A0A3Q0KKA0_SCHMA Loading...

G protein-coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KKA0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 219 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	36.4	Very low	44.9	Very low	179 Å²	179	122.8 Å²	122.8	88%	0.882	61%	0.607	S	S	*	*				0	104.3	0	-75.2	174.5	171.6	0	0	107.6	W3	M1-W3 VanDerWaalsContact O-CD1 3.29Å; M1-W3 PolarHBondContact O-N 3.32Å
2	V	32.2	Very low	45.5	Very low	127 Å²	127	121.4 Å²	121.4	77%	0.77	62%	0.618	S	S	*	*			trans	-84.9	106.8	178.3	177.5	0	0	0	0	107.3	L4	V2-L4 HydrophobicContact CG1-CB 3.96Å; V2-L4 HydrophobicContact CG1-CD1 3.53Å; V2-L4 HydrophobicContact CG1-CG 3.78Å; V2-L4 PolarHBondContact O-N 3.49Å
3	W	44.4	Very low	45.9	Very low	109 Å²	109	113.6 Å²	113.6	41%	0.413	58%	0.581	S	S	.	*			trans	-82.8	28.5	-176.5	-75.9	83.5	0	0	0	113.3	M1 I5 R26 I102	M1-W3 VanDerWaalsContact O-CD1 3.29Å; M1-W3 PolarHBondContact O-N 3.32Å; W3-I5 PolarHBondContact O-N 2.94Å; W3-I5 VanDerWaalsContact O-N 3.16Å; W3-R26 VanDerWaalsContact CE3-NE 3.33Å; W3-R26 VanDerWaalsContact CE3-NH1 3.33Å; W3-R26 HydrophobicContact CZ3-CG 4.39Å; W3-I102 HydrophobicContact CH2-CG2 4.36Å; W3-I102 VanDerWaalsContact CH2-O 3.23Å; W3-I102 WeakPolarHBondContact CH2-O 3.47Å; W3-I102 HydrophobicContact CZ3-CG2 4.05Å; W3-I102 WeakPolarHBondContact CZ3-O 3.38Å
4	L	37.8	Very low	46.5	Very low	141 Å²	141	113.5 Å²	113.5	74%	0.738	58%	0.58	S	S	*	*			trans	-85.8	88.9	-178.1	-70	165.9	0	0	0	110	V2 R6	V2-L4 HydrophobicContact CG1-CB 3.96Å; V2-L4 HydrophobicContact CG1-CD1 3.53Å; V2-L4 HydrophobicContact CG1-CG 3.78Å; V2-L4 PolarHBondContact O-N 3.49Å; L4-R6 PolarHBondContact O-N 3.32Å
5	I	47.2	Very low	46.6	Very low	52 Å²	52	113.3 Å²	113.3	27%	0.267	57%	0.574	S	S	.	*			trans	-64.4	121.5	142.5	-66.8	171.2	0	0	0	103.8	W3 R7 Y176	W3-I5 PolarHBondContact O-N 2.94Å; W3-I5 VanDerWaalsContact O-N 3.16Å; I5-R7 PolarHBondContact O-N 3.49Å; I5-Y176 HydrophobicContact CD1-CE2 4.15Å
6	R	44.2	Very low	46.7	Very low	234 Å²	234	111.4 Å²	111.4	88%	0.883	57%	0.572	S	S	*	*			trans	-49.1	109.6	177.6	-167.8	-179.5	-160.3	179.4	4.7	107.6	L4 K8	L4-R6 PolarHBondContact O-N 3.32Å; R6-K8 PolarHBondContact O-N 3.29Å
7	R	45.7	Very low	46.8	Very low	166 Å²	166	106.5 Å²	106.5	63%	0.626	55%	0.547	S	S	*	.			trans	-50.5	114.8	-179.7	-94.4	-176.8	-171.2	175.5	5.2	108.4	I5 D24	I5-R7 PolarHBondContact O-N 3.49Å; R7-D24 IonicContact CZ-OD1 2.64Å; R7-D24 IonicContact NE-OD1 3.81Å; R7-D24 PolarHBondContact NE-OD1 3.42Å; R7-D24 IonicContact NH2-OD1 3.89Å; R7-D24 PolarHBondContact NH2-OD1 2.96Å; R7-D24 IonicContact NH2-OD2 3.6Å
8	K	49.2	Very low	47	Very low	120 Å²	120	105.6 Å²	105.6	52%	0.522	54%	0.535	S	S	.	.			trans	-96	105.5	168.1	-149.3	176.7	-176.7	-179.4	0	106.4	R6 G10 R18	R6-K8 PolarHBondContact O-N 3.29Å; K8-G10 PolarHBondContact O-N 3.02Å; K8-R18 PolarHBondContact O-NH2 3.09Å
9	D	53.2	Low	47	Very low	126 Å²	126	103.4 Å²	103.4	67%	0.674	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.4	-177.4	-61.9	-37.6	0	0	0	112.4	V11 R18	D9-V11 VanDerWaalsContact C-N 3.33Å; D9-V11 PolarHBondContact O-N 3.1Å; D9-R18 PolarHBondContact O-NH1 2.93Å
10	G	52.1	Low	47.2	Very low	75 Å²	75	103.3 Å²	103.3	77%	0.773	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	2.2	-175.3	0	0	0	0	0	117.5	K8	K8-G10 PolarHBondContact O-N 3.02Å
11	V	51.9	Low	47.3	Very low	22 Å²	22	105.2 Å²	105.2	13%	0.133	55%	0.553	C	S	.	*			trans	-108.6	106.3	175.3	-170.3	0	0	0	0	109	D9 P13 R18 L182	D9-V11 VanDerWaalsContact C-N 3.33Å; D9-V11 PolarHBondContact O-N 3.1Å; V11-P13 WeakPolarHBondContact O-CD 3.06Å; V11-R18 VanDerWaalsContact O-CZ 3.27Å; V11-R18 PolarHBondContact O-NH1 2.71Å; V11-R18 PolarHBondContact O-NH2 2.85Å; V11-L182 HydrophobicContact CB-CD1 4.41Å; V11-L182 HydrophobicContact CG1-CD1 3.95Å; V11-L182 HydrophobicContact CG2-CD1 3.52Å
12	S	51.4	Low	48.1	Very low	106 Å²	106	102 Å²	102	74%	0.741	55%	0.547	S	S	*	.			trans	-69.3	119.3	166.6	45	0	0	0	0	108.2
13	P	51.7	Low	49.5	Very low	20 Å²	20	98.5 Å²	98.5	13%	0.13	52%	0.524	C	S	.	.			trans	-64.4	143.8	173.3	30.1	-36.5	0	0	0	109.4	V11 F15 R18	V11-P13 WeakPolarHBondContact O-CD 3.06Å; P13-F15 WeakPolarHBondContact CB-O 3.27Å; P13-F15 WeakPolarHBondContact CG-O 3.49Å; P13-F15 CarbonylContact O-C 3.56Å; P13-F15 PolarHBondContact O-N 3.17Å; P13-R18 HydrophobicContact CG-CB 4.19Å; P13-R18 HydrophobicContact CG-CG 3.9Å
14	I	54.2	Low	50.9	Low	112 Å²	112	97.1 Å²	97.1	57%	0.574	52%	0.524	S	S	*	.	S	Bend	trans	-57.5	-32.4	179.6	-67	161.8	0	0	0	110.7	I171 Y174	I14-I171 HydrophobicContact CG2-CG2 4.37Å; I14-Y174 HydrophobicContact CD1-CD1 3.68Å; I14-Y174 HydrophobicContact CD1-CE1 3.81Å
15	F	46.9	Very low	52.9	Low	110 Å²	110	90.8 Å²	90.8	48%	0.482	49%	0.491	S	S	.	.	S	Bend	trans	-106	131	166.3	-142.8	-90.2	0	0	0	109	P13 L17 I171	P13-F15 WeakPolarHBondContact CB-O 3.27Å; P13-F15 WeakPolarHBondContact CG-O 3.49Å; P13-F15 CarbonylContact O-C 3.56Å; P13-F15 PolarHBondContact O-N 3.17Å; F15-L17 HydrophobicContact CB-CG 4.24Å; F15-L17 HydrophobicContact CD1-CD2 4.11Å; F15-L17 HydrophobicContact CD1-CG 3.96Å; F15-L17 PolarHBondContact O-N 3.18Å; F15-I171 HydrophobicContact CB-CG2 4.03Å; F15-I171 HydrophobicContact CD2-CG2 4.25Å
16	P	49	Very low	54.6	Low	83 Å²	83	89.6 Å²	89.6	54%	0.539	48%	0.483	S	S	.	.			trans	-73.8	50.6	176.4	32.9	-36.3	0	0	0	111.8	R18 G19 C20	P16-R18 PolarHBondContact O-N 3.28Å; P16-G19 PolarHBondContact O-N 3.4Å; P16-C20 PolarHBondContact O-N 3.27Å
17	L	49.2	Very low	56.5	Low	29 Å²	29	82.3 Å²	82.3	15%	0.152	46%	0.461	C	S	.	.	H	α-helix	trans	-57.2	-29.2	168.3	-71.8	169.2	0	0	0	111.2	F15 G19 C20 F21 C22 V172	F15-L17 HydrophobicContact CB-CG 4.24Å; F15-L17 HydrophobicContact CD1-CD2 4.11Å; F15-L17 HydrophobicContact CD1-CG 3.96Å; F15-L17 PolarHBondContact O-N 3.18Å; L17-G19 PolarHBondContact O-N 3.26Å; L17-C20 PolarHBondContact O-N 3.25Å; L17-F21 HydrophobicContact CD2-CD2 4.09Å; L17-F21 PolarHBondContact O-N 3.25Å; L17-F21 VanDerWaalsContact O-N 3.09Å; L17-C22 PolarHBondContact O-N 3.37Å; L17-V172 HydrophobicContact CD1-CB 4.33Å; L17-V172 HydrophobicContact CD1-CG1 4.12Å; L17-V172 HydrophobicContact CD1-CG2 3.53Å
18	R	48.9	Very low	58.4	Low	89 Å²	89	74.9 Å²	74.9	34%	0.336	44%	0.437	S	S	.	.	H	α-helix	trans	-55.8	-35.9	170.1	-82.3	-174.4	-177.1	-168.5	0.7	112.6	K8 D9 V11 P13 P16	K8-R18 PolarHBondContact O-NH2 3.09Å; D9-R18 PolarHBondContact O-NH1 2.93Å; V11-R18 VanDerWaalsContact O-CZ 3.27Å; V11-R18 PolarHBondContact O-NH1 2.71Å; V11-R18 PolarHBondContact O-NH2 2.85Å; P13-R18 HydrophobicContact CG-CB 4.19Å; P13-R18 HydrophobicContact CG-CG 3.9Å; P16-R18 PolarHBondContact O-N 3.28Å
19	G	48.2	Very low	60.3	Low	64 Å²	64	69.2 Å²	69.2	66%	0.66	41%	0.412	S	S	*	.	H	α-helix	trans	-83.1	-38.9	-178.2	0	0	0	0	0	114	P16 L17	P16-G19 PolarHBondContact O-N 3.4Å; L17-G19 PolarHBondContact O-N 3.26Å
20	C	50.7	Low	62	Low	102 Å²	102	65.6 Å²	65.6	69%	0.689	39%	0.391	S	S	*	.	H	α-helix	trans	-91.8	-35.1	-173.2	-73.3	0	0	0	0	115.2	P16 L17	P16-C20 PolarHBondContact O-N 3.27Å; L17-C20 PolarHBondContact O-N 3.25Å
21	F	49.3	Very low	63.8	Low	144 Å²	144	65.6 Å²	65.6	63%	0.632	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	-2.6	-169.8	-68.3	-72	0	0	0	114.8	L17 L23	L17-F21 HydrophobicContact CD2-CD2 4.09Å; L17-F21 PolarHBondContact O-N 3.25Å; L17-F21 VanDerWaalsContact O-N 3.09Å; F21-L23 HydrophobicContact CB-CD1 4.06Å; F21-L23 HydrophobicContact CB-CG 4.02Å; F21-L23 PolarHBondContact O-N 3.5Å
22	C	53.3	Low	65.7	Low	110 Å²	110	64.6 Å²	64.6	74%	0.743	37%	0.366	S	S	*	.			trans	53	19.8	-177.7	-56.2	0	0	0	0	114.5	L17	L17-C22 PolarHBondContact O-N 3.37Å
23	L	61.6	Low	67.7	Low	55 Å²	55	59.6 Å²	59.6	29%	0.288	33%	0.331	S	S	.	.			trans	-81.5	128.6	178.9	-66.8	172.8	0	0	0	109.4	F21 L27 I31	F21-L23 HydrophobicContact CB-CD1 4.06Å; F21-L23 HydrophobicContact CB-CG 4.02Å; F21-L23 PolarHBondContact O-N 3.5Å; L23-L27 HydrophobicContact CD2-CD2 3.52Å; L23-L27 HydrophobicContact CD2-CG 4.08Å; L23-I31 HydrophobicContact CD1-CD1 4.48Å; L23-I31 HydrophobicContact CD2-CD1 4.47Å
24	D	73.8	Confident	69.7	Low	80 Å²	80	61.4 Å²	61.4	43%	0.428	34%	0.339	S	S	.	.			trans	-61.4	142.2	166.4	-67.3	-40.4	0	0	0	108.9	R7 R26 L27 G28	R7-D24 IonicContact CZ-OD1 2.64Å; R7-D24 IonicContact NE-OD1 3.81Å; R7-D24 PolarHBondContact NE-OD1 3.42Å; R7-D24 IonicContact NH2-OD1 3.89Å; R7-D24 PolarHBondContact NH2-OD1 2.96Å; R7-D24 IonicContact NH2-OD2 3.6Å; D24-R26 PolarHBondContact O-N 3.43Å; D24-R26 VanDerWaalsContact O-N 3.07Å; D24-L27 PolarHBondContact O-N 3.17Å; D24-G28 PolarHBondContact O-N 3.41Å
25	N	79.6	Confident	71.5	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.043	33%	0.326	C	S	.	.	H	α-helix	trans	-54.4	-34.3	-177.3	-70	-28.9	0	0	0	112.5	G28 C29 Y176 E179	N25-G28 PolarHBondContact O-N 3.11Å; N25-C29 WeakPolarHBondContact O-CB 3.39Å; N25-C29 PolarHBondContact O-N 3.42Å; N25-Y176 HydrophobicContact CB-CD2 4.13Å; N25-E179 WeakPolarHBondContact CB-OE2 3.37Å; N25-E179 PolarHBondContact ND2-OE2 3.46Å
26	R	82.1	Confident	73.8	Confident	27 Å²	27	53.1 Å²	53.1	10%	0.102	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-45.9	174.4	-175.2	172.8	-175.2	-166.2	-5.2	112.4	W3 D24 C29 F30 I102 Y176	W3-R26 VanDerWaalsContact CE3-NE 3.33Å; W3-R26 VanDerWaalsContact CE3-NH1 3.33Å; W3-R26 HydrophobicContact CZ3-CG 4.39Å; D24-R26 PolarHBondContact O-N 3.43Å; D24-R26 VanDerWaalsContact O-N 3.07Å; R26-C29 PolarHBondContact O-N 2.89Å; R26-F30 WeakPolarHBondContact O-CB 3.49Å; R26-F30 PolarHBondContact O-N 3.38Å; R26-I102 HydrophobicContact CG-CG2 4.23Å; R26-I102 PolarHBondContact NH2-O 3.27Å; R26-Y176 HydrophobicContact CB-CD2 4.16Å; R26-Y176 HydrophobicContact CB-CE1 4.4Å; R26-Y176 HydrophobicContact CB-CE2 3.6Å; R26-Y176 WeakPolarHBondContact CD-OH 3.16Å; R26-Y176 HydrophobicContact CG-CE1 4.16Å; R26-Y176 HydrophobicContact CG-CE2 4.05Å; R26-Y176 WeakPolarHBondContact CG-OH 3.05Å
27	L	84.4	Confident	76	Confident	80 Å²	80	49.8 Å²	49.8	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-67.7	-41.2	178.6	-179.3	61.2	0	0	0	110.5	L23 D24 C29 F30 I31	L23-L27 HydrophobicContact CD2-CD2 3.52Å; L23-L27 HydrophobicContact CD2-CG 4.08Å; D24-L27 PolarHBondContact O-N 3.17Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 2.92Å; L27-F30 WeakPolarHBondContact O-CB 3.27Å; L27-F30 PolarHBondContact O-N 3.44Å; L27-I31 HydrophobicContact CD1-CD1 4.16Å; L27-I31 HydrophobicContact CD1-CG1 4.35Å; L27-I31 HydrophobicContact CG-CD1 3.99Å; L27-I31 WeakPolarHBondContact O-CG1 3.31Å; L27-I31 PolarHBondContact O-N 3.28Å
28	G	86	Confident	78.1	Confident	11 Å²	11	53.1 Å²	53.1	11%	0.113	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-45.7	172.7	0	0	0	0	0	112.3	D24 N25 F30 I31 S32 V172	D24-G28 PolarHBondContact O-N 3.41Å; N25-G28 PolarHBondContact O-N 3.11Å; G28-F30 VanDerWaalsContact C-N 3.33Å; G28-F30 PolarHBondContact O-N 3.2Å; G28-I31 PolarHBondContact O-N 3.44Å; G28-S32 WeakPolarHBondContact O-CB 3.37Å; G28-S32 PolarHBondContact O-N 3.42Å; G28-S32 PolarHBondContact O-OG 2.97Å; G28-V172 VanDerWaalsContact C-CG1 3.48Å
29	C	88	Confident	80.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-33.4	176.5	-171	0	0	0	0	112.8	N25 R26 L27 S32 T33 Y176	N25-C29 WeakPolarHBondContact O-CB 3.39Å; N25-C29 PolarHBondContact O-N 3.42Å; R26-C29 PolarHBondContact O-N 2.89Å; L27-C29 VanDerWaalsContact C-N 3.34Å; L27-C29 PolarHBondContact O-N 2.92Å; C29-S32 WeakPolarHBondContact CA-OG 3.26Å; C29-S32 PolarHBondContact O-OG 3.03Å; C29-T33 WeakPolarHBondContact O-CB 3.36Å; C29-T33 WeakPolarHBondContact O-CG2 3.35Å; C29-T33 PolarHBondContact O-N 2.94Å; C29-T33 PolarHBondContact O-OG1 2.99Å; C29-Y176 HydrophobicContact CB-CD1 3.72Å; C29-Y176 HydrophobicContact CB-CG 4.09Å
30	F	90.1	Very high	82.4	Confident	51 Å²	51	46.4 Å²	46.4	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-46.4	176.1	-173.1	-111.4	0	0	0	111.7	R26 L27 G28 S32 T33 I34 I99 I102 S103	R26-F30 WeakPolarHBondContact O-CB 3.49Å; R26-F30 PolarHBondContact O-N 3.38Å; L27-F30 WeakPolarHBondContact O-CB 3.27Å; L27-F30 PolarHBondContact O-N 3.44Å; G28-F30 VanDerWaalsContact C-N 3.33Å; G28-F30 PolarHBondContact O-N 3.2Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 2.88Å; F30-T33 WeakPolarHBondContact CA-OG1 3.5Å; F30-T33 PolarHBondContact O-N 3.41Å; F30-T33 PolarHBondContact O-OG1 2.92Å; F30-I34 HydrophobicContact CD1-CD1 3.76Å; F30-I34 HydrophobicContact CE1-CD1 3.36Å; F30-I34 HydrophobicContact CE2-CD1 4.19Å; F30-I34 HydrophobicContact CG-CD1 4.35Å; F30-I34 HydrophobicContact CZ-CD1 3.61Å; F30-I34 WeakPolarHBondContact O-CG1 3.4Å; F30-I34 PolarHBondContact O-N 3.31Å; F30-I99 HydrophobicContact CE2-CG2 4.02Å; F30-I102 HydrophobicContact CB-CG2 4.21Å; F30-I102 HydrophobicContact CD2-CB 4.14Å; F30-I102 HydrophobicContact CD2-CG2 3.68Å; F30-I102 HydrophobicContact CE2-CG2 4.48Å; F30-I102 HydrophobicContact CG-CG2 4.3Å; F30-S103 WeakPolarHBondContact CE2-OG 3.21Å
31	I	90.4	Very high	84.4	Confident	75 Å²	75	43.1 Å²	43.1	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-42.3	176.7	-65.4	166.4	0	0	0	110.5	L23 L27 G28 I34 T35	L23-I31 HydrophobicContact CD1-CD1 4.48Å; L23-I31 HydrophobicContact CD2-CD1 4.47Å; L27-I31 HydrophobicContact CD1-CD1 4.16Å; L27-I31 HydrophobicContact CD1-CG1 4.35Å; L27-I31 HydrophobicContact CG-CD1 3.99Å; L27-I31 WeakPolarHBondContact O-CG1 3.31Å; L27-I31 PolarHBondContact O-N 3.28Å; G28-I31 PolarHBondContact O-N 3.44Å; I31-I34 PolarHBondContact O-N 3.22Å; I31-T35 WeakPolarHBondContact O-CB 3.44Å; I31-T35 PolarHBondContact O-N 2.68Å; I31-T35 PolarHBondContact O-OG1 3.07Å
32	S	91.6	Very high	86.4	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-44.8	178.7	70.9	0	0	0	0	111.8	G28 C29 F30 T35 T36 F169	G28-S32 WeakPolarHBondContact O-CB 3.37Å; G28-S32 PolarHBondContact O-N 3.42Å; G28-S32 PolarHBondContact O-OG 2.97Å; C29-S32 WeakPolarHBondContact CA-OG 3.26Å; C29-S32 PolarHBondContact O-OG 3.03Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 2.88Å; S32-T35 PolarHBondContact O-N 3.46Å; S32-T36 WeakPolarHBondContact O-CB 3.11Å; S32-T36 PolarHBondContact O-N 3.32Å; S32-T36 PolarHBondContact O-OG1 3.32Å; S32-F169 VanDerWaalsContact CB-CD1 3.43Å
33	T	92.8	Very high	88.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67	-38.8	179.5	49.3	0	0	0	0	112.8	C29 F30 T36 A37 V98 W120	C29-T33 WeakPolarHBondContact O-CB 3.36Å; C29-T33 WeakPolarHBondContact O-CG2 3.35Å; C29-T33 PolarHBondContact O-N 2.94Å; C29-T33 PolarHBondContact O-OG1 2.99Å; F30-T33 WeakPolarHBondContact CA-OG1 3.5Å; F30-T33 PolarHBondContact O-N 3.41Å; F30-T33 PolarHBondContact O-OG1 2.92Å; T33-T36 PolarHBondContact O-N 3.06Å; T33-A37 WeakPolarHBondContact O-CB 3.39Å; T33-A37 PolarHBondContact O-N 3.11Å; T33-V98 HydrophobicContact CG2-CB 4.34Å; T33-V98 HydrophobicContact CG2-CG1 3.73Å; T33-W120 HydrophobicContact CG2-CD2 4.36Å; T33-W120 HydrophobicContact CG2-CH2 4.29Å; T33-W120 HydrophobicContact CG2-CZ2 3.81Å
34	I	93.9	Very high	89.7	Confident	59 Å²	59	35.3 Å²	35.3	30%	0.303	19%	0.187	S	C	.	.	H	α-helix	trans	-61.9	-47.1	171.7	-70.6	170.4	0	0	0	110.9	F30 I31 T36 A37 I38 I99	F30-I34 HydrophobicContact CD1-CD1 3.76Å; F30-I34 HydrophobicContact CE1-CD1 3.36Å; F30-I34 HydrophobicContact CE2-CD1 4.19Å; F30-I34 HydrophobicContact CG-CD1 4.35Å; F30-I34 HydrophobicContact CZ-CD1 3.61Å; F30-I34 WeakPolarHBondContact O-CG1 3.4Å; F30-I34 PolarHBondContact O-N 3.31Å; I31-I34 PolarHBondContact O-N 3.22Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 3.14Å; I34-A37 WeakPolarHBondContact O-CB 3.4Å; I34-A37 PolarHBondContact O-N 3.13Å; I34-A37 VanDerWaalsContact O-N 3.15Å; I34-I38 HydrophobicContact CG2-CD1 3.89Å; I34-I38 WeakPolarHBondContact O-CG1 3.47Å; I34-I38 PolarHBondContact O-N 3.32Å; I34-I99 HydrophobicContact CG1-CD1 3.98Å; I34-I99 HydrophobicContact CG1-CG1 4.14Å
35	T	92.7	Very high	90.5	Very high	48 Å²	48	35.7 Å²	35.7	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-62.2	-44.8	-179	-52.5	0	0	0	0	110.2	I31 S32 A37 I38 S39 F169	I31-T35 WeakPolarHBondContact O-CB 3.44Å; I31-T35 PolarHBondContact O-N 2.68Å; I31-T35 PolarHBondContact O-OG1 3.07Å; S32-T35 PolarHBondContact O-N 3.46Å; T35-A37 VanDerWaalsContact C-N 3.32Å; T35-A37 PolarHBondContact O-N 3.04Å; T35-I38 PolarHBondContact O-N 2.86Å; T35-S39 WeakPolarHBondContact O-CB 3.36Å; T35-S39 PolarHBondContact O-N 2.88Å; T35-S39 PolarHBondContact O-OG 3.35Å; T35-F169 HydrophobicContact CG2-CE2 3.66Å; T35-F169 HydrophobicContact CG2-CZ 3.73Å
36	T	94.1	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-39.4	173.9	-62.4	0	0	0	0	112.5	S32 T33 I34 S39 S40 L91 W120 M124 Y166	S32-T36 WeakPolarHBondContact O-CB 3.11Å; S32-T36 PolarHBondContact O-N 3.32Å; S32-T36 PolarHBondContact O-OG1 3.32Å; T33-T36 PolarHBondContact O-N 3.06Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 3.14Å; T36-S39 WeakPolarHBondContact CA-OG 3.38Å; T36-S39 PolarHBondContact O-OG 2.89Å; T36-S40 WeakPolarHBondContact O-CB 3.29Å; T36-S40 PolarHBondContact O-N 3.05Å; T36-S40 PolarHBondContact O-OG 3.31Å; T36-L91 HydrophobicContact CG2-CD1 4.1Å; T36-L91 HydrophobicContact CG2-CD2 3.95Å; T36-L91 HydrophobicContact CG2-CG 4.04Å; T36-W120 HydrophobicContact CG2-CZ2 4.44Å; T36-M124 HydrophobicContact CG2-SD 3.94Å; T36-Y166 HydrophobicContact CG2-CE1 4.07Å
