.32Å; I90-I150 HydrophobicContact CD1-CG2 3.71Å; I90-I150 HydrophobicContact CG1-CG2 4.3Å; I90-L151 HydrophobicContact CG1-CD2 3.9Å; I90-L151 HydrophobicContact CG1-CG 4.2Å; I90-L154 HydrophobicContact CG2-CD1 4.27Å; I90-W164 HydrophobicContact CG2-CH2 4.24Å; I90-W164 HydrophobicContact CG2-CZ3 3.92Å; I90-W164 WeakPolarHBondContact O-CH2 3.35Å; I90-V167 HydrophobicContact CG2-CG1 3.83Å; I90-I171 HydrophobicContact CD1-CD1 3.95Å
91	F	98.1	Very high	96.6	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-71.3	-3.1	-178.8	-80.5	-92.9	0	0	0	114.3	L42 L45 I87 F88 L95 W100 V105 L108 L109 I171	L42-F91 HydrophobicContact CD2-CE1 4.05Å; L42-F91 HydrophobicContact CD2-CE2 4.22Å; L42-F91 HydrophobicContact CD2-CZ 3.43Å; L42-F91 VanDerWaalsContact CD2-CZ 3.43Å; L45-F91 HydrophobicContact CD1-CE1 4.3Å; I87-F91 HydrophobicContact CG2-CD2 4.12Å; I87-F91 HydrophobicContact CG2-CE2 4.32Å; I87-F91 WeakPolarHBondContact O-CD2 3.32Å; I87-F91 PolarHBondContact O-N 3.34Å; I87-F91 VanDerWaalsContact O-N 3.07Å; F88-F91 PolarHBondContact O-N 3.01Å; F91-L95 WeakPolarHBondContact O-CD1 3.37Å; F91-W100 AromaticContact CE1-CZ3 3.81Å; F91-W100 HydrophobicContact CE1-CZ3 3.81Å; F91-V105 HydrophobicContact CD1-CG1 4.44Å; F91-L108 HydrophobicContact CD1-CD2 3.71Å; F91-L108 HydrophobicContact CD2-CD2 4.3Å; F91-L108 HydrophobicContact CE1-CD2 3.51Å; F91-L108 HydrophobicContact CE2-CD2 4.16Å; F91-L108 HydrophobicContact CG-CD2 4.11Å; F91-L108 HydrophobicContact CZ-CD2 3.77Å; F91-L109 HydrophobicContact CB-CD2 3.59Å; F91-L109 HydrophobicContact CB-CG 4.18Å; F91-I171 HydrophobicContact CE2-CB 4.24Å; F91-I171 HydrophobicContact CE2-CD1 4.47Å; F91-I171 HydrophobicContact CE2-CG1 3.94Å; F91-I171 HydrophobicContact CE2-CG2 3.9Å; F91-I171 HydrophobicContact CZ-CG2 4.48Å
92	R	97.6	Very high	96.7	Very high	173 Å²	173	51.5 Å²	51.5	65%	0.653	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-5.1	169.6	-71.2	-71.7	-64.2	-173.7	-0.8	113.8	F88 I90 L109	F88-R92 HydrophobicContact CD1-CG 4.02Å; F88-R92 HydrophobicContact CE1-CG 3.81Å; F88-R92 HydrophobicContact CZ-CG 4.39Å; F88-R92 VanDerWaalsContact O-CG 3.25Å; F88-R92 WeakPolarHBondContact O-CG 3.45Å; F88-R92 PolarHBondContact O-N 3.17Å; F88-R92 VanDerWaalsContact O-N 3.16Å; I90-R92 PolarHBondContact O-N 2.94Å; I90-R92 VanDerWaalsContact O-N 3.08Å; R92-L109 HydrophobicContact CG-CD2 4.37Å
93	Q	98.2	Very high	96.9	Very high	61 Å²	61	53.4 Å²	53.4	29%	0.285	29%	0.294	S	S	.	.	S	Bend	trans	-74.6	174.6	173.3	-55.9	-53.2	-55.3	0	0	111.4	A89 I90 L95 L151 Y159 W164	A89-Q93 PolarHBondContact O-NE2 3.19Å; I90-Q93 WeakPolarHBondContact O-CB 3.3Å; I90-Q93 VanDerWaalsContact O-CG 3.27Å; I90-Q93 WeakPolarHBondContact O-CG 3.21Å; I90-Q93 PolarHBondContact O-N 3.16Å; Q93-L95 PolarHBondContact O-N 2.97Å; Q93-L151 HydrophobicContact CG-CD2 3.76Å; Q93-Y159 HydrophobicContact CB-CD1 4.3Å; Q93-Y159 HydrophobicContact CB-CE1 3.75Å; Q93-Y159 HydrophobicContact CG-CE1 4.21Å; Q93-W164 HydrophobicContact CB-CH2 4.01Å; Q93-W164 HydrophobicContact CB-CZ2 3.9Å
94	D	96.1	Very high	97	Very high	85 Å²	85	54.9 Å²	54.9	46%	0.455	30%	0.301	S	S	.	.			trans	-66.9	118.6	179.1	-177	9.7	0	0	0	112.1	S96 W164	D94-S96 WeakPolarHBondContact OD1-CB 3.37Å; D94-S96 PolarHBondContact OD1-N 3.36Å; D94-S96 PolarHBondContact OD1-OG 3.44Å; D94-S96 PolarHBondContact OD2-OG 2.83Å; D94-W164 VanDerWaalsContact O-CE2 3.28Å; D94-W164 WeakPolarHBondContact O-CZ2 3.44Å; D94-W164 PolarHBondContact O-NE1 3.47Å
95	L	96.1	Very high	97	Very high	31 Å²	31	55.5 Å²	55.5	16%	0.162	31%	0.305	C	S	.	.			trans	-108.3	2.5	-179.2	-67.4	160	0	0	0	112.4	F91 Q93 S97 T98 W100 V105 W164	F91-L95 WeakPolarHBondContact O-CD1 3.37Å; Q93-L95 PolarHBondContact O-N 2.97Å; L95-S97 PolarHBondContact O-N 3.4Å; L95-S97 VanDerWaalsContact O-N 3.15Å; L95-T98 HydrophobicContact CD2-CG2 4.29Å; L95-T98 WeakPolarHBondContact O-CB 3.43Å; L95-T98 WeakPolarHBondContact O-CG2 3.29Å; L95-T98 PolarHBondContact O-N 3.39Å; L95-T98 PolarHBondContact O-OG1 3.42Å; L95-W100 HydrophobicContact CD2-CE3 3.82Å; L95-W100 HydrophobicContact CD2-CZ3 3.64Å; L95-V105 HydrophobicContact CD1-CG1 3.62Å; L95-V105 HydrophobicContact CD1-CG2 4.42Å; L95-W164 HydrophobicContact CD2-CD2 3.67Å; L95-W164 HydrophobicContact CD2-CE3 3.71Å; L95-W164 HydrophobicContact CD2-CG 4.43Å; L95-W164 HydrophobicContact CD2-CH2 3.54Å; L95-W164 HydrophobicContact CD2-CZ2 3.49Å; L95-W164 VanDerWaalsContact CD2-CZ2 3.49Å; L95-W164 HydrophobicContact CD2-CZ3 3.66Å; L95-W164 HydrophobicContact CG-CH2 4.23Å; L95-W164 HydrophobicContact CG-CZ2 3.99Å
96	S	94.6	Very high	97.1	Very high	94 Å²	94	57.4 Å²	57.4	66%	0.657	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-56.8	-34.2	-171.2	59.8	0	0	0	0	113.7	D94 T98	D94-S96 WeakPolarHBondContact OD1-CB 3.37Å; D94-S96 PolarHBondContact OD1-N 3.36Å; D94-S96 PolarHBondContact OD1-OG 3.44Å; D94-S96 PolarHBondContact OD2-OG 2.83Å; S96-T98 PolarHBondContact O-N 3.29Å
97	S	94.6	Very high	97.2	Very high	51 Å²	51	59.3 Å²	59.3	36%	0.357	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-69.7	-14.1	178.6	73.7	0	0	0	0	114.5	L95 Y159	L95-S97 PolarHBondContact O-N 3.4Å; L95-S97 VanDerWaalsContact O-N 3.15Å; S97-Y159 WeakPolarHBondContact CB-O 3.43Å; S97-Y159 PolarHBondContact OG-O 3.44Å
98	T	95.6	Very high	97.2	Very high	8 Å²	8	59.3 Å²	59.3	5%	0.049	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-81.9	-30.1	-169.9	65.1	0	0	0	0	112.9	L95 S96 W100 H161 W164	L95-T98 HydrophobicContact CD2-CG2 4.29Å; L95-T98 WeakPolarHBondContact O-CB 3.43Å; L95-T98 WeakPolarHBondContact O-CG2 3.29Å; L95-T98 PolarHBondContact O-N 3.39Å; L95-T98 PolarHBondContact O-OG1 3.42Å; S96-T98 PolarHBondContact O-N 3.29Å; T98-W100 HydrophobicContact CG2-CD2 4.02Å; T98-W100 HydrophobicContact CG2-CE3 4.18Å; T98-W100 HydrophobicContact CG2-CG 4.44Å; T98-W100 HydrophobicContact CG2-CZ2 4.41Å; T98-W100 HydrophobicContact CG2-CZ3 4.44Å; T98-W100 PolarHBondContact O-N 2.95Å; T98-W100 VanDerWaalsContact OG1-CB 3.3Å; T98-W100 WeakPolarHBondContact OG1-CB 3.49Å; T98-W100 VanDerWaalsContact OG1-CG 3.28Å; T98-W100 PolarHBondContact OG1-N 2.75Å; T98-H161 PolarHBondContact O-CE1 3.42Å; T98-H161 PolarHBondContact O-ND1 3.41Å; T98-H161 VanDerWaalsContact O-ND1 3.09Å; T98-W164 HydrophobicContact CG2-CB 3.48Å; T98-W164 VanDerWaalsContact CG2-CB 3.48Å; T98-W164 HydrophobicContact CG2-CD2 4.19Å; T98-W164 HydrophobicContact CG2-CG 3.36Å
99	G	94.8	Very high	97.2	Very high	63 Å²	63	57.8 Å²	57.8	65%	0.649	32%	0.319	S	S	*	.			trans	61.6	21.4	-166	0	0	0	0	0	113.3
100	W	97.1	Very high	97.2	Very high	18 Å²	18	58 Å²	58	7%	0.068	32%	0.32	C	S	.	.			trans	-69.4	150	176	-72.3	-6.7	0	0	0	111.6	L45 N46 F91 L95 T98 E102 V105 W164 R168	L45-W100 HydrophobicContact CB-CD2 3.95Å; L45-W100 HydrophobicContact CB-CG 4.13Å; L45-W100 HydrophobicContact CB-CZ2 4.36Å; L45-W100 HydrophobicContact CD1-CD2 3.99Å; L45-W100 HydrophobicContact CD1-CE3 3.72Å; L45-W100 HydrophobicContact CD1-CH2 4.2Å; L45-W100 HydrophobicContact CD1-CZ2 4.43Å; L45-W100 HydrophobicContact CD1-CZ3 3.84Å; L45-W100 HydrophobicContact CD2-CB 3.93Å; L45-W100 HydrophobicContact CD2-CD2 3.99Å; L45-W100 HydrophobicContact CD2-CE3 4.18Å; L45-W100 HydrophobicContact CD2-CG 3.9Å; L45-W100 HydrophobicContact CG-CD2 4.19Å; L45-W100 HydrophobicContact CG-CE3 4.37Å; L45-W100 HydrophobicContact CG-CG 4.46Å; N46-W100 PolarHBondContact O-NE1 3.29Å; F91-W100 AromaticContact CE1-CZ3 3.81Å; F91-W100 HydrophobicContact CE1-CZ3 3.81Å; L95-W100 HydrophobicContact CD2-CE3 3.82Å; L95-W100 HydrophobicContact CD2-CZ3 3.64Å; T98-W100 HydrophobicContact CG2-CD2 4.02Å; T98-W100 HydrophobicContact CG2-CE3 4.18Å; T98-W100 HydrophobicContact CG2-CG 4.44Å; T98-W100 HydrophobicContact CG2-CZ2 4.41Å; T98-W100 HydrophobicContact CG2-CZ3 4.44Å; T98-W100 PolarHBondContact O-N 2.95Å; T98-W100 VanDerWaalsContact OG1-CB 3.3Å; T98-W100 WeakPolarHBondContact OG1-CB 3.49Å; T98-W100 VanDerWaalsContact OG1-CG 3.28Å; T98-W100 PolarHBondContact OG1-N 2.75Å; W100-E102 PolarHBondContact O-N 3.46Å; W100-V105 HydrophobicContact CB-CG2 4.3Å; W100-V105 HydrophobicContact CE3-CG2 4.2Å; W100-W164 HydrophobicContact CH2-CB 3.98Å; W100-W164 HydrophobicContact CH2-CE3 4.1Å; W100-W164 HydrophobicContact CZ2-CB 4.12Å; W100-W164 HydrophobicContact CZ3-CE3 4.16Å; W100-R168 HydrophobicContact CH2-CB 3.92Å; W100-R168 HydrophobicContact CH2-CG 4.29Å; W100-R168 HydrophobicContact CZ2-CB 4.1Å; W100-R168 HydrophobicContact CZ2-CG 4.38Å
101	N	97.3	Very high	97.2	Very high	89 Å²	89	60.1 Å²	60.1	48%	0.476	33%	0.332	S	S	.	.			trans	-69	115.2	174.6	-178.1	-48.4	0	0	0	109.6	T103 I104 V105	N101-T103 VanDerWaalsContact C-N 3.3Å; N101-T103 PolarHBondContact O-N 2.89Å; N101-T103 VanDerWaalsContact OD1-CB 3.27Å; N101-T103 WeakPolarHBondContact OD1-CB 3.42Å; N101-T103 PolarHBondContact OD1-N 3.4Å; N101-I104 HydrophobicContact CB-CB 4.35Å; N101-I104 HydrophobicContact CB-CD1 3.87Å; N101-I104 HydrophobicContact CB-CG1 3.9Å; N101-I104 WeakPolarHBondContact O-CB 3.18Å; N101-I104 PolarHBondContact O-N 3.48Å; N101-I104 PolarHBondContact OD1-N 3.44Å; N101-V105 PolarHBondContact O-N 3Å
