A0A3Q0KLW7_SCHMA Loading...

Chitin synthase export chaperone

AlphaFold DB , UniProt , Accession A0A3Q0KLW7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 283 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	60.9	Low	72.3	Confident	219 Å²	219	129.4 Å²	129.4	100%	1.079	66%	0.656	S	S	*	*				0	-53	0	-91.4	179.9	170.8	0	0	113.7	R3 N4	M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.11Å; M1-N4 PolarHBondContact O-N 3.46Å
2	L	64.2	Low	73.2	Confident	153 Å²	153	125.7 Å²	125.7	80%	0.801	64%	0.639	S	S	*	*	H	α-helix	trans	-53.5	-38	-175.7	-101.7	135	0	0	0	115.7	N4 C5 V6	L2-N4 PolarHBondContact O-N 3.18Å; L2-C5 PolarHBondContact O-N 3.39Å; L2-V6 PolarHBondContact O-N 3.44Å
3	R	65.8	Low	73.8	Confident	212 Å²	212	124.9 Å²	124.9	80%	0.8	64%	0.637	S	S	*	*	H	α-helix	trans	-66.2	-33.9	-177.9	-154.2	-177.2	-81.2	-123.3	4.3	113.3	M1 I7	M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.11Å; R3-I7 WeakPolarHBondContact O-CG1 3.38Å; R3-I7 PolarHBondContact O-N 3.42Å
4	N	72.3	Confident	74.5	Confident	119 Å²	119	129.4 Å²	129.4	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-72	-37.2	178.6	-72.2	8.7	0	0	0	111.7	M1 L2 V6 I7 E8	M1-N4 PolarHBondContact O-N 3.46Å; L2-N4 PolarHBondContact O-N 3.18Å; N4-V6 PolarHBondContact O-N 3.2Å; N4-I7 PolarHBondContact O-N 3.33Å; N4-E8 WeakPolarHBondContact O-CB 3.46Å; N4-E8 PolarHBondContact O-N 2.99Å
5	C	75.6	Confident	75.2	Confident	82 Å²	82	124.8 Å²	124.8	55%	0.554	62%	0.624	S	S	*	*	H	α-helix	trans	-65.1	-38.4	-179.8	-174.5	0	0	0	0	112.5	L2 K9	L2-C5 PolarHBondContact O-N 3.39Å; C5-K9 PolarHBondContact O-N 3.44Å; C5-K9 VanDerWaalsContact O-N 3.11Å
6	V	71.9	Confident	75.8	Confident	91 Å²	91	125.3 Å²	125.3	55%	0.552	62%	0.624	S	S	*	*	H	α-helix	trans	-66.6	-43.6	176.6	178.1	0	0	0	0	111.2	L2 N4 E8 K9 V10	L2-V6 PolarHBondContact O-N 3.44Å; N4-V6 PolarHBondContact O-N 3.2Å; V6-E8 PolarHBondContact O-N 3.06Å; V6-K9 PolarHBondContact O-N 3.24Å; V6-V10 WeakPolarHBondContact O-CG2 3.34Å; V6-V10 PolarHBondContact O-N 2.97Å; V6-V10 VanDerWaalsContact O-N 3.08Å
7	I	74.8	Confident	76.4	Confident	100 Å²	100	119.8 Å²	119.8	51%	0.513	61%	0.607	S	S	.	*	H	α-helix	trans	-62.5	-44.6	179	-65.4	168.6	0	0	0	110.4	R3 N4 K9 V10 V11	R3-I7 WeakPolarHBondContact O-CG1 3.38Å; R3-I7 PolarHBondContact O-N 3.42Å; N4-I7 PolarHBondContact O-N 3.33Å; I7-K9 VanDerWaalsContact C-N 3.33Å; I7-K9 PolarHBondContact O-N 3.49Å; I7-V10 PolarHBondContact O-N 3.35Å; I7-V11 HydrophobicContact CG2-CG2 4.39Å; I7-V11 WeakPolarHBondContact O-CG2 3.49Å; I7-V11 PolarHBondContact O-N 3.41Å
8	E	74.6	Confident	77	Confident	126 Å²	126	117 Å²	117	59%	0.589	60%	0.596	S	S	*	*	H	α-helix	trans	-61.8	-40.2	178.6	-166	175.6	-174.6	0	0	112.2	N4 V6 V11 N12	N4-E8 WeakPolarHBondContact O-CB 3.46Å; N4-E8 PolarHBondContact O-N 2.99Å; V6-E8 PolarHBondContact O-N 3.06Å; E8-V11 PolarHBondContact O-N 3.43Å; E8-N12 WeakPolarHBondContact O-CB 3.38Å; E8-N12 PolarHBondContact O-N 3.08Å
9	K	76.9	Confident	77.5	Confident	148 Å²	148	120 Å²	120	64%	0.643	60%	0.6	S	S	*	*	H	α-helix	trans	-65.3	-39.6	176.2	-164.2	172.6	-175.7	177.5	0	112.5	C5 V6 I7 L13	C5-K9 PolarHBondContact O-N 3.44Å; C5-K9 VanDerWaalsContact O-N 3.11Å; V6-K9 PolarHBondContact O-N 3.24Å; I7-K9 VanDerWaalsContact C-N 3.33Å; I7-K9 PolarHBondContact O-N 3.49Å; K9-L13 PolarHBondContact O-N 3.02Å
10	V	77.1	Confident	77.8	Confident	96 Å²	96	121.1 Å²	121.1	58%	0.582	60%	0.597	S	S	*	*	H	α-helix	trans	-67.6	-41.8	176.9	173.2	0	0	0	0	111.4	V6 I7 L13 W14	V6-V10 WeakPolarHBondContact O-CG2 3.34Å; V6-V10 PolarHBondContact O-N 2.97Å; V6-V10 VanDerWaalsContact O-N 3.08Å; I7-V10 PolarHBondContact O-N 3.35Å; V10-L13 PolarHBondContact O-N 3.36Å; V10-W14 WeakPolarHBondContact O-CB 3.33Å; V10-W14 PolarHBondContact O-N 2.99Å
11	V	81.4	Confident	78.4	Confident	77 Å²	77	119.1 Å²	119.1	47%	0.467	59%	0.589	S	S	.	*	H	α-helix	trans	-63.3	-42.1	176.3	172.7	0	0	0	0	111.2	I7 E8 W14 T15	I7-V11 HydrophobicContact CG2-CG2 4.39Å; I7-V11 WeakPolarHBondContact O-CG2 3.49Å; I7-V11 PolarHBondContact O-N 3.41Å; E8-V11 PolarHBondContact O-N 3.43Å; V11-W14 PolarHBondContact O-N 2.94Å; V11-T15 HydrophobicContact CG1-CG2 4.4Å; V11-T15 WeakPolarHBondContact O-CG2 3.27Å; V11-T15 PolarHBondContact O-N 3.33Å; V11-T15 PolarHBondContact O-OG1 2.99Å
12	N	82.5	Confident	79.6	Confident	85 Å²	85	115.3 Å²	115.3	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-40.9	175.9	-78.7	-21.7	0	0	0	112.5	E8 T15 Q16	E8-N12 WeakPolarHBondContact O-CB 3.38Å; E8-N12 PolarHBondContact O-N 3.08Å; N12-T15 WeakPolarHBondContact CA-OG1 3.41Å; N12-T15 PolarHBondContact O-OG1 2.94Å; N12-Q16 WeakPolarHBondContact O-CB 3.39Å; N12-Q16 VanDerWaalsContact O-CG 3.27Å; N12-Q16 WeakPolarHBondContact O-CG 3.49Å; N12-Q16 PolarHBondContact O-N 3.01Å
13	L	81.7	Confident	80.9	Confident	116 Å²	116	113.5 Å²	113.5	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-64.7	-41.4	176.2	-123.1	110.5	0	0	0	112	K9 V10 Q16 G17	K9-L13 PolarHBondContact O-N 3.02Å; V10-L13 PolarHBondContact O-N 3.36Å; L13-Q16 PolarHBondContact O-N 2.95Å; L13-G17 PolarHBondContact O-N 2.99Å
14	W	83.8	Confident	82	Confident	187 Å²	187	111 Å²	111	71%	0.708	55%	0.549	S	S	*	.	H	α-helix	trans	-67	-44.5	179.5	-168.7	80.5	0	0	0	111.8	V10 V11 Q16 G17 V18	V10-W14 WeakPolarHBondContact O-CB 3.33Å; V10-W14 PolarHBondContact O-N 2.99Å; V11-W14 PolarHBondContact O-N 2.94Å; W14-Q16 VanDerWaalsContact C-N 3.34Å; W14-Q16 PolarHBondContact O-N 3.33Å; W14-G17 PolarHBondContact O-N 2.94Å; W14-V18 HydrophobicContact CD2-CG2 4.07Å; W14-V18 HydrophobicContact CE3-CG2 4.11Å; W14-V18 HydrophobicContact CH2-CG2 4.07Å; W14-V18 HydrophobicContact CZ2-CG2 4.02Å; W14-V18 HydrophobicContact CZ3-CG2 4.11Å; W14-V18 WeakPolarHBondContact O-CG2 3.38Å; W14-V18 PolarHBondContact O-N 3.33Å
15	T	84	Confident	82.7	Confident	61 Å²	61	112.6 Å²	112.6	37%	0.374	55%	0.55	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.2	52	0	0	0	0	112.6	V11 N12 R19	V11-T15 HydrophobicContact CG1-CG2 4.4Å; V11-T15 WeakPolarHBondContact O-CG2 3.27Å; V11-T15 PolarHBondContact O-N 3.33Å; V11-T15 PolarHBondContact O-OG1 2.99Å; N12-T15 WeakPolarHBondContact CA-OG1 3.41Å; N12-T15 PolarHBondContact O-OG1 2.94Å; T15-R19 WeakPolarHBondContact O-CB 3.44Å; T15-R19 PolarHBondContact O-N 3.2Å
16	Q	85.1	Confident	83.4	Confident	132 Å²	132	115.2 Å²	115.2	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-63.1	-45.1	171.5	-77.2	177.3	-9.4	0	0	111.8	N12 L13 W14 V18 R19 Y20	N12-Q16 WeakPolarHBondContact O-CB 3.39Å; N12-Q16 VanDerWaalsContact O-CG 3.27Å; N12-Q16 WeakPolarHBondContact O-CG 3.49Å; N12-Q16 PolarHBondContact O-N 3.01Å; L13-Q16 PolarHBondContact O-N 2.95Å; W14-Q16 VanDerWaalsContact C-N 3.34Å; W14-Q16 PolarHBondContact O-N 3.33Å; Q16-V18 PolarHBondContact O-N 3.5Å; Q16-R19 PolarHBondContact O-N 3.45Å; Q16-Y20 WeakPolarHBondContact O-CB 3.03Å; Q16-Y20 PolarHBondContact O-N 3.46Å
17	G	86.3	Confident	84	Confident	33 Å²	33	116.7 Å²	116.7	34%	0.34	55%	0.553	S	S	.	*	H	α-helix	trans	-62	-42.3	176.9	0	0	0	0	0	113.1	L13 W14 Y20 N21	L13-G17 PolarHBondContact O-N 2.99Å; W14-G17 PolarHBondContact O-N 2.94Å; G17-Y20 PolarHBondContact O-N 3.36Å; G17-N21 PolarHBondContact O-N 3.43Å; G17-N21 PolarHBondContact O-ND2 2.94Å
18	V	86.2	Confident	84.4	Confident	69 Å²	69	114.5 Å²	114.5	42%	0.418	55%	0.55	S	S	.	.	H	α-helix	trans	-64.3	-44.1	175.7	172.6	0	0	0	0	111.1	W14 Q16 N21 M22	W14-V18 HydrophobicContact CD2-CG2 4.07Å; W14-V18 HydrophobicContact CE3-CG2 4.11Å; W14-V18 HydrophobicContact CH2-CG2 4.07Å; W14-V18 HydrophobicContact CZ2-CG2 4.02Å; W14-V18 HydrophobicContact CZ3-CG2 4.11Å; W14-V18 WeakPolarHBondContact O-CG2 3.38Å; W14-V18 PolarHBondContact O-N 3.33Å; Q16-V18 PolarHBondContact O-N 3.5Å; V18-N21 PolarHBondContact O-N 3.48Å; V18-M22 WeakPolarHBondContact O-CB 3.4Å; V18-M22 PolarHBondContact O-N 2.93Å
19	R	87.1	Confident	84.6	Confident	174 Å²	174	111.1 Å²	111.1	66%	0.657	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-45.9	177.5	-172.7	-179.2	-63	-177.3	0.4	111.6	T15 Q16 N21 M22 E23	T15-R19 WeakPolarHBondContact O-CB 3.44Å; T15-R19 PolarHBondContact O-N 3.2Å; Q16-R19 PolarHBondContact O-N 3.45Å; R19-N21 PolarHBondContact O-N 2.95Å; R19-M22 PolarHBondContact O-N 2.92Å; R19-E23 WeakPolarHBondContact O-CG 3.47Å; R19-E23 PolarHBondContact O-N 3.05Å
20	Y	83.5	Confident	84.9	Confident	141 Å²	141	108.1 Å²	108.1	55%	0.553	53%	0.53	S	S	*	.	H	α-helix	trans	-59.3	-45.5	177.4	-179.5	-98.3	0	0	0	112.2	Q16 G17 E23 R24	Q16-Y20 WeakPolarHBondContact O-CB 3.03Å; Q16-Y20 PolarHBondContact O-N 3.46Å; G17-Y20 PolarHBondContact O-N 3.36Å; Y20-E23 PolarHBondContact O-N 3.46Å; Y20-R24 PolarHBondContact O-N 3.06Å
21	N	89.8	Confident	85	Confident	80 Å²	80	107.6 Å²	107.6	43%	0.428	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-42.7	176.7	-74.3	-29.3	0	0	0	112.1	G17 V18 R19 E23 R24 F25	G17-N21 PolarHBondContact O-N 3.43Å; G17-N21 PolarHBondContact O-ND2 2.94Å; V18-N21 PolarHBondContact O-N 3.48Å; R19-N21 PolarHBondContact O-N 2.95Å; N21-E23 PolarHBondContact O-N 3.48Å; N21-R24 PolarHBondContact O-N 3.28Å; N21-F25 HydrophobicContact CB-CE2 4.39Å; N21-F25 WeakPolarHBondContact O-CD2 3.41Å; N21-F25 PolarHBondContact O-N 3.26Å
22	M	87.1	Confident	84.8	Confident	140 Å²	140	111 Å²	111	69%	0.69	54%	0.535	S	S	*	.	H	α-helix	trans	-61.4	-42.5	178.1	-165.8	81.1	177.5	0	0	111.9	V18 R19 F25 K26	V18-M22 WeakPolarHBondContact O-CB 3.4Å; V18-M22 PolarHBondContact O-N 2.93Å; R19-M22 PolarHBondContact O-N 2.92Å; M22-F25 PolarHBondContact O-N 2.91Å; M22-K26 WeakPolarHBondContact O-CB 3.44Å; M22-K26 PolarHBondContact O-N 3.47Å
23	E	90.7	Very high	84.2	Confident	115 Å²	115	115.2 Å²	115.2	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.7	-75.6	174.3	-171.9	0	0	111.4	R19 Y20 N21 F25 K26 E27	R19-E23 WeakPolarHBondContact O-CG 3.47Å; R19-E23 PolarHBondContact O-N 3.05Å; Y20-E23 PolarHBondContact O-N 3.46Å; N21-E23 PolarHBondContact O-N 3.48Å; E23-F25 PolarHBondContact O-N 3.21Å; E23-K26 WeakPolarHBondContact O-CB 3.34Å; E23-K26 PolarHBondContact O-N 3.42Å; E23-E27 WeakPolarHBondContact O-CB 3.4Å; E23-E27 PolarHBondContact O-N 2.93Å
24	R	88.9	Confident	83.8	Confident	160 Å²	160	115.1 Å²	115.1	60%	0.604	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-41.7	176.2	-161.7	-176.4	-157.6	-174.5	6.4	112.8	Y20 N21 E27 A28	Y20-R24 PolarHBondContact O-N 3.06Å; N21-R24 PolarHBondContact O-N 3.28Å; R24-E27 PolarHBondContact O-N 2.84Å; R24-A28 WeakPolarHBondContact O-CB 3.47Å; R24-A28 PolarHBondContact O-N 3.48Å
25	F	88.5	Confident	83.3	Confident	151 Å²	151	112.8 Å²	112.8	66%	0.662	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-40.3	174.5	-77.5	-61	0	0	0	111.7	N21 M22 E23 A28 S29	N21-F25 HydrophobicContact CB-CE2 4.39Å; N21-F25 WeakPolarHBondContact O-CD2 3.41Å; N21-F25 PolarHBondContact O-N 3.26Å; M22-F25 PolarHBondContact O-N 2.91Å; E23-F25 PolarHBondContact O-N 3.21Å; F25-A28 PolarHBondContact O-N 3.29Å; F25-S29 WeakPolarHBondContact O-CB 3.27Å; F25-S29 PolarHBondContact O-N 2.87Å; F25-S29 PolarHBondContact O-OG 3.39Å
26	K	89.2	Confident	82.8	Confident	138 Å²	138	112.3 Å²	112.3	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-63.2	-47.1	176.3	-171	178.9	179.4	-175.9	0	110.8	M22 E23 S29 I30	M22-K26 WeakPolarHBondContact O-CB 3.44Å; M22-K26 PolarHBondContact O-N 3.47Å; E23-K26 WeakPolarHBondContact O-CB 3.34Å; E23-K26 PolarHBondContact O-N 3.42Å; K26-S29 PolarHBondContact O-N 3.22Å; K26-S29 PolarHBondContact O-OG 2.9Å; K26-I30 HydrophobicContact CG-CD1 3.98Å; K26-I30 VanDerWaalsContact O-CG1 3.27Å; K26-I30 WeakPolarHBondContact O-CG1 3.37Å; K26-I30 PolarHBondContact O-N 3.23Å
27	E	84.7	Confident	82.4	Confident	122 Å²	122	110.4 Å²	110.4	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-61.5	-45.3	176.7	-170.5	173.8	-168.3	0	0	111.9	E23 R24 S29 I30 N31	E23-E27 WeakPolarHBondContact O-CB 3.4Å; E23-E27 PolarHBondContact O-N 2.93Å; R24-E27 PolarHBondContact O-N 2.84Å; E27-S29 VanDerWaalsContact C-N 3.32Å; E27-S29 PolarHBondContact O-N 2.92Å; E27-I30 PolarHBondContact O-N 2.91Å; E27-N31 WeakPolarHBondContact O-CB 3.36Å; E27-N31 PolarHBondContact O-N 3.47Å; E27-N31 PolarHBondContact O-ND2 2.89Å
28	A	82.4	Confident	82	Confident	54 Å²	54	112.2 Å²	112.2	45%	0.446	53%	0.528	S	S	.	.	H	α-helix	trans	-58.8	-42.9	174	0	0	0	0	0	112.1	R24 F25 N31 Q32	R24-A28 WeakPolarHBondContact O-CB 3.47Å; R24-A28 PolarHBondContact O-N 3.48Å; F25-A28 PolarHBondContact O-N 3.29Å; A28-N31 PolarHBondContact O-N 2.7Å; A28-Q32 WeakPolarHBondContact O-CB 3.35Å; A28-Q32 PolarHBondContact O-N 3.43Å
29	S	79.9	Confident	81.6	Confident	54 Å²	54	110.9 Å²	110.9	38%	0.378	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-35.3	177.9	76.4	0	0	0	0	113.1	F25 K26 E27 R33	F25-S29 WeakPolarHBondContact O-CB 3.27Å; F25-S29 PolarHBondContact O-N 2.87Å; F25-S29 PolarHBondContact O-OG 3.39Å; K26-S29 PolarHBondContact O-N 3.22Å; K26-S29 PolarHBondContact O-OG 2.9Å; E27-S29 VanDerWaalsContact C-N 3.32Å; E27-S29 PolarHBondContact O-N 2.92Å; S29-R33 WeakPolarHBondContact O-CB 2.81Å; S29-R33 PolarHBondContact O-N 3.49Å
30	I	82	Confident	81.4	Confident	85 Å²	85	107.3 Å²	107.3	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-69.5	-46.5	175.9	-70.2	165.4	0	0	0	109.7	K26 E27 Q32 R33 Q34	K26-I30 HydrophobicContact CG-CD1 3.98Å; K26-I30 VanDerWaalsContact O-CG1 3.27Å; K26-I30 WeakPolarHBondContact O-CG1 3.37Å; K26-I30 PolarHBondContact O-N 3.23Å; E27-I30 PolarHBondContact O-N 2.91Å; I30-Q32 VanDerWaalsContact C-N 3.33Å; I30-Q32 PolarHBondContact O-N 2.95Å; I30-R33 PolarHBondContact O-N 2.83Å; I30-Q34 WeakPolarHBondContact O-CB 3.21Å; I30-Q34 PolarHBondContact O-N 3.17Å
31	N	80.4	Confident	81.5	Confident	86 Å²	86	106.8 Å²	106.8	46%	0.46	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-43.2	177.6	-70.3	-22.5	0	0	0	111.2	E27 A28 R33 Q34 Y35	E27-N31 WeakPolarHBondContact O-CB 3.36Å; E27-N31 PolarHBondContact O-N 3.47Å; E27-N31 PolarHBondContact O-ND2 2.89Å; A28-N31 PolarHBondContact O-N 2.7Å; N31-R33 PolarHBondContact O-N 3.43Å; N31-Q34 PolarHBondContact O-N 2.7Å; N31-Y35 WeakPolarHBondContact O-CB 3.46Å; N31-Y35 PolarHBondContact O-N 2.68Å
32	Q	75.8	Confident	81.3	Confident	147 Å²	147	103.6 Å²	103.6	69%	0.687	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-41.2	175.4	-174.9	178.7	-17.5	0	0	112.2	A28 I30 S36	A28-Q32 WeakPolarHBondContact O-CB 3.35Å; A28-Q32 PolarHBondContact O-N 3.43Å; I30-Q32 VanDerWaalsContact C-N 3.33Å; I30-Q32 PolarHBondContact O-N 2.95Å; Q32-S36 WeakPolarHBondContact O-CB 3.4Å; Q32-S36 PolarHBondContact O-N 3.44Å
33	R	70.6	Confident	81.2	Confident	174 Å²	174	97.7 Å²	97.7	66%	0.657	47%	0.466	S	S	*	.	H	α-helix	trans	-68.4	-42.7	177.9	-168.2	-177.6	-63.4	-177.9	-0.6	111.9	S29 I30 N31 Y35 S36 N37	S29-R33 WeakPolarHBondContact O-CB 2.81Å; S29-R33 PolarHBondContact O-N 3.49Å; I30-R33 PolarHBondContact O-N 2.83Å; N31-R33 PolarHBondContact O-N 3.43Å; R33-Y35 VanDerWaalsContact C-N 3.32Å; R33-S36 PolarHBondContact O-N 2.84Å; R33-N37 WeakPolarHBondContact O-CB 3.29Å; R33-N37 VanDerWaalsContact O-CG 3.27Å; R33-N37 PolarHBondContact O-N 2.98Å
34	Q	73.8	Confident	81.1	Confident	114 Å²	114	97.5 Å²	97.5	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-63.6	-42	176.7	-175.3	174.3	-28	0	0	110.9	I30 N31 N37 N38	I30-Q34 WeakPolarHBondContact O-CB 3.21Å; I30-Q34 PolarHBondContact O-N 3.17Å; N31-Q34 PolarHBondContact O-N 2.7Å; Q34-N37 PolarHBondContact O-N 3.04Å; Q34-N38 VanDerWaalsContact O-CB 3.29Å; Q34-N38 WeakPolarHBondContact O-CB 3.46Å; Q34-N38 PolarHBondContact O-N 3.43Å; Q34-N38 PolarHBondContact O-ND2 3.05Å
35	Y	72.3	Confident	81.2	Confident	138 Å²	138	91.9 Å²	91.9	54%	0.541	45%	0.45	S	S	.	.	H	α-helix	trans	-59.9	-50.1	174.1	-175.5	-97.3	0	0	0	111.6	N31 R33 N37 N38 E39	N31-Y35 WeakPolarHBondContact O-CB 3.46Å; N31-Y35 PolarHBondContact O-N 2.68Å; R33-Y35 VanDerWaalsContact C-N 3.32Å; Y35-N37 PolarHBondContact O-N 3.43Å; Y35-N38 WeakPolarHBondContact O-CB 3.45Å; Y35-N38 PolarHBondContact O-N 2.64Å; Y35-E39 VanDerWaalsContact CE1-CD 3.49Å; Y35-E39 HydrophobicContact CE1-CG 4.18Å; Y35-E39 WeakPolarHBondContact CE1-OE1 3.39Å; Y35-E39 WeakPolarHBondContact O-CG 3.49Å; Y35-E39 PolarHBondContact O-N 3.5Å; Y35-E39 PolarHBondContact OH-OE1 3.15Å
36	S	73.9	Confident	81.3	Confident	51 Å²	51	84.7 Å²	84.7	36%	0.357	42%	0.419	S	S	.	.	H	α-helix	trans	-61.6	-41.6	176.7	177.7	0	0	0	0	113.4	Q32 R33 N38 E39 N40	Q32-S36 WeakPolarHBondContact O-CB 3.4Å; Q32-S36 PolarHBondContact O-N 3.44Å; R33-S36 PolarHBondContact O-N 2.84Å; S36-N38 VanDerWaalsContact C-N 3.32Å; S36-N38 PolarHBondContact O-N 3.27Å; S36-E39 PolarHBondContact O-N 3.45Å; S36-N40 PolarHBondContact O-N 3.34Å; S36-N40 PolarHBondContact O-ND2 3.49Å
37	N	77.1	Confident	81.4	Confident	93 Å²	93	79.4 Å²	79.4	50%	0.497	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176.7	-76.9	-9	0	0	0	111.8	R33 Q34 Y35 E39 N40 F41	R33-N37 WeakPolarHBondContact O-CB 3.29Å; R33-N37 VanDerWaalsContact O-CG 3.27Å; R33-N37 PolarHBondContact O-N 2.98Å; Q34-N37 PolarHBondContact O-N 3.04Å; Y35-N37 PolarHBondContact O-N 3.43Å; N37-E39 VanDerWaalsContact C-N 3.33Å; N37-E39 PolarHBondContact O-N 3.25Å; N37-N40 PolarHBondContact O-N 3.4Å; N37-F41 WeakPolarHBondContact O-CB 3.29Å; N37-F41 PolarHBondContact O-N 3.38Å
38	N	78.2	Confident	81.7	Confident	70 Å²	70	76.1 Å²	76.1	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-36.1	177.4	-78.1	-4.7	0	0	0	112.3	Q34 Y35 S36 F42 Q227	Q34-N38 VanDerWaalsContact O-CB 3.29Å; Q34-N38 WeakPolarHBondContact O-CB 3.46Å; Q34-N38 PolarHBondContact O-N 3.43Å; Q34-N38 PolarHBondContact O-ND2 3.05Å; Y35-N38 WeakPolarHBondContact O-CB 3.45Å; Y35-N38 PolarHBondContact O-N 2.64Å; S36-N38 VanDerWaalsContact C-N 3.32Å; S36-N38 PolarHBondContact O-N 3.27Å; N38-F42 WeakPolarHBondContact O-CB 3.37Å; N38-F42 PolarHBondContact O-N 3.27Å; N38-Q227 PolarHBondContact O-NE2 3.02Å
39	E	78.6	Confident	82.2	Confident	42 Å²	42	75.5 Å²	75.5	20%	0.196	38%	0.379	C	S	.	.	H	α-helix	trans	-67.2	-44.3	174.2	-70.2	-168.6	165.4	0	0	112.4	Y35 S36 N37 F41 F42 T43 R224	Y35-E39 VanDerWaalsContact CE1-CD 3.49Å; Y35-E39 HydrophobicContact CE1-CG 4.18Å; Y35-E39 WeakPolarHBondContact CE1-OE1 3.39Å; Y35-E39 WeakPolarHBondContact O-CG 3.49Å; Y35-E39 PolarHBondContact O-N 3.5Å; Y35-E39 PolarHBondContact OH-OE1 3.15Å; S36-E39 PolarHBondContact O-N 3.45Å; N37-E39 VanDerWaalsContact C-N 3.33Å; N37-E39 PolarHBondContact O-N 3.25Å; E39-F41 VanDerWaalsContact C-N 3.32Å; E39-F41 PolarHBondContact O-N 3.44Å; E39-F42 PolarHBondContact O-N 3.31Å; E39-T43 WeakPolarHBondContact O-CB 3.39Å; E39-T43 PolarHBondContact O-N 2.88Å; E39-T43 PolarHBondContact O-OG1 3.04Å; E39-R224 VanDerWaalsContact CD-NH1 3.34Å; E39-R224 IonicContact OE1-CZ 3.58Å; E39-R224 VanDerWaalsContact OE1-CZ 3.31Å; E39-R224 IonicContact OE1-NH1 3.37Å; E39-R224 PolarHBondContact OE1-NH1 3.04Å; E39-R224 IonicContact OE1-NH2 2.99Å; E39-R224 IonicContact OE2-CZ 2.84Å; E39-R224 IonicContact OE2-NH1 3.54Å; E39-R224 PolarHBondContact OE2-NH1 3.32Å; E39-R224 IonicContact OE2-NH2 3.31Å; E39-R224 PolarHBondContact OE2-NH2 3.39Å
40	N	80.9	Confident	82.8	Confident	99 Å²	99	73.1 Å²	73.1	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-42.2	178	-68.5	-21.2	0	0	0	111	S36 N37 T43 L44	S36-N40 PolarHBondContact O-N 3.34Å; S36-N40 PolarHBondContact O-ND2 3.49Å; N37-N40 PolarHBondContact O-N 3.4Å; N40-T43 PolarHBondContact O-N 3.3Å; N40-L44 VanDerWaalsContact O-CB 3.24Å; N40-L44 WeakPolarHBondContact O-CB 3.42Å; N40-L44 PolarHBondContact O-N 3.1Å
41	F	85.7	Confident	83.3	Confident	129 Å²	129	73.6 Å²	73.6	57%	0.566	37%	0.365	S	S	*	.	H	α-helix	trans	-65.3	-42.2	177	-171.9	-106.8	0	0	0	112.1	N37 E39 N45	N37-F41 WeakPolarHBondContact O-CB 3.29Å; N37-F41 PolarHBondContact O-N 3.38Å; E39-F41 VanDerWaalsContact C-N 3.32Å; E39-F41 PolarHBondContact O-N 3.44Å; F41-N45 VanDerWaalsContact CD1-ND2 3.25Å; F41-N45 WeakPolarHBondContact CD1-ND2 3.04Å; F41-N45 WeakPolarHBondContact CE1-ND2 3.28Å; F41-N45 VanDerWaalsContact CZ-ND2 3.26Å; F41-N45 WeakPolarHBondContact CZ-ND2 3.27Å; F41-N45 WeakPolarHBondContact O-CB 3.38Å; F41-N45 PolarHBondContact O-N 2.99Å; F41-N45 PolarHBondContact O-ND2 3.12Å
42	F	87.2	Confident	83.9	Confident	14 Å²	14	74.6 Å²	74.6	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-53.5	174.2	172.6	-98.4	0	0	0	111.4	N38 E39 L44 N45 V46 S226 Q227 L230 A233	N38-F42 WeakPolarHBondContact O-CB 3.37Å; N38-F42 PolarHBondContact O-N 3.27Å; E39-F42 PolarHBondContact O-N 3.31Å; F42-L44 VanDerWaalsContact C-N 3.33Å; F42-L44 PolarHBondContact O-N 3.32Å; F42-N45 PolarHBondContact O-N 3.04Å; F42-V46 HydrophobicContact CD1-CG2 4.36Å; F42-V46 HydrophobicContact CD2-CG2 4.34Å; F42-V46 HydrophobicContact CE1-CG2 3.96Å; F42-V46 HydrophobicContact CE2-CG2 3.96Å; F42-V46 HydrophobicContact CZ-CG2 3.75Å; F42-V46 WeakPolarHBondContact O-CG2 3.49Å; F42-V46 PolarHBondContact O-N 3.2Å; F42-S226 WeakPolarHBondContact CE2-O 3.26Å; F42-Q227 HydrophobicContact CD2-CB 4.35Å; F42-Q227 HydrophobicContact CD2-CG 4.18Å; F42-L230 HydrophobicContact CD2-CB 4.16Å; F42-L230 HydrophobicContact CD2-CD1 4.17Å; F42-L230 HydrophobicContact CD2-CG 4.32Å; F42-L230 HydrophobicContact CE2-CB 3.78Å; F42-L230 HydrophobicContact CE2-CG 4.27Å; F42-A233 HydrophobicContact CZ-CB 4.23Å
43	T	85.3	Confident	84.8	Confident	15 Å²	15	67.8 Å²	67.8	9%	0.092	34%	0.338	C	S	.	.	H	α-helix	trans	-59.4	-44.9	-178.4	-54.2	0	0	0	0	111.1	E39 N40 N45 V46 L47 V217 F218	E39-T43 WeakPolarHBondContact O-CB 3.39Å; E39-T43 PolarHBondContact O-N 2.88Å; E39-T43 PolarHBondContact O-OG1 3.04Å; N40-T43 PolarHBondContact O-N 3.3Å; T43-N45 PolarHBondContact O-N 3.37Å; T43-V46 PolarHBondContact O-N 2.76Å; T43-L47 HydrophobicContact CG2-CD1 4.11Å; T43-L47 WeakPolarHBondContact O-CB 3.12Å; T43-L47 WeakPolarHBondContact O-CG 3.21Å; T43-L47 PolarHBondContact O-N 2.69Å; T43-V217 HydrophobicContact CG2-CG1 4.33Å; T43-F218 HydrophobicContact CG2-CD1 3.96Å; T43-F218 HydrophobicContact CG2-CD2 4.07Å; T43-F218 HydrophobicContact CG2-CE1 4Å; T43-F218 HydrophobicContact CG2-CE2 4.11Å; T43-F218 HydrophobicContact CG2-CG 4Å; T43-F218 HydrophobicContact CG2-CZ 4.08Å
44	L	88.5	Confident	85.9	Confident	111 Å²	111	61.4 Å²	61.4	58%	0.581	32%	0.315	S	S	*	.	H	α-helix	trans	-61.8	-42.5	178.5	-173.6	69.8	0	0	0	111.8	N40 F42 L47 A48	N40-L44 VanDerWaalsContact O-CB 3.24Å; N40-L44 WeakPolarHBondContact O-CB 3.42Å; N40-L44 PolarHBondContact O-N 3.1Å; F42-L44 VanDerWaalsContact C-N 3.33Å; F42-L44 PolarHBondContact O-N 3.32Å; L44-L47 PolarHBondContact O-N 2.59Å; L44-A48 VanDerWaalsContact O-CB 3.27Å; L44-A48 WeakPolarHBondContact O-CB 3.33Å; L44-A48 PolarHBondContact O-N 3.23Å
45	N	90.4	Very high	86.9	Confident	43 Å²	43	59.9 Å²	59.9	23%	0.23	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-40.6	179	-70.3	-22.6	0	0	0	112.4	F41 F42 T43 L47 A48 I49 L230	F41-N45 VanDerWaalsContact CD1-ND2 3.25Å; F41-N45 WeakPolarHBondContact CD1-ND2 3.04Å; F41-N45 WeakPolarHBondContact CE1-ND2 3.28Å; F41-N45 VanDerWaalsContact CZ-ND2 3.26Å; F41-N45 WeakPolarHBondContact CZ-ND2 3.27Å; F41-N45 WeakPolarHBondContact O-CB 3.38Å; F41-N45 PolarHBondContact O-N 2.99Å; F41-N45 PolarHBondContact O-ND2 3.12Å; F42-N45 PolarHBondContact O-N 3.04Å; T43-N45 PolarHBondContact O-N 3.37Å; N45-L47 VanDerWaalsContact C-N 3.33Å; N45-A48 PolarHBondContact O-N 3.26Å; N45-I49 WeakPolarHBondContact O-CG1 3.36Å; N45-I49 PolarHBondContact O-N 3.48Å; N45-L230 HydrophobicContact CB-CD1 3.74Å; N45-L230 HydrophobicContact CB-CD2 4.45Å; N45-L230 HydrophobicContact CB-CG 4.37Å
46	V	90.7	Very high	88	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.4	-47.3	174.9	171.6	0	0	0	0	110.2	F42 T43 T50 V217 L230 A233 A234 L237	F42-V46 HydrophobicContact CD1-CG2 4.36Å; F42-V46 HydrophobicContact CD2-CG2 4.34Å; F42-V46 HydrophobicContact CE1-CG2 3.96Å; F42-V46 HydrophobicContact CE2-CG2 3.96Å; F42-V46 HydrophobicContact CZ-CG2 3.75Å; F42-V46 WeakPolarHBondContact O-CG2 3.49Å; F42-V46 PolarHBondContact O-N 3.2Å; T43-V46 PolarHBondContact O-N 2.76Å; V46-T50 WeakPolarHBondContact O-CB 3.45Å; V46-T50 PolarHBondContact O-N 3.07Å; V46-T50 PolarHBondContact O-OG1 3.46Å; V46-V217 HydrophobicContact CB-CG1 4.11Å; V46-V217 HydrophobicContact CG1-CG1 3.7Å; V46-V217 HydrophobicContact CG1-CG2 4.2Å; V46-L230 HydrophobicContact CG2-CG 4.03Å; V46-A233 HydrophobicContact CG1-CB 4.09Å; V46-A233 HydrophobicContact CG2-CB 4.03Å; V46-A234 HydrophobicContact CG1-CB 4.23Å; V46-L237 HydrophobicContact CG1-CD2 4.21Å
47	L	90.8	Very high	89	Confident	27 Å²	27	55 Å²	55	14%	0.141	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-42.9	176.3	-71.2	171.2	0	0	0	111.9	T43 L44 N45 I49 T50 I51 I150 F218 L237	T43-L47 HydrophobicContact CG2-CD1 4.11Å; T43-L47 WeakPolarHBondContact O-CB 3.12Å; T43-L47 WeakPolarHBondContact O-CG 3.21Å; T43-L47 PolarHBondContact O-N 2.69Å; L44-L47 PolarHBondContact O-N 2.59Å; N45-L47 VanDerWaalsContact C-N 3.33Å; L47-I49 PolarHBondContact O-N 3.05Å; L47-T50 PolarHBondContact O-N 3.39Å; L47-I51 WeakPolarHBondContact O-CB 3.37Å; L47-I51 WeakPolarHBondContact O-CD1 2.94Å; L47-I51 WeakPolarHBondContact O-CG1 3.5Å; L47-I51 PolarHBondContact O-N 2.87Å; L47-I150 HydrophobicContact CD2-CD1 4.14Å; L47-F218 HydrophobicContact CD1-CE2 4.08Å; L47-F218 HydrophobicContact CD1-CZ 3.71Å; L47-F218 HydrophobicContact CD2-CE2 4.26Å; L47-L237 HydrophobicContact CD2-CD2 3.85Å
