A0A087YQS3_POEFO Loading...

Coagulation factor II (thrombin) receptor-like 1, tandem duplicate 2

AlphaFold DB , UniProt , Accession A0A087YQS3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 381 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.9	Very low	46.2	Very low	226 Å²	226	108.9 Å²	108.9	100%	1.113	55%	0.55	S	S	*	*				0	102.7	0	-98.5	163.6	58.4	0	0	107	S3	M1-S3 PolarHBondContact O-N 2.89Å
2	D	43.6	Very low	46.7	Very low	122 Å²	122	108.3 Å²	108.3	65%	0.652	56%	0.555	S	S	*	*			trans	-67.4	125.9	-167.8	-74.2	-40.8	0	0	0	112.3	K4 W5	D2-K4 PolarHBondContact O-N 3.49Å; D2-W5 PolarHBondContact O-N 2.97Å
3	S	39.6	Very low	47	Very low	93 Å²	93	104.5 Å²	104.5	65%	0.65	54%	0.536	S	S	*	.	H	α-helix	trans	-47.8	-28.7	172.2	177.4	0	0	0	0	112.9	M1 W5 I6 L7	M1-S3 PolarHBondContact O-N 2.89Å; S3-W5 PolarHBondContact O-N 3.39Å; S3-I6 PolarHBondContact O-N 3.03Å; S3-L7 WeakPolarHBondContact O-CB 3.31Å; S3-L7 PolarHBondContact O-N 2.8Å
4	K	46.6	Very low	46.9	Very low	167 Å²	167	97.6 Å²	97.6	73%	0.726	50%	0.503	S	S	*	.	H	α-helix	trans	-61.4	-37.1	176.4	-64.1	-175	178.5	-178.2	0	113.6	D2 S8	D2-K4 PolarHBondContact O-N 3.49Å; K4-S8 WeakPolarHBondContact O-CB 3.27Å; K4-S8 PolarHBondContact O-N 3.15Å; K4-S8 PolarHBondContact O-OG 3.15Å; K4-S8 VanDerWaalsContact O-OG 3.07Å
5	W	47.5	Very low	46.7	Very low	198 Å²	198	96.9 Å²	96.9	75%	0.75	51%	0.509	S	S	*	.	H	α-helix	trans	-72.5	-39	-179.3	-110.3	96.7	0	0	0	112.3	D2 S3 S8 L9	D2-W5 PolarHBondContact O-N 2.97Å; S3-W5 PolarHBondContact O-N 3.39Å; W5-S8 PolarHBondContact O-N 3.26Å; W5-L9 WeakPolarHBondContact O-CB 3.43Å; W5-L9 PolarHBondContact O-N 3.37Å
6	I	47.6	Very low	46.7	Very low	92 Å²	92	95.3 Å²	95.3	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-43.1	175.3	-63	173.1	0	0	0	109.5	S3 S8 L9 L10	S3-I6 PolarHBondContact O-N 3.03Å; I6-S8 PolarHBondContact O-N 3.3Å; I6-L9 PolarHBondContact O-N 2.69Å; I6-L10 HydrophobicContact CG2-CD1 3.71Å; I6-L10 HydrophobicContact CG2-CG 4.3Å; I6-L10 WeakPolarHBondContact O-CB 3.42Å; I6-L10 WeakPolarHBondContact O-CG 3.43Å; I6-L10 PolarHBondContact O-N 3.22Å
7	L	46.3	Very low	46.5	Very low	63 Å²	63	96.3 Å²	96.3	33%	0.33	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.3	-151.5	81.3	0	0	0	111.7	S3 L10 L11 V295	S3-L7 WeakPolarHBondContact O-CB 3.31Å; S3-L7 PolarHBondContact O-N 2.8Å; L7-L10 PolarHBondContact O-N 2.92Å; L7-L11 HydrophobicContact CG-CD1 4.33Å; L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 VanDerWaalsContact O-CG 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.39Å; L7-V295 HydrophobicContact CD1-CG1 4.17Å; L7-V295 HydrophobicContact CD1-CG2 4.24Å