102	E	96.2	Very high	97.2	Very high	151 Å²	151	60 Å²	60	71%	0.706	33%	0.331	S	S	*	.	H	α-helix	trans	-57.3	-40.7	-177	-66.3	-179.6	176.9	0	0	112.4	W100 I104 V105 E106	W100-E102 PolarHBondContact O-N 3.46Å; E102-I104 VanDerWaalsContact C-N 3.27Å; E102-I104 PolarHBondContact O-N 3.19Å; E102-V105 CarbonylContact O-C 3.59Å; E102-V105 WeakPolarHBondContact O-CA 3.35Å; E102-V105 WeakPolarHBondContact O-CB 3.48Å; E102-V105 PolarHBondContact O-N 2.86Å; E102-E106 WeakPolarHBondContact O-CG 3.41Å; E102-E106 PolarHBondContact O-N 2.83Å
103	T	97.9	Very high	97.1	Very high	81 Å²	81	57.7 Å²	57.7	50%	0.497	32%	0.323	S	S	.	.	H	α-helix	trans	-60.8	-35.2	177.2	-51.9	0	0	0	0	112.3	N101 N107	N101-T103 VanDerWaalsContact C-N 3.3Å; N101-T103 PolarHBondContact O-N 2.89Å; N101-T103 VanDerWaalsContact OD1-CB 3.27Å; N101-T103 WeakPolarHBondContact OD1-CB 3.42Å; N101-T103 PolarHBondContact OD1-N 3.4Å; T103-N107 WeakPolarHBondContact O-CB 3.12Å; T103-N107 PolarHBondContact O-N 3.2Å; T103-N107 PolarHBondContact O-ND2 2.95Å
104	I	98.4	Very high	96.9	Very high	30 Å²	30	59.7 Å²	59.7	15%	0.154	33%	0.333	C	S	.	.	H	α-helix	trans	-68.3	-41.2	175.8	-59.8	-176.7	0	0	0	110.3	L41 Q44 L45 N101 E102 N107 L108	L41-I104 HydrophobicContact CB-CG2 4.12Å; L41-I104 HydrophobicContact CD2-CG2 3.96Å; L41-I104 WeakPolarHBondContact O-CG2 2.92Å; Q44-I104 HydrophobicContact CB-CD1 3.87Å; Q44-I104 HydrophobicContact CB-CG2 4.38Å; L45-I104 HydrophobicContact CD2-CB 4.05Å; L45-I104 HydrophobicContact CD2-CG2 3.66Å; L45-I104 HydrophobicContact CG-CG2 4.24Å; N101-I104 HydrophobicContact CB-CB 4.35Å; N101-I104 HydrophobicContact CB-CD1 3.87Å; N101-I104 HydrophobicContact CB-CG1 3.9Å; N101-I104 WeakPolarHBondContact O-CB 3.18Å; N101-I104 PolarHBondContact O-N 3.48Å; N101-I104 PolarHBondContact OD1-N 3.44Å; E102-I104 VanDerWaalsContact C-N 3.27Å; E102-I104 PolarHBondContact O-N 3.19Å; I104-N107 PolarHBondContact O-N 3.14Å; I104-L108 WeakPolarHBondContact O-CB 3.44Å; I104-L108 PolarHBondContact O-N 3.07Å
105	V	98.3	Very high	96.9	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-44.4	176.7	175.9	0	0	0	0	111.1	L45 F91 L95 W100 N101 E102 N107 L108 L109	L45-V105 HydrophobicContact CD2-CG2 4.02Å; F91-V105 HydrophobicContact CD1-CG1 4.44Å; L95-V105 HydrophobicContact CD1-CG1 3.62Å; L95-V105 HydrophobicContact CD1-CG2 4.42Å; W100-V105 HydrophobicContact CB-CG2 4.3Å; W100-V105 HydrophobicContact CE3-CG2 4.2Å; N101-V105 PolarHBondContact O-N 3Å; E102-V105 CarbonylContact O-C 3.59Å; E102-V105 WeakPolarHBondContact O-CA 3.35Å; E102-V105 WeakPolarHBondContact O-CB 3.48Å; E102-V105 PolarHBondContact O-N 2.86Å; V105-N107 PolarHBondContact O-N 2.87Å; V105-L108 WeakPolarHBondContact O-CB 3.44Å; V105-L108 PolarHBondContact O-N 3.21Å; V105-L108 VanDerWaalsContact O-N 3.16Å; V105-L109 HydrophobicContact CG1-CD1 4.2Å; V105-L109 PolarHBondContact O-N 3.14Å
106	E	98.3	Very high	96.8	Very high	120 Å²	120	55.2 Å²	55.2	56%	0.561	31%	0.309	S	S	*	.	H	α-helix	trans	-61	-45	176.7	-72.9	178.8	157.6	0	0	111.5	E102 L108 L109 A110	E102-E106 WeakPolarHBondContact O-CG 3.41Å; E102-E106 PolarHBondContact O-N 2.83Å; E106-L108 VanDerWaalsContact C-N 3.29Å; E106-L108 PolarHBondContact O-N 2.89Å; E106-L109 PolarHBondContact O-N 3.37Å; E106-A110 WeakPolarHBondContact O-CB 3.36Å; E106-A110 PolarHBondContact O-N 3.39Å
107	N	98.4	Very high	96.6	Very high	77 Å²	77	54.1 Å²	54.1	41%	0.412	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-38.2	174.7	-76.2	-34.5	0	0	0	111.9	L41 T103 I104 V105 N111	L41-N107 HydrophobicContact CD1-CB 4.06Å; L41-N107 HydrophobicContact CD2-CB 4.07Å; T103-N107 WeakPolarHBondContact O-CB 3.12Å; T103-N107 PolarHBondContact O-N 3.2Å; T103-N107 PolarHBondContact O-ND2 2.95Å; I104-N107 PolarHBondContact O-N 3.14Å; V105-N107 PolarHBondContact O-N 2.87Å; N107-N111 WeakPolarHBondContact O-CB 3.49Å; N107-N111 PolarHBondContact O-N 2.97Å; N107-N111 PolarHBondContact O-ND2 3.43Å
108	L	98.6	Very high	96.4	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-49.2	175.1	174.4	66.4	0	0	0	110.5	C38 L41 L42 F91 I104 V105 E106 A110 N111 V112	C38-L108 HydrophobicContact CB-CD1 3.7Å; L41-L108 HydrophobicContact CB-CB 4.35Å; L41-L108 HydrophobicContact CB-CD1 4.5Å; L41-L108 HydrophobicContact CD1-CB 4.24Å; L42-L108 HydrophobicContact CD2-CD2 3.63Å; L42-L108 HydrophobicContact CG-CD1 4.18Å; L42-L108 HydrophobicContact CG-CD2 4.04Å; F91-L108 HydrophobicContact CD1-CD2 3.71Å; F91-L108 HydrophobicContact CD2-CD2 4.3Å; F91-L108 HydrophobicContact CE1-CD2 3.51Å; F91-L108 HydrophobicContact CE2-CD2 4.16Å; F91-L108 HydrophobicContact CG-CD2 4.11Å; F91-L108 HydrophobicContact CZ-CD2 3.77Å; I104-L108 WeakPolarHBondContact O-CB 3.44Å; I104-L108 PolarHBondContact O-N 3.07Å; V105-L108 WeakPolarHBondContact O-CB 3.44Å; V105-L108 PolarHBondContact O-N 3.21Å; V105-L108 VanDerWaalsContact O-N 3.16Å; E106-L108 VanDerWaalsContact C-N 3.29Å; E106-L108 PolarHBondContact O-N 2.89Å; L108-A110 VanDerWaalsContact C-N 3.35Å; L108-A110 PolarHBondContact O-N 3.14Å; L108-N111 PolarHBondContact O-N 3.02Å; L108-V112 HydrophobicContact CD1-CG2 4.28Å; L108-V112 WeakPolarHBondContact O-CG2 3.47Å; L108-V112 PolarHBondContact O-N 2.9Å
109	L	98.4	Very high	96.1	Very high	25 Å²	25	55.5 Å²	55.5	13%	0.131	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-42.2	178.3	-76.1	172	0	0	0	111.8	F88 F91 R92 V105 E106 V112 Y113	F88-L109 HydrophobicContact CD2-CB 4.46Å; F88-L109 HydrophobicContact CD2-CD2 3.58Å; F88-L109 HydrophobicContact CE2-CB 4.03Å; F88-L109 HydrophobicContact CE2-CD2 3.72Å; F88-L109 HydrophobicContact CE2-CG 4.46Å; F88-L109 HydrophobicContact CG-CD2 4.14Å; F88-L109 HydrophobicContact CZ-CD2 4.36Å; F91-L109 HydrophobicContact CB-CD2 3.59Å; F91-L109 HydrophobicContact CB-CG 4.18Å; R92-L109 HydrophobicContact CG-CD2 4.37Å; V105-L109 HydrophobicContact CG1-CD1 4.2Å; V105-L109 PolarHBondContact O-N 3.14Å; E106-L109 PolarHBondContact O-N 3.37Å; L109-V112 PolarHBondContact O-N 3.2Å; L109-Y113 VanDerWaalsContact O-CB 3.28Å; L109-Y113 WeakPolarHBondContact O-CB 3.4Å; L109-Y113 PolarHBondContact O-N 3.43Å
110	A	98.3	Very high	95.7	Very high	43 Å²	43	56.7 Å²	56.7	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-46.2	176.1	0	0	0	0	0	111.7	E106 L108 V112 Y113 H114	E106-A110 WeakPolarHBondContact O-CB 3.36Å; E106-A110 PolarHBondContact O-N 3.39Å; L108-A110 VanDerWaalsContact C-N 3.35Å; L108-A110 PolarHBondContact O-N 3.14Å; A110-V112 VanDerWaalsContact C-N 3.35Å; A110-V112 PolarHBondContact O-N 3.28Å; A110-Y113 PolarHBondContact O-N 2.72Å; A110-H114 PolarHBondContact O-CD2 2.78Å; A110-H114 PolarHBondContact O-N 3.31Å
111	N	97.8	Very high	95	Very high	44 Å²	44	58.9 Å²	58.9	24%	0.235	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-39.1	177	-85.4	-88.3	0	0	0	112.4	N107 L108 Q115	N107-N111 WeakPolarHBondContact O-CB 3.49Å; N107-N111 PolarHBondContact O-N 2.97Å; N107-N111 PolarHBondContact O-ND2 3.43Å; L108-N111 PolarHBondContact O-N 3.02Å; N111-Q115 WeakPolarHBondContact O-CG 3.28Å; N111-Q115 PolarHBondContact O-N 3.23Å; N111-Q115 PolarHBondContact O-NE2 3.07Å
112	V	98.3	Very high	94.2	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-44.9	175.3	171.8	0	0	0	0	110.5	L84 I87 F88 L108 L109 A110 H114 Q115 I116 F175	L84-V112 HydrophobicContact CB-CG1 4.26Å; L84-V112 HydrophobicContact CD2-CG1 4.26Å; L84-V112 WeakPolarHBondContact O-CG1 3.45Å; I87-V112 HydrophobicContact CG2-CG2 4.39Å; F88-V112 HydrophobicContact CB-CG1 3.91Å; F88-V112 HydrophobicContact CD2-CB 4.48Å; F88-V112 HydrophobicContact CD2-CG1 4.19Å; L108-V112 HydrophobicContact CD1-CG2 4.28Å; L108-V112 WeakPolarHBondContact O-CG2 3.47Å; L108-V112 PolarHBondContact O-N 2.9Å; L109-V112 PolarHBondContact O-N 3.2Å; A110-V112 VanDerWaalsContact C-N 3.35Å; A110-V112 PolarHBondContact O-N 3.28Å; V112-H114 PolarHBondContact O-N 3.46Å; V112-Q115 WeakPolarHBondContact O-CB 3.31Å; V112-Q115 PolarHBondContact O-N 2.97Å; V112-I116 HydrophobicContact CG1-CD1 3.91Å; V112-I116 HydrophobicContact CG1-CG1 4.47Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.32Å; V112-F175 HydrophobicContact CG2-CZ 4.13Å
113	Y	96.6	Very high	93.4	Very high	124 Å²	124	49.1 Å²	49.1	49%	0.486	25%	0.25	S	S	.	.	H	α-helix	trans	-59.7	-45	178.2	-178	-94.6	0	0	0	112.1	F88 L109 A110 Q115 I116 D117	F88-Y113 HydrophobicContact CE2-CD2 4.37Å; F88-Y113 HydrophobicContact CZ-CD2 4.46Å; L109-Y113 VanDerWaalsContact O-CB 3.28Å; L109-Y113 WeakPolarHBondContact O-CB 3.4Å; L109-Y113 PolarHBondContact O-N 3.43Å; A110-Y113 PolarHBondContact O-N 2.72Å; Y113-Q115 VanDerWaalsContact C-N 3.3Å; Y113-Q115 PolarHBondContact O-N 3.24Å; Y113-I116 WeakPolarHBondContact O-CB 3.41Å; Y113-I116 PolarHBondContact O-N 3.33Å; Y113-I116 VanDerWaalsContact O-N 3.12Å; Y113-D117 PolarHBondContact O-N 3.26Å
114	H	94.2	Very high	92.4	Very high	104 Å²	104	49.6 Å²	49.6	48%	0.481	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-40.2	175.7	-82	-63.3	0	0	0	112.6	A110 V112 D117 H118	A110-H114 PolarHBondContact O-CD2 2.78Å; A110-H114 PolarHBondContact O-N 3.31Å; V112-H114 PolarHBondContact O-N 3.46Å; H114-D117 PolarHBondContact O-N 3.28Å; H114-H118 PolarHBondContact O-CD2 2.91Å; H114-H118 PolarHBondContact O-N 2.91Å