48	A	91.3	Very high	89.7	Confident	53 Å²	53	54.2 Å²	54.2	44%	0.438	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-44.6	179.7	0	0	0	0	0	111.9	L44 N45 I51 L52	L44-A48 VanDerWaalsContact O-CB 3.27Å; L44-A48 WeakPolarHBondContact O-CB 3.33Å; L44-A48 PolarHBondContact O-N 3.23Å; N45-A48 PolarHBondContact O-N 3.26Å; A48-I51 PolarHBondContact O-N 3.16Å; A48-L52 WeakPolarHBondContact O-CB 3.42Å; A48-L52 PolarHBondContact O-N 3.45Å
49	I	92.1	Very high	90.5	Very high	41 Å²	41	52.2 Å²	52.2	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-45	175.8	-65.5	169.4	0	0	0	110.4	N45 L47 I51 L52 Q53 L112 L230 A234	N45-I49 WeakPolarHBondContact O-CG1 3.36Å; N45-I49 PolarHBondContact O-N 3.48Å; L47-I49 PolarHBondContact O-N 3.05Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 2.87Å; I49-L52 WeakPolarHBondContact O-CB 3.25Å; I49-L52 PolarHBondContact O-N 3.35Å; I49-L52 VanDerWaalsContact O-N 3.16Å; I49-Q53 WeakPolarHBondContact O-CG 3.48Å; I49-Q53 PolarHBondContact O-N 3.18Å; I49-L112 HydrophobicContact CG2-CD1 3.54Å; I49-L112 HydrophobicContact CG2-CD2 4.27Å; I49-L230 HydrophobicContact CD1-CD2 3.36Å; I49-A234 HydrophobicContact CB-CB 3.8Å; I49-A234 HydrophobicContact CD1-CB 4.47Å; I49-A234 HydrophobicContact CG2-CB 3.62Å
50	T	92.7	Very high	91.3	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-44.8	178.9	-56.1	0	0	0	0	111.4	V46 L47 L52 Q53 F54 A234 L237	V46-T50 WeakPolarHBondContact O-CB 3.45Å; V46-T50 PolarHBondContact O-N 3.07Å; V46-T50 PolarHBondContact O-OG1 3.46Å; L47-T50 PolarHBondContact O-N 3.39Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.81Å; T50-Q53 PolarHBondContact O-N 2.85Å; T50-F54 WeakPolarHBondContact O-CB 3.4Å; T50-F54 PolarHBondContact O-N 3.32Å; T50-A234 PolarHBondContact OG1-O 3.39Å; T50-L237 HydrophobicContact CG2-CB 4.25Å; T50-L237 HydrophobicContact CG2-CD2 4.17Å; T50-L237 HydrophobicContact CG2-CG 4.01Å
51	I	92.6	Very high	91.9	Very high	95 Å²	95	46.6 Å²	46.6	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-63.5	-40.1	176.6	-69.9	164.9	0	0	0	110.4	L47 A48 I49 F54 V55	L47-I51 WeakPolarHBondContact O-CB 3.37Å; L47-I51 WeakPolarHBondContact O-CD1 2.94Å; L47-I51 WeakPolarHBondContact O-CG1 3.5Å; L47-I51 PolarHBondContact O-N 2.87Å; A48-I51 PolarHBondContact O-N 3.16Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 2.87Å; I51-F54 WeakPolarHBondContact O-CB 3.41Å; I51-F54 PolarHBondContact O-N 2.6Å; I51-V55 HydrophobicContact CG2-CG2 4.34Å; I51-V55 VanDerWaalsContact O-CG2 3.31Å; I51-V55 WeakPolarHBondContact O-CG2 3.42Å; I51-V55 PolarHBondContact O-N 3.22Å
52	L	94.2	Very high	92.1	Very high	107 Å²	107	41 Å²	41	56%	0.56	23%	0.232	S	C	*	.	H	α-helix	trans	-61.7	-46.2	175.8	-179.6	63	0	0	0	111.5	A48 I49 T50 F54 V55 I56	A48-L52 WeakPolarHBondContact O-CB 3.42Å; A48-L52 PolarHBondContact O-N 3.45Å; I49-L52 WeakPolarHBondContact O-CB 3.25Å; I49-L52 PolarHBondContact O-N 3.35Å; I49-L52 VanDerWaalsContact O-N 3.16Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.81Å; L52-F54 VanDerWaalsContact C-N 3.31Å; L52-F54 PolarHBondContact O-N 3.37Å; L52-V55 PolarHBondContact O-N 2.93Å; L52-I56 HydrophobicContact CD1-CD1 4.34Å; L52-I56 HydrophobicContact CG-CD1 4.17Å; L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.24Å; L52-I56 PolarHBondContact O-N 3Å
53	Q	94.6	Very high	92.4	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.014	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-42.3	175.1	-64.5	-177.9	-80.1	0	0	111.3	I49 T50 I56 T57 L112 T116 Y238	I49-Q53 WeakPolarHBondContact O-CG 3.48Å; I49-Q53 PolarHBondContact O-N 3.18Å; T50-Q53 PolarHBondContact O-N 2.85Å; Q53-I56 PolarHBondContact O-N 3.03Å; Q53-T57 PolarHBondContact O-N 3.28Å; Q53-T57 PolarHBondContact O-OG1 3.36Å; Q53-T57 VanDerWaalsContact O-OG1 3.07Å; Q53-L112 HydrophobicContact CG-CD2 3.76Å; Q53-L112 HydrophobicContact CG-CG 4.45Å; Q53-T116 HydrophobicContact CB-CG2 4.37Å; Q53-T116 VanDerWaalsContact CG-OG1 3.3Å; Q53-T116 WeakPolarHBondContact CG-OG1 3.27Å; Q53-T116 PolarHBondContact NE2-OG1 3.1Å; Q53-Y238 HydrophobicContact CB-CD2 3.39Å; Q53-Y238 HydrophobicContact CB-CE2 3.66Å; Q53-Y238 HydrophobicContact CB-CG 3.97Å; Q53-Y238 HydrophobicContact CG-CD2 4.43Å
54	F	92.8	Very high	92.7	Very high	40 Å²	40	46 Å²	46	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-48.7	175	169.8	-96.4	0	0	0	112.2	T50 I51 L52 I56 T57 F58 F139 V143 W241	T50-F54 WeakPolarHBondContact O-CB 3.4Å; T50-F54 PolarHBondContact O-N 3.32Å; I51-F54 WeakPolarHBondContact O-CB 3.41Å; I51-F54 PolarHBondContact O-N 2.6Å; L52-F54 VanDerWaalsContact C-N 3.31Å; L52-F54 PolarHBondContact O-N 3.37Å; F54-I56 VanDerWaalsContact C-N 3.32Å; F54-I56 PolarHBondContact O-N 3.38Å; F54-T57 PolarHBondContact O-N 3.42Å; F54-F58 HydrophobicContact CZ-CB 4.4Å; F54-F58 WeakPolarHBondContact O-CB 3.2Å; F54-F58 PolarHBondContact O-N 2.88Å; F54-F139 HydrophobicContact CE2-CD1 4.12Å; F54-F139 HydrophobicContact CE2-CE1 4.5Å; F54-F139 HydrophobicContact CZ-CD1 4.41Å; F54-V143 HydrophobicContact CE1-CG2 3.91Å; F54-V143 HydrophobicContact CE2-CG2 3.54Å; F54-V143 HydrophobicContact CZ-CG2 3.14Å; F54-W241 AromaticContact CD2-CD2 3.64Å; F54-W241 HydrophobicContact CD2-CD2 3.64Å; F54-W241 AromaticContact CD2-CE2 3.23Å; F54-W241 AromaticContact CD2-CE3 3.97Å; F54-W241 HydrophobicContact CD2-CE3 3.97Å; F54-W241 HydrophobicContact CD2-CG 4.4Å; F54-W241 AromaticContact CD2-CH2 3.64Å; F54-W241 HydrophobicContact CD2-CH2 3.64Å; F54-W241 AromaticContact CD2-CZ2 3.29Å; F54-W241 HydrophobicContact CD2-CZ2 3.29Å; F54-W241 AromaticContact CD2-CZ3 3.95Å; F54-W241 HydrophobicContact CD2-CZ3 3.95Å; F54-W241 AromaticContact CD2-NE1 3.69Å; F54-W241 HydrophobicContact CE2-CD2 4.2Å; F54-W241 AromaticContact CE2-CE2 3.33Å; F54-W241 AromaticContact CE2-CH2 3.91Å; F54-W241 HydrophobicContact CE2-CH2 3.91Å; F54-W241 AromaticContact CE2-CZ2 3.2Å; F54-W241 HydrophobicContact CE2-CZ2 3.2Å; F54-W241 AromaticContact CE2-NE1 3.52Å; F54-W241 HydrophobicContact CZ-CZ2 4.5Å
55	V	94	Very high	92.8	Very high	82 Å²	82	40.8 Å²	40.8	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-42.1	179.7	169.2	0	0	0	0	111	I51 L52 F58 G59	I51-V55 HydrophobicContact CG2-CG2 4.34Å; I51-V55 VanDerWaalsContact O-CG2 3.31Å; I51-V55 WeakPolarHBondContact O-CG2 3.42Å; I51-V55 PolarHBondContact O-N 3.22Å; L52-V55 PolarHBondContact O-N 2.93Å; V55-F58 PolarHBondContact O-N 3.46Å; V55-G59 PolarHBondContact O-N 3.3Å
56	I	95.4	Very high	92.7	Very high	87 Å²	87	43.9 Å²	43.9	45%	0.446	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-45.7	176.2	-67.2	165.9	0	0	0	110.4	L52 Q53 F54 G59 G60 T116	L52-I56 HydrophobicContact CD1-CD1 4.34Å; L52-I56 HydrophobicContact CG-CD1 4.17Å; L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.24Å; L52-I56 PolarHBondContact O-N 3Å; Q53-I56 PolarHBondContact O-N 3.03Å; F54-I56 VanDerWaalsContact C-N 3.32Å; F54-I56 PolarHBondContact O-N 3.38Å; I56-G59 PolarHBondContact O-N 3.14Å; I56-G60 PolarHBondContact O-N 2.81Å; I56-T116 HydrophobicContact CB-CG2 3.97Å; I56-T116 HydrophobicContact CD1-CG2 4.4Å; I56-T116 HydrophobicContact CG2-CG2 3.65Å
57	T	94.8	Very high	92.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-43.7	179.3	-61.3	0	0	0	0	112.5	Q53 F54 T61 T120 I123 Y238 W241	Q53-T57 PolarHBondContact O-N 3.28Å; Q53-T57 PolarHBondContact O-OG1 3.36Å; Q53-T57 VanDerWaalsContact O-OG1 3.07Å; F54-T57 PolarHBondContact O-N 3.42Å; T57-T61 WeakPolarHBondContact O-CB 3.48Å; T57-T61 PolarHBondContact O-N 2.96Å; T57-T61 PolarHBondContact O-OG1 3.06Å; T57-T120 WeakPolarHBondContact CA-OG1 3.35Å; T57-T120 PolarHBondContact OG1-OG1 3.5Å; T57-I123 HydrophobicContact CG2-CD1 3.78Å; T57-Y238 PolarHBondContact OG1-OH 3.03Å; T57-W241 HydrophobicContact CG2-CH2 3.94Å; T57-W241 HydrophobicContact CG2-CZ3 4.03Å
58	F	93.8	Very high	92.5	Very high	77 Å²	77	50.4 Å²	50.4	34%	0.338	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-47.9	175.8	174.5	-101.8	0	0	0	111.5	F54 V55 N62 F139	F54-F58 HydrophobicContact CZ-CB 4.4Å; F54-F58 WeakPolarHBondContact O-CB 3.2Å; F54-F58 PolarHBondContact O-N 2.88Å; V55-F58 PolarHBondContact O-N 3.46Å; F58-N62 VanDerWaalsContact CD2-ND2 3.34Å; F58-N62 WeakPolarHBondContact CD2-ND2 3.5Å; F58-N62 WeakPolarHBondContact CE2-ND2 3.31Å; F58-N62 WeakPolarHBondContact CZ-ND2 3.43Å; F58-N62 WeakPolarHBondContact O-CB 3.13Å; F58-N62 PolarHBondContact O-N 3.12Å; F58-N62 PolarHBondContact O-ND2 3.07Å; F58-F139 HydrophobicContact CB-CD1 4.47Å; F58-F139 HydrophobicContact CB-CE1 4.17Å; F58-F139 HydrophobicContact CD2-CB 4.01Å; F58-F139 AromaticContact CD2-CD1 3.65Å; F58-F139 HydrophobicContact CD2-CD1 3.65Å; F58-F139 AromaticContact CD2-CD2 3.86Å; F58-F139 HydrophobicContact CD2-CD2 3.86Å; F58-F139 AromaticContact CD2-CE1 3.98Å; F58-F139 HydrophobicContact CD2-CE1 3.98Å; F58-F139 HydrophobicContact CD2-CE2 4.21Å; F58-F139 AromaticContact CD2-CG 3.58Å; F58-F139 HydrophobicContact CD2-CG 3.58Å; F58-F139 HydrophobicContact CD2-CZ 4.27Å; F58-F139 HydrophobicContact CE2-CB 3.99Å; F58-F139 HydrophobicContact CE2-CD1 4.45Å; F58-F139 HydrophobicContact CE2-CD2 4.13Å; F58-F139 AromaticContact CE2-CG 3.97Å; F58-F139 HydrophobicContact CE2-CG 3.97Å
59	G	94.5	Very high	92.4	Very high	28 Å²	28	54.8 Å²	54.8	29%	0.289	30%	0.298	S	S	.	.	H	α-helix	trans	-63.5	-48	178.7	0	0	0	0	0	112.2	V55 I56 T61 N62 L63	V55-G59 PolarHBondContact O-N 3.3Å; I56-G59 PolarHBondContact O-N 3.14Å; G59-T61 PolarHBondContact O-N 3.16Å; G59-N62 PolarHBondContact O-N 2.99Å; G59-L63 WeakPolarHBondContact O-CB 3.38Å; G59-L63 VanDerWaalsContact O-CG 3.3Å; G59-L63 WeakPolarHBondContact O-CG 3.15Å; G59-L63 PolarHBondContact O-N 2.92Å
60	G	93.9	Very high	92.2	Very high	22 Å²	22	56.3 Å²	56.3	23%	0.227	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-42.5	178.3	0	0	0	0	0	112.8	I56 L63 V64	I56-G60 PolarHBondContact O-N 2.81Å; G60-L63 PolarHBondContact O-N 3.26Å; G60-V64 WeakPolarHBondContact O-CG2 3.41Å; G60-V64 PolarHBondContact O-N 3.32Å; G60-V64 VanDerWaalsContact O-N 3.11Å
61	T	93.9	Very high	92	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-46.1	176.7	-57.9	0	0	0	0	111.4	T57 G59 L63 V64 V65 I123 A127 V135 F139	T57-T61 WeakPolarHBondContact O-CB 3.48Å; T57-T61 PolarHBondContact O-N 2.96Å; T57-T61 PolarHBondContact O-OG1 3.06Å; G59-T61 PolarHBondContact O-N 3.16Å; T61-L63 PolarHBondContact O-N 3.01Å; T61-V64 PolarHBondContact O-N 2.89Å; T61-V65 HydrophobicContact CG2-CG2 4.24Å; T61-V65 WeakPolarHBondContact O-CB 3.36Å; T61-V65 VanDerWaalsContact O-CG2 3.3Å; T61-V65 WeakPolarHBondContact O-CG2 3.28Å; T61-V65 PolarHBondContact O-N 3.28Å; T61-I123 HydrophobicContact CG2-CG2 3.87Å; T61-I123 WeakPolarHBondContact OG1-CG2 3.46Å; T61-A127 HydrophobicContact CG2-CB 3.74Å; T61-V135 HydrophobicContact CG2-CG1 4.2Å; T61-F139 HydrophobicContact CG2-CE2 3.69Å; T61-F139 HydrophobicContact CG2-CZ 3.94Å
62	N	91.5	Very high	91.7	Very high	13 Å²	13	58 Å²	58	7%	0.07	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-42.7	177.6	-90.8	-70.7	0	0	0	112.6	F58 G59 V64 V65 Q66 N136	F58-N62 VanDerWaalsContact CD2-ND2 3.34Å; F58-N62 WeakPolarHBondContact CD2-ND2 3.5Å; F58-N62 WeakPolarHBondContact CE2-ND2 3.31Å; F58-N62 WeakPolarHBondContact CZ-ND2 3.43Å; F58-N62 WeakPolarHBondContact O-CB 3.13Å; F58-N62 PolarHBondContact O-N 3.12Å; F58-N62 PolarHBondContact O-ND2 3.07Å; G59-N62 PolarHBondContact O-N 2.99Å; N62-V64 VanDerWaalsContact C-N 3.32Å; N62-V64 PolarHBondContact O-N 3.27Å; N62-V65 PolarHBondContact O-N 3.31Å; N62-Q66 VanDerWaalsContact O-CB 3.25Å; N62-Q66 WeakPolarHBondContact O-CB 3.44Å; N62-Q66 WeakPolarHBondContact O-CG 3Å; N62-Q66 PolarHBondContact O-N 3.5Å; N62-Q66 PolarHBondContact OD1-NE2 3.2Å; N62-N136 PolarHBondContact OD1-OD1 2.77Å
63	L	92.3	Very high	91.4	Very high	113 Å²	113	59.5 Å²	59.5	59%	0.592	31%	0.308	S	S	*	.	H	α-helix	trans	-58.8	-45.2	176.3	-75.5	171	0	0	0	111.6	G59 G60 T61 V67	G59-L63 WeakPolarHBondContact O-CB 3.38Å; G59-L63 VanDerWaalsContact O-CG 3.3Å; G59-L63 WeakPolarHBondContact O-CG 3.15Å; G59-L63 PolarHBondContact O-N 2.92Å; G60-L63 PolarHBondContact O-N 3.26Å; T61-L63 PolarHBondContact O-N 3.01Å; L63-V67 VanDerWaalsContact O-CB 3.3Å; L63-V67 WeakPolarHBondContact O-CB 3.38Å; L63-V67 WeakPolarHBondContact O-CG2 3.5Å; L63-V67 PolarHBondContact O-N 2.9Å
64	V	91.3	Very high	91.1	Very high	21 Å²	21	59.9 Å²	59.9	13%	0.127	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-41.7	179	167.3	0	0	0	0	112.1	G60 T61 N62 I70 S71 I74 A124 T128	G60-V64 WeakPolarHBondContact O-CG2 3.41Å; G60-V64 PolarHBondContact O-N 3.32Å; G60-V64 VanDerWaalsContact O-N 3.11Å; T61-V64 PolarHBondContact O-N 2.89Å; N62-V64 VanDerWaalsContact C-N 3.32Å; N62-V64 PolarHBondContact O-N 3.27Å; V64-I70 HydrophobicContact CB-CG2 4.45Å; V64-I70 HydrophobicContact CG1-CG2 4.14Å; V64-I70 HydrophobicContact CG2-CG2 4.17Å; V64-S71 WeakPolarHBondContact O-CB 3.24Å; V64-I74 HydrophobicContact CG1-CD1 3.4Å; V64-I74 HydrophobicContact CG2-CD1 4.49Å; V64-A124 HydrophobicContact CB-CB 3.91Å; V64-A124 HydrophobicContact CG1-CB 3.93Å; V64-A124 HydrophobicContact CG2-CB 3.97Å; V64-T128 HydrophobicContact CG1-CG2 3.76Å
65	V	90.5	Very high	90.7	Very high	1 Å²	1	60 Å²	60	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-72.4	-40.7	-177.5	168.7	0	0	0	0	111.7	T61 N62 A127 E132	T61-V65 HydrophobicContact CG2-CG2 4.24Å; T61-V65 WeakPolarHBondContact O-CB 3.36Å; T61-V65 VanDerWaalsContact O-CG2 3.3Å; T61-V65 WeakPolarHBondContact O-CG2 3.28Å; T61-V65 PolarHBondContact O-N 3.28Å; N62-V65 PolarHBondContact O-N 3.31Å; V65-A127 HydrophobicContact CG2-CB 3.78Å; V65-E132 HydrophobicContact CG1-CB 3.86Å; V65-E132 HydrophobicContact CG1-CG 3.6Å
66	Q	88.9	Confident	90.3	Very high	107 Å²	107	61.8 Å²	61.8	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-76.5	-33	-179.1	-69	175.7	10.4	0	0	112.8	N62 T68	N62-Q66 VanDerWaalsContact O-CB 3.25Å; N62-Q66 WeakPolarHBondContact O-CB 3.44Å; N62-Q66 WeakPolarHBondContact O-CG 3Å; N62-Q66 PolarHBondContact O-N 3.5Å; N62-Q66 PolarHBondContact OD1-NE2 3.2Å; Q66-T68 PolarHBondContact O-N 3.39Å
67	V	91	Very high	90	Very high	62 Å²	62	61.6 Å²	61.6	38%	0.376	31%	0.314	S	S	.	.			trans	-81.1	92.9	176.4	-178.4	0	0	0	0	108.9	L63 Q69 I70 S71	L63-V67 VanDerWaalsContact O-CB 3.3Å; L63-V67 WeakPolarHBondContact O-CB 3.38Å; L63-V67 WeakPolarHBondContact O-CG2 3.5Å; L63-V67 PolarHBondContact O-N 2.9Å; V67-Q69 HydrophobicContact CG1-CB 4.45Å; V67-Q69 PolarHBondContact O-N 3.06Å; V67-Q69 VanDerWaalsContact O-N 3.07Å; V67-I70 HydrophobicContact CB-CB 4.32Å; V67-I70 HydrophobicContact CB-CD1 3.95Å; V67-I70 HydrophobicContact CB-CG1 4.19Å; V67-I70 HydrophobicContact CG1-CB 4.19Å; V67-I70 HydrophobicContact CG1-CD1 3.72Å; V67-I70 HydrophobicContact CG1-CG1 3.68Å; V67-I70 HydrophobicContact CG2-CD1 4.47Å; V67-I70 PolarHBondContact O-N 3.23Å; V67-S71 PolarHBondContact O-N 3.42Å
68	T	86	Confident	89.4	Confident	103 Å²	103	63.9 Å²	63.9	63%	0.632	33%	0.326	S	S	*	.	H	α-helix	trans	-50.4	-36.2	-176.7	55.9	0	0	0	0	113.9	Q66 S71 K72	Q66-T68 PolarHBondContact O-N 3.39Å; T68-S71 PolarHBondContact O-N 3.06Å; T68-K72 VanDerWaalsContact O-CB 3.3Å; T68-K72 WeakPolarHBondContact O-CB 3.02Å; T68-K72 PolarHBondContact O-N 3.26Å
69	Q	89.2	Confident	89.1	Confident	145 Å²	145	64.6 Å²	64.6	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-43.4	177.3	-173	66.6	6.3	0	0	112.6	V67 W73	V67-Q69 HydrophobicContact CG1-CB 4.45Å; V67-Q69 PolarHBondContact O-N 3.06Å; V67-Q69 VanDerWaalsContact O-N 3.07Å; Q69-W73 WeakPolarHBondContact O-CB 3.37Å; Q69-W73 PolarHBondContact O-N 2.99Å; Q69-W73 VanDerWaalsContact O-N 3.11Å
70	I	88.7	Confident	88.8	Confident	73 Å²	73	65.1 Å²	65.1	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-71.5	-43.6	178.1	-61	173.7	0	0	0	109.1	V64 V67 K72 W73 I74	V64-I70 HydrophobicContact CB-CG2 4.45Å; V64-I70 HydrophobicContact CG1-CG2 4.14Å; V64-I70 HydrophobicContact CG2-CG2 4.17Å; V67-I70 HydrophobicContact CB-CB 4.32Å; V67-I70 HydrophobicContact CB-CD1 3.95Å; V67-I70 HydrophobicContact CB-CG1 4.19Å; V67-I70 HydrophobicContact CG1-CB 4.19Å; V67-I70 HydrophobicContact CG1-CD1 3.72Å; V67-I70 HydrophobicContact CG1-CG1 3.68Å; V67-I70 HydrophobicContact CG2-CD1 4.47Å; V67-I70 PolarHBondContact O-N 3.23Å; I70-K72 VanDerWaalsContact C-N 3.34Å; I70-K72 PolarHBondContact O-N 3.33Å; I70-W73 PolarHBondContact O-N 3.45Å; I70-I74 HydrophobicContact CG2-CD1 3.83Å; I70-I74 HydrophobicContact CG2-CG1 4.41Å; I70-I74 WeakPolarHBondContact O-CG1 3.23Å; I70-I74 PolarHBondContact O-N 3.37Å
71	S	87.8	Confident	88.5	Confident	10 Å²	10	64.4 Å²	64.4	7%	0.07	32%	0.324	C	S	.	.	H	α-helix	trans	-55.2	-49.4	176.5	-171.8	0	0	0	0	111.4	V64 V67 T68 I74 T75	V64-S71 WeakPolarHBondContact O-CB 3.24Å; V67-S71 PolarHBondContact O-N 3.42Å; T68-S71 PolarHBondContact O-N 3.06Å; S71-I74 PolarHBondContact O-N 2.94Å; S71-T75 WeakPolarHBondContact O-CG2 3.46Å; S71-T75 PolarHBondContact O-N 3.46Å; S71-T75 PolarHBondContact O-OG1 3.05Å
72	K	87.2	Confident	88.3	Confident	124 Å²	124	68 Å²	68	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-46.7	178.9	-170.3	178.2	-179	-174.5	0	111.9	T68 I70 I74 T75 E76	T68-K72 VanDerWaalsContact O-CB 3.3Å; T68-K72 WeakPolarHBondContact O-CB 3.02Å; T68-K72 PolarHBondContact O-N 3.26Å; I70-K72 VanDerWaalsContact C-N 3.34Å; I70-K72 PolarHBondContact O-N 3.33Å; K72-I74 VanDerWaalsContact C-N 3.29Å; K72-I74 PolarHBondContact O-N 3.17Å; K72-T75 WeakPolarHBondContact CA-OG1 3.33Å; K72-T75 PolarHBondContact O-N 3.42Å; K72-T75 VanDerWaalsContact O-N 3.15Å; K72-T75 PolarHBondContact O-OG1 2.97Å; K72-E76 WeakPolarHBondContact CE-OE1 3.1Å; K72-E76 WeakPolarHBondContact O-CG 3.35Å; K72-E76 PolarHBondContact O-N 3.27Å
73	W	88.2	Confident	88.2	Confident	138 Å²	138	71.5 Å²	71.5	52%	0.523	36%	0.359	S	S	.	.	H	α-helix	trans	-58.7	-40.7	178.3	-178.7	69.8	0	0	0	112.5	Q69 I70 E76 H77 I80	Q69-W73 WeakPolarHBondContact O-CB 3.37Å; Q69-W73 PolarHBondContact O-N 2.99Å; Q69-W73 VanDerWaalsContact O-N 3.11Å; I70-W73 PolarHBondContact O-N 3.45Å; W73-E76 PolarHBondContact O-N 2.96Å; W73-H77 AromaticContact CD1-CD2 3.6Å; W73-H77 AromaticContact CD1-NE2 3.85Å; W73-H77 AromaticContact CE2-CD2 3.67Å; W73-H77 AromaticContact NE1-CD2 3.24Å; W73-H77 PolarHBondContact NE1-CD2 2.96Å; W73-H77 AromaticContact NE1-NE2 3.4Å; W73-H77 PolarHBondContact NE1-NE2 3.38Å; W73-H77 PolarHBondContact O-CD2 3.01Å; W73-H77 VanDerWaalsContact O-CD2 3.31Å; W73-H77 PolarHBondContact O-N 3.12Å; W73-I80 HydrophobicContact CE3-CD1 3.93Å; W73-I80 HydrophobicContact CH2-CD1 3.46Å; W73-I80 VanDerWaalsContact CH2-CD1 3.46Å; W73-I80 HydrophobicContact CZ2-CD1 4.1Å; W73-I80 HydrophobicContact CZ3-CD1 3.36Å
74	I	87.8	Confident	88.2	Confident	11 Å²	11	66.3 Å²	66.3	6%	0.056	33%	0.332	C	S	.	.	H	α-helix	trans	-67.2	-41.3	176.4	-70.5	173	0	0	0	111.5	V64 I70 S71 K72 E76 H77 I80 T128	V64-I74 HydrophobicContact CG1-CD1 3.4Å; V64-I74 HydrophobicContact CG2-CD1 4.49Å; I70-I74 HydrophobicContact CG2-CD1 3.83Å; I70-I74 HydrophobicContact CG2-CG1 4.41Å; I70-I74 WeakPolarHBondContact O-CG1 3.23Å; I70-I74 PolarHBondContact O-N 3.37Å; S71-I74 PolarHBondContact O-N 2.94Å; K72-I74 VanDerWaalsContact C-N 3.29Å; K72-I74 PolarHBondContact O-N 3.17Å; I74-E76 VanDerWaalsContact C-N 3.28Å; I74-E76 PolarHBondContact O-N 3.06Å; I74-H77 CarbonylContact O-C 3.21Å; I74-H77 PolarHBondContact O-N 3.37Å; I74-H77 VanDerWaalsContact O-N 3.16Å; I74-I80 HydrophobicContact CG1-CD1 4.37Å; I74-T128 HydrophobicContact CB-CG2 4.24Å; I74-T128 HydrophobicContact CD1-CG2 4.42Å; I74-T128 HydrophobicContact CG2-CG2 4.03Å
75	T	84.4	Confident	88	Confident	42 Å²	42	66.3 Å²	66.3	26%	0.258	33%	0.334	S	S	.	.	H	α-helix	trans	-68.8	-24.7	177.5	56.8	0	0	0	0	113.8	S71 K72 T128 L129	S71-T75 WeakPolarHBondContact O-CG2 3.46Å; S71-T75 PolarHBondContact O-N 3.46Å; S71-T75 PolarHBondContact O-OG1 3.05Å; K72-T75 WeakPolarHBondContact CA-OG1 3.33Å; K72-T75 PolarHBondContact O-N 3.42Å; K72-T75 VanDerWaalsContact O-N 3.15Å; K72-T75 PolarHBondContact O-OG1 2.97Å; T75-T128 WeakPolarHBondContact CG2-OG1 3.3Å; T75-L129 HydrophobicContact CG2-CD2 4.35Å
76	E	86.4	Confident	87.9	Confident	120 Å²	120	70.1 Å²	70.1	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-76.8	-28.2	172.9	-73.1	174.7	-175.4	0	0	111.6	K72 W73 I74	K72-E76 WeakPolarHBondContact CE-OE1 3.1Å; K72-E76 WeakPolarHBondContact O-CG 3.35Å; K72-E76 PolarHBondContact O-N 3.27Å; W73-E76 PolarHBondContact O-N 2.96Å; I74-E76 VanDerWaalsContact C-N 3.28Å; I74-E76 PolarHBondContact O-N 3.06Å
77	H	88.1	Confident	88.1	Confident	83 Å²	83	67.7 Å²	67.7	38%	0.384	35%	0.346	S	S	.	.			trans	-112.2	71.9	179.8	-64.5	-61.4	0	0	0	111.8	W73 I74 T79 I80	W73-H77 AromaticContact CD1-CD2 3.6Å; W73-H77 AromaticContact CD1-NE2 3.85Å; W73-H77 AromaticContact CE2-CD2 3.67Å; W73-H77 AromaticContact NE1-CD2 3.24Å; W73-H77 PolarHBondContact NE1-CD2 2.96Å; W73-H77 AromaticContact NE1-NE2 3.4Å; W73-H77 PolarHBondContact NE1-NE2 3.38Å; W73-H77 PolarHBondContact O-CD2 3.01Å; W73-H77 VanDerWaalsContact O-CD2 3.31Å; W73-H77 PolarHBondContact O-N 3.12Å; I74-H77 CarbonylContact O-C 3.21Å; I74-H77 PolarHBondContact O-N 3.37Å; I74-H77 VanDerWaalsContact O-N 3.16Å; H77-T79 PolarHBondContact O-N 3.19Å; H77-I80 HydrophobicContact CB-CD1 3.88Å; H77-I80 HydrophobicContact CB-CG1 4.12Å; H77-I80 PolarHBondContact O-N 3.45Å
78	D	82.6	Confident	88	Confident	48 Å²	48	64.8 Å²	64.8	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-51.5	-19.8	174.6	-75.6	-24.6	0	0	0	112.7	I80 L81 W82 F186 K190	D78-I80 VanDerWaalsContact C-N 3.3Å; D78-I80 PolarHBondContact O-N 3.39Å; D78-L81 PolarHBondContact O-N 2.91Å; D78-W82 VanDerWaalsContact O-CD1 3.29Å; D78-W82 PolarHBondContact O-N 2.98Å; D78-F186 HydrophobicContact CB-CE1 4Å; D78-F186 HydrophobicContact CB-CZ 4.46Å; D78-K190 IonicContact OD1-NZ 3.8Å; D78-K190 IonicContact OD2-NZ 3.02Å; D78-K190 PolarHBondContact OD2-NZ 3.18Å
79	T	87.2	Confident	88.1	Confident	93 Å²	93	61.6 Å²	61.6	57%	0.571	31%	0.307	S	S	*	.	H	α-helix	trans	-62.1	-30.8	174.7	55.6	0	0	0	0	113.9	H77 L81 W82 V83	H77-T79 PolarHBondContact O-N 3.19Å; T79-L81 VanDerWaalsContact C-N 3.35Å; T79-W82 PolarHBondContact O-N 3.02Å; T79-V83 WeakPolarHBondContact O-CB 3.22Å; T79-V83 VanDerWaalsContact O-CG2 3.29Å; T79-V83 WeakPolarHBondContact O-CG2 3.26Å; T79-V83 PolarHBondContact O-N 3.47Å
80	I	88.4	Confident	88.1	Confident	38 Å²	38	58.4 Å²	58.4	20%	0.195	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-43.3	-179.4	-63.4	172.9	0	0	0	110.2	W73 I74 H77 D78 S84	W73-I80 HydrophobicContact CE3-CD1 3.93Å; W73-I80 HydrophobicContact CH2-CD1 3.46Å; W73-I80 VanDerWaalsContact CH2-CD1 3.46Å; W73-I80 HydrophobicContact CZ2-CD1 4.1Å; W73-I80 HydrophobicContact CZ3-CD1 3.36Å; I74-I80 HydrophobicContact CG1-CD1 4.37Å; H77-I80 HydrophobicContact CB-CD1 3.88Å; H77-I80 HydrophobicContact CB-CG1 4.12Å; H77-I80 PolarHBondContact O-N 3.45Å; D78-I80 VanDerWaalsContact C-N 3.3Å; D78-I80 PolarHBondContact O-N 3.39Å; I80-S84 VanDerWaalsContact O-CB 3.28Å; I80-S84 WeakPolarHBondContact O-CB 3.34Å; I80-S84 PolarHBondContact O-N 3.37Å; I80-S84 PolarHBondContact O-OG 2.83Å
81	L	88.3	Confident	88.1	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-47.6	176	178.8	65.8	0	0	0	111	D78 T79 S84 S85 D126 Q182 F186	D78-L81 PolarHBondContact O-N 2.91Å; T79-L81 VanDerWaalsContact C-N 3.35Å; L81-S84 PolarHBondContact O-OG 2.93Å; L81-S85 WeakPolarHBondContact O-CB 3.14Å; L81-S85 PolarHBondContact O-N 3.34Å; L81-S85 PolarHBondContact O-OG 3.48Å; L81-D126 HydrophobicContact CD1-CB 4.06Å; L81-Q182 VanDerWaalsContact CD2-NE2 3.31Å; L81-F186 HydrophobicContact CD2-CE2 3.68Å; L81-F186 HydrophobicContact CD2-CZ 3.61Å
82	W	88	Confident	88.1	Confident	77 Å²	77	55.5 Å²	55.5	29%	0.292	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-49.7	179.4	-80	107	0	0	0	112.7	D78 T79 S85 V86 Q182 I183 F186	D78-W82 VanDerWaalsContact O-CD1 3.29Å; D78-W82 PolarHBondContact O-N 2.98Å; T79-W82 PolarHBondContact O-N 3.02Å; W82-S85 PolarHBondContact O-N 3.39Å; W82-V86 WeakPolarHBondContact O-CB 3.5Å; W82-V86 VanDerWaalsContact O-CG2 3.25Å; W82-V86 WeakPolarHBondContact O-CG2 3.32Å; W82-V86 PolarHBondContact O-N 2.89Å; W82-Q182 HydrophobicContact CH2-CB 4.31Å; W82-Q182 HydrophobicContact CH2-CG 4.07Å; W82-Q182 HydrophobicContact CZ2-CG 4.41Å; W82-I183 HydrophobicContact CH2-CB 4.05Å; W82-I183 HydrophobicContact CH2-CG1 3.33Å; W82-I183 HydrophobicContact CZ2-CG1 4.4Å; W82-I183 HydrophobicContact CZ3-CG1 3.73Å; W82-F186 AromaticContact CE2-CD2 3.75Å; W82-F186 HydrophobicContact CH2-CD2 4.46Å; W82-F186 HydrophobicContact CZ2-CB 4.12Å; W82-F186 AromaticContact CZ2-CD2 3.38Å; W82-F186 HydrophobicContact CZ2-CD2 3.38Å; W82-F186 HydrophobicContact CZ2-CE2 4.04Å; W82-F186 AromaticContact CZ2-CG 3.92Å; W82-F186 HydrophobicContact CZ2-CG 3.92Å; W82-F186 AromaticContact NE1-CD2 3.63Å; W82-F186 AromaticContact NE1-CE2 3.71Å; W82-F186 AromaticContact NE1-CG 3.83Å; W82-F186 AromaticContact NE1-CZ 3.99Å