8	S	47.4	Very low	46.2	Very low	66 Å²	66	93.4 Å²	93.4	46%	0.462	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-41	176.2	-67.1	0	0	0	0	112.6	K4 W5 I6 L11 V12	K4-S8 WeakPolarHBondContact O-CB 3.27Å; K4-S8 PolarHBondContact O-N 3.15Å; K4-S8 PolarHBondContact O-OG 3.15Å; K4-S8 VanDerWaalsContact O-OG 3.07Å; W5-S8 PolarHBondContact O-N 3.26Å; I6-S8 PolarHBondContact O-N 3.3Å; S8-L11 PolarHBondContact O-N 3.26Å; S8-V12 WeakPolarHBondContact O-CB 3.44Å; S8-V12 WeakPolarHBondContact O-CG2 3.05Å; S8-V12 PolarHBondContact O-N 2.98Å
9	L	49.7	Very low	45.7	Very low	100 Å²	100	94.8 Å²	94.8	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-42	177.2	-165	81	0	0	0	111.4	W5 I6 V12 I13	W5-L9 WeakPolarHBondContact O-CB 3.43Å; W5-L9 PolarHBondContact O-N 3.37Å; I6-L9 PolarHBondContact O-N 2.69Å; L9-V12 PolarHBondContact O-N 3.28Å; L9-I13 HydrophobicContact CD2-CD1 4.46Å; L9-I13 HydrophobicContact CG-CD1 4.12Å; L9-I13 WeakPolarHBondContact O-CB 2.79Å; L9-I13 VanDerWaalsContact O-CG1 3.23Å; L9-I13 WeakPolarHBondContact O-CG1 3.48Å; L9-I13 PolarHBondContact O-N 3.21Å
10	L	49.2	Very low	45.3	Very low	20 Å²	20	98.2 Å²	98.2	11%	0.105	53%	0.533	C	S	.	.	H	α-helix	trans	-67.3	-37.4	176.8	-70.4	168.1	0	0	0	112.3	I6 L7 G14 V291	I6-L10 HydrophobicContact CG2-CD1 3.71Å; I6-L10 HydrophobicContact CG2-CG 4.3Å; I6-L10 WeakPolarHBondContact O-CB 3.42Å; I6-L10 WeakPolarHBondContact O-CG 3.43Å; I6-L10 PolarHBondContact O-N 3.22Å; L7-L10 PolarHBondContact O-N 2.92Å; L10-G14 PolarHBondContact O-N 3.4Å; L10-V291 HydrophobicContact CD1-CG1 3.63Å; L10-V291 HydrophobicContact CD2-CG1 3.9Å; L10-V291 HydrophobicContact CG-CG1 4.25Å
11	L	50.3	Low	44.8	Very low	51 Å²	51	96.3 Å²	96.3	27%	0.267	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-43.4	173.4	-80.7	162.2	0	0	0	111.6	L7 S8 G14 C15 V295	L7-L11 HydrophobicContact CG-CD1 4.33Å; L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 VanDerWaalsContact O-CG 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.39Å; S8-L11 PolarHBondContact O-N 3.26Å; L11-G14 PolarHBondContact O-N 3.38Å; L11-C15 WeakPolarHBondContact O-CB 3.25Å; L11-C15 PolarHBondContact O-N 3.19Å; L11-C15 PolarHBondContact O-SG 3.01Å; L11-C15 VanDerWaalsContact O-SG 3.34Å; L11-V295 HydrophobicContact CD2-CG1 4.42Å
12	V	52	Low	44.5	Very low	101 Å²	101	94.3 Å²	94.3	61%	0.612	52%	0.519	S	S	*	.	H	α-helix	trans	-64.9	-42.8	177.7	170.3	0	0	0	0	111.2	S8 L9 A16	S8-V12 WeakPolarHBondContact O-CB 3.44Å; S8-V12 WeakPolarHBondContact O-CG2 3.05Å; S8-V12 PolarHBondContact O-N 2.98Å; L9-V12 PolarHBondContact O-N 3.28Å; V12-A16 PolarHBondContact O-N 2.98Å; V12-A16 VanDerWaalsContact O-N 3.16Å