37	A	94.5	Very high	91.1	Very high	13 Å²	13	36 Å²	36	11%	0.107	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-46.2	176.7	0	0	0	0	0	111.5	T33 I34 T35 S40 A41 L92 S95 I99	T33-A37 WeakPolarHBondContact O-CB 3.39Å; T33-A37 PolarHBondContact O-N 3.11Å; I34-A37 WeakPolarHBondContact O-CB 3.4Å; I34-A37 PolarHBondContact O-N 3.13Å; I34-A37 VanDerWaalsContact O-N 3.15Å; T35-A37 VanDerWaalsContact C-N 3.32Å; T35-A37 PolarHBondContact O-N 3.04Å; A37-S40 PolarHBondContact O-OG 3.35Å; A37-S40 VanDerWaalsContact O-OG 3.05Å; A37-A41 WeakPolarHBondContact O-CB 3.47Å; A37-A41 PolarHBondContact O-N 2.83Å; A37-L92 HydrophobicContact CB-CD1 4.44Å; A37-L92 WeakPolarHBondContact O-CD1 3.24Å; A37-S95 WeakPolarHBondContact CA-OG 3.45Å; A37-S95 VanDerWaalsContact CB-OG 3.3Å; A37-S95 WeakPolarHBondContact CB-OG 3.31Å; A37-I99 HydrophobicContact CB-CD1 3.94Å
38	I	94.6	Very high	91.3	Very high	99 Å²	99	34.2 Å²	34.2	51%	0.508	18%	0.182	S	C	.	.	H	α-helix	trans	-65.1	-48.8	178.9	-64.8	168.7	0	0	0	110.5	I34 T35 S40 A41 I42	I34-I38 HydrophobicContact CG2-CD1 3.89Å; I34-I38 WeakPolarHBondContact O-CG1 3.47Å; I34-I38 PolarHBondContact O-N 3.32Å; T35-I38 PolarHBondContact O-N 2.86Å; I38-S40 PolarHBondContact O-N 3.46Å; I38-A41 PolarHBondContact O-N 3.35Å; I38-I42 HydrophobicContact CG2-CD1 3.96Å; I38-I42 WeakPolarHBondContact O-CG1 3.47Å; I38-I42 PolarHBondContact O-N 3.26Å
39	S	93.3	Very high	91.2	Very high	12 Å²	12	37 Å²	37	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-35.5	-177.6	56.2	0	0	0	0	112.4	T35 T36 I42 S43 Y158 Y166	T35-S39 WeakPolarHBondContact O-CB 3.36Å; T35-S39 PolarHBondContact O-N 2.88Å; T35-S39 PolarHBondContact O-OG 3.35Å; T36-S39 WeakPolarHBondContact CA-OG 3.38Å; T36-S39 PolarHBondContact O-OG 2.89Å; S39-I42 PolarHBondContact O-N 3.19Å; S39-S43 WeakPolarHBondContact O-CB 3.35Å; S39-S43 PolarHBondContact O-N 3.49Å; S39-S43 PolarHBondContact O-OG 2.89Å; S39-Y158 VanDerWaalsContact CA-OH 3.24Å; S39-Y158 WeakPolarHBondContact CA-OH 3.43Å; S39-Y158 WeakPolarHBondContact CB-OH 3.47Å; S39-Y158 PolarHBondContact O-OH 3.38Å; S39-Y166 WeakPolarHBondContact CB-OH 3.39Å; S39-Y166 VanDerWaalsContact OG-CE1 3.24Å; S39-Y166 WeakPolarHBondContact OG-CE1 3.5Å; S39-Y166 PolarHBondContact OG-OH 3.49Å
40	S	92.9	Very high	90.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.3	-34.9	173.1	59.7	0	0	0	0	112.7	T36 A37 I38 S43 W44 L92 Y166	T36-S40 WeakPolarHBondContact O-CB 3.29Å; T36-S40 PolarHBondContact O-N 3.05Å; T36-S40 PolarHBondContact O-OG 3.31Å; A37-S40 PolarHBondContact O-OG 3.35Å; A37-S40 VanDerWaalsContact O-OG 3.05Å; I38-S40 PolarHBondContact O-N 3.46Å; S40-S43 PolarHBondContact O-N 3.36Å; S40-W44 VanDerWaalsContact O-CB 3.25Å; S40-W44 WeakPolarHBondContact O-CB 3.4Å; S40-W44 PolarHBondContact O-N 3.28Å; S40-L92 WeakPolarHBondContact OG-CD1 3.3Å; S40-Y166 PolarHBondContact N-OH 3.15Å
41	A	93.8	Very high	90.5	Very high	32 Å²	32	37.7 Å²	37.7	26%	0.264	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-43.7	172.8	0	0	0	0	0	111.8	A37 I38 W44 I45 L92	A37-A41 WeakPolarHBondContact O-CB 3.47Å; A37-A41 PolarHBondContact O-N 2.83Å; I38-A41 PolarHBondContact O-N 3.35Å; A41-W44 WeakPolarHBondContact O-CB 3.41Å; A41-W44 PolarHBondContact O-N 2.85Å; A41-I45 WeakPolarHBondContact O-CG1 3.37Å; A41-I45 PolarHBondContact O-N 3.44Å; A41-L92 HydrophobicContact CB-CD1 3.99Å
42	I	91.8	Very high	90.2	Very high	68 Å²	68	36.6 Å²	36.6	35%	0.349	20%	0.197	S	C	.	.	H	α-helix	trans	-63.4	-46.1	175.3	-67.5	167.3	0	0	0	110.7	I38 S39 W44 I45 F46 Y158	I38-I42 HydrophobicContact CG2-CD1 3.96Å; I38-I42 WeakPolarHBondContact O-CG1 3.47Å; I38-I42 PolarHBondContact O-N 3.26Å; S39-I42 PolarHBondContact O-N 3.19Å; I42-W44 VanDerWaalsContact C-N 3.27Å; I42-W44 PolarHBondContact O-N 2.93Å; I42-I45 PolarHBondContact O-N 3.1Å; I42-F46 HydrophobicContact CG2-CD2 3.93Å; I42-F46 HydrophobicContact CG2-CE2 3.44Å; I42-F46 VanDerWaalsContact CG2-CE2 3.44Å; I42-F46 HydrophobicContact CG2-CZ 4.33Å; I42-F46 VanDerWaalsContact O-CD2 3.31Å; I42-F46 WeakPolarHBondContact O-CD2 3.31Å; I42-F46 PolarHBondContact O-N 3.02Å; I42-F46 VanDerWaalsContact O-N 3.1Å; I42-Y158 WeakPolarHBondContact CB-OH 3.14Å; I42-Y158 HydrophobicContact CG2-CE1 4.13Å; I42-Y158 HydrophobicContact CG2-CE2 4.18Å; I42-Y158 WeakPolarHBondContact CG2-OH 3.25Å
43	S	90.5	Very high	89.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.7	-42.3	174	-66.4	0	0	0	0	112	S39 S40 I45 F46 V47 N88 Y158	S39-S43 WeakPolarHBondContact O-CB 3.35Å; S39-S43 PolarHBondContact O-N 3.49Å; S39-S43 PolarHBondContact O-OG 2.89Å; S40-S43 PolarHBondContact O-N 3.36Å; S43-I45 VanDerWaalsContact C-N 3.34Å; S43-I45 PolarHBondContact O-N 3.47Å; S43-F46 PolarHBondContact O-N 3.38Å; S43-V47 WeakPolarHBondContact O-CG2 3.42Å; S43-V47 PolarHBondContact O-N 3.16Å; S43-V47 VanDerWaalsContact O-N 3.08Å; S43-N88 WeakPolarHBondContact CB-OD1 3.11Å; S43-Y158 WeakPolarHBondContact OG-CE1 3.44Å
44	W	92	Very high	88.2	Confident	78 Å²	78	37.9 Å²	37.9	30%	0.295	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-40.5	179.1	-174.1	80	0	0	0	111.7	S40 A41 I42 V47 V48 F85 N88	S40-W44 VanDerWaalsContact O-CB 3.25Å; S40-W44 WeakPolarHBondContact O-CB 3.4Å; S40-W44 PolarHBondContact O-N 3.28Å; A41-W44 WeakPolarHBondContact O-CB 3.41Å; A41-W44 PolarHBondContact O-N 2.85Å; I42-W44 VanDerWaalsContact C-N 3.27Å; I42-W44 PolarHBondContact O-N 2.93Å; W44-V47 PolarHBondContact O-N 3.37Å; W44-V48 HydrophobicContact CD2-CG2 4.12Å; W44-V48 HydrophobicContact CE3-CG2 4.27Å; W44-V48 HydrophobicContact CH2-CG2 4.17Å; W44-V48 HydrophobicContact CZ2-CG2 3.99Å; W44-V48 HydrophobicContact CZ3-CG2 4.3Å; W44-V48 VanDerWaalsContact O-CG2 3.31Å; W44-V48 WeakPolarHBondContact O-CG2 3.31Å; W44-V48 PolarHBondContact O-N 3.07Å; W44-F85 AromaticContact CE2-CE2 3.48Å; W44-F85 VanDerWaalsContact CE2-CE2 3.48Å; W44-F85 HydrophobicContact CZ2-CD2 4.47Å; W44-F85 AromaticContact CZ2-CE2 3.5Å; W44-F85 HydrophobicContact CZ2-CE2 3.5Å; W44-F85 VanDerWaalsContact CZ2-CE2 3.5Å; W44-F85 AromaticContact CZ2-CZ 3.89Å; W44-F85 HydrophobicContact CZ2-CZ 3.89Å; W44-F85 AromaticContact NE1-CD2 3.37Å; W44-F85 AromaticContact NE1-CE2 3.14Å; W44-F85 AromaticContact NE1-CZ 3.69Å; W44-N88 HydrophobicContact CB-CB 4.06Å
45	I	90.4	Very high	87.2	Confident	88 Å²	88	38.9 Å²	38.9	45%	0.451	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-45	174.4	-67.3	164.6	0	0	0	110.9	A41 I42 S43 V47 V48 L49	A41-I45 WeakPolarHBondContact O-CG1 3.37Å; A41-I45 PolarHBondContact O-N 3.44Å; I42-I45 PolarHBondContact O-N 3.1Å; S43-I45 VanDerWaalsContact C-N 3.34Å; S43-I45 PolarHBondContact O-N 3.47Å; I45-V47 PolarHBondContact O-N 3Å; I45-V48 PolarHBondContact O-N 3.08Å; I45-L49 HydrophobicContact CG2-CD1 4.08Å; I45-L49 HydrophobicContact CG2-CG 4.33Å; I45-L49 WeakPolarHBondContact O-CG 3.42Å; I45-L49 PolarHBondContact O-N 3.37Å
46	F	86.4	Confident	86.3	Confident	36 Å²	36	40.3 Å²	40.3	16%	0.158	23%	0.225	C	C	.	.	H	α-helix	trans	-59.6	-45.4	177.6	-75.1	-55.4	0	0	0	112.4	I42 S43 V48 L49 D50 Y151 F154 Y158	I42-F46 HydrophobicContact CG2-CD2 3.93Å; I42-F46 HydrophobicContact CG2-CE2 3.44Å; I42-F46 VanDerWaalsContact CG2-CE2 3.44Å; I42-F46 HydrophobicContact CG2-CZ 4.33Å; I42-F46 VanDerWaalsContact O-CD2 3.31Å; I42-F46 WeakPolarHBondContact O-CD2 3.31Å; I42-F46 PolarHBondContact O-N 3.02Å; I42-F46 VanDerWaalsContact O-N 3.1Å; S43-F46 PolarHBondContact O-N 3.38Å; F46-V48 VanDerWaalsContact C-N 3.31Å; F46-V48 PolarHBondContact O-N 3.28Å; F46-L49 HydrophobicContact CD1-CD1 4.5Å; F46-L49 WeakPolarHBondContact O-CB 3.2Å; F46-L49 PolarHBondContact O-N 3.35Å; F46-D50 PolarHBondContact O-N 3.42Å; F46-Y151 HydrophobicContact CD1-CE2 4.05Å; F46-Y151 HydrophobicContact CE1-CE2 4.47Å; F46-Y151 PolarHBondContact O-OH 3.1Å; F46-F154 HydrophobicContact CE1-CE1 4.23Å; F46-F154 HydrophobicContact CE2-CE1 4.17Å; F46-F154 HydrophobicContact CZ-CD1 4.4Å; F46-F154 AromaticContact CZ-CE1 3.61Å; F46-F154 HydrophobicContact CZ-CE1 3.61Å; F46-Y158 HydrophobicContact CD2-CD1 4.46Å; F46-Y158 HydrophobicContact CD2-CE1 4.48Å; F46-Y158 HydrophobicContact CE2-CD1 4.43Å
47	V	88.2	Confident	84.8	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-39.2	177.6	174.2	0	0	0	0	111.5	S43 W44 I45 D50 L51 D81 M84 F85	S43-V47 WeakPolarHBondContact O-CG2 3.42Å; S43-V47 PolarHBondContact O-N 3.16Å; S43-V47 VanDerWaalsContact O-N 3.08Å; W44-V47 PolarHBondContact O-N 3.37Å; I45-V47 PolarHBondContact O-N 3Å; V47-D50 PolarHBondContact O-N 2.92Å; V47-L51 HydrophobicContact CG1-CD1 4.28Å; V47-L51 WeakPolarHBondContact O-CG 3.27Å; V47-L51 PolarHBondContact O-N 2.97Å; V47-D81 HydrophobicContact CG1-CB 4.28Å; V47-D81 WeakPolarHBondContact CG1-O 3.41Å; V47-M84 HydrophobicContact CG2-CB 4.01Å; V47-F85 HydrophobicContact CG1-CB 3.84Å
48	V	88.6	Confident	83.3	Confident	42 Å²	42	50.5 Å²	50.5	26%	0.255	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-42.9	175	171.5	0	0	0	0	111.1	W44 I45 F46 D50 L51 V52 F85	W44-V48 HydrophobicContact CD2-CG2 4.12Å; W44-V48 HydrophobicContact CE3-CG2 4.27Å; W44-V48 HydrophobicContact CH2-CG2 4.17Å; W44-V48 HydrophobicContact CZ2-CG2 3.99Å; W44-V48 HydrophobicContact CZ3-CG2 4.3Å; W44-V48 VanDerWaalsContact O-CG2 3.31Å; W44-V48 WeakPolarHBondContact O-CG2 3.31Å; W44-V48 PolarHBondContact O-N 3.07Å; I45-V48 PolarHBondContact O-N 3.08Å; F46-V48 VanDerWaalsContact C-N 3.31Å; F46-V48 PolarHBondContact O-N 3.28Å; V48-D50 VanDerWaalsContact C-N 3.31Å; V48-D50 PolarHBondContact O-N 3.38Å; V48-L51 PolarHBondContact O-N 3.31Å; V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CB 3.4Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.43Å; V48-V52 PolarHBondContact O-N 2.87Å; V48-F85 HydrophobicContact CG2-CD2 3.9Å; V48-F85 HydrophobicContact CG2-CE2 3.73Å
49	L	84.2	Confident	81.4	Confident	70 Å²	70	50.1 Å²	50.1	37%	0.366	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-43.3	175.7	-71.4	172.7	0	0	0	111.1	I45 F46 V52 T53	I45-L49 HydrophobicContact CG2-CD1 4.08Å; I45-L49 HydrophobicContact CG2-CG 4.33Å; I45-L49 WeakPolarHBondContact O-CG 3.42Å; I45-L49 PolarHBondContact O-N 3.37Å; F46-L49 HydrophobicContact CD1-CD1 4.5Å; F46-L49 WeakPolarHBondContact O-CB 3.2Å; F46-L49 PolarHBondContact O-N 3.35Å; L49-V52 PolarHBondContact O-N 3.47Å; L49-T53 WeakPolarHBondContact O-CG2 3.39Å; L49-T53 PolarHBondContact O-N 2.82Å
50	D	80.5	Confident	79.5	Confident	19 Å²	19	54 Å²	54	10%	0.102	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-48.1	175	-84	-49.8	0	0	0	111.6	F46 V47 V48 V52 T53 W54 R148 Y151	F46-D50 PolarHBondContact O-N 3.42Å; V47-D50 PolarHBondContact O-N 2.92Å; V48-D50 VanDerWaalsContact C-N 3.31Å; V48-D50 PolarHBondContact O-N 3.38Å; D50-V52 VanDerWaalsContact C-N 3.34Å; D50-V52 PolarHBondContact O-N 3.46Å; D50-T53 PolarHBondContact O-N 3.02Å; D50-T53 PolarHBondContact O-OG1 3.36Å; D50-W54 PolarHBondContact O-N 2.82Å; D50-R148 IonicContact OD1-NH1 3.4Å; D50-Y151 VanDerWaalsContact CG-OH 3.3Å; D50-Y151 WeakPolarHBondContact OD1-CE1 3.36Å; D50-Y151 VanDerWaalsContact OD2-CE1 3.27Å; D50-Y151 WeakPolarHBondContact OD2-CE1 3.39Å; D50-Y151 PolarHBondContact OD2-OH 3.49Å
51	L	84.2	Confident	77.7	Confident	46 Å²	46	57.4 Å²	57.4	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-37.8	175.9	-70.9	172.3	0	0	0	113.1	V47 V48 W54 A55 D81 I82 F85	V47-L51 HydrophobicContact CG1-CD1 4.28Å; V47-L51 WeakPolarHBondContact O-CG 3.27Å; V47-L51 PolarHBondContact O-N 2.97Å; V48-L51 PolarHBondContact O-N 3.31Å; L51-W54 WeakPolarHBondContact O-CB 3.47Å; L51-W54 PolarHBondContact O-N 3.19Å; L51-A55 PolarHBondContact O-N 2.92Å; L51-A55 VanDerWaalsContact O-N 3.17Å; L51-D81 HydrophobicContact CD2-CB 3.67Å; L51-D81 HydrophobicContact CG-CB 3.99Å; L51-I82 HydrophobicContact CD2-CG1 4.19Å; L51-F85 HydrophobicContact CD1-CB 4.37Å; L51-F85 HydrophobicContact CD1-CD2 4.31Å
52	V	82.8	Confident	75.6	Confident	52 Å²	52	62.4 Å²	62.4	32%	0.315	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-40.2	176.9	170.8	0	0	0	0	111	V48 L49 D50 W54 A55 I56	V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CB 3.4Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.43Å; V48-V52 PolarHBondContact O-N 2.87Å; L49-V52 PolarHBondContact O-N 3.47Å; D50-V52 VanDerWaalsContact C-N 3.34Å; D50-V52 PolarHBondContact O-N 3.46Å; V52-W54 PolarHBondContact O-N 3.29Å; V52-A55 PolarHBondContact O-N 3.49Å; V52-A55 VanDerWaalsContact O-N 3.1Å; V52-I56 HydrophobicContact CG1-CD1 3.96Å; V52-I56 PolarHBondContact O-N 3.43Å
53	T	74.1	Confident	73.7	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.043	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-24.3	175.7	73.8	0	0	0	0	112.7	L49 D50 F59 I61 R148	L49-T53 WeakPolarHBondContact O-CG2 3.39Å; L49-T53 PolarHBondContact O-N 2.82Å; D50-T53 PolarHBondContact O-N 3.02Å; D50-T53 PolarHBondContact O-OG1 3.36Å; T53-F59 HydrophobicContact CG2-CD1 3.68Å; T53-F59 HydrophobicContact CG2-CE1 3.93Å; T53-I61 HydrophobicContact CG2-CD1 3.71Å; T53-I61 HydrophobicContact CG2-CG1 4.49Å; T53-R148 PolarHBondContact OG1-NH2 3.03Å; T53-R148 VanDerWaalsContact OG1-NH2 3.09Å
54	W	68.2	Low	71.5	Confident	21 Å²	21	67.6 Å²	67.6	8%	0.08	37%	0.372	C	S	.	.	H	α-helix	trans	-76.3	-44.6	172.7	-77.5	115	0	0	0	112.8	D50 L51 V52 W69 R70 W74 F77 I78	D50-W54 PolarHBondContact O-N 2.82Å; L51-W54 WeakPolarHBondContact O-CB 3.47Å; L51-W54 PolarHBondContact O-N 3.19Å; V52-W54 PolarHBondContact O-N 3.29Å; W54-W69 AromaticContact CE2-CH2 3.91Å; W54-W69 HydrophobicContact CH2-CE3 4.16Å; W54-W69 AromaticContact CH2-CH2 2.95Å; W54-W69 HydrophobicContact CH2-CH2 2.95Å; W54-W69 AromaticContact CH2-CZ2 3.39Å; W54-W69 HydrophobicContact CH2-CZ2 3.39Å; W54-W69 AromaticContact CH2-CZ3 3.33Å; W54-W69 HydrophobicContact CH2-CZ3 3.33Å; W54-W69 AromaticContact CZ2-CH2 2.95Å; W54-W69 HydrophobicContact CZ2-CH2 2.95Å; W54-W69 AromaticContact CZ2-CZ2 3.77Å; W54-W69 HydrophobicContact CZ2-CZ2 3.77Å; W54-W69 AromaticContact CZ2-CZ3 3.43Å; W54-W69 HydrophobicContact CZ2-CZ3 3.43Å; W54-W69 VanDerWaalsContact CZ2-CZ3 3.43Å; W54-W69 HydrophobicContact CZ3-CH2 4Å; W54-W69 HydrophobicContact CZ3-CZ2 4.04Å; W54-R70 HydrophobicContact CH2-CG 4.24Å; W54-R70 HydrophobicContact CZ3-CG 3.61Å; W54-W74 HydrophobicContact CE3-CE3 4.35Å; W54-W74 HydrophobicContact CH2-CB 3.25Å; W54-W74 HydrophobicContact CH2-CG 4.42Å; W54-W74 HydrophobicContact CZ2-CB 4.08Å; W54-W74 HydrophobicContact CZ3-CB 3.7Å; W54-W74 HydrophobicContact CZ3-CE3 4.09Å; W54-W74 HydrophobicContact CZ3-CG 4.5Å; W54-F77 HydrophobicContact CZ2-CB 4.21Å; W54-I78 HydrophobicContact CB-CD1 4.37Å; W54-I78 HydrophobicContact CD2-CD1 3.87Å; W54-I78 HydrophobicContact CD2-CG1 3.91Å; W54-I78 HydrophobicContact CE3-CD1 4.14Å; W54-I78 HydrophobicContact CG-CD1 4Å; W54-I78 HydrophobicContact CG-CG1 3.98Å; W54-I78 HydrophobicContact CZ2-CG1 4.19Å
55	A	73.9	Confident	69.1	Low	80 Å²	80	72 Å²	72	66%	0.661	39%	0.393	S	S	*	.	H	α-helix	trans	-69.3	-34.8	-176.4	0	0	0	0	0	112.7	L51 V52	L51-A55 PolarHBondContact O-N 2.92Å; L51-A55 VanDerWaalsContact O-N 3.17Å; V52-A55 PolarHBondContact O-N 3.49Å; V52-A55 VanDerWaalsContact O-N 3.1Å
56	I	73	Confident	66.9	Low	79 Å²	79	73 Å²	73	41%	0.405	41%	0.406	S	S	.	.			trans	-110.4	105.9	-176.2	-53.1	176.6	0	0	0	109.1	V52 D58 F59	V52-I56 HydrophobicContact CG1-CD1 3.96Å; V52-I56 PolarHBondContact O-N 3.43Å; I56-D58 HydrophobicContact CG2-CB 4.47Å; I56-D58 PolarHBondContact O-N 3.36Å; I56-F59 HydrophobicContact CB-CB 3.9Å; I56-F59 HydrophobicContact CG2-CB 3.9Å; I56-F59 PolarHBondContact O-N 2.92Å
57	P	62.2	Low	65.1	Low	88 Å²	88	74 Å²	74	57%	0.571	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.7	179.1	26.4	-33.3	0	0	0	113.1	F59	P57-F59 VanDerWaalsContact C-N 3.34Å
58	D	63.2	Low	63.2	Low	139 Å²	139	82.9 Å²	82.9	74%	0.743	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.4	-178.6	-55.3	-34.8	0	0	0	113.4	I56 V60	I56-D58 HydrophobicContact CG2-CB 4.47Å; I56-D58 PolarHBondContact O-N 3.36Å; D58-V60 VanDerWaalsContact C-N 3.31Å; D58-V60 PolarHBondContact O-N 3.37Å
59	F	55.9	Low	61.5	Low	90 Å²	90	82.8 Å²	82.8	40%	0.395	44%	0.444	S	S	.	.			trans	-78.3	84.9	176.5	-170.1	-101.6	0	0	0	109.6	T53 I56 P57 I61	T53-F59 HydrophobicContact CG2-CD1 3.68Å; T53-F59 HydrophobicContact CG2-CE1 3.93Å; I56-F59 HydrophobicContact CB-CB 3.9Å; I56-F59 HydrophobicContact CG2-CB 3.9Å; I56-F59 PolarHBondContact O-N 2.92Å; P57-F59 VanDerWaalsContact C-N 3.34Å; F59-I61 HydrophobicContact CD1-CD1 4.41Å; F59-I61 HydrophobicContact CD1-CG1 4.03Å; F59-I61 HydrophobicContact CE1-CD1 3.87Å; F59-I61 HydrophobicContact CE1-CG1 3.61Å; F59-I61 HydrophobicContact CZ-CG1 4.46Å; F59-I61 PolarHBondContact O-N 2.86Å