83	V	90.8	Very high	87.9	Confident	85 Å²	85	51.4 Å²	51.4	52%	0.515	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-46.8	-178	171.8	0	0	0	0	110.8	T79 V86 I87	T79-V83 WeakPolarHBondContact O-CB 3.22Å; T79-V83 VanDerWaalsContact O-CG2 3.29Å; T79-V83 WeakPolarHBondContact O-CG2 3.26Å; T79-V83 PolarHBondContact O-N 3.47Å; V83-V86 PolarHBondContact O-N 2.9Å; V83-I87 HydrophobicContact CG1-CD1 3.65Å; V83-I87 HydrophobicContact CG1-CG1 4.45Å; V83-I87 WeakPolarHBondContact O-CB 3.36Å; V83-I87 VanDerWaalsContact O-CG1 3.22Å; V83-I87 WeakPolarHBondContact O-CG1 3.43Å; V83-I87 PolarHBondContact O-N 3.46Å
84	S	90.8	Very high	87.8	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-41.6	178.7	58.6	0	0	0	0	112.5	I80 L81 Y88 A122	I80-S84 VanDerWaalsContact O-CB 3.28Å; I80-S84 WeakPolarHBondContact O-CB 3.34Å; I80-S84 PolarHBondContact O-N 3.37Å; I80-S84 PolarHBondContact O-OG 2.83Å; L81-S84 PolarHBondContact O-OG 2.93Å; S84-Y88 VanDerWaalsContact O-CB 3.29Å; S84-Y88 WeakPolarHBondContact O-CB 3.12Å; S84-Y88 PolarHBondContact O-N 2.95Å; S84-A122 WeakPolarHBondContact OG-CA 3.23Å
85	S	87.5	Confident	87.6	Confident	22 Å²	22	47.9 Å²	47.9	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-44.7	177.6	-59.5	0	0	0	0	112.1	L81 W82 Y88 L89	L81-S85 WeakPolarHBondContact O-CB 3.14Å; L81-S85 PolarHBondContact O-N 3.34Å; L81-S85 PolarHBondContact O-OG 3.48Å; W82-S85 PolarHBondContact O-N 3.39Å; S85-Y88 PolarHBondContact O-N 3.28Å; S85-L89 WeakPolarHBondContact O-CB 3.26Å; S85-L89 VanDerWaalsContact O-CG 3.29Å; S85-L89 WeakPolarHBondContact O-CG 3.32Å; S85-L89 PolarHBondContact O-N 3.03Å
86	V	89.2	Confident	87.4	Confident	80 Å²	80	48.2 Å²	48.2	49%	0.485	26%	0.26	S	S	.	.	H	α-helix	trans	-64.2	-45.4	178.2	170.5	0	0	0	0	110.8	W82 V83 Y88 L89 V90	W82-V86 WeakPolarHBondContact O-CB 3.5Å; W82-V86 VanDerWaalsContact O-CG2 3.25Å; W82-V86 WeakPolarHBondContact O-CG2 3.32Å; W82-V86 PolarHBondContact O-N 2.89Å; V83-V86 PolarHBondContact O-N 2.9Å; V86-Y88 VanDerWaalsContact C-N 3.34Å; V86-Y88 PolarHBondContact O-N 2.92Å; V86-L89 PolarHBondContact O-N 3.3Å; V86-V90 HydrophobicContact CG1-CG2 4.43Å; V86-V90 VanDerWaalsContact O-CG2 3.28Å; V86-V90 WeakPolarHBondContact O-CG2 2.99Å; V86-V90 PolarHBondContact O-N 2.95Å
87	I	91.8	Very high	87.3	Confident	57 Å²	57	48.6 Å²	48.6	29%	0.292	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-44.8	177.5	-66.8	167.8	0	0	0	110.5	V83 L89 V90 L91 F118	V83-I87 HydrophobicContact CG1-CD1 3.65Å; V83-I87 HydrophobicContact CG1-CG1 4.45Å; V83-I87 WeakPolarHBondContact O-CB 3.36Å; V83-I87 VanDerWaalsContact O-CG1 3.22Å; V83-I87 WeakPolarHBondContact O-CG1 3.43Å; V83-I87 PolarHBondContact O-N 3.46Å; I87-L89 PolarHBondContact O-N 3.25Å; I87-V90 PolarHBondContact O-N 2.85Å; I87-L91 HydrophobicContact CG2-CD1 3.88Å; I87-L91 HydrophobicContact CG2-CG 4.34Å; I87-L91 WeakPolarHBondContact O-CB 3.31Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.48Å; I87-L91 PolarHBondContact O-N 3.46Å; I87-F118 HydrophobicContact CB-CD1 4.08Å; I87-F118 HydrophobicContact CB-CD2 4.49Å; I87-F118 HydrophobicContact CB-CE1 4.25Å; I87-F118 HydrophobicContact CB-CG 4.22Å; I87-F118 HydrophobicContact CD1-CD1 4.2Å; I87-F118 HydrophobicContact CD1-CE1 3.6Å; I87-F118 HydrophobicContact CD1-CZ 3.92Å; I87-F118 HydrophobicContact CG2-CB 4.41Å; I87-F118 HydrophobicContact CG2-CD1 3.85Å; I87-F118 HydrophobicContact CG2-CD2 3.45Å; I87-F118 VanDerWaalsContact CG2-CD2 3.45Å; I87-F118 HydrophobicContact CG2-CE1 3.91Å; I87-F118 HydrophobicContact CG2-CE2 3.49Å; I87-F118 VanDerWaalsContact CG2-CE2 3.49Å; I87-F118 HydrophobicContact CG2-CG 3.64Å; I87-F118 HydrophobicContact CG2-CZ 3.74Å
88	Y	90.8	Very high	87.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-47.6	176.6	173.1	-107.2	0	0	0	112.1	S84 S85 V86 V90 L91 Q92 M115 S119 N239 W242	S84-Y88 VanDerWaalsContact O-CB 3.29Å; S84-Y88 WeakPolarHBondContact O-CB 3.12Å; S84-Y88 PolarHBondContact O-N 2.95Å; S85-Y88 PolarHBondContact O-N 3.28Å; V86-Y88 VanDerWaalsContact C-N 3.34Å; V86-Y88 PolarHBondContact O-N 2.92Å; Y88-V90 VanDerWaalsContact C-N 3.34Å; Y88-V90 PolarHBondContact O-N 3.49Å; Y88-L91 CarbonylContact O-C 3.58Å; Y88-L91 PolarHBondContact O-N 3Å; Y88-Q92 WeakPolarHBondContact O-CB 3.24Å; Y88-Q92 PolarHBondContact O-N 3.43Å; Y88-M115 HydrophobicContact CD2-CE 3.95Å; Y88-M115 HydrophobicContact CD2-SD 3.92Å; Y88-M115 HydrophobicContact CE2-CE 3.38Å; Y88-M115 HydrophobicContact CE2-SD 3.97Å; Y88-S119 VanDerWaalsContact CE2-CB 3.41Å; Y88-N239 PolarHBondContact OH-OD1 2.88Å; Y88-N239 VanDerWaalsContact OH-OD1 3.1Å; Y88-W242 HydrophobicContact CD1-CH2 4.1Å; Y88-W242 AromaticContact CD1-CZ2 3.87Å; Y88-W242 HydrophobicContact CD1-CZ2 3.87Å; Y88-W242 AromaticContact CE1-CD2 3.69Å; Y88-W242 HydrophobicContact CE1-CD2 3.69Å; Y88-W242 AromaticContact CE1-CE2 3.58Å; Y88-W242 AromaticContact CE1-CE3 3.77Å; Y88-W242 HydrophobicContact CE1-CE3 3.77Å; Y88-W242 HydrophobicContact CE1-CG 4.4Å; Y88-W242 AromaticContact CE1-CH2 3.77Å; Y88-W242 HydrophobicContact CE1-CH2 3.77Å; Y88-W242 AromaticContact CE1-CZ2 3.65Å; Y88-W242 HydrophobicContact CE1-CZ2 3.65Å; Y88-W242 AromaticContact CE1-CZ3 3.82Å; Y88-W242 HydrophobicContact CE1-CZ3 3.82Å; Y88-W242 AromaticContact CZ-CD2 3.86Å; Y88-W242 AromaticContact CZ-CE2 3.98Å
89	L	86.9	Confident	86.7	Confident	36 Å²	36	48 Å²	48	19%	0.188	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-37.9	179.3	-72.1	173.8	0	0	0	112.5	S85 V86 I87 Q92 A93 L179	S85-L89 WeakPolarHBondContact O-CB 3.26Å; S85-L89 VanDerWaalsContact O-CG 3.29Å; S85-L89 WeakPolarHBondContact O-CG 3.32Å; S85-L89 PolarHBondContact O-N 3.03Å; V86-L89 PolarHBondContact O-N 3.3Å; I87-L89 PolarHBondContact O-N 3.25Å; L89-Q92 PolarHBondContact O-N 3.4Å; L89-A93 WeakPolarHBondContact O-CB 3.3Å; L89-A93 PolarHBondContact O-N 3.04Å; L89-L179 HydrophobicContact CD1-CB 4.35Å; L89-L179 HydrophobicContact CD1-CD1 3.96Å; L89-L179 HydrophobicContact CD1-CG 4.2Å
90	V	89.3	Confident	86.2	Confident	78 Å²	78	45.2 Å²	45.2	47%	0.473	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-45.1	174.5	169.6	0	0	0	0	110.6	V86 I87 Y88 Q92 A93 I94	V86-V90 HydrophobicContact CG1-CG2 4.43Å; V86-V90 VanDerWaalsContact O-CG2 3.28Å; V86-V90 WeakPolarHBondContact O-CG2 2.99Å; V86-V90 PolarHBondContact O-N 2.95Å; I87-V90 PolarHBondContact O-N 2.85Å; Y88-V90 VanDerWaalsContact C-N 3.34Å; Y88-V90 PolarHBondContact O-N 3.49Å; V90-Q92 VanDerWaalsContact C-N 3.31Å; V90-Q92 PolarHBondContact O-N 3.43Å; V90-A93 PolarHBondContact O-N 2.86Å; V90-I94 HydrophobicContact CG1-CD1 3.86Å; V90-I94 WeakPolarHBondContact O-CG1 3.28Å; V90-I94 PolarHBondContact O-N 3.33Å
91	L	89.2	Confident	85.5	Confident	17 Å²	17	46.9 Å²	46.9	9%	0.089	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-37.3	175	-68.6	169.8	0	0	0	111	I87 Y88 A93 W95 Y111 L114 M115 F118	I87-L91 HydrophobicContact CG2-CD1 3.88Å; I87-L91 HydrophobicContact CG2-CG 4.34Å; I87-L91 WeakPolarHBondContact O-CB 3.31Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.48Å; I87-L91 PolarHBondContact O-N 3.46Å; Y88-L91 CarbonylContact O-C 3.58Å; Y88-L91 PolarHBondContact O-N 3Å; L91-A93 PolarHBondContact O-N 3.33Å; L91-W95 WeakPolarHBondContact O-CB 3.34Å; L91-W95 PolarHBondContact O-N 3.44Å; L91-Y111 WeakPolarHBondContact CA-OH 3.46Å; L91-Y111 HydrophobicContact CB-CE1 4.06Å; L91-Y111 HydrophobicContact CD2-CD2 4.41Å; L91-Y111 HydrophobicContact CD2-CE1 4.21Å; L91-Y111 HydrophobicContact CD2-CE2 3.71Å; L91-Y111 PolarHBondContact O-OH 2.73Å; L91-L114 HydrophobicContact CD1-CB 4.39Å; L91-L114 HydrophobicContact CD1-CD2 3.91Å; L91-L114 HydrophobicContact CD1-CG 3.85Å; L91-L114 HydrophobicContact CD2-CD2 3.93Å; L91-M115 HydrophobicContact CB-CG 4.17Å; L91-M115 HydrophobicContact CB-SD 3.24Å; L91-M115 WeakPolarHBondContact CB-SD 3.37Å; L91-M115 HydrophobicContact CD1-SD 4.26Å; L91-M115 HydrophobicContact CG-SD 4.37Å; L91-F118 HydrophobicContact CD1-CD2 3.79Å; L91-F118 HydrophobicContact CD1-CE2 4.41Å
92	Q	86.6	Confident	84.8	Confident	6 Å²	6	46.6 Å²	46.6	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-44.9	174.4	179.3	177.5	-20.3	0	0	111.6	Y88 L89 V90 W95 M96 M115 D175 N239	Y88-Q92 WeakPolarHBondContact O-CB 3.24Å; Y88-Q92 PolarHBondContact O-N 3.43Å; L89-Q92 PolarHBondContact O-N 3.4Å; V90-Q92 VanDerWaalsContact C-N 3.31Å; V90-Q92 PolarHBondContact O-N 3.43Å; Q92-W95 WeakPolarHBondContact O-CB 3.48Å; Q92-W95 PolarHBondContact O-N 3.38Å; Q92-M96 PolarHBondContact O-N 3.29Å; Q92-M115 HydrophobicContact CB-CE 4.08Å; Q92-D175 PolarHBondContact NE2-OD1 3.37Å; Q92-D175 PolarHBondContact NE2-OD2 2.81Å; Q92-N239 PolarHBondContact NE2-ND2 2.93Å; Q92-N239 PolarHBondContact NE2-OD1 2.79Å; Q92-N239 PolarHBondContact OE1-OD1 2.99Å
93	A	84.8	Confident	84.4	Confident	37 Å²	37	49.1 Å²	49.1	31%	0.306	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-47.3	178.9	0	0	0	0	0	111.7	L89 V90 L91 W95 M96 F97	L89-A93 WeakPolarHBondContact O-CB 3.3Å; L89-A93 PolarHBondContact O-N 3.04Å; V90-A93 PolarHBondContact O-N 2.86Å; L91-A93 PolarHBondContact O-N 3.33Å; A93-W95 VanDerWaalsContact C-N 3.26Å; A93-W95 PolarHBondContact O-N 3.16Å; A93-M96 PolarHBondContact O-N 3.38Å; A93-M96 VanDerWaalsContact O-N 3.17Å; A93-F97 HydrophobicContact CB-CD2 4.37Å; A93-F97 HydrophobicContact CB-CE2 4.43Å; A93-F97 WeakPolarHBondContact O-CD2 3.29Å; A93-F97 PolarHBondContact O-N 3.4Å
94	I	86	Confident	84	Confident	64 Å²	64	51.6 Å²	51.6	33%	0.328	28%	0.276	S	S	.	.	H	α-helix	trans	-59.6	-39.9	177.4	-69.1	164.8	0	0	0	110.8	V90 M96 V98 L101 Y111	V90-I94 HydrophobicContact CG1-CD1 3.86Å; V90-I94 WeakPolarHBondContact O-CG1 3.28Å; V90-I94 PolarHBondContact O-N 3.33Å; I94-M96 VanDerWaalsContact C-N 3.32Å; I94-M96 PolarHBondContact O-N 3.4Å; I94-V98 WeakPolarHBondContact O-CA 3.47Å; I94-V98 WeakPolarHBondContact O-CB 3.43Å; I94-V98 PolarHBondContact O-N 3.14Å; I94-L101 HydrophobicContact CG2-CD1 3.76Å; I94-Y111 VanDerWaalsContact CB-OH 3.23Å; I94-Y111 WeakPolarHBondContact CB-OH 3.46Å; I94-Y111 HydrophobicContact CG2-CE2 4.17Å; I94-Y111 WeakPolarHBondContact CG2-OH 3.32Å
95	W	82.5	Confident	83.4	Confident	12 Å²	12	60.2 Å²	60.2	5%	0.045	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-35.8	179.2	-160.7	-98.2	0	0	0	112.4	L91 Q92 A93 S102 Y111 V231 L232	L91-W95 WeakPolarHBondContact O-CB 3.34Å; L91-W95 PolarHBondContact O-N 3.44Å; Q92-W95 WeakPolarHBondContact O-CB 3.48Å; Q92-W95 PolarHBondContact O-N 3.38Å; A93-W95 VanDerWaalsContact C-N 3.26Å; A93-W95 PolarHBondContact O-N 3.16Å; W95-S102 WeakPolarHBondContact CH2-OG 3.45Å; W95-S102 WeakPolarHBondContact CZ2-OG 3.48Å; W95-Y111 HydrophobicContact CB-CE1 4.04Å; W95-Y111 AromaticContact CD2-CD1 3.91Å; W95-Y111 HydrophobicContact CD2-CD1 3.91Å; W95-Y111 AromaticContact CD2-CE1 3.78Å; W95-Y111 HydrophobicContact CD2-CE1 3.78Å; W95-Y111 AromaticContact CE3-CD1 2.97Å; W95-Y111 HydrophobicContact CE3-CD1 2.97Å; W95-Y111 HydrophobicContact CE3-CD2 4.16Å; W95-Y111 AromaticContact CE3-CE1 3.07Å; W95-Y111 HydrophobicContact CE3-CE1 3.07Å; W95-Y111 HydrophobicContact CE3-CE2 4.23Å; W95-Y111 AromaticContact CE3-CG 3.52Å; W95-Y111 HydrophobicContact CE3-CG 3.52Å; W95-Y111 AromaticContact CE3-CZ 3.7Å; W95-Y111 HydrophobicContact CG-CE1 4.26Å; W95-Y111 AromaticContact CH2-CD1 3.88Å; W95-Y111 HydrophobicContact CH2-CD1 3.88Å; W95-Y111 HydrophobicContact CH2-CG 4.22Å; W95-Y111 AromaticContact CZ3-CD1 2.99Å; W95-Y111 HydrophobicContact CZ3-CD1 2.99Å; W95-Y111 HydrophobicContact CZ3-CD2 4.08Å; W95-Y111 AromaticContact CZ3-CE1 3.67Å; W95-Y111 HydrophobicContact CZ3-CE1 3.67Å; W95-Y111 AromaticContact CZ3-CG 3.2Å; W95-Y111 HydrophobicContact CZ3-CG 3.2Å; W95-Y111 PolarHBondContact N-OH 3.38Å; W95-V231 HydrophobicContact CH2-CG1 3.92Å; W95-V231 HydrophobicContact CZ2-CG1 3.97Å; W95-L232 HydrophobicContact CG-CD1 4.19Å; W95-L232 VanDerWaalsContact NE1-CD1 3.26Å; W95-L232 PolarHBondContact NE1-O 2.95Å
96	M	80.4	Confident	83.3	Confident	48 Å²	48	61.9 Å²	61.9	24%	0.236	32%	0.319	C	S	.	.	H	α-helix	trans	-74.6	-43.9	178	-170.3	-178.9	-68.7	0	0	112.5	Q92 A93 I94 L168 S171 L172	Q92-M96 PolarHBondContact O-N 3.29Å; A93-M96 PolarHBondContact O-N 3.38Å; A93-M96 VanDerWaalsContact O-N 3.17Å; I94-M96 VanDerWaalsContact C-N 3.32Å; I94-M96 PolarHBondContact O-N 3.4Å; M96-L168 HydrophobicContact SD-CG 4.41Å; M96-S171 WeakPolarHBondContact CE-OG 3.3Å; M96-L172 HydrophobicContact SD-CD2 4.16Å; M96-L172 HydrophobicContact SD-CG 4.47Å
97	F	83.3	Confident	83	Confident	128 Å²	128	65 Å²	65	56%	0.561	32%	0.323	S	S	*	.	H	α-helix	trans	-85.3	-22.7	-175.9	-68.4	-65.2	0	0	0	113.9	A93 P99 L172	A93-F97 HydrophobicContact CB-CD2 4.37Å; A93-F97 HydrophobicContact CB-CE2 4.43Å; A93-F97 WeakPolarHBondContact O-CD2 3.29Å; A93-F97 PolarHBondContact O-N 3.4Å; F97-P99 VanDerWaalsContact C-CD 3.48Å; F97-P99 WeakPolarHBondContact O-CD 3.48Å; F97-L172 HydrophobicContact CE2-CD2 4.35Å; F97-L172 HydrophobicContact CZ-CD1 4.25Å; F97-L172 HydrophobicContact CZ-CD2 4.03Å
98	V	83.9	Confident	82.7	Confident	68 Å²	68	63.1 Å²	63.1	41%	0.412	31%	0.314	S	S	.	.			trans	-126.2	69.6	-176	-164.4	0	0	0	0	110.9	I94 G100 L101	I94-V98 WeakPolarHBondContact O-CA 3.47Å; I94-V98 WeakPolarHBondContact O-CB 3.43Å; I94-V98 PolarHBondContact O-N 3.14Å; V98-G100 PolarHBondContact O-N 2.98Å; V98-L101 HydrophobicContact CB-CD1 4.24Å; V98-L101 HydrophobicContact CB-CG 4.48Å; V98-L101 HydrophobicContact CG1-CD1 4Å; V98-L101 HydrophobicContact CG1-CG 3.85Å; V98-L101 PolarHBondContact O-N 3.29Å; V98-L101 VanDerWaalsContact O-N 3.16Å
99	P	75.8	Confident	82.6	Confident	50 Å²	50	66.5 Å²	66.5	33%	0.325	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-21.5	179.7	25.5	-35	0	0	0	112.8	F97 L101 S102 R103 L232	F97-P99 VanDerWaalsContact C-CD 3.48Å; F97-P99 WeakPolarHBondContact O-CD 3.48Å; P99-L101 PolarHBondContact O-N 3.47Å; P99-S102 WeakPolarHBondContact O-CB 3.42Å; P99-S102 PolarHBondContact O-N 3.14Å; P99-S102 VanDerWaalsContact O-N 3.07Å; P99-R103 PolarHBondContact O-N 3.08Å; P99-L232 HydrophobicContact CB-CD2 3.73Å
100	G	76.1	Confident	82.6	Confident	36 Å²	36	70.8 Å²	70.8	37%	0.371	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-26.7	177	0	0	0	0	0	114.6	V98	V98-G100 PolarHBondContact O-N 2.98Å
101	L	73.8	Confident	82.6	Confident	73 Å²	73	68.4 Å²	68.4	38%	0.382	34%	0.335	S	S	.	.	H	α-helix	trans	-72.5	-34.9	174.7	-70.3	174.2	0	0	0	111.9	I94 V98 P99 R103 K104	I94-L101 HydrophobicContact CG2-CD1 3.76Å; V98-L101 HydrophobicContact CB-CD1 4.24Å; V98-L101 HydrophobicContact CB-CG 4.48Å; V98-L101 HydrophobicContact CG1-CD1 4Å; V98-L101 HydrophobicContact CG1-CG 3.85Å; V98-L101 PolarHBondContact O-N 3.29Å; V98-L101 VanDerWaalsContact O-N 3.16Å; P99-L101 PolarHBondContact O-N 3.47Å; L101-R103 VanDerWaalsContact C-N 3.26Å; L101-R103 PolarHBondContact O-N 2.46Å; L101-K104 PolarHBondContact O-N 3.23Å
102	S	73.7	Confident	82.6	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	34%	0.336	C	S	.	.	H	α-helix	trans	-73.3	-18	179.6	-164.8	0	0	0	0	113.2	W95 P99 N108 L232	W95-S102 WeakPolarHBondContact CH2-OG 3.45Å; W95-S102 WeakPolarHBondContact CZ2-OG 3.48Å; P99-S102 WeakPolarHBondContact O-CB 3.42Å; P99-S102 PolarHBondContact O-N 3.14Å; P99-S102 VanDerWaalsContact O-N 3.07Å; S102-N108 WeakPolarHBondContact O-CB 3.2Å; S102-L232 VanDerWaalsContact OG-CA 3.22Å; S102-L232 WeakPolarHBondContact OG-CA 3.4Å; S102-L232 WeakPolarHBondContact OG-CB 3.25Å; S102-L232 PolarHBondContact OG-N 3.48Å; S102-L232 VanDerWaalsContact OG-N 3.12Å
103	R	79.6	Confident	82.8	Confident	129 Å²	129	73.3 Å²	73.3	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-83.9	-22.4	177.8	-67.6	177.3	179.4	176.2	-2	114	P99 L101 D229	P99-R103 PolarHBondContact O-N 3.08Å; L101-R103 VanDerWaalsContact C-N 3.26Å; L101-R103 PolarHBondContact O-N 2.46Å; R103-D229 WeakPolarHBondContact CG-OD1 3.44Å; R103-D229 IonicContact CZ-OD1 3.38Å; R103-D229 IonicContact CZ-OD2 3.72Å; R103-D229 IonicContact NE-OD1 2.68Å; R103-D229 PolarHBondContact NE-OD1 2.93Å; R103-D229 IonicContact NE-OD2 3.77Å; R103-D229 IonicContact NH2-OD1 3.22Å; R103-D229 PolarHBondContact NH2-OD1 3.16Å; R103-D229 IonicContact NH2-OD2 2.64Å; R103-D229 PolarHBondContact NH2-OD2 3.4Å
104	K	82.4	Confident	83.2	Confident	138 Å²	138	75 Å²	75	60%	0.6	36%	0.364	S	S	*	.	S	Bend	trans	-94.2	118.8	-173.1	-69	-176.8	180	-178.6	0	111.1	L101 Y107 N108	L101-K104 PolarHBondContact O-N 3.23Å; K104-Y107 HydrophobicContact CB-CD2 4.08Å; K104-Y107 WeakPolarHBondContact O-CB 3.39Å; K104-Y107 PolarHBondContact O-N 2.79Å; K104-N108 PolarHBondContact O-N 2.88Å
105	Y	78.4	Confident	83.4	Confident	185 Å²	185	72.4 Å²	72.4	73%	0.725	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	141.4	166.2	-174.5	-94.6	0	0	0	110.4	I109	Y105-I109 HydrophobicContact CD2-CG1 4.23Å; Y105-I109 HydrophobicContact CE2-CG1 4.05Å
106	P	84	Confident	84	Confident	56 Å²	56	72.1 Å²	72.1	36%	0.364	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.5	2.2	-1.3	36.5	-35.6	0	0	0	114.4	N108 I109 M110	P106-N108 PolarHBondContact O-N 3.31Å; P106-I109 PolarHBondContact O-N 2.77Å; P106-I109 VanDerWaalsContact O-N 3.08Å; P106-M110 PolarHBondContact O-N 3.38Å; P106-M110 VanDerWaalsContact O-N 3.14Å
107	Y	84.4	Confident	84.7	Confident	145 Å²	145	74.1 Å²	74.1	57%	0.569	36%	0.361	S	S	*	.	H	α-helix	trans	-56.5	-37.9	-175.1	-61.3	-74.2	0	0	0	112.7	K104 I109 M110 Y111	K104-Y107 HydrophobicContact CB-CD2 4.08Å; K104-Y107 WeakPolarHBondContact O-CB 3.39Å; K104-Y107 PolarHBondContact O-N 2.79Å; Y107-I109 VanDerWaalsContact C-N 3.34Å; Y107-I109 PolarHBondContact O-N 3.44Å; Y107-M110 PolarHBondContact O-N 3.08Å; Y107-Y111 VanDerWaalsContact O-CB 3.25Å; Y107-Y111 WeakPolarHBondContact O-CB 3.49Å; Y107-Y111 PolarHBondContact O-N 3.32Å
108	N	85.9	Confident	85.2	Confident	18 Å²	18	70 Å²	70	10%	0.096	34%	0.343	C	S	.	.	H	α-helix	trans	-56.4	-43.5	176.2	65	-11.8	0	0	0	113.3	S102 K104 P106 L112 V231	S102-N108 WeakPolarHBondContact O-CB 3.2Å; K104-N108 PolarHBondContact O-N 2.88Å; P106-N108 PolarHBondContact O-N 3.31Å; N108-L112 WeakPolarHBondContact O-CB 3.37Å; N108-L112 PolarHBondContact O-N 3Å; N108-L112 VanDerWaalsContact O-N 3.08Å; N108-V231 HydrophobicContact CB-CB 4.26Å; N108-V231 HydrophobicContact CB-CG1 4Å; N108-V231 HydrophobicContact CB-CG2 4.4Å
109	I	86.8	Confident	85.6	Confident	72 Å²	72	66.7 Å²	66.7	37%	0.369	32%	0.323	S	S	.	.	H	α-helix	trans	-73.2	-45.4	178.5	-57.6	-51.2	0	0	0	111.2	Y105 P106 Y107 Y111 L112 I113 V231	Y105-I109 HydrophobicContact CD2-CG1 4.23Å; Y105-I109 HydrophobicContact CE2-CG1 4.05Å; P106-I109 PolarHBondContact O-N 2.77Å; P106-I109 VanDerWaalsContact O-N 3.08Å; Y107-I109 VanDerWaalsContact C-N 3.34Å; Y107-I109 PolarHBondContact O-N 3.44Å; I109-Y111 PolarHBondContact O-N 3.36Å; I109-L112 PolarHBondContact O-N 2.99Å; I109-L112 VanDerWaalsContact O-N 3.14Å; I109-I113 HydrophobicContact CG2-CD1 3.99Å; I109-I113 HydrophobicContact CG2-CG1 4.5Å; I109-I113 WeakPolarHBondContact O-CG1 3.37Å; I109-I113 PolarHBondContact O-N 3.44Å; I109-V231 HydrophobicContact CD1-CG2 4.4Å
110	M	88.6	Confident	86.6	Confident	126 Å²	126	65 Å²	65	62%	0.621	31%	0.312	S	S	*	.	H	α-helix	trans	-57	-42.3	178.5	-69.1	-170.8	77.7	0	0	111.2	P106 Y107 I113 L114	P106-M110 PolarHBondContact O-N 3.38Å; P106-M110 VanDerWaalsContact O-N 3.14Å; Y107-M110 PolarHBondContact O-N 3.08Å; M110-I113 PolarHBondContact O-N 2.88Å; M110-L114 WeakPolarHBondContact O-CB 3.42Å; M110-L114 PolarHBondContact O-N 3.31Å
111	Y	87.5	Confident	87.4	Confident	28 Å²	28	66.6 Å²	66.6	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-68.5	-40.4	178.3	-159.6	-76.2	0	0	0	112.7	L91 I94 W95 Y107 I109 I113 L114 M115	L91-Y111 WeakPolarHBondContact CA-OH 3.46Å; L91-Y111 HydrophobicContact CB-CE1 4.06Å; L91-Y111 HydrophobicContact CD2-CD2 4.41Å; L91-Y111 HydrophobicContact CD2-CE1 4.21Å; L91-Y111 HydrophobicContact CD2-CE2 3.71Å; L91-Y111 PolarHBondContact O-OH 2.73Å; I94-Y111 VanDerWaalsContact CB-OH 3.23Å; I94-Y111 WeakPolarHBondContact CB-OH 3.46Å; I94-Y111 HydrophobicContact CG2-CE2 4.17Å; I94-Y111 WeakPolarHBondContact CG2-OH 3.32Å; W95-Y111 HydrophobicContact CB-CE1 4.04Å; W95-Y111 AromaticContact CD2-CD1 3.91Å; W95-Y111 HydrophobicContact CD2-CD1 3.91Å; W95-Y111 AromaticContact CD2-CE1 3.78Å; W95-Y111 HydrophobicContact CD2-CE1 3.78Å; W95-Y111 AromaticContact CE3-CD1 2.97Å; W95-Y111 HydrophobicContact CE3-CD1 2.97Å; W95-Y111 HydrophobicContact CE3-CD2 4.16Å; W95-Y111 AromaticContact CE3-CE1 3.07Å; W95-Y111 HydrophobicContact CE3-CE1 3.07Å; W95-Y111 HydrophobicContact CE3-CE2 4.23Å; W95-Y111 AromaticContact CE3-CG 3.52Å; W95-Y111 HydrophobicContact CE3-CG 3.52Å; W95-Y111 AromaticContact CE3-CZ 3.7Å; W95-Y111 HydrophobicContact CG-CE1 4.26Å; W95-Y111 AromaticContact CH2-CD1 3.88Å; W95-Y111 HydrophobicContact CH2-CD1 3.88Å; W95-Y111 HydrophobicContact CH2-CG 4.22Å; W95-Y111 AromaticContact CZ3-CD1 2.99Å; W95-Y111 HydrophobicContact CZ3-CD1 2.99Å; W95-Y111 HydrophobicContact CZ3-CD2 4.08Å; W95-Y111 AromaticContact CZ3-CE1 3.67Å; W95-Y111 HydrophobicContact CZ3-CE1 3.67Å; W95-Y111 AromaticContact CZ3-CG 3.2Å; W95-Y111 HydrophobicContact CZ3-CG 3.2Å; W95-Y111 PolarHBondContact N-OH 3.38Å; Y107-Y111 VanDerWaalsContact O-CB 3.25Å; Y107-Y111 WeakPolarHBondContact O-CB 3.49Å; Y107-Y111 PolarHBondContact O-N 3.32Å; I109-Y111 PolarHBondContact O-N 3.36Å; Y111-I113 VanDerWaalsContact C-N 3.29Å; Y111-I113 PolarHBondContact O-N 2.99Å; Y111-L114 PolarHBondContact O-N 2.76Å; Y111-L114 VanDerWaalsContact O-N 3.17Å; Y111-M115 HydrophobicContact CD1-CG 3.52Å; Y111-M115 HydrophobicContact CE1-CG 3.43Å; Y111-M115 VanDerWaalsContact CE1-CG 3.43Å; Y111-M115 HydrophobicContact CE1-SD 4.08Å; Y111-M115 WeakPolarHBondContact O-CB 3.24Å; Y111-M115 WeakPolarHBondContact O-CG 3.36Å; Y111-M115 PolarHBondContact O-N 3.23Å
112	L	89.3	Confident	88.2	Confident	23 Å²	23	63.2 Å²	63.2	12%	0.12	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-42.1	177.2	-170.2	143.7	0	0	0	110.9	I49 Q53 N108 I109 T116 V231	I49-L112 HydrophobicContact CG2-CD1 3.54Å; I49-L112 HydrophobicContact CG2-CD2 4.27Å; Q53-L112 HydrophobicContact CG-CD2 3.76Å; Q53-L112 HydrophobicContact CG-CG 4.45Å; N108-L112 WeakPolarHBondContact O-CB 3.37Å; N108-L112 PolarHBondContact O-N 3Å; N108-L112 VanDerWaalsContact O-N 3.08Å; I109-L112 PolarHBondContact O-N 2.99Å; I109-L112 VanDerWaalsContact O-N 3.14Å; L112-T116 WeakPolarHBondContact O-CB 3.4Å; L112-T116 PolarHBondContact O-N 2.96Å; L112-T116 PolarHBondContact O-OG1 2.86Å; L112-T116 VanDerWaalsContact O-OG1 3.05Å; L112-V231 HydrophobicContact CB-CG1 4.39Å; L112-V231 HydrophobicContact CD1-CG1 3.65Å
113	I	91.7	Very high	89.1	Confident	102 Å²	102	63.2 Å²	63.2	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-46.6	173.2	-66.9	167.4	0	0	0	110.7	I109 M110 Y111 T116 L117	I109-I113 HydrophobicContact CG2-CD1 3.99Å; I109-I113 HydrophobicContact CG2-CG1 4.5Å; I109-I113 WeakPolarHBondContact O-CG1 3.37Å; I109-I113 PolarHBondContact O-N 3.44Å; M110-I113 PolarHBondContact O-N 2.88Å; Y111-I113 VanDerWaalsContact C-N 3.29Å; Y111-I113 PolarHBondContact O-N 2.99Å; I113-T116 PolarHBondContact O-N 3.41Å; I113-L117 WeakPolarHBondContact O-CB 3.38Å; I113-L117 PolarHBondContact O-N 3.44Å
114	L	92.3	Very high	89.7	Confident	73 Å²	73	57.1 Å²	57.1	38%	0.382	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-44.5	-178.7	-159.9	65.6	0	0	0	111.7	L91 M110 Y111 L117 F118	L91-L114 HydrophobicContact CD1-CB 4.39Å; L91-L114 HydrophobicContact CD1-CD2 3.91Å; L91-L114 HydrophobicContact CD1-CG 3.85Å; L91-L114 HydrophobicContact CD2-CD2 3.93Å; M110-L114 WeakPolarHBondContact O-CB 3.42Å; M110-L114 PolarHBondContact O-N 3.31Å; Y111-L114 PolarHBondContact O-N 2.76Å; Y111-L114 VanDerWaalsContact O-N 3.17Å; L114-L117 PolarHBondContact O-N 2.79Å; L114-F118 HydrophobicContact CD1-CD2 3.99Å; L114-F118 HydrophobicContact CD1-CE2 3.45Å; L114-F118 VanDerWaalsContact CD1-CE2 3.45Å; L114-F118 HydrophobicContact CD1-CZ 4.47Å; L114-F118 HydrophobicContact CD2-CE2 4.39Å; L114-F118 HydrophobicContact CG-CD2 3.83Å; L114-F118 HydrophobicContact CG-CE2 3.67Å; L114-F118 VanDerWaalsContact O-CD2 3.26Å; L114-F118 WeakPolarHBondContact O-CD2 3.42Å; L114-F118 PolarHBondContact O-N 3.39Å
115	M	90.8	Very high	90.1	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-57	-50.9	173.7	-84	-67.6	-79.1	0	0	111.1	Y88 L91 Q92 Y111 L117 S119	Y88-M115 HydrophobicContact CD2-CE 3.95Å; Y88-M115 HydrophobicContact CD2-SD 3.92Å; Y88-M115 HydrophobicContact CE2-CE 3.38Å; Y88-M115 HydrophobicContact CE2-SD 3.97Å; L91-M115 HydrophobicContact CB-CG 4.17Å; L91-M115 HydrophobicContact CB-SD 3.24Å; L91-M115 WeakPolarHBondContact CB-SD 3.37Å; L91-M115 HydrophobicContact CD1-SD 4.26Å; L91-M115 HydrophobicContact CG-SD 4.37Å; Q92-M115 HydrophobicContact CB-CE 4.08Å; Y111-M115 HydrophobicContact CD1-CG 3.52Å; Y111-M115 HydrophobicContact CE1-CG 3.43Å; Y111-M115 VanDerWaalsContact CE1-CG 3.43Å; Y111-M115 HydrophobicContact CE1-SD 4.08Å; Y111-M115 WeakPolarHBondContact O-CB 3.24Å; Y111-M115 WeakPolarHBondContact O-CG 3.36Å; Y111-M115 PolarHBondContact O-N 3.23Å; M115-L117 VanDerWaalsContact C-N 3.31Å; M115-L117 PolarHBondContact O-N 3.4Å; M115-S119 WeakPolarHBondContact O-CB 3.38Å; M115-S119 PolarHBondContact O-N 3.41Å; M115-S119 PolarHBondContact O-OG 2.83Å