115	Q	95.3	Very high	91.1	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-42.6	175	-71.3	166.9	87.2	0	0	112	S35 C38 L84 N111 V112 Y113 D117 L119	S35-Q115 PolarHBondContact OG-OE1 3.39Å; C38-Q115 PolarHBondContact SG-NE2 3.09Å; L84-Q115 HydrophobicContact CD1-CB 3.61Å; N111-Q115 WeakPolarHBondContact O-CG 3.28Å; N111-Q115 PolarHBondContact O-N 3.23Å; N111-Q115 PolarHBondContact O-NE2 3.07Å; V112-Q115 WeakPolarHBondContact O-CB 3.31Å; V112-Q115 PolarHBondContact O-N 2.97Å; Y113-Q115 VanDerWaalsContact C-N 3.3Å; Y113-Q115 PolarHBondContact O-N 3.24Å; Q115-D117 VanDerWaalsContact C-N 3.34Å; Q115-L119 WeakPolarHBondContact O-CB 3.08Å; Q115-L119 WeakPolarHBondContact O-CD1 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.21Å; Q115-L119 PolarHBondContact O-N 3.27Å
116	I	94.3	Very high	89.6	Confident	18 Å²	18	54.6 Å²	54.6	9%	0.092	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-47.1	176.5	-67.5	167.6	0	0	0	110.2	Y81 L84 Q85 F88 V112 Y113 L119 K120	Y81-I116 HydrophobicContact CD2-CG2 4.14Å; Y81-I116 HydrophobicContact CE2-CB 4.5Å; Y81-I116 HydrophobicContact CE2-CG2 3.54Å; L84-I116 HydrophobicContact CB-CD1 4.16Å; L84-I116 HydrophobicContact CB-CG1 3.64Å; L84-I116 HydrophobicContact CD1-CG1 4.48Å; Q85-I116 HydrophobicContact CG-CD1 4.19Å; Q85-I116 HydrophobicContact CG-CG1 4.4Å; Q85-I116 HydrophobicContact CG-CG2 4.21Å; F88-I116 HydrophobicContact CB-CD1 4.05Å; F88-I116 HydrophobicContact CG-CD1 4.46Å; V112-I116 HydrophobicContact CG1-CD1 3.91Å; V112-I116 HydrophobicContact CG1-CG1 4.47Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.32Å; Y113-I116 WeakPolarHBondContact O-CB 3.41Å; Y113-I116 PolarHBondContact O-N 3.33Å; Y113-I116 VanDerWaalsContact O-N 3.12Å; I116-L119 PolarHBondContact O-N 2.82Å; I116-K120 WeakPolarHBondContact O-CB 3.35Å; I116-K120 PolarHBondContact O-N 3.46Å
117	D	90.4	Very high	87.8	Confident	71 Å²	71	52.3 Å²	52.3	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-48.3	-179.2	-168.3	64.8	0	0	0	111.7	Y113 H114 Q115 L119 K120 T121	Y113-D117 PolarHBondContact O-N 3.26Å; H114-D117 PolarHBondContact O-N 3.28Å; Q115-D117 VanDerWaalsContact C-N 3.34Å; D117-L119 PolarHBondContact O-N 3.32Å; D117-K120 WeakPolarHBondContact O-CB 3.23Å; D117-K120 PolarHBondContact O-N 3.44Å; D117-T121 PolarHBondContact O-N 3.11Å; D117-T121 VanDerWaalsContact O-N 3.09Å; D117-T121 PolarHBondContact O-OG1 3.42Å
118	H	89.5	Confident	85.8	Confident	88 Å²	88	56.9 Å²	56.9	41%	0.407	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176.3	-78.3	-60.9	0	0	0	113.3	H114 K120 I122	H114-H118 PolarHBondContact O-CD2 2.91Å; H114-H118 PolarHBondContact O-N 2.91Å; H118-K120 VanDerWaalsContact C-N 3.35Å; H118-I122 PolarHBondContact O-N 3.49Å
119	L	89.8	Confident	83.6	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-42.1	175.8	-81.3	161.6	0	0	0	111.3	L27 A77 I80 Y81 L84 Q115 I116 D117 I122 L123	L27-L119 HydrophobicContact CD1-CD2 3.84Å; L27-L119 HydrophobicContact CD1-CG 4.07Å; L27-L119 HydrophobicContact CD2-CD2 3.72Å; L27-L119 HydrophobicContact CG-CD2 4.24Å; A77-L119 HydrophobicContact CB-CD2 4.1Å; I80-L119 HydrophobicContact CB-CD1 4.37Å; I80-L119 HydrophobicContact CG2-CD1 3.71Å; Y81-L119 HydrophobicContact CD2-CB 3.85Å; L84-L119 HydrophobicContact CD1-CD1 3.57Å; Q115-L119 WeakPolarHBondContact O-CB 3.08Å; Q115-L119 WeakPolarHBondContact O-CD1 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.21Å; Q115-L119 PolarHBondContact O-N 3.27Å; I116-L119 PolarHBondContact O-N 2.82Å; D117-L119 PolarHBondContact O-N 3.32Å; L119-I122 PolarHBondContact O-N 2.93Å; L119-L123 WeakPolarHBondContact O-CB 3.41Å; L119-L123 WeakPolarHBondContact O-CG 3.21Å; L119-L123 PolarHBondContact O-N 2.99Å
120	K	86.4	Confident	81.3	Confident	87 Å²	87	69.2 Å²	69.2	38%	0.378	33%	0.333	S	S	.	.	H	α-helix	trans	-58.6	-49.5	179.6	-177	-179.9	169.3	-173.2	0	111.4	Y81 I116 D117 H118 I122 L123 E124	Y81-K120 HydrophobicContact CE2-CB 3.98Å; I116-K120 WeakPolarHBondContact O-CB 3.35Å; I116-K120 PolarHBondContact O-N 3.46Å; D117-K120 WeakPolarHBondContact O-CB 3.23Å; D117-K120 PolarHBondContact O-N 3.44Å; H118-K120 VanDerWaalsContact C-N 3.35Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 3.27Å; K120-L123 PolarHBondContact O-N 3.27Å; K120-L123 VanDerWaalsContact O-N 3.16Å; K120-E124 VanDerWaalsContact CE-CD 3.47Å; K120-E124 WeakPolarHBondContact CE-OE1 3.45Å; K120-E124 HydrophobicContact CG-CG 4.21Å; K120-E124 IonicContact NZ-OE1 2.72Å; K120-E124 WeakPolarHBondContact O-CB 3.46Å; K120-E124 WeakPolarHBondContact O-CG 3.15Å; K120-E124 PolarHBondContact O-N 2.88Å
121	T	82.4	Confident	78.8	Confident	65 Å²	65	74.7 Å²	74.7	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-56.1	-45.7	179.4	-50.3	0	0	0	0	111.9	D117 E124 E125	D117-T121 PolarHBondContact O-N 3.11Å; D117-T121 VanDerWaalsContact O-N 3.09Å; D117-T121 PolarHBondContact O-OG1 3.42Å; T121-E124 PolarHBondContact O-N 2.9Å; T121-E125 WeakPolarHBondContact O-CG 3.46Å; T121-E125 PolarHBondContact O-N 2.86Å
122	I	80.1	Confident	76.4	Confident	26 Å²	26	76.5 Å²	76.5	13%	0.133	36%	0.362	C	S	.	.	H	α-helix	trans	-69.3	-36.2	-179.1	-67.3	172.6	0	0	0	111.6	Y24 L27 H118 L119 K120 K126	Y24-I122 HydrophobicContact CE1-CG2 4.44Å; L27-I122 HydrophobicContact CB-CD1 3.71Å; L27-I122 HydrophobicContact CD1-CD1 3.96Å; L27-I122 HydrophobicContact CD2-CD1 3.81Å; L27-I122 HydrophobicContact CD2-CG2 4.35Å; L27-I122 HydrophobicContact CG-CD1 4.01Å; H118-I122 PolarHBondContact O-N 3.49Å; L119-I122 PolarHBondContact O-N 2.93Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 3.27Å; I122-K126 WeakPolarHBondContact O-CG 3.23Å
123	L	80.4	Confident	74	Confident	8 Å²	8	81.7 Å²	81.7	4%	0.042	39%	0.394	C	S	.	.	H	α-helix	trans	-71.7	-37.7	177.4	-70.6	172.1	0	0	0	111.9	A77 L78 Y81 L119 K120 K126 L127	A77-L123 HydrophobicContact CB-CD2 4Å; L78-L123 HydrophobicContact CD1-CD2 4.19Å; L78-L123 HydrophobicContact CD2-CD1 3.69Å; L78-L123 HydrophobicContact CD2-CD2 4.17Å; L78-L123 HydrophobicContact CD2-CG 4.47Å; L78-L123 HydrophobicContact CG-CD1 3.95Å; L78-L123 HydrophobicContact CG-CD2 3.68Å; L78-L123 HydrophobicContact CG-CG 4.44Å; Y81-L123 HydrophobicContact CD1-CD1 4.39Å; Y81-L123 HydrophobicContact CD2-CD1 4.45Å; Y81-L123 HydrophobicContact CG-CD1 4.04Å; L119-L123 WeakPolarHBondContact O-CB 3.41Å; L119-L123 WeakPolarHBondContact O-CG 3.21Å; L119-L123 PolarHBondContact O-N 2.99Å; K120-L123 PolarHBondContact O-N 3.27Å; K120-L123 VanDerWaalsContact O-N 3.16Å; L123-K126 WeakPolarHBondContact O-CB 3.45Å; L123-K126 PolarHBondContact O-N 3.38Å; L123-L127 HydrophobicContact CB-CD1 4.36Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 WeakPolarHBondContact O-CG 3.25Å; L123-L127 PolarHBondContact O-N 2.68Å
124	E	77.1	Confident	71.4	Confident	92 Å²	92	86.3 Å²	86.3	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-64.4	-43.9	176.7	-75	176.4	157.2	0	0	111.6	K120 T121 K126 L127 E128	K120-E124 VanDerWaalsContact CE-CD 3.47Å; K120-E124 WeakPolarHBondContact CE-OE1 3.45Å; K120-E124 HydrophobicContact CG-CG 4.21Å; K120-E124 IonicContact NZ-OE1 2.72Å; K120-E124 WeakPolarHBondContact O-CB 3.46Å; K120-E124 WeakPolarHBondContact O-CG 3.15Å; K120-E124 PolarHBondContact O-N 2.88Å; T121-E124 PolarHBondContact O-N 2.9Å; E124-K126 PolarHBondContact O-N 2.89Å; E124-L127 PolarHBondContact O-N 2.92Å; E124-E128 WeakPolarHBondContact O-CG 3.44Å; E124-E128 PolarHBondContact O-N 2.98Å; E124-E128 VanDerWaalsContact O-N 3.14Å
125	E	70.6	Confident	69	Low	103 Å²	103	84.8 Å²	84.8	48%	0.481	42%	0.423	S	S	.	.	H	α-helix	trans	-57	-21.8	173.8	-73.6	178.7	-172.7	0	0	113.9	T121	T121-E125 WeakPolarHBondContact O-CG 3.46Å; T121-E125 PolarHBondContact O-N 2.86Å
126	K	65.8	Low	66.9	Low	44 Å²	44	87 Å²	87	19%	0.191	43%	0.433	C	S	.	.	H	α-helix	trans	-97.6	-44.9	-179.3	-77.5	-76.6	-174.8	157	0	112.9	L20 E74 I122 L123 E124 E128 K129	L20-K126 HydrophobicContact CD2-CD 4.48Å; E74-K126 IonicContact OE1-NZ 3.89Å; I122-K126 WeakPolarHBondContact O-CG 3.23Å; L123-K126 WeakPolarHBondContact O-CB 3.45Å; L123-K126 PolarHBondContact O-N 3.38Å; E124-K126 PolarHBondContact O-N 2.89Å; K126-E128 VanDerWaalsContact C-N 3.25Å; K126-E128 PolarHBondContact O-N 3.33Å; K126-K129 PolarHBondContact O-N 3.18Å
127	L	62.2	Low	64.9	Low	72 Å²	72	92.5 Å²	92.5	38%	0.377	46%	0.456	S	S	.	.	H	α-helix	trans	-69	-23.1	-178.3	-70	169.5	0	0	0	112.3	L123 E124 K129 E130 F132	L123-L127 HydrophobicContact CB-CD1 4.36Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 WeakPolarHBondContact O-CG 3.25Å; L123-L127 PolarHBondContact O-N 2.68Å; E124-L127 PolarHBondContact O-N 2.92Å; L127-K129 PolarHBondContact O-N 3.34Å; L127-E130 VanDerWaalsContact O-O 3.12Å; L127-F132 HydrophobicContact CD2-CB 3.48Å; L127-F132 VanDerWaalsContact CD2-CB 3.48Å; L127-F132 HydrophobicContact CD2-CD1 4.27Å; L127-F132 HydrophobicContact CD2-CD2 3.67Å; L127-F132 HydrophobicContact CD2-CE2 4.5Å; L127-F132 HydrophobicContact CD2-CG 3.53Å
128	E	55.1	Low	62.9	Low	174 Å²	174	96.1 Å²	96.1	81%	0.813	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.6	170.1	-74.9	-173.6	169.7	0	0	113.7	E124 K126	E124-E128 WeakPolarHBondContact O-CG 3.44Å; E124-E128 PolarHBondContact O-N 2.98Å; E124-E128 VanDerWaalsContact O-N 3.14Å; K126-E128 VanDerWaalsContact C-N 3.25Å; K126-E128 PolarHBondContact O-N 3.33Å
129	K	52.7	Low	61.5	Low	170 Å²	170	93.1 Å²	93.1	74%	0.739	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-13.9	-174.4	-66.7	-180	-177.5	167.3	0	114.7	K126 L127	K126-K129 PolarHBondContact O-N 3.18Å; L127-K129 PolarHBondContact O-N 3.34Å