60	V	53.3	Low	60	Low	94 Å²	94	84.2 Å²	84.2	57%	0.57	45%	0.445	S	S	*	.			trans	-82.8	112.9	178.6	-176.9	0	0	0	0	109.1	D58	D58-V60 VanDerWaalsContact C-N 3.31Å; D58-V60 PolarHBondContact O-N 3.37Å
61	I	55	Low	58.7	Low	72 Å²	72	89.2 Å²	89.2	37%	0.369	47%	0.47	S	S	.	.			trans	-90.2	94.9	161.5	-56.4	173.4	0	0	0	105.6	T53 F59 Q64	T53-I61 HydrophobicContact CG2-CD1 3.71Å; T53-I61 HydrophobicContact CG2-CG1 4.49Å; F59-I61 HydrophobicContact CD1-CD1 4.41Å; F59-I61 HydrophobicContact CD1-CG1 4.03Å; F59-I61 HydrophobicContact CE1-CD1 3.87Å; F59-I61 HydrophobicContact CE1-CG1 3.61Å; F59-I61 HydrophobicContact CZ-CG1 4.46Å; F59-I61 PolarHBondContact O-N 2.86Å; I61-Q64 WeakPolarHBondContact O-CG 3.24Å
62	D	50.3	Low	57.7	Low	136 Å²	136	97 Å²	97	73%	0.727	50%	0.496	S	S	*	.	S	Bend	trans	-57.1	139.5	174.4	-85.7	-36.7	0	0	0	110.8
63	P	50.4	Low	57	Low	111 Å²	111	98.4 Å²	98.4	72%	0.721	50%	0.498	S	S	*	.	S	Bend	cis	-108.8	114.7	4.7	34.4	-19.9	0	0	0	111.6
64	Q	45.1	Very low	56.8	Low	67 Å²	67	103 Å²	103	31%	0.313	52%	0.515	S	S	.	.			trans	-113.9	131.8	178.4	-74.5	174.9	3	0	0	111.7	I61 W147	I61-Q64 WeakPolarHBondContact O-CG 3.24Å; Q64-W147 HydrophobicContact CB-CE3 3.93Å; Q64-W147 HydrophobicContact CB-CZ3 4.46Å; Q64-W147 HydrophobicContact CG-CE3 3.64Å; Q64-W147 HydrophobicContact CG-CZ3 3.98Å; Q64-W147 VanDerWaalsContact OE1-CZ3 3.24Å
65	F	40.5	Very low	57.4	Low	170 Å²	170	109.3 Å²	109.3	75%	0.746	54%	0.543	S	S	*	.			trans	-68.1	146.5	164.7	-79.3	-86.9	0	0	0	110.5	T67 W147	F65-T67 PolarHBondContact O-N 3.49Å; F65-W147 HydrophobicContact CB-CB 4.11Å
66	P	45.3	Very low	57.8	Low	109 Å²	109	106.3 Å²	106.3	71%	0.708	52%	0.52	S	S	*	.			trans	-57.2	126.3	-175.1	20.4	-31.6	0	0	0	112.9	Y68	P66-Y68 PolarHBondContact O-N 2.88Å
67	T	48.3	Very low	58.2	Low	58 Å²	58	103.7 Å²	103.7	36%	0.356	51%	0.505	S	S	.	.			trans	-91.4	98.1	-160.3	44.5	0	0	0	0	115	F65 W147	F65-T67 PolarHBondContact O-N 3.49Å; T67-W147 HydrophobicContact CG2-CD2 3.49Å; T67-W147 VanDerWaalsContact CG2-CD2 3.49Å; T67-W147 HydrophobicContact CG2-CE3 3.25Å; T67-W147 HydrophobicContact CG2-CG 4.25Å; T67-W147 HydrophobicContact CG2-CH2 3.59Å; T67-W147 HydrophobicContact CG2-CZ2 3.97Å; T67-W147 HydrophobicContact CG2-CZ3 3.24Å
68	Y	48.4	Very low	59.3	Low	190 Å²	190	101.1 Å²	101.1	75%	0.745	49%	0.487	S	S	*	.			trans	-86.2	-4	168.3	-71.2	-81	0	0	0	114.6	P66 R70 I71	P66-Y68 PolarHBondContact O-N 2.88Å; Y68-R70 VanDerWaalsContact C-N 3.34Å; Y68-R70 PolarHBondContact O-N 3.39Å; Y68-I71 HydrophobicContact CD1-CD1 4.18Å; Y68-I71 WeakPolarHBondContact O-CG1 3.38Å; Y68-I71 PolarHBondContact O-N 3.26Å
69	W	52.5	Low	60.5	Low	41 Å²	41	100.3 Å²	100.3	16%	0.155	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-70.4	-23.5	-174	73.8	-78.9	0	0	0	114.6	W54 I71 R72 F77 W147	W54-W69 AromaticContact CE2-CH2 3.91Å; W54-W69 HydrophobicContact CH2-CE3 4.16Å; W54-W69 AromaticContact CH2-CH2 2.95Å; W54-W69 HydrophobicContact CH2-CH2 2.95Å; W54-W69 AromaticContact CH2-CZ2 3.39Å; W54-W69 HydrophobicContact CH2-CZ2 3.39Å; W54-W69 AromaticContact CH2-CZ3 3.33Å; W54-W69 HydrophobicContact CH2-CZ3 3.33Å; W54-W69 AromaticContact CZ2-CH2 2.95Å; W54-W69 HydrophobicContact CZ2-CH2 2.95Å; W54-W69 AromaticContact CZ2-CZ2 3.77Å; W54-W69 HydrophobicContact CZ2-CZ2 3.77Å; W54-W69 AromaticContact CZ2-CZ3 3.43Å; W54-W69 HydrophobicContact CZ2-CZ3 3.43Å; W54-W69 VanDerWaalsContact CZ2-CZ3 3.43Å; W54-W69 HydrophobicContact CZ3-CH2 4Å; W54-W69 HydrophobicContact CZ3-CZ2 4.04Å; W69-I71 PolarHBondContact O-N 3.47Å; W69-R72 PolarHBondContact O-N 3.27Å; W69-F77 HydrophobicContact CZ3-CD2 4.2Å; W69-W147 AromaticContact CD1-CE2 3.39Å; W69-W147 AromaticContact CD1-CH2 3.93Å; W69-W147 AromaticContact CD1-CZ2 3.29Å; W69-W147 AromaticContact CD1-NE1 3.4Å; W69-W147 HydrophobicContact CD2-CH2 4.47Å; W69-W147 AromaticContact CD2-CZ2 3.67Å; W69-W147 HydrophobicContact CD2-CZ2 3.67Å; W69-W147 AromaticContact CE2-CE2 3.96Å; W69-W147 AromaticContact CE2-CH2 3.45Å; W69-W147 VanDerWaalsContact CE2-CH2 3.45Å; W69-W147 AromaticContact CE2-CZ2 3.04Å; W69-W147 AromaticContact CG-CE2 3.96Å; W69-W147 AromaticContact CG-CZ2 3.82Å; W69-W147 HydrophobicContact CG-CZ2 3.82Å; W69-W147 AromaticContact CG-NE1 3.67Å; W69-W147 HydrophobicContact CH2-CH2 4.44Å; W69-W147 HydrophobicContact CH2-CZ2 4.1Å; W69-W147 AromaticContact CZ2-CH2 3.46Å; W69-W147 HydrophobicContact CZ2-CH2 3.46Å; W69-W147 VanDerWaalsContact CZ2-CH2 3.46Å; W69-W147 AromaticContact CZ2-CZ2 3.34Å; W69-W147 HydrophobicContact CZ2-CZ2 3.34Å; W69-W147 AromaticContact NE1-CE2 3.49Å; W69-W147 AromaticContact NE1-CH2 3.13Å; W69-W147 AromaticContact NE1-CZ2 2.87Å; W69-W147 AromaticContact NE1-NE1 3.98Å
70	R	53.8	Low	62.1	Low	99 Å²	99	96.9 Å²	96.9	37%	0.374	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-52.7	-23.4	176.6	-114.5	-174	-128.6	-142.1	4.1	112.2	W54 Y68 R72	W54-R70 HydrophobicContact CH2-CG 4.24Å; W54-R70 HydrophobicContact CZ3-CG 3.61Å; Y68-R70 VanDerWaalsContact C-N 3.34Å; Y68-R70 PolarHBondContact O-N 3.39Å; R70-R72 PolarHBondContact O-N 2.89Å
71	I	52.7	Low	63.8	Low	125 Å²	125	93.2 Å²	93.2	64%	0.641	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-72.5	-30.1	-169.8	-62.5	169.9	0	0	0	113.3	Y68 W69	Y68-I71 HydrophobicContact CD1-CD1 4.18Å; Y68-I71 WeakPolarHBondContact O-CG1 3.38Å; Y68-I71 PolarHBondContact O-N 3.26Å; W69-I71 PolarHBondContact O-N 3.47Å
72	R	62.6	Low	65.5	Low	209 Å²	209	93.3 Å²	93.3	79%	0.789	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-40.9	-171.4	-68.6	-172.4	-157	176.2	7.3	117.1	W69 R70	W69-R72 PolarHBondContact O-N 3.27Å; R70-R72 PolarHBondContact O-N 2.89Å
73	F	68.3	Low	67.6	Low	81 Å²	81	92.2 Å²	92.2	36%	0.355	44%	0.435	S	S	.	.	S	Bend	trans	-124.7	4.7	-165.5	-60.5	-71.9	0	0	0	115.4	K75 G76 W141 L144	F73-K75 PolarHBondContact O-N 3.05Å; F73-K75 VanDerWaalsContact O-N 3.13Å; F73-G76 PolarHBondContact O-N 2.98Å; F73-G76 VanDerWaalsContact O-N 3.11Å; F73-W141 AromaticContact CD1-CH2 3.8Å; F73-W141 HydrophobicContact CD1-CH2 3.8Å; F73-W141 HydrophobicContact CD1-CZ2 4.14Å; F73-W141 HydrophobicContact CD1-CZ3 4.06Å; F73-W141 HydrophobicContact CD2-CE3 4.24Å; F73-W141 HydrophobicContact CD2-CH2 4.47Å; F73-W141 AromaticContact CD2-CZ3 3.92Å; F73-W141 HydrophobicContact CD2-CZ3 3.92Å; F73-W141 AromaticContact CE1-CH2 3.4Å; F73-W141 HydrophobicContact CE1-CH2 3.4Å; F73-W141 HydrophobicContact CE1-CZ2 4.09Å; F73-W141 AromaticContact CE1-CZ3 3.78Å; F73-W141 HydrophobicContact CE1-CZ3 3.78Å; F73-W141 HydrophobicContact CE2-CE3 4.34Å; F73-W141 HydrophobicContact CE2-CH2 4.13Å; F73-W141 AromaticContact CE2-CZ3 3.62Å; F73-W141 HydrophobicContact CE2-CZ3 3.62Å; F73-W141 HydrophobicContact CG-CE3 4.38Å; F73-W141 HydrophobicContact CG-CH2 4.33Å; F73-W141 HydrophobicContact CG-CZ3 4.13Å; F73-W141 AromaticContact CZ-CH2 3.58Å; F73-W141 HydrophobicContact CZ-CH2 3.58Å; F73-W141 AromaticContact CZ-CZ3 3.55Å; F73-W141 HydrophobicContact CZ-CZ3 3.55Å; F73-L144 HydrophobicContact CE2-CD1 4.41Å
74	W	69.6	Low	69.7	Low	105 Å²	105	87.1 Å²	87.1	40%	0.398	40%	0.402	S	S	.	.	H	α-helix	trans	-54.6	-36.3	-176.1	74.5	-77.7	0	0	0	114.2	W54 G76 F77 I78	W54-W74 HydrophobicContact CE3-CE3 4.35Å; W54-W74 HydrophobicContact CH2-CB 3.25Å; W54-W74 HydrophobicContact CH2-CG 4.42Å; W54-W74 HydrophobicContact CZ2-CB 4.08Å; W54-W74 HydrophobicContact CZ3-CB 3.7Å; W54-W74 HydrophobicContact CZ3-CE3 4.09Å; W54-W74 HydrophobicContact CZ3-CG 4.5Å; W74-G76 VanDerWaalsContact C-N 3.29Å; W74-G76 PolarHBondContact O-N 3Å; W74-F77 PolarHBondContact O-N 3.37Å; W74-I78 HydrophobicContact CE3-CD1 3.26Å; W74-I78 HydrophobicContact CE3-CG1 4.27Å; W74-I78 HydrophobicContact CZ3-CD1 3.31Å; W74-I78 PolarHBondContact O-N 3.04Å
75	K	81.9	Confident	72	Confident	153 Å²	153	86.3 Å²	86.3	67%	0.665	40%	0.397	S	S	*	.	H	α-helix	trans	-59.6	-37.6	-179.6	-62.9	-177	179	179.4	0	113	F73 L79	F73-K75 PolarHBondContact O-N 3.05Å; F73-K75 VanDerWaalsContact O-N 3.13Å; K75-L79 WeakPolarHBondContact O-CB 3.47Å; K75-L79 PolarHBondContact O-N 2.94Å; K75-L79 VanDerWaalsContact O-N 3.07Å
76	G	82.6	Confident	74.6	Confident	16 Å²	16	83.5 Å²	83.5	17%	0.165	39%	0.385	C	S	.	.	H	α-helix	trans	-71	-41.9	-179.5	0	0	0	0	0	112.3	F73 W74 L79 C80 Y137	F73-G76 PolarHBondContact O-N 2.98Å; F73-G76 VanDerWaalsContact O-N 3.11Å; W74-G76 VanDerWaalsContact C-N 3.29Å; W74-G76 PolarHBondContact O-N 3Å; G76-L79 PolarHBondContact O-N 3.29Å; G76-C80 PolarHBondContact O-N 2.67Å; G76-C80 PolarHBondContact O-SG 3.17Å; G76-C80 VanDerWaalsContact O-SG 3.36Å; G76-Y137 WeakPolarHBondContact CA-OH 3.23Å
77	F	81.3	Confident	76.9	Confident	25 Å²	25	79.2 Å²	79.2	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-47.4	174.2	-79.4	-84	0	0	0	111.9	W54 W69 W74 L79 C80 D81 T138 W141	W54-F77 HydrophobicContact CZ2-CB 4.21Å; W69-F77 HydrophobicContact CZ3-CD2 4.2Å; W74-F77 PolarHBondContact O-N 3.37Å; F77-L79 VanDerWaalsContact C-N 3.3Å; F77-L79 PolarHBondContact O-N 3.41Å; F77-C80 WeakPolarHBondContact O-CB 3.34Å; F77-C80 PolarHBondContact O-N 2.88Å; F77-C80 VanDerWaalsContact O-N 3.14Å; F77-D81 VanDerWaalsContact O-CG 3.26Å; F77-D81 PolarHBondContact O-N 3.02Å; F77-T138 HydrophobicContact CD1-CG2 4.33Å; F77-T138 HydrophobicContact CE1-CG2 4.12Å; F77-W141 HydrophobicContact CE2-CB 4.13Å; F77-W141 HydrophobicContact CE2-CG 4.39Å; F77-W141 HydrophobicContact CZ-CB 3.8Å; F77-W141 HydrophobicContact CZ-CG 4.39Å
78	I	85	Confident	79.1	Confident	34 Å²	34	76.4 Å²	76.4	17%	0.174	34%	0.341	C	S	.	.	H	α-helix	trans	-60.7	-40.7	177.2	-70.1	-175	0	0	0	111.7	W54 W74 C80 D81 I82	W54-I78 HydrophobicContact CB-CD1 4.37Å; W54-I78 HydrophobicContact CD2-CD1 3.87Å; W54-I78 HydrophobicContact CD2-CG1 3.91Å; W54-I78 HydrophobicContact CE3-CD1 4.14Å; W54-I78 HydrophobicContact CG-CD1 4Å; W54-I78 HydrophobicContact CG-CG1 3.98Å; W54-I78 HydrophobicContact CZ2-CG1 4.19Å; W74-I78 HydrophobicContact CE3-CD1 3.26Å; W74-I78 HydrophobicContact CE3-CG1 4.27Å; W74-I78 HydrophobicContact CZ3-CD1 3.31Å; W74-I78 PolarHBondContact O-N 3.04Å; I78-C80 VanDerWaalsContact C-N 3.32Å; I78-C80 PolarHBondContact O-N 2.84Å; I78-D81 PolarHBondContact O-N 2.96Å; I78-I82 HydrophobicContact CG2-CD1 3.66Å; I78-I82 HydrophobicContact CG2-CG1 4.25Å; I78-I82 WeakPolarHBondContact O-CB 3.31Å; I78-I82 VanDerWaalsContact O-CG1 3.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.38Å; I78-I82 PolarHBondContact O-N 3.16Å
79	L	88.6	Confident	81.3	Confident	122 Å²	122	70 Å²	70	64%	0.639	32%	0.319	S	S	*	.	H	α-helix	trans	-61.9	-42.4	177.2	-175.8	66	0	0	0	111.5	K75 G76 F77 F83	K75-L79 WeakPolarHBondContact O-CB 3.47Å; K75-L79 PolarHBondContact O-N 2.94Å; K75-L79 VanDerWaalsContact O-N 3.07Å; G76-L79 PolarHBondContact O-N 3.29Å; F77-L79 VanDerWaalsContact C-N 3.3Å; F77-L79 PolarHBondContact O-N 3.41Å; L79-F83 WeakPolarHBondContact O-CB 3.09Å; L79-F83 PolarHBondContact O-N 3.33Å
80	C	89.2	Confident	83.4	Confident	17 Å²	17	72.2 Å²	72.2	12%	0.115	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-45.2	174.4	-71.5	0	0	0	0	112.2	G76 F77 I78 F83 M84 V134 Y137	G76-C80 PolarHBondContact O-N 2.67Å; G76-C80 PolarHBondContact O-SG 3.17Å; G76-C80 VanDerWaalsContact O-SG 3.36Å; F77-C80 WeakPolarHBondContact O-CB 3.34Å; F77-C80 PolarHBondContact O-N 2.88Å; F77-C80 VanDerWaalsContact O-N 3.14Å; I78-C80 VanDerWaalsContact C-N 3.32Å; I78-C80 PolarHBondContact O-N 2.84Å; C80-F83 PolarHBondContact O-N 3Å; C80-M84 WeakPolarHBondContact O-CB 2.9Å; C80-M84 WeakPolarHBondContact O-CG 3.17Å; C80-M84 PolarHBondContact O-N 3.35Å; C80-V134 HydrophobicContact CB-CG1 3.82Å; C80-V134 HydrophobicContact CB-CG2 4.4Å; C80-Y137 WeakPolarHBondContact SG-CD1 3.34Å
81	D	88.3	Confident	85.3	Confident	17 Å²	17	67.5 Å²	67.5	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-44.5	179.6	-65.2	-21.4	0	0	0	111	V47 L51 F77 I78 F83 M84 F85	V47-D81 HydrophobicContact CG1-CB 4.28Å; V47-D81 WeakPolarHBondContact CG1-O 3.41Å; L51-D81 HydrophobicContact CD2-CB 3.67Å; L51-D81 HydrophobicContact CG-CB 3.99Å; F77-D81 VanDerWaalsContact O-CG 3.26Å; F77-D81 PolarHBondContact O-N 3.02Å; I78-D81 PolarHBondContact O-N 2.96Å; D81-F83 PolarHBondContact O-N 3.49Å; D81-M84 PolarHBondContact O-N 2.84Å; D81-F85 VanDerWaalsContact O-CB 3.31Å; D81-F85 WeakPolarHBondContact O-CB 3.21Å; D81-F85 PolarHBondContact O-N 2.85Å
82	I	91.8	Very high	87.3	Confident	74 Å²	74	63.4 Å²	63.4	38%	0.379	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-44.8	175.8	-67.8	168.7	0	0	0	110.9	L51 I78 F85 F86	L51-I82 HydrophobicContact CD2-CG1 4.19Å; I78-I82 HydrophobicContact CG2-CD1 3.66Å; I78-I82 HydrophobicContact CG2-CG1 4.25Å; I78-I82 WeakPolarHBondContact O-CB 3.31Å; I78-I82 VanDerWaalsContact O-CG1 3.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.38Å; I78-I82 PolarHBondContact O-N 3.16Å; I82-F85 WeakPolarHBondContact O-CB 3.48Å; I82-F85 PolarHBondContact O-N 2.86Å; I82-F86 HydrophobicContact CG2-CD2 4.13Å; I82-F86 HydrophobicContact CG2-CE2 3.83Å; I82-F86 WeakPolarHBondContact O-CD2 3Å; I82-F86 PolarHBondContact O-N 3.28Å
83	F	93.6	Very high	88.9	Confident	113 Å²	113	57.8 Å²	57.8	50%	0.496	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-44.6	179.1	-178.9	-109.9	0	0	0	111.8	L79 C80 D81 F85 F86 A87 A130 V134	L79-F83 WeakPolarHBondContact O-CB 3.09Å; L79-F83 PolarHBondContact O-N 3.33Å; C80-F83 PolarHBondContact O-N 3Å; D81-F83 PolarHBondContact O-N 3.49Å; F83-F85 VanDerWaalsContact C-N 3.32Å; F83-F85 PolarHBondContact O-N 3.35Å; F83-F86 PolarHBondContact O-N 2.93Å; F83-A87 WeakPolarHBondContact O-CB 3.22Å; F83-A87 PolarHBondContact O-N 2.75Å; F83-A130 HydrophobicContact CD1-CB 4.48Å; F83-A130 HydrophobicContact CE1-CB 3.42Å; F83-A130 VanDerWaalsContact CE1-CB 3.42Å; F83-A130 HydrophobicContact CZ-CB 3.89Å; F83-V134 HydrophobicContact CD1-CG2 4.08Å
84	M	93.4	Very high	90.2	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-68.4	-30.2	177.2	-73.3	-58.8	-68.8	0	0	112.8	V47 C80 D81 A87 N88 Y127 N131 V134	V47-M84 HydrophobicContact CG2-CB 4.01Å; C80-M84 WeakPolarHBondContact O-CB 2.9Å; C80-M84 WeakPolarHBondContact O-CG 3.17Å; C80-M84 PolarHBondContact O-N 3.35Å; D81-M84 PolarHBondContact O-N 2.84Å; M84-A87 PolarHBondContact O-N 3.39Å; M84-N88 WeakPolarHBondContact O-CB 3.49Å; M84-N88 PolarHBondContact O-N 2.97Å; M84-N88 PolarHBondContact O-ND2 2.96Å; M84-Y127 HydrophobicContact CE-CE2 4.38Å; M84-N131 HydrophobicContact CE-CB 4.4Å; M84-V134 HydrophobicContact CG-CB 4.12Å; M84-V134 HydrophobicContact CG-CG1 3.8Å; M84-V134 HydrophobicContact CG-CG2 3.95Å; M84-V134 HydrophobicContact SD-CB 4.17Å; M84-V134 HydrophobicContact SD-CG1 4.45Å; M84-V134 HydrophobicContact SD-CG2 4.03Å
85	F	94	Very high	91.3	Very high	49 Å²	49	50.2 Å²	50.2	22%	0.215	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-51.1	173.6	174.6	-91.9	0	0	0	110.4	W44 V47 V48 L51 D81 I82 F83 L89	W44-F85 AromaticContact CE2-CE2 3.48Å; W44-F85 VanDerWaalsContact CE2-CE2 3.48Å; W44-F85 HydrophobicContact CZ2-CD2 4.47Å; W44-F85 AromaticContact CZ2-CE2 3.5Å; W44-F85 HydrophobicContact CZ2-CE2 3.5Å; W44-F85 VanDerWaalsContact CZ2-CE2 3.5Å; W44-F85 AromaticContact CZ2-CZ 3.89Å; W44-F85 HydrophobicContact CZ2-CZ 3.89Å; W44-F85 AromaticContact NE1-CD2 3.37Å; W44-F85 AromaticContact NE1-CE2 3.14Å; W44-F85 AromaticContact NE1-CZ 3.69Å; V47-F85 HydrophobicContact CG1-CB 3.84Å; V48-F85 HydrophobicContact CG2-CD2 3.9Å; V48-F85 HydrophobicContact CG2-CE2 3.73Å; L51-F85 HydrophobicContact CD1-CB 4.37Å; L51-F85 HydrophobicContact CD1-CD2 4.31Å; D81-F85 VanDerWaalsContact O-CB 3.31Å; D81-F85 WeakPolarHBondContact O-CB 3.21Å; D81-F85 PolarHBondContact O-N 2.85Å; I82-F85 WeakPolarHBondContact O-CB 3.48Å; I82-F85 PolarHBondContact O-N 2.86Å; F83-F85 VanDerWaalsContact C-N 3.32Å; F83-F85 PolarHBondContact O-N 3.35Å; F85-L89 HydrophobicContact CE1-CD2 4.47Å; F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.42Å; F85-L89 PolarHBondContact O-N 2.85Å
86	F	95.3	Very high	92	Very high	112 Å²	112	46.4 Å²	46.4	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-68.9	-40.7	177.7	-70.3	-66.4	0	0	0	112.6	I82 F83 N88 L89 I90	I82-F86 HydrophobicContact CG2-CD2 4.13Å; I82-F86 HydrophobicContact CG2-CE2 3.83Å; I82-F86 WeakPolarHBondContact O-CD2 3Å; I82-F86 PolarHBondContact O-N 3.28Å; F83-F86 PolarHBondContact O-N 2.93Å; F86-N88 PolarHBondContact O-N 3.03Å; F86-L89 PolarHBondContact O-N 3.06Å; F86-I90 WeakPolarHBondContact O-CB 3.4Å; F86-I90 VanDerWaalsContact O-CG1 3.28Å; F86-I90 WeakPolarHBondContact O-CG1 3.16Å; F86-I90 PolarHBondContact O-N 3.05Å
87	A	94.6	Very high	92.5	Very high	18 Å²	18	48.3 Å²	48.3	15%	0.149	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-45.9	179.2	0	0	0	0	0	112.1	F83 M84 L91 Y127	F83-A87 WeakPolarHBondContact O-CB 3.22Å; F83-A87 PolarHBondContact O-N 2.75Å; M84-A87 PolarHBondContact O-N 3.39Å; A87-L91 WeakPolarHBondContact O-CB 3.35Å; A87-L91 PolarHBondContact O-N 3.27Å; A87-Y127 HydrophobicContact CB-CD2 4.03Å; A87-Y127 HydrophobicContact CB-CE2 4.22Å