116	T	94.5	Very high	90.6	Very high	6 Å²	6	42.1 Å²	42.1	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-37.1	179.1	-62.7	0	0	0	0	112.4	Q53 I56 L112 I113 S119 T120	Q53-T116 HydrophobicContact CB-CG2 4.37Å; Q53-T116 VanDerWaalsContact CG-OG1 3.3Å; Q53-T116 WeakPolarHBondContact CG-OG1 3.27Å; Q53-T116 PolarHBondContact NE2-OG1 3.1Å; I56-T116 HydrophobicContact CB-CG2 3.97Å; I56-T116 HydrophobicContact CD1-CG2 4.4Å; I56-T116 HydrophobicContact CG2-CG2 3.65Å; L112-T116 WeakPolarHBondContact O-CB 3.4Å; L112-T116 PolarHBondContact O-N 2.96Å; L112-T116 PolarHBondContact O-OG1 2.86Å; L112-T116 VanDerWaalsContact O-OG1 3.05Å; I113-T116 PolarHBondContact O-N 3.41Å; T116-S119 WeakPolarHBondContact CA-OG 3.35Å; T116-S119 PolarHBondContact O-OG 3.29Å; T116-T120 WeakPolarHBondContact O-CB 3.18Å; T116-T120 PolarHBondContact O-N 3.27Å; T116-T120 PolarHBondContact O-OG1 3.17Å
117	L	94.8	Very high	90.9	Very high	90 Å²	90	39.5 Å²	39.5	47%	0.471	19%	0.193	S	C	.	.	H	α-helix	trans	-68.1	-50.1	179.9	-174.7	139.7	0	0	0	111.3	I113 L114 M115 T120 L121	I113-L117 WeakPolarHBondContact O-CB 3.38Å; I113-L117 PolarHBondContact O-N 3.44Å; L114-L117 PolarHBondContact O-N 2.79Å; M115-L117 VanDerWaalsContact C-N 3.31Å; M115-L117 PolarHBondContact O-N 3.4Å; L117-T120 PolarHBondContact O-N 3.22Å; L117-L121 HydrophobicContact CD2-CD1 3.85Å; L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 3.46Å
118	F	94.9	Very high	91.2	Very high	40 Å²	40	32.7 Å²	32.7	18%	0.175	17%	0.167	C	C	.	.	H	α-helix	trans	-71.1	-36	-180	-74.7	-66.9	0	0	0	113	I87 L91 L114 T120 L121 A122	I87-F118 HydrophobicContact CB-CD1 4.08Å; I87-F118 HydrophobicContact CB-CD2 4.49Å; I87-F118 HydrophobicContact CB-CE1 4.25Å; I87-F118 HydrophobicContact CB-CG 4.22Å; I87-F118 HydrophobicContact CD1-CD1 4.2Å; I87-F118 HydrophobicContact CD1-CE1 3.6Å; I87-F118 HydrophobicContact CD1-CZ 3.92Å; I87-F118 HydrophobicContact CG2-CB 4.41Å; I87-F118 HydrophobicContact CG2-CD1 3.85Å; I87-F118 HydrophobicContact CG2-CD2 3.45Å; I87-F118 VanDerWaalsContact CG2-CD2 3.45Å; I87-F118 HydrophobicContact CG2-CE1 3.91Å; I87-F118 HydrophobicContact CG2-CE2 3.49Å; I87-F118 VanDerWaalsContact CG2-CE2 3.49Å; I87-F118 HydrophobicContact CG2-CG 3.64Å; I87-F118 HydrophobicContact CG2-CZ 3.74Å; L91-F118 HydrophobicContact CD1-CD2 3.79Å; L91-F118 HydrophobicContact CD1-CE2 4.41Å; L114-F118 HydrophobicContact CD1-CD2 3.99Å; L114-F118 HydrophobicContact CD1-CE2 3.45Å; L114-F118 VanDerWaalsContact CD1-CE2 3.45Å; L114-F118 HydrophobicContact CD1-CZ 4.47Å; L114-F118 HydrophobicContact CD2-CE2 4.39Å; L114-F118 HydrophobicContact CG-CD2 3.83Å; L114-F118 HydrophobicContact CG-CE2 3.67Å; L114-F118 VanDerWaalsContact O-CD2 3.26Å; L114-F118 WeakPolarHBondContact O-CD2 3.42Å; L114-F118 PolarHBondContact O-N 3.39Å; F118-T120 VanDerWaalsContact C-N 3.3Å; F118-T120 PolarHBondContact O-N 3.22Å; F118-L121 HydrophobicContact CD1-CD1 4.41Å; F118-L121 PolarHBondContact O-N 3.11Å; F118-A122 WeakPolarHBondContact O-CB 3.43Å; F118-A122 PolarHBondContact O-N 2.82Å
119	S	92.6	Very high	91.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-37.7	173.9	67.1	0	0	0	0	112	Y88 M115 T116 A122 I123 Y238	Y88-S119 VanDerWaalsContact CE2-CB 3.41Å; M115-S119 WeakPolarHBondContact O-CB 3.38Å; M115-S119 PolarHBondContact O-N 3.41Å; M115-S119 PolarHBondContact O-OG 2.83Å; T116-S119 WeakPolarHBondContact CA-OG 3.35Å; T116-S119 PolarHBondContact O-OG 3.29Å; S119-A122 PolarHBondContact O-N 2.79Å; S119-I123 WeakPolarHBondContact O-CB 3.48Å; S119-I123 PolarHBondContact O-N 3.45Å; S119-Y238 WeakPolarHBondContact CB-OH 3.41Å; S119-Y238 PolarHBondContact OG-OH 3.02Å
120	T	95.4	Very high	91.4	Very high	15 Å²	15	29.4 Å²	29.4	9%	0.092	15%	0.15	C	C	.	.	H	α-helix	trans	-67.7	-43.4	175.8	-58.7	0	0	0	0	110.7	T57 T116 L117 F118 A122 A124	T57-T120 WeakPolarHBondContact CA-OG1 3.35Å; T57-T120 PolarHBondContact OG1-OG1 3.5Å; T116-T120 WeakPolarHBondContact O-CB 3.18Å; T116-T120 PolarHBondContact O-N 3.27Å; T116-T120 PolarHBondContact O-OG1 3.17Å; L117-T120 PolarHBondContact O-N 3.22Å; F118-T120 VanDerWaalsContact C-N 3.3Å; F118-T120 PolarHBondContact O-N 3.22Å; T120-A122 PolarHBondContact O-N 3.02Å; T120-A124 WeakPolarHBondContact O-CB 3.35Å; T120-A124 PolarHBondContact O-N 2.88Å
121	L	93.6	Very high	91.3	Very high	68 Å²	68	27.8 Å²	27.8	36%	0.356	14%	0.139	S	C	.	.	H	α-helix	trans	-63.1	-40.8	175.1	-72.7	172.4	0	0	0	112.3	L117 F118 S125	L117-L121 HydrophobicContact CD2-CD1 3.85Å; L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 3.46Å; F118-L121 HydrophobicContact CD1-CD1 4.41Å; F118-L121 PolarHBondContact O-N 3.11Å; L121-S125 VanDerWaalsContact O-CB 3.26Å; L121-S125 WeakPolarHBondContact O-CB 3.15Å; L121-S125 PolarHBondContact O-N 3.26Å; L121-S125 PolarHBondContact O-OG 3.34Å
122	A	91.6	Very high	91.4	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-51.1	178.4	0	0	0	0	0	111.5	S84 F118 S119 T120 S125 D126	S84-A122 WeakPolarHBondContact OG-CA 3.23Å; F118-A122 WeakPolarHBondContact O-CB 3.43Å; F118-A122 PolarHBondContact O-N 2.82Å; S119-A122 PolarHBondContact O-N 2.79Å; T120-A122 PolarHBondContact O-N 3.02Å; A122-S125 PolarHBondContact O-N 2.86Å; A122-D126 PolarHBondContact O-N 3.38Å
123	I	92.5	Very high	91.3	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-46.7	175.7	-78.8	170.9	0	0	0	110.8	T57 T61 S119 S125 D126 A127 F139 W241 W242 F245	T57-I123 HydrophobicContact CG2-CD1 3.78Å; T61-I123 HydrophobicContact CG2-CG2 3.87Å; T61-I123 WeakPolarHBondContact OG1-CG2 3.46Å; S119-I123 WeakPolarHBondContact O-CB 3.48Å; S119-I123 PolarHBondContact O-N 3.45Å; I123-S125 PolarHBondContact O-N 3.34Å; I123-D126 PolarHBondContact O-N 2.87Å; I123-A127 WeakPolarHBondContact O-CB 3.34Å; I123-A127 PolarHBondContact O-N 3.29Å; I123-F139 HydrophobicContact CG2-CZ 4.33Å; I123-W241 HydrophobicContact CD1-CH2 4.4Å; I123-W241 HydrophobicContact CD1-CZ3 4.5Å; I123-W242 HydrophobicContact CD1-CG 3.97Å; I123-W242 VanDerWaalsContact CG1-NE1 3.33Å; I123-F245 HydrophobicContact CD1-CD1 3.89Å; I123-F245 HydrophobicContact CD1-CE1 4.34Å; I123-F245 HydrophobicContact CG1-CD1 4.19Å; I123-F245 HydrophobicContact CG1-CE1 4.31Å; I123-F245 HydrophobicContact CG2-CD1 4.15Å; I123-F245 HydrophobicContact CG2-CE1 3.51Å; I123-F245 HydrophobicContact CG2-CZ 4.31Å
124	A	92.7	Very high	91.2	Very high	1 Å²	1	29 Å²	29	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-42	-177.9	0	0	0	0	0	110.7	V64 T120 A127 T128	V64-A124 HydrophobicContact CB-CB 3.91Å; V64-A124 HydrophobicContact CG1-CB 3.93Å; V64-A124 HydrophobicContact CG2-CB 3.97Å; T120-A124 WeakPolarHBondContact O-CB 3.35Å; T120-A124 PolarHBondContact O-N 2.88Å; A124-A127 PolarHBondContact O-N 3.04Å; A124-T128 VanDerWaalsContact O-CG2 3.25Å; A124-T128 WeakPolarHBondContact O-CG2 3.45Å; A124-T128 PolarHBondContact O-N 3.05Å; A124-T128 VanDerWaalsContact O-N 3.1Å
125	S	90.6	Very high	91.2	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-45	176.9	-56.7	0	0	0	0	112.1	L121 A122 I123 T128	L121-S125 VanDerWaalsContact O-CB 3.26Å; L121-S125 WeakPolarHBondContact O-CB 3.15Å; L121-S125 PolarHBondContact O-N 3.26Å; L121-S125 PolarHBondContact O-OG 3.34Å; A122-S125 PolarHBondContact O-N 2.86Å; I123-S125 PolarHBondContact O-N 3.34Å; S125-T128 PolarHBondContact O-N 3.28Å; S125-T128 PolarHBondContact O-OG1 3.33Å
126	D	88.9	Confident	91.2	Very high	5 Å²	5	27.9 Å²	27.9	3%	0.027	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-41.6	177.2	-157	60.1	0	0	0	111.2	L81 A122 I123 T128 L129 Y130 Q182 W250	L81-D126 HydrophobicContact CD1-CB 4.06Å; A122-D126 PolarHBondContact O-N 3.38Å; I123-D126 PolarHBondContact O-N 2.87Å; D126-T128 VanDerWaalsContact C-N 3.28Å; D126-T128 PolarHBondContact O-N 3.17Å; D126-L129 VanDerWaalsContact O-CB 3.32Å; D126-L129 WeakPolarHBondContact O-CB 3.48Å; D126-L129 WeakPolarHBondContact O-CG 3.34Å; D126-L129 PolarHBondContact O-N 2.93Å; D126-Y130 VanDerWaalsContact O-CD2 3.28Å; D126-Y130 WeakPolarHBondContact O-CD2 3.17Å; D126-Q182 PolarHBondContact OD1-NE2 3.02Å; D126-W250 PolarHBondContact OD2-NE1 3.35Å; D126-W250 VanDerWaalsContact OD2-NE1 3.07Å
127	A	90.3	Very high	91.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-26.1	-179.8	0	0	0	0	0	113.6	T61 V65 I123 A124 L129 Y130 V135 M249	T61-A127 HydrophobicContact CG2-CB 3.74Å; V65-A127 HydrophobicContact CG2-CB 3.78Å; I123-A127 WeakPolarHBondContact O-CB 3.34Å; I123-A127 PolarHBondContact O-N 3.29Å; A124-A127 PolarHBondContact O-N 3.04Å; A127-L129 PolarHBondContact O-N 3.41Å; A127-Y130 PolarHBondContact O-N 3.03Å; A127-V135 HydrophobicContact CB-CG1 4.07Å; A127-V135 HydrophobicContact CB-CG2 3.96Å; A127-M249 HydrophobicContact CB-CE 4.37Å
128	T	90	Very high	91.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-59.3	-28.8	175.2	63.8	0	0	0	0	112.9	V64 I74 T75 A124 S125 D126 Y130 K258	V64-T128 HydrophobicContact CG1-CG2 3.76Å; I74-T128 HydrophobicContact CB-CG2 4.24Å; I74-T128 HydrophobicContact CD1-CG2 4.42Å; I74-T128 HydrophobicContact CG2-CG2 4.03Å; T75-T128 WeakPolarHBondContact CG2-OG1 3.3Å; A124-T128 VanDerWaalsContact O-CG2 3.25Å; A124-T128 WeakPolarHBondContact O-CG2 3.45Å; A124-T128 PolarHBondContact O-N 3.05Å; A124-T128 VanDerWaalsContact O-N 3.1Å; S125-T128 PolarHBondContact O-N 3.28Å; S125-T128 PolarHBondContact O-OG1 3.33Å; D126-T128 VanDerWaalsContact C-N 3.28Å; D126-T128 PolarHBondContact O-N 3.17Å; T128-Y130 PolarHBondContact O-N 2.89Å; T128-K258 PolarHBondContact O-NZ 3.44Å
129	L	86.9	Confident	91	Very high	21 Å²	21	27.1 Å²	27.1	11%	0.11	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.3	178.7	-55.4	175.6	0	0	0	112.7	T75 D126 A127 Y185 L257 K258	T75-L129 HydrophobicContact CG2-CD2 4.35Å; D126-L129 VanDerWaalsContact O-CB 3.32Å; D126-L129 WeakPolarHBondContact O-CB 3.48Å; D126-L129 WeakPolarHBondContact O-CG 3.34Å; D126-L129 PolarHBondContact O-N 2.93Å; A127-L129 PolarHBondContact O-N 3.41Å; L129-Y185 HydrophobicContact CD1-CE1 4.24Å; L129-L257 HydrophobicContact CB-CD1 3.7Å; L129-L257 WeakPolarHBondContact O-CD1 3.17Å; L129-K258 PolarHBondContact O-N 3.02Å
130	Y	89.2	Confident	91	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-108	159.4	-175	-63.5	-106.6	0	0	0	112	D126 A127 T128 L195 M249 T253 G256 L257 K258	D126-Y130 VanDerWaalsContact O-CD2 3.28Å; D126-Y130 WeakPolarHBondContact O-CD2 3.17Å; A127-Y130 PolarHBondContact O-N 3.03Å; T128-Y130 PolarHBondContact O-N 2.89Å; Y130-L195 VanDerWaalsContact OH-CD2 3.22Å; Y130-L195 WeakPolarHBondContact OH-CD2 3.43Å; Y130-M249 HydrophobicContact CD1-CE 3.8Å; Y130-M249 HydrophobicContact CD2-CE 3.27Å; Y130-M249 HydrophobicContact CE1-CE 4.08Å; Y130-M249 VanDerWaalsContact CE1-O 3.3Å; Y130-M249 WeakPolarHBondContact CE1-O 3.39Å; Y130-M249 HydrophobicContact CE2-CE 3.62Å; Y130-M249 HydrophobicContact CG-CE 3.38Å; Y130-M249 PolarHBondContact OH-O 3.35Å; Y130-T253 PolarHBondContact OH-OG1 2.93Å; Y130-G256 CarbonylContact C-O 3.59Å; Y130-G256 WeakPolarHBondContact CA-O 3.47Å; Y130-L257 HydrophobicContact CD2-CD1 4.44Å; Y130-L257 HydrophobicContact CE2-CD1 4.25Å; Y130-K258 WeakPolarHBondContact O-CE 3.3Å; Y130-K258 PolarHBondContact O-NZ 3.11Å
131	F	87.6	Confident	91	Very high	92 Å²	92	30.6 Å²	30.6	40%	0.404	18%	0.179	S	C	.	.			trans	-66.3	139.9	169.6	-67.2	-75	0	0	0	111.6	A133 I134 V135 G256 K258	F131-A133 VanDerWaalsContact C-N 3.25Å; F131-A133 PolarHBondContact O-N 3.34Å; F131-I134 HydrophobicContact CB-CD1 4.32Å; F131-I134 HydrophobicContact CD2-CD1 4.44Å; F131-I134 PolarHBondContact O-N 2.71Å; F131-V135 PolarHBondContact O-N 3.17Å; F131-V135 VanDerWaalsContact O-N 3.11Å; F131-G256 VanDerWaalsContact CD2-O 3.28Å; F131-G256 WeakPolarHBondContact CD2-O 3.28Å; F131-G256 PolarHBondContact N-O 3.42Å; F131-K258 HydrophobicContact CD1-CG 3.79Å; F131-K258 HydrophobicContact CD2-CG 4.27Å; F131-K258 HydrophobicContact CE1-CG 3.77Å; F131-K258 HydrophobicContact CE2-CG 4.25Å; F131-K258 HydrophobicContact CG-CG 4.05Å; F131-K258 HydrophobicContact CZ-CB 4.39Å; F131-K258 HydrophobicContact CZ-CG 4.01Å
132	E	88.4	Confident	91	Very high	77 Å²	77	27.4 Å²	27.4	36%	0.36	16%	0.163	S	C	.	.	H	α-helix	trans	-57.5	-39.1	-175.1	-42	-175.9	-176.7	0	0	112.3	V65 I134 V135 N136	V65-E132 HydrophobicContact CG1-CB 3.86Å; V65-E132 HydrophobicContact CG1-CG 3.6Å; E132-I134 VanDerWaalsContact C-N 3.27Å; E132-I134 PolarHBondContact O-N 2.88Å; E132-V135 PolarHBondContact O-N 3.47Å; E132-N136 PolarHBondContact O-N 2.91Å; E132-N136 PolarHBondContact O-ND2 2.99Å
133	A	89.1	Confident	91	Very high	69 Å²	69	29.5 Å²	29.5	57%	0.57	18%	0.175	S	C	*	.	H	α-helix	trans	-59.2	-39.8	176.8	0	0	0	0	0	111.9	F131 V137	F131-A133 VanDerWaalsContact C-N 3.25Å; F131-A133 PolarHBondContact O-N 3.34Å; A133-V137 WeakPolarHBondContact O-CB 3.43Å; A133-V137 WeakPolarHBondContact O-CG2 3.31Å; A133-V137 PolarHBondContact O-N 3.5Å
134	I	89.2	Confident	91.1	Very high	33 Å²	33	33.5 Å²	33.5	17%	0.169	20%	0.2	C	C	.	.	H	α-helix	trans	-76	-41.2	-177.1	-68.1	168.4	0	0	0	110.4	F131 E132 N136 V137 M138	F131-I134 HydrophobicContact CB-CD1 4.32Å; F131-I134 HydrophobicContact CD2-CD1 4.44Å; F131-I134 PolarHBondContact O-N 2.71Å; E132-I134 VanDerWaalsContact C-N 3.27Å; E132-I134 PolarHBondContact O-N 2.88Å; I134-N136 VanDerWaalsContact C-N 3.29Å; I134-N136 PolarHBondContact O-N 3.47Å; I134-V137 PolarHBondContact O-N 3.35Å; I134-M138 HydrophobicContact CG2-CE 4.37Å; I134-M138 HydrophobicContact CG2-CG 4.21Å; I134-M138 WeakPolarHBondContact O-CB 3.26Å; I134-M138 VanDerWaalsContact O-CG 3.29Å; I134-M138 WeakPolarHBondContact O-CG 3.3Å; I134-M138 PolarHBondContact O-N 3.01Å
135	V	91.7	Very high	91.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-54	-49.1	172.6	177.1	0	0	0	0	110.4	T61 A127 F131 E132 M138 F139 M249	T61-V135 HydrophobicContact CG2-CG1 4.2Å; A127-V135 HydrophobicContact CB-CG1 4.07Å; A127-V135 HydrophobicContact CB-CG2 3.96Å; F131-V135 PolarHBondContact O-N 3.17Å; F131-V135 VanDerWaalsContact O-N 3.11Å; E132-V135 PolarHBondContact O-N 3.47Å; V135-M138 PolarHBondContact O-N 2.99Å; V135-F139 HydrophobicContact CG1-CD2 3.79Å; V135-F139 HydrophobicContact CG1-CE2 3.67Å; V135-F139 VanDerWaalsContact O-CD2 3.26Å; V135-F139 WeakPolarHBondContact O-CD2 3.47Å; V135-F139 PolarHBondContact O-N 3.05Å; V135-M249 HydrophobicContact CG2-CE 3.87Å; V135-M249 HydrophobicContact CG2-SD 4.35Å
136	N	91.3	Very high	91.2	Very high	59 Å²	59	36.3 Å²	36.3	32%	0.316	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-40.7	179.5	-76	-29.6	0	0	0	113.3	N62 E132 I134 F139 G140	N62-N136 PolarHBondContact OD1-OD1 2.77Å; E132-N136 PolarHBondContact O-N 2.91Å; E132-N136 PolarHBondContact O-ND2 2.99Å; I134-N136 VanDerWaalsContact C-N 3.29Å; I134-N136 PolarHBondContact O-N 3.47Å; N136-F139 PolarHBondContact O-N 2.85Å; N136-G140 PolarHBondContact O-N 3.37Å
137	V	92.8	Very high	91.4	Very high	86 Å²	86	40.1 Å²	40.1	52%	0.521	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-43.6	174.2	170.8	0	0	0	0	110.7	A133 I134 F139 G140 V141	A133-V137 WeakPolarHBondContact O-CB 3.43Å; A133-V137 WeakPolarHBondContact O-CG2 3.31Å; A133-V137 PolarHBondContact O-N 3.5Å; I134-V137 PolarHBondContact O-N 3.35Å; V137-F139 VanDerWaalsContact C-N 3.35Å; V137-F139 PolarHBondContact O-N 2.87Å; V137-G140 CarbonylContact O-C 3.57Å; V137-G140 WeakPolarHBondContact O-CA 3.43Å; V137-G140 PolarHBondContact O-N 3.31Å; V137-G140 VanDerWaalsContact O-N 3.11Å; V137-V141 HydrophobicContact CG1-CG2 4.3Å; V137-V141 WeakPolarHBondContact O-CG2 3.28Å; V137-V141 PolarHBondContact O-N 2.98Å
138	M	92.8	Very high	91.5	Very high	31 Å²	31	45 Å²	45	15%	0.153	26%	0.259	C	S	.	.	H	α-helix	trans	-66.3	-35.7	178.5	-68	-54.6	131.8	0	0	112.3	I134 V135 V141 S142 F245 L248 M249	I134-M138 HydrophobicContact CG2-CE 4.37Å; I134-M138 HydrophobicContact CG2-CG 4.21Å; I134-M138 WeakPolarHBondContact O-CB 3.26Å; I134-M138 VanDerWaalsContact O-CG 3.29Å; I134-M138 WeakPolarHBondContact O-CG 3.3Å; I134-M138 PolarHBondContact O-N 3.01Å; V135-M138 PolarHBondContact O-N 2.99Å; M138-V141 PolarHBondContact O-N 3.3Å; M138-S142 WeakPolarHBondContact O-CB 3.29Å; M138-S142 PolarHBondContact O-N 3.27Å; M138-S142 PolarHBondContact O-OG 2.89Å; M138-F245 HydrophobicContact CB-CE2 4.08Å; M138-L248 HydrophobicContact SD-CB 4.01Å; M138-M249 HydrophobicContact CB-CG 4.2Å; M138-M249 HydrophobicContact CB-SD 3.75Å; M138-M249 HydrophobicContact CG-CG 4.44Å; M138-M249 HydrophobicContact CG-SD 3.81Å
139	F	93.7	Very high	91.6	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-48.8	169	-90.2	-70.2	0	0	0	110.6	F54 F58 T61 I123 V135 N136 V137 V141 S142 V143 W241 F245	F54-F139 HydrophobicContact CE2-CD1 4.12Å; F54-F139 HydrophobicContact CE2-CE1 4.5Å; F54-F139 HydrophobicContact CZ-CD1 4.41Å; F58-F139 HydrophobicContact CB-CD1 4.47Å; F58-F139 HydrophobicContact CB-CE1 4.17Å; F58-F139 HydrophobicContact CD2-CB 4.01Å; F58-F139 AromaticContact CD2-CD1 3.65Å; F58-F139 HydrophobicContact CD2-CD1 3.65Å; F58-F139 AromaticContact CD2-CD2 3.86Å; F58-F139 HydrophobicContact CD2-CD2 3.86Å; F58-F139 AromaticContact CD2-CE1 3.98Å; F58-F139 HydrophobicContact CD2-CE1 3.98Å; F58-F139 HydrophobicContact CD2-CE2 4.21Å; F58-F139 AromaticContact CD2-CG 3.58Å; F58-F139 HydrophobicContact CD2-CG 3.58Å; F58-F139 HydrophobicContact CD2-CZ 4.27Å; F58-F139 HydrophobicContact CE2-CB 3.99Å; F58-F139 HydrophobicContact CE2-CD1 4.45Å; F58-F139 HydrophobicContact CE2-CD2 4.13Å; F58-F139 AromaticContact CE2-CG 3.97Å; F58-F139 HydrophobicContact CE2-CG 3.97Å; T61-F139 HydrophobicContact CG2-CE2 3.69Å; T61-F139 HydrophobicContact CG2-CZ 3.94Å; I123-F139 HydrophobicContact CG2-CZ 4.33Å; V135-F139 HydrophobicContact CG1-CD2 3.79Å; V135-F139 HydrophobicContact CG1-CE2 3.67Å; V135-F139 VanDerWaalsContact O-CD2 3.26Å; V135-F139 WeakPolarHBondContact O-CD2 3.47Å; V135-F139 PolarHBondContact O-N 3.05Å; N136-F139 PolarHBondContact O-N 2.85Å; V137-F139 VanDerWaalsContact C-N 3.35Å; V137-F139 PolarHBondContact O-N 2.87Å; F139-V141 PolarHBondContact O-N 2.95Å; F139-S142 PolarHBondContact O-N 3.44Å; F139-S142 PolarHBondContact O-OG 2.95Å; F139-V143 WeakPolarHBondContact O-CG2 3.29Å; F139-V143 PolarHBondContact O-N 3.34Å; F139-W241 HydrophobicContact CD1-CH2 4.37Å; F139-W241 AromaticContact CD1-CZ2 3.83Å; F139-W241 HydrophobicContact CD1-CZ2 3.83Å; F139-W241 AromaticContact CE1-CH2 3.7Å; F139-W241 HydrophobicContact CE1-CH2 3.7Å; F139-W241 AromaticContact CE1-CZ2 3.63Å; F139-W241 HydrophobicContact CE1-CZ2 3.63Å; F139-F245 HydrophobicContact CB-CE2 4.18Å; F139-F245 AromaticContact CD1-CD2 3.84Å; F139-F245 HydrophobicContact CD1-CD2 3.84Å; F139-F245 AromaticContact CD1-CE2 3.64Å; F139-F245 HydrophobicContact CD1-CE2 3.64Å; F139-F245 HydrophobicContact CD1-CZ 4.33Å; F139-F245 HydrophobicContact CD2-CD2 4.47Å; F139-F245 AromaticContact CD2-CE2 3.49Å; F139-F245 HydrophobicContact CD2-CE2 3.49Å; F139-F245 VanDerWaalsContact CD2-CE2 3.49Å; F139-F245 AromaticContact CD2-CZ 3.78Å; F139-F245 HydrophobicContact CD2-CZ 3.78Å; F139-F245 HydrophobicContact CE1-CD2 4.07Å; F139-F245 AromaticContact CE1-CE2 3.84Å; F139-F245 HydrophobicContact CE1-CE2 3.84Å; F139-F245 HydrophobicContact CE1-CZ 4.1Å; F139-F245 HydrophobicContact CE2-CE1 4.35Å; F139-F245 AromaticContact CE2-CE2 3.66Å; F139-F245 HydrophobicContact CE2-CE2 3.66Å; F139-F245 AromaticContact CE2-CZ 3.47Å; F139-F245 HydrophobicContact CE2-CZ 3.47Å; F139-F245 VanDerWaalsContact CE2-CZ 3.47Å; F139-F245 HydrophobicContact CG-CD2 4.06Å; F139-F245 AromaticContact CG-CE2 3.47Å; F139-F245 HydrophobicContact CG-CE2 3.47Å; F139-F245 VanDerWaalsContact CG-CE2 3.47Å; F139-F245 HydrophobicContact CG-CZ 4.18Å; F139-F245 HydrophobicContact CZ-CD2 4.45Å; F139-F245 HydrophobicContact CZ-CE1 4.13Å; F139-F245 AromaticContact CZ-CE2 3.83Å; F139-F245 HydrophobicContact CZ-CE2 3.83Å; F139-F245 AromaticContact CZ-CZ 3.64Å; F139-F245 HydrophobicContact CZ-CZ 3.64Å
140	G	93.6	Very high	91.6	Very high	38 Å²	38	45.9 Å²	45.9	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-55.9	-47.3	175.5	0	0	0	0	0	112.9	N136 V137 V143 T144	N136-G140 PolarHBondContact O-N 3.37Å; V137-G140 CarbonylContact O-C 3.57Å; V137-G140 WeakPolarHBondContact O-CA 3.43Å; V137-G140 PolarHBondContact O-N 3.31Å; V137-G140 VanDerWaalsContact O-N 3.11Å; G140-V143 PolarHBondContact O-N 3.31Å; G140-T144 WeakPolarHBondContact O-CG2 3.42Å; G140-T144 PolarHBondContact O-N 3.49Å; G140-T144 PolarHBondContact O-OG1 2.95Å
141	V	94.4	Very high	91.6	Very high	50 Å²	50	49.6 Å²	49.6	30%	0.303	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177.6	176.5	0	0	0	0	111.6	V137 M138 F139 V143 T144 L145 L248	V137-V141 HydrophobicContact CG1-CG2 4.3Å; V137-V141 WeakPolarHBondContact O-CG2 3.28Å; V137-V141 PolarHBondContact O-N 2.98Å; M138-V141 PolarHBondContact O-N 3.3Å; F139-V141 PolarHBondContact O-N 2.95Å; V141-V143 VanDerWaalsContact C-N 3.33Å; V141-V143 PolarHBondContact O-N 2.9Å; V141-T144 WeakPolarHBondContact CA-OG1 3.32Å; V141-T144 PolarHBondContact O-N 2.9Å; V141-T144 PolarHBondContact O-OG1 2.89Å; V141-L145 HydrophobicContact CG1-CD1 4.12Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CB 3.42Å; V141-L145 WeakPolarHBondContact O-CG 3.36Å; V141-L145 PolarHBondContact O-N 2.85Å; V141-L248 HydrophobicContact CB-CD1 4.31Å; V141-L248 HydrophobicContact CG1-CD1 3.87Å; V141-L248 HydrophobicContact CG1-CD2 4.09Å
142	S	93.4	Very high	91.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-39.4	179.1	75.2	0	0	0	0	112.1	M138 F139 F146 W241	M138-S142 WeakPolarHBondContact O-CB 3.29Å; M138-S142 PolarHBondContact O-N 3.27Å; M138-S142 PolarHBondContact O-OG 2.89Å; F139-S142 PolarHBondContact O-N 3.44Å; F139-S142 PolarHBondContact O-OG 2.95Å; S142-F146 WeakPolarHBondContact O-CB 3.39Å; S142-F146 PolarHBondContact O-N 3.45Å; S142-W241 PolarHBondContact OG-NE1 3.35Å
143	V	92.7	Very high	91.6	Very high	45 Å²	45	44.7 Å²	44.7	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-70.8	-42.3	177.7	174.5	0	0	0	0	111.1	F54 F139 G140 V141 F146 N147	F54-V143 HydrophobicContact CE1-CG2 3.91Å; F54-V143 HydrophobicContact CE2-CG2 3.54Å; F54-V143 HydrophobicContact CZ-CG2 3.14Å; F139-V143 WeakPolarHBondContact O-CG2 3.29Å; F139-V143 PolarHBondContact O-N 3.34Å; G140-V143 PolarHBondContact O-N 3.31Å; V141-V143 VanDerWaalsContact C-N 3.33Å; V141-V143 PolarHBondContact O-N 2.9Å; V143-F146 PolarHBondContact O-N 3.43Å; V143-N147 WeakPolarHBondContact O-CB 3.45Å; V143-N147 PolarHBondContact O-N 3.5Å; V143-N147 PolarHBondContact O-ND2 3.16Å
144	T	94.2	Very high	91.3	Very high	85 Å²	85	45.2 Å²	45.2	52%	0.521	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-40.4	177.4	55	0	0	0	0	111.4	G140 V141 N147 L148	G140-T144 WeakPolarHBondContact O-CG2 3.42Å; G140-T144 PolarHBondContact O-N 3.49Å; G140-T144 PolarHBondContact O-OG1 2.95Å; V141-T144 WeakPolarHBondContact CA-OG1 3.32Å; V141-T144 PolarHBondContact O-N 2.9Å; V141-T144 PolarHBondContact O-OG1 2.89Å; T144-N147 PolarHBondContact O-N 2.95Å; T144-L148 VanDerWaalsContact O-CB 3.3Å; T144-L148 WeakPolarHBondContact O-CB 3.15Å; T144-L148 PolarHBondContact O-N 2.82Å
145	L	93.1	Very high	91.1	Very high	44 Å²	44	49.5 Å²	49.5	23%	0.23	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-46.8	172.1	-74.5	179.5	0	0	0	111.6	V141 N147 L148 I149 L248	V141-L145 HydrophobicContact CG1-CD1 4.12Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CB 3.42Å; V141-L145 WeakPolarHBondContact O-CG 3.36Å; V141-L145 PolarHBondContact O-N 2.85Å; L145-N147 VanDerWaalsContact C-N 3.34Å; L145-N147 PolarHBondContact O-N 3.34Å; L145-L148 WeakPolarHBondContact O-CB 3.42Å; L145-L148 PolarHBondContact O-N 2.94Å; L145-I149 WeakPolarHBondContact O-CG1 3.35Å; L145-I149 PolarHBondContact O-N 2.85Å; L145-L248 HydrophobicContact CD1-CD1 4Å; L145-L248 HydrophobicContact CD1-CD2 4.08Å; L145-L248 HydrophobicContact CD1-CG 4.48Å
146	F	92.3	Very high	90.6	Very high	20 Å²	20	52.4 Å²	52.4	9%	0.088	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-45.8	178.3	-171.3	-98.5	0	0	0	112.2	S142 V143 I149 I150 L210 L237 W241	S142-F146 WeakPolarHBondContact O-CB 3.39Å; S142-F146 PolarHBondContact O-N 3.45Å; V143-F146 PolarHBondContact O-N 3.43Å; F146-I149 PolarHBondContact O-N 3.2Å; F146-I150 HydrophobicContact CD1-CD1 3.7Å; F146-I150 HydrophobicContact CE1-CD1 3.38Å; F146-I150 HydrophobicContact CE1-CG1 4.41Å; F146-I150 HydrophobicContact CZ-CD1 4.1Å; F146-I150 WeakPolarHBondContact O-CG1 3.44Å; F146-I150 PolarHBondContact O-N 2.88Å; F146-L210 HydrophobicContact CD2-CD1 3.52Å; F146-L210 HydrophobicContact CD2-CD2 4.03Å; F146-L210 HydrophobicContact CD2-CG 4.39Å; F146-L210 HydrophobicContact CE2-CD1 3.5Å; F146-L210 VanDerWaalsContact CE2-CD1 3.5Å; F146-L237 HydrophobicContact CE2-CD1 3.77Å; F146-L237 HydrophobicContact CE2-CG 4.03Å; F146-L237 HydrophobicContact CZ-CD1 3.84Å; F146-L237 HydrophobicContact CZ-CD2 3.95Å; F146-L237 HydrophobicContact CZ-CG 3.76Å; F146-W241 HydrophobicContact CD2-CB 4.15Å; F146-W241 HydrophobicContact CE2-CB 4.25Å