13	I	50.2	Low	44.3	Very low	60 Å²	60	89.5 Å²	89.5	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-44.1	176	-67.5	168.8	0	0	0	110.4	L9 C15 A16 F17 I288	L9-I13 HydrophobicContact CD2-CD1 4.46Å; L9-I13 HydrophobicContact CG-CD1 4.12Å; L9-I13 WeakPolarHBondContact O-CB 2.79Å; L9-I13 VanDerWaalsContact O-CG1 3.23Å; L9-I13 WeakPolarHBondContact O-CG1 3.48Å; L9-I13 PolarHBondContact O-N 3.21Å; I13-C15 PolarHBondContact O-N 2.84Å; I13-A16 PolarHBondContact O-N 3.04Å; I13-F17 HydrophobicContact CG2-CD2 3.98Å; I13-F17 HydrophobicContact CG2-CE2 3.76Å; I13-F17 WeakPolarHBondContact O-CD2 3.47Å; I13-F17 PolarHBondContact O-N 2.88Å; I13-I288 HydrophobicContact CG2-CD1 4.17Å; I13-I288 HydrophobicContact CG2-CG2 3.97Å
14	G	45.8	Very low	44.6	Very low	7 Å²	7	93 Å²	93	7%	0.072	50%	0.498	C	S	.	.	H	α-helix	trans	-60.8	-43.6	176.9	0	0	0	0	0	113.4	L10 L11 A16 F17 A18	L10-G14 PolarHBondContact O-N 3.4Å; L11-G14 PolarHBondContact O-N 3.38Å; G14-A16 VanDerWaalsContact C-N 3.32Å; G14-A16 PolarHBondContact O-N 3.28Å; G14-F17 PolarHBondContact O-N 3.13Å; G14-A18 WeakPolarHBondContact O-CB 3.39Å; G14-A18 PolarHBondContact O-N 2.8Å; G14-A18 VanDerWaalsContact O-N 3.11Å
15	C	44.1	Very low	45	Very low	88 Å²	88	85.6 Å²	85.6	60%	0.595	47%	0.467	S	S	*	.	H	α-helix	trans	-64.4	-33.5	176.3	-75.5	0	0	0	0	113	L11 I13 F17 A18	L11-C15 WeakPolarHBondContact O-CB 3.25Å; L11-C15 PolarHBondContact O-N 3.19Å; L11-C15 PolarHBondContact O-SG 3.01Å; L11-C15 VanDerWaalsContact O-SG 3.34Å; I13-C15 PolarHBondContact O-N 2.84Å; C15-F17 VanDerWaalsContact C-N 3.3Å; C15-F17 PolarHBondContact O-N 3.36Å; C15-A18 PolarHBondContact O-N 3.22Å
16	A	46.8	Very low	45.6	Very low	70 Å²	70	76.4 Å²	76.4	58%	0.579	43%	0.432	S	S	*	.	H	α-helix	trans	-69.2	-27.2	178.2	0	0	0	0	0	113.2	V12 I13 G14	V12-A16 PolarHBondContact O-N 2.98Å; V12-A16 VanDerWaalsContact O-N 3.16Å; I13-A16 PolarHBondContact O-N 3.04Å; G14-A16 VanDerWaalsContact C-N 3.32Å; G14-A16 PolarHBondContact O-N 3.28Å
17	F	43.7	Very low	46.5	Very low	113 Å²	113	74.3 Å²	74.3	50%	0.496	42%	0.421	S	S	.	.	H	α-helix	trans	-95.2	-14	177.6	-68.9	-69.2	0	0	0	114	I13 G14 C15 V19 I288	I13-F17 HydrophobicContact CG2-CD2 3.98Å; I13-F17 HydrophobicContact CG2-CE2 3.76Å; I13-F17 WeakPolarHBondContact O-CD2 3.47Å; I13-F17 PolarHBondContact O-N 2.88Å; G14-F17 PolarHBondContact O-N 3.13Å; C15-F17 VanDerWaalsContact C-N 3.3Å; C15-F17 PolarHBondContact O-N 3.36Å; F17-V19 PolarHBondContact O-N 3.09Å; F17-I288 HydrophobicContact CE2-CD1 4.47Å
18	A	40.3	Very low	47.4	Very low	44 Å²	44	71.3 Å²	71.3	36%	0.364	41%	0.405	S	S	.	.			trans	-81.8	16.9	-179.4	0	0	0	0	0	114.6	G14 C15 N20	G14-A18 WeakPolarHBondContact O-CB 3.39Å; G14-A18 PolarHBondContact O-N 2.8Å; G14-A18 VanDerWaalsContact O-N 3.11Å; C15-A18 PolarHBondContact O-N 3.22Å; A18-N20 PolarHBondContact O-N 3.08Å; A18-N20 VanDerWaalsContact O-N 3.09Å
19	V	37.3	Very low	48.6	Very low	121 Å²	121	72.2 Å²	72.2	73%	0.733	40%	0.404	S	S	*	.			trans	-78	103.1	-177.3	-173.8	0	0	0	0	109	F17	F17-V19 PolarHBondContact O-N 3.09Å
20	N	36.8	Very low	49.8	Very low	161 Å²	161	73 Å²	73	86%	0.861	40%	0.403	S	S	*	.	S	Bend	trans	110.2	53.4	151.3	-141.6	29.3	0	0	0	119.1	A18	A18-N20 PolarHBondContact O-N 3.08Å; A18-N20 VanDerWaalsContact O-N 3.09Å