88	N	94.2	Very high	93	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-41.5	175.5	-79.1	-67.8	0	0	0	111.8	S43 W44 M84 F86 L91 L92 Y127	S43-N88 WeakPolarHBondContact CB-OD1 3.11Å; W44-N88 HydrophobicContact CB-CB 4.06Å; M84-N88 WeakPolarHBondContact O-CB 3.49Å; M84-N88 PolarHBondContact O-N 2.97Å; M84-N88 PolarHBondContact O-ND2 2.96Å; F86-N88 PolarHBondContact O-N 3.03Å; N88-L91 PolarHBondContact O-N 3.48Å; N88-L92 VanDerWaalsContact O-CB 3.23Å; N88-L92 WeakPolarHBondContact O-CB 3.44Å; N88-L92 PolarHBondContact O-N 3.48Å; N88-Y127 PolarHBondContact OD1-OH 3.24Å
89	L	94.9	Very high	93.3	Very high	54 Å²	54	47.1 Å²	47.1	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-62.9	-45.7	179.1	-174.3	68.2	0	0	0	112	F85 F86 L92 I93	F85-L89 HydrophobicContact CE1-CD2 4.47Å; F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.42Å; F85-L89 PolarHBondContact O-N 2.85Å; F86-L89 PolarHBondContact O-N 3.06Å; L89-L92 PolarHBondContact O-N 2.97Å; L89-I93 HydrophobicContact CD1-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.05Å; L89-I93 VanDerWaalsContact O-CG1 3.3Å; L89-I93 WeakPolarHBondContact O-CG1 3.42Å; L89-I93 PolarHBondContact O-N 3.49Å
90	I	95.5	Very high	93.5	Very high	88 Å²	88	43.8 Å²	43.8	45%	0.451	23%	0.225	S	C	.	.	H	α-helix	trans	-62.8	-45.2	177.6	-69.1	166.6	0	0	0	110.4	F86 L92 I93 M94 I123	F86-I90 WeakPolarHBondContact O-CB 3.4Å; F86-I90 VanDerWaalsContact O-CG1 3.28Å; F86-I90 WeakPolarHBondContact O-CG1 3.16Å; F86-I90 PolarHBondContact O-N 3.05Å; I90-L92 VanDerWaalsContact C-N 3.34Å; I90-L92 PolarHBondContact O-N 3.22Å; I90-I93 PolarHBondContact O-N 3.03Å; I90-M94 WeakPolarHBondContact O-CB 3.23Å; I90-M94 WeakPolarHBondContact O-CG 3.5Å; I90-M94 PolarHBondContact O-N 2.89Å; I90-I123 HydrophobicContact CG2-CD1 4.29Å; I90-I123 HydrophobicContact CG2-CG2 4.15Å
91	L	94.8	Very high	93.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-42.9	177.9	-179.6	61.4	0	0	0	111.6	T36 A87 N88 M94 S95 I123 M124 Y127 Y166	T36-L91 HydrophobicContact CG2-CD1 4.1Å; T36-L91 HydrophobicContact CG2-CD2 3.95Å; T36-L91 HydrophobicContact CG2-CG 4.04Å; A87-L91 WeakPolarHBondContact O-CB 3.35Å; A87-L91 PolarHBondContact O-N 3.27Å; N88-L91 PolarHBondContact O-N 3.48Å; L91-M94 PolarHBondContact O-N 3.06Å; L91-S95 WeakPolarHBondContact O-CB 3.48Å; L91-S95 PolarHBondContact O-N 3.22Å; L91-S95 PolarHBondContact O-OG 3.05Å; L91-I123 HydrophobicContact CD1-CG2 4.19Å; L91-M124 HydrophobicContact CD1-CG 4Å; L91-M124 HydrophobicContact CD1-SD 3.45Å; L91-M124 WeakPolarHBondContact CD1-SD 3.41Å; L91-M124 HydrophobicContact CD2-SD 4.09Å; L91-M124 HydrophobicContact CG-SD 4.39Å; L91-Y127 HydrophobicContact CB-CD2 4.09Å; L91-Y127 HydrophobicContact CD2-CD1 3.92Å; L91-Y127 HydrophobicContact CD2-CD2 3.71Å; L91-Y127 HydrophobicContact CD2-CE1 4.12Å; L91-Y127 HydrophobicContact CD2-CE2 3.88Å; L91-Y127 HydrophobicContact CD2-CG 3.74Å; L91-Y127 HydrophobicContact CG-CD2 4.49Å; L91-Y166 HydrophobicContact CD2-CE2 4.07Å
92	L	94.8	Very high	93.4	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.209	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-52.6	177.6	-176.4	72.6	0	0	0	110.9	A37 S40 A41 N88 L89 I90 M94 S95 V96	A37-L92 HydrophobicContact CB-CD1 4.44Å; A37-L92 WeakPolarHBondContact O-CD1 3.24Å; S40-L92 WeakPolarHBondContact OG-CD1 3.3Å; A41-L92 HydrophobicContact CB-CD1 3.99Å; N88-L92 VanDerWaalsContact O-CB 3.23Å; N88-L92 WeakPolarHBondContact O-CB 3.44Å; N88-L92 PolarHBondContact O-N 3.48Å; L89-L92 PolarHBondContact O-N 2.97Å; I90-L92 VanDerWaalsContact C-N 3.34Å; I90-L92 PolarHBondContact O-N 3.22Å; L92-M94 VanDerWaalsContact C-N 3.3Å; L92-M94 PolarHBondContact O-N 2.92Å; L92-S95 WeakPolarHBondContact CA-OG 3.48Å; L92-S95 PolarHBondContact O-N 3.44Å; L92-S95 PolarHBondContact O-OG 3.48Å; L92-V96 WeakPolarHBondContact O-CG2 3.28Å; L92-V96 PolarHBondContact O-N 3.36Å
93	I	95.7	Very high	93.2	Very high	90 Å²	90	40.4 Å²	40.4	46%	0.462	21%	0.209	S	C	.	.	H	α-helix	trans	-56.4	-46.8	179.4	-69.3	166.4	0	0	0	110.6	L89 I90 V96 I97	L89-I93 HydrophobicContact CD1-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.05Å; L89-I93 VanDerWaalsContact O-CG1 3.3Å; L89-I93 WeakPolarHBondContact O-CG1 3.42Å; L89-I93 PolarHBondContact O-N 3.49Å; I90-I93 PolarHBondContact O-N 3.03Å; I93-V96 PolarHBondContact O-N 3.42Å; I93-I97 HydrophobicContact CG2-CD1 3.91Å; I93-I97 WeakPolarHBondContact O-CG1 3.42Å; I93-I97 PolarHBondContact O-N 2.93Å
94	M	94.3	Very high	92.7	Very high	28 Å²	28	41.1 Å²	41.1	14%	0.138	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-37	-179.7	-74.1	-64.9	-53.9	0	0	113	I90 L91 L92 V96 I97 V98 A119 I123	I90-M94 WeakPolarHBondContact O-CB 3.23Å; I90-M94 WeakPolarHBondContact O-CG 3.5Å; I90-M94 PolarHBondContact O-N 2.89Å; L91-M94 PolarHBondContact O-N 3.06Å; L92-M94 VanDerWaalsContact C-N 3.3Å; L92-M94 PolarHBondContact O-N 2.92Å; M94-V96 VanDerWaalsContact C-N 3.34Å; M94-I97 PolarHBondContact O-N 2.69Å; M94-I97 HydrophobicContact SD-CD1 4.01Å; M94-V98 WeakPolarHBondContact O-CG2 3.45Å; M94-V98 PolarHBondContact O-N 3.45Å; M94-A119 HydrophobicContact CE-CB 3.76Å; M94-I123 HydrophobicContact CB-CD1 4.32Å; M94-I123 HydrophobicContact CE-CD1 4.18Å; M94-I123 HydrophobicContact CG-CD1 3.54Å; M94-I123 HydrophobicContact SD-CD1 4.21Å
95	S	94	Very high	91.9	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-42.3	174.2	71.8	0	0	0	0	111.5	A37 L91 L92 V98 I99	A37-S95 WeakPolarHBondContact CA-OG 3.45Å; A37-S95 VanDerWaalsContact CB-OG 3.3Å; A37-S95 WeakPolarHBondContact CB-OG 3.31Å; L91-S95 WeakPolarHBondContact O-CB 3.48Å; L91-S95 PolarHBondContact O-N 3.22Å; L91-S95 PolarHBondContact O-OG 3.05Å; L92-S95 WeakPolarHBondContact CA-OG 3.48Å; L92-S95 PolarHBondContact O-N 3.44Å; L92-S95 PolarHBondContact O-OG 3.48Å; S95-V98 PolarHBondContact O-N 3.32Å; S95-I99 WeakPolarHBondContact O-CD1 3.43Å; S95-I99 WeakPolarHBondContact O-CG1 3.37Å; S95-I99 PolarHBondContact O-N 2.86Å
96	V	95.1	Very high	91	Very high	73 Å²	73	46.4 Å²	46.4	44%	0.442	26%	0.257	S	S	.	.	H	α-helix	trans	-63.7	-43.7	176.1	174.2	0	0	0	0	111.4	L92 I93 M94 V98 I99 V100	L92-V96 WeakPolarHBondContact O-CG2 3.28Å; L92-V96 PolarHBondContact O-N 3.36Å; I93-V96 PolarHBondContact O-N 3.42Å; M94-V96 VanDerWaalsContact C-N 3.34Å; V96-V98 VanDerWaalsContact C-N 3.33Å; V96-V98 PolarHBondContact O-N 3.15Å; V96-I99 PolarHBondContact O-N 2.9Å; V96-V100 WeakPolarHBondContact O-CG2 3.47Å; V96-V100 PolarHBondContact O-N 3.28Å
97	I	93.3	Very high	89.9	Confident	56 Å²	56	50.2 Å²	50.2	29%	0.287	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-45.5	176.6	-68.9	166.5	0	0	0	110.8	I93 M94 V100 A101 Y116	I93-I97 HydrophobicContact CG2-CD1 3.91Å; I93-I97 WeakPolarHBondContact O-CG1 3.42Å; I93-I97 PolarHBondContact O-N 2.93Å; M94-I97 PolarHBondContact O-N 2.69Å; M94-I97 HydrophobicContact SD-CD1 4.01Å; I97-V100 PolarHBondContact O-N 2.66Å; I97-A101 WeakPolarHBondContact O-CB 3.45Å; I97-A101 PolarHBondContact O-N 3.3Å; I97-Y116 HydrophobicContact CG2-CD1 3.6Å; I97-Y116 HydrophobicContact CG2-CE1 3.78Å; I97-Y116 HydrophobicContact CG2-CG 4.16Å
98	V	92.1	Very high	88.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-40	178.7	175.6	0	0	0	0	111.6	T33 M94 S95 V96 V100 A101 I102 L117 W120	T33-V98 HydrophobicContact CG2-CB 4.34Å; T33-V98 HydrophobicContact CG2-CG1 3.73Å; M94-V98 WeakPolarHBondContact O-CG2 3.45Å; M94-V98 PolarHBondContact O-N 3.45Å; S95-V98 PolarHBondContact O-N 3.32Å; V96-V98 VanDerWaalsContact C-N 3.33Å; V96-V98 PolarHBondContact O-N 3.15Å; V98-V100 VanDerWaalsContact C-N 3.33Å; V98-V100 PolarHBondContact O-N 2.83Å; V98-A101 PolarHBondContact O-N 3.48Å; V98-I102 HydrophobicContact CG1-CD1 3.62Å; V98-I102 HydrophobicContact CG1-CG1 4.14Å; V98-I102 WeakPolarHBondContact O-CB 3.5Å; V98-I102 VanDerWaalsContact O-CG1 3.31Å; V98-I102 WeakPolarHBondContact O-CG1 3.46Å; V98-I102 PolarHBondContact O-N 3.44Å; V98-L117 HydrophobicContact CG1-CD1 4.36Å; V98-W120 HydrophobicContact CG2-CB 3.71Å; V98-W120 HydrophobicContact CG2-CG 3.95Å
99	I	92.6	Very high	87.8	Confident	34 Å²	34	61.8 Å²	61.8	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-57.8	-47.3	174.9	-70.6	163	0	0	0	110.5	F30 I34 A37 S95 V96 I102 S103	F30-I99 HydrophobicContact CE2-CG2 4.02Å; I34-I99 HydrophobicContact CG1-CD1 3.98Å; I34-I99 HydrophobicContact CG1-CG1 4.14Å; A37-I99 HydrophobicContact CB-CD1 3.94Å; S95-I99 WeakPolarHBondContact O-CD1 3.43Å; S95-I99 WeakPolarHBondContact O-CG1 3.37Å; S95-I99 PolarHBondContact O-N 2.86Å; V96-I99 PolarHBondContact O-N 2.9Å; I99-I102 PolarHBondContact O-N 3.35Å; I99-S103 VanDerWaalsContact O-CB 3.28Å; I99-S103 WeakPolarHBondContact O-CB 3.38Å; I99-S103 PolarHBondContact O-N 2.94Å; I99-S103 PolarHBondContact O-OG 3.32Å
100	V	91.7	Very high	86.7	Confident	51 Å²	51	61.8 Å²	61.8	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-44.1	177.4	173.2	0	0	0	0	111.1	V96 I97 V98 I102 S103 W104 Y108	V96-V100 WeakPolarHBondContact O-CG2 3.47Å; V96-V100 PolarHBondContact O-N 3.28Å; I97-V100 PolarHBondContact O-N 2.66Å; V98-V100 VanDerWaalsContact C-N 3.33Å; V98-V100 PolarHBondContact O-N 2.83Å; V100-I102 PolarHBondContact O-N 2.99Å; V100-S103 PolarHBondContact O-N 3.42Å; V100-W104 HydrophobicContact CG1-CE3 3.92Å; V100-W104 HydrophobicContact CG1-CZ3 4.18Å; V100-W104 PolarHBondContact O-N 3.32Å; V100-W104 VanDerWaalsContact O-N 3.11Å; V100-Y108 HydrophobicContact CG1-CE2 4.08Å
101	A	89.1	Confident	85.4	Confident	1 Å²	1	62 Å²	62	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-41.3	179.7	0	0	0	0	0	112.4	I97 V98 Y108 L113	I97-A101 WeakPolarHBondContact O-CB 3.45Å; I97-A101 PolarHBondContact O-N 3.3Å; V98-A101 PolarHBondContact O-N 3.48Å; A101-Y108 HydrophobicContact CB-CD1 4.26Å; A101-Y108 HydrophobicContact CB-CD2 4.36Å; A101-Y108 HydrophobicContact CB-CG 4.12Å; A101-L113 HydrophobicContact CB-CD1 3.77Å
102	I	87.3	Confident	84.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-70	-37.1	176.6	-66.7	172.7	0	0	0	111	W3 R26 F30 V98 I99 V100 W104 L113	W3-I102 HydrophobicContact CH2-CG2 4.36Å; W3-I102 VanDerWaalsContact CH2-O 3.23Å; W3-I102 WeakPolarHBondContact CH2-O 3.47Å; W3-I102 HydrophobicContact CZ3-CG2 4.05Å; W3-I102 WeakPolarHBondContact CZ3-O 3.38Å; R26-I102 HydrophobicContact CG-CG2 4.23Å; R26-I102 PolarHBondContact NH2-O 3.27Å; F30-I102 HydrophobicContact CB-CG2 4.21Å; F30-I102 HydrophobicContact CD2-CB 4.14Å; F30-I102 HydrophobicContact CD2-CG2 3.68Å; F30-I102 HydrophobicContact CE2-CG2 4.48Å; F30-I102 HydrophobicContact CG-CG2 4.3Å; V98-I102 HydrophobicContact CG1-CD1 3.62Å; V98-I102 HydrophobicContact CG1-CG1 4.14Å; V98-I102 WeakPolarHBondContact O-CB 3.5Å; V98-I102 VanDerWaalsContact O-CG1 3.31Å; V98-I102 WeakPolarHBondContact O-CG1 3.46Å; V98-I102 PolarHBondContact O-N 3.44Å; I99-I102 PolarHBondContact O-N 3.35Å; V100-I102 PolarHBondContact O-N 2.99Å; I102-W104 PolarHBondContact O-N 3.36Å; I102-L113 HydrophobicContact CG1-CD1 3.95Å
103	S	86.4	Confident	84.2	Confident	37 Å²	37	66 Å²	66	26%	0.259	32%	0.322	S	S	.	.	H	α-helix	trans	-69.1	-29.1	-178	-60.7	0	0	0	0	113.7	F30 I99 V100 P105	F30-S103 WeakPolarHBondContact CE2-OG 3.21Å; I99-S103 VanDerWaalsContact O-CB 3.28Å; I99-S103 WeakPolarHBondContact O-CB 3.38Å; I99-S103 PolarHBondContact O-N 2.94Å; I99-S103 PolarHBondContact O-OG 3.32Å; V100-S103 PolarHBondContact O-N 3.42Å; S103-P105 VanDerWaalsContact C-CD 3.45Å; S103-P105 WeakPolarHBondContact O-CD 3.44Å
104	W	83.9	Confident	83.8	Confident	128 Å²	128	62.3 Å²	62.3	49%	0.485	30%	0.302	S	S	.	.			trans	-115.7	75.3	-178.4	-84.5	-26.3	0	0	0	113.8	V100 I102 A106 R107 Y108	V100-W104 HydrophobicContact CG1-CE3 3.92Å; V100-W104 HydrophobicContact CG1-CZ3 4.18Å; V100-W104 PolarHBondContact O-N 3.32Å; V100-W104 VanDerWaalsContact O-N 3.11Å; I102-W104 PolarHBondContact O-N 3.36Å; W104-A106 PolarHBondContact O-N 3.48Å; W104-A106 VanDerWaalsContact O-N 3.14Å; W104-R107 PolarHBondContact O-N 3.3Å; W104-Y108 HydrophobicContact CB-CD2 4.18Å; W104-Y108 PolarHBondContact O-N 2.92Å
105	P	75.4	Confident	83.5	Confident	66 Å²	66	64.7 Å²	64.7	43%	0.429	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.8	176.2	26.1	-34	0	0	0	113.6	S103	S103-P105 VanDerWaalsContact C-CD 3.45Å; S103-P105 WeakPolarHBondContact O-CD 3.44Å
106	A	75.9	Confident	83.4	Confident	99 Å²	99	68.7 Å²	68.7	82%	0.818	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-31.8	179.8	0	0	0	0	0	113.2	W104	W104-A106 PolarHBondContact O-N 3.48Å; W104-A106 VanDerWaalsContact O-N 3.14Å
107	R	73	Confident	83.1	Confident	192 Å²	192	65.2 Å²	65.2	73%	0.725	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-42.2	179.8	-72.3	-169	-179.8	-175.3	1.4	112	W104 R109	W104-R107 PolarHBondContact O-N 3.3Å; R107-R109 PolarHBondContact O-N 2.78Å
108	Y	70.5	Confident	83	Confident	69 Å²	69	69 Å²	69	27%	0.271	33%	0.327	S	S	.	.	S	Bend	trans	-93.2	93.4	178.8	-65.1	-84.4	0	0	0	109.4	V100 A101 W104 H112 Y116	V100-Y108 HydrophobicContact CG1-CE2 4.08Å; A101-Y108 HydrophobicContact CB-CD1 4.26Å; A101-Y108 HydrophobicContact CB-CD2 4.36Å; A101-Y108 HydrophobicContact CB-CG 4.12Å; W104-Y108 HydrophobicContact CB-CD2 4.18Å; W104-Y108 PolarHBondContact O-N 2.92Å; Y108-H112 HydrophobicContact CD1-CB 4.41Å; Y108-Y116 HydrophobicContact CD1-CE2 4.15Å; Y108-Y116 HydrophobicContact CE1-CE2 4.02Å
109	R	72.9	Confident	83.1	Confident	191 Å²	191	70.6 Å²	70.6	72%	0.721	34%	0.34	S	S	*	.			trans	-59.9	157.8	168.9	-72.2	-168.3	-172.9	-174	3.7	110.5	R107 Y111 H112 L113	R107-R109 PolarHBondContact O-N 2.78Å; R109-Y111 PolarHBondContact O-N 3.46Å; R109-H112 PolarHBondContact O-N 3.42Å; R109-L113 PolarHBondContact O-N 3.02Å
110	L	72.1	Confident	83.1	Confident	54 Å²	54	69 Å²	69	28%	0.283	33%	0.332	S	S	.	.	H	α-helix	trans	-49.6	-37.1	-178.4	-74.2	98.4	0	0	0	113.2	H112 L113 K114 A183 L184	L110-H112 PolarHBondContact O-N 2.91Å; L110-L113 PolarHBondContact O-N 3.36Å; L110-K114 PolarHBondContact O-N 3.43Å; L110-A183 HydrophobicContact CD2-CB 4.33Å; L110-L184 HydrophobicContact CB-CD1 4.24Å; L110-L184 HydrophobicContact CB-CD2 4.4Å; L110-L184 HydrophobicContact CB-CG 4.38Å
111	Y	68.4	Low	83.2	Confident	94 Å²	94	67 Å²	67	37%	0.369	32%	0.32	S	S	.	.	H	α-helix	trans	-55.5	-48.2	175.8	-72.4	-91.7	0	0	0	113.8	R109 L184 D189	R109-Y111 PolarHBondContact O-N 3.46Å; Y111-L184 HydrophobicContact CD1-CD2 3.61Å; Y111-L184 HydrophobicContact CD2-CD2 3.61Å; Y111-L184 HydrophobicContact CE1-CD2 3.52Å; Y111-L184 HydrophobicContact CE2-CD2 3.46Å; Y111-L184 VanDerWaalsContact CE2-CD2 3.46Å; Y111-L184 HydrophobicContact CG-CD2 3.67Å; Y111-D189 WeakPolarHBondContact CD1-OD1 3.46Å; Y111-D189 WeakPolarHBondContact CE1-OD1 3.3Å
112	H	80.7	Confident	83.5	Confident	114 Å²	114	70.8 Å²	70.8	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-72.8	-38.8	179.5	-67.2	-65.3	0	0	0	111.3	Y108 R109 L110 K114 S115 Y116	Y108-H112 HydrophobicContact CD1-CB 4.41Å; R109-H112 PolarHBondContact O-N 3.42Å; L110-H112 PolarHBondContact O-N 2.91Å; H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 3.28Å; H112-S115 PolarHBondContact O-N 2.94Å; H112-Y116 HydrophobicContact CB-CE2 4.33Å; H112-Y116 WeakPolarHBondContact O-CD2 3.18Å; H112-Y116 PolarHBondContact O-N 2.9Å
113	L	84.9	Confident	83.8	Confident	9 Å²	9	72.5 Å²	72.5	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-39.6	178.6	-176.7	62.9	0	0	0	112.1	A101 I102 R109 L110 S115 Y116 L117 Y176 I180	A101-L113 HydrophobicContact CB-CD1 3.77Å; I102-L113 HydrophobicContact CG1-CD1 3.95Å; R109-L113 PolarHBondContact O-N 3.02Å; L110-L113 PolarHBondContact O-N 3.36Å; L113-S115 VanDerWaalsContact C-N 3.33Å; L113-S115 PolarHBondContact O-N 3.02Å; L113-Y116 PolarHBondContact O-N 2.85Å; L113-L117 WeakPolarHBondContact O-CB 3.43Å; L113-L117 PolarHBondContact O-N 3Å; L113-Y176 HydrophobicContact CD2-CE1 4.23Å; L113-I180 HydrophobicContact CD2-CD1 3.69Å; L113-I180 HydrophobicContact CG-CD1 3.93Å
114	K	85.4	Confident	84.1	Confident	12 Å²	12	70.8 Å²	70.8	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-52.8	-48.7	175.7	-179.3	-170.2	177.3	-169.2	0	111.9	L110 H112 L117 R118 Y177 I180 L184 D189 E191	L110-K114 PolarHBondContact O-N 3.43Å; H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 3.28Å; K114-L117 PolarHBondContact O-N 2.77Å; K114-R118 WeakPolarHBondContact O-CB 3.46Å; K114-R118 PolarHBondContact O-N 3.46Å; K114-Y177 HydrophobicContact CG-CD2 4.35Å; K114-Y177 HydrophobicContact CG-CE2 3.68Å; K114-I180 HydrophobicContact CB-CG2 3.97Å; K114-I180 HydrophobicContact CG-CG2 4.49Å; K114-L184 HydrophobicContact CB-CD1 4.27Å; K114-L184 HydrophobicContact CD-CD1 3.98Å; K114-D189 IonicContact NZ-OD2 3.87Å; K114-D189 PolarHBondContact NZ-OD2 3.45Å; K114-E191 IonicContact NZ-OE2 3.97Å; K114-E191 PolarHBondContact NZ-OE2 2.79Å