147	N	91.7	Very high	89.7	Confident	85 Å²	85	58.4 Å²	58.4	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-41	175.4	-74.6	-26.6	0	0	0	112.6	V143 T144 L145 I149 I150 C151	V143-N147 WeakPolarHBondContact O-CB 3.45Å; V143-N147 PolarHBondContact O-N 3.5Å; V143-N147 PolarHBondContact O-ND2 3.16Å; T144-N147 PolarHBondContact O-N 2.95Å; L145-N147 VanDerWaalsContact C-N 3.34Å; L145-N147 PolarHBondContact O-N 3.34Å; N147-I149 VanDerWaalsContact C-N 3.29Å; N147-I149 PolarHBondContact O-N 2.86Å; N147-I150 PolarHBondContact O-N 2.82Å; N147-C151 PolarHBondContact O-N 3.05Å; N147-C151 PolarHBondContact O-SG 2.8Å; N147-C151 VanDerWaalsContact O-SG 3.35Å
148	L	93	Very high	88.8	Confident	102 Å²	102	60 Å²	60	53%	0.534	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-41.7	175.9	-179.6	68.7	0	0	0	111.1	T144 L145 C151 T152	T144-L148 VanDerWaalsContact O-CB 3.3Å; T144-L148 WeakPolarHBondContact O-CB 3.15Å; T144-L148 PolarHBondContact O-N 2.82Å; L145-L148 WeakPolarHBondContact O-CB 3.42Å; L145-L148 PolarHBondContact O-N 2.94Å; L148-C151 PolarHBondContact O-N 3.42Å; L148-T152 WeakPolarHBondContact O-CB 3.44Å; L148-T152 PolarHBondContact O-N 2.99Å; L148-T152 PolarHBondContact O-OG1 2.84Å
149	I	91.4	Very high	87.6	Confident	16 Å²	16	60.9 Å²	60.9	8%	0.082	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-43.9	177.2	-65.2	-52.4	0	0	0	111.3	L145 F146 N147 C151 T152 I153 L210 L211 V214	L145-I149 WeakPolarHBondContact O-CG1 3.35Å; L145-I149 PolarHBondContact O-N 2.85Å; F146-I149 PolarHBondContact O-N 3.2Å; N147-I149 VanDerWaalsContact C-N 3.29Å; N147-I149 PolarHBondContact O-N 2.86Å; I149-C151 PolarHBondContact O-N 3.33Å; I149-T152 WeakPolarHBondContact O-CB 3.31Å; I149-T152 PolarHBondContact O-N 3.32Å; I149-I153 HydrophobicContact CG2-CG1 4.33Å; I149-I153 WeakPolarHBondContact O-CG1 3.42Å; I149-I153 PolarHBondContact O-N 3.46Å; I149-L210 HydrophobicContact CB-CD2 4.17Å; I149-L210 HydrophobicContact CB-CG 4.36Å; I149-L210 HydrophobicContact CG1-CD2 3.87Å; I149-L210 HydrophobicContact CG1-CG 4.36Å; I149-L210 HydrophobicContact CG2-CD2 4.37Å; I149-L210 HydrophobicContact CG2-CG 4.01Å; I149-L211 HydrophobicContact CD1-CD1 4.38Å; I149-L211 HydrophobicContact CD1-CD2 3.91Å; I149-L211 HydrophobicContact CD1-CG 3.92Å; I149-L211 HydrophobicContact CG2-CD2 3.71Å; I149-L211 HydrophobicContact CG2-CG 3.93Å; I149-V214 HydrophobicContact CG2-CB 4.44Å; I149-V214 HydrophobicContact CG2-CG2 4.28Å
150	I	88.9	Confident	86.6	Confident	26 Å²	26	64 Å²	64	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-57.7	-47.7	174.5	-71.7	171.1	0	0	0	111.3	L47 F146 N147 T152 I153 S154 V214 F218	L47-I150 HydrophobicContact CD2-CD1 4.14Å; F146-I150 HydrophobicContact CD1-CD1 3.7Å; F146-I150 HydrophobicContact CE1-CD1 3.38Å; F146-I150 HydrophobicContact CE1-CG1 4.41Å; F146-I150 HydrophobicContact CZ-CD1 4.1Å; F146-I150 WeakPolarHBondContact O-CG1 3.44Å; F146-I150 PolarHBondContact O-N 2.88Å; N147-I150 PolarHBondContact O-N 2.82Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.09Å; I150-I153 PolarHBondContact O-N 3.06Å; I150-S154 WeakPolarHBondContact O-CB 3.23Å; I150-S154 PolarHBondContact O-N 3.27Å; I150-S154 PolarHBondContact O-OG 3.06Å; I150-V214 HydrophobicContact CG1-CG1 3.98Å; I150-V214 HydrophobicContact CG1-CG2 4.45Å; I150-F218 HydrophobicContact CB-CZ 4.48Å; I150-F218 HydrophobicContact CD1-CE2 4.48Å; I150-F218 HydrophobicContact CG1-CE2 4.14Å; I150-F218 HydrophobicContact CG1-CZ 4.32Å; I150-F218 HydrophobicContact CG2-CE1 4.06Å; I150-F218 HydrophobicContact CG2-CE2 4.1Å; I150-F218 HydrophobicContact CG2-CZ 3.48Å; I150-F218 VanDerWaalsContact CG2-CZ 3.48Å
151	C	88.8	Confident	85.5	Confident	79 Å²	79	62.2 Å²	62.2	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-43.5	176.1	-71.8	0	0	0	0	111.5	N147 L148 I149 S154 V155	N147-C151 PolarHBondContact O-N 3.05Å; N147-C151 PolarHBondContact O-SG 2.8Å; N147-C151 VanDerWaalsContact O-SG 3.35Å; L148-C151 PolarHBondContact O-N 3.42Å; I149-C151 PolarHBondContact O-N 3.33Å; C151-S154 WeakPolarHBondContact O-CB 3.37Å; C151-S154 PolarHBondContact O-N 3.39Å; C151-V155 PolarHBondContact O-N 3.4Å
152	T	88.6	Confident	84.6	Confident	60 Å²	60	66.6 Å²	66.6	37%	0.368	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-48.2	178.6	-56.3	0	0	0	0	111.3	L148 I149 I150 S154 V155 L156	L148-T152 WeakPolarHBondContact O-CB 3.44Å; L148-T152 PolarHBondContact O-N 2.99Å; L148-T152 PolarHBondContact O-OG1 2.84Å; I149-T152 WeakPolarHBondContact O-CB 3.31Å; I149-T152 PolarHBondContact O-N 3.32Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.09Å; T152-S154 VanDerWaalsContact C-N 3.3Å; T152-S154 PolarHBondContact O-N 2.91Å; T152-V155 PolarHBondContact O-N 3.39Å; T152-V155 VanDerWaalsContact O-N 3.16Å; T152-L156 VanDerWaalsContact O-CB 3.24Å; T152-L156 WeakPolarHBondContact O-CB 3.35Å; T152-L156 PolarHBondContact O-N 2.96Å
153	I	86.6	Confident	83.7	Confident	6 Å²	6	72.8 Å²	72.8	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-34.8	179.2	-69.6	-56.3	0	0	0	112.2	I149 I150 V155 L156 L211 V214 K215 F218	I149-I153 HydrophobicContact CG2-CG1 4.33Å; I149-I153 WeakPolarHBondContact O-CG1 3.42Å; I149-I153 PolarHBondContact O-N 3.46Å; I150-I153 PolarHBondContact O-N 3.06Å; I153-V155 PolarHBondContact O-N 2.76Å; I153-L156 HydrophobicContact CD1-CD2 4.2Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L211 HydrophobicContact CD1-CD2 3.67Å; I153-L211 HydrophobicContact CG1-CD2 4.03Å; I153-V214 HydrophobicContact CB-CG1 4.01Å; I153-V214 HydrophobicContact CG1-CB 4.33Å; I153-V214 HydrophobicContact CG1-CG1 3.92Å; I153-V214 HydrophobicContact CG2-CG1 4.1Å; I153-K215 HydrophobicContact CD1-CB 4.16Å; I153-K215 HydrophobicContact CD1-CD 4.32Å; I153-K215 HydrophobicContact CG2-CB 4.27Å; I153-K215 HydrophobicContact CG2-CD 3.72Å; I153-F218 HydrophobicContact CG2-CB 4.47Å
154	S	82.1	Confident	82.9	Confident	80 Å²	80	75.8 Å²	75.8	56%	0.559	39%	0.386	S	S	*	.	H	α-helix	trans	-62.2	-28	176.9	-58.8	0	0	0	0	112.6	I150 C151 T152	I150-S154 WeakPolarHBondContact O-CB 3.23Å; I150-S154 PolarHBondContact O-N 3.27Å; I150-S154 PolarHBondContact O-OG 3.06Å; C151-S154 WeakPolarHBondContact O-CB 3.37Å; C151-S154 PolarHBondContact O-N 3.39Å; T152-S154 VanDerWaalsContact C-N 3.3Å; T152-S154 PolarHBondContact O-N 2.91Å
155	V	85.1	Confident	82.1	Confident	122 Å²	122	76.3 Å²	76.3	74%	0.739	39%	0.389	S	S	*	.	H	α-helix	trans	-95	-29	177.5	-180	0	0	0	0	111.7	C151 T152 I153 Q157	C151-V155 PolarHBondContact O-N 3.4Å; T152-V155 PolarHBondContact O-N 3.39Å; T152-V155 VanDerWaalsContact O-N 3.16Å; I153-V155 PolarHBondContact O-N 2.76Å; V155-Q157 PolarHBondContact O-N 2.92Å
156	L	82.3	Confident	81.6	Confident	62 Å²	62	78.4 Å²	78.4	33%	0.325	40%	0.4	S	S	.	.			trans	-77.1	113.2	-171.6	-169.3	60.2	0	0	0	112.6	T152 I153 F158 F160 K215	T152-L156 VanDerWaalsContact O-CB 3.24Å; T152-L156 WeakPolarHBondContact O-CB 3.35Å; T152-L156 PolarHBondContact O-N 2.96Å; I153-L156 HydrophobicContact CD1-CD2 4.2Å; I153-L156 PolarHBondContact O-N 2.95Å; L156-F158 HydrophobicContact CD1-CB 4.28Å; L156-F158 HydrophobicContact CG-CB 4.35Å; L156-F160 HydrophobicContact CD2-CE2 3.64Å; L156-F160 HydrophobicContact CD2-CZ 4.44Å; L156-F160 HydrophobicContact CG-CE2 4.37Å; L156-K215 PolarHBondContact O-NZ 3.45Å
157	Q	73.1	Confident	81.1	Confident	184 Å²	184	77.7 Å²	77.7	86%	0.86	40%	0.397	S	S	*	.			trans	-83.1	-11.8	178.5	-63.3	-172.5	-7.7	0	0	114.2	V155	V155-Q157 PolarHBondContact O-N 2.92Å
158	F	73	Confident	80.7	Confident	119 Å²	119	76 Å²	76	52%	0.522	39%	0.388	S	S	.	.			trans	-71.4	138.3	-179.2	-167.2	-85.4	0	0	0	111.5	L156 F160 K215	L156-F158 HydrophobicContact CD1-CB 4.28Å; L156-F158 HydrophobicContact CG-CB 4.35Å; F158-F160 HydrophobicContact CB-CE2 3.92Å; F158-F160 HydrophobicContact CB-CZ 4.05Å; F158-F160 AromaticContact CD1-CD1 3.48Å; F158-F160 HydrophobicContact CD1-CD1 3.48Å; F158-F160 VanDerWaalsContact CD1-CD1 3.48Å; F158-F160 AromaticContact CD1-CD2 3.72Å; F158-F160 HydrophobicContact CD1-CD2 3.72Å; F158-F160 AromaticContact CD1-CE1 3.19Å; F158-F160 HydrophobicContact CD1-CE1 3.19Å; F158-F160 AromaticContact CD1-CE2 3.42Å; F158-F160 HydrophobicContact CD1-CE2 3.42Å; F158-F160 VanDerWaalsContact CD1-CE2 3.42Å; F158-F160 AromaticContact CD1-CG 3.74Å; F158-F160 HydrophobicContact CD1-CG 3.74Å; F158-F160 AromaticContact CD1-CZ 3.16Å; F158-F160 HydrophobicContact CD1-CZ 3.16Å; F158-F160 AromaticContact CE1-CD1 3.41Å; F158-F160 HydrophobicContact CE1-CD1 3.41Å; F158-F160 VanDerWaalsContact CE1-CD1 3.41Å; F158-F160 HydrophobicContact CE1-CD2 4.46Å; F158-F160 AromaticContact CE1-CE1 3.26Å; F158-F160 HydrophobicContact CE1-CE1 3.26Å; F158-F160 HydrophobicContact CE1-CE2 4.33Å; F158-F160 HydrophobicContact CE1-CG 4.03Å; F158-F160 AromaticContact CE1-CZ 3.77Å; F158-F160 HydrophobicContact CE1-CZ 3.77Å; F158-F160 HydrophobicContact CG-CE1 4.19Å; F158-F160 HydrophobicContact CG-CE2 4.06Å; F158-F160 AromaticContact CG-CZ 3.81Å; F158-F160 HydrophobicContact CG-CZ 3.81Å; F158-F160 HydrophobicContact CZ-CE1 4.32Å; F158-K215 WeakPolarHBondContact O-CE 3.34Å
159	D	67.6	Low	80.4	Confident	51 Å²	51	77.5 Å²	77.5	27%	0.273	39%	0.39	S	S	.	.			trans	-99.7	105.4	179.2	-171.8	6.6	0	0	0	111.7	T161 G221 E222	D159-T161 VanDerWaalsContact OD1-CB 3.28Å; D159-T161 WeakPolarHBondContact OD1-CB 3.44Å; D159-T161 WeakPolarHBondContact OD1-CG2 3.3Å; D159-T161 PolarHBondContact OD1-N 2.94Å; D159-T161 PolarHBondContact OD1-OG1 3.4Å; D159-T161 PolarHBondContact OD2-OG1 3.47Å; D159-G221 WeakPolarHBondContact OD1-CA 3.05Å; D159-G221 WeakPolarHBondContact OD2-CA 3.49Å; D159-E222 PolarHBondContact OD2-N 3Å
160	F	71.8	Confident	80.2	Confident	70 Å²	70	77.7 Å²	77.7	31%	0.307	39%	0.392	S	S	.	.			trans	-90.9	-9.6	173.6	-58.9	-79.6	0	0	0	112.8	L156 F158 K162 Y163 Y212	L156-F160 HydrophobicContact CD2-CE2 3.64Å; L156-F160 HydrophobicContact CD2-CZ 4.44Å; L156-F160 HydrophobicContact CG-CE2 4.37Å; F158-F160 HydrophobicContact CB-CE2 3.92Å; F158-F160 HydrophobicContact CB-CZ 4.05Å; F158-F160 AromaticContact CD1-CD1 3.48Å; F158-F160 HydrophobicContact CD1-CD1 3.48Å; F158-F160 VanDerWaalsContact CD1-CD1 3.48Å; F158-F160 AromaticContact CD1-CD2 3.72Å; F158-F160 HydrophobicContact CD1-CD2 3.72Å; F158-F160 AromaticContact CD1-CE1 3.19Å; F158-F160 HydrophobicContact CD1-CE1 3.19Å; F158-F160 AromaticContact CD1-CE2 3.42Å; F158-F160 HydrophobicContact CD1-CE2 3.42Å; F158-F160 VanDerWaalsContact CD1-CE2 3.42Å; F158-F160 AromaticContact CD1-CG 3.74Å; F158-F160 HydrophobicContact CD1-CG 3.74Å; F158-F160 AromaticContact CD1-CZ 3.16Å; F158-F160 HydrophobicContact CD1-CZ 3.16Å; F158-F160 AromaticContact CE1-CD1 3.41Å; F158-F160 HydrophobicContact CE1-CD1 3.41Å; F158-F160 VanDerWaalsContact CE1-CD1 3.41Å; F158-F160 HydrophobicContact CE1-CD2 4.46Å; F158-F160 AromaticContact CE1-CE1 3.26Å; F158-F160 HydrophobicContact CE1-CE1 3.26Å; F158-F160 HydrophobicContact CE1-CE2 4.33Å; F158-F160 HydrophobicContact CE1-CG 4.03Å; F158-F160 AromaticContact CE1-CZ 3.77Å; F158-F160 HydrophobicContact CE1-CZ 3.77Å; F158-F160 HydrophobicContact CG-CE1 4.19Å; F158-F160 HydrophobicContact CG-CE2 4.06Å; F158-F160 AromaticContact CG-CZ 3.81Å; F158-F160 HydrophobicContact CG-CZ 3.81Å; F158-F160 HydrophobicContact CZ-CE1 4.32Å; F160-K162 PolarHBondContact O-N 2.93Å; F160-K162 VanDerWaalsContact O-N 3.12Å; F160-Y163 PolarHBondContact O-N 3.31Å; F160-Y212 HydrophobicContact CB-CD2 4.4Å; F160-Y212 VanDerWaalsContact O-CE2 3.27Å; F160-Y212 WeakPolarHBondContact O-CE2 3.46Å
161	T	72.2	Confident	80	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-65.4	-22.9	-166.6	66.4	0	0	0	0	113.1	D159 Y163 Y164 Y212 K215 M216 E222 F223	D159-T161 VanDerWaalsContact OD1-CB 3.28Å; D159-T161 WeakPolarHBondContact OD1-CB 3.44Å; D159-T161 WeakPolarHBondContact OD1-CG2 3.3Å; D159-T161 PolarHBondContact OD1-N 2.94Å; D159-T161 PolarHBondContact OD1-OG1 3.4Å; D159-T161 PolarHBondContact OD2-OG1 3.47Å; T161-Y163 PolarHBondContact O-N 3.19Å; T161-Y164 PolarHBondContact O-N 2.9Å; T161-Y212 PolarHBondContact O-OH 2.88Å; T161-K215 HydrophobicContact CG2-CB 4.47Å; T161-K215 HydrophobicContact CG2-CG 3.89Å; T161-M216 HydrophobicContact CG2-CG 3.96Å; T161-E222 PolarHBondContact OG1-N 3.43Å; T161-F223 WeakPolarHBondContact O-CD2 3.44Å; T161-F223 PolarHBondContact OG1-N 3.31Å; T161-F223 VanDerWaalsContact OG1-N 3.1Å
162	K	75.2	Confident	79.9	Confident	141 Å²	141	75.5 Å²	75.5	61%	0.613	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-54.6	-25.9	176.9	-167.1	171	-175.6	171.9	0	114.4	F160 Y164	F160-K162 PolarHBondContact O-N 2.93Å; F160-K162 VanDerWaalsContact O-N 3.12Å; K162-Y164 VanDerWaalsContact C-N 3.3Å; K162-Y164 PolarHBondContact O-N 3.42Å
163	Y	74.1	Confident	79.9	Confident	131 Å²	131	77.2 Å²	77.2	51%	0.514	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-92	37.1	-178.3	-59.8	-70.4	0	0	0	113.7	F160 T161 T165 I166 N167	F160-Y163 PolarHBondContact O-N 3.31Å; T161-Y163 PolarHBondContact O-N 3.19Å; Y163-T165 VanDerWaalsContact C-N 3.33Å; Y163-T165 PolarHBondContact O-N 2.95Å; Y163-I166 HydrophobicContact CD1-CD1 3.63Å; Y163-I166 HydrophobicContact CE1-CD1 4.47Å; Y163-I166 HydrophobicContact CG-CD1 4.14Å; Y163-I166 WeakPolarHBondContact O-CB 3.33Å; Y163-I166 PolarHBondContact O-N 3.48Å; Y163-N167 PolarHBondContact O-N 3.37Å; Y163-N167 VanDerWaalsContact O-N 3.07Å
164	Y	75.1	Confident	80	Confident	108 Å²	108	77 Å²	77	42%	0.424	38%	0.377	S	S	.	.	H	α-helix	trans	-52	-46.1	-177.9	178.7	-100.2	0	0	0	114	T161 K162 I166 N167 L168 Y212 M216	T161-Y164 PolarHBondContact O-N 2.9Å; K162-Y164 VanDerWaalsContact C-N 3.3Å; K162-Y164 PolarHBondContact O-N 3.42Å; Y164-I166 VanDerWaalsContact C-N 3.26Å; Y164-I166 PolarHBondContact O-N 2.99Å; Y164-N167 WeakPolarHBondContact O-CB 3.46Å; Y164-N167 PolarHBondContact O-N 3.42Å; Y164-N167 VanDerWaalsContact O-N 3.12Å; Y164-L168 PolarHBondContact O-N 2.71Å; Y164-Y212 WeakPolarHBondContact CA-OH 3.41Å; Y164-Y212 VanDerWaalsContact CB-OH 3.29Å; Y164-Y212 WeakPolarHBondContact CB-OH 3.44Å; Y164-Y212 HydrophobicContact CD2-CE1 4.35Å; Y164-Y212 PolarHBondContact N-OH 2.98Å; Y164-M216 HydrophobicContact CD2-CE 4.33Å; Y164-M216 HydrophobicContact CD2-SD 4.03Å; Y164-M216 HydrophobicContact CE2-CE 4.29Å; Y164-M216 HydrophobicContact CE2-SD 4.42Å
165	T	77.3	Confident	80.1	Confident	96 Å²	96	74.1 Å²	74.1	59%	0.589	36%	0.355	S	S	*	.	H	α-helix	trans	-61.8	-35.6	178.8	-43.1	0	0	0	0	112	Y163 L168 F169	Y163-T165 VanDerWaalsContact C-N 3.33Å; Y163-T165 PolarHBondContact O-N 2.95Å; T165-L168 PolarHBondContact O-N 3.45Å; T165-F169 HydrophobicContact CG2-CD2 4.37Å; T165-F169 HydrophobicContact CG2-CE2 3.95Å; T165-F169 WeakPolarHBondContact O-CD2 3.39Å; T165-F169 PolarHBondContact O-N 3.34Å
166	I	83.2	Confident	80.3	Confident	89 Å²	89	73.7 Å²	73.7	46%	0.456	35%	0.346	S	S	.	.	H	α-helix	trans	-67.8	-42.6	176.5	-58.4	-177.9	0	0	0	110	Y163 Y164 L168 F169 V170	Y163-I166 HydrophobicContact CD1-CD1 3.63Å; Y163-I166 HydrophobicContact CE1-CD1 4.47Å; Y163-I166 HydrophobicContact CG-CD1 4.14Å; Y163-I166 WeakPolarHBondContact O-CB 3.33Å; Y163-I166 PolarHBondContact O-N 3.48Å; Y164-I166 VanDerWaalsContact C-N 3.26Å; Y164-I166 PolarHBondContact O-N 2.99Å; I166-L168 VanDerWaalsContact C-N 3.27Å; I166-L168 PolarHBondContact O-N 2.98Å; I166-F169 PolarHBondContact O-N 3.47Å; I166-F169 VanDerWaalsContact O-N 3.14Å; I166-V170 HydrophobicContact CG2-CG2 4.29Å; I166-V170 WeakPolarHBondContact O-CG2 3.31Å; I166-V170 PolarHBondContact O-N 2.97Å
167	N	82.3	Confident	80.6	Confident	4 Å²	4	71.8 Å²	71.8	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-36.8	177.1	-177.8	61.3	0	0	0	112.3	Y163 Y164 V170 S171 Y212 E213	Y163-N167 PolarHBondContact O-N 3.37Å; Y163-N167 VanDerWaalsContact O-N 3.07Å; Y164-N167 WeakPolarHBondContact O-CB 3.46Å; Y164-N167 PolarHBondContact O-N 3.42Å; Y164-N167 VanDerWaalsContact O-N 3.12Å; N167-V170 PolarHBondContact O-N 2.63Å; N167-S171 PolarHBondContact O-N 2.6Å; N167-Y212 HydrophobicContact CB-CD1 3.69Å; N167-Y212 HydrophobicContact CB-CD2 4.26Å; N167-Y212 HydrophobicContact CB-CE1 3.6Å; N167-Y212 HydrophobicContact CB-CE2 4.19Å; N167-Y212 HydrophobicContact CB-CG 4.05Å; N167-Y212 WeakPolarHBondContact ND2-CD1 3.2Å; N167-Y212 VanDerWaalsContact ND2-CE1 3.31Å; N167-Y212 WeakPolarHBondContact ND2-CE1 3.41Å; N167-E213 PolarHBondContact ND2-OE1 2.93Å
168	L	82	Confident	81.1	Confident	49 Å²	49	63.4 Å²	63.4	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-59.9	-47.9	173.4	-168.4	161.5	0	0	0	111.1	M96 Y164 T165 I166 V170 S171 L172	M96-L168 HydrophobicContact SD-CG 4.41Å; Y164-L168 PolarHBondContact O-N 2.71Å; T165-L168 PolarHBondContact O-N 3.45Å; I166-L168 VanDerWaalsContact C-N 3.27Å; I166-L168 PolarHBondContact O-N 2.98Å; L168-V170 PolarHBondContact O-N 3.48Å; L168-S171 PolarHBondContact O-N 2.89Å; L168-L172 HydrophobicContact CD2-CD1 3.59Å; L168-L172 HydrophobicContact CD2-CG 4.13Å; L168-L172 PolarHBondContact O-N 2.96Å
169	F	87.2	Confident	81.8	Confident	135 Å²	135	60.8 Å²	60.8	59%	0.592	29%	0.289	S	S	*	.	H	α-helix	trans	-62.1	-41.7	175.5	-75.7	-68.3	0	0	0	112.7	T165 I166 S171 L172 F173	T165-F169 HydrophobicContact CG2-CD2 4.37Å; T165-F169 HydrophobicContact CG2-CE2 3.95Å; T165-F169 WeakPolarHBondContact O-CD2 3.39Å; T165-F169 PolarHBondContact O-N 3.34Å; I166-F169 PolarHBondContact O-N 3.47Å; I166-F169 VanDerWaalsContact O-N 3.14Å; F169-S171 VanDerWaalsContact C-N 3.31Å; F169-S171 PolarHBondContact O-N 3.03Å; F169-L172 PolarHBondContact O-N 3.07Å; F169-F173 VanDerWaalsContact O-CB 3.3Å; F169-F173 WeakPolarHBondContact O-CB 3.3Å; F169-F173 PolarHBondContact O-N 2.96Å
170	V	87.2	Confident	82.8	Confident	20 Å²	20	63.7 Å²	63.7	12%	0.121	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-41.2	175.9	171.9	0	0	0	0	110.7	I166 N167 L168 F173 I174 F205 F208	I166-V170 HydrophobicContact CG2-CG2 4.29Å; I166-V170 WeakPolarHBondContact O-CG2 3.31Å; I166-V170 PolarHBondContact O-N 2.97Å; N167-V170 PolarHBondContact O-N 2.63Å; L168-V170 PolarHBondContact O-N 3.48Å; V170-F173 PolarHBondContact O-N 3.2Å; V170-I174 HydrophobicContact CG1-CD1 3.86Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 WeakPolarHBondContact O-CD1 3.47Å; V170-I174 VanDerWaalsContact O-CG1 3.28Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 2.96Å; V170-F205 HydrophobicContact CG1-CB 4.19Å; V170-F205 HydrophobicContact CG1-CD1 4.17Å; V170-F208 HydrophobicContact CG1-CD1 4.39Å
171	S	85.5	Confident	83.4	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-63.8	-48.3	177.2	-172	0	0	0	0	112.1	M96 N167 L168 F169 F173 I174 D175 K209	M96-S171 WeakPolarHBondContact CE-OG 3.3Å; N167-S171 PolarHBondContact O-N 2.6Å; L168-S171 PolarHBondContact O-N 2.89Å; F169-S171 VanDerWaalsContact C-N 3.31Å; F169-S171 PolarHBondContact O-N 3.03Å; S171-F173 PolarHBondContact O-N 3.37Å; S171-I174 PolarHBondContact O-N 3.42Å; S171-D175 PolarHBondContact O-N 3.31Å; S171-K209 VanDerWaalsContact OG-CE 3.26Å; S171-K209 WeakPolarHBondContact OG-CE 3.47Å; S171-K209 PolarHBondContact OG-NZ 2.67Å
172	L	86.2	Confident	84	Confident	55 Å²	55	61.2 Å²	61.2	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-37.2	177.1	-69.5	176.9	0	0	0	111.6	M96 F97 L168 F169 M176	M96-L172 HydrophobicContact SD-CD2 4.16Å; M96-L172 HydrophobicContact SD-CG 4.47Å; F97-L172 HydrophobicContact CE2-CD2 4.35Å; F97-L172 HydrophobicContact CZ-CD1 4.25Å; F97-L172 HydrophobicContact CZ-CD2 4.03Å; L168-L172 HydrophobicContact CD2-CD1 3.59Å; L168-L172 HydrophobicContact CD2-CG 4.13Å; L168-L172 PolarHBondContact O-N 2.96Å; F169-L172 PolarHBondContact O-N 3.07Å; L172-M176 WeakPolarHBondContact O-CB 3.33Å; L172-M176 VanDerWaalsContact O-CG 3.23Å; L172-M176 WeakPolarHBondContact O-CG 3.22Å; L172-M176 PolarHBondContact O-N 3.44Å
173	F	89	Confident	84.5	Confident	97 Å²	97	57.6 Å²	57.6	43%	0.425	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-46.6	176.3	179.1	-102.2	0	0	0	112.1	F169 V170 S171 D175 M176 V177 F205	F169-F173 VanDerWaalsContact O-CB 3.3Å; F169-F173 WeakPolarHBondContact O-CB 3.3Å; F169-F173 PolarHBondContact O-N 2.96Å; V170-F173 PolarHBondContact O-N 3.2Å; S171-F173 PolarHBondContact O-N 3.37Å; F173-D175 PolarHBondContact O-N 2.98Å; F173-M176 PolarHBondContact O-N 2.79Å; F173-V177 HydrophobicContact CD1-CG2 4.18Å; F173-V177 HydrophobicContact CD2-CG2 4.44Å; F173-V177 HydrophobicContact CE1-CG2 3.74Å; F173-V177 HydrophobicContact CE2-CG2 4.03Å; F173-V177 HydrophobicContact CZ-CG2 3.66Å; F173-V177 WeakPolarHBondContact O-CG2 3.36Å; F173-V177 PolarHBondContact O-N 3.05Å; F173-F205 HydrophobicContact CD1-CD2 4.38Å; F173-F205 HydrophobicContact CD1-CE2 4.47Å; F173-F205 HydrophobicContact CD1-CG 4.47Å; F173-F205 AromaticContact CE1-CD2 3.98Å; F173-F205 HydrophobicContact CE1-CD2 3.98Å; F173-F205 AromaticContact CE1-CE2 3.77Å; F173-F205 HydrophobicContact CE1-CE2 3.77Å; F173-F205 HydrophobicContact CE1-CZ 4.09Å
174	I	88.1	Confident	85	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-49.9	175.9	-68.3	158.8	0	0	0	110.3	V170 S171 M176 V177 L178 F205 T206 K209	V170-I174 HydrophobicContact CG1-CD1 3.86Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 WeakPolarHBondContact O-CD1 3.47Å; V170-I174 VanDerWaalsContact O-CG1 3.28Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 2.96Å; S171-I174 PolarHBondContact O-N 3.42Å; I174-M176 PolarHBondContact O-N 3.47Å; I174-V177 PolarHBondContact O-N 3.01Å; I174-V177 VanDerWaalsContact O-N 3.09Å; I174-L178 HydrophobicContact CG2-CD1 3.97Å; I174-L178 HydrophobicContact CG2-CG 4.27Å; I174-L178 WeakPolarHBondContact O-CG 3.46Å; I174-L178 PolarHBondContact O-N 3.47Å; I174-F205 HydrophobicContact CD1-CB 3.74Å; I174-F205 WeakPolarHBondContact CD1-O 3.28Å; I174-F205 HydrophobicContact CG1-CB 3.58Å; I174-T206 HydrophobicContact CD1-CG2 4.27Å; I174-T206 HydrophobicContact CG1-CG2 4.47Å; I174-T206 HydrophobicContact CG2-CG2 3.77Å; I174-K209 HydrophobicContact CD1-CB 4.02Å; I174-K209 HydrophobicContact CD1-CD 3.81Å
175	D	85.6	Confident	85.3	Confident	19 Å²	19	47.1 Å²	47.1	10%	0.102	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-38	-178	-62.8	-21.3	0	0	0	110.8	Q92 S171 F173 L179	Q92-D175 PolarHBondContact NE2-OD1 3.37Å; Q92-D175 PolarHBondContact NE2-OD2 2.81Å; S171-D175 PolarHBondContact O-N 3.31Å; F173-D175 PolarHBondContact O-N 2.98Å; D175-L179 WeakPolarHBondContact O-CB 3.43Å; D175-L179 PolarHBondContact O-N 3.37Å
176	M	87.8	Confident	85.6	Confident	113 Å²	113	44.6 Å²	44.6	56%	0.557	23%	0.225	S	C	*	.	H	α-helix	trans	-68.7	-42.7	173.9	-73.6	-68.3	174.3	0	0	113.1	L172 F173 I174 L178 L179 I180	L172-M176 WeakPolarHBondContact O-CB 3.33Å; L172-M176 VanDerWaalsContact O-CG 3.23Å; L172-M176 WeakPolarHBondContact O-CG 3.22Å; L172-M176 PolarHBondContact O-N 3.44Å; F173-M176 PolarHBondContact O-N 2.79Å; I174-M176 PolarHBondContact O-N 3.47Å; M176-L178 VanDerWaalsContact C-N 3.3Å; M176-L178 PolarHBondContact O-N 3.47Å; M176-L179 PolarHBondContact O-N 2.94Å; M176-I180 WeakPolarHBondContact O-CB 3.31Å; M176-I180 VanDerWaalsContact O-CG1 3.23Å; M176-I180 WeakPolarHBondContact O-CG1 3.25Å; M176-I180 PolarHBondContact O-N 3.33Å
177	V	88.1	Confident	85.7	Confident	22 Å²	22	46.4 Å²	46.4	13%	0.133	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-41	176.6	169.7	0	0	0	0	110.6	F173 I174 G181 A202	F173-V177 HydrophobicContact CD1-CG2 4.18Å; F173-V177 HydrophobicContact CD2-CG2 4.44Å; F173-V177 HydrophobicContact CE1-CG2 3.74Å; F173-V177 HydrophobicContact CE2-CG2 4.03Å; F173-V177 HydrophobicContact CZ-CG2 3.66Å; F173-V177 WeakPolarHBondContact O-CG2 3.36Å; F173-V177 PolarHBondContact O-N 3.05Å; I174-V177 PolarHBondContact O-N 3.01Å; I174-V177 VanDerWaalsContact O-N 3.09Å; V177-G181 PolarHBondContact O-N 3.18Å; V177-A202 HydrophobicContact CG1-CB 4.1Å
178	L	85.2	Confident	85.7	Confident	9 Å²	9	50.8 Å²	50.8	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-49.2	174.9	-64.9	179.5	0	0	0	110.6	I174 M176 I180 G181 Q182 A202 W242 N243 L246 T247 W250	I174-L178 HydrophobicContact CG2-CD1 3.97Å; I174-L178 HydrophobicContact CG2-CG 4.27Å; I174-L178 WeakPolarHBondContact O-CG 3.46Å; I174-L178 PolarHBondContact O-N 3.47Å; M176-L178 VanDerWaalsContact C-N 3.3Å; M176-L178 PolarHBondContact O-N 3.47Å; L178-I180 VanDerWaalsContact C-N 3.34Å; L178-I180 PolarHBondContact O-N 3.46Å; L178-G181 PolarHBondContact O-N 2.97Å; L178-Q182 PolarHBondContact O-N 3.27Å; L178-A202 HydrophobicContact CD2-CB 4.35Å; L178-W242 HydrophobicContact CD1-CZ3 4.02Å; L178-N243 WeakPolarHBondContact CD1-OD1 3.22Å; L178-L246 HydrophobicContact CD1-CD2 4.16Å; L178-L246 HydrophobicContact CD2-CD2 3.7Å; L178-L246 HydrophobicContact CG-CD2 4.37Å; L178-T247 HydrophobicContact CD2-CG2 3.95Å; L178-W250 HydrophobicContact CB-CH2 4.15Å; L178-W250 HydrophobicContact CB-CZ3 4.31Å; L178-W250 HydrophobicContact CD2-CE3 3.81Å; L178-W250 HydrophobicContact CD2-CH2 3.9Å; L178-W250 HydrophobicContact CD2-CZ3 3.43Å; L178-W250 VanDerWaalsContact CD2-CZ3 3.43Å; L178-W250 HydrophobicContact CG-CZ3 4.47Å; L178-W250 WeakPolarHBondContact O-CH2 3.18Å
179	L	86.4	Confident	85.4	Confident	63 Å²	63	53.7 Å²	53.7	33%	0.33	28%	0.281	S	S	.	.	H	α-helix	trans	-57.4	-47	177.8	-165.7	166.3	0	0	0	111.7	L89 D175 M176 Q182 I183	L89-L179 HydrophobicContact CD1-CB 4.35Å; L89-L179 HydrophobicContact CD1-CD1 3.96Å; L89-L179 HydrophobicContact CD1-CG 4.2Å; D175-L179 WeakPolarHBondContact O-CB 3.43Å; D175-L179 PolarHBondContact O-N 3.37Å; M176-L179 PolarHBondContact O-N 2.94Å; L179-Q182 PolarHBondContact O-N 2.96Å; L179-I183 HydrophobicContact CD2-CD1 3.29Å; L179-I183 HydrophobicContact CD2-CG1 4.01Å; L179-I183 WeakPolarHBondContact O-CG1 3.41Å; L179-I183 PolarHBondContact O-N 3.45Å