130	E	49.8	Very low	60.6	Low	115 Å²	115	93.4 Å²	93.4	54%	0.537	46%	0.463	S	S	.	.	S	Bend	trans	-129.4	132.3	179.4	-77.7	177.5	-179	0	0	109.3	L127 F132	L127-E130 VanDerWaalsContact O-O 3.12Å; E130-F132 HydrophobicContact CB-CD2 3.81Å; E130-F132 HydrophobicContact CB-CE2 4.38Å; E130-F132 PolarHBondContact O-N 3.33Å; E130-F132 WeakPolarHBondContact OE2-CE2 3.37Å
131	D	46	Very low	60.5	Low	157 Å²	157	93.2 Å²	93.2	84%	0.84	47%	0.466	S	S	*	.			trans	-69.9	71.6	177	-143.5	0.3	0	0	0	108.7	T133	D131-T133 PolarHBondContact O-N 3.35Å; D131-T133 PolarHBondContact O-OG1 3.47Å
132	F	48	Very low	60.9	Low	83 Å²	83	93.5 Å²	93.5	36%	0.364	46%	0.463	S	S	.	.			trans	-77.8	63.5	-165.6	-128.4	-71	0	0	0	110.4	L127 E130 K136	L127-F132 HydrophobicContact CD2-CB 3.48Å; L127-F132 VanDerWaalsContact CD2-CB 3.48Å; L127-F132 HydrophobicContact CD2-CD1 4.27Å; L127-F132 HydrophobicContact CD2-CD2 3.67Å; L127-F132 HydrophobicContact CD2-CE2 4.5Å; L127-F132 HydrophobicContact CD2-CG 3.53Å; E130-F132 HydrophobicContact CB-CD2 3.81Å; E130-F132 HydrophobicContact CB-CE2 4.38Å; E130-F132 PolarHBondContact O-N 3.33Å; E130-F132 WeakPolarHBondContact OE2-CE2 3.37Å; F132-K136 HydrophobicContact CD1-CD 4.29Å; F132-K136 HydrophobicContact CE1-CD 3.5Å; F132-K136 HydrophobicContact CZ-CD 4.31Å
133	T	48.2	Very low	61.5	Low	110 Å²	110	92.3 Å²	92.3	68%	0.675	46%	0.456	S	S	*	.			trans	-106	129.4	-178.5	45.3	0	0	0	0	112.3	D131 G135	D131-T133 PolarHBondContact O-N 3.35Å; D131-T133 PolarHBondContact O-OG1 3.47Å; T133-G135 PolarHBondContact O-N 3.29Å
134	R	40.4	Very low	62	Low	221 Å²	221	97.5 Å²	97.5	83%	0.834	48%	0.479	S	S	*	.	S	Bend	trans	84.9	-28.9	148.6	-142.4	171.1	-159.7	171.7	4.3	119.5
135	G	43.6	Very low	62.9	Low	73 Å²	73	100 Å²	100	75%	0.753	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-26.4	-178.2	0	0	0	0	0	116.1	T133 F137	T133-G135 PolarHBondContact O-N 3.29Å; G135-F137 PolarHBondContact O-N 2.95Å
136	K	52.4	Low	64.2	Low	50 Å²	50	95.1 Å²	95.1	22%	0.217	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.6	-165.2	-157.3	157.8	172.8	165.4	0	115.5	E74 D75 L78 F132 M138	E74-K136 PolarHBondContact O-NZ 3.46Å; D75-K136 WeakPolarHBondContact OD1-CE 3.44Å; D75-K136 IonicContact OD1-NZ 2.67Å; D75-K136 PolarHBondContact OD1-NZ 3.35Å; L78-K136 HydrophobicContact CD1-CD 4.02Å; F132-K136 HydrophobicContact CD1-CD 4.29Å; F132-K136 HydrophobicContact CE1-CD 3.5Å; F132-K136 HydrophobicContact CZ-CD 4.31Å; K136-M138 VanDerWaalsContact C-N 3.32Å; K136-M138 PolarHBondContact O-N 2.94Å
137	F	51.5	Low	65.7	Low	134 Å²	134	93 Å²	93	59%	0.588	45%	0.452	S	S	*	.	H	α-helix	trans	-73.2	-14.8	-173.7	-83	-87	0	0	0	115.1	G135 S140 L141	G135-F137 PolarHBondContact O-N 2.95Å; F137-S140 WeakPolarHBondContact O-CB 3.36Å; F137-S140 PolarHBondContact O-N 3.35Å; F137-S140 PolarHBondContact O-OG 3.49Å; F137-L141 PolarHBondContact O-N 3.31Å
138	M	49.1	Very low	67.4	Low	147 Å²	147	91.2 Å²	91.2	72%	0.724	45%	0.451	S	S	*	.	H	α-helix	trans	-71.1	-43.1	-173.5	-71	-138.3	-63.7	0	0	113.4	K136 S140 L141 H142	K136-M138 VanDerWaalsContact C-N 3.32Å; K136-M138 PolarHBondContact O-N 2.94Å; M138-S140 VanDerWaalsContact C-N 3.26Å; M138-S140 PolarHBondContact O-N 3.32Å; M138-L141 PolarHBondContact O-N 3.18Å; M138-H142 PolarHBondContact O-N 3.45Å
139	S	59.5	Low	69.5	Low	25 Å²	25	86.7 Å²	86.7	18%	0.175	43%	0.426	C	S	.	.	H	α-helix	trans	-62.5	-37.9	172	66	0	0	0	0	110.9	L141 H142 L143	S139-L141 VanDerWaalsContact C-N 3.32Å; S139-L141 PolarHBondContact O-N 3.29Å; S139-H142 PolarHBondContact O-N 2.92Å; S139-L143 WeakPolarHBondContact O-CB 3.48Å; S139-L143 WeakPolarHBondContact O-CG 3.43Å; S139-L143 PolarHBondContact O-N 3.03Å
140	S	71.3	Confident	71.7	Confident	6 Å²	6	78.6 Å²	78.6	4%	0.042	39%	0.391	C	S	.	.	H	α-helix	trans	-61.2	-38.9	176.9	96.6	0	0	0	0	112.3	E82 F137 M138 K144	E82-S140 VanDerWaalsContact OE1-CB 3.27Å; E82-S140 WeakPolarHBondContact OE1-CB 3.42Å; E82-S140 VanDerWaalsContact OE2-CA 3.28Å; E82-S140 WeakPolarHBondContact OE2-CA 3.32Å; F137-S140 WeakPolarHBondContact O-CB 3.36Å; F137-S140 PolarHBondContact O-N 3.35Å; F137-S140 PolarHBondContact O-OG 3.49Å; M138-S140 VanDerWaalsContact C-N 3.26Å; M138-S140 PolarHBondContact O-N 3.32Å; S140-K144 WeakPolarHBondContact O-CB 3.37Å; S140-K144 WeakPolarHBondContact O-CD 3.42Å; S140-K144 WeakPolarHBondContact O-CG 3.47Å; S140-K144 PolarHBondContact O-N 3.38Å
141	L	84.8	Confident	74	Confident	82 Å²	82	75.1 Å²	75.1	43%	0.429	38%	0.376	S	S	.	.	H	α-helix	trans	-72.1	-44	-176.9	-175.4	62.3	0	0	0	111.5	F137 M138 S139 K144 R145	F137-L141 PolarHBondContact O-N 3.31Å; M138-L141 PolarHBondContact O-N 3.18Å; S139-L141 VanDerWaalsContact C-N 3.32Å; S139-L141 PolarHBondContact O-N 3.29Å; L141-K144 PolarHBondContact O-N 3.45Å; L141-R145 WeakPolarHBondContact O-CG 3.49Å; L141-R145 PolarHBondContact O-N 3.03Å
142	H	90.9	Very high	76.5	Confident	71 Å²	71	73.9 Å²	73.9	33%	0.329	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-40.7	178.2	-65	163.6	0	0	0	111.9	P62 E64 M138 S139 R145 Y146	P62-H142 HydrophobicContact CB-CB 3.9Å; P62-H142 HydrophobicContact CG-CB 3.71Å; E64-H142 IonicContact OE1-CE1 3.88Å; E64-H142 IonicContact OE1-CG 3.8Å; E64-H142 IonicContact OE1-ND1 3.7Å; E64-H142 PolarHBondContact OE1-ND1 3.3Å; E64-H142 IonicContact OE2-ND1 3.22Å; M138-H142 PolarHBondContact O-N 3.45Å; S139-H142 PolarHBondContact O-N 2.92Å; H142-R145 PolarHBondContact O-N 3.41Å; H142-Y146 VanDerWaalsContact O-CB 3.28Å; H142-Y146 WeakPolarHBondContact O-CB 3.28Å; H142-Y146 PolarHBondContact O-N 3.07Å
143	L	92.1	Very high	78.9	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-45.1	172.7	-76	176.6	0	0	0	111.8	P62 I65 T79 E82 M83 S139 R145 Y146 Y147	P62-L143 HydrophobicContact CG-CD2 4.2Å; I65-L143 HydrophobicContact CD1-CD2 4.37Å; I65-L143 HydrophobicContact CG1-CD2 4.03Å; T79-L143 HydrophobicContact CG2-CD1 4.1Å; E82-L143 HydrophobicContact CB-CD1 4.22Å; M83-L143 HydrophobicContact CG-CD1 4.19Å; M83-L143 HydrophobicContact CG-CD2 4.05Å; S139-L143 WeakPolarHBondContact O-CB 3.48Å; S139-L143 WeakPolarHBondContact O-CG 3.43Å; S139-L143 PolarHBondContact O-N 3.03Å; L143-R145 VanDerWaalsContact C-N 3.34Å; L143-R145 PolarHBondContact O-N 2.9Å; L143-Y146 WeakPolarHBondContact O-CB 3.33Å; L143-Y146 PolarHBondContact O-N 3.19Å; L143-Y146 VanDerWaalsContact O-N 3.14Å; L143-Y147 HydrophobicContact CB-CD2 4.49Å; L143-Y147 HydrophobicContact CB-CE2 4.47Å; L143-Y147 HydrophobicContact CD2-CE2 4.07Å; L143-Y147 WeakPolarHBondContact O-CD2 3.47Å; L143-Y147 PolarHBondContact O-N 2.8Å
144	K	91.9	Very high	81.3	Confident	117 Å²	117	65.2 Å²	65.2	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-44.2	175.3	-78.6	167.4	-175.8	167.5	0	112.2	S140 L141 G148	S140-K144 WeakPolarHBondContact O-CB 3.37Å; S140-K144 WeakPolarHBondContact O-CD 3.42Å; S140-K144 WeakPolarHBondContact O-CG 3.47Å; S140-K144 PolarHBondContact O-N 3.38Å; L141-K144 PolarHBondContact O-N 3.45Å; K144-G148 WeakPolarHBondContact O-CA 3.44Å; K144-G148 PolarHBondContact O-N 2.93Å
145	R	95.2	Very high	84	Confident	146 Å²	146	60.7 Å²	60.7	55%	0.551	30%	0.304	S	S	*	.	H	α-helix	trans	-64.9	-40.1	175.3	-73.8	177.9	-173.8	169.9	2	112.1	L141 H142 L143 R149	L141-R145 WeakPolarHBondContact O-CG 3.49Å; L141-R145 PolarHBondContact O-N 3.03Å; H142-R145 PolarHBondContact O-N 3.41Å; L143-R145 VanDerWaalsContact C-N 3.34Å; L143-R145 PolarHBondContact O-N 2.9Å; R145-R149 WeakPolarHBondContact O-CG 2.76Å; R145-R149 PolarHBondContact O-N 3.12Å; R145-R149 PolarHBondContact O-NE 2.84Å
146	Y	97.6	Very high	86.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-53.8	177.5	165.4	-105.9	0	0	0	112.2	F59 I61 H142 L143 G148 R149 I150 E170 N174	F59-Y146 HydrophobicContact CB-CD2 4.16Å; F59-Y146 HydrophobicContact CB-CE2 3.67Å; F59-Y146 VanDerWaalsContact O-CD2 3.31Å; F59-Y146 WeakPolarHBondContact O-CD2 3.39Å; I61-Y146 VanDerWaalsContact CA-CD2 3.4Å; I61-Y146 HydrophobicContact CB-CD2 4.05Å; I61-Y146 HydrophobicContact CB-CE2 3.67Å; I61-Y146 HydrophobicContact CG1-CD2 4.42Å; I61-Y146 HydrophobicContact CG1-CE1 4.27Å; I61-Y146 HydrophobicContact CG1-CE2 4.15Å; H142-Y146 VanDerWaalsContact O-CB 3.28Å; H142-Y146 WeakPolarHBondContact O-CB 3.28Å; H142-Y146 PolarHBondContact O-N 3.07Å; L143-Y146 WeakPolarHBondContact O-CB 3.33Å; L143-Y146 PolarHBondContact O-N 3.19Å; L143-Y146 VanDerWaalsContact O-N 3.14Å; Y146-G148 VanDerWaalsContact C-N 3.33Å; Y146-G148 PolarHBondContact O-N 3.09Å; Y146-R149 WeakPolarHBondContact O-CB 3.31Å; Y146-R149 PolarHBondContact O-N 3.22Å; Y146-I150 HydrophobicContact CE1-CD1 3.9Å; Y146-I150 HydrophobicContact CE2-CD1 4.08Å; Y146-I150 PolarHBondContact O-N 3.08Å; Y146-I150 WeakPolarHBondContact OH-CD1 3.46Å; Y146-E170 WeakPolarHBondContact OH-CG 3.4Å; Y146-E170 PolarHBondContact OH-OE1 3.39Å; Y146-N174 WeakPolarHBondContact CE1-OD1 3.48Å; Y146-N174 PolarHBondContact OH-ND2 3.28Å; Y146-N174 PolarHBondContact OH-OD1 2.93Å