115	S	88.7	Confident	84.6	Confident	79 Å²	79	68.7 Å²	68.7	55%	0.552	33%	0.333	S	S	*	.	H	α-helix	trans	-66.2	-46.5	-177.8	-174.5	0	0	0	0	112.1	H112 L113 L117 R118 A119	H112-S115 PolarHBondContact O-N 2.94Å; L113-S115 VanDerWaalsContact C-N 3.33Å; L113-S115 PolarHBondContact O-N 3.02Å; S115-L117 VanDerWaalsContact C-N 3.34Å; S115-L117 PolarHBondContact O-N 2.94Å; S115-R118 PolarHBondContact O-N 3.02Å; S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.31Å
116	Y	91.2	Very high	85.6	Confident	83 Å²	83	70.6 Å²	70.6	33%	0.325	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-40.8	177.5	-69	-63.1	0	0	0	112.6	I97 Y108 H112 L113 A119 W120	I97-Y116 HydrophobicContact CG2-CD1 3.6Å; I97-Y116 HydrophobicContact CG2-CE1 3.78Å; I97-Y116 HydrophobicContact CG2-CG 4.16Å; Y108-Y116 HydrophobicContact CD1-CE2 4.15Å; Y108-Y116 HydrophobicContact CE1-CE2 4.02Å; H112-Y116 HydrophobicContact CB-CE2 4.33Å; H112-Y116 WeakPolarHBondContact O-CD2 3.18Å; H112-Y116 PolarHBondContact O-N 2.9Å; L113-Y116 PolarHBondContact O-N 2.85Å; Y116-A119 PolarHBondContact O-N 3.31Å; Y116-W120 WeakPolarHBondContact O-CB 3.47Å; Y116-W120 PolarHBondContact O-N 3.21Å
117	L	89.9	Confident	86.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-69.1	-39.6	179.3	-169.6	61.4	0	0	0	111.7	V98 L113 K114 S115 W120 C121 Y176 I180	V98-L117 HydrophobicContact CG1-CD1 4.36Å; L113-L117 WeakPolarHBondContact O-CB 3.43Å; L113-L117 PolarHBondContact O-N 3Å; K114-L117 PolarHBondContact O-N 2.77Å; S115-L117 VanDerWaalsContact C-N 3.34Å; S115-L117 PolarHBondContact O-N 2.94Å; L117-W120 HydrophobicContact CD1-CE3 4.33Å; L117-W120 PolarHBondContact O-N 3.38Å; L117-C121 PolarHBondContact O-N 3.41Å; L117-C121 PolarHBondContact O-SG 3.46Å; L117-C121 VanDerWaalsContact O-SG 3.35Å; L117-Y176 HydrophobicContact CD2-CD1 3.56Å; L117-Y176 HydrophobicContact CD2-CE1 4.24Å; L117-Y176 HydrophobicContact CD2-CG 4.19Å; L117-I180 HydrophobicContact CD2-CD1 3.95Å
118	R	91.4	Very high	87.4	Confident	136 Å²	136	57.7 Å²	57.7	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-49.1	171.6	-177.7	-178.4	176	-176.9	0.5	111.2	K114 S115 W120 C121 I122 Y177	K114-R118 WeakPolarHBondContact O-CB 3.46Å; K114-R118 PolarHBondContact O-N 3.46Å; S115-R118 PolarHBondContact O-N 3.02Å; R118-W120 VanDerWaalsContact C-N 3.33Å; R118-W120 PolarHBondContact O-N 3.44Å; R118-C121 PolarHBondContact O-N 2.95Å; R118-I122 HydrophobicContact CG-CD1 3.99Å; R118-I122 WeakPolarHBondContact O-CG1 3.41Å; R118-I122 PolarHBondContact O-N 2.93Å; R118-Y177 HydrophobicContact CB-CD2 4.25Å; R118-Y177 HydrophobicContact CB-CE2 3.73Å; R118-Y177 HydrophobicContact CG-CE2 4.38Å
119	A	93.1	Very high	88.5	Confident	33 Å²	33	59.7 Å²	59.7	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-43.5	179	0	0	0	0	0	111.4	M94 S115 Y116 C121 I122 I123	M94-A119 HydrophobicContact CE-CB 3.76Å; S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.31Å; Y116-A119 PolarHBondContact O-N 3.31Å; A119-C121 PolarHBondContact O-N 2.78Å; A119-I122 PolarHBondContact O-N 3.42Å; A119-I123 WeakPolarHBondContact O-CB 3.33Å; A119-I123 VanDerWaalsContact O-CG1 3.28Å; A119-I123 WeakPolarHBondContact O-CG1 3.42Å; A119-I123 PolarHBondContact O-N 2.92Å
120	W	93.8	Very high	89.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-44.2	176	-177.9	84.6	0	0	0	112.5	T33 T36 V98 Y116 L117 R118 I122 I123 M124 F169	T33-W120 HydrophobicContact CG2-CD2 4.36Å; T33-W120 HydrophobicContact CG2-CH2 4.29Å; T33-W120 HydrophobicContact CG2-CZ2 3.81Å; T36-W120 HydrophobicContact CG2-CZ2 4.44Å; V98-W120 HydrophobicContact CG2-CB 3.71Å; V98-W120 HydrophobicContact CG2-CG 3.95Å; Y116-W120 WeakPolarHBondContact O-CB 3.47Å; Y116-W120 PolarHBondContact O-N 3.21Å; L117-W120 HydrophobicContact CD1-CE3 4.33Å; L117-W120 PolarHBondContact O-N 3.38Å; R118-W120 VanDerWaalsContact C-N 3.33Å; R118-W120 PolarHBondContact O-N 3.44Å; W120-I122 PolarHBondContact O-N 3.34Å; W120-I123 PolarHBondContact O-N 3.03Å; W120-M124 HydrophobicContact CD2-CG 4Å; W120-M124 HydrophobicContact CE3-CG 4.23Å; W120-M124 HydrophobicContact CH2-CE 4.24Å; W120-M124 HydrophobicContact CH2-CG 4.03Å; W120-M124 HydrophobicContact CZ2-CE 4.2Å; W120-M124 HydrophobicContact CZ2-CG 3.77Å; W120-M124 HydrophobicContact CZ2-SD 4.06Å; W120-M124 HydrophobicContact CZ3-CG 4.24Å; W120-M124 WeakPolarHBondContact O-CB 3.45Å; W120-M124 WeakPolarHBondContact O-CG 3.21Å; W120-M124 PolarHBondContact O-N 2.86Å; W120-F169 HydrophobicContact CH2-CB 4.45Å
121	C	93.3	Very high	90.2	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.061	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-43	175.6	-71	0	0	0	0	112.5	L117 R118 A119 M124 I125 L170	L117-C121 PolarHBondContact O-N 3.41Å; L117-C121 PolarHBondContact O-SG 3.46Å; L117-C121 VanDerWaalsContact O-SG 3.35Å; R118-C121 PolarHBondContact O-N 2.95Å; A119-C121 PolarHBondContact O-N 2.78Å; C121-M124 PolarHBondContact O-N 3.44Å; C121-I125 WeakPolarHBondContact O-CG1 3.24Å; C121-I125 PolarHBondContact O-N 3.47Å; C121-L170 HydrophobicContact CB-CD1 4.19Å; C121-L170 WeakPolarHBondContact O-CD1 3.49Å
122	I	94.6	Very high	91.3	Very high	82 Å²	82	49 Å²	49	42%	0.421	25%	0.25	S	C	.	.	H	α-helix	trans	-62.5	-45.9	177.3	-67.2	167.1	0	0	0	110.3	R118 A119 W120 M124 I125 L126	R118-I122 HydrophobicContact CG-CD1 3.99Å; R118-I122 WeakPolarHBondContact O-CG1 3.41Å; R118-I122 PolarHBondContact O-N 2.93Å; A119-I122 PolarHBondContact O-N 3.42Å; W120-I122 PolarHBondContact O-N 3.34Å; I122-M124 VanDerWaalsContact C-N 3.34Å; I122-M124 PolarHBondContact O-N 2.82Å; I122-I125 PolarHBondContact O-N 3.49Å; I122-L126 HydrophobicContact CG2-CD1 4.14Å; I122-L126 WeakPolarHBondContact O-CG 3.33Å; I122-L126 PolarHBondContact O-N 3.02Å
123	I	94.7	Very high	91.7	Very high	36 Å²	36	45.7 Å²	45.7	19%	0.185	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-39.7	179.4	-70.6	170.7	0	0	0	111.1	I90 L91 M94 A119 W120 I125 L126 Y127	I90-I123 HydrophobicContact CG2-CD1 4.29Å; I90-I123 HydrophobicContact CG2-CG2 4.15Å; L91-I123 HydrophobicContact CD1-CG2 4.19Å; M94-I123 HydrophobicContact CB-CD1 4.32Å; M94-I123 HydrophobicContact CE-CD1 4.18Å; M94-I123 HydrophobicContact CG-CD1 3.54Å; M94-I123 HydrophobicContact SD-CD1 4.21Å; A119-I123 WeakPolarHBondContact O-CB 3.33Å; A119-I123 VanDerWaalsContact O-CG1 3.28Å; A119-I123 WeakPolarHBondContact O-CG1 3.42Å; A119-I123 PolarHBondContact O-N 2.92Å; W120-I123 PolarHBondContact O-N 3.03Å; I123-I125 VanDerWaalsContact C-N 3.34Å; I123-I125 PolarHBondContact O-N 3.32Å; I123-L126 PolarHBondContact O-N 2.93Å; I123-Y127 WeakPolarHBondContact O-CB 3.39Å; I123-Y127 PolarHBondContact O-N 3.46Å
124	M	93.5	Very high	91.9	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-42.7	173.7	-80.9	-71.2	-74.7	0	0	112	T36 L91 W120 C121 I122 Y127 Q128 Y166 L170	T36-M124 HydrophobicContact CG2-SD 3.94Å; L91-M124 HydrophobicContact CD1-CG 4Å; L91-M124 HydrophobicContact CD1-SD 3.45Å; L91-M124 WeakPolarHBondContact CD1-SD 3.41Å; L91-M124 HydrophobicContact CD2-SD 4.09Å; L91-M124 HydrophobicContact CG-SD 4.39Å; W120-M124 HydrophobicContact CD2-CG 4Å; W120-M124 HydrophobicContact CE3-CG 4.23Å; W120-M124 HydrophobicContact CH2-CE 4.24Å; W120-M124 HydrophobicContact CH2-CG 4.03Å; W120-M124 HydrophobicContact CZ2-CE 4.2Å; W120-M124 HydrophobicContact CZ2-CG 3.77Å; W120-M124 HydrophobicContact CZ2-SD 4.06Å; W120-M124 HydrophobicContact CZ3-CG 4.24Å; W120-M124 WeakPolarHBondContact O-CB 3.45Å; W120-M124 WeakPolarHBondContact O-CG 3.21Å; W120-M124 PolarHBondContact O-N 2.86Å; C121-M124 PolarHBondContact O-N 3.44Å; I122-M124 VanDerWaalsContact C-N 3.34Å; I122-M124 PolarHBondContact O-N 2.82Å; M124-Y127 PolarHBondContact O-N 3.13Å; M124-Q128 WeakPolarHBondContact O-CB 3.31Å; M124-Q128 WeakPolarHBondContact O-CG 3.34Å; M124-Q128 PolarHBondContact O-N 2.96Å; M124-Y166 HydrophobicContact CE-CD1 4.1Å; M124-Y166 HydrophobicContact CE-CD2 4.26Å; M124-Y166 HydrophobicContact CE-CG 3.71Å; M124-L170 HydrophobicContact CB-CD1 3.72Å
125	I	94.5	Very high	91.9	Very high	83 Å²	83	46.7 Å²	46.7	43%	0.426	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-48.9	176.2	-68.1	165.3	0	0	0	110.9	C121 I122 I123 Y127 Q128 I129 L170	C121-I125 WeakPolarHBondContact O-CG1 3.24Å; C121-I125 PolarHBondContact O-N 3.47Å; I122-I125 PolarHBondContact O-N 3.49Å; I123-I125 VanDerWaalsContact C-N 3.34Å; I123-I125 PolarHBondContact O-N 3.32Å; I125-Y127 VanDerWaalsContact C-N 3.33Å; I125-Y127 PolarHBondContact O-N 2.85Å; I125-Q128 PolarHBondContact O-N 2.81Å; I125-I129 HydrophobicContact CG2-CD1 4.24Å; I125-I129 WeakPolarHBondContact O-CG1 3.34Å; I125-I129 PolarHBondContact O-N 3.04Å; I125-I129 VanDerWaalsContact O-N 3.13Å; I125-L170 HydrophobicContact CD1-CD1 4.33Å; I125-L170 HydrophobicContact CD1-CD2 4.27Å; I125-L170 HydrophobicContact CG1-CD1 3.81Å; I125-L170 HydrophobicContact CG1-CD2 3.65Å; I125-L170 HydrophobicContact CG1-CG 4.38Å
126	L	94.8	Very high	91.8	Very high	106 Å²	106	47 Å²	47	56%	0.555	26%	0.257	S	S	*	.	H	α-helix	trans	-61.8	-42.3	179.2	-67.9	175.1	0	0	0	111.6	I122 I123 Q128 I129 A130	I122-L126 HydrophobicContact CG2-CD1 4.14Å; I122-L126 WeakPolarHBondContact O-CG 3.33Å; I122-L126 PolarHBondContact O-N 3.02Å; I123-L126 PolarHBondContact O-N 2.93Å; L126-Q128 VanDerWaalsContact C-N 3.3Å; L126-Q128 PolarHBondContact O-N 3.45Å; L126-I129 PolarHBondContact O-N 3.3Å; L126-A130 WeakPolarHBondContact O-CB 3.45Å; L126-A130 PolarHBondContact O-N 2.81Å
127	Y	94.5	Very high	91.6	Very high	6 Å²	6	46.6 Å²	46.6	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-41.9	175.2	178.5	-84.1	0	0	0	111.2	M84 A87 N88 L91 I123 M124 I125 I129 A130 N131 Y166	M84-Y127 HydrophobicContact CE-CE2 4.38Å; A87-Y127 HydrophobicContact CB-CD2 4.03Å; A87-Y127 HydrophobicContact CB-CE2 4.22Å; N88-Y127 PolarHBondContact OD1-OH 3.24Å; L91-Y127 HydrophobicContact CB-CD2 4.09Å; L91-Y127 HydrophobicContact CD2-CD1 3.92Å; L91-Y127 HydrophobicContact CD2-CD2 3.71Å; L91-Y127 HydrophobicContact CD2-CE1 4.12Å; L91-Y127 HydrophobicContact CD2-CE2 3.88Å; L91-Y127 HydrophobicContact CD2-CG 3.74Å; L91-Y127 HydrophobicContact CG-CD2 4.49Å; I123-Y127 WeakPolarHBondContact O-CB 3.39Å; I123-Y127 PolarHBondContact O-N 3.46Å; M124-Y127 PolarHBondContact O-N 3.13Å; I125-Y127 VanDerWaalsContact C-N 3.33Å; I125-Y127 PolarHBondContact O-N 2.85Å; Y127-I129 PolarHBondContact O-N 3.49Å; Y127-A130 WeakPolarHBondContact O-CB 3.43Å; Y127-A130 PolarHBondContact O-N 3.11Å; Y127-N131 HydrophobicContact CD1-CB 4.29Å; Y127-N131 HydrophobicContact CE1-CB 3.9Å; Y127-N131 WeakPolarHBondContact O-CB 3.19Å; Y127-N131 PolarHBondContact O-N 2.68Å; Y127-Y166 HydrophobicContact CD1-CD2 4.02Å; Y127-Y166 HydrophobicContact CD1-CE2 4.08Å; Y127-Y166 AromaticContact CE1-CD2 3.77Å; Y127-Y166 HydrophobicContact CE1-CD2 3.77Å; Y127-Y166 AromaticContact CE1-CE2 3.51Å; Y127-Y166 HydrophobicContact CE1-CE2 3.51Å
128	Q	92.5	Very high	91.1	Very high	14 Å²	14	47.4 Å²	47.4	7%	0.065	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-37.9	179.8	-70.9	-76.5	74.4	0	0	112.5	M124 I125 L126 L132 Y163 Y166	M124-Q128 WeakPolarHBondContact O-CB 3.31Å; M124-Q128 WeakPolarHBondContact O-CG 3.34Å; M124-Q128 PolarHBondContact O-N 2.96Å; I125-Q128 PolarHBondContact O-N 2.81Å; L126-Q128 VanDerWaalsContact C-N 3.3Å; L126-Q128 PolarHBondContact O-N 3.45Å; Q128-L132 VanDerWaalsContact O-CB 3.27Å; Q128-L132 WeakPolarHBondContact O-CB 3.37Å; Q128-L132 PolarHBondContact O-N 3.47Å; Q128-Y163 HydrophobicContact CB-CD2 4.47Å; Q128-Y163 HydrophobicContact CB-CE2 4.06Å; Q128-Y163 PolarHBondContact NE2-O 2.93Å; Q128-Y163 VanDerWaalsContact OE1-CD2 3.28Å; Q128-Y166 VanDerWaalsContact NE2-CB 3.3Å
129	I	93.5	Very high	90.5	Very high	112 Å²	112	48 Å²	48	57%	0.574	26%	0.264	S	S	*	.	H	α-helix	trans	-64.2	-46.7	173.9	-63.9	167.5	0	0	0	110.3	I125 L126 Y127 L132 G133	I125-I129 HydrophobicContact CG2-CD1 4.24Å; I125-I129 WeakPolarHBondContact O-CG1 3.34Å; I125-I129 PolarHBondContact O-N 3.04Å; I125-I129 VanDerWaalsContact O-N 3.13Å; L126-I129 PolarHBondContact O-N 3.3Å; Y127-I129 PolarHBondContact O-N 3.49Å; I129-L132 PolarHBondContact O-N 2.87Å; I129-G133 PolarHBondContact O-N 2.97Å
130	A	91.9	Very high	90	Very high	16 Å²	16	50.4 Å²	50.4	13%	0.132	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-50	175.6	0	0	0	0	0	112	F83 L126 Y127 L132 G133 V134	F83-A130 HydrophobicContact CD1-CB 4.48Å; F83-A130 HydrophobicContact CE1-CB 3.42Å; F83-A130 VanDerWaalsContact CE1-CB 3.42Å; F83-A130 HydrophobicContact CZ-CB 3.89Å; L126-A130 WeakPolarHBondContact O-CB 3.45Å; L126-A130 PolarHBondContact O-N 2.81Å; Y127-A130 WeakPolarHBondContact O-CB 3.43Å; Y127-A130 PolarHBondContact O-N 3.11Å; A130-L132 PolarHBondContact O-N 3.24Å; A130-G133 PolarHBondContact O-N 3.18Å; A130-V134 WeakPolarHBondContact O-CG2 3.39Å; A130-V134 PolarHBondContact O-N 3.43Å
131	N	89.8	Confident	89.1	Confident	8 Å²	8	53.6 Å²	53.6	4%	0.043	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-41.8	-179.5	-170.6	43.4	0	0	0	111.5	M84 Y127 G135	M84-N131 HydrophobicContact CE-CB 4.4Å; Y127-N131 HydrophobicContact CD1-CB 4.29Å; Y127-N131 HydrophobicContact CE1-CB 3.9Å; Y127-N131 WeakPolarHBondContact O-CB 3.19Å; Y127-N131 PolarHBondContact O-N 2.68Å; N131-G135 WeakPolarHBondContact O-CA 3.21Å; N131-G135 PolarHBondContact O-N 3.24Å
132	L	90.4	Very high	87.8	Confident	89 Å²	89	55 Å²	55	47%	0.466	30%	0.295	S	S	.	.	H	α-helix	trans	-64.6	-46.6	175.3	-173.3	72.1	0	0	0	111.4	Q128 I129 A130 G135 V136 Y163	Q128-L132 VanDerWaalsContact O-CB 3.27Å; Q128-L132 WeakPolarHBondContact O-CB 3.37Å; Q128-L132 PolarHBondContact O-N 3.47Å; I129-L132 PolarHBondContact O-N 2.87Å; A130-L132 PolarHBondContact O-N 3.24Å; L132-G135 PolarHBondContact O-N 3.04Å; L132-V136 VanDerWaalsContact O-CG2 3.31Å; L132-V136 WeakPolarHBondContact O-CG2 3.28Å; L132-V136 PolarHBondContact O-N 2.99Å; L132-Y163 HydrophobicContact CB-CE2 4.3Å; L132-Y163 HydrophobicContact CD1-CE2 4.44Å
133	G	90.2	Very high	86.4	Confident	45 Å²	45	54.7 Å²	54.7	46%	0.464	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-46.9	179.8	0	0	0	0	0	112.7	I129 A130 Y137	I129-G133 PolarHBondContact O-N 2.97Å; A130-G133 PolarHBondContact O-N 3.18Å; G133-Y137 WeakPolarHBondContact O-CB 3.35Å; G133-Y137 PolarHBondContact O-N 3.29Å
134	V	88.7	Confident	85	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.127	33%	0.332	C	S	.	.	H	α-helix	trans	-68	-39.5	176.5	174.8	0	0	0	0	111.4	C80 F83 M84 A130 Y137 T138	C80-V134 HydrophobicContact CB-CG1 3.82Å; C80-V134 HydrophobicContact CB-CG2 4.4Å; F83-V134 HydrophobicContact CD1-CG2 4.08Å; M84-V134 HydrophobicContact CG-CB 4.12Å; M84-V134 HydrophobicContact CG-CG1 3.8Å; M84-V134 HydrophobicContact CG-CG2 3.95Å; M84-V134 HydrophobicContact SD-CB 4.17Å; M84-V134 HydrophobicContact SD-CG1 4.45Å; M84-V134 HydrophobicContact SD-CG2 4.03Å; A130-V134 WeakPolarHBondContact O-CG2 3.39Å; A130-V134 PolarHBondContact O-N 3.43Å; V134-Y137 PolarHBondContact O-N 3.47Å; V134-T138 HydrophobicContact CG1-CG2 4.13Å; V134-T138 WeakPolarHBondContact O-CB 3.4Å; V134-T138 WeakPolarHBondContact O-CG2 3.49Å; V134-T138 PolarHBondContact O-N 3.49Å; V134-T138 PolarHBondContact O-OG1 2.9Å
135	G	85.2	Confident	83.5	Confident	21 Å²	21	59 Å²	59	22%	0.216	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-45.6	176.1	0	0	0	0	0	112.6	N131 L132 T138 Y139	N131-G135 WeakPolarHBondContact O-CA 3.21Å; N131-G135 PolarHBondContact O-N 3.24Å; L132-G135 PolarHBondContact O-N 3.04Å; G135-T138 PolarHBondContact O-OG1 3.38Å; G135-T138 VanDerWaalsContact O-OG1 3.04Å; G135-Y139 WeakPolarHBondContact O-CB 3.46Å; G135-Y139 PolarHBondContact O-N 3.14Å
136	V	86.6	Confident	81.8	Confident	87 Å²	87	58.3 Å²	58.3	53%	0.527	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-39.9	176.1	173.2	0	0	0	0	111.3	L132 Y139 S140	L132-V136 VanDerWaalsContact O-CG2 3.31Å; L132-V136 WeakPolarHBondContact O-CG2 3.28Å; L132-V136 PolarHBondContact O-N 2.99Å; V136-Y139 PolarHBondContact O-N 3.46Å; V136-S140 WeakPolarHBondContact O-CB 3.49Å; V136-S140 PolarHBondContact O-N 3.48Å; V136-S140 PolarHBondContact O-OG 3.39Å
137	Y	86.2	Confident	80.1	Confident	74 Å²	74	54.6 Å²	54.6	29%	0.29	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-54.6	178.6	178	-98.3	0	0	0	111.3	G76 C80 G133 V134 Y139 S140 W141	G76-Y137 WeakPolarHBondContact CA-OH 3.23Å; C80-Y137 WeakPolarHBondContact SG-CD1 3.34Å; G133-Y137 WeakPolarHBondContact O-CB 3.35Å; G133-Y137 PolarHBondContact O-N 3.29Å; V134-Y137 PolarHBondContact O-N 3.47Å; Y137-Y139 PolarHBondContact O-N 3.38Å; Y137-S140 PolarHBondContact O-N 2.85Å; Y137-S140 VanDerWaalsContact O-N 3.16Å; Y137-W141 AromaticContact CD2-NE1 3.96Å; Y137-W141 AromaticContact CE2-NE1 3.42Å; Y137-W141 AromaticContact CZ-CD1 3.97Å; Y137-W141 AromaticContact CZ-NE1 3.6Å