180	I	88.7	Confident	84.8	Confident	112 Å²	112	50.6 Å²	50.6	57%	0.574	27%	0.268	S	S	*	.	H	α-helix	trans	-65	-40.9	178	-67.8	166.3	0	0	0	111.4	M176 L178 Q182 I183 G184	M176-I180 WeakPolarHBondContact O-CB 3.31Å; M176-I180 VanDerWaalsContact O-CG1 3.23Å; M176-I180 WeakPolarHBondContact O-CG1 3.25Å; M176-I180 PolarHBondContact O-N 3.33Å; L178-I180 VanDerWaalsContact C-N 3.34Å; L178-I180 PolarHBondContact O-N 3.46Å; I180-Q182 VanDerWaalsContact C-N 3.33Å; I180-Q182 PolarHBondContact O-N 3.3Å; I180-I183 PolarHBondContact O-N 2.74Å; I180-G184 PolarHBondContact O-N 3.22Å
181	G	84.6	Confident	84.4	Confident	4 Å²	4	52.8 Å²	52.8	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-44.3	176.7	0	0	0	0	0	111.8	V177 L178 G184 Y185	V177-G181 PolarHBondContact O-N 3.18Å; L178-G181 PolarHBondContact O-N 2.97Å; G181-G184 PolarHBondContact O-N 3.44Å; G181-Y185 PolarHBondContact O-N 2.96Å
182	Q	84.9	Confident	84.2	Confident	14 Å²	14	55.5 Å²	55.5	7%	0.065	29%	0.29	C	S	.	.	H	α-helix	trans	-66.2	-45.8	177.2	-161.7	69.7	-12.1	0	0	111.7	L81 W82 D126 L178 L179 I180 G184 Y185 F186 W250	L81-Q182 VanDerWaalsContact CD2-NE2 3.31Å; W82-Q182 HydrophobicContact CH2-CB 4.31Å; W82-Q182 HydrophobicContact CH2-CG 4.07Å; W82-Q182 HydrophobicContact CZ2-CG 4.41Å; D126-Q182 PolarHBondContact OD1-NE2 3.02Å; L178-Q182 PolarHBondContact O-N 3.27Å; L179-Q182 PolarHBondContact O-N 2.96Å; I180-Q182 VanDerWaalsContact C-N 3.33Å; I180-Q182 PolarHBondContact O-N 3.3Å; Q182-G184 VanDerWaalsContact C-N 3.34Å; Q182-G184 PolarHBondContact O-N 2.98Å; Q182-Y185 PolarHBondContact O-N 3.49Å; Q182-F186 HydrophobicContact CG-CE2 4.49Å; Q182-F186 WeakPolarHBondContact O-CD2 3.4Å; Q182-F186 PolarHBondContact O-N 3.48Å; Q182-W250 HydrophobicContact CB-CH2 4.21Å; Q182-W250 HydrophobicContact CB-CZ2 4.36Å
183	I	86.9	Confident	84.1	Confident	65 Å²	65	56.4 Å²	56.4	33%	0.333	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-46.7	176	-70.4	179.3	0	0	0	110.6	W82 L179 I180 Y185 F186 I187	W82-I183 HydrophobicContact CH2-CB 4.05Å; W82-I183 HydrophobicContact CH2-CG1 3.33Å; W82-I183 HydrophobicContact CZ2-CG1 4.4Å; W82-I183 HydrophobicContact CZ3-CG1 3.73Å; L179-I183 HydrophobicContact CD2-CD1 3.29Å; L179-I183 HydrophobicContact CD2-CG1 4.01Å; L179-I183 WeakPolarHBondContact O-CG1 3.41Å; L179-I183 PolarHBondContact O-N 3.45Å; I180-I183 PolarHBondContact O-N 2.74Å; I183-Y185 VanDerWaalsContact C-N 3.31Å; I183-Y185 PolarHBondContact O-N 3.43Å; I183-F186 PolarHBondContact O-N 3.06Å; I183-I187 HydrophobicContact CG2-CD1 3.42Å; I183-I187 VanDerWaalsContact CG2-CD1 3.42Å; I183-I187 HydrophobicContact CG2-CG1 4.1Å; I183-I187 WeakPolarHBondContact O-CG1 3.35Å; I183-I187 PolarHBondContact O-N 3.35Å
184	G	83.4	Confident	84.1	Confident	13 Å²	13	53.4 Å²	53.4	13%	0.134	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-42.2	-179.5	0	0	0	0	0	112.1	I180 G181 Q182 F186 I187 L188	I180-G184 PolarHBondContact O-N 3.22Å; G181-G184 PolarHBondContact O-N 3.44Å; Q182-G184 VanDerWaalsContact C-N 3.34Å; Q182-G184 PolarHBondContact O-N 2.98Å; G184-F186 VanDerWaalsContact C-N 3.34Å; G184-F186 PolarHBondContact O-N 2.88Å; G184-I187 PolarHBondContact O-N 3.46Å; G184-L188 WeakPolarHBondContact O-CB 3.19Å; G184-L188 VanDerWaalsContact O-CD1 3.25Å; G184-L188 WeakPolarHBondContact O-CD1 3.35Å; G184-L188 PolarHBondContact O-N 3.02Å
185	Y	82.7	Confident	84	Confident	6 Å²	6	53.3 Å²	53.3	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-44	177.3	174.7	-105.6	0	0	0	112.6	L129 G181 Q182 I183 K190 L195 L257	L129-Y185 HydrophobicContact CD1-CE1 4.24Å; G181-Y185 PolarHBondContact O-N 2.96Å; Q182-Y185 PolarHBondContact O-N 3.49Å; I183-Y185 VanDerWaalsContact C-N 3.31Å; I183-Y185 PolarHBondContact O-N 3.43Å; Y185-K190 HydrophobicContact CE1-CB 4.25Å; Y185-K190 HydrophobicContact CE1-CG 4.04Å; Y185-K190 VanDerWaalsContact CE2-C 3.46Å; Y185-K190 VanDerWaalsContact CE2-CA 3.49Å; Y185-K190 HydrophobicContact CE2-CB 3.87Å; Y185-K190 WeakPolarHBondContact CE2-O 3.18Å; Y185-K190 WeakPolarHBondContact O-CA 3.36Å; Y185-K190 PolarHBondContact O-N 2.83Å; Y185-L195 HydrophobicContact CD2-CB 4.48Å; Y185-L257 HydrophobicContact CE2-CD2 4.34Å; Y185-L257 WeakPolarHBondContact OH-CD2 3.49Å
186	F	82.7	Confident	84.1	Confident	44 Å²	44	54.1 Å²	54.1	19%	0.193	29%	0.292	C	S	.	.	H	α-helix	trans	-73.4	-38.9	178.8	-79.8	-82.3	0	0	0	113.3	D78 L81 W82 Q182 I183 G184	D78-F186 HydrophobicContact CB-CE1 4Å; D78-F186 HydrophobicContact CB-CZ 4.46Å; L81-F186 HydrophobicContact CD2-CE2 3.68Å; L81-F186 HydrophobicContact CD2-CZ 3.61Å; W82-F186 AromaticContact CE2-CD2 3.75Å; W82-F186 HydrophobicContact CH2-CD2 4.46Å; W82-F186 HydrophobicContact CZ2-CB 4.12Å; W82-F186 AromaticContact CZ2-CD2 3.38Å; W82-F186 HydrophobicContact CZ2-CD2 3.38Å; W82-F186 HydrophobicContact CZ2-CE2 4.04Å; W82-F186 AromaticContact CZ2-CG 3.92Å; W82-F186 HydrophobicContact CZ2-CG 3.92Å; W82-F186 AromaticContact NE1-CD2 3.63Å; W82-F186 AromaticContact NE1-CE2 3.71Å; W82-F186 AromaticContact NE1-CG 3.83Å; W82-F186 AromaticContact NE1-CZ 3.99Å; Q182-F186 HydrophobicContact CG-CE2 4.49Å; Q182-F186 WeakPolarHBondContact O-CD2 3.4Å; Q182-F186 PolarHBondContact O-N 3.48Å; I183-F186 PolarHBondContact O-N 3.06Å; G184-F186 VanDerWaalsContact C-N 3.34Å; G184-F186 PolarHBondContact O-N 2.88Å
187	I	85	Confident	84.2	Confident	127 Å²	127	52.8 Å²	52.8	65%	0.651	29%	0.29	S	S	*	.	H	α-helix	trans	-69.7	-40.9	179.8	-67.3	179.4	0	0	0	111.5	I183 G184 S189	I183-I187 HydrophobicContact CG2-CD1 3.42Å; I183-I187 VanDerWaalsContact CG2-CD1 3.42Å; I183-I187 HydrophobicContact CG2-CG1 4.1Å; I183-I187 WeakPolarHBondContact O-CG1 3.35Å; I183-I187 PolarHBondContact O-N 3.35Å; G184-I187 PolarHBondContact O-N 3.46Å; I187-S189 PolarHBondContact O-N 3.48Å; I187-S189 VanDerWaalsContact O-N 3.09Å
188	L	82.7	Confident	84.2	Confident	96 Å²	96	52.2 Å²	52.2	50%	0.503	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	35.1	-179.9	-74.2	120.6	0	0	0	112.5	G184 K190 N191 V194	G184-L188 WeakPolarHBondContact O-CB 3.19Å; G184-L188 VanDerWaalsContact O-CD1 3.25Å; G184-L188 WeakPolarHBondContact O-CD1 3.35Å; G184-L188 PolarHBondContact O-N 3.02Å; L188-K190 PolarHBondContact O-N 2.92Å; L188-N191 HydrophobicContact CB-CB 4.24Å; L188-N191 VanDerWaalsContact O-CB 3.29Å; L188-N191 WeakPolarHBondContact O-CB 3.4Å; L188-N191 PolarHBondContact O-N 3.4Å; L188-V194 HydrophobicContact CB-CG2 4.22Å; L188-V194 HydrophobicContact CD1-CG2 3.98Å; L188-V194 HydrophobicContact CG-CG2 4.48Å
189	S	75.9	Confident	84.4	Confident	109 Å²	109	51.8 Å²	51.8	76%	0.762	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	46	174.6	-59.5	0	0	0	0	114.2	I187 N191	I187-S189 PolarHBondContact O-N 3.48Å; I187-S189 VanDerWaalsContact O-N 3.09Å; S189-N191 VanDerWaalsContact C-N 3.3Å; S189-N191 PolarHBondContact O-N 3.13Å
190	K	74.6	Confident	84.6	Confident	71 Å²	71	51.3 Å²	51.3	31%	0.309	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	35.4	178.2	-56.6	-172.3	180	-168.3	0	113.1	D78 Y185 L188 K192	D78-K190 IonicContact OD1-NZ 3.8Å; D78-K190 IonicContact OD2-NZ 3.02Å; D78-K190 PolarHBondContact OD2-NZ 3.18Å; Y185-K190 HydrophobicContact CE1-CB 4.25Å; Y185-K190 HydrophobicContact CE1-CG 4.04Å; Y185-K190 VanDerWaalsContact CE2-C 3.46Å; Y185-K190 VanDerWaalsContact CE2-CA 3.49Å; Y185-K190 HydrophobicContact CE2-CB 3.87Å; Y185-K190 WeakPolarHBondContact CE2-O 3.18Å; Y185-K190 WeakPolarHBondContact O-CA 3.36Å; Y185-K190 PolarHBondContact O-N 2.83Å; L188-K190 PolarHBondContact O-N 2.92Å; K190-K192 PolarHBondContact O-N 3.43Å
191	N	78.1	Confident	84.7	Confident	66 Å²	66	50 Å²	50	35%	0.353	29%	0.285	S	S	.	.			trans	-68.4	116.9	177.3	-172	-7.3	0	0	0	111.8	L188 S189 T193 V194	L188-N191 HydrophobicContact CB-CB 4.24Å; L188-N191 VanDerWaalsContact O-CB 3.29Å; L188-N191 WeakPolarHBondContact O-CB 3.4Å; L188-N191 PolarHBondContact O-N 3.4Å; S189-N191 VanDerWaalsContact C-N 3.3Å; S189-N191 PolarHBondContact O-N 3.13Å; N191-T193 VanDerWaalsContact CG-OG1 3.31Å; N191-T193 PolarHBondContact ND2-OG1 3.39Å; N191-T193 PolarHBondContact O-N 3.38Å; N191-T193 PolarHBondContact OD1-N 3Å; N191-T193 VanDerWaalsContact OD1-N 3.11Å; N191-T193 PolarHBondContact OD1-OG1 3.34Å; N191-V194 HydrophobicContact CB-CG2 4.19Å; N191-V194 PolarHBondContact O-N 3.02Å
192	K	81.6	Confident	85.1	Confident	59 Å²	59	49.9 Å²	49.9	26%	0.257	28%	0.283	S	S	.	.	H	α-helix	trans	-56.6	-32.2	-179.3	-56.8	-173	-173.5	-175.4	0	113.1	K190 V194 T196 T253 L257 D259	K190-K192 PolarHBondContact O-N 3.43Å; K192-V194 VanDerWaalsContact C-N 3.34Å; K192-V194 PolarHBondContact O-N 2.9Å; K192-T196 PolarHBondContact O-N 3.15Å; K192-T196 PolarHBondContact O-OG1 3.2Å; K192-T253 HydrophobicContact CB-CG2 3.97Å; K192-T253 HydrophobicContact CG-CG2 4.32Å; K192-L257 HydrophobicContact CD-CB 4.33Å; K192-L257 HydrophobicContact CD-CD2 4.26Å; K192-L257 HydrophobicContact CG-CD2 3.86Å; K192-D259 IonicContact NZ-OD1 2.71Å; K192-D259 PolarHBondContact NZ-OD1 2.89Å
193	T	84.9	Confident	85.4	Confident	75 Å²	75	51.5 Å²	51.5	46%	0.46	29%	0.292	S	S	.	.	H	α-helix	trans	-67.8	-33.1	-174.7	62.1	0	0	0	0	113	N191 L195 V197	N191-T193 VanDerWaalsContact CG-OG1 3.31Å; N191-T193 PolarHBondContact ND2-OG1 3.39Å; N191-T193 PolarHBondContact O-N 3.38Å; N191-T193 PolarHBondContact OD1-N 3Å; N191-T193 VanDerWaalsContact OD1-N 3.11Å; N191-T193 PolarHBondContact OD1-OG1 3.34Å; T193-L195 PolarHBondContact O-N 3.33Å; T193-V197 WeakPolarHBondContact O-CB 3.45Å; T193-V197 VanDerWaalsContact O-CG2 3.28Å; T193-V197 WeakPolarHBondContact O-CG2 3.45Å; T193-V197 PolarHBondContact O-N 2.92Å
194	V	87.5	Confident	85.6	Confident	33 Å²	33	51.8 Å²	51.8	20%	0.2	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-44.9	-177.8	179	0	0	0	0	110.3	L188 N191 K192 V197 A198	L188-V194 HydrophobicContact CB-CG2 4.22Å; L188-V194 HydrophobicContact CD1-CG2 3.98Å; L188-V194 HydrophobicContact CG-CG2 4.48Å; N191-V194 HydrophobicContact CB-CG2 4.19Å; N191-V194 PolarHBondContact O-N 3.02Å; K192-V194 VanDerWaalsContact C-N 3.34Å; K192-V194 PolarHBondContact O-N 2.9Å; V194-V197 PolarHBondContact O-N 2.9Å; V194-A198 WeakPolarHBondContact O-CB 3.18Å; V194-A198 PolarHBondContact O-N 2.69Å
195	L	86.5	Confident	86	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68.3	-43.7	-177.4	-156.2	58.6	0	0	0	111.3	Y130 Y185 T193 V197 A198 G199 W250 T253	Y130-L195 VanDerWaalsContact OH-CD2 3.22Å; Y130-L195 WeakPolarHBondContact OH-CD2 3.43Å; Y185-L195 HydrophobicContact CD2-CB 4.48Å; T193-L195 PolarHBondContact O-N 3.33Å; L195-V197 PolarHBondContact O-N 3.45Å; L195-A198 PolarHBondContact O-N 3.34Å; L195-G199 PolarHBondContact O-N 2.81Å; L195-W250 HydrophobicContact CD1-CB 4.35Å; L195-W250 HydrophobicContact CD1-CD2 3.27Å; L195-W250 HydrophobicContact CD1-CE3 3.62Å; L195-W250 HydrophobicContact CD1-CG 3.62Å; L195-W250 HydrophobicContact CD1-CH2 4.01Å; L195-W250 HydrophobicContact CD1-CZ2 3.72Å; L195-W250 HydrophobicContact CD1-CZ3 3.97Å; L195-W250 HydrophobicContact CD2-CG 4.12Å; L195-W250 HydrophobicContact CG-CB 3.84Å; L195-W250 HydrophobicContact CG-CD2 3.76Å; L195-W250 HydrophobicContact CG-CE3 4.34Å; L195-W250 HydrophobicContact CG-CG 3.51Å; L195-T253 HydrophobicContact CB-CG2 4.22Å; L195-T253 HydrophobicContact CD2-CG2 4.13Å; L195-T253 WeakPolarHBondContact CD2-OG1 3.44Å
196	T	87.8	Confident	86.4	Confident	35 Å²	35	54.7 Å²	54.7	22%	0.215	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-42.5	175.7	-58.8	0	0	0	0	112.6	K192 G199 A200 W250	K192-T196 PolarHBondContact O-N 3.15Å; K192-T196 PolarHBondContact O-OG1 3.2Å; T196-G199 PolarHBondContact O-N 2.9Å; T196-A200 VanDerWaalsContact O-CB 3.28Å; T196-A200 WeakPolarHBondContact O-CB 3.42Å; T196-A200 PolarHBondContact O-N 2.69Å; T196-W250 VanDerWaalsContact CA-O 3.26Å; T196-W250 WeakPolarHBondContact CA-O 3.41Å; T196-W250 PolarHBondContact N-O 3.43Å; T196-W250 PolarHBondContact OG1-O 3.03Å
197	V	89.7	Confident	86.8	Confident	85 Å²	85	54.6 Å²	54.6	52%	0.515	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-43.7	177.5	171.7	0	0	0	0	111	T193 V194 L195 G199 A200 I201	T193-V197 WeakPolarHBondContact O-CB 3.45Å; T193-V197 VanDerWaalsContact O-CG2 3.28Å; T193-V197 WeakPolarHBondContact O-CG2 3.45Å; T193-V197 PolarHBondContact O-N 2.92Å; V194-V197 PolarHBondContact O-N 2.9Å; L195-V197 PolarHBondContact O-N 3.45Å; V197-G199 PolarHBondContact O-N 3.49Å; V197-A200 PolarHBondContact O-N 3.36Å; V197-I201 HydrophobicContact CG1-CD1 3.82Å; V197-I201 HydrophobicContact CG1-CG1 4.5Å; V197-I201 VanDerWaalsContact O-CG1 3.3Å; V197-I201 WeakPolarHBondContact O-CG1 3.41Å; V197-I201 PolarHBondContact O-N 2.69Å
198	A	89	Confident	87	Confident	10 Å²	10	52.6 Å²	52.6	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-45.1	176.4	0	0	0	0	0	111.8	V194 L195 I201 A202 W250	V194-A198 WeakPolarHBondContact O-CB 3.18Å; V194-A198 PolarHBondContact O-N 2.69Å; L195-A198 PolarHBondContact O-N 3.34Å; A198-I201 PolarHBondContact O-N 3.5Å; A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.35Å; A198-A202 PolarHBondContact O-N 3.48Å; A198-W250 HydrophobicContact CB-CE3 4.1Å; A198-W250 HydrophobicContact CB-CZ3 4.08Å
199	G	88.4	Confident	87.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-43.7	175.7	0	0	0	0	0	112.7	L195 T196 V197 I201 A202 L203	L195-G199 PolarHBondContact O-N 2.81Å; T196-G199 PolarHBondContact O-N 2.9Å; V197-G199 PolarHBondContact O-N 3.49Å; G199-I201 PolarHBondContact O-N 2.84Å; G199-A202 PolarHBondContact O-N 2.87Å; G199-L203 WeakPolarHBondContact O-CB 3.39Å; G199-L203 PolarHBondContact O-N 3.02Å
200	A	90.8	Very high	88	Confident	54 Å²	54	43 Å²	43	45%	0.446	24%	0.236	S	C	.	.	H	α-helix	trans	-64.3	-38.5	178.4	0	0	0	0	0	112.6	T196 V197 P204	T196-A200 VanDerWaalsContact O-CB 3.28Å; T196-A200 WeakPolarHBondContact O-CB 3.42Å; T196-A200 PolarHBondContact O-N 2.69Å; V197-A200 PolarHBondContact O-N 3.36Å; A200-P204 VanDerWaalsContact O-CD 3.28Å; A200-P204 WeakPolarHBondContact O-CD 3.33Å
201	I	91.7	Very high	88.7	Confident	85 Å²	85	42.1 Å²	42.1	44%	0.436	23%	0.234	S	C	.	.	H	α-helix	trans	-67.9	-42.8	174.7	-68.4	167.5	0	0	0	110.4	V197 A198 G199 P204 F205	V197-I201 HydrophobicContact CG1-CD1 3.82Å; V197-I201 HydrophobicContact CG1-CG1 4.5Å; V197-I201 VanDerWaalsContact O-CG1 3.3Å; V197-I201 WeakPolarHBondContact O-CG1 3.41Å; V197-I201 PolarHBondContact O-N 2.69Å; A198-I201 PolarHBondContact O-N 3.5Å; G199-I201 PolarHBondContact O-N 2.84Å; I201-P204 WeakPolarHBondContact O-CD 3.34Å; I201-P204 WeakPolarHBondContact O-CG 3.23Å; I201-F205 WeakPolarHBondContact O-CD2 3.36Å
202	A	91.7	Very high	89.2	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-74.4	-31.7	-175.3	0	0	0	0	0	113.6	V177 L178 A198 G199 F205 T206 T247	V177-A202 HydrophobicContact CG1-CB 4.1Å; L178-A202 HydrophobicContact CD2-CB 4.35Å; A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.35Å; A198-A202 PolarHBondContact O-N 3.48Å; G199-A202 PolarHBondContact O-N 2.87Å; A202-F205 PolarHBondContact O-N 3.49Å; A202-T206 WeakPolarHBondContact O-CG2 3.28Å; A202-T206 PolarHBondContact O-N 2.96Å; A202-T206 PolarHBondContact O-OG1 3.2Å; A202-T247 HydrophobicContact CB-CG2 3.45Å; A202-T247 VanDerWaalsContact CB-CG2 3.45Å
203	L	91.8	Very high	89.5	Confident	47 Å²	47	36.9 Å²	36.9	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-52.3	-49.6	-176	-176	139	0	0	0	115.4	G199 F205 T206 L207 L248 I251	G199-L203 WeakPolarHBondContact O-CB 3.39Å; G199-L203 PolarHBondContact O-N 3.02Å; L203-F205 VanDerWaalsContact C-N 3.27Å; L203-F205 PolarHBondContact O-N 3.2Å; L203-T206 WeakPolarHBondContact CA-OG1 3.5Å; L203-T206 PolarHBondContact O-N 2.99Å; L203-T206 PolarHBondContact O-OG1 2.91Å; L203-L207 HydrophobicContact CD2-CD1 3.71Å; L203-L207 HydrophobicContact CD2-CG 4.49Å; L203-L207 HydrophobicContact CG-CD1 4.26Å; L203-L207 WeakPolarHBondContact O-CG 3.29Å; L203-L207 PolarHBondContact O-N 3.38Å; L203-L248 HydrophobicContact CD1-CD2 4.03Å; L203-I251 HydrophobicContact CB-CD1 3.87Å; L203-I251 HydrophobicContact CD1-CD1 3.32Å; L203-I251 HydrophobicContact CG-CD1 4.19Å
204	P	91.7	Very high	89.7	Confident	71 Å²	71	33.3 Å²	33.3	46%	0.461	19%	0.186	S	C	.	.	H	α-helix	trans	-62.2	-36	177.8	23.2	-34.1	0	0	0	112.3	A200 I201 F208	A200-P204 VanDerWaalsContact O-CD 3.28Å; A200-P204 WeakPolarHBondContact O-CD 3.33Å; I201-P204 WeakPolarHBondContact O-CD 3.34Å; I201-P204 WeakPolarHBondContact O-CG 3.23Å; P204-F208 WeakPolarHBondContact O-CB 3.43Å; P204-F208 PolarHBondContact O-N 2.99Å
205	F	91.4	Very high	89.7	Confident	78 Å²	78	32.2 Å²	32.2	34%	0.342	18%	0.179	S	C	.	.	H	α-helix	trans	-73.1	-38.4	178.5	-62.8	-75.4	0	0	0	112	V170 F173 I174 I201 A202 L203 F208 K209	V170-F205 HydrophobicContact CG1-CB 4.19Å; V170-F205 HydrophobicContact CG1-CD1 4.17Å; F173-F205 HydrophobicContact CD1-CD2 4.38Å; F173-F205 HydrophobicContact CD1-CE2 4.47Å; F173-F205 HydrophobicContact CD1-CG 4.47Å; F173-F205 AromaticContact CE1-CD2 3.98Å; F173-F205 HydrophobicContact CE1-CD2 3.98Å; F173-F205 AromaticContact CE1-CE2 3.77Å; F173-F205 HydrophobicContact CE1-CE2 3.77Å; F173-F205 HydrophobicContact CE1-CZ 4.09Å; I174-F205 HydrophobicContact CD1-CB 3.74Å; I174-F205 WeakPolarHBondContact CD1-O 3.28Å; I174-F205 HydrophobicContact CG1-CB 3.58Å; I201-F205 WeakPolarHBondContact O-CD2 3.36Å; A202-F205 PolarHBondContact O-N 3.49Å; L203-F205 VanDerWaalsContact C-N 3.27Å; L203-F205 PolarHBondContact O-N 3.2Å; F205-F208 PolarHBondContact O-N 2.79Å; F205-K209 WeakPolarHBondContact O-CB 3.28Å; F205-K209 PolarHBondContact O-N 3.41Å
206	T	90.9	Very high	89.6	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-65.4	-40.2	176	55.8	0	0	0	0	111.6	I174 A202 L203 K209 L210 N243 T247	I174-T206 HydrophobicContact CD1-CG2 4.27Å; I174-T206 HydrophobicContact CG1-CG2 4.47Å; I174-T206 HydrophobicContact CG2-CG2 3.77Å; A202-T206 WeakPolarHBondContact O-CG2 3.28Å; A202-T206 PolarHBondContact O-N 2.96Å; A202-T206 PolarHBondContact O-OG1 3.2Å; L203-T206 WeakPolarHBondContact CA-OG1 3.5Å; L203-T206 PolarHBondContact O-N 2.99Å; L203-T206 PolarHBondContact O-OG1 2.91Å; T206-K209 PolarHBondContact O-N 3.37Å; T206-L210 VanDerWaalsContact O-CB 3.3Å; T206-L210 WeakPolarHBondContact O-CB 3.36Å; T206-L210 PolarHBondContact O-N 3.38Å; T206-N243 HydrophobicContact CG2-CB 3.86Å; T206-T247 HydrophobicContact CG2-CG2 3.73Å
207	L	90.7	Very high	89.6	Confident	43 Å²	43	31 Å²	31	23%	0.225	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-41.8	174	-68.6	177.2	0	0	0	112.1	L203 L210 L211	L203-L207 HydrophobicContact CD2-CD1 3.71Å; L203-L207 HydrophobicContact CD2-CG 4.49Å; L203-L207 HydrophobicContact CG-CD1 4.26Å; L203-L207 WeakPolarHBondContact O-CG 3.29Å; L203-L207 PolarHBondContact O-N 3.38Å; L207-L210 PolarHBondContact O-N 2.91Å; L207-L211 WeakPolarHBondContact O-CG 3.28Å; L207-L211 PolarHBondContact O-N 3.47Å
208	F	89	Confident	89.2	Confident	85 Å²	85	29.6 Å²	29.6	37%	0.373	16%	0.158	S	C	.	.	H	α-helix	trans	-63.3	-45.6	175.5	-179.1	-98.7	0	0	0	112	V170 P204 F205 L210 L211 Y212	V170-F208 HydrophobicContact CG1-CD1 4.39Å; P204-F208 WeakPolarHBondContact O-CB 3.43Å; P204-F208 PolarHBondContact O-N 2.99Å; F205-F208 PolarHBondContact O-N 2.79Å; F208-L210 VanDerWaalsContact C-N 3.33Å; F208-L210 PolarHBondContact O-N 3.4Å; F208-L211 PolarHBondContact O-N 3.22Å; F208-Y212 WeakPolarHBondContact O-CB 3.42Å; F208-Y212 PolarHBondContact O-N 3.38Å
209	K	89.3	Confident	88.3	Confident	3 Å²	3	29.4 Å²	29.4	1%	0.013	16%	0.157	C	C	.	.	H	α-helix	trans	-58.3	-45.9	174.6	-178.1	-178	173.2	-179.1	0	110.8	S171 I174 F205 T206 Y212 E213 N239 N243	S171-K209 VanDerWaalsContact OG-CE 3.26Å; S171-K209 WeakPolarHBondContact OG-CE 3.47Å; S171-K209 PolarHBondContact OG-NZ 2.67Å; I174-K209 HydrophobicContact CD1-CB 4.02Å; I174-K209 HydrophobicContact CD1-CD 3.81Å; F205-K209 WeakPolarHBondContact O-CB 3.28Å; F205-K209 PolarHBondContact O-N 3.41Å; T206-K209 PolarHBondContact O-N 3.37Å; K209-Y212 PolarHBondContact O-N 3.07Å; K209-E213 HydrophobicContact CG-CG 4.35Å; K209-E213 WeakPolarHBondContact O-CB 3.26Å; K209-E213 VanDerWaalsContact O-CG 3.32Å; K209-E213 WeakPolarHBondContact O-CG 3.38Å; K209-E213 PolarHBondContact O-N 3.01Å; K209-N239 PolarHBondContact NZ-ND2 3.09Å; K209-N243 PolarHBondContact NZ-ND2 3.26Å
210	L	90.4	Very high	87.2	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-45.8	178.1	178.9	61.7	0	0	0	112.1	F146 I149 T206 L207 F208 Y212 E213 V214 L237 C240	F146-L210 HydrophobicContact CD2-CD1 3.52Å; F146-L210 HydrophobicContact CD2-CD2 4.03Å; F146-L210 HydrophobicContact CD2-CG 4.39Å; F146-L210 HydrophobicContact CE2-CD1 3.5Å; F146-L210 VanDerWaalsContact CE2-CD1 3.5Å; I149-L210 HydrophobicContact CB-CD2 4.17Å; I149-L210 HydrophobicContact CB-CG 4.36Å; I149-L210 HydrophobicContact CG1-CD2 3.87Å; I149-L210 HydrophobicContact CG1-CG 4.36Å; I149-L210 HydrophobicContact CG2-CD2 4.37Å; I149-L210 HydrophobicContact CG2-CG 4.01Å; T206-L210 VanDerWaalsContact O-CB 3.3Å; T206-L210 WeakPolarHBondContact O-CB 3.36Å; T206-L210 PolarHBondContact O-N 3.38Å; L207-L210 PolarHBondContact O-N 2.91Å; F208-L210 VanDerWaalsContact C-N 3.33Å; F208-L210 PolarHBondContact O-N 3.4Å; L210-Y212 VanDerWaalsContact C-N 3.32Å; L210-Y212 PolarHBondContact O-N 3.42Å; L210-E213 PolarHBondContact O-N 3Å; L210-V214 HydrophobicContact CD1-CG2 3.78Å; L210-V214 HydrophobicContact CG-CG2 4.31Å; L210-V214 VanDerWaalsContact O-CB 3.29Å; L210-V214 WeakPolarHBondContact O-CB 3.36Å; L210-V214 WeakPolarHBondContact O-CG2 3.15Å; L210-V214 PolarHBondContact O-N 3.32Å; L210-L237 HydrophobicContact CD1-CD1 4.32Å; L210-C240 HydrophobicContact CB-CB 4.32Å; L210-C240 HydrophobicContact CD1-CB 3.68Å
211	L	89.3	Confident	86	Confident	51 Å²	51	30 Å²	30	27%	0.267	17%	0.169	S	C	.	.	H	α-helix	trans	-56.4	-46.8	174.7	-82.4	161	0	0	0	111.7	I149 I153 L207 F208 K215	I149-L211 HydrophobicContact CD1-CD1 4.38Å; I149-L211 HydrophobicContact CD1-CD2 3.91Å; I149-L211 HydrophobicContact CD1-CG 3.92Å; I149-L211 HydrophobicContact CG2-CD2 3.71Å; I149-L211 HydrophobicContact CG2-CG 3.93Å; I153-L211 HydrophobicContact CD1-CD2 3.67Å; I153-L211 HydrophobicContact CG1-CD2 4.03Å; L207-L211 WeakPolarHBondContact O-CG 3.28Å; L207-L211 PolarHBondContact O-N 3.47Å; F208-L211 PolarHBondContact O-N 3.22Å; L211-K215 WeakPolarHBondContact O-CB 3.02Å; L211-K215 PolarHBondContact O-N 3.41Å
212	Y	88.1	Confident	84.8	Confident	5 Å²	5	32.2 Å²	32.2	2%	0.02	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-49.2	-178.7	-176.4	-86.3	0	0	0	112	F160 T161 Y164 N167 F208 K209 L210 K215 M216	F160-Y212 HydrophobicContact CB-CD2 4.4Å; F160-Y212 VanDerWaalsContact O-CE2 3.27Å; F160-Y212 WeakPolarHBondContact O-CE2 3.46Å; T161-Y212 PolarHBondContact O-OH 2.88Å; Y164-Y212 WeakPolarHBondContact CA-OH 3.41Å; Y164-Y212 VanDerWaalsContact CB-OH 3.29Å; Y164-Y212 WeakPolarHBondContact CB-OH 3.44Å; Y164-Y212 HydrophobicContact CD2-CE1 4.35Å; Y164-Y212 PolarHBondContact N-OH 2.98Å; N167-Y212 HydrophobicContact CB-CD1 3.69Å; N167-Y212 HydrophobicContact CB-CD2 4.26Å; N167-Y212 HydrophobicContact CB-CE1 3.6Å; N167-Y212 HydrophobicContact CB-CE2 4.19Å; N167-Y212 HydrophobicContact CB-CG 4.05Å; N167-Y212 WeakPolarHBondContact ND2-CD1 3.2Å; N167-Y212 VanDerWaalsContact ND2-CE1 3.31Å; N167-Y212 WeakPolarHBondContact ND2-CE1 3.41Å; F208-Y212 WeakPolarHBondContact O-CB 3.42Å; F208-Y212 PolarHBondContact O-N 3.38Å; K209-Y212 PolarHBondContact O-N 3.07Å; L210-Y212 VanDerWaalsContact C-N 3.32Å; L210-Y212 PolarHBondContact O-N 3.42Å; Y212-K215 WeakPolarHBondContact O-CB 3.02Å; Y212-K215 PolarHBondContact O-N 3.28Å; Y212-M216 HydrophobicContact CD1-CE 3.91Å; Y212-M216 HydrophobicContact CD1-CG 4.3Å; Y212-M216 HydrophobicContact CD1-SD 4.32Å; Y212-M216 HydrophobicContact CE1-CE 3.38Å; Y212-M216 HydrophobicContact CE1-CG 3.85Å; Y212-M216 HydrophobicContact CE1-SD 3.43Å; Y212-M216 WeakPolarHBondContact CE1-SD 3.38Å; Y212-M216 PolarHBondContact O-N 3.49Å
213	E	89.1	Confident	83.8	Confident	10 Å²	10	36.6 Å²	36.6	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-68.1	-40.3	-178.1	-67	-64.5	166.7	0	0	112.1	N167 K209 L210 K215 M216 V217 Y225 I236 C240	N167-E213 PolarHBondContact ND2-OE1 2.93Å; K209-E213 HydrophobicContact CG-CG 4.35Å; K209-E213 WeakPolarHBondContact O-CB 3.26Å; K209-E213 VanDerWaalsContact O-CG 3.32Å; K209-E213 WeakPolarHBondContact O-CG 3.38Å; K209-E213 PolarHBondContact O-N 3.01Å; L210-E213 PolarHBondContact O-N 3Å; E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.39Å; E213-M216 PolarHBondContact O-N 3.37Å; E213-M216 VanDerWaalsContact O-N 3.16Å; E213-M216 WeakPolarHBondContact OE2-CE 3.19Å; E213-V217 WeakPolarHBondContact O-CG2 3.25Å; E213-V217 PolarHBondContact O-N 3.24Å; E213-Y225 PolarHBondContact OE2-OH 2.82Å; E213-I236 HydrophobicContact CB-CG2 4.43Å; E213-I236 VanDerWaalsContact CD-CG2 3.4Å; E213-I236 HydrophobicContact CG-CG2 3.85Å; E213-I236 VanDerWaalsContact OE2-CG2 3.32Å; E213-I236 WeakPolarHBondContact OE2-CG2 3.47Å; E213-C240 VanDerWaalsContact CG-SG 3.56Å