147	Y	97.8	Very high	88.8	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-70.5	-30.1	177.2	-67.5	-68.7	0	0	0	113	M83 N86 I87 I90 L143 R149 I150 L151 N174	M83-Y147 WeakPolarHBondContact CA-OH 3.35Å; M83-Y147 WeakPolarHBondContact CB-OH 3.46Å; M83-Y147 WeakPolarHBondContact CE-OH 3.34Å; M83-Y147 HydrophobicContact CG-CE2 4.33Å; M83-Y147 WeakPolarHBondContact CG-OH 3.46Å; N86-Y147 HydrophobicContact CB-CD1 3.67Å; N86-Y147 HydrophobicContact CB-CD2 3.21Å; N86-Y147 HydrophobicContact CB-CE1 3.93Å; N86-Y147 HydrophobicContact CB-CE2 3.5Å; N86-Y147 HydrophobicContact CB-CG 3.3Å; N86-Y147 WeakPolarHBondContact OD1-CB 3.44Å; I87-Y147 HydrophobicContact CG1-CE1 4.3Å; I90-Y147 HydrophobicContact CD1-CD1 3.64Å; I90-Y147 HydrophobicContact CD1-CE1 4.28Å; L143-Y147 HydrophobicContact CB-CD2 4.49Å; L143-Y147 HydrophobicContact CB-CE2 4.47Å; L143-Y147 HydrophobicContact CD2-CE2 4.07Å; L143-Y147 WeakPolarHBondContact O-CD2 3.47Å; L143-Y147 PolarHBondContact O-N 2.8Å; Y147-R149 VanDerWaalsContact C-N 3.31Å; Y147-R149 PolarHBondContact O-N 3.43Å; Y147-I150 HydrophobicContact CD1-CD1 3.93Å; Y147-I150 HydrophobicContact CE1-CD1 4.42Å; Y147-I150 WeakPolarHBondContact O-CB 3.27Å; Y147-I150 PolarHBondContact O-N 2.65Å; Y147-L151 PolarHBondContact O-N 2.97Å; Y147-N174 PolarHBondContact OH-OD1 3.41Å
148	G	97.9	Very high	91	Very high	34 Å²	34	63.5 Å²	63.5	35%	0.351	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-40.3	170.3	0	0	0	0	0	112.6	K144 Y146 L151 H152	K144-G148 WeakPolarHBondContact O-CA 3.44Å; K144-G148 PolarHBondContact O-N 2.93Å; Y146-G148 VanDerWaalsContact C-N 3.33Å; Y146-G148 PolarHBondContact O-N 3.09Å; G148-L151 PolarHBondContact O-N 3.47Å; G148-H152 VanDerWaalsContact O-CB 3.27Å; G148-H152 WeakPolarHBondContact O-CB 3.33Å; G148-H152 PolarHBondContact O-N 2.89Å
149	R	98.5	Very high	93.3	Very high	78 Å²	78	58.8 Å²	58.8	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-64.4	-38.9	173.9	-75.8	175.3	-75.3	162.3	1.9	112.3	F59 D60 R145 Y146 Y147 H152 Y153	F59-R149 PolarHBondContact O-NH1 3.01Å; F59-R149 PolarHBondContact O-NH2 3.2Å; F59-R149 VanDerWaalsContact O-NH2 3.14Å; D60-R149 PolarHBondContact O-NH2 3.39Å; D60-R149 IonicContact OD2-NH1 3.69Å; D60-R149 PolarHBondContact OD2-NH1 3.3Å; R145-R149 WeakPolarHBondContact O-CG 2.76Å; R145-R149 PolarHBondContact O-N 3.12Å; R145-R149 PolarHBondContact O-NE 2.84Å; Y146-R149 WeakPolarHBondContact O-CB 3.31Å; Y146-R149 PolarHBondContact O-N 3.22Å; Y147-R149 VanDerWaalsContact C-N 3.31Å; Y147-R149 PolarHBondContact O-N 3.43Å; R149-H152 PolarHBondContact O-N 2.88Å; R149-Y153 VanDerWaalsContact O-CB 3.31Å; R149-Y153 WeakPolarHBondContact O-CB 3.46Å; R149-Y153 PolarHBondContact O-N 3.45Å
150	I	98.7	Very high	95.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-49.3	175.6	-66.4	169.1	0	0	0	111	F59 I90 Y146 Y147 H152 Y153 L154 V167 E170	F59-I150 HydrophobicContact CB-CG1 4.16Å; F59-I150 HydrophobicContact CD1-CB 4.4Å; F59-I150 HydrophobicContact CD1-CG1 3.59Å; F59-I150 HydrophobicContact CD2-CG1 4.22Å; F59-I150 HydrophobicContact CE1-CB 4.43Å; F59-I150 HydrophobicContact CE1-CG1 3.98Å; F59-I150 HydrophobicContact CG-CD1 4.5Å; F59-I150 HydrophobicContact CG-CG1 3.72Å; F59-I150 HydrophobicContact CZ-CG1 4.43Å; I90-I150 HydrophobicContact CD1-CB 4.22Å; I90-I150 HydrophobicContact CD1-CD1 4.32Å; I90-I150 HydrophobicContact CD1-CG2 3.71Å; I90-I150 HydrophobicContact CG1-CG2 4.3Å; Y146-I150 HydrophobicContact CE1-CD1 3.9Å; Y146-I150 HydrophobicContact CE2-CD1 4.08Å; Y146-I150 PolarHBondContact O-N 3.08Å; Y146-I150 WeakPolarHBondContact OH-CD1 3.46Å; Y147-I150 HydrophobicContact CD1-CD1 3.93Å; Y147-I150 HydrophobicContact CE1-CD1 4.42Å; Y147-I150 WeakPolarHBondContact O-CB 3.27Å; Y147-I150 PolarHBondContact O-N 2.65Å; I150-H152 VanDerWaalsContact C-N 3.34Å; I150-H152 PolarHBondContact O-N 3.18Å; I150-Y153 WeakPolarHBondContact O-CB 3.45Å; I150-Y153 PolarHBondContact O-N 3.48Å; I150-L154 PolarHBondContact O-N 2.97Å; I150-V167 HydrophobicContact CG2-CB 4.44Å; I150-V167 HydrophobicContact CG2-CG1 3.81Å; I150-V167 HydrophobicContact CG2-CG2 3.77Å; I150-E170 HydrophobicContact CD1-CG 4.22Å
151	L	98.4	Very high	96.3	Very high	42 Å²	42	62.5 Å²	62.5	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-40.4	178.2	-71.7	169.8	0	0	0	111.9	I90 Q93 Y147 G148 L154 K155	I90-L151 HydrophobicContact CG1-CD2 3.9Å; I90-L151 HydrophobicContact CG1-CG 4.2Å; Q93-L151 HydrophobicContact CG-CD2 3.76Å; Y147-L151 PolarHBondContact O-N 2.97Å; G148-L151 PolarHBondContact O-N 3.47Å; L151-L154 PolarHBondContact O-N 2.98Å; L151-K155 WeakPolarHBondContact O-CG 3.45Å; L151-K155 PolarHBondContact O-N 3.26Å; L151-K155 VanDerWaalsContact O-N 3.08Å
152	H	98.4	Very high	96.9	Very high	131 Å²	131	59.7 Å²	59.7	61%	0.606	29%	0.29	S	S	*	.	H	α-helix	trans	-63.1	-42.7	175.5	-178.8	72.1	0	0	0	111.7	G148 R149 I150 K155 A156	G148-H152 VanDerWaalsContact O-CB 3.27Å; G148-H152 WeakPolarHBondContact O-CB 3.33Å; G148-H152 PolarHBondContact O-N 2.89Å; R149-H152 PolarHBondContact O-N 2.88Å; I150-H152 VanDerWaalsContact C-N 3.34Å; I150-H152 PolarHBondContact O-N 3.18Å; H152-K155 PolarHBondContact O-N 3.39Å; H152-A156 WeakPolarHBondContact O-CB 3.03Å; H152-A156 PolarHBondContact O-N 2.96Å
153	Y	98.6	Very high	97.3	Very high	11 Å²	11	56.3 Å²	56.3	4%	0.043	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-46.2	175	167.4	-94.8	0	0	0	112.4	D55 M57 F59 R149 I150 K155 A156 K157 A163 I166 V167	D55-Y153 WeakPolarHBondContact O-CE2 3.41Å; D55-Y153 PolarHBondContact O-OH 2.05Å; M57-Y153 HydrophobicContact CB-CD2 4.03Å; M57-Y153 HydrophobicContact CB-CE2 3.87Å; M57-Y153 HydrophobicContact CG-CD2 4.35Å; M57-Y153 HydrophobicContact SD-CD2 3.33Å; M57-Y153 WeakPolarHBondContact SD-CD2 3.36Å; M57-Y153 HydrophobicContact SD-CE2 4.12Å; M57-Y153 HydrophobicContact SD-CG 3.87Å; F59-Y153 AromaticContact CE1-CD1 3.94Å; F59-Y153 HydrophobicContact CE1-CD1 3.94Å; F59-Y153 HydrophobicContact CE1-CD2 4.33Å; F59-Y153 AromaticContact CE1-CG 3.72Å; F59-Y153 HydrophobicContact CE1-CG 3.72Å; F59-Y153 AromaticContact CZ-CD1 3.66Å; F59-Y153 HydrophobicContact CZ-CD1 3.66Å; F59-Y153 HydrophobicContact CZ-CD2 4.41Å; F59-Y153 HydrophobicContact CZ-CE1 4.03Å; F59-Y153 AromaticContact CZ-CG 3.86Å; F59-Y153 HydrophobicContact CZ-CG 3.86Å; R149-Y153 VanDerWaalsContact O-CB 3.31Å; R149-Y153 WeakPolarHBondContact O-CB 3.46Å; R149-Y153 PolarHBondContact O-N 3.45Å; I150-Y153 WeakPolarHBondContact O-CB 3.45Å; I150-Y153 PolarHBondContact O-N 3.48Å; Y153-K155 VanDerWaalsContact C-N 3.3Å; Y153-K155 PolarHBondContact O-N 3.2Å; Y153-A156 PolarHBondContact O-N 3.47Å; Y153-K157 HydrophobicContact CD2-CG 4.06Å; Y153-K157 HydrophobicContact CE1-CG 4.48Å; Y153-K157 HydrophobicContact CE2-CG 3.77Å; Y153-K157 WeakPolarHBondContact O-CB 3.26Å; Y153-K157 WeakPolarHBondContact O-CG 3.44Å; Y153-K157 PolarHBondContact O-N 3.43Å; Y153-A163 HydrophobicContact CE1-CB 3.78Å; Y153-I166 HydrophobicContact CE1-CB 4.23Å; Y153-I166 HydrophobicContact CE1-CG2 4.18Å; Y153-I166 WeakPolarHBondContact OH-CB 3.47Å; Y153-I166 WeakPolarHBondContact OH-CG1 3.47Å; Y153-V167 HydrophobicContact CD1-CG2 3.94Å; Y153-V167 HydrophobicContact CE1-CG2 4.06Å
154	L	98.6	Very high	97.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56	-47.4	175.5	-76.8	171	0	0	0	111	I90 I150 L151 K157 E158 Y159 A163 W164 V167	I90-L154 HydrophobicContact CG2-CD1 4.27Å; I150-L154 PolarHBondContact O-N 2.97Å; L151-L154 PolarHBondContact O-N 2.98Å; L154-K157 CarbonylContact O-C 3.56Å; L154-K157 PolarHBondContact O-N 2.81Å; L154-E158 PolarHBondContact O-N 3.48Å; L154-E158 VanDerWaalsContact O-N 3.17Å; L154-Y159 HydrophobicContact CB-CD1 3.85Å; L154-Y159 HydrophobicContact CB-CE1 3.82Å; L154-Y159 PolarHBondContact O-N 3.26Å; L154-A163 HydrophobicContact CD2-CB 4.11Å; L154-W164 HydrophobicContact CD1-CH2 3.77Å; L154-W164 HydrophobicContact CD1-CZ2 4.07Å; L154-W164 HydrophobicContact CD1-CZ3 4Å; L154-W164 HydrophobicContact CD2-CD2 3.79Å; L154-W164 HydrophobicContact CD2-CE3 4.03Å; L154-W164 HydrophobicContact CD2-CG 4.24Å; L154-W164 HydrophobicContact CD2-CH2 4.42Å; L154-W164 HydrophobicContact CD2-CZ2 4.2Å; L154-W164 HydrophobicContact CD2-CZ3 4.33Å; L154-V167 HydrophobicContact CD1-CG1 4.46Å; L154-V167 HydrophobicContact CD1-CG2 4.24Å; L154-V167 HydrophobicContact CD2-CB 4.29Å; L154-V167 HydrophobicContact CD2-CG2 3.66Å; L154-V167 HydrophobicContact CG-CG2 3.79Å
155	K	98.3	Very high	97.8	Very high	126 Å²	126	50.8 Å²	50.8	55%	0.548	25%	0.25	S	S	.	.	H	α-helix	trans	-61.8	-47.1	176.8	-73	176.8	-179.9	-174.9	0	112.6	L151 H152 Y153 K157 E158 Y159	L151-K155 WeakPolarHBondContact O-CG 3.45Å; L151-K155 PolarHBondContact O-N 3.26Å; L151-K155 VanDerWaalsContact O-N 3.08Å; H152-K155 PolarHBondContact O-N 3.39Å; Y153-K155 VanDerWaalsContact C-N 3.3Å; Y153-K155 PolarHBondContact O-N 3.2Å; K155-K157 PolarHBondContact O-N 2.9Å; K155-E158 PolarHBondContact O-N 3.28Å; K155-Y159 HydrophobicContact CG-CE2 4.2Å; K155-Y159 VanDerWaalsContact CG-OH 3.25Å; K155-Y159 WeakPolarHBondContact CG-OH 3.48Å
156	A	98.1	Very high	98	Very high	68 Å²	68	44.3 Å²	44.3	56%	0.562	23%	0.227	S	C	*	.	H	α-helix	trans	-65	-24.4	-179.3	0	0	0	0	0	113	H152 Y153	H152-A156 WeakPolarHBondContact O-CB 3.03Å; H152-A156 PolarHBondContact O-N 2.96Å; Y153-A156 PolarHBondContact O-N 3.47Å