138	T	80.9	Confident	78.7	Confident	17 Å²	17	55.9 Å²	55.9	10%	0.104	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-38.2	177.7	51.3	0	0	0	0	111	F77 V134 G135 W141	F77-T138 HydrophobicContact CD1-CG2 4.33Å; F77-T138 HydrophobicContact CE1-CG2 4.12Å; V134-T138 HydrophobicContact CG1-CG2 4.13Å; V134-T138 WeakPolarHBondContact O-CB 3.4Å; V134-T138 WeakPolarHBondContact O-CG2 3.49Å; V134-T138 PolarHBondContact O-N 3.49Å; V134-T138 PolarHBondContact O-OG1 2.9Å; G135-T138 PolarHBondContact O-OG1 3.38Å; G135-T138 VanDerWaalsContact O-OG1 3.04Å; T138-W141 PolarHBondContact O-N 3.33Å
139	Y	78	Confident	77.5	Confident	147 Å²	147	56.5 Å²	56.5	58%	0.576	33%	0.333	S	S	*	.	H	α-helix	trans	-67.8	-37.1	178.1	-168.1	-77.8	0	0	0	113.8	G135 V136 Y137 W141 Y142 V156	G135-Y139 WeakPolarHBondContact O-CB 3.46Å; G135-Y139 PolarHBondContact O-N 3.14Å; V136-Y139 PolarHBondContact O-N 3.46Å; Y137-Y139 PolarHBondContact O-N 3.38Å; Y139-W141 PolarHBondContact O-N 3.46Å; Y139-Y142 VanDerWaalsContact CA-CE2 3.42Å; Y139-Y142 AromaticContact CD1-CD2 4Å; Y139-Y142 HydrophobicContact CD1-CD2 4Å; Y139-Y142 HydrophobicContact CD1-CE2 4.49Å; Y139-Y142 AromaticContact CD2-CD2 3.27Å; Y139-Y142 HydrophobicContact CD2-CD2 3.27Å; Y139-Y142 AromaticContact CD2-CE2 3.02Å; Y139-Y142 HydrophobicContact CD2-CE2 3.02Å; Y139-Y142 HydrophobicContact CE1-CD2 4.35Å; Y139-Y142 AromaticContact CE2-CD2 3.64Å; Y139-Y142 HydrophobicContact CE2-CD2 3.64Å; Y139-Y142 AromaticContact CE2-CE2 3.62Å; Y139-Y142 HydrophobicContact CE2-CE2 3.62Å; Y139-Y142 AromaticContact CG-CD2 3.41Å; Y139-Y142 HydrophobicContact CG-CD2 3.41Å; Y139-Y142 VanDerWaalsContact CG-CD2 3.41Å; Y139-Y142 AromaticContact CG-CE2 3.5Å; Y139-Y142 HydrophobicContact CG-CE2 3.5Å; Y139-Y142 WeakPolarHBondContact O-CD2 3.43Å; Y139-Y142 PolarHBondContact O-N 2.93Å; Y139-Y142 VanDerWaalsContact O-N 3.1Å; Y139-V156 HydrophobicContact CD2-CG1 4.34Å
140	S	82.1	Confident	76.7	Confident	85 Å²	85	55.4 Å²	55.4	59%	0.594	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-18.9	179.5	-60.4	0	0	0	0	113.4	V136 Y137	V136-S140 WeakPolarHBondContact O-CB 3.49Å; V136-S140 PolarHBondContact O-N 3.48Å; V136-S140 PolarHBondContact O-OG 3.39Å; Y137-S140 PolarHBondContact O-N 2.85Å; Y137-S140 VanDerWaalsContact O-N 3.16Å
141	W	75.1	Confident	75.8	Confident	67 Å²	67	57.2 Å²	57.2	25%	0.254	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	8.4	-178.7	-61.7	104.4	0	0	0	114.4	F73 F77 Y137 T138 Y139 G143 L144 A145	F73-W141 AromaticContact CD1-CH2 3.8Å; F73-W141 HydrophobicContact CD1-CH2 3.8Å; F73-W141 HydrophobicContact CD1-CZ2 4.14Å; F73-W141 HydrophobicContact CD1-CZ3 4.06Å; F73-W141 HydrophobicContact CD2-CE3 4.24Å; F73-W141 HydrophobicContact CD2-CH2 4.47Å; F73-W141 AromaticContact CD2-CZ3 3.92Å; F73-W141 HydrophobicContact CD2-CZ3 3.92Å; F73-W141 AromaticContact CE1-CH2 3.4Å; F73-W141 HydrophobicContact CE1-CH2 3.4Å; F73-W141 HydrophobicContact CE1-CZ2 4.09Å; F73-W141 AromaticContact CE1-CZ3 3.78Å; F73-W141 HydrophobicContact CE1-CZ3 3.78Å; F73-W141 HydrophobicContact CE2-CE3 4.34Å; F73-W141 HydrophobicContact CE2-CH2 4.13Å; F73-W141 AromaticContact CE2-CZ3 3.62Å; F73-W141 HydrophobicContact CE2-CZ3 3.62Å; F73-W141 HydrophobicContact CG-CE3 4.38Å; F73-W141 HydrophobicContact CG-CH2 4.33Å; F73-W141 HydrophobicContact CG-CZ3 4.13Å; F73-W141 AromaticContact CZ-CH2 3.58Å; F73-W141 HydrophobicContact CZ-CH2 3.58Å; F73-W141 AromaticContact CZ-CZ3 3.55Å; F73-W141 HydrophobicContact CZ-CZ3 3.55Å; F77-W141 HydrophobicContact CE2-CB 4.13Å; F77-W141 HydrophobicContact CE2-CG 4.39Å; F77-W141 HydrophobicContact CZ-CB 3.8Å; F77-W141 HydrophobicContact CZ-CG 4.39Å; Y137-W141 AromaticContact CD2-NE1 3.96Å; Y137-W141 AromaticContact CE2-NE1 3.42Å; Y137-W141 AromaticContact CZ-CD1 3.97Å; Y137-W141 AromaticContact CZ-NE1 3.6Å; T138-W141 PolarHBondContact O-N 3.33Å; Y139-W141 PolarHBondContact O-N 3.46Å; W141-G143 VanDerWaalsContact C-N 3.34Å; W141-G143 PolarHBondContact O-N 3.49Å; W141-L144 HydrophobicContact CE3-CD1 3.61Å; W141-L144 HydrophobicContact CZ3-CD1 3.72Å; W141-L144 PolarHBondContact O-N 3.34Å; W141-L144 VanDerWaalsContact O-N 3.16Å; W141-A145 PolarHBondContact O-N 3.13Å
142	Y	66.8	Low	75.1	Confident	39 Å²	39	57.8 Å²	57.8	15%	0.153	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-51.3	-46.4	-179.2	-98.7	-75.8	0	0	0	114	Y139 L144 A145 L152 I153 V156	Y139-Y142 VanDerWaalsContact CA-CE2 3.42Å; Y139-Y142 AromaticContact CD1-CD2 4Å; Y139-Y142 HydrophobicContact CD1-CD2 4Å; Y139-Y142 HydrophobicContact CD1-CE2 4.49Å; Y139-Y142 AromaticContact CD2-CD2 3.27Å; Y139-Y142 HydrophobicContact CD2-CD2 3.27Å; Y139-Y142 AromaticContact CD2-CE2 3.02Å; Y139-Y142 HydrophobicContact CD2-CE2 3.02Å; Y139-Y142 HydrophobicContact CE1-CD2 4.35Å; Y139-Y142 AromaticContact CE2-CD2 3.64Å; Y139-Y142 HydrophobicContact CE2-CD2 3.64Å; Y139-Y142 AromaticContact CE2-CE2 3.62Å; Y139-Y142 HydrophobicContact CE2-CE2 3.62Å; Y139-Y142 AromaticContact CG-CD2 3.41Å; Y139-Y142 HydrophobicContact CG-CD2 3.41Å; Y139-Y142 VanDerWaalsContact CG-CD2 3.41Å; Y139-Y142 AromaticContact CG-CE2 3.5Å; Y139-Y142 HydrophobicContact CG-CE2 3.5Å; Y139-Y142 WeakPolarHBondContact O-CD2 3.43Å; Y139-Y142 PolarHBondContact O-N 2.93Å; Y139-Y142 VanDerWaalsContact O-N 3.1Å; Y142-L144 PolarHBondContact O-N 3.02Å; Y142-L144 VanDerWaalsContact O-N 3.15Å; Y142-A145 PolarHBondContact O-N 3.23Å; Y142-L152 HydrophobicContact CD1-CD2 3.41Å; Y142-L152 VanDerWaalsContact CD1-CD2 3.41Å; Y142-L152 HydrophobicContact CD1-CG 4.04Å; Y142-L152 HydrophobicContact CD2-CD2 4.38Å; Y142-L152 HydrophobicContact CE1-CB 3.76Å; Y142-L152 HydrophobicContact CE1-CD2 3.29Å; Y142-L152 HydrophobicContact CE1-CG 3.35Å; Y142-L152 HydrophobicContact CE2-CD2 4.18Å; Y142-L152 HydrophobicContact CE2-CG 4.25Å; Y142-L152 HydrophobicContact CG-CD2 3.98Å; Y142-L152 VanDerWaalsContact CZ-CG 3.47Å; Y142-L152 PolarHBondContact OH-O 2.93Å; Y142-I153 HydrophobicContact CE1-CG1 3.96Å; Y142-V156 HydrophobicContact CE2-CG2 4.08Å; Y142-V156 WeakPolarHBondContact OH-CB 3.48Å; Y142-V156 WeakPolarHBondContact OH-CG2 3.39Å
143	G	65	Low	74.7	Confident	74 Å²	74	57.6 Å²	57.6	76%	0.763	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24.6	-175.3	0	0	0	0	0	114	W141	W141-G143 VanDerWaalsContact C-N 3.34Å; W141-G143 PolarHBondContact O-N 3.49Å
144	L	64	Low	74.3	Confident	117 Å²	117	61 Å²	61	61%	0.613	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-93.6	-11.7	179	-66.1	173.7	0	0	0	113	F73 W141 Y142	F73-L144 HydrophobicContact CE2-CD1 4.41Å; W141-L144 HydrophobicContact CE3-CD1 3.61Å; W141-L144 HydrophobicContact CZ3-CD1 3.72Å; W141-L144 PolarHBondContact O-N 3.34Å; W141-L144 VanDerWaalsContact O-N 3.16Å; Y142-L144 PolarHBondContact O-N 3.02Å; Y142-L144 VanDerWaalsContact O-N 3.15Å
145	A	62.2	Low	73.9	Confident	10 Å²	10	60.4 Å²	60.4	8%	0.083	34%	0.338	C	S	.	.			trans	-111.8	28.1	-175.3	0	0	0	0	0	113.2	W141 Y142 W147 R148 A149 L152	W141-A145 PolarHBondContact O-N 3.13Å; Y142-A145 PolarHBondContact O-N 3.23Å; A145-W147 PolarHBondContact O-N 3.37Å; A145-R148 PolarHBondContact O-N 2.9Å; A145-A149 PolarHBondContact O-N 3.19Å; A145-L152 HydrophobicContact CB-CD2 4.34Å
146	A	58.3	Low	73.7	Confident	69 Å²	69	60.1 Å²	60.1	57%	0.57	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-54.2	-29	-173.5	0	0	0	0	0	114.9	R148 A149	A146-R148 VanDerWaalsContact C-N 3.3Å; A146-R148 PolarHBondContact O-N 3.06Å; A146-A149 WeakPolarHBondContact O-CB 3.33Å; A146-A149 PolarHBondContact O-N 3.39Å; A146-A149 VanDerWaalsContact O-N 3.11Å
147	W	59.2	Low	73.6	Confident	29 Å²	29	61.8 Å²	61.8	11%	0.11	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-69.4	-22.4	177.3	64.1	-81.9	0	0	0	113.6	Q64 F65 T67 W69 A145	Q64-W147 HydrophobicContact CB-CE3 3.93Å; Q64-W147 HydrophobicContact CB-CZ3 4.46Å; Q64-W147 HydrophobicContact CG-CE3 3.64Å; Q64-W147 HydrophobicContact CG-CZ3 3.98Å; Q64-W147 VanDerWaalsContact OE1-CZ3 3.24Å; F65-W147 HydrophobicContact CB-CB 4.11Å; T67-W147 HydrophobicContact CG2-CD2 3.49Å; T67-W147 VanDerWaalsContact CG2-CD2 3.49Å; T67-W147 HydrophobicContact CG2-CE3 3.25Å; T67-W147 HydrophobicContact CG2-CG 4.25Å; T67-W147 HydrophobicContact CG2-CH2 3.59Å; T67-W147 HydrophobicContact CG2-CZ2 3.97Å; T67-W147 HydrophobicContact CG2-CZ3 3.24Å; W69-W147 AromaticContact CD1-CE2 3.39Å; W69-W147 AromaticContact CD1-CH2 3.93Å; W69-W147 AromaticContact CD1-CZ2 3.29Å; W69-W147 AromaticContact CD1-NE1 3.4Å; W69-W147 HydrophobicContact CD2-CH2 4.47Å; W69-W147 AromaticContact CD2-CZ2 3.67Å; W69-W147 HydrophobicContact CD2-CZ2 3.67Å; W69-W147 AromaticContact CE2-CE2 3.96Å; W69-W147 AromaticContact CE2-CH2 3.45Å; W69-W147 VanDerWaalsContact CE2-CH2 3.45Å; W69-W147 AromaticContact CE2-CZ2 3.04Å; W69-W147 AromaticContact CG-CE2 3.96Å; W69-W147 AromaticContact CG-CZ2 3.82Å; W69-W147 HydrophobicContact CG-CZ2 3.82Å; W69-W147 AromaticContact CG-NE1 3.67Å; W69-W147 HydrophobicContact CH2-CH2 4.44Å; W69-W147 HydrophobicContact CH2-CZ2 4.1Å; W69-W147 AromaticContact CZ2-CH2 3.46Å; W69-W147 HydrophobicContact CZ2-CH2 3.46Å; W69-W147 VanDerWaalsContact CZ2-CH2 3.46Å; W69-W147 AromaticContact CZ2-CZ2 3.34Å; W69-W147 HydrophobicContact CZ2-CZ2 3.34Å; W69-W147 AromaticContact NE1-CE2 3.49Å; W69-W147 AromaticContact NE1-CH2 3.13Å; W69-W147 AromaticContact NE1-CZ2 2.87Å; W69-W147 AromaticContact NE1-NE1 3.98Å; A145-W147 PolarHBondContact O-N 3.37Å
148	R	65.2	Low	73.7	Confident	33 Å²	33	60.4 Å²	60.4	13%	0.125	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-99.7	5.9	170.1	-90.4	-177.4	-176.2	-176.7	9.1	112.7	D50 T53 A145 A146 P150 Y151 L152	D50-R148 IonicContact OD1-NH1 3.4Å; T53-R148 PolarHBondContact OG1-NH2 3.03Å; T53-R148 VanDerWaalsContact OG1-NH2 3.09Å; A145-R148 PolarHBondContact O-N 2.9Å; A146-R148 VanDerWaalsContact C-N 3.3Å; A146-R148 PolarHBondContact O-N 3.06Å; R148-P150 VanDerWaalsContact C-CD 3.47Å; R148-Y151 PolarHBondContact O-N 3.39Å; R148-L152 WeakPolarHBondContact O-CB 3.21Å; R148-L152 PolarHBondContact O-N 3.48Å
149	A	68.2	Low	73.8	Confident	26 Å²	26	61.1 Å²	61.1	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-47.7	-49.1	-172.8	0	0	0	0	0	114.6	A145 A146 Y151 L152 I153	A145-A149 PolarHBondContact O-N 3.19Å; A146-A149 WeakPolarHBondContact O-CB 3.33Å; A146-A149 PolarHBondContact O-N 3.39Å; A146-A149 VanDerWaalsContact O-N 3.11Å; A149-Y151 PolarHBondContact O-N 2.89Å; A149-L152 PolarHBondContact O-N 2.93Å; A149-I153 HydrophobicContact CB-CD1 4.34Å; A149-I153 VanDerWaalsContact O-CB 3.29Å; A149-I153 WeakPolarHBondContact O-CB 3.46Å; A149-I153 WeakPolarHBondContact O-CD1 3.5Å; A149-I153 WeakPolarHBondContact O-CG1 3.3Å; A149-I153 PolarHBondContact O-N 3.46Å
150	P	76	Confident	74.3	Confident	89 Å²	89	59 Å²	59	58%	0.578	33%	0.329	S	S	*	.	H	α-helix	trans	-63.5	-43.6	-176.7	23.4	-33.3	0	0	0	112.5	R148 F154	R148-P150 VanDerWaalsContact C-CD 3.47Å; P150-F154 WeakPolarHBondContact O-CB 3.23Å; P150-F154 PolarHBondContact O-N 3.35Å
151	Y	74.2	Confident	74.6	Confident	54 Å²	54	59 Å²	59	21%	0.212	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-45.1	176.8	175.7	-97.6	0	0	0	111.4	F46 D50 R148 A149 F154 S155	F46-Y151 HydrophobicContact CD1-CE2 4.05Å; F46-Y151 HydrophobicContact CE1-CE2 4.47Å; F46-Y151 PolarHBondContact O-OH 3.1Å; D50-Y151 VanDerWaalsContact CG-OH 3.3Å; D50-Y151 WeakPolarHBondContact OD1-CE1 3.36Å; D50-Y151 VanDerWaalsContact OD2-CE1 3.27Å; D50-Y151 WeakPolarHBondContact OD2-CE1 3.39Å; D50-Y151 PolarHBondContact OD2-OH 3.49Å; R148-Y151 PolarHBondContact O-N 3.39Å; A149-Y151 PolarHBondContact O-N 2.89Å; Y151-F154 PolarHBondContact O-N 3.36Å; Y151-S155 VanDerWaalsContact O-CB 3.24Å; Y151-S155 WeakPolarHBondContact O-CB 3.44Å; Y151-S155 PolarHBondContact O-N 2.87Å
152	L	75.2	Confident	75.4	Confident	21 Å²	21	55.9 Å²	55.9	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-44.6	-178.6	-166.9	65.5	0	0	0	111.1	Y142 A145 R148 A149 S155 V156	Y142-L152 HydrophobicContact CD1-CD2 3.41Å; Y142-L152 VanDerWaalsContact CD1-CD2 3.41Å; Y142-L152 HydrophobicContact CD1-CG 4.04Å; Y142-L152 HydrophobicContact CD2-CD2 4.38Å; Y142-L152 HydrophobicContact CE1-CB 3.76Å; Y142-L152 HydrophobicContact CE1-CD2 3.29Å; Y142-L152 HydrophobicContact CE1-CG 3.35Å; Y142-L152 HydrophobicContact CE2-CD2 4.18Å; Y142-L152 HydrophobicContact CE2-CG 4.25Å; Y142-L152 HydrophobicContact CG-CD2 3.98Å; Y142-L152 VanDerWaalsContact CZ-CG 3.47Å; Y142-L152 PolarHBondContact OH-O 2.93Å; A145-L152 HydrophobicContact CB-CD2 4.34Å; R148-L152 WeakPolarHBondContact O-CB 3.21Å; R148-L152 PolarHBondContact O-N 3.48Å; A149-L152 PolarHBondContact O-N 2.93Å; L152-S155 PolarHBondContact O-N 3.48Å; L152-V156 WeakPolarHBondContact O-CG2 3.15Å; L152-V156 PolarHBondContact O-N 3.44Å
153	I	80.8	Confident	76.5	Confident	84 Å²	84	57.8 Å²	57.8	43%	0.431	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-49.8	175.2	-69.2	164.2	0	0	0	110.2	Y142 A149 S155 V156 M157	Y142-I153 HydrophobicContact CE1-CG1 3.96Å; A149-I153 HydrophobicContact CB-CD1 4.34Å; A149-I153 VanDerWaalsContact O-CB 3.29Å; A149-I153 WeakPolarHBondContact O-CB 3.46Å; A149-I153 WeakPolarHBondContact O-CD1 3.5Å; A149-I153 WeakPolarHBondContact O-CG1 3.3Å; A149-I153 PolarHBondContact O-N 3.46Å; I153-S155 PolarHBondContact O-N 3.08Å; I153-V156 PolarHBondContact O-N 3.17Å; I153-M157 HydrophobicContact CG2-CG 4.29Å; I153-M157 HydrophobicContact CG2-SD 3.94Å; I153-M157 WeakPolarHBondContact O-CB 3.39Å; I153-M157 VanDerWaalsContact O-CG 3.27Å; I153-M157 WeakPolarHBondContact O-CG 3.12Å; I153-M157 PolarHBondContact O-N 3.28Å
154	F	82	Confident	77.7	Confident	118 Å²	118	58.9 Å²	58.9	52%	0.518	31%	0.313	S	S	.	.	H	α-helix	trans	-59.5	-47.3	179	178.2	-93.6	0	0	0	111.7	F46 P150 Y151 V156 M157 Y158	F46-F154 HydrophobicContact CE1-CE1 4.23Å; F46-F154 HydrophobicContact CE2-CE1 4.17Å; F46-F154 HydrophobicContact CZ-CD1 4.4Å; F46-F154 AromaticContact CZ-CE1 3.61Å; F46-F154 HydrophobicContact CZ-CE1 3.61Å; P150-F154 WeakPolarHBondContact O-CB 3.23Å; P150-F154 PolarHBondContact O-N 3.35Å; Y151-F154 PolarHBondContact O-N 3.36Å; F154-V156 PolarHBondContact O-N 3.22Å; F154-M157 PolarHBondContact O-N 3.42Å; F154-Y158 WeakPolarHBondContact O-CB 3.48Å; F154-Y158 PolarHBondContact O-N 2.85Å
155	S	80.3	Confident	79	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.049	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-46.7	179.1	-174.3	0	0	0	0	111.5	Y151 L152 I153 Y158 F159	Y151-S155 VanDerWaalsContact O-CB 3.24Å; Y151-S155 WeakPolarHBondContact O-CB 3.44Å; Y151-S155 PolarHBondContact O-N 2.87Å; L152-S155 PolarHBondContact O-N 3.48Å; I153-S155 PolarHBondContact O-N 3.08Å; S155-Y158 WeakPolarHBondContact O-CB 3.27Å; S155-Y158 PolarHBondContact O-N 2.95Å; S155-F159 WeakPolarHBondContact O-CD2 3.28Å; S155-F159 WeakPolarHBondContact O-CG 3.17Å; S155-F159 PolarHBondContact O-N 3.35Å; S155-F159 WeakPolarHBondContact OG-CE2 3.31Å
156	V	81	Confident	80.4	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-69.1	-40.2	177.8	170	0	0	0	0	112.8	Y139 Y142 L152 I153 F154 Y158 F159 I160	Y139-V156 HydrophobicContact CD2-CG1 4.34Å; Y142-V156 HydrophobicContact CE2-CG2 4.08Å; Y142-V156 WeakPolarHBondContact OH-CB 3.48Å; Y142-V156 WeakPolarHBondContact OH-CG2 3.39Å; L152-V156 WeakPolarHBondContact O-CG2 3.15Å; L152-V156 PolarHBondContact O-N 3.44Å; I153-V156 PolarHBondContact O-N 3.17Å; F154-V156 PolarHBondContact O-N 3.22Å; V156-Y158 VanDerWaalsContact C-N 3.29Å; V156-Y158 PolarHBondContact O-N 3.49Å; V156-F159 PolarHBondContact O-N 3.33Å; V156-I160 HydrophobicContact CG1-CD1 3.83Å; V156-I160 HydrophobicContact CG1-CG1 4.29Å; V156-I160 VanDerWaalsContact O-CG1 3.31Å; V156-I160 WeakPolarHBondContact O-CG1 3.32Å; V156-I160 PolarHBondContact O-N 2.91Å
157	M	85.6	Confident	82	Confident	123 Å²	123	55.9 Å²	55.9	61%	0.606	29%	0.289	S	S	*	.	H	α-helix	trans	-59.1	-44.5	174	-74.5	-175.2	78.5	0	0	110.9	I153 F154 F159 I160 V161	I153-M157 HydrophobicContact CG2-CG 4.29Å; I153-M157 HydrophobicContact CG2-SD 3.94Å; I153-M157 WeakPolarHBondContact O-CB 3.39Å; I153-M157 VanDerWaalsContact O-CG 3.27Å; I153-M157 WeakPolarHBondContact O-CG 3.12Å; I153-M157 PolarHBondContact O-N 3.28Å; F154-M157 PolarHBondContact O-N 3.42Å; M157-F159 PolarHBondContact O-N 2.97Å; M157-I160 PolarHBondContact O-N 3.3Å; M157-V161 WeakPolarHBondContact O-CG2 3.45Å; M157-V161 PolarHBondContact O-N 3.34Å