214	V	89.7	Confident	82.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-40.7	172.5	172.8	0	0	0	0	110.4	I149 I150 I153 L210 M216 V217 F218 L237	I149-V214 HydrophobicContact CG2-CB 4.44Å; I149-V214 HydrophobicContact CG2-CG2 4.28Å; I150-V214 HydrophobicContact CG1-CG1 3.98Å; I150-V214 HydrophobicContact CG1-CG2 4.45Å; I153-V214 HydrophobicContact CB-CG1 4.01Å; I153-V214 HydrophobicContact CG1-CB 4.33Å; I153-V214 HydrophobicContact CG1-CG1 3.92Å; I153-V214 HydrophobicContact CG2-CG1 4.1Å; L210-V214 HydrophobicContact CD1-CG2 3.78Å; L210-V214 HydrophobicContact CG-CG2 4.31Å; L210-V214 VanDerWaalsContact O-CB 3.29Å; L210-V214 WeakPolarHBondContact O-CB 3.36Å; L210-V214 WeakPolarHBondContact O-CG2 3.15Å; L210-V214 PolarHBondContact O-N 3.32Å; V214-M216 PolarHBondContact O-N 2.62Å; V214-V217 PolarHBondContact O-N 3.21Å; V214-F218 HydrophobicContact CG1-CD2 3.72Å; V214-F218 HydrophobicContact CG1-CE2 3.96Å; V214-F218 WeakPolarHBondContact O-CD2 3.33Å; V214-F218 PolarHBondContact O-N 3.23Å; V214-L237 HydrophobicContact CG2-CD1 3.63Å
215	K	87.6	Confident	82.4	Confident	10 Å²	10	37.1 Å²	37.1	4%	0.043	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-36.3	175.2	-170.3	68.9	176.9	176.4	0	112.4	I153 L156 F158 T161 L211 Y212 E213 V217 G219	I153-K215 HydrophobicContact CD1-CB 4.16Å; I153-K215 HydrophobicContact CD1-CD 4.32Å; I153-K215 HydrophobicContact CG2-CB 4.27Å; I153-K215 HydrophobicContact CG2-CD 3.72Å; L156-K215 PolarHBondContact O-NZ 3.45Å; F158-K215 WeakPolarHBondContact O-CE 3.34Å; T161-K215 HydrophobicContact CG2-CB 4.47Å; T161-K215 HydrophobicContact CG2-CG 3.89Å; L211-K215 WeakPolarHBondContact O-CB 3.02Å; L211-K215 PolarHBondContact O-N 3.41Å; Y212-K215 WeakPolarHBondContact O-CB 3.02Å; Y212-K215 PolarHBondContact O-N 3.28Å; E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.39Å; K215-V217 VanDerWaalsContact C-N 3.34Å; K215-G219 WeakPolarHBondContact CD-O 3.22Å; K215-G219 VanDerWaalsContact CE-O 3.28Å; K215-G219 WeakPolarHBondContact CE-O 3.26Å; K215-G219 PolarHBondContact NZ-O 2.99Å; K215-G219 CarbonylContact O-C 3.49Å; K215-G219 WeakPolarHBondContact O-CA 3.42Å; K215-G219 PolarHBondContact O-N 3.45Å
216	M	84.2	Confident	81.7	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-70.7	-28	174.9	-72.5	-156	-58.8	0	0	113.5	T161 Y164 Y212 E213 V214 Y225	T161-M216 HydrophobicContact CG2-CG 3.96Å; Y164-M216 HydrophobicContact CD2-CE 4.33Å; Y164-M216 HydrophobicContact CD2-SD 4.03Å; Y164-M216 HydrophobicContact CE2-CE 4.29Å; Y164-M216 HydrophobicContact CE2-SD 4.42Å; Y212-M216 HydrophobicContact CD1-CE 3.91Å; Y212-M216 HydrophobicContact CD1-CG 4.3Å; Y212-M216 HydrophobicContact CD1-SD 4.32Å; Y212-M216 HydrophobicContact CE1-CE 3.38Å; Y212-M216 HydrophobicContact CE1-CG 3.85Å; Y212-M216 HydrophobicContact CE1-SD 3.43Å; Y212-M216 WeakPolarHBondContact CE1-SD 3.38Å; Y212-M216 PolarHBondContact O-N 3.49Å; E213-M216 PolarHBondContact O-N 3.37Å; E213-M216 VanDerWaalsContact O-N 3.16Å; E213-M216 WeakPolarHBondContact OE2-CE 3.19Å; V214-M216 PolarHBondContact O-N 2.62Å; M216-Y225 HydrophobicContact CB-CD2 3.88Å; M216-Y225 HydrophobicContact CB-CE2 3.72Å; M216-Y225 HydrophobicContact CE-CE1 4.48Å; M216-Y225 HydrophobicContact CE-CE2 3.7Å; M216-Y225 VanDerWaalsContact CE-OH 3.24Å; M216-Y225 WeakPolarHBondContact CE-OH 3.4Å; M216-Y225 PolarHBondContact O-N 3.38Å
217	V	86	Confident	81	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.03	21%	0.21	C	C	.	.	H	α-helix	trans	-79.1	-55.6	177.1	172.8	0	0	0	0	111.9	T43 V46 E213 V214 K215 G219 Y225 A233	T43-V217 HydrophobicContact CG2-CG1 4.33Å; V46-V217 HydrophobicContact CB-CG1 4.11Å; V46-V217 HydrophobicContact CG1-CG1 3.7Å; V46-V217 HydrophobicContact CG1-CG2 4.2Å; E213-V217 WeakPolarHBondContact O-CG2 3.25Å; E213-V217 PolarHBondContact O-N 3.24Å; V214-V217 PolarHBondContact O-N 3.21Å; K215-V217 VanDerWaalsContact C-N 3.34Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-Y225 HydrophobicContact CG2-CD2 3.87Å; V217-Y225 HydrophobicContact CG2-CE2 4.06Å; V217-A233 HydrophobicContact CG2-CB 4.27Å
218	F	81.5	Confident	80.3	Confident	56 Å²	56	45.2 Å²	45.2	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-35.1	178.1	-81.2	-105.8	0	0	0	111.3	T43 L47 I150 I153 V214 R224	T43-F218 HydrophobicContact CG2-CD1 3.96Å; T43-F218 HydrophobicContact CG2-CD2 4.07Å; T43-F218 HydrophobicContact CG2-CE1 4Å; T43-F218 HydrophobicContact CG2-CE2 4.11Å; T43-F218 HydrophobicContact CG2-CG 4Å; T43-F218 HydrophobicContact CG2-CZ 4.08Å; L47-F218 HydrophobicContact CD1-CE2 4.08Å; L47-F218 HydrophobicContact CD1-CZ 3.71Å; L47-F218 HydrophobicContact CD2-CE2 4.26Å; I150-F218 HydrophobicContact CB-CZ 4.48Å; I150-F218 HydrophobicContact CD1-CE2 4.48Å; I150-F218 HydrophobicContact CG1-CE2 4.14Å; I150-F218 HydrophobicContact CG1-CZ 4.32Å; I150-F218 HydrophobicContact CG2-CE1 4.06Å; I150-F218 HydrophobicContact CG2-CE2 4.1Å; I150-F218 HydrophobicContact CG2-CZ 3.48Å; I150-F218 VanDerWaalsContact CG2-CZ 3.48Å; I153-F218 HydrophobicContact CG2-CB 4.47Å; V214-F218 HydrophobicContact CG1-CD2 3.72Å; V214-F218 HydrophobicContact CG1-CE2 3.96Å; V214-F218 WeakPolarHBondContact O-CD2 3.33Å; V214-F218 PolarHBondContact O-N 3.23Å; F218-R224 PolarHBondContact O-NH2 2.66Å
219	G	71	Confident	80	Confident	6 Å²	6	41.8 Å²	41.8	6%	0.062	22%	0.216	C	C	.	.			trans	87.1	-151.4	177.5	0	0	0	0	0	116.1	K215 V217	K215-G219 WeakPolarHBondContact CD-O 3.22Å; K215-G219 VanDerWaalsContact CE-O 3.28Å; K215-G219 WeakPolarHBondContact CE-O 3.26Å; K215-G219 PolarHBondContact NZ-O 2.99Å; K215-G219 CarbonylContact O-C 3.49Å; K215-G219 WeakPolarHBondContact O-CA 3.42Å; K215-G219 PolarHBondContact O-N 3.45Å; V217-G219 VanDerWaalsContact C-N 3.33Å
220	G	65.9	Low	79.8	Confident	51 Å²	51	43.4 Å²	43.4	53%	0.526	23%	0.225	S	C	.	.			trans	80.9	19.3	-167.5	0	0	0	0	0	113.5
221	G	65.6	Low	79.7	Confident	15 Å²	15	44 Å²	44	16%	0.155	23%	0.229	C	C	.	.	S	Bend	trans	-128.9	174	170.1	0	0	0	0	0	112.4	D159	D159-G221 WeakPolarHBondContact OD1-CA 3.05Å; D159-G221 WeakPolarHBondContact OD2-CA 3.49Å
222	E	66.7	Low	79.6	Confident	131 Å²	131	42.1 Å²	42.1	61%	0.612	22%	0.219	S	C	*	.	S	Bend	trans	-63.1	-39.9	-179.6	-169.8	176.8	-178.8	0	0	112.2	D159 T161	D159-E222 PolarHBondContact OD2-N 3Å; T161-E222 PolarHBondContact OG1-N 3.43Å
223	F	69.5	Low	79.6	Confident	94 Å²	94	41.9 Å²	41.9	41%	0.412	22%	0.218	S	C	.	.			trans	-105.1	126.5	178.6	-63.2	-82.7	0	0	0	111.7	T161	T161-F223 WeakPolarHBondContact O-CD2 3.44Å; T161-F223 PolarHBondContact OG1-N 3.31Å; T161-F223 VanDerWaalsContact OG1-N 3.1Å
224	R	73.1	Confident	79.7	Confident	96 Å²	96	41.4 Å²	41.4	36%	0.362	22%	0.216	S	C	.	.			trans	-136.7	151.8	-179.3	-64	174.9	107.5	173.1	0.8	110	E39 F218	E39-R224 VanDerWaalsContact CD-NH1 3.34Å; E39-R224 IonicContact OE1-CZ 3.58Å; E39-R224 VanDerWaalsContact OE1-CZ 3.31Å; E39-R224 IonicContact OE1-NH1 3.37Å; E39-R224 PolarHBondContact OE1-NH1 3.04Å; E39-R224 IonicContact OE1-NH2 2.99Å; E39-R224 IonicContact OE2-CZ 2.84Å; E39-R224 IonicContact OE2-NH1 3.54Å; E39-R224 PolarHBondContact OE2-NH1 3.32Å; E39-R224 IonicContact OE2-NH2 3.31Å; E39-R224 PolarHBondContact OE2-NH2 3.39Å; F218-R224 PolarHBondContact O-NH2 2.66Å
225	Y	80.4	Confident	79.7	Confident	33 Å²	33	41.8 Å²	41.8	13%	0.129	22%	0.22	C	C	.	.			trans	-65.1	138.2	171	-74.8	-69.1	0	0	0	110.9	E213 M216 V217 D229 A233 I236	E213-Y225 PolarHBondContact OE2-OH 2.82Å; M216-Y225 HydrophobicContact CB-CD2 3.88Å; M216-Y225 HydrophobicContact CB-CE2 3.72Å; M216-Y225 HydrophobicContact CE-CE1 4.48Å; M216-Y225 HydrophobicContact CE-CE2 3.7Å; M216-Y225 VanDerWaalsContact CE-OH 3.24Å; M216-Y225 WeakPolarHBondContact CE-OH 3.4Å; M216-Y225 PolarHBondContact O-N 3.38Å; V217-Y225 HydrophobicContact CG2-CD2 3.87Å; V217-Y225 HydrophobicContact CG2-CE2 4.06Å; Y225-D229 HydrophobicContact CD1-CB 4.34Å; Y225-A233 HydrophobicContact CD1-CB 4.24Å; Y225-A233 HydrophobicContact CD2-CB 3.8Å; Y225-A233 HydrophobicContact CE2-CB 4.24Å; Y225-A233 HydrophobicContact CG-CB 3.81Å; Y225-I236 HydrophobicContact CE1-CD1 4.06Å; Y225-I236 WeakPolarHBondContact OH-CD1 3.28Å
226	S	77.7	Confident	79.8	Confident	51 Å²	51	42.7 Å²	42.7	36%	0.357	22%	0.224	S	C	.	.			trans	-70.7	152.8	171.9	-172.6	0	0	0	0	110.1	F42 M228 D229	F42-S226 WeakPolarHBondContact CE2-O 3.26Å; S226-M228 PolarHBondContact O-N 3.24Å; S226-M228 VanDerWaalsContact O-N 3.15Å; S226-D229 WeakPolarHBondContact O-CA 3.45Å; S226-D229 WeakPolarHBondContact O-CB 3.29Å; S226-D229 PolarHBondContact O-N 3.38Å
227	Q	75.8	Confident	80.1	Confident	108 Å²	108	42.5 Å²	42.5	51%	0.505	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-58.8	-27.5	172.8	-67.6	-170.6	-33.1	0	0	113	N38 F42 D229 L230	N38-Q227 PolarHBondContact O-NE2 3.02Å; F42-Q227 HydrophobicContact CD2-CB 4.35Å; F42-Q227 HydrophobicContact CD2-CG 4.18Å; Q227-D229 PolarHBondContact O-N 2.83Å; Q227-L230 WeakPolarHBondContact O-CB 3.3Å; Q227-L230 PolarHBondContact O-N 3.11Å
228	M	76.2	Confident	80.4	Confident	134 Å²	134	42.3 Å²	42.3	66%	0.66	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-68	-20	173.9	-64.6	-175.3	-70.9	0	0	113	S226	S226-M228 PolarHBondContact O-N 3.24Å; S226-M228 VanDerWaalsContact O-N 3.15Å
229	D	82.6	Confident	80.8	Confident	13 Å²	13	40 Å²	40	7%	0.07	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-99.1	22.1	-178	-66.3	-36.4	0	0	0	111.9	R103 Y225 S226 Q227 V231 L232 A233	R103-D229 WeakPolarHBondContact CG-OD1 3.44Å; R103-D229 IonicContact CZ-OD1 3.38Å; R103-D229 IonicContact CZ-OD2 3.72Å; R103-D229 IonicContact NE-OD1 2.68Å; R103-D229 PolarHBondContact NE-OD1 2.93Å; R103-D229 IonicContact NE-OD2 3.77Å; R103-D229 IonicContact NH2-OD1 3.22Å; R103-D229 PolarHBondContact NH2-OD1 3.16Å; R103-D229 IonicContact NH2-OD2 2.64Å; R103-D229 PolarHBondContact NH2-OD2 3.4Å; Y225-D229 HydrophobicContact CD1-CB 4.34Å; S226-D229 WeakPolarHBondContact O-CA 3.45Å; S226-D229 WeakPolarHBondContact O-CB 3.29Å; S226-D229 PolarHBondContact O-N 3.38Å; Q227-D229 PolarHBondContact O-N 2.83Å; D229-V231 PolarHBondContact O-N 3.34Å; D229-L232 HydrophobicContact CB-CB 4.06Å; D229-L232 HydrophobicContact CB-CD2 4.06Å; D229-L232 WeakPolarHBondContact O-CB 3.46Å; D229-L232 PolarHBondContact O-N 2.96Å; D229-A233 WeakPolarHBondContact O-CB 3.35Å; D229-A233 PolarHBondContact O-N 2.87Å
230	L	85.9	Confident	81.8	Confident	37 Å²	37	39.7 Å²	39.7	19%	0.194	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-47	-179.2	-177.7	155.3	0	0	0	112.7	F42 N45 V46 I49 Q227 A234	F42-L230 HydrophobicContact CD2-CB 4.16Å; F42-L230 HydrophobicContact CD2-CD1 4.17Å; F42-L230 HydrophobicContact CD2-CG 4.32Å; F42-L230 HydrophobicContact CE2-CB 3.78Å; F42-L230 HydrophobicContact CE2-CG 4.27Å; N45-L230 HydrophobicContact CB-CD1 3.74Å; N45-L230 HydrophobicContact CB-CD2 4.45Å; N45-L230 HydrophobicContact CB-CG 4.37Å; V46-L230 HydrophobicContact CG2-CG 4.03Å; I49-L230 HydrophobicContact CD1-CD2 3.36Å; Q227-L230 WeakPolarHBondContact O-CB 3.3Å; Q227-L230 PolarHBondContact O-N 3.11Å; L230-A234 PolarHBondContact O-N 3.45Å
231	V	87.2	Confident	83	Confident	13 Å²	13	37.7 Å²	37.7	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-37.2	179.1	-176.4	0	0	0	0	110.8	W95 N108 I109 L112 D229 A234 G235	W95-V231 HydrophobicContact CH2-CG1 3.92Å; W95-V231 HydrophobicContact CZ2-CG1 3.97Å; N108-V231 HydrophobicContact CB-CB 4.26Å; N108-V231 HydrophobicContact CB-CG1 4Å; N108-V231 HydrophobicContact CB-CG2 4.4Å; I109-V231 HydrophobicContact CD1-CG2 4.4Å; L112-V231 HydrophobicContact CB-CG1 4.39Å; L112-V231 HydrophobicContact CD1-CG1 3.65Å; D229-V231 PolarHBondContact O-N 3.34Å; V231-A234 PolarHBondContact O-N 2.96Å; V231-G235 PolarHBondContact O-N 2.93Å
232	L	87.3	Confident	84.2	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.063	18%	0.181	C	C	.	.	H	α-helix	trans	-59.4	-51.8	175.5	176.9	58	0	0	0	110.6	W95 P99 S102 D229 A234 G235 I236	W95-L232 HydrophobicContact CG-CD1 4.19Å; W95-L232 VanDerWaalsContact NE1-CD1 3.26Å; W95-L232 PolarHBondContact NE1-O 2.95Å; P99-L232 HydrophobicContact CB-CD2 3.73Å; S102-L232 VanDerWaalsContact OG-CA 3.22Å; S102-L232 WeakPolarHBondContact OG-CA 3.4Å; S102-L232 WeakPolarHBondContact OG-CB 3.25Å; S102-L232 PolarHBondContact OG-N 3.48Å; S102-L232 VanDerWaalsContact OG-N 3.12Å; D229-L232 HydrophobicContact CB-CB 4.06Å; D229-L232 HydrophobicContact CB-CD2 4.06Å; D229-L232 WeakPolarHBondContact O-CB 3.46Å; D229-L232 PolarHBondContact O-N 2.96Å; L232-A234 PolarHBondContact O-N 3.47Å; L232-G235 PolarHBondContact O-N 3.11Å; L232-I236 HydrophobicContact CD1-CD1 3.73Å; L232-I236 HydrophobicContact CD1-CG1 4.27Å; L232-I236 HydrophobicContact CG-CD1 3.9Å; L232-I236 WeakPolarHBondContact O-CG1 3.36Å; L232-I236 PolarHBondContact O-N 3.43Å
233	A	88.6	Confident	85.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-42.6	179	0	0	0	0	0	112	F42 V46 V217 Y225 D229 I236 L237	F42-A233 HydrophobicContact CZ-CB 4.23Å; V46-A233 HydrophobicContact CG1-CB 4.09Å; V46-A233 HydrophobicContact CG2-CB 4.03Å; V217-A233 HydrophobicContact CG2-CB 4.27Å; Y225-A233 HydrophobicContact CD1-CB 4.24Å; Y225-A233 HydrophobicContact CD2-CB 3.8Å; Y225-A233 HydrophobicContact CE2-CB 4.24Å; Y225-A233 HydrophobicContact CG-CB 3.81Å; D229-A233 WeakPolarHBondContact O-CB 3.35Å; D229-A233 PolarHBondContact O-N 2.87Å; A233-I236 PolarHBondContact O-N 2.68Å; A233-L237 VanDerWaalsContact O-CB 3.31Å; A233-L237 WeakPolarHBondContact O-CB 3.38Å; A233-L237 PolarHBondContact O-N 3.29Å
234	A	90.3	Very high	86.4	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-45.6	176.5	0	0	0	0	0	112	V46 I49 T50 L230 V231 L232 I236 L237 Y238	V46-A234 HydrophobicContact CG1-CB 4.23Å; I49-A234 HydrophobicContact CB-CB 3.8Å; I49-A234 HydrophobicContact CD1-CB 4.47Å; I49-A234 HydrophobicContact CG2-CB 3.62Å; T50-A234 PolarHBondContact OG1-O 3.39Å; L230-A234 PolarHBondContact O-N 3.45Å; V231-A234 PolarHBondContact O-N 2.96Å; L232-A234 PolarHBondContact O-N 3.47Å; A234-I236 VanDerWaalsContact C-N 3.34Å; A234-I236 PolarHBondContact O-N 3.29Å; A234-L237 PolarHBondContact O-N 3.02Å; A234-Y238 WeakPolarHBondContact O-CB 3.49Å; A234-Y238 PolarHBondContact O-N 3.17Å
235	G	89.9	Confident	87.3	Confident	8 Å²	8	22.6 Å²	22.6	8%	0.082	12%	0.117	C	C	.	.	H	α-helix	trans	-63.2	-38.4	177	0	0	0	0	0	113.2	V231 L232 N239	V231-G235 PolarHBondContact O-N 2.93Å; L232-G235 PolarHBondContact O-N 3.11Å; G235-N239 WeakPolarHBondContact O-CB 3.3Å; G235-N239 PolarHBondContact O-N 3.2Å
236	I	89.6	Confident	87.8	Confident	28 Å²	28	21.6 Å²	21.6	14%	0.144	11%	0.114	C	C	.	.	H	α-helix	trans	-68.4	-42.5	176.6	-68.6	169.5	0	0	0	110.9	E213 Y225 L232 A233 A234 N239 C240	E213-I236 HydrophobicContact CB-CG2 4.43Å; E213-I236 VanDerWaalsContact CD-CG2 3.4Å; E213-I236 HydrophobicContact CG-CG2 3.85Å; E213-I236 VanDerWaalsContact OE2-CG2 3.32Å; E213-I236 WeakPolarHBondContact OE2-CG2 3.47Å; Y225-I236 HydrophobicContact CE1-CD1 4.06Å; Y225-I236 WeakPolarHBondContact OH-CD1 3.28Å; L232-I236 HydrophobicContact CD1-CD1 3.73Å; L232-I236 HydrophobicContact CD1-CG1 4.27Å; L232-I236 HydrophobicContact CG-CD1 3.9Å; L232-I236 WeakPolarHBondContact O-CG1 3.36Å; L232-I236 PolarHBondContact O-N 3.43Å; A233-I236 PolarHBondContact O-N 2.68Å; A234-I236 VanDerWaalsContact C-N 3.34Å; A234-I236 PolarHBondContact O-N 3.29Å; I236-N239 WeakPolarHBondContact O-CB 3.25Å; I236-N239 PolarHBondContact O-N 2.88Å; I236-C240 PolarHBondContact O-N 3.11Å; I236-C240 PolarHBondContact O-SG 3.39Å
237	L	91.3	Very high	88.5	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-65.7	-41.5	178.3	-171.2	61.9	0	0	0	111.5	V46 L47 T50 F146 L210 V214 A233 A234 N239 C240 W241	V46-L237 HydrophobicContact CG1-CD2 4.21Å; L47-L237 HydrophobicContact CD2-CD2 3.85Å; T50-L237 HydrophobicContact CG2-CB 4.25Å; T50-L237 HydrophobicContact CG2-CD2 4.17Å; T50-L237 HydrophobicContact CG2-CG 4.01Å; F146-L237 HydrophobicContact CE2-CD1 3.77Å; F146-L237 HydrophobicContact CE2-CG 4.03Å; F146-L237 HydrophobicContact CZ-CD1 3.84Å; F146-L237 HydrophobicContact CZ-CD2 3.95Å; F146-L237 HydrophobicContact CZ-CG 3.76Å; L210-L237 HydrophobicContact CD1-CD1 4.32Å; V214-L237 HydrophobicContact CG2-CD1 3.63Å; A233-L237 VanDerWaalsContact O-CB 3.31Å; A233-L237 WeakPolarHBondContact O-CB 3.38Å; A233-L237 PolarHBondContact O-N 3.29Å; A234-L237 PolarHBondContact O-N 3.02Å; L237-N239 VanDerWaalsContact C-N 3.32Å; L237-N239 PolarHBondContact O-N 3.47Å; L237-C240 WeakPolarHBondContact O-CB 3.36Å; L237-C240 PolarHBondContact O-N 3.41Å; L237-W241 PolarHBondContact O-N 3.1Å; L237-W241 VanDerWaalsContact O-N 3.11Å
238	Y	92.8	Very high	89.3	Confident	1 Å²	1	15 Å²	15	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-57.8	-44.7	171.3	172.1	-99.3	0	0	0	111.8	Q53 T57 S119 A234 C240 W241 W242	Q53-Y238 HydrophobicContact CB-CD2 3.39Å; Q53-Y238 HydrophobicContact CB-CE2 3.66Å; Q53-Y238 HydrophobicContact CB-CG 3.97Å; Q53-Y238 HydrophobicContact CG-CD2 4.43Å; T57-Y238 PolarHBondContact OG1-OH 3.03Å; S119-Y238 WeakPolarHBondContact CB-OH 3.41Å; S119-Y238 PolarHBondContact OG-OH 3.02Å; A234-Y238 WeakPolarHBondContact O-CB 3.49Å; A234-Y238 PolarHBondContact O-N 3.17Å; Y238-C240 VanDerWaalsContact C-N 3.31Å; Y238-C240 PolarHBondContact O-N 3.04Å; Y238-W241 HydrophobicContact CD2-CE3 4.02Å; Y238-W241 HydrophobicContact CD2-CZ3 4.38Å; Y238-W241 AromaticContact CE2-CE3 3.77Å; Y238-W241 HydrophobicContact CE2-CE3 3.77Å; Y238-W241 AromaticContact CE2-CZ3 3.67Å; Y238-W241 HydrophobicContact CE2-CZ3 3.67Å; Y238-W241 PolarHBondContact O-N 3.4Å; Y238-W242 WeakPolarHBondContact O-CB 3.41Å; Y238-W242 PolarHBondContact O-N 3.2Å
239	N	90.3	Very high	90	Very high	7 Å²	7	8.7 Å²	8.7	4%	0.037	5%	0.047	C	C	.	.	H	α-helix	trans	-62.8	-35.7	176.3	179.6	28.4	0	0	0	112.6	Y88 Q92 K209 G235 I236 L237 W241 W242 N243	Y88-N239 PolarHBondContact OH-OD1 2.88Å; Y88-N239 VanDerWaalsContact OH-OD1 3.1Å; Q92-N239 PolarHBondContact NE2-ND2 2.93Å; Q92-N239 PolarHBondContact NE2-OD1 2.79Å; Q92-N239 PolarHBondContact OE1-OD1 2.99Å; K209-N239 PolarHBondContact NZ-ND2 3.09Å; G235-N239 WeakPolarHBondContact O-CB 3.3Å; G235-N239 PolarHBondContact O-N 3.2Å; I236-N239 WeakPolarHBondContact O-CB 3.25Å; I236-N239 PolarHBondContact O-N 2.88Å; L237-N239 VanDerWaalsContact C-N 3.32Å; L237-N239 PolarHBondContact O-N 3.47Å; N239-W241 VanDerWaalsContact C-N 3.34Å; N239-W242 PolarHBondContact O-N 3.26Å; N239-N243 WeakPolarHBondContact O-CB 3.28Å; N239-N243 PolarHBondContact O-N 2.87Å; N239-N243 PolarHBondContact O-ND2 3.38Å; N239-N243 PolarHBondContact OD1-ND2 3.3Å
240	C	91.2	Very high	90.4	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.007	4%	0.044	C	C	.	.	H	α-helix	trans	-63.2	-43.2	174.1	-65.1	0	0	0	0	111.7	L210 E213 I236 L237 Y238 S244	L210-C240 HydrophobicContact CB-CB 4.32Å; L210-C240 HydrophobicContact CD1-CB 3.68Å; E213-C240 VanDerWaalsContact CG-SG 3.56Å; I236-C240 PolarHBondContact O-N 3.11Å; I236-C240 PolarHBondContact O-SG 3.39Å; L237-C240 WeakPolarHBondContact O-CB 3.36Å; L237-C240 PolarHBondContact O-N 3.41Å; Y238-C240 VanDerWaalsContact C-N 3.31Å; Y238-C240 PolarHBondContact O-N 3.04Å; C240-S244 WeakPolarHBondContact O-CB 3.32Å; C240-S244 PolarHBondContact O-N 3.33Å; C240-S244 PolarHBondContact O-OG 3.37Å
241	W	91.1	Very high	90.6	Very high	8 Å²	8	9.3 Å²	9.3	3%	0.03	5%	0.049	C	C	.	.	H	α-helix	trans	-64.1	-45.3	173.5	170.2	77.6	0	0	0	111.7	F54 T57 I123 F139 S142 F146 L237 Y238 N239 N243 S244 F245	F54-W241 AromaticContact CD2-CD2 3.64Å; F54-W241 HydrophobicContact CD2-CD2 3.64Å; F54-W241 AromaticContact CD2-CE2 3.23Å; F54-W241 AromaticContact CD2-CE3 3.97Å; F54-W241 HydrophobicContact CD2-CE3 3.97Å; F54-W241 HydrophobicContact CD2-CG 4.4Å; F54-W241 AromaticContact CD2-CH2 3.64Å; F54-W241 HydrophobicContact CD2-CH2 3.64Å; F54-W241 AromaticContact CD2-CZ2 3.29Å; F54-W241 HydrophobicContact CD2-CZ2 3.29Å; F54-W241 AromaticContact CD2-CZ3 3.95Å; F54-W241 HydrophobicContact CD2-CZ3 3.95Å; F54-W241 AromaticContact CD2-NE1 3.69Å; F54-W241 HydrophobicContact CE2-CD2 4.2Å; F54-W241 AromaticContact CE2-CE2 3.33Å; F54-W241 AromaticContact CE2-CH2 3.91Å; F54-W241 HydrophobicContact CE2-CH2 3.91Å; F54-W241 AromaticContact CE2-CZ2 3.2Å; F54-W241 HydrophobicContact CE2-CZ2 3.2Å; F54-W241 AromaticContact CE2-NE1 3.52Å; F54-W241 HydrophobicContact CZ-CZ2 4.5Å; T57-W241 HydrophobicContact CG2-CH2 3.94Å; T57-W241 HydrophobicContact CG2-CZ3 4.03Å; I123-W241 HydrophobicContact CD1-CH2 4.4Å; I123-W241 HydrophobicContact CD1-CZ3 4.5Å; F139-W241 HydrophobicContact CD1-CH2 4.37Å; F139-W241 AromaticContact CD1-CZ2 3.83Å; F139-W241 HydrophobicContact CD1-CZ2 3.83Å; F139-W241 AromaticContact CE1-CH2 3.7Å; F139-W241 HydrophobicContact CE1-CH2 3.7Å; F139-W241 AromaticContact CE1-CZ2 3.63Å; F139-W241 HydrophobicContact CE1-CZ2 3.63Å; S142-W241 PolarHBondContact OG-NE1 3.35Å; F146-W241 HydrophobicContact CD2-CB 4.15Å; F146-W241 HydrophobicContact CE2-CB 4.25Å; L237-W241 PolarHBondContact O-N 3.1Å; L237-W241 VanDerWaalsContact O-N 3.11Å; Y238-W241 HydrophobicContact CD2-CE3 4.02Å; Y238-W241 HydrophobicContact CD2-CZ3 4.38Å; Y238-W241 AromaticContact CE2-CE3 3.77Å; Y238-W241 HydrophobicContact CE2-CE3 3.77Å; Y238-W241 AromaticContact CE2-CZ3 3.67Å; Y238-W241 HydrophobicContact CE2-CZ3 3.67Å; Y238-W241 PolarHBondContact O-N 3.4Å; N239-W241 VanDerWaalsContact C-N 3.34Å; W241-N243 PolarHBondContact O-N 3.19Å; W241-S244 WeakPolarHBondContact O-CA 3.48Å; W241-S244 WeakPolarHBondContact O-CB 3.3Å; W241-S244 PolarHBondContact O-N 3.11Å; W241-F245 HydrophobicContact CH2-CB 4.48Å; W241-F245 HydrophobicContact CZ2-CB 3.91Å; W241-F245 HydrophobicContact CZ2-CD2 4.33Å; W241-F245 HydrophobicContact CZ2-CG 4.1Å; W241-F245 PolarHBondContact O-N 3.36Å
242	W	91.2	Very high	90.7	Very high	13 Å²	13	9.1 Å²	9.1	5%	0.049	5%	0.048	C	C	.	.	H	α-helix	trans	-54.8	-49.4	178	-176.8	98.6	0	0	0	111.6	Y88 I123 L178 Y238 N239 S244 F245 L246	Y88-W242 HydrophobicContact CD1-CH2 4.1Å; Y88-W242 AromaticContact CD1-CZ2 3.87Å; Y88-W242 HydrophobicContact CD1-CZ2 3.87Å; Y88-W242 AromaticContact CE1-CD2 3.69Å; Y88-W242 HydrophobicContact CE1-CD2 3.69Å; Y88-W242 AromaticContact CE1-CE2 3.58Å; Y88-W242 AromaticContact CE1-CE3 3.77Å; Y88-W242 HydrophobicContact CE1-CE3 3.77Å; Y88-W242 HydrophobicContact CE1-CG 4.4Å; Y88-W242 AromaticContact CE1-CH2 3.77Å; Y88-W242 HydrophobicContact CE1-CH2 3.77Å; Y88-W242 AromaticContact CE1-CZ2 3.65Å; Y88-W242 HydrophobicContact CE1-CZ2 3.65Å; Y88-W242 AromaticContact CE1-CZ3 3.82Å; Y88-W242 HydrophobicContact CE1-CZ3 3.82Å; Y88-W242 AromaticContact CZ-CD2 3.86Å; Y88-W242 AromaticContact CZ-CE2 3.98Å; I123-W242 HydrophobicContact CD1-CG 3.97Å; I123-W242 VanDerWaalsContact CG1-NE1 3.33Å; L178-W242 HydrophobicContact CD1-CZ3 4.02Å; Y238-W242 WeakPolarHBondContact O-CB 3.41Å; Y238-W242 PolarHBondContact O-N 3.2Å; N239-W242 PolarHBondContact O-N 3.26Å; W242-S244 VanDerWaalsContact C-N 3.32Å; W242-S244 PolarHBondContact O-N 3.14Å; W242-F245 PolarHBondContact O-N 3.12Å; W242-L246 HydrophobicContact CH2-CD1 3.7Å; W242-L246 HydrophobicContact CH2-CD2 4.36Å; W242-L246 HydrophobicContact CH2-CG 4.5Å; W242-L246 HydrophobicContact CZ2-CD1 3.68Å; W242-L246 HydrophobicContact CZ3-CD1 4.33Å; W242-L246 WeakPolarHBondContact O-CB 3.22Å; W242-L246 PolarHBondContact O-N 3.11Å
243	N	91.2	Very high	90.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-61.8	-40	176.3	-75.2	-51.8	0	0	0	111.9	L178 T206 K209 N239 W241 T247	L178-N243 WeakPolarHBondContact CD1-OD1 3.22Å; T206-N243 HydrophobicContact CG2-CB 3.86Å; K209-N243 PolarHBondContact NZ-ND2 3.26Å; N239-N243 WeakPolarHBondContact O-CB 3.28Å; N239-N243 PolarHBondContact O-N 2.87Å; N239-N243 PolarHBondContact O-ND2 3.38Å; N239-N243 PolarHBondContact OD1-ND2 3.3Å; W241-N243 PolarHBondContact O-N 3.19Å; N243-T247 WeakPolarHBondContact O-CB 3.22Å; N243-T247 VanDerWaalsContact O-CG2 3.3Å; N243-T247 WeakPolarHBondContact O-CG2 3.25Å; N243-T247 PolarHBondContact O-N 3.39Å; N243-T247 PolarHBondContact O-OG1 2.87Å
244	S	90.8	Very high	90.3	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.028	8%	0.081	C	C	.	.	H	α-helix	trans	-65.3	-43.6	178.1	-57.5	0	0	0	0	111.2	C240 W241 W242 T247 L248	C240-S244 WeakPolarHBondContact O-CB 3.32Å; C240-S244 PolarHBondContact O-N 3.33Å; C240-S244 PolarHBondContact O-OG 3.37Å; W241-S244 WeakPolarHBondContact O-CA 3.48Å; W241-S244 WeakPolarHBondContact O-CB 3.3Å; W241-S244 PolarHBondContact O-N 3.11Å; W242-S244 VanDerWaalsContact C-N 3.32Å; W242-S244 PolarHBondContact O-N 3.14Å; S244-T247 WeakPolarHBondContact CA-OG1 3.47Å; S244-T247 PolarHBondContact O-OG1 2.97Å; S244-L248 VanDerWaalsContact O-CG 3.23Å; S244-L248 WeakPolarHBondContact O-CG 3.4Å; S244-L248 PolarHBondContact O-N 2.75Å; S244-L248 VanDerWaalsContact O-N 3.13Å