157	K	97.8	Very high	98	Very high	78 Å²	78	44.3 Å²	44.3	34%	0.339	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	15.8	175.2	-64	-69.1	-175.1	169.7	0	113	D55 Y153 L154 K155 Y159 S160 A163	D55-K157 WeakPolarHBondContact OD1-CE 3.39Å; D55-K157 IonicContact OD1-NZ 2.62Å; D55-K157 PolarHBondContact OD1-NZ 3.2Å; Y153-K157 HydrophobicContact CD2-CG 4.06Å; Y153-K157 HydrophobicContact CE1-CG 4.48Å; Y153-K157 HydrophobicContact CE2-CG 3.77Å; Y153-K157 WeakPolarHBondContact O-CB 3.26Å; Y153-K157 WeakPolarHBondContact O-CG 3.44Å; Y153-K157 PolarHBondContact O-N 3.43Å; L154-K157 CarbonylContact O-C 3.56Å; L154-K157 PolarHBondContact O-N 2.81Å; K155-K157 PolarHBondContact O-N 2.9Å; K157-Y159 PolarHBondContact O-N 3.39Å; K157-Y159 VanDerWaalsContact O-N 3.13Å; K157-S160 VanDerWaalsContact O-CB 3.26Å; K157-S160 WeakPolarHBondContact O-CB 3.05Å; K157-S160 PolarHBondContact O-N 2.95Å; K157-S160 PolarHBondContact O-OG 3.34Å; K157-A163 HydrophobicContact CB-CB 3.51Å; K157-A163 HydrophobicContact CG-CB 4.21Å
158	E	97.8	Very high	98	Very high	171 Å²	171	45.2 Å²	45.2	80%	0.799	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	38	176.7	-58.1	-179.6	158.8	0	0	112.8	L154 K155 S160	L154-E158 PolarHBondContact O-N 3.48Å; L154-E158 VanDerWaalsContact O-N 3.17Å; K155-E158 PolarHBondContact O-N 3.28Å; E158-S160 PolarHBondContact O-N 2.99Å
159	Y	98.1	Very high	98	Very high	47 Å²	47	46.3 Å²	46.3	18%	0.184	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	29.3	-176.7	-57.3	-85.5	0	0	0	113.2	Q93 S97 L154 K155 K157 W164	Q93-Y159 HydrophobicContact CB-CD1 4.3Å; Q93-Y159 HydrophobicContact CB-CE1 3.75Å; Q93-Y159 HydrophobicContact CG-CE1 4.21Å; S97-Y159 WeakPolarHBondContact CB-O 3.43Å; S97-Y159 PolarHBondContact OG-O 3.44Å; L154-Y159 HydrophobicContact CB-CD1 3.85Å; L154-Y159 HydrophobicContact CB-CE1 3.82Å; L154-Y159 PolarHBondContact O-N 3.26Å; K155-Y159 HydrophobicContact CG-CE2 4.2Å; K155-Y159 VanDerWaalsContact CG-OH 3.25Å; K155-Y159 WeakPolarHBondContact CG-OH 3.48Å; K157-Y159 PolarHBondContact O-N 3.39Å; K157-Y159 VanDerWaalsContact O-N 3.13Å; Y159-W164 HydrophobicContact CD1-CZ2 4.09Å; Y159-W164 PolarHBondContact O-NE1 3.16Å
160	S	97.3	Very high	98	Very high	40 Å²	40	43.3 Å²	43.3	28%	0.28	22%	0.219	S	C	.	.			trans	-59.6	159	-177.2	59.1	0	0	0	0	113.5	K157 E158 C162 A163 W164	K157-S160 VanDerWaalsContact O-CB 3.26Å; K157-S160 WeakPolarHBondContact O-CB 3.05Å; K157-S160 PolarHBondContact O-N 2.95Å; K157-S160 PolarHBondContact O-OG 3.34Å; E158-S160 PolarHBondContact O-N 2.99Å; S160-C162 PolarHBondContact O-N 3.07Å; S160-C162 VanDerWaalsContact O-N 3.15Å; S160-A163 WeakPolarHBondContact O-CB 3.5Å; S160-A163 PolarHBondContact O-N 3.26Å; S160-A163 PolarHBondContact OG-N 2.76Å; S160-W164 PolarHBondContact O-N 3.28Å
161	H	96.8	Very high	98	Very high	70 Å²	70	43.3 Å²	43.3	32%	0.324	22%	0.219	S	C	.	.	H	α-helix	trans	-50.5	-40.8	176	-179.4	82.5	0	0	0	112.8	T98 T165	T98-H161 PolarHBondContact O-CE1 3.42Å; T98-H161 PolarHBondContact O-ND1 3.41Å; T98-H161 VanDerWaalsContact O-ND1 3.09Å; H161-T165 PolarHBondContact O-N 3.5Å; H161-T165 PolarHBondContact O-OG1 3.49Å
162	C	97.3	Very high	97.9	Very high	22 Å²	22	42 Å²	42	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-71.8	-37.7	178.1	-80.3	0	0	0	0	113.3	C52 D55 S160 W164 T165 I166	C52-C162 WeakPolarHBondContact CA-SG 3.2Å; C52-C162 HydrophobicContact CB-CB 3.51Å; C52-C162 WeakPolarHBondContact CB-SG 3.1Å; C52-C162 WeakPolarHBondContact SG-CA 3.42Å; C52-C162 WeakPolarHBondContact SG-CB 3.49Å; C52-C162 CovalentContact SG-SG 2.05Å; C52-C162 PolarHBondContact SG-SG 3.32Å; D55-C162 HydrophobicContact CB-CB 4.36Å; D55-C162 VanDerWaalsContact OD2-CB 3.3Å; D55-C162 WeakPolarHBondContact OD2-CB 3.45Å; S160-C162 PolarHBondContact O-N 3.07Å; S160-C162 VanDerWaalsContact O-N 3.15Å; C162-W164 VanDerWaalsContact C-N 3.31Å; C162-W164 PolarHBondContact O-N 3.07Å; C162-T165 WeakPolarHBondContact O-CB 3.41Å; C162-T165 PolarHBondContact O-N 2.88Å; C162-I166 WeakPolarHBondContact O-CG1 3.43Å; C162-I166 PolarHBondContact O-N 3.46Å
163	A	97.9	Very high	97.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-46.2	173.6	0	0	0	0	0	111.2	Y153 L154 K157 S160 T165 I166 V167	Y153-A163 HydrophobicContact CE1-CB 3.78Å; L154-A163 HydrophobicContact CD2-CB 4.11Å; K157-A163 HydrophobicContact CB-CB 3.51Å; K157-A163 HydrophobicContact CG-CB 4.21Å; S160-A163 WeakPolarHBondContact O-CB 3.5Å; S160-A163 PolarHBondContact O-N 3.26Å; S160-A163 PolarHBondContact OG-N 2.76Å; A163-T165 PolarHBondContact O-N 3.24Å; A163-I166 PolarHBondContact O-N 2.83Å; A163-V167 WeakPolarHBondContact O-CG2 3.47Å; A163-V167 PolarHBondContact O-N 2.99Å
164	W	98.1	Very high	97.9	Very high	1 Å²	1	40 Å²	40	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-36.9	175.7	-82.1	118.3	0	0	0	113.6	I90 Q93 D94 L95 T98 W100 L154 Y159 S160 C162 I166 V167 R168	I90-W164 HydrophobicContact CG2-CH2 4.24Å; I90-W164 HydrophobicContact CG2-CZ3 3.92Å; I90-W164 WeakPolarHBondContact O-CH2 3.35Å; Q93-W164 HydrophobicContact CB-CH2 4.01Å; Q93-W164 HydrophobicContact CB-CZ2 3.9Å; D94-W164 VanDerWaalsContact O-CE2 3.28Å; D94-W164 WeakPolarHBondContact O-CZ2 3.44Å; D94-W164 PolarHBondContact O-NE1 3.47Å; L95-W164 HydrophobicContact CD2-CD2 3.67Å; L95-W164 HydrophobicContact CD2-CE3 3.71Å; L95-W164 HydrophobicContact CD2-CG 4.43Å; L95-W164 HydrophobicContact CD2-CH2 3.54Å; L95-W164 HydrophobicContact CD2-CZ2 3.49Å; L95-W164 VanDerWaalsContact CD2-CZ2 3.49Å; L95-W164 HydrophobicContact CD2-CZ3 3.66Å; L95-W164 HydrophobicContact CG-CH2 4.23Å; L95-W164 HydrophobicContact CG-CZ2 3.99Å; T98-W164 HydrophobicContact CG2-CB 3.48Å; T98-W164 VanDerWaalsContact CG2-CB 3.48Å; T98-W164 HydrophobicContact CG2-CD2 4.19Å; T98-W164 HydrophobicContact CG2-CG 3.36Å; W100-W164 HydrophobicContact CH2-CB 3.98Å; W100-W164 HydrophobicContact CH2-CE3 4.1Å; W100-W164 HydrophobicContact CZ2-CB 4.12Å; W100-W164 HydrophobicContact CZ3-CE3 4.16Å; L154-W164 HydrophobicContact CD1-CH2 3.77Å; L154-W164 HydrophobicContact CD1-CZ2 4.07Å; L154-W164 HydrophobicContact CD1-CZ3 4Å; L154-W164 HydrophobicContact CD2-CD2 3.79Å; L154-W164 HydrophobicContact CD2-CE3 4.03Å; L154-W164 HydrophobicContact CD2-CG 4.24Å; L154-W164 HydrophobicContact CD2-CH2 4.42Å; L154-W164 HydrophobicContact CD2-CZ2 4.2Å; L154-W164 HydrophobicContact CD2-CZ3 4.33Å; Y159-W164 HydrophobicContact CD1-CZ2 4.09Å; Y159-W164 PolarHBondContact O-NE1 3.16Å; S160-W164 PolarHBondContact O-N 3.28Å; C162-W164 VanDerWaalsContact C-N 3.31Å; C162-W164 PolarHBondContact O-N 3.07Å; W164-I166 VanDerWaalsContact C-N 3.34Å; W164-I166 PolarHBondContact O-N 3.3Å; W164-V167 HydrophobicContact CE3-CB 4.41Å; W164-V167 HydrophobicContact CE3-CG1 4.34Å; W164-V167 HydrophobicContact CZ3-CG1 4.26Å; W164-V167 PolarHBondContact O-N 2.83Å; W164-R168 VanDerWaalsContact O-CB 3.26Å; W164-R168 WeakPolarHBondContact O-CB 3.28Å; W164-R168 PolarHBondContact O-N 3.14Å
165	T	97.8	Very high	97.8	Very high	1 Å²	1	40 Å²	40	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-44.1	173.9	-62	0	0	0	0	111.2	L49 C52 H161 C162 A163 V169	L49-T165 HydrophobicContact CD1-CG2 4.49Å; C52-T165 HydrophobicContact CB-CG2 4.35Å; H161-T165 PolarHBondContact O-N 3.5Å; H161-T165 PolarHBondContact O-OG1 3.49Å; C162-T165 WeakPolarHBondContact O-CB 3.41Å; C162-T165 PolarHBondContact O-N 2.88Å; A163-T165 PolarHBondContact O-N 3.24Å; T165-V169 WeakPolarHBondContact O-CG2 3.26Å; T165-V169 PolarHBondContact O-N 3.3Å
166	I	98.1	Very high	97.7	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.051	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-46.1	176.6	-65.2	-57	0	0	0	111.4	L49 D55 R56 F59 Y153 C162 A163 W164 R168 V169 E170	L49-I166 HydrophobicContact CD1-CD1 3.59Å; D55-I166 HydrophobicContact CB-CG1 4.46Å; R56-I166 HydrophobicContact CB-CD1 4.31Å; F59-I166 HydrophobicContact CE2-CG2 3.85Å; F59-I166 HydrophobicContact CZ-CG2 4.08Å; Y153-I166 HydrophobicContact CE1-CB 4.23Å; Y153-I166 HydrophobicContact CE1-CG2 4.18Å; Y153-I166 WeakPolarHBondContact OH-CB 3.47Å; Y153-I166 WeakPolarHBondContact OH-CG1 3.47Å; C162-I166 WeakPolarHBondContact O-CG1 3.43Å; C162-I166 PolarHBondContact O-N 3.46Å; A163-I166 PolarHBondContact O-N 2.83Å; W164-I166 VanDerWaalsContact C-N 3.34Å; W164-I166 PolarHBondContact O-N 3.3Å; I166-R168 PolarHBondContact O-N 2.96Å; I166-V169 PolarHBondContact O-N 3.48Å; I166-E170 PolarHBondContact O-N 3.33Å
167	V	98.4	Very high	97.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-41.8	178	170.4	0	0	0	0	111.3	F59 I90 I150 Y153 L154 A163 W164 V169 E170 I171	F59-V167 HydrophobicContact CZ-CG2 4.34Å; I90-V167 HydrophobicContact CG2-CG1 3.83Å; I150-V167 HydrophobicContact CG2-CB 4.44Å; I150-V167 HydrophobicContact CG2-CG1 3.81Å; I150-V167 HydrophobicContact CG2-CG2 3.77Å; Y153-V167 HydrophobicContact CD1-CG2 3.94Å; Y153-V167 HydrophobicContact CE1-CG2 4.06Å; L154-V167 HydrophobicContact CD1-CG1 4.46Å; L154-V167 HydrophobicContact CD1-CG2 4.24Å; L154-V167 HydrophobicContact CD2-CB 4.29Å; L154-V167 HydrophobicContact CD2-CG2 3.66Å; L154-V167 HydrophobicContact CG-CG2 3.79Å; A163-V167 WeakPolarHBondContact O-CG2 3.47Å; A163-V167 PolarHBondContact O-N 2.99Å; W164-V167 HydrophobicContact CE3-CB 4.41Å; W164-V167 HydrophobicContact CE3-CG1 4.34Å; W164-V167 HydrophobicContact CZ3-CG1 4.26Å; W164-V167 PolarHBondContact O-N 2.83Å; V167-V169 VanDerWaalsContact C-N 3.3Å; V167-V169 PolarHBondContact O-N 3.39Å; V167-E170 CarbonylContact O-C 3.48Å; V167-E170 PolarHBondContact O-N 2.95Å; V167-E170 VanDerWaalsContact O-N 3.09Å; V167-I171 HydrophobicContact CG1-CG1 4.02Å; V167-I171 VanDerWaalsContact O-CG1 3.23Å; V167-I171 WeakPolarHBondContact O-CG1 3.38Å; V167-I171 PolarHBondContact O-N 2.99Å