158	Y	86.9	Confident	83.5	Confident	45 Å²	45	56 Å²	56	18%	0.176	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-44.5	174.5	177.9	-100.7	0	0	0	111.9	S39 I42 S43 F46 F154 S155 V156 I160 V161 C162	S39-Y158 VanDerWaalsContact CA-OH 3.24Å; S39-Y158 WeakPolarHBondContact CA-OH 3.43Å; S39-Y158 WeakPolarHBondContact CB-OH 3.47Å; S39-Y158 PolarHBondContact O-OH 3.38Å; I42-Y158 WeakPolarHBondContact CB-OH 3.14Å; I42-Y158 HydrophobicContact CG2-CE1 4.13Å; I42-Y158 HydrophobicContact CG2-CE2 4.18Å; I42-Y158 WeakPolarHBondContact CG2-OH 3.25Å; S43-Y158 WeakPolarHBondContact OG-CE1 3.44Å; F46-Y158 HydrophobicContact CD2-CD1 4.46Å; F46-Y158 HydrophobicContact CD2-CE1 4.48Å; F46-Y158 HydrophobicContact CE2-CD1 4.43Å; F154-Y158 WeakPolarHBondContact O-CB 3.48Å; F154-Y158 PolarHBondContact O-N 2.85Å; S155-Y158 WeakPolarHBondContact O-CB 3.27Å; S155-Y158 PolarHBondContact O-N 2.95Å; V156-Y158 VanDerWaalsContact C-N 3.29Å; V156-Y158 PolarHBondContact O-N 3.49Å; Y158-I160 PolarHBondContact O-N 3.42Å; Y158-V161 PolarHBondContact O-N 3.38Å; Y158-C162 VanDerWaalsContact CZ-SG 3.5Å; Y158-C162 WeakPolarHBondContact O-CB 3.39Å; Y158-C162 PolarHBondContact O-N 3.38Å; Y158-C162 PolarHBondContact O-SG 3.05Å
159	F	84.6	Confident	84.7	Confident	32 Å²	32	56 Å²	56	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-37.1	177	-71.7	-51.1	0	0	0	113.6	S155 V156 M157 C162 Y163	S155-F159 WeakPolarHBondContact O-CD2 3.28Å; S155-F159 WeakPolarHBondContact O-CG 3.17Å; S155-F159 PolarHBondContact O-N 3.35Å; S155-F159 WeakPolarHBondContact OG-CE2 3.31Å; V156-F159 PolarHBondContact O-N 3.33Å; M157-F159 PolarHBondContact O-N 2.97Å; F159-C162 PolarHBondContact O-N 2.99Å; F159-Y163 WeakPolarHBondContact O-CB 3.08Å; F159-Y163 PolarHBondContact O-N 2.98Å
160	I	87.7	Confident	85.8	Confident	101 Å²	101	56.6 Å²	56.6	52%	0.518	30%	0.299	S	S	.	.	H	α-helix	trans	-64.5	-46.3	175.4	-69.5	166.7	0	0	0	110.3	V156 M157 Y158 C162 Y163 V164	V156-I160 HydrophobicContact CG1-CD1 3.83Å; V156-I160 HydrophobicContact CG1-CG1 4.29Å; V156-I160 VanDerWaalsContact O-CG1 3.31Å; V156-I160 WeakPolarHBondContact O-CG1 3.32Å; V156-I160 PolarHBondContact O-N 2.91Å; M157-I160 PolarHBondContact O-N 3.3Å; Y158-I160 PolarHBondContact O-N 3.42Å; I160-C162 VanDerWaalsContact C-N 3.35Å; I160-C162 PolarHBondContact O-N 3.48Å; I160-Y163 WeakPolarHBondContact O-CB 3.45Å; I160-Y163 PolarHBondContact O-N 3.03Å; I160-V164 WeakPolarHBondContact O-CG2 3.49Å; I160-V164 PolarHBondContact O-N 3.24Å
161	V	89.2	Confident	86.4	Confident	85 Å²	85	54.9 Å²	54.9	52%	0.515	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-46.9	176.7	172.5	0	0	0	0	110.4	M157 Y158 Y163 V164 L165	M157-V161 WeakPolarHBondContact O-CG2 3.45Å; M157-V161 PolarHBondContact O-N 3.34Å; Y158-V161 PolarHBondContact O-N 3.38Å; V161-Y163 VanDerWaalsContact C-N 3.32Å; V161-Y163 PolarHBondContact O-N 3.31Å; V161-V164 PolarHBondContact O-N 3.26Å; V161-L165 HydrophobicContact CG1-CD1 4.01Å; V161-L165 HydrophobicContact CG1-CG 4.48Å; V161-L165 WeakPolarHBondContact O-CG 3.47Å; V161-L165 PolarHBondContact O-N 3.16Å
162	C	90.2	Very high	87.1	Confident	3 Å²	3	53 Å²	53	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-42.3	175.8	-69.1	0	0	0	0	111.9	Y158 F159 I160 V164 L165 Y166	Y158-C162 VanDerWaalsContact CZ-SG 3.5Å; Y158-C162 WeakPolarHBondContact O-CB 3.39Å; Y158-C162 PolarHBondContact O-N 3.38Å; Y158-C162 PolarHBondContact O-SG 3.05Å; F159-C162 PolarHBondContact O-N 2.99Å; I160-C162 VanDerWaalsContact C-N 3.35Å; I160-C162 PolarHBondContact O-N 3.48Å; C162-V164 PolarHBondContact O-N 3.47Å; C162-L165 PolarHBondContact O-N 3.07Å; C162-Y166 HydrophobicContact CB-CE2 4.34Å; C162-Y166 VanDerWaalsContact O-CB 3.23Å; C162-Y166 WeakPolarHBondContact O-CB 3.42Å; C162-Y166 WeakPolarHBondContact O-CD1 3.38Å; C162-Y166 PolarHBondContact O-N 3.32Å
163	Y	90	Very high	87.7	Confident	78 Å²	78	52 Å²	52	31%	0.306	27%	0.274	S	S	.	.	H	α-helix	trans	-58.6	-48.7	178.6	179.7	-92.8	0	0	0	111.4	Q128 L132 F159 I160 V161 Y166 V167	Q128-Y163 HydrophobicContact CB-CD2 4.47Å; Q128-Y163 HydrophobicContact CB-CE2 4.06Å; Q128-Y163 PolarHBondContact NE2-O 2.93Å; Q128-Y163 VanDerWaalsContact OE1-CD2 3.28Å; L132-Y163 HydrophobicContact CB-CE2 4.3Å; L132-Y163 HydrophobicContact CD1-CE2 4.44Å; F159-Y163 WeakPolarHBondContact O-CB 3.08Å; F159-Y163 PolarHBondContact O-N 2.98Å; I160-Y163 WeakPolarHBondContact O-CB 3.45Å; I160-Y163 PolarHBondContact O-N 3.03Å; V161-Y163 VanDerWaalsContact C-N 3.32Å; V161-Y163 PolarHBondContact O-N 3.31Å; Y163-Y166 PolarHBondContact O-N 3.01Å; Y163-V167 HydrophobicContact CD1-CG2 4.46Å; Y163-V167 HydrophobicContact CE1-CG2 4.1Å; Y163-V167 WeakPolarHBondContact O-CG2 3.35Å; Y163-V167 PolarHBondContact O-N 3.02Å
164	V	91.6	Very high	88.1	Confident	97 Å²	97	53.5 Å²	53.5	59%	0.588	28%	0.275	S	S	*	.	H	α-helix	trans	-63.1	-44.6	178.7	176	0	0	0	0	111.1	I160 V161 C162 Y166 V167 G168	I160-V164 WeakPolarHBondContact O-CG2 3.49Å; I160-V164 PolarHBondContact O-N 3.24Å; V161-V164 PolarHBondContact O-N 3.26Å; C162-V164 PolarHBondContact O-N 3.47Å; V164-Y166 VanDerWaalsContact C-N 3.33Å; V164-Y166 PolarHBondContact O-N 2.94Å; V164-V167 PolarHBondContact O-N 3.09Å; V164-G168 PolarHBondContact O-N 3.18Å
165	L	91.2	Very high	88.3	Confident	73 Å²	73	48 Å²	48	38%	0.382	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.5	-71.5	175.1	0	0	0	111.7	V161 C162 V167 G168 F169	V161-L165 HydrophobicContact CG1-CD1 4.01Å; V161-L165 HydrophobicContact CG1-CG 4.48Å; V161-L165 WeakPolarHBondContact O-CG 3.47Å; V161-L165 PolarHBondContact O-N 3.16Å; C162-L165 PolarHBondContact O-N 3.07Å; L165-V167 PolarHBondContact O-N 2.76Å; L165-G168 WeakPolarHBondContact O-CA 3.26Å; L165-G168 PolarHBondContact O-N 3.48Å; L165-G168 VanDerWaalsContact O-N 3.13Å; L165-F169 HydrophobicContact CB-CD2 4.4Å; L165-F169 HydrophobicContact CB-CE2 3.93Å; L165-F169 HydrophobicContact CB-CZ 4.25Å; L165-F169 HydrophobicContact CD2-CZ 4.33Å; L165-F169 WeakPolarHBondContact O-CB 3.38Å; L165-F169 WeakPolarHBondContact O-CD2 3.34Å; L165-F169 WeakPolarHBondContact O-CG 3.36Å; L165-F169 PolarHBondContact O-N 3.34Å
166	Y	91.7	Very high	88.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.6	-33.9	-178.3	-73.2	1.3	0	0	0	112.8	T36 S39 S40 L91 M124 Y127 Q128 C162 Y163 V164 F169 L170	T36-Y166 HydrophobicContact CG2-CE1 4.07Å; S39-Y166 WeakPolarHBondContact CB-OH 3.39Å; S39-Y166 VanDerWaalsContact OG-CE1 3.24Å; S39-Y166 WeakPolarHBondContact OG-CE1 3.5Å; S39-Y166 PolarHBondContact OG-OH 3.49Å; S40-Y166 PolarHBondContact N-OH 3.15Å; L91-Y166 HydrophobicContact CD2-CE2 4.07Å; M124-Y166 HydrophobicContact CE-CD1 4.1Å; M124-Y166 HydrophobicContact CE-CD2 4.26Å; M124-Y166 HydrophobicContact CE-CG 3.71Å; Y127-Y166 HydrophobicContact CD1-CD2 4.02Å; Y127-Y166 HydrophobicContact CD1-CE2 4.08Å; Y127-Y166 AromaticContact CE1-CD2 3.77Å; Y127-Y166 HydrophobicContact CE1-CD2 3.77Å; Y127-Y166 AromaticContact CE1-CE2 3.51Å; Y127-Y166 HydrophobicContact CE1-CE2 3.51Å; Q128-Y166 VanDerWaalsContact NE2-CB 3.3Å; C162-Y166 HydrophobicContact CB-CE2 4.34Å; C162-Y166 VanDerWaalsContact O-CB 3.23Å; C162-Y166 WeakPolarHBondContact O-CB 3.42Å; C162-Y166 WeakPolarHBondContact O-CD1 3.38Å; C162-Y166 PolarHBondContact O-N 3.32Å; Y163-Y166 PolarHBondContact O-N 3.01Å; V164-Y166 VanDerWaalsContact C-N 3.33Å; V164-Y166 PolarHBondContact O-N 2.94Å; Y166-F169 AromaticContact CD1-CD2 3.99Å; Y166-F169 HydrophobicContact CD1-CD2 3.99Å; Y166-F169 HydrophobicContact CD1-CE2 4.47Å; Y166-F169 PolarHBondContact O-N 3.46Å; Y166-L170 VanDerWaalsContact O-CB 3.3Å; Y166-L170 WeakPolarHBondContact O-CB 3.48Å; Y166-L170 PolarHBondContact O-N 3.29Å
167	V	92.3	Very high	88.9	Confident	61 Å²	61	48.4 Å²	48.4	37%	0.37	25%	0.25	S	C	.	.	H	α-helix	trans	-61.5	-46.9	169.3	174.5	0	0	0	0	110.4	Y163 V164 L165 F169 L170 I171	Y163-V167 HydrophobicContact CD1-CG2 4.46Å; Y163-V167 HydrophobicContact CE1-CG2 4.1Å; Y163-V167 WeakPolarHBondContact O-CG2 3.35Å; Y163-V167 PolarHBondContact O-N 3.02Å; V164-V167 PolarHBondContact O-N 3.09Å; L165-V167 PolarHBondContact O-N 2.76Å; V167-F169 PolarHBondContact O-N 2.93Å; V167-L170 WeakPolarHBondContact O-CB 3.23Å; V167-L170 PolarHBondContact O-N 3.46Å; V167-I171 HydrophobicContact CG1-CD1 4.41Å; V167-I171 WeakPolarHBondContact O-CG1 3.33Å; V167-I171 PolarHBondContact O-N 2.88Å
168	G	88.7	Confident	88.8	Confident	32 Å²	32	44 Å²	44	33%	0.33	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-47	175.8	0	0	0	0	0	112.3	V164 L165 L170 I171 V172	V164-G168 PolarHBondContact O-N 3.18Å; L165-G168 WeakPolarHBondContact O-CA 3.26Å; L165-G168 PolarHBondContact O-N 3.48Å; L165-G168 VanDerWaalsContact O-N 3.13Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 2.92Å; G168-I171 WeakPolarHBondContact O-CB 3.38Å; G168-I171 PolarHBondContact O-N 3.26Å; G168-I171 VanDerWaalsContact O-N 3.17Å; G168-V172 VanDerWaalsContact O-CG2 3.26Å; G168-V172 WeakPolarHBondContact O-CG2 3.36Å; G168-V172 PolarHBondContact O-N 3.23Å; G168-V172 VanDerWaalsContact O-N 3.08Å
169	F	91	Very high	88.6	Confident	32 Å²	32	43.3 Å²	43.3	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-33.7	179.3	-65.1	-19.8	0	0	0	113.6	S32 T35 W120 L165 Y166 V167 I171 V172 G173	S32-F169 VanDerWaalsContact CB-CD1 3.43Å; T35-F169 HydrophobicContact CG2-CE2 3.66Å; T35-F169 HydrophobicContact CG2-CZ 3.73Å; W120-F169 HydrophobicContact CH2-CB 4.45Å; L165-F169 HydrophobicContact CB-CD2 4.4Å; L165-F169 HydrophobicContact CB-CE2 3.93Å; L165-F169 HydrophobicContact CB-CZ 4.25Å; L165-F169 HydrophobicContact CD2-CZ 4.33Å; L165-F169 WeakPolarHBondContact O-CB 3.38Å; L165-F169 WeakPolarHBondContact O-CD2 3.34Å; L165-F169 WeakPolarHBondContact O-CG 3.36Å; L165-F169 PolarHBondContact O-N 3.34Å; Y166-F169 AromaticContact CD1-CD2 3.99Å; Y166-F169 HydrophobicContact CD1-CD2 3.99Å; Y166-F169 HydrophobicContact CD1-CE2 4.47Å; Y166-F169 PolarHBondContact O-N 3.46Å; V167-F169 PolarHBondContact O-N 2.93Å; F169-I171 VanDerWaalsContact C-N 3.34Å; F169-V172 PolarHBondContact O-N 3.49Å; F169-G173 PolarHBondContact O-N 2.93Å
170	L	91.3	Very high	88.5	Confident	38 Å²	38	41.9 Å²	41.9	20%	0.199	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-44.7	172.1	-176.7	77	0	0	0	110.7	C121 M124 I125 Y166 V167 G168 V172 G173 Y174	C121-L170 HydrophobicContact CB-CD1 4.19Å; C121-L170 WeakPolarHBondContact O-CD1 3.49Å; M124-L170 HydrophobicContact CB-CD1 3.72Å; I125-L170 HydrophobicContact CD1-CD1 4.33Å; I125-L170 HydrophobicContact CD1-CD2 4.27Å; I125-L170 HydrophobicContact CG1-CD1 3.81Å; I125-L170 HydrophobicContact CG1-CD2 3.65Å; I125-L170 HydrophobicContact CG1-CG 4.38Å; Y166-L170 VanDerWaalsContact O-CB 3.3Å; Y166-L170 WeakPolarHBondContact O-CB 3.48Å; Y166-L170 PolarHBondContact O-N 3.29Å; V167-L170 WeakPolarHBondContact O-CB 3.23Å; V167-L170 PolarHBondContact O-N 3.46Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 2.92Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 2.88Å; L170-G173 PolarHBondContact O-N 2.78Å; L170-Y174 VanDerWaalsContact O-CB 3.23Å; L170-Y174 WeakPolarHBondContact O-CB 3.41Å; L170-Y174 PolarHBondContact O-N 3.36Å
171	I	89.7	Confident	88.2	Confident	53 Å²	53	41.4 Å²	41.4	27%	0.272	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-42.3	178.2	-62.7	165.1	0	0	0	110.6	I14 F15 V167 G168 F169 S175	I14-I171 HydrophobicContact CG2-CG2 4.37Å; F15-I171 HydrophobicContact CB-CG2 4.03Å; F15-I171 HydrophobicContact CD2-CG2 4.25Å; V167-I171 HydrophobicContact CG1-CD1 4.41Å; V167-I171 WeakPolarHBondContact O-CG1 3.33Å; V167-I171 PolarHBondContact O-N 2.88Å; G168-I171 WeakPolarHBondContact O-CB 3.38Å; G168-I171 PolarHBondContact O-N 3.26Å; G168-I171 VanDerWaalsContact O-N 3.17Å; F169-I171 VanDerWaalsContact C-N 3.34Å; I171-S175 WeakPolarHBondContact O-CB 3.45Å; I171-S175 PolarHBondContact O-N 3.4Å; I171-S175 PolarHBondContact O-OG 2.77Å
172	V	88.4	Confident	87.6	Confident	16 Å²	16	41 Å²	41	10%	0.097	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-49.5	177	-175.8	0	0	0	0	111.2	L17 G28 G168 F169 L170 Y174 S175 Y176	L17-V172 HydrophobicContact CD1-CB 4.33Å; L17-V172 HydrophobicContact CD1-CG1 4.12Å; L17-V172 HydrophobicContact CD1-CG2 3.53Å; G28-V172 VanDerWaalsContact C-CG1 3.48Å; G168-V172 VanDerWaalsContact O-CG2 3.26Å; G168-V172 WeakPolarHBondContact O-CG2 3.36Å; G168-V172 PolarHBondContact O-N 3.23Å; G168-V172 VanDerWaalsContact O-N 3.08Å; F169-V172 PolarHBondContact O-N 3.49Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 2.88Å; V172-Y174 VanDerWaalsContact C-N 3.35Å; V172-Y174 PolarHBondContact O-N 3.33Å; V172-S175 WeakPolarHBondContact O-CB 2.83Å; V172-S175 PolarHBondContact O-N 3.22Å; V172-Y176 PolarHBondContact O-N 3.42Å
173	G	88.1	Confident	87	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-40	179.7	0	0	0	0	0	112.5	F169 L170 Y176 Y177	F169-G173 PolarHBondContact O-N 2.93Å; L170-G173 PolarHBondContact O-N 2.78Å; G173-Y176 PolarHBondContact O-N 3.5Å; G173-Y177 WeakPolarHBondContact O-CB 3.47Å; G173-Y177 PolarHBondContact O-N 3.3Å
174	Y	88.7	Confident	86.2	Confident	115 Å²	115	38.8 Å²	38.8	45%	0.451	21%	0.207	S	C	.	.	H	α-helix	trans	-66.7	-36.6	175.2	-172.8	-97.6	0	0	0	112.5	I14 L170 V172 Y176 Y177 S178	I14-Y174 HydrophobicContact CD1-CD1 3.68Å; I14-Y174 HydrophobicContact CD1-CE1 3.81Å; L170-Y174 VanDerWaalsContact O-CB 3.23Å; L170-Y174 WeakPolarHBondContact O-CB 3.41Å; L170-Y174 PolarHBondContact O-N 3.36Å; V172-Y174 VanDerWaalsContact C-N 3.35Å; V172-Y174 PolarHBondContact O-N 3.33Å; Y174-Y176 VanDerWaalsContact C-N 3.33Å; Y174-Y176 PolarHBondContact O-N 3.24Å; Y174-Y177 HydrophobicContact CD2-CD1 4.3Å; Y174-Y177 HydrophobicContact CE2-CD1 4.2Å; Y174-Y177 WeakPolarHBondContact O-CB 3.46Å; Y174-Y177 PolarHBondContact O-N 3.2Å; Y174-S178 PolarHBondContact O-N 2.9Å; Y174-S178 PolarHBondContact O-OG 3.18Å
175	S	86.7	Confident	85.1	Confident	2 Å²	2	37 Å²	37	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-36.6	174.1	-59.8	0	0	0	0	112	I171 V172 S178 E179	I171-S175 WeakPolarHBondContact O-CB 3.45Å; I171-S175 PolarHBondContact O-N 3.4Å; I171-S175 PolarHBondContact O-OG 2.77Å; V172-S175 WeakPolarHBondContact O-CB 2.83Å; V172-S175 PolarHBondContact O-N 3.22Å; S175-S178 PolarHBondContact O-OG 2.73Å; S175-E179 PolarHBondContact O-N 2.9Å
176	Y	86.1	Confident	83.8	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-71.6	-38	173.7	-175.8	-133.3	0	0	0	112.2	I5 N25 R26 C29 L113 L117 V172 G173 Y174 S178 E179 I180	I5-Y176 HydrophobicContact CD1-CE2 4.15Å; N25-Y176 HydrophobicContact CB-CD2 4.13Å; R26-Y176 HydrophobicContact CB-CD2 4.16Å; R26-Y176 HydrophobicContact CB-CE1 4.4Å; R26-Y176 HydrophobicContact CB-CE2 3.6Å; R26-Y176 WeakPolarHBondContact CD-OH 3.16Å; R26-Y176 HydrophobicContact CG-CE1 4.16Å; R26-Y176 HydrophobicContact CG-CE2 4.05Å; R26-Y176 WeakPolarHBondContact CG-OH 3.05Å; C29-Y176 HydrophobicContact CB-CD1 3.72Å; C29-Y176 HydrophobicContact CB-CG 4.09Å; L113-Y176 HydrophobicContact CD2-CE1 4.23Å; L117-Y176 HydrophobicContact CD2-CD1 3.56Å; L117-Y176 HydrophobicContact CD2-CE1 4.24Å; L117-Y176 HydrophobicContact CD2-CG 4.19Å; V172-Y176 PolarHBondContact O-N 3.42Å; G173-Y176 PolarHBondContact O-N 3.5Å; Y174-Y176 VanDerWaalsContact C-N 3.33Å; Y174-Y176 PolarHBondContact O-N 3.24Å; Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.18Å; Y176-E179 PolarHBondContact O-N 3.41Å; Y176-I180 HydrophobicContact CD1-CD1 4.02Å; Y176-I180 HydrophobicContact CD2-CD1 4.4Å; Y176-I180 HydrophobicContact CD2-CG1 4.36Å; Y176-I180 HydrophobicContact CE1-CD1 3.61Å; Y176-I180 HydrophobicContact CE1-CG1 4.47Å; Y176-I180 HydrophobicContact CE2-CD1 4Å; Y176-I180 HydrophobicContact CE2-CG1 3.96Å; Y176-I180 HydrophobicContact CG-CD1 4.39Å; Y176-I180 WeakPolarHBondContact O-CG1 3.36Å; Y176-I180 PolarHBondContact O-N 3.14Å
177	Y	86.9	Confident	82.5	Confident	29 Å²	29	42.6 Å²	42.6	11%	0.114	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.8	171.3	-100.9	0	0	0	112.5	K114 R118 G173 Y174 I180 R181	K114-Y177 HydrophobicContact CG-CD2 4.35Å; K114-Y177 HydrophobicContact CG-CE2 3.68Å; R118-Y177 HydrophobicContact CB-CD2 4.25Å; R118-Y177 HydrophobicContact CB-CE2 3.73Å; R118-Y177 HydrophobicContact CG-CE2 4.38Å; G173-Y177 WeakPolarHBondContact O-CB 3.47Å; G173-Y177 PolarHBondContact O-N 3.3Å; Y174-Y177 HydrophobicContact CD2-CD1 4.3Å; Y174-Y177 HydrophobicContact CE2-CD1 4.2Å; Y174-Y177 WeakPolarHBondContact O-CB 3.46Å; Y174-Y177 PolarHBondContact O-N 3.2Å; Y177-I180 PolarHBondContact O-N 2.92Å; Y177-R181 WeakPolarHBondContact O-CB 3.17Å; Y177-R181 PolarHBondContact O-N 3.41Å
178	S	83.9	Confident	80.9	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-38.1	178.3	66.3	0	0	0	0	112.1	Y174 S175 Y176 R181 L182	Y174-S178 PolarHBondContact O-N 2.9Å; Y174-S178 PolarHBondContact O-OG 3.18Å; S175-S178 PolarHBondContact O-OG 2.73Å; Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.18Å; S178-R181 PolarHBondContact O-N 2.95Å; S178-L182 WeakPolarHBondContact O-CB 3.39Å; S178-L182 VanDerWaalsContact O-CG 3.3Å; S178-L182 WeakPolarHBondContact O-CG 3.49Å; S178-L182 PolarHBondContact O-N 3Å
179	E	82.4	Confident	79.4	Confident	29 Å²	29	40.4 Å²	40.4	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-46.3	173.4	-174.6	177.7	169.2	0	0	111.9	N25 S175 Y176 R181 L182 A183	N25-E179 WeakPolarHBondContact CB-OE2 3.37Å; N25-E179 PolarHBondContact ND2-OE2 3.46Å; S175-E179 PolarHBondContact O-N 2.9Å; Y176-E179 PolarHBondContact O-N 3.41Å; E179-R181 PolarHBondContact O-N 3.49Å; E179-L182 PolarHBondContact O-N 3.01Å; E179-A183 WeakPolarHBondContact O-CB 3.3Å; E179-A183 PolarHBondContact O-N 3.28Å