245	F	92.9	Very high	89.8	Confident	3 Å²	3	21.8 Å²	21.8	1%	0.013	11%	0.11	C	C	.	.	H	α-helix	trans	-62.8	-47.5	176.6	173.6	-96.6	0	0	0	111.8	I123 M138 F139 W241 W242 T247 L248 M249	I123-F245 HydrophobicContact CD1-CD1 3.89Å; I123-F245 HydrophobicContact CD1-CE1 4.34Å; I123-F245 HydrophobicContact CG1-CD1 4.19Å; I123-F245 HydrophobicContact CG1-CE1 4.31Å; I123-F245 HydrophobicContact CG2-CD1 4.15Å; I123-F245 HydrophobicContact CG2-CE1 3.51Å; I123-F245 HydrophobicContact CG2-CZ 4.31Å; M138-F245 HydrophobicContact CB-CE2 4.08Å; F139-F245 HydrophobicContact CB-CE2 4.18Å; F139-F245 AromaticContact CD1-CD2 3.84Å; F139-F245 HydrophobicContact CD1-CD2 3.84Å; F139-F245 AromaticContact CD1-CE2 3.64Å; F139-F245 HydrophobicContact CD1-CE2 3.64Å; F139-F245 HydrophobicContact CD1-CZ 4.33Å; F139-F245 HydrophobicContact CD2-CD2 4.47Å; F139-F245 AromaticContact CD2-CE2 3.49Å; F139-F245 HydrophobicContact CD2-CE2 3.49Å; F139-F245 VanDerWaalsContact CD2-CE2 3.49Å; F139-F245 AromaticContact CD2-CZ 3.78Å; F139-F245 HydrophobicContact CD2-CZ 3.78Å; F139-F245 HydrophobicContact CE1-CD2 4.07Å; F139-F245 AromaticContact CE1-CE2 3.84Å; F139-F245 HydrophobicContact CE1-CE2 3.84Å; F139-F245 HydrophobicContact CE1-CZ 4.1Å; F139-F245 HydrophobicContact CE2-CE1 4.35Å; F139-F245 AromaticContact CE2-CE2 3.66Å; F139-F245 HydrophobicContact CE2-CE2 3.66Å; F139-F245 AromaticContact CE2-CZ 3.47Å; F139-F245 HydrophobicContact CE2-CZ 3.47Å; F139-F245 VanDerWaalsContact CE2-CZ 3.47Å; F139-F245 HydrophobicContact CG-CD2 4.06Å; F139-F245 AromaticContact CG-CE2 3.47Å; F139-F245 HydrophobicContact CG-CE2 3.47Å; F139-F245 VanDerWaalsContact CG-CE2 3.47Å; F139-F245 HydrophobicContact CG-CZ 4.18Å; F139-F245 HydrophobicContact CZ-CD2 4.45Å; F139-F245 HydrophobicContact CZ-CE1 4.13Å; F139-F245 AromaticContact CZ-CE2 3.83Å; F139-F245 HydrophobicContact CZ-CE2 3.83Å; F139-F245 AromaticContact CZ-CZ 3.64Å; F139-F245 HydrophobicContact CZ-CZ 3.64Å; W241-F245 HydrophobicContact CH2-CB 4.48Å; W241-F245 HydrophobicContact CZ2-CB 3.91Å; W241-F245 HydrophobicContact CZ2-CD2 4.33Å; W241-F245 HydrophobicContact CZ2-CG 4.1Å; W241-F245 PolarHBondContact O-N 3.36Å; W242-F245 PolarHBondContact O-N 3.12Å; F245-T247 PolarHBondContact O-N 3.18Å; F245-L248 PolarHBondContact O-N 3.23Å; F245-M249 HydrophobicContact CD1-CG 4.23Å; F245-M249 HydrophobicContact CE1-CG 3.63Å; F245-M249 HydrophobicContact CE2-CG 3.99Å; F245-M249 HydrophobicContact CE2-SD 4.37Å; F245-M249 HydrophobicContact CZ-CG 3.51Å; F245-M249 HydrophobicContact CZ-SD 3.9Å; F245-M249 WeakPolarHBondContact O-CG 3.45Å; F245-M249 PolarHBondContact O-N 3Å
246	L	90.6	Very high	89.2	Confident	11 Å²	11	21.4 Å²	21.4	6%	0.058	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-40.5	-177.9	-161.9	122.4	0	0	0	111.9	L178 W242 L248 M249 W250	L178-L246 HydrophobicContact CD1-CD2 4.16Å; L178-L246 HydrophobicContact CD2-CD2 3.7Å; L178-L246 HydrophobicContact CG-CD2 4.37Å; W242-L246 HydrophobicContact CH2-CD1 3.7Å; W242-L246 HydrophobicContact CH2-CD2 4.36Å; W242-L246 HydrophobicContact CH2-CG 4.5Å; W242-L246 HydrophobicContact CZ2-CD1 3.68Å; W242-L246 HydrophobicContact CZ3-CD1 4.33Å; W242-L246 WeakPolarHBondContact O-CB 3.22Å; W242-L246 PolarHBondContact O-N 3.11Å; L246-L248 PolarHBondContact O-N 3.4Å; L246-M249 WeakPolarHBondContact O-CB 3.29Å; L246-M249 PolarHBondContact O-N 3.31Å; L246-W250 HydrophobicContact CD2-CD2 3.89Å; L246-W250 HydrophobicContact CD2-CE3 4.33Å; L246-W250 HydrophobicContact CD2-CH2 3.83Å; L246-W250 HydrophobicContact CD2-CZ2 3.32Å; L246-W250 HydrophobicContact CD2-CZ3 4.32Å; L246-W250 HydrophobicContact CG-CZ2 4.25Å; L246-W250 WeakPolarHBondContact O-CB 3.22Å; L246-W250 VanDerWaalsContact O-CD1 3.24Å; L246-W250 PolarHBondContact O-N 3.24Å
247	T	91.7	Very high	88.7	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-63.8	-38.4	174.7	48.3	0	0	0	0	113.1	L178 A202 T206 N243 S244 F245 W250 I251	L178-T247 HydrophobicContact CD2-CG2 3.95Å; A202-T247 HydrophobicContact CB-CG2 3.45Å; A202-T247 VanDerWaalsContact CB-CG2 3.45Å; T206-T247 HydrophobicContact CG2-CG2 3.73Å; N243-T247 WeakPolarHBondContact O-CB 3.22Å; N243-T247 VanDerWaalsContact O-CG2 3.3Å; N243-T247 WeakPolarHBondContact O-CG2 3.25Å; N243-T247 PolarHBondContact O-N 3.39Å; N243-T247 PolarHBondContact O-OG1 2.87Å; S244-T247 WeakPolarHBondContact CA-OG1 3.47Å; S244-T247 PolarHBondContact O-OG1 2.97Å; F245-T247 PolarHBondContact O-N 3.18Å; T247-W250 PolarHBondContact O-N 3.4Å; T247-I251 WeakPolarHBondContact O-CG1 3.5Å; T247-I251 PolarHBondContact O-N 2.95Å
248	L	92.1	Very high	88.1	Confident	19 Å²	19	23.5 Å²	23.5	10%	0.099	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-45.6	173.9	-71.9	169.6	0	0	0	112.2	M138 V141 L145 L203 S244 F245 L246 W250 I251 S252	M138-L248 HydrophobicContact SD-CB 4.01Å; V141-L248 HydrophobicContact CB-CD1 4.31Å; V141-L248 HydrophobicContact CG1-CD1 3.87Å; V141-L248 HydrophobicContact CG1-CD2 4.09Å; L145-L248 HydrophobicContact CD1-CD1 4Å; L145-L248 HydrophobicContact CD1-CD2 4.08Å; L145-L248 HydrophobicContact CD1-CG 4.48Å; L203-L248 HydrophobicContact CD1-CD2 4.03Å; S244-L248 VanDerWaalsContact O-CG 3.23Å; S244-L248 WeakPolarHBondContact O-CG 3.4Å; S244-L248 PolarHBondContact O-N 2.75Å; S244-L248 VanDerWaalsContact O-N 3.13Å; F245-L248 PolarHBondContact O-N 3.23Å; L246-L248 PolarHBondContact O-N 3.4Å; L248-W250 VanDerWaalsContact C-N 3.27Å; L248-W250 PolarHBondContact O-N 3.15Å; L248-I251 PolarHBondContact O-N 3.33Å; L248-S252 PolarHBondContact O-N 3.3Å
249	M	90.9	Very high	86.7	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-54.1	-48.1	174.1	-79.5	-69	-67.7	0	0	110.7	A127 Y130 V135 M138 F245 L246 I251 S252 T253	A127-M249 HydrophobicContact CB-CE 4.37Å; Y130-M249 HydrophobicContact CD1-CE 3.8Å; Y130-M249 HydrophobicContact CD2-CE 3.27Å; Y130-M249 HydrophobicContact CE1-CE 4.08Å; Y130-M249 VanDerWaalsContact CE1-O 3.3Å; Y130-M249 WeakPolarHBondContact CE1-O 3.39Å; Y130-M249 HydrophobicContact CE2-CE 3.62Å; Y130-M249 HydrophobicContact CG-CE 3.38Å; Y130-M249 PolarHBondContact OH-O 3.35Å; V135-M249 HydrophobicContact CG2-CE 3.87Å; V135-M249 HydrophobicContact CG2-SD 4.35Å; M138-M249 HydrophobicContact CB-CG 4.2Å; M138-M249 HydrophobicContact CB-SD 3.75Å; M138-M249 HydrophobicContact CG-CG 4.44Å; M138-M249 HydrophobicContact CG-SD 3.81Å; F245-M249 HydrophobicContact CD1-CG 4.23Å; F245-M249 HydrophobicContact CE1-CG 3.63Å; F245-M249 HydrophobicContact CE2-CG 3.99Å; F245-M249 HydrophobicContact CE2-SD 4.37Å; F245-M249 HydrophobicContact CZ-CG 3.51Å; F245-M249 HydrophobicContact CZ-SD 3.9Å; F245-M249 WeakPolarHBondContact O-CG 3.45Å; F245-M249 PolarHBondContact O-N 3Å; L246-M249 WeakPolarHBondContact O-CB 3.29Å; L246-M249 PolarHBondContact O-N 3.31Å; M249-I251 PolarHBondContact O-N 2.97Å; M249-S252 CarbonylContact O-C 3.55Å; M249-S252 WeakPolarHBondContact O-CA 3.3Å; M249-S252 WeakPolarHBondContact O-CB 3.43Å; M249-S252 PolarHBondContact O-N 3.42Å; M249-S252 PolarHBondContact O-OG 3.35Å; M249-T253 PolarHBondContact O-N 3.05Å
250	W	90.5	Very high	85	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-36.9	-177.8	-72.6	9.6	0	0	0	113.6	D126 L178 Q182 L195 T196 A198 L246 T247 L248 S252 T253	D126-W250 PolarHBondContact OD2-NE1 3.35Å; D126-W250 VanDerWaalsContact OD2-NE1 3.07Å; L178-W250 HydrophobicContact CB-CH2 4.15Å; L178-W250 HydrophobicContact CB-CZ3 4.31Å; L178-W250 HydrophobicContact CD2-CE3 3.81Å; L178-W250 HydrophobicContact CD2-CH2 3.9Å; L178-W250 HydrophobicContact CD2-CZ3 3.43Å; L178-W250 VanDerWaalsContact CD2-CZ3 3.43Å; L178-W250 HydrophobicContact CG-CZ3 4.47Å; L178-W250 WeakPolarHBondContact O-CH2 3.18Å; Q182-W250 HydrophobicContact CB-CH2 4.21Å; Q182-W250 HydrophobicContact CB-CZ2 4.36Å; L195-W250 HydrophobicContact CD1-CB 4.35Å; L195-W250 HydrophobicContact CD1-CD2 3.27Å; L195-W250 HydrophobicContact CD1-CE3 3.62Å; L195-W250 HydrophobicContact CD1-CG 3.62Å; L195-W250 HydrophobicContact CD1-CH2 4.01Å; L195-W250 HydrophobicContact CD1-CZ2 3.72Å; L195-W250 HydrophobicContact CD1-CZ3 3.97Å; L195-W250 HydrophobicContact CD2-CG 4.12Å; L195-W250 HydrophobicContact CG-CB 3.84Å; L195-W250 HydrophobicContact CG-CD2 3.76Å; L195-W250 HydrophobicContact CG-CE3 4.34Å; L195-W250 HydrophobicContact CG-CG 3.51Å; T196-W250 VanDerWaalsContact CA-O 3.26Å; T196-W250 WeakPolarHBondContact CA-O 3.41Å; T196-W250 PolarHBondContact N-O 3.43Å; T196-W250 PolarHBondContact OG1-O 3.03Å; A198-W250 HydrophobicContact CB-CE3 4.1Å; A198-W250 HydrophobicContact CB-CZ3 4.08Å; L246-W250 HydrophobicContact CD2-CD2 3.89Å; L246-W250 HydrophobicContact CD2-CE3 4.33Å; L246-W250 HydrophobicContact CD2-CH2 3.83Å; L246-W250 HydrophobicContact CD2-CZ2 3.32Å; L246-W250 HydrophobicContact CD2-CZ3 4.32Å; L246-W250 HydrophobicContact CG-CZ2 4.25Å; L246-W250 WeakPolarHBondContact O-CB 3.22Å; L246-W250 VanDerWaalsContact O-CD1 3.24Å; L246-W250 PolarHBondContact O-N 3.24Å; T247-W250 PolarHBondContact O-N 3.4Å; L248-W250 VanDerWaalsContact C-N 3.27Å; L248-W250 PolarHBondContact O-N 3.15Å; W250-S252 VanDerWaalsContact C-N 3.27Å; W250-S252 PolarHBondContact O-N 2.87Å; W250-T253 WeakPolarHBondContact CA-OG1 2.97Å; W250-T253 VanDerWaalsContact O-CB 3.28Å; W250-T253 WeakPolarHBondContact O-CB 3.48Å; W250-T253 PolarHBondContact O-N 3.31Å; W250-T253 PolarHBondContact O-OG1 2.85Å
251	I	90.3	Very high	83	Confident	59 Å²	59	38.7 Å²	38.7	30%	0.303	20%	0.195	S	C	.	.	H	α-helix	trans	-63	-38.7	170.7	-71.1	167.4	0	0	0	110.6	L203 T247 L248 M249 T253	L203-I251 HydrophobicContact CB-CD1 3.87Å; L203-I251 HydrophobicContact CD1-CD1 3.32Å; L203-I251 HydrophobicContact CG-CD1 4.19Å; T247-I251 WeakPolarHBondContact O-CG1 3.5Å; T247-I251 PolarHBondContact O-N 2.95Å; L248-I251 PolarHBondContact O-N 3.33Å; M249-I251 PolarHBondContact O-N 2.97Å; I251-T253 PolarHBondContact O-N 3.18Å
252	S	89.4	Confident	80.9	Confident	9 Å²	9	40.7 Å²	40.7	6%	0.063	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-2.6	178.4	80.1	0	0	0	0	114.9	L248 M249 W250 Y254 S255 G256	L248-S252 PolarHBondContact O-N 3.3Å; M249-S252 CarbonylContact O-C 3.55Å; M249-S252 WeakPolarHBondContact O-CA 3.3Å; M249-S252 WeakPolarHBondContact O-CB 3.43Å; M249-S252 PolarHBondContact O-N 3.42Å; M249-S252 PolarHBondContact O-OG 3.35Å; W250-S252 VanDerWaalsContact C-N 3.27Å; W250-S252 PolarHBondContact O-N 2.87Å; S252-Y254 PolarHBondContact O-N 2.96Å; S252-Y254 VanDerWaalsContact O-N 3.14Å; S252-S255 PolarHBondContact O-N 3.47Å; S252-S255 VanDerWaalsContact O-N 3.11Å; S252-S255 PolarHBondContact O-OG 3.07Å; S252-S255 VanDerWaalsContact O-OG 3.12Å; S252-G256 PolarHBondContact O-N 3.41Å
253	T	87.9	Confident	78.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-52.9	-38.3	-178.5	-53.4	0	0	0	0	113.5	Y130 K192 L195 M249 W250 I251 S255 G256 L257	Y130-T253 PolarHBondContact OH-OG1 2.93Å; K192-T253 HydrophobicContact CB-CG2 3.97Å; K192-T253 HydrophobicContact CG-CG2 4.32Å; L195-T253 HydrophobicContact CB-CG2 4.22Å; L195-T253 HydrophobicContact CD2-CG2 4.13Å; L195-T253 WeakPolarHBondContact CD2-OG1 3.44Å; M249-T253 PolarHBondContact O-N 3.05Å; W250-T253 WeakPolarHBondContact CA-OG1 2.97Å; W250-T253 VanDerWaalsContact O-CB 3.28Å; W250-T253 WeakPolarHBondContact O-CB 3.48Å; W250-T253 PolarHBondContact O-N 3.31Å; W250-T253 PolarHBondContact O-OG1 2.85Å; I251-T253 PolarHBondContact O-N 3.18Å; T253-S255 VanDerWaalsContact C-N 3.28Å; T253-S255 PolarHBondContact O-N 3.04Å; T253-G256 PolarHBondContact O-N 2.95Å; T253-L257 HydrophobicContact CG2-CB 4.22Å; T253-L257 HydrophobicContact CG2-CD1 4.29Å; T253-L257 HydrophobicContact CG2-CD2 4.37Å; T253-L257 PolarHBondContact O-N 3.17Å
254	Y	81.1	Confident	76.7	Confident	192 Å²	192	49.6 Å²	49.6	75%	0.753	26%	0.263	S	S	*	.	H	α-helix	trans	-61.2	-37.4	-177.9	-168.8	-93.6	0	0	0	112.7	S252	S252-Y254 PolarHBondContact O-N 2.96Å; S252-Y254 VanDerWaalsContact O-N 3.14Å
255	S	78.4	Confident	74.6	Confident	87 Å²	87	54 Å²	54	61%	0.608	29%	0.285	S	S	*	.	H	α-helix	trans	-96	-21.4	178.9	54.3	0	0	0	0	113.5	S252 T253	S252-S255 PolarHBondContact O-N 3.47Å; S252-S255 VanDerWaalsContact O-N 3.11Å; S252-S255 PolarHBondContact O-OG 3.07Å; S252-S255 VanDerWaalsContact O-OG 3.12Å; T253-S255 VanDerWaalsContact C-N 3.28Å; T253-S255 PolarHBondContact O-N 3.04Å
256	G	78.2	Confident	72.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-113.4	-12.6	-162.6	0	0	0	0	0	118.6	Y130 F131 S252 T253 K258	Y130-G256 CarbonylContact C-O 3.59Å; Y130-G256 WeakPolarHBondContact CA-O 3.47Å; F131-G256 VanDerWaalsContact CD2-O 3.28Å; F131-G256 WeakPolarHBondContact CD2-O 3.28Å; F131-G256 PolarHBondContact N-O 3.42Å; S252-G256 PolarHBondContact O-N 3.41Å; T253-G256 PolarHBondContact O-N 2.95Å; G256-K258 PolarHBondContact O-N 2.71Å
257	L	79.6	Confident	70.3	Confident	16 Å²	16	62.2 Å²	62.2	8%	0.084	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-69.9	128.1	179	-153.4	74.1	0	0	0	110.6	L129 Y130 Y185 K192 T253 D259	L129-L257 HydrophobicContact CB-CD1 3.7Å; L129-L257 WeakPolarHBondContact O-CD1 3.17Å; Y130-L257 HydrophobicContact CD2-CD1 4.44Å; Y130-L257 HydrophobicContact CE2-CD1 4.25Å; Y185-L257 HydrophobicContact CE2-CD2 4.34Å; Y185-L257 WeakPolarHBondContact OH-CD2 3.49Å; K192-L257 HydrophobicContact CD-CB 4.33Å; K192-L257 HydrophobicContact CD-CD2 4.26Å; K192-L257 HydrophobicContact CG-CD2 3.86Å; T253-L257 HydrophobicContact CG2-CB 4.22Å; T253-L257 HydrophobicContact CG2-CD1 4.29Å; T253-L257 HydrophobicContact CG2-CD2 4.37Å; T253-L257 PolarHBondContact O-N 3.17Å; L257-D259 PolarHBondContact O-N 3.22Å
258	K	77.7	Confident	68.3	Low	56 Å²	56	65 Å²	65	24%	0.243	35%	0.351	C	S	.	.			trans	-64.5	120	172.8	-72.7	169.5	174.5	155.8	0	108.7	T128 L129 Y130 F131 G256 L260	T128-K258 PolarHBondContact O-NZ 3.44Å; L129-K258 PolarHBondContact O-N 3.02Å; Y130-K258 WeakPolarHBondContact O-CE 3.3Å; Y130-K258 PolarHBondContact O-NZ 3.11Å; F131-K258 HydrophobicContact CD1-CG 3.79Å; F131-K258 HydrophobicContact CD2-CG 4.27Å; F131-K258 HydrophobicContact CE1-CG 3.77Å; F131-K258 HydrophobicContact CE2-CG 4.25Å; F131-K258 HydrophobicContact CG-CG 4.05Å; F131-K258 HydrophobicContact CZ-CB 4.39Å; F131-K258 HydrophobicContact CZ-CG 4.01Å; G256-K258 PolarHBondContact O-N 2.71Å; K258-L260 PolarHBondContact O-N 3.29Å; K258-L260 VanDerWaalsContact O-N 3.17Å
259	D	63	Low	66.4	Low	88 Å²	88	68.4 Å²	68.4	47%	0.471	37%	0.37	S	S	.	.			trans	-69.2	113.9	169.1	-75.4	-23.7	0	0	0	108.4	K192 L257 N261 S262	K192-D259 IonicContact NZ-OD1 2.71Å; K192-D259 PolarHBondContact NZ-OD1 2.89Å; L257-D259 PolarHBondContact O-N 3.22Å; D259-N261 PolarHBondContact O-N 2.72Å; D259-S262 WeakPolarHBondContact O-CB 3.43Å; D259-S262 PolarHBondContact O-N 3.07Å; D259-S262 PolarHBondContact O-OG 3.01Å
260	L	55.6	Low	64.7	Low	122 Å²	122	72.3 Å²	72.3	64%	0.639	39%	0.393	S	S	*	.	H	α-helix	trans	-51.4	-26.6	175.2	-79.5	157.1	0	0	0	112.6	K258	K258-L260 PolarHBondContact O-N 3.29Å; K258-L260 VanDerWaalsContact O-N 3.17Å
261	N	49.6	Very low	63.1	Low	118 Å²	118	77.7 Å²	77.7	63%	0.631	42%	0.419	S	S	*	.	H	α-helix	trans	-73.7	-26.9	176.5	-79.1	-7.8	0	0	0	114.2	D259 T263 N264 I265	D259-N261 PolarHBondContact O-N 2.72Å; N261-T263 VanDerWaalsContact C-N 3.27Å; N261-T263 PolarHBondContact O-N 3.29Å; N261-N264 PolarHBondContact O-N 3.11Å; N261-I265 WeakPolarHBondContact O-CG1 3.39Å; N261-I265 PolarHBondContact O-N 3.19Å
262	S	47.2	Very low	61.5	Low	50 Å²	50	77.8 Å²	77.8	35%	0.35	43%	0.425	S	S	.	.	H	α-helix	trans	-64.1	-33	-177	65.2	0	0	0	0	112.5	D259 T266	D259-S262 WeakPolarHBondContact O-CB 3.43Å; D259-S262 PolarHBondContact O-N 3.07Å; D259-S262 PolarHBondContact O-OG 3.01Å; S262-T266 PolarHBondContact O-N 3.32Å
263	T	47.6	Very low	59.9	Low	90 Å²	90	79.9 Å²	79.9	55%	0.552	44%	0.439	S	S	*	.	H	α-helix	trans	-76.2	-32.2	179.7	-5.4	0	0	0	0	112.3	N261 T266 L267	N261-T263 VanDerWaalsContact C-N 3.27Å; N261-T263 PolarHBondContact O-N 3.29Å; T263-T266 PolarHBondContact O-OG1 3.33Å; T263-L267 PolarHBondContact O-N 3.02Å; T263-L267 VanDerWaalsContact O-N 3.11Å
264	N	45.8	Very low	58.5	Low	110 Å²	110	83.5 Å²	83.5	59%	0.588	46%	0.461	S	S	*	.	H	α-helix	trans	-70.4	-35.2	174.3	-79.2	-8.6	0	0	0	112	N261 L267 S268	N261-N264 PolarHBondContact O-N 3.11Å; N264-L267 PolarHBondContact O-N 3.3Å; N264-S268 WeakPolarHBondContact O-CB 3.21Å; N264-S268 PolarHBondContact O-N 3.45Å; N264-S268 PolarHBondContact O-OG 2.8Å
265	I	46.7	Very low	57.4	Low	96 Å²	96	78.9 Å²	78.9	49%	0.492	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-40.7	177.6	-63.4	164.3	0	0	0	110.7	N261 S268 N269	N261-I265 WeakPolarHBondContact O-CG1 3.39Å; N261-I265 PolarHBondContact O-N 3.19Å; I265-S268 PolarHBondContact O-OG 2.83Å; I265-N269 WeakPolarHBondContact O-CB 3.36Å; I265-N269 PolarHBondContact O-N 3.48Å; I265-N269 PolarHBondContact O-ND2 3.26Å; I265-N269 PolarHBondContact O-OD1 2.84Å
266	T	45.2	Very low	56.2	Low	84 Å²	84	80.3 Å²	80.3	52%	0.515	45%	0.45	S	S	.	.	H	α-helix	trans	-68.2	-41.1	177	54.4	0	0	0	0	111.5	S262 T263 N269 V270	S262-T266 PolarHBondContact O-N 3.32Å; T263-T266 PolarHBondContact O-OG1 3.33Å; T266-N269 PolarHBondContact O-N 3.47Å; T266-V270 VanDerWaalsContact O-CG2 3.28Å; T266-V270 WeakPolarHBondContact O-CG2 3.28Å; T266-V270 PolarHBondContact O-N 2.88Å
267	L	48.7	Very low	55.1	Low	103 Å²	103	85.2 Å²	85.2	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-65.7	-42.3	176.1	-153.6	80.2	0	0	0	111.7	T263 N264 N269 V270 E271	T263-L267 PolarHBondContact O-N 3.02Å; T263-L267 VanDerWaalsContact O-N 3.11Å; N264-L267 PolarHBondContact O-N 3.3Å; L267-N269 VanDerWaalsContact C-N 3.31Å; L267-N269 PolarHBondContact O-N 2.9Å; L267-V270 PolarHBondContact O-N 3.36Å; L267-E271 WeakPolarHBondContact O-CB 3.24Å; L267-E271 WeakPolarHBondContact O-CG 3.35Å; L267-E271 PolarHBondContact O-N 3.11Å
268	S	48.7	Very low	54.1	Low	60 Å²	60	87.8 Å²	87.8	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-67	-32.9	176.1	82.7	0	0	0	0	112.2	N264 I265 S272	N264-S268 WeakPolarHBondContact O-CB 3.21Å; N264-S268 PolarHBondContact O-N 3.45Å; N264-S268 PolarHBondContact O-OG 2.8Å; I265-S268 PolarHBondContact O-OG 2.83Å; S268-S272 VanDerWaalsContact O-CB 3.24Å; S268-S272 WeakPolarHBondContact O-CB 3.48Å; S268-S272 PolarHBondContact O-N 2.87Å; S268-S272 PolarHBondContact O-OG 2.98Å
269	N	52.5	Low	53	Low	91 Å²	91	90.8 Å²	90.8	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-70.6	-36	174.2	-73.6	-9.2	0	0	0	111.7	I265 T266 L267 S272 S273	I265-N269 WeakPolarHBondContact O-CB 3.36Å; I265-N269 PolarHBondContact O-N 3.48Å; I265-N269 PolarHBondContact O-ND2 3.26Å; I265-N269 PolarHBondContact O-OD1 2.84Å; T266-N269 PolarHBondContact O-N 3.47Å; L267-N269 VanDerWaalsContact C-N 3.31Å; L267-N269 PolarHBondContact O-N 2.9Å; N269-S272 VanDerWaalsContact CA-OG 3.31Å; N269-S272 WeakPolarHBondContact CA-OG 3.28Å; N269-S272 PolarHBondContact O-OG 3.29Å; N269-S272 VanDerWaalsContact O-OG 3.11Å; N269-S273 VanDerWaalsContact O-CB 3.3Å; N269-S273 WeakPolarHBondContact O-CB 3.48Å; N269-S273 PolarHBondContact O-N 3.02Å; N269-S273 PolarHBondContact O-OG 3.31Å
270	V	55.5	Low	52.8	Low	84 Å²	84	91.2 Å²	91.2	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-70.2	-45.7	173.2	174	0	0	0	0	110.6	T266 L267 S272 S273 V274	T266-V270 VanDerWaalsContact O-CG2 3.28Å; T266-V270 WeakPolarHBondContact O-CG2 3.28Å; T266-V270 PolarHBondContact O-N 2.88Å; L267-V270 PolarHBondContact O-N 3.36Å; V270-S272 PolarHBondContact O-N 3.46Å; V270-S273 WeakPolarHBondContact CA-OG 3.23Å; V270-S273 PolarHBondContact O-N 3.22Å; V270-S273 PolarHBondContact O-OG 3.42Å; V270-V274 HydrophobicContact CG1-CG2 4.26Å; V270-V274 WeakPolarHBondContact O-CB 3.4Å; V270-V274 VanDerWaalsContact O-CG2 3.23Å; V270-V274 WeakPolarHBondContact O-CG2 3.31Å; V270-V274 PolarHBondContact O-N 2.69Å
271	E	56.2	Low	52.7	Low	116 Å²	116	93.7 Å²	93.7	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-62.7	-42	176.6	-76.2	-177	164.2	0	0	112	L267 V274 N275	L267-E271 WeakPolarHBondContact O-CB 3.24Å; L267-E271 WeakPolarHBondContact O-CG 3.35Å; L267-E271 PolarHBondContact O-N 3.11Å; E271-V274 PolarHBondContact O-N 3.46Å; E271-N275 VanDerWaalsContact O-CB 3.28Å; E271-N275 WeakPolarHBondContact O-CB 3.35Å; E271-N275 PolarHBondContact O-N 2.9Å; E271-N275 PolarHBondContact O-ND2 3.37Å
272	S	56.9	Low	52.8	Low	62 Å²	62	97 Å²	97	43%	0.434	53%	0.53	S	S	.	.	H	α-helix	trans	-68.1	-36.9	176.2	54.3	0	0	0	0	112.8	S268 N269 V270 N275 L276	S268-S272 VanDerWaalsContact O-CB 3.24Å; S268-S272 WeakPolarHBondContact O-CB 3.48Å; S268-S272 PolarHBondContact O-N 2.87Å; S268-S272 PolarHBondContact O-OG 2.98Å; N269-S272 VanDerWaalsContact CA-OG 3.31Å; N269-S272 WeakPolarHBondContact CA-OG 3.28Å; N269-S272 PolarHBondContact O-OG 3.29Å; N269-S272 VanDerWaalsContact O-OG 3.11Å; V270-S272 PolarHBondContact O-N 3.46Å; S272-N275 PolarHBondContact O-N 3.01Å; S272-L276 WeakPolarHBondContact O-CB 3.3Å; S272-L276 PolarHBondContact O-N 2.67Å
273	S	56.4	Low	52.9	Low	53 Å²	53	104.5 Å²	104.5	37%	0.371	57%	0.566	S	S	.	*	H	α-helix	trans	-71.8	-36.6	174.8	50.9	0	0	0	0	112.5	N269 V270 L276 I277	N269-S273 VanDerWaalsContact O-CB 3.3Å; N269-S273 WeakPolarHBondContact O-CB 3.48Å; N269-S273 PolarHBondContact O-N 3.02Å; N269-S273 PolarHBondContact O-OG 3.31Å; V270-S273 WeakPolarHBondContact CA-OG 3.23Å; V270-S273 PolarHBondContact O-N 3.22Å; V270-S273 PolarHBondContact O-OG 3.42Å; S273-L276 PolarHBondContact O-N 2.86Å; S273-I277 WeakPolarHBondContact O-CD1 3.21Å; S273-I277 WeakPolarHBondContact O-CG1 3.28Å; S273-I277 PolarHBondContact O-N 3.47Å
274	V	58.5	Low	53.2	Low	76 Å²	76	105.3 Å²	105.3	46%	0.461	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-45	171.2	171.6	0	0	0	0	110.4	V270 E271 L276 I277 T278	V270-V274 HydrophobicContact CG1-CG2 4.26Å; V270-V274 WeakPolarHBondContact O-CB 3.4Å; V270-V274 VanDerWaalsContact O-CG2 3.23Å; V270-V274 WeakPolarHBondContact O-CG2 3.31Å; V270-V274 PolarHBondContact O-N 2.69Å; E271-V274 PolarHBondContact O-N 3.46Å; V274-L276 VanDerWaalsContact C-N 3.31Å; V274-L276 PolarHBondContact O-N 2.94Å; V274-I277 PolarHBondContact O-N 3.36Å; V274-T278 PolarHBondContact O-N 2.9Å; V274-T278 PolarHBondContact O-OG1 3.41Å
275	N	58.3	Low	53.6	Low	95 Å²	95	105 Å²	105	51%	0.508	57%	0.566	S	S	.	*	H	α-helix	trans	-62.7	-37.6	176.8	-72.6	-18.1	0	0	0	112	E271 S272 T278 L279	E271-N275 VanDerWaalsContact O-CB 3.28Å; E271-N275 WeakPolarHBondContact O-CB 3.35Å; E271-N275 PolarHBondContact O-N 2.9Å; E271-N275 PolarHBondContact O-ND2 3.37Å; S272-N275 PolarHBondContact O-N 3.01Å; N275-T278 VanDerWaalsContact CA-OG1 3.28Å; N275-T278 WeakPolarHBondContact CA-OG1 3.44Å; N275-T278 PolarHBondContact O-N 3.2Å; N275-T278 PolarHBondContact O-OG1 3.28Å; N275-L279 PolarHBondContact O-N 3.5Å
276	L	51.3	Low	54	Low	116 Å²	116	105.5 Å²	105.5	61%	0.607	57%	0.57	S	S	*	*	H	α-helix	trans	-66.4	-41.2	174.8	-168.1	73.5	0	0	0	111.8	S272 S273 V274 T278 L279 T280	S272-L276 WeakPolarHBondContact O-CB 3.3Å; S272-L276 PolarHBondContact O-N 2.67Å; S273-L276 PolarHBondContact O-N 2.86Å; V274-L276 VanDerWaalsContact C-N 3.31Å; V274-L276 PolarHBondContact O-N 2.94Å; L276-T278 VanDerWaalsContact C-N 3.34Å; L276-L279 PolarHBondContact O-N 3.21Å; L276-T280 WeakPolarHBondContact O-CG2 3.47Å; L276-T280 PolarHBondContact O-N 3.18Å; L276-T280 VanDerWaalsContact O-N 3.08Å; L276-T280 PolarHBondContact O-OG1 2.82Å
277	I	56.7	Low	54.5	Low	104 Å²	104	106.8 Å²	106.8	53%	0.533	57%	0.573	S	S	.	*	H	α-helix	trans	-67.4	-35.2	176.3	-67.2	162.8	0	0	0	111.3	S273 V274 T280 K281	S273-I277 WeakPolarHBondContact O-CD1 3.21Å; S273-I277 WeakPolarHBondContact O-CG1 3.28Å; S273-I277 PolarHBondContact O-N 3.47Å; V274-I277 PolarHBondContact O-N 3.36Å; I277-T280 PolarHBondContact O-OG1 3.16Å; I277-K281 PolarHBondContact O-N 3.41Å
278	T	57.4	Low	54.8	Low	69 Å²	69	107 Å²	107	42%	0.423	58%	0.575	S	S	.	*	H	α-helix	trans	-70.7	-35.8	175.3	48.2	0	0	0	0	112.2	V274 N275 L276 K281 F282	V274-T278 PolarHBondContact O-N 2.9Å; V274-T278 PolarHBondContact O-OG1 3.41Å; N275-T278 VanDerWaalsContact CA-OG1 3.28Å; N275-T278 WeakPolarHBondContact CA-OG1 3.44Å; N275-T278 PolarHBondContact O-N 3.2Å; N275-T278 PolarHBondContact O-OG1 3.28Å; L276-T278 VanDerWaalsContact C-N 3.34Å; T278-K281 PolarHBondContact O-N 3.19Å; T278-F282 WeakPolarHBondContact O-CD2 3.44Å
279	L	56.3	Low	55.2	Low	120 Å²	120	110.1 Å²	110.1	63%	0.628	59%	0.586	S	S	*	*	H	α-helix	trans	-68.6	-41.4	176.8	-85.4	158	0	0	0	112.1	N275 L276 K281 F282	N275-L279 PolarHBondContact O-N 3.5Å; L276-L279 PolarHBondContact O-N 3.21Å; L279-K281 PolarHBondContact O-N 3.47Å; L279-F282 PolarHBondContact O-N 3.08Å
280	T	56.7	Low	55.4	Low	97 Å²	97	111.5 Å²	111.5	60%	0.595	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-8.1	179.4	54.7	0	0	0	0	114.7	L276 I277	L276-T280 WeakPolarHBondContact O-CG2 3.47Å; L276-T280 PolarHBondContact O-N 3.18Å; L276-T280 VanDerWaalsContact O-N 3.08Å; L276-T280 PolarHBondContact O-OG1 2.82Å; I277-T280 PolarHBondContact O-OG1 3.16Å
281	K	54.4	Low	55.4	Low	173 Å²	173	113.6 Å²	113.6	75%	0.752	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-8.4	172.9	-100.2	-176.8	176.7	178.9	0	114.1	I277 T278 L279	I277-K281 PolarHBondContact O-N 3.41Å; T278-K281 PolarHBondContact O-N 3.19Å; L279-K281 PolarHBondContact O-N 3.47Å
282	F	52.7	Low	55.3	Low	188 Å²	188	113.4 Å²	113.4	83%	0.825	60%	0.604	S	S	*	*			trans	-107.5	-1.6	-178.6	-88.9	-75.8	0	0	0	114.4	T278 L279	T278-F282 WeakPolarHBondContact O-CD2 3.44Å; L279-F282 PolarHBondContact O-N 3.08Å
283	D	48.7	Very low	55.2	Low	208 Å²	208	118.1 Å²	118.1	100%	1.112	62%	0.62	S	S	*	*			trans	-99.7	0	164.9	-73.3	-25.3	0	0	0	110.5

Retrieved 283 of 283 residues in 536.7 ms (Link to these results)

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