168	R	98	Very high	97.5	Very high	20 Å²	20	30.9 Å²	30.9	8%	0.075	15%	0.153	C	C	.	.	H	α-helix	trans	-55.7	-44.6	175.7	-174.4	-172.9	70.7	138.9	-15.8	112.1	L42 L45 G47 W100 W164 I166 E170 I171 L172	L42-R168 HydrophobicContact CD2-CG 4.11Å; L42-R168 WeakPolarHBondContact O-CD 3.45Å; L42-R168 PolarHBondContact O-NH1 2.72Å; L45-R168 PolarHBondContact O-NH1 2.85Å; G47-R168 PolarHBondContact O-NH2 3.26Å; W100-R168 HydrophobicContact CH2-CB 3.92Å; W100-R168 HydrophobicContact CH2-CG 4.29Å; W100-R168 HydrophobicContact CZ2-CB 4.1Å; W100-R168 HydrophobicContact CZ2-CG 4.38Å; W164-R168 VanDerWaalsContact O-CB 3.26Å; W164-R168 WeakPolarHBondContact O-CB 3.28Å; W164-R168 PolarHBondContact O-N 3.14Å; I166-R168 PolarHBondContact O-N 2.96Å; R168-E170 VanDerWaalsContact C-N 3.35Å; R168-I171 PolarHBondContact O-N 3.08Å; R168-L172 PolarHBondContact O-N 2.82Å
169	V	97.2	Very high	97.4	Very high	57 Å²	57	25 Å²	25	35%	0.345	13%	0.127	S	C	.	.	H	α-helix	trans	-63.5	-42.1	177	171.8	0	0	0	0	111	L49 T165 I166 V167 I171 L172 R173	L49-V169 HydrophobicContact CD1-CG2 4.39Å; T165-V169 WeakPolarHBondContact O-CG2 3.26Å; T165-V169 PolarHBondContact O-N 3.3Å; I166-V169 PolarHBondContact O-N 3.48Å; V167-V169 VanDerWaalsContact C-N 3.3Å; V167-V169 PolarHBondContact O-N 3.39Å; V169-I171 VanDerWaalsContact C-N 3.34Å; V169-I171 PolarHBondContact O-N 3.28Å; V169-L172 WeakPolarHBondContact O-CB 3.34Å; V169-L172 PolarHBondContact O-N 3.31Å; V169-R173 PolarHBondContact O-N 3.47Å; V169-R173 VanDerWaalsContact O-N 3.08Å
170	E	98.1	Very high	97.1	Very high	14 Å²	14	27.8 Å²	27.8	7%	0.065	14%	0.14	C	C	.	.	H	α-helix	trans	-65	-38.9	175.6	-170.9	65.9	-172.8	0	0	111.5	F59 Y146 I150 I166 V167 R168 R173 N174	F59-E170 HydrophobicContact CB-CG 4.48Å; F59-E170 HydrophobicContact CD2-CB 3.89Å; F59-E170 HydrophobicContact CD2-CG 3.56Å; F59-E170 HydrophobicContact CE2-CB 4.02Å; F59-E170 HydrophobicContact CE2-CG 4.2Å; F59-E170 HydrophobicContact CG-CG 4.35Å; Y146-E170 WeakPolarHBondContact OH-CG 3.4Å; Y146-E170 PolarHBondContact OH-OE1 3.39Å; I150-E170 HydrophobicContact CD1-CG 4.22Å; I166-E170 PolarHBondContact O-N 3.33Å; V167-E170 CarbonylContact O-C 3.48Å; V167-E170 PolarHBondContact O-N 2.95Å; V167-E170 VanDerWaalsContact O-N 3.09Å; R168-E170 VanDerWaalsContact C-N 3.35Å; E170-R173 CarbonylContact O-C 3.59Å; E170-R173 WeakPolarHBondContact O-CA 3.39Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 3.27Å; E170-R173 VanDerWaalsContact O-N 3.12Å; E170-R173 IonicContact OE1-NH1 3.51Å; E170-R173 IonicContact OE2-NH1 2.77Å; E170-N174 PolarHBondContact O-N 3.01Å; E170-N174 PolarHBondContact O-ND2 3.04Å
171	I	98.4	Very high	96.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.6	-38.9	177.1	-60.1	-73.1	0	0	0	111.3	L42 I87 I90 F91 V167 R168 V169 R173 N174 F175	L42-I171 HydrophobicContact CD1-CG2 3.89Å; L42-I171 HydrophobicContact CD2-CG2 4.35Å; I87-I171 HydrophobicContact CD1-CG2 4.47Å; I87-I171 HydrophobicContact CG1-CD1 3.89Å; I87-I171 HydrophobicContact CG1-CG2 4.36Å; I87-I171 HydrophobicContact CG2-CD1 4.47Å; I87-I171 HydrophobicContact CG2-CG2 3.97Å; I90-I171 HydrophobicContact CD1-CD1 3.95Å; F91-I171 HydrophobicContact CE2-CB 4.24Å; F91-I171 HydrophobicContact CE2-CD1 4.47Å; F91-I171 HydrophobicContact CE2-CG1 3.94Å; F91-I171 HydrophobicContact CE2-CG2 3.9Å; F91-I171 HydrophobicContact CZ-CG2 4.48Å; V167-I171 HydrophobicContact CG1-CG1 4.02Å; V167-I171 VanDerWaalsContact O-CG1 3.23Å; V167-I171 WeakPolarHBondContact O-CG1 3.38Å; V167-I171 PolarHBondContact O-N 2.99Å; R168-I171 PolarHBondContact O-N 3.08Å; V169-I171 VanDerWaalsContact C-N 3.34Å; V169-I171 PolarHBondContact O-N 3.28Å; I171-R173 PolarHBondContact O-N 3.17Å; I171-N174 WeakPolarHBondContact O-CA 3.3Å; I171-N174 VanDerWaalsContact O-CB 3.31Å; I171-N174 WeakPolarHBondContact O-CB 3.41Å; I171-N174 PolarHBondContact O-N 3.15Å; I171-F175 HydrophobicContact CG2-CD2 4.05Å; I171-F175 HydrophobicContact CG2-CE2 3.81Å; I171-F175 WeakPolarHBondContact O-CD2 3.21Å; I171-F175 PolarHBondContact O-N 2.85Å; I171-F175 VanDerWaalsContact O-N 3.09Å
172	L	97.9	Very high	96.8	Very high	15 Å²	15	22.6 Å²	22.6	8%	0.079	11%	0.111	C	C	.	.	H	α-helix	trans	-55.4	-42.4	170.1	-81.8	166.9	0	0	0	111.2	Q39 L42 W43 R168 V169 N174 F175 V176	Q39-L172 HydrophobicContact CB-CD2 4.33Å; Q39-L172 HydrophobicContact CG-CD2 4.37Å; L42-L172 HydrophobicContact CB-CD2 3.61Å; L42-L172 HydrophobicContact CB-CG 3.95Å; L42-L172 HydrophobicContact CD1-CD2 3.97Å; L42-L172 HydrophobicContact CD1-CG 4.18Å; L42-L172 HydrophobicContact CG-CD2 4.45Å; W43-L172 HydrophobicContact CD2-CD1 4.16Å; W43-L172 HydrophobicContact CD2-CD2 4.48Å; W43-L172 HydrophobicContact CE3-CD1 4.42Å; W43-L172 HydrophobicContact CG-CD2 4.38Å; W43-L172 HydrophobicContact CH2-CD1 4.35Å; W43-L172 HydrophobicContact CZ2-CD1 4.09Å; R168-L172 PolarHBondContact O-N 2.82Å; V169-L172 WeakPolarHBondContact O-CB 3.34Å; V169-L172 PolarHBondContact O-N 3.31Å; L172-N174 VanDerWaalsContact C-N 3.32Å; L172-N174 PolarHBondContact O-N 2.88Å; L172-F175 PolarHBondContact O-N 3.02Å; L172-V176 PolarHBondContact O-N 3.44Å
173	R	97.4	Very high	96.6	Very high	100 Å²	100	23.2 Å²	23.2	38%	0.377	12%	0.121	S	C	.	.	H	α-helix	trans	-64	-35.8	174.3	-162.4	-169.6	179.1	-171.8	1.5	112.1	V169 E170 I171 F175 V176 F177	V169-R173 PolarHBondContact O-N 3.47Å; V169-R173 VanDerWaalsContact O-N 3.08Å; E170-R173 CarbonylContact O-C 3.59Å; E170-R173 WeakPolarHBondContact O-CA 3.39Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 3.27Å; E170-R173 VanDerWaalsContact O-N 3.12Å; E170-R173 IonicContact OE1-NH1 3.51Å; E170-R173 IonicContact OE2-NH1 2.77Å; I171-R173 PolarHBondContact O-N 3.17Å; R173-F175 PolarHBondContact O-N 3.42Å; R173-V176 WeakPolarHBondContact O-CB 3.34Å; R173-V176 PolarHBondContact O-N 3.42Å; R173-V176 VanDerWaalsContact O-N 3.14Å; R173-F177 HydrophobicContact CG-CD2 4.38Å; R173-F177 HydrophobicContact CG-CE2 3.67Å; R173-F177 HydrophobicContact CG-CZ 4.3Å; R173-F177 WeakPolarHBondContact O-CD2 3.37Å; R173-F177 PolarHBondContact O-N 3.35Å
174	N	98	Very high	96.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-42.8	175.7	-81.3	-119.7	0	0	0	111.5	M83 I87 Y146 Y147 E170 I171 L172 V176 F177 I178	M83-N174 HydrophobicContact CE-CB 4.04Å; M83-N174 WeakPolarHBondContact CE-OD1 3.43Å; I87-N174 HydrophobicContact CD1-CB 4.16Å; Y146-N174 WeakPolarHBondContact CE1-OD1 3.48Å; Y146-N174 PolarHBondContact OH-ND2 3.28Å; Y146-N174 PolarHBondContact OH-OD1 2.93Å; Y147-N174 PolarHBondContact OH-OD1 3.41Å; E170-N174 PolarHBondContact O-N 3.01Å; E170-N174 PolarHBondContact O-ND2 3.04Å; I171-N174 WeakPolarHBondContact O-CA 3.3Å; I171-N174 VanDerWaalsContact O-CB 3.31Å; I171-N174 WeakPolarHBondContact O-CB 3.41Å; I171-N174 PolarHBondContact O-N 3.15Å; L172-N174 VanDerWaalsContact C-N 3.32Å; L172-N174 PolarHBondContact O-N 2.88Å; N174-V176 PolarHBondContact O-N 3.09Å; N174-F177 CarbonylContact O-C 3.56Å; N174-F177 WeakPolarHBondContact O-CA 3.35Å; N174-F177 PolarHBondContact O-N 3.05Å; N174-I178 WeakPolarHBondContact O-CG1 3.41Å; N174-I178 PolarHBondContact O-N 3.25Å
175	F	97.8	Very high	95.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.4	-27.7	175.7	-79.1	-73.8	0	0	0	113.3	C38 Q39 L42 L84 I87 V112 I171 L172 R173 I178 N179	C38-F175 HydrophobicContact CB-CD1 4.16Å; C38-F175 HydrophobicContact CB-CD2 4.43Å; C38-F175 HydrophobicContact CB-CE1 3.54Å; C38-F175 HydrophobicContact CB-CE2 3.86Å; C38-F175 HydrophobicContact CB-CZ 3.38Å; Q39-F175 HydrophobicContact CG-CB 3.45Å; Q39-F175 VanDerWaalsContact CG-CB 3.45Å; Q39-F175 HydrophobicContact CG-CD2 4.4Å; Q39-F175 HydrophobicContact CG-CG 3.96Å; L42-F175 HydrophobicContact CD1-CD2 3.63Å; L42-F175 HydrophobicContact CD1-CE2 3.67Å; L84-F175 HydrophobicContact CD2-CE1 4.09Å; L84-F175 HydrophobicContact CD2-CZ 4.43Å; I87-F175 HydrophobicContact CD1-CE2 4.18Å; I87-F175 HydrophobicContact CD1-CZ 4.21Å; I87-F175 HydrophobicContact CG2-CE2 4.38Å; I87-F175 HydrophobicContact CG2-CZ 4.48Å; V112-F175 HydrophobicContact CG2-CZ 4.13Å; I171-F175 HydrophobicContact CG2-CD2 4.05Å; I171-F175 HydrophobicContact CG2-CE2 3.81Å; I171-F175 WeakPolarHBondContact O-CD2 3.21Å; I171-F175 PolarHBondContact O-N 2.85Å; I171-F175 VanDerWaalsContact O-N 3.09Å; L172-F175 PolarHBondContact O-N 3.02Å; R173-F175 PolarHBondContact O-N 3.42Å; F175-I178 HydrophobicContact CD1-CD1 4.04Å; F175-I178 HydrophobicContact CE1-CD1 4.19Å; F175-N179 WeakPolarHBondContact O-CB 3.4Å; F175-N179 VanDerWaalsContact O-CG 3.29Å; F175-N179 PolarHBondContact O-N 3.08Å; F175-N179 PolarHBondContact O-ND2 3.06Å; F175-N179 VanDerWaalsContact O-ND2 3.15Å
176	V	96.2	Very high	94.9	Very high	69 Å²	69	32.7 Å²	32.7	42%	0.418	16%	0.158	S	C	.	.	H	α-helix	trans	-63.4	-43.4	169.5	178.1	0	0	0	0	110.8	L172 R173 N174 N179 K180	L172-V176 PolarHBondContact O-N 3.44Å; R173-V176 WeakPolarHBondContact O-CB 3.34Å; R173-V176 PolarHBondContact O-N 3.42Å; R173-V176 VanDerWaalsContact O-N 3.14Å; N174-V176 PolarHBondContact O-N 3.09Å; V176-N179 PolarHBondContact O-N 3.16Å; V176-K180 WeakPolarHBondContact O-CG 3.44Å; V176-K180 PolarHBondContact O-N 3.02Å; V176-K180 VanDerWaalsContact O-N 3.14Å