180	I	83	Confident	77.8	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-59.8	-47.2	175.6	-71	173.1	0	0	0	110.6	L113 K114 L117 Y176 Y177 L182 A183 L184	L113-I180 HydrophobicContact CD2-CD1 3.69Å; L113-I180 HydrophobicContact CG-CD1 3.93Å; K114-I180 HydrophobicContact CB-CG2 3.97Å; K114-I180 HydrophobicContact CG-CG2 4.49Å; L117-I180 HydrophobicContact CD2-CD1 3.95Å; Y176-I180 HydrophobicContact CD1-CD1 4.02Å; Y176-I180 HydrophobicContact CD2-CD1 4.4Å; Y176-I180 HydrophobicContact CD2-CG1 4.36Å; Y176-I180 HydrophobicContact CE1-CD1 3.61Å; Y176-I180 HydrophobicContact CE1-CG1 4.47Å; Y176-I180 HydrophobicContact CE2-CD1 4Å; Y176-I180 HydrophobicContact CE2-CG1 3.96Å; Y176-I180 HydrophobicContact CG-CD1 4.39Å; Y176-I180 WeakPolarHBondContact O-CG1 3.36Å; Y176-I180 PolarHBondContact O-N 3.14Å; Y177-I180 PolarHBondContact O-N 2.92Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.99Å; I180-A183 WeakPolarHBondContact O-CB 3.46Å; I180-A183 PolarHBondContact O-N 3.1Å; I180-L184 HydrophobicContact CG2-CD1 3.45Å; I180-L184 VanDerWaalsContact CG2-CD1 3.45Å; I180-L184 WeakPolarHBondContact O-CD1 3.5Å; I180-L184 PolarHBondContact O-N 3.32Å
181	R	80.7	Confident	76.2	Confident	92 Å²	92	46.4 Å²	46.4	35%	0.347	26%	0.262	S	S	.	.	H	α-helix	trans	-58	-46	178.5	-175.2	179.9	176.3	-143.3	3.2	111	Y177 S178 E179 L184 V185 V192 E195	Y177-R181 WeakPolarHBondContact O-CB 3.17Å; Y177-R181 PolarHBondContact O-N 3.41Å; S178-R181 PolarHBondContact O-N 2.95Å; E179-R181 PolarHBondContact O-N 3.49Å; R181-L184 PolarHBondContact O-N 2.64Å; R181-V185 WeakPolarHBondContact O-CG2 3.21Å; R181-V185 PolarHBondContact O-N 2.96Å; R181-V192 HydrophobicContact CG-CG2 4.22Å; R181-E195 IonicContact CZ-OE2 2.88Å; R181-E195 IonicContact NE-OE2 3.18Å; R181-E195 IonicContact NH2-OE1 3.7Å; R181-E195 IonicContact NH2-OE2 2.78Å; R181-E195 PolarHBondContact NH2-OE2 3.37Å
182	L	77	Confident	74.6	Confident	77 Å²	77	44.3 Å²	44.3	40%	0.403	25%	0.252	S	S	.	.	H	α-helix	trans	-66.9	-33.5	178.3	-72.4	171.2	0	0	0	113.3	V11 S178 E179 I180	V11-L182 HydrophobicContact CB-CD1 4.41Å; V11-L182 HydrophobicContact CG1-CD1 3.95Å; V11-L182 HydrophobicContact CG2-CD1 3.52Å; S178-L182 WeakPolarHBondContact O-CB 3.39Å; S178-L182 VanDerWaalsContact O-CG 3.3Å; S178-L182 WeakPolarHBondContact O-CG 3.49Å; S178-L182 PolarHBondContact O-N 3Å; E179-L182 PolarHBondContact O-N 3.01Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.99Å
183	A	77	Confident	73	Confident	33 Å²	33	47.9 Å²	47.9	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-64.6	-44.2	173.1	0	0	0	0	0	110.9	L110 E179 I180 G186 E187	L110-A183 HydrophobicContact CD2-CB 4.33Å; E179-A183 WeakPolarHBondContact O-CB 3.3Å; E179-A183 PolarHBondContact O-N 3.28Å; I180-A183 WeakPolarHBondContact O-CB 3.46Å; I180-A183 PolarHBondContact O-N 3.1Å; A183-G186 PolarHBondContact O-N 3.14Å; A183-G186 VanDerWaalsContact O-N 3.14Å; A183-E187 PolarHBondContact O-N 3.29Å
184	L	74.8	Confident	71.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.7	-33.1	178.1	-76.6	139.2	0	0	0	113.4	L110 Y111 K114 I180 R181 G186 E187 G188 D189	L110-L184 HydrophobicContact CB-CD1 4.24Å; L110-L184 HydrophobicContact CB-CD2 4.4Å; L110-L184 HydrophobicContact CB-CG 4.38Å; Y111-L184 HydrophobicContact CD1-CD2 3.61Å; Y111-L184 HydrophobicContact CD2-CD2 3.61Å; Y111-L184 HydrophobicContact CE1-CD2 3.52Å; Y111-L184 HydrophobicContact CE2-CD2 3.46Å; Y111-L184 VanDerWaalsContact CE2-CD2 3.46Å; Y111-L184 HydrophobicContact CG-CD2 3.67Å; K114-L184 HydrophobicContact CB-CD1 4.27Å; K114-L184 HydrophobicContact CD-CD1 3.98Å; I180-L184 HydrophobicContact CG2-CD1 3.45Å; I180-L184 VanDerWaalsContact CG2-CD1 3.45Å; I180-L184 WeakPolarHBondContact O-CD1 3.5Å; I180-L184 PolarHBondContact O-N 3.32Å; R181-L184 PolarHBondContact O-N 2.64Å; L184-G186 PolarHBondContact O-N 2.87Å; L184-E187 PolarHBondContact O-N 3.34Å; L184-G188 PolarHBondContact O-N 3.41Å; L184-G188 VanDerWaalsContact O-N 3.1Å; L184-D189 HydrophobicContact CB-CB 3.92Å; L184-D189 VanDerWaalsContact CB-CG 3.44Å; L184-D189 VanDerWaalsContact CB-OD2 3.24Å; L184-D189 WeakPolarHBondContact CB-OD2 3.24Å; L184-D189 WeakPolarHBondContact CD2-OD1 3.22Å; L184-D189 PolarHBondContact O-N 3.34Å; L184-D189 VanDerWaalsContact O-N 3.14Å
185	V	67.9	Low	70.1	Confident	60 Å²	60	53.2 Å²	53.2	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-56.4	-38.4	171.1	-177.3	0	0	0	0	111.1	R181 E187 G188 V192 I196	R181-V185 WeakPolarHBondContact O-CG2 3.21Å; R181-V185 PolarHBondContact O-N 2.96Å; V185-E187 VanDerWaalsContact C-N 3.29Å; V185-E187 PolarHBondContact O-N 3.22Å; V185-G188 PolarHBondContact O-N 2.86Å; V185-V192 HydrophobicContact CG1-CG1 4.43Å; V185-V192 HydrophobicContact CG2-CB 4.05Å; V185-V192 HydrophobicContact CG2-CG1 3.51Å; V185-V192 HydrophobicContact CG2-CG2 4.08Å; V185-I196 HydrophobicContact CG1-CD1 4.42Å
186	G	64.5	Low	68.7	Low	66 Å²	66	57 Å²	57	68%	0.68	32%	0.318	S	S	*	.	H	α-helix	trans	-69.2	-23.9	176.3	0	0	0	0	0	114.3	A183 L184	A183-G186 PolarHBondContact O-N 3.14Å; A183-G186 VanDerWaalsContact O-N 3.14Å; L184-G186 PolarHBondContact O-N 2.87Å
187	E	64.2	Low	67.2	Low	125 Å²	125	61.4 Å²	61.4	58%	0.584	34%	0.342	S	S	*	.	H	α-helix	trans	-93.1	-8	179.1	-71.2	-178	170.6	0	0	113.5	A183 L184 V185	A183-E187 PolarHBondContact O-N 3.29Å; L184-E187 PolarHBondContact O-N 3.34Å; V185-E187 VanDerWaalsContact C-N 3.29Å; V185-E187 PolarHBondContact O-N 3.22Å
188	G	57.9	Low	65.7	Low	43 Å²	43	67.4 Å²	67.4	44%	0.443	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	46.3	-179.4	0	0	0	0	0	114.2	L184 V185	L184-G188 PolarHBondContact O-N 3.41Å; L184-G188 VanDerWaalsContact O-N 3.1Å; V185-G188 PolarHBondContact O-N 2.86Å
189	D	57	Low	64.2	Low	4 Å²	4	71.7 Å²	71.7	2%	0.021	39%	0.389	C	S	.	.			trans	-57	122.9	176.3	-135.9	9	0	0	0	112.5	Y111 K114 L184 E191 V192 L193	Y111-D189 WeakPolarHBondContact CD1-OD1 3.46Å; Y111-D189 WeakPolarHBondContact CE1-OD1 3.3Å; K114-D189 IonicContact NZ-OD2 3.87Å; K114-D189 PolarHBondContact NZ-OD2 3.45Å; L184-D189 HydrophobicContact CB-CB 3.92Å; L184-D189 VanDerWaalsContact CB-CG 3.44Å; L184-D189 VanDerWaalsContact CB-OD2 3.24Å; L184-D189 WeakPolarHBondContact CB-OD2 3.24Å; L184-D189 WeakPolarHBondContact CD2-OD1 3.22Å; L184-D189 PolarHBondContact O-N 3.34Å; L184-D189 VanDerWaalsContact O-N 3.14Å; D189-E191 PolarHBondContact O-N 3.01Å; D189-V192 HydrophobicContact CB-CB 4.09Å; D189-V192 HydrophobicContact CB-CG2 4.01Å; D189-V192 PolarHBondContact O-N 3.21Å; D189-L193 WeakPolarHBondContact O-CB 3.42Å; D189-L193 PolarHBondContact O-N 3.42Å
190	P	57.6	Low	63	Low	88 Å²	88	73.4 Å²	73.4	57%	0.571	40%	0.404	S	S	*	.	H	α-helix	trans	-67	-33.9	-178.1	25.6	-33.3	0	0	0	113.1	L193 Q194	P190-L193 PolarHBondContact O-N 3.28Å; P190-Q194 WeakPolarHBondContact O-CB 3.08Å; P190-Q194 PolarHBondContact O-N 3.19Å
191	E	58.6	Low	61.4	Low	107 Å²	107	75 Å²	75	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-67.3	-39.3	176.9	-67.2	-177.4	159.6	0	0	112.1	K114 D189 Q194 E195	K114-E191 IonicContact NZ-OE2 3.97Å; K114-E191 PolarHBondContact NZ-OE2 2.79Å; D189-E191 PolarHBondContact O-N 3.01Å; E191-Q194 PolarHBondContact O-N 3.28Å; E191-E195 PolarHBondContact O-N 3.45Å
192	V	54.6	Low	59.6	Low	9 Å²	9	73.1 Å²	73.1	6%	0.055	43%	0.425	C	S	.	.	H	α-helix	trans	-77.5	-33.4	177.4	-174.4	0	0	0	0	110.4	R181 V185 D189 Q194 E195 I196	R181-V192 HydrophobicContact CG-CG2 4.22Å; V185-V192 HydrophobicContact CG1-CG1 4.43Å; V185-V192 HydrophobicContact CG2-CB 4.05Å; V185-V192 HydrophobicContact CG2-CG1 3.51Å; V185-V192 HydrophobicContact CG2-CG2 4.08Å; D189-V192 HydrophobicContact CB-CB 4.09Å; D189-V192 HydrophobicContact CB-CG2 4.01Å; D189-V192 PolarHBondContact O-N 3.21Å; V192-Q194 PolarHBondContact O-N 3.47Å; V192-E195 PolarHBondContact O-N 3.45Å; V192-I196 HydrophobicContact CG1-CD1 3.79Å; V192-I196 HydrophobicContact CG1-CG1 4.08Å; V192-I196 WeakPolarHBondContact O-CB 3.4Å; V192-I196 VanDerWaalsContact O-CG1 3.22Å; V192-I196 WeakPolarHBondContact O-CG1 3.22Å; V192-I196 PolarHBondContact O-N 3.42Å
193	L	55	Low	57.9	Low	91 Å²	91	72.7 Å²	72.7	48%	0.476	43%	0.432	S	S	.	.	H	α-helix	trans	-59	-39.8	167.9	-132.9	88.3	0	0	0	110.7	D189 P190 N197	D189-L193 WeakPolarHBondContact O-CB 3.42Å; D189-L193 PolarHBondContact O-N 3.42Å; P190-L193 PolarHBondContact O-N 3.28Å; L193-N197 WeakPolarHBondContact O-CA 3.33Å; L193-N197 WeakPolarHBondContact O-CB 3.23Å; L193-N197 PolarHBondContact O-N 2.76Å; L193-N197 PolarHBondContact O-ND2 2.79Å
194	Q	59.3	Low	56.2	Low	139 Å²	139	75.4 Å²	75.4	65%	0.65	45%	0.449	S	S	*	.	H	α-helix	trans	-67.5	-41.2	175.8	-171.2	177.4	-0.4	0	0	112	P190 E191 V192 N197 F198	P190-Q194 WeakPolarHBondContact O-CB 3.08Å; P190-Q194 PolarHBondContact O-N 3.19Å; E191-Q194 PolarHBondContact O-N 3.28Å; V192-Q194 PolarHBondContact O-N 3.47Å; Q194-N197 PolarHBondContact O-N 3.32Å; Q194-F198 WeakPolarHBondContact O-CB 3.33Å; Q194-F198 PolarHBondContact O-N 3.36Å
195	E	56.3	Low	54.4	Low	89 Å²	89	81.2 Å²	81.2	42%	0.416	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-41.9	173.5	-75.1	179.3	157.7	0	0	112.4	R181 E191 V192 F198 L199	R181-E195 IonicContact CZ-OE2 2.88Å; R181-E195 IonicContact NE-OE2 3.18Å; R181-E195 IonicContact NH2-OE1 3.7Å; R181-E195 IonicContact NH2-OE2 2.78Å; R181-E195 PolarHBondContact NH2-OE2 3.37Å; E191-E195 PolarHBondContact O-N 3.45Å; V192-E195 PolarHBondContact O-N 3.45Å; E195-F198 PolarHBondContact O-N 3.47Å; E195-L199 WeakPolarHBondContact O-CB 3.22Å; E195-L199 VanDerWaalsContact O-CG 3.23Å; E195-L199 WeakPolarHBondContact O-CG 3.34Å; E195-L199 PolarHBondContact O-N 2.75Å
196	I	57	Low	52.6	Low	82 Å²	82	86.1 Å²	86.1	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-43.4	174.7	-69.1	168.2	0	0	0	109.8	V185 V192 F198 L199 S200	V185-I196 HydrophobicContact CG1-CD1 4.42Å; V192-I196 HydrophobicContact CG1-CD1 3.79Å; V192-I196 HydrophobicContact CG1-CG1 4.08Å; V192-I196 WeakPolarHBondContact O-CB 3.4Å; V192-I196 VanDerWaalsContact O-CG1 3.22Å; V192-I196 WeakPolarHBondContact O-CG1 3.22Å; V192-I196 PolarHBondContact O-N 3.42Å; I196-F198 VanDerWaalsContact C-N 3.31Å; I196-F198 PolarHBondContact O-N 2.82Å; I196-L199 PolarHBondContact O-N 2.85Å; I196-S200 WeakPolarHBondContact O-CB 3.19Å; I196-S200 PolarHBondContact O-N 2.94Å; I196-S200 PolarHBondContact O-OG 2.72Å
197	N	55.1	Low	51	Low	94 Å²	94	86.6 Å²	86.6	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-32.3	175.9	-72.9	-18	0	0	0	112	L193 Q194 S200 G201	L193-N197 WeakPolarHBondContact O-CA 3.33Å; L193-N197 WeakPolarHBondContact O-CB 3.23Å; L193-N197 PolarHBondContact O-N 2.76Å; L193-N197 PolarHBondContact O-ND2 2.79Å; Q194-N197 PolarHBondContact O-N 3.32Å; N197-S200 VanDerWaalsContact CA-OG 3.31Å; N197-S200 WeakPolarHBondContact CA-OG 3.49Å; N197-S200 PolarHBondContact O-OG 2.76Å; N197-G201 WeakPolarHBondContact O-CA 3.14Å; N197-G201 PolarHBondContact O-N 3.5Å
198	F	56.9	Low	49.7	Very low	155 Å²	155	86.2 Å²	86.2	68%	0.68	51%	0.507	S	S	*	.	H	α-helix	trans	-71.2	-42.6	173.5	-176.9	-97	0	0	0	111	Q194 E195 I196 A202	Q194-F198 WeakPolarHBondContact O-CB 3.33Å; Q194-F198 PolarHBondContact O-N 3.36Å; E195-F198 PolarHBondContact O-N 3.47Å; I196-F198 VanDerWaalsContact C-N 3.31Å; I196-F198 PolarHBondContact O-N 2.82Å; F198-A202 VanDerWaalsContact O-CB 3.22Å; F198-A202 WeakPolarHBondContact O-CB 3.31Å; F198-A202 PolarHBondContact O-N 3.34Å
199	L	51.9	Low	48.5	Very low	121 Å²	121	91.6 Å²	91.6	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-71.4	-36.8	176.5	-70.7	169.2	0	0	0	112.3	E195 I196 A202 A203	E195-L199 WeakPolarHBondContact O-CB 3.22Å; E195-L199 VanDerWaalsContact O-CG 3.23Å; E195-L199 WeakPolarHBondContact O-CG 3.34Å; E195-L199 PolarHBondContact O-N 2.75Å; I196-L199 PolarHBondContact O-N 2.85Å; L199-A202 PolarHBondContact O-N 3.49Å; L199-A203 PolarHBondContact O-N 3Å; L199-A203 VanDerWaalsContact O-N 3.1Å
200	S	56.5	Low	47.2	Very low	64 Å²	64	97.6 Å²	97.6	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-76.7	-32.8	175.5	69.8	0	0	0	0	111.9	I196 N197 A203 S204	I196-S200 WeakPolarHBondContact O-CB 3.19Å; I196-S200 PolarHBondContact O-N 2.94Å; I196-S200 PolarHBondContact O-OG 2.72Å; N197-S200 VanDerWaalsContact CA-OG 3.31Å; N197-S200 WeakPolarHBondContact CA-OG 3.49Å; N197-S200 PolarHBondContact O-OG 2.76Å; S200-A203 PolarHBondContact O-N 3.32Å; S200-S204 PolarHBondContact O-N 3.39Å
201	G	48.5	Very low	46.1	Very low	36 Å²	36	103.3 Å²	103.3	37%	0.371	56%	0.563	S	S	.	*	H	α-helix	trans	-70.9	-28	169.8	0	0	0	0	0	113.4	N197 S204	N197-G201 WeakPolarHBondContact O-CA 3.14Å; N197-G201 PolarHBondContact O-N 3.5Å; G201-S204 PolarHBondContact O-OG 3.1Å
202	A	43.5	Very low	44.8	Very low	53 Å²	53	103.9 Å²	103.9	44%	0.438	57%	0.574	S	S	.	*	H	α-helix	trans	-76.9	-29	171.6	0	0	0	0	0	112.3	F198 L199 S204 T205	F198-A202 VanDerWaalsContact O-CB 3.22Å; F198-A202 WeakPolarHBondContact O-CB 3.31Å; F198-A202 PolarHBondContact O-N 3.34Å; L199-A202 PolarHBondContact O-N 3.49Å; A202-S204 VanDerWaalsContact C-N 3.31Å; A202-T205 PolarHBondContact O-OG1 3.25Å
203	A	41.5	Very low	43.8	Very low	67 Å²	67	112 Å²	112	55%	0.554	61%	0.609	S	S	*	*	H	α-helix	trans	-74.7	-19.4	174.4	0	0	0	0	0	113.2	L199 S200	L199-A203 PolarHBondContact O-N 3Å; L199-A203 VanDerWaalsContact O-N 3.1Å; S200-A203 PolarHBondContact O-N 3.32Å
204	S	41.6	Very low	43.1	Very low	90 Å²	90	113 Å²	113	63%	0.629	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-1.5	-178.6	59	0	0	0	0	115	S200 G201 A202	S200-S204 PolarHBondContact O-N 3.39Å; G201-S204 PolarHBondContact O-OG 3.1Å; A202-S204 VanDerWaalsContact C-N 3.31Å
205	T	36.9	Very low	42.1	Very low	122 Å²	122	115.5 Å²	115.5	75%	0.748	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-5.9	169.6	54.2	0	0	0	0	113.8	A202 S207	A202-T205 PolarHBondContact O-OG1 3.25Å; T205-S207 PolarHBondContact O-N 3.3Å
206	M	30.8	Very low	41.1	Very low	163 Å²	163	118.3 Å²	118.3	80%	0.803	65%	0.651	S	S	*	*	S	Bend	trans	-89.6	87.6	162.5	-80.6	-169.6	-85.7	0	0	110
207	S	30.3	Very low	40.3	Very low	77 Å²	77	124 Å²	124	54%	0.538	68%	0.675	S	S	.	*			trans	8.4	125.3	158.4	179.3	0	0	0	0	118.3	T205 H209	T205-S207 PolarHBondContact O-N 3.3Å; S207-H209 PolarHBondContact O-N 3.01Å
208	P	36.7	Very low	39.3	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	69%	0.69	S	S	*	*			trans	-78.2	90.2	176.4	34	-31	0	0	0	109.9	I210	P208-I210 PolarHBondContact O-N 2.96Å
209	H	32.4	Very low	38.9	Very low	156 Å²	156	132.8 Å²	132.8	72%	0.722	72%	0.718	S	S	*	*			trans	-75.4	86.4	159.2	-87.5	-74.9	0	0	0	109.4	S207 Y211	S207-H209 PolarHBondContact O-N 3.01Å; H209-Y211 PolarHBondContact O-N 3.21Å
210	I	30.3	Very low	38.3	Very low	130 Å²	130	133.4 Å²	133.4	67%	0.667	72%	0.722	S	S	*	*			trans	-0.4	101.2	139.8	-62.2	161.8	0	0	0	112.7	P208 T212	P208-I210 PolarHBondContact O-N 2.96Å; I210-T212 HydrophobicContact CG2-CG2 3.85Å
211	Y	34.3	Very low	37.3	Very low	208 Å²	208	137 Å²	137	82%	0.816	74%	0.737	S	S	*	*			trans	-106.6	78.6	149.7	-75.8	-80.7	0	0	0	107.6	H209 F213	H209-Y211 PolarHBondContact O-N 3.21Å; Y211-F213 PolarHBondContact O-N 3.34Å
212	T	31.1	Very low	36.7	Very low	120 Å²	120	142.6 Å²	142.6	74%	0.736	76%	0.757	S	S	*	*			trans	-67	112.4	159	39.7	0	0	0	0	108.2	I210	I210-T212 HydrophobicContact CG2-CG2 3.85Å
213	F	33.2	Very low	36.3	Very low	178 Å²	178	147.9 Å²	147.9	78%	0.781	78%	0.776	S	S	*	*			trans	-107.4	135.7	156.8	-93.6	-85.3	0	0	0	108.9	Y211	Y211-F213 PolarHBondContact O-N 3.34Å
214	P	40	Very low	35.9	Very low	114 Å²	114	152.9 Å²	152.9	74%	0.74	79%	0.79	S	S	*	*			trans	-81.1	129	-161.4	32	-31.5	0	0	0	111.4	N216	P214-N216 PolarHBondContact O-N 3.26Å
215	Q	38.9	Very low	35.6	Very low	190 Å²	190	157.1 Å²	157.1	89%	0.888	80%	0.8	S	S	*	*			trans	-73.8	116.8	168	-83.1	-174.9	-22.5	0	0	109.7	Q217	Q215-Q217 PolarHBondContact O-N 3.11Å; Q215-Q217 VanDerWaalsContact O-N 3.11Å
216	N	35.9	Very low	35.5	Very low	149 Å²	149	159.6 Å²	159.6	80%	0.797	80%	0.804	S	S	*	*			trans	-53.1	108.4	166.3	-81.9	-33.5	0	0	0	110.7	P214 K218	P214-N216 PolarHBondContact O-N 3.26Å; N216-K218 PolarHBondContact O-N 3.39Å
217	Q	39.4	Very low	35.8	Very low	200 Å²	200	159.4 Å²	159.4	94%	0.935	80%	0.804	S	S	*	*			trans	-74.1	104.6	160.2	-79.5	-177.8	-25.9	0	0	108.3	Q215	Q215-Q217 PolarHBondContact O-N 3.11Å; Q215-Q217 VanDerWaalsContact O-N 3.11Å
218	K	34.6	Very low	36.3	Very low	188 Å²	188	166.3 Å²	166.3	82%	0.817	83%	0.826	S	S	*	*			trans	-103	113.3	160	-76.8	-174.3	176.1	-176.1	0	107.8	N216	N216-K218 PolarHBondContact O-N 3.39Å
219	I	48.8	Very low	36.3	Very low	246 Å²	246	170.8 Å²	170.8	100%	1.262	83%	0.833	S	S	*	*			trans	-126.4	0	144.8	-60.6	179.6	0	0	0	105.2

Retrieved 219 of 219 residues in 112.3 ms (Link to these results)

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