177	F	95.6	Very high	93.1	Very high	12 Å²	12	39.5 Å²	39.5	5%	0.053	19%	0.194	C	C	.	.	H	α-helix	trans	-70.2	-39.9	176.9	-61.9	-63	0	0	0	112.6	I61 I65 K66 M83 R173 N174 N179 K180 L181	I61-F177 HydrophobicContact CD1-CD2 3.21Å; I61-F177 HydrophobicContact CD1-CE2 3.42Å; I61-F177 VanDerWaalsContact CD1-CE2 3.42Å; I61-F177 HydrophobicContact CD1-CG 3.98Å; I61-F177 HydrophobicContact CD1-CZ 4.37Å; I61-F177 HydrophobicContact CG2-CE2 3.94Å; I61-F177 HydrophobicContact CG2-CZ 4.16Å; I65-F177 HydrophobicContact CG2-CB 3.74Å; I65-F177 HydrophobicContact CG2-CD1 4.48Å; I65-F177 HydrophobicContact CG2-CG 4.05Å; I65-F177 WeakPolarHBondContact O-CD1 3.32Å; K66-F177 HydrophobicContact CB-CE1 4.34Å; K66-F177 HydrophobicContact CG-CE1 3.96Å; K66-F177 HydrophobicContact CG-CZ 3.81Å; M83-F177 HydrophobicContact CE-CB 4.37Å; R173-F177 HydrophobicContact CG-CD2 4.38Å; R173-F177 HydrophobicContact CG-CE2 3.67Å; R173-F177 HydrophobicContact CG-CZ 4.3Å; R173-F177 WeakPolarHBondContact O-CD2 3.37Å; R173-F177 PolarHBondContact O-N 3.35Å; N174-F177 CarbonylContact O-C 3.56Å; N174-F177 WeakPolarHBondContact O-CA 3.35Å; N174-F177 PolarHBondContact O-N 3.05Å; F177-N179 VanDerWaalsContact C-N 3.29Å; F177-N179 PolarHBondContact O-N 3.21Å; F177-K180 HydrophobicContact CD1-CD 4.33Å; F177-K180 WeakPolarHBondContact O-CB 3.25Å; F177-K180 PolarHBondContact O-N 3.33Å; F177-K180 VanDerWaalsContact O-N 3.1Å; F177-L181 WeakPolarHBondContact O-CG 3.27Å; F177-L181 PolarHBondContact O-N 2.97Å
178	I	95.9	Very high	92.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.8	-43.8	173.3	-70.5	167.7	0	0	0	110.4	Q31 I80 M83 L84 I87 N174 F175 K180 L181 T182	Q31-I178 HydrophobicContact CG-CG2 4.48Å; I80-I178 HydrophobicContact CG1-CG2 4.4Å; I80-I178 HydrophobicContact CG2-CG2 3.95Å; M83-I178 HydrophobicContact CB-CD1 4.21Å; M83-I178 HydrophobicContact CB-CG1 4.32Å; M83-I178 HydrophobicContact CE-CD1 4.32Å; M83-I178 HydrophobicContact CE-CG1 3.84Å; M83-I178 HydrophobicContact SD-CG1 3.96Å; L84-I178 HydrophobicContact CD2-CD1 4.02Å; L84-I178 HydrophobicContact CG-CD1 4.4Å; I87-I178 HydrophobicContact CD1-CD1 3.79Å; N174-I178 WeakPolarHBondContact O-CG1 3.41Å; N174-I178 PolarHBondContact O-N 3.25Å; F175-I178 HydrophobicContact CD1-CD1 4.04Å; F175-I178 HydrophobicContact CE1-CD1 4.19Å; I178-K180 VanDerWaalsContact C-N 3.33Å; I178-K180 PolarHBondContact O-N 2.94Å; I178-L181 PolarHBondContact O-N 3.03Å; I178-T182 WeakPolarHBondContact O-CB 3.33Å; I178-T182 PolarHBondContact O-N 3.05Å; I178-T182 PolarHBondContact O-OG1 3.33Å
179	N	94.8	Very high	92.6	Very high	48 Å²	48	42.6 Å²	42.6	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-38.5	176.1	-78.4	-33.9	0	0	0	112.5	S35 Q39 F175 V176 F177 T182 G183	S35-N179 VanDerWaalsContact CB-OD1 3.26Å; S35-N179 WeakPolarHBondContact CB-OD1 3.46Å; Q39-N179 PolarHBondContact OE1-ND2 3.27Å; F175-N179 WeakPolarHBondContact O-CB 3.4Å; F175-N179 VanDerWaalsContact O-CG 3.29Å; F175-N179 PolarHBondContact O-N 3.08Å; F175-N179 PolarHBondContact O-ND2 3.06Å; F175-N179 VanDerWaalsContact O-ND2 3.15Å; V176-N179 PolarHBondContact O-N 3.16Å; F177-N179 VanDerWaalsContact C-N 3.29Å; F177-N179 PolarHBondContact O-N 3.21Å; N179-T182 WeakPolarHBondContact O-CB 3.32Å; N179-T182 PolarHBondContact O-N 2.81Å; N179-G183 PolarHBondContact O-N 3.05Å
180	K	93.4	Very high	92.4	Very high	105 Å²	105	41.8 Å²	41.8	46%	0.457	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-47.4	172.7	-70.9	177.6	178.2	-175.5	0	111.4	V176 F177 I178 T182 G183	V176-K180 WeakPolarHBondContact O-CG 3.44Å; V176-K180 PolarHBondContact O-N 3.02Å; V176-K180 VanDerWaalsContact O-N 3.14Å; F177-K180 HydrophobicContact CD1-CD 4.33Å; F177-K180 WeakPolarHBondContact O-CB 3.25Å; F177-K180 PolarHBondContact O-N 3.33Å; F177-K180 VanDerWaalsContact O-N 3.1Å; I178-K180 VanDerWaalsContact C-N 3.33Å; I178-K180 PolarHBondContact O-N 2.94Å; K180-T182 VanDerWaalsContact C-N 3.27Å; K180-T182 PolarHBondContact O-N 2.99Å; K180-G183 WeakPolarHBondContact O-CA 3.3Å; K180-G183 PolarHBondContact O-N 3.13Å
181	L	92.9	Very high	92	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-36.8	177.4	-70.1	170.7	0	0	0	111.9	I65 P68 F71 T79 I80 M83 F177 I178 G183 Y184	I65-L181 HydrophobicContact CD1-CD1 4.48Å; P68-L181 HydrophobicContact CB-CD2 4.15Å; F71-L181 HydrophobicContact CD1-CD2 4.24Å; F71-L181 HydrophobicContact CD2-CD2 4.3Å; F71-L181 HydrophobicContact CE1-CD2 4.11Å; F71-L181 HydrophobicContact CE2-CD2 4.16Å; F71-L181 HydrophobicContact CG-CD2 4.32Å; F71-L181 HydrophobicContact CZ-CD2 4.05Å; T79-L181 HydrophobicContact CG2-CD1 3.67Å; I80-L181 HydrophobicContact CD1-CB 3.84Å; I80-L181 HydrophobicContact CG1-CB 3.73Å; I80-L181 HydrophobicContact CG1-CD1 4.14Å; M83-L181 HydrophobicContact SD-CD1 3.85Å; F177-L181 WeakPolarHBondContact O-CG 3.27Å; F177-L181 PolarHBondContact O-N 2.97Å; I178-L181 PolarHBondContact O-N 3.03Å; L181-G183 PolarHBondContact O-N 2.49Å; L181-G183 VanDerWaalsContact O-N 3.13Å; L181-Y184 WeakPolarHBondContact O-CB 3.39Å; L181-Y184 PolarHBondContact O-N 3.15Å
182	T	93.7	Very high	91.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-63.4	-18.7	175.4	-55	0	0	0	0	112.2	G28 Q31 R32 I178 N179 K180 Y184 L185	G28-T182 VanDerWaalsContact O-CG2 3.27Å; G28-T182 WeakPolarHBondContact O-CG2 3.49Å; Q31-T182 HydrophobicContact CB-CG2 3.82Å; Q31-T182 HydrophobicContact CG-CG2 3.96Å; Q31-T182 VanDerWaalsContact CG-OG1 3.32Å; Q31-T182 WeakPolarHBondContact CG-OG1 3.27Å; R32-T182 HydrophobicContact CG-CG2 3.72Å; I178-T182 WeakPolarHBondContact O-CB 3.33Å; I178-T182 PolarHBondContact O-N 3.05Å; I178-T182 PolarHBondContact O-OG1 3.33Å; N179-T182 WeakPolarHBondContact O-CB 3.32Å; N179-T182 PolarHBondContact O-N 2.81Å; K180-T182 VanDerWaalsContact C-N 3.27Å; K180-T182 PolarHBondContact O-N 2.99Å; T182-Y184 VanDerWaalsContact C-N 3.25Å; T182-Y184 PolarHBondContact O-N 2.87Å; T182-L185 HydrophobicContact CG2-CD1 4.33Å; T182-L185 PolarHBondContact O-N 3.03Å
183	G	92.4	Very high	91.2	Very high	35 Å²	35	48.3 Å²	48.3	36%	0.361	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-59	-35.7	169	0	0	0	0	0	113.1	N179 K180 L181 L185 R186	N179-G183 PolarHBondContact O-N 3.05Å; K180-G183 WeakPolarHBondContact O-CA 3.3Å; K180-G183 PolarHBondContact O-N 3.13Å; L181-G183 PolarHBondContact O-N 2.49Å; L181-G183 VanDerWaalsContact O-N 3.13Å; G183-L185 VanDerWaalsContact C-N 3.3Å; G183-L185 PolarHBondContact O-N 3.27Å; G183-R186 PolarHBondContact O-N 2.97Å
184	Y	90.6	Very high	90.8	Very high	75 Å²	75	44.6 Å²	44.6	29%	0.294	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-78.1	-9.8	-177.5	-65.7	-83.8	0	0	0	114	P68 F71 K73 L181 T182 R186	P68-Y184 HydrophobicContact CB-CE2 3.86Å; P68-Y184 HydrophobicContact CG-CE2 3.83Å; P68-Y184 PolarHBondContact O-OH 3.11Å; F71-Y184 HydrophobicContact CB-CD1 3.85Å; F71-Y184 HydrophobicContact CB-CD2 4.09Å; F71-Y184 HydrophobicContact CB-CE1 4.25Å; F71-Y184 HydrophobicContact CB-CE2 4.45Å; F71-Y184 HydrophobicContact CB-CG 3.77Å; K73-Y184 WeakPolarHBondContact CG-O 3.26Å; L181-Y184 WeakPolarHBondContact O-CB 3.39Å; L181-Y184 PolarHBondContact O-N 3.15Å; T182-Y184 VanDerWaalsContact C-N 3.25Å; T182-Y184 PolarHBondContact O-N 2.87Å; Y184-R186 VanDerWaalsContact C-N 3.29Å
185	L	88.6	Confident	90.2	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-78.4	-16.2	176.4	-57.4	-178.1	0	0	0	112.3	Y24 L27 K73 A76 A77 I80 T182 G183	Y24-L185 WeakPolarHBondContact CB-O 3.25Å; Y24-L185 HydrophobicContact CD1-CD2 4.09Å; Y24-L185 HydrophobicContact CE1-CD2 4.32Å; L27-L185 HydrophobicContact CD2-CD1 3.99Å; L27-L185 HydrophobicContact CG-CD1 3.97Å; K73-L185 PolarHBondContact NZ-O 2.81Å; K73-L185 WeakPolarHBondContact O-CD2 3.26Å; A76-L185 HydrophobicContact CB-CD2 3.99Å; A77-L185 HydrophobicContact CB-CD2 4.06Å; I80-L185 HydrophobicContact CD1-CD1 4.18Å; T182-L185 HydrophobicContact CG2-CD1 4.33Å; T182-L185 PolarHBondContact O-N 3.03Å; G183-L185 VanDerWaalsContact C-N 3.3Å; G183-L185 PolarHBondContact O-N 3.27Å
186	R	80.2	Confident	89.6	Confident	126 Å²	126	52 Å²	52	48%	0.475	26%	0.261	S	S	.	.			trans	-76.6	152.4	177.5	-67.7	-175.1	170.7	-174.3	-7	111.5	R32 K73 G183 Y184	R32-R186 VanDerWaalsContact CZ-NE 3.35Å; R32-R186 VanDerWaalsContact CZ-NH2 3.33Å; R32-R186 VanDerWaalsContact NH2-CZ 3.33Å; K73-R186 VanDerWaalsContact CE-O 3.23Å; K73-R186 WeakPolarHBondContact CE-O 3.36Å; K73-R186 PolarHBondContact NZ-O 2.64Å; G183-R186 PolarHBondContact O-N 2.97Å; Y184-R186 VanDerWaalsContact C-N 3.29Å
187	N	60.6	Low	89	Confident	154 Å²	154	50.5 Å²	50.5	82%	0.824	25%	0.247	S	C	*	.			trans	-74.1	0	163	-65	-31.2	0	0	0	110.4	S21 N25 K73	S21-N187 WeakPolarHBondContact CB-ND2 3.16Å; S21-N187 PolarHBondContact OG-ND2 2.73Å; N25-N187 PolarHBondContact ND2-ND2 3.21Å; N25-N187 PolarHBondContact OD1-N 3.28Å; K73-N187 VanDerWaalsContact NZ-N 3.19Å; K73-N187 PolarHBondContact NZ-OD1 2.98Å

Retrieved 187 of 187 residues in 40.6 ms (Link to these results)

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