21	A	35.8	Very low	51.1	Low	59 Å²	59	73.3 Å²	73.3	49%	0.488	41%	0.406	S	S	.	.			trans	-143.5	142.7	158.1	0	0	0	0	0	111.5	R304	A21-R304 WeakPolarHBondContact O-CB 3.3Å; A21-R304 WeakPolarHBondContact O-CD 3.3Å
22	Q	33.1	Very low	52.2	Low	184 Å²	184	79.8 Å²	79.8	86%	0.86	44%	0.435	S	S	*	.			trans	-100	121.2	176	-78.5	169.8	-29.3	0	0	109.2
23	G	40.8	Very low	53.2	Low	21 Å²	21	80.4 Å²	80.4	22%	0.216	44%	0.435	C	S	.	.			trans	159.5	151	176.3	0	0	0	0	0	112.8
24	R	46.1	Very low	54.6	Low	168 Å²	168	78.2 Å²	78.2	63%	0.634	43%	0.428	S	S	*	.			trans	-80.5	159.4	173.2	-72.3	-178.9	173.4	179.6	-0.9	110	D38	R24-D38 HydrophobicContact CB-CB 4.34Å
25	S	53.9	Low	56.3	Low	11 Å²	11	77.9 Å²	77.9	8%	0.077	42%	0.424	C	S	.	.			trans	-63.7	162.3	-177.4	68.7	0	0	0	0	113.1	I27 D303	S25-I27 PolarHBondContact O-N 3.21Å; S25-I27 WeakPolarHBondContact OG-CD1 3.43Å; S25-I27 VanDerWaalsContact OG-CG1 3.22Å; S25-I27 WeakPolarHBondContact OG-CG1 3.48Å; S25-D303 PolarHBondContact N-O 3.04Å
26	F	60.8	Low	58	Low	4 Å²	4	76.1 Å²	76.1	2%	0.018	41%	0.411	C	S	.	.			trans	-72.9	50.2	169.4	-84.1	-96.3	0	0	0	112.6	G28 I37 A41 T44 L45 V205 I206 Y306	F26-G28 PolarHBondContact O-N 2.72Å; F26-I37 HydrophobicContact CE1-CD1 4.37Å; F26-A41 HydrophobicContact CB-CB 4.44Å; F26-A41 HydrophobicContact CD1-CB 3.29Å; F26-A41 HydrophobicContact CD2-CB 3.52Å; F26-A41 HydrophobicContact CE1-CB 3.26Å; F26-A41 WeakPolarHBondContact CE1-O 3.48Å; F26-A41 HydrophobicContact CE2-CB 3.58Å; F26-A41 HydrophobicContact CG-CB 3.48Å; F26-A41 VanDerWaalsContact CG-CB 3.48Å; F26-A41 HydrophobicContact CZ-CB 3.54Å; F26-A41 WeakPolarHBondContact CZ-O 3.37Å; F26-T44 HydrophobicContact CE2-CG2 4.21Å; F26-T44 HydrophobicContact CZ-CG2 4.2Å; F26-L45 HydrophobicContact CD1-CD1 4.09Å; F26-L45 HydrophobicContact CD1-CG 4.45Å; F26-L45 HydrophobicContact CE1-CB 4.44Å; F26-L45 HydrophobicContact CE1-CD1 3.35Å; F26-L45 HydrophobicContact CE1-CD2 4.28Å; F26-L45 HydrophobicContact CE1-CG 3.39Å; F26-L45 HydrophobicContact CZ-CD1 4.23Å; F26-L45 HydrophobicContact CZ-CG 3.75Å; F26-V205 HydrophobicContact CD1-CG2 4.05Å; F26-I206 PolarHBondContact O-N 3.49Å; F26-Y306 HydrophobicContact CB-CD2 3.91Å; F26-Y306 HydrophobicContact CB-CE1 4.32Å; F26-Y306 HydrophobicContact CB-CE2 3.59Å; F26-Y306 HydrophobicContact CB-CG 4.38Å; F26-Y306 HydrophobicContact CD1-CE1 4.39Å; F26-Y306 AromaticContact CD2-CD1 3Å; F26-Y306 HydrophobicContact CD2-CD1 3Å; F26-Y306 AromaticContact CD2-CD2 3.75Å; F26-Y306 HydrophobicContact CD2-CD2 3.75Å; F26-Y306 AromaticContact CD2-CE1 3.07Å; F26-Y306 HydrophobicContact CD2-CE1 3.07Å; F26-Y306 AromaticContact CD2-CE2 3.81Å; F26-Y306 HydrophobicContact CD2-CE2 3.81Å; F26-Y306 AromaticContact CD2-CG 3.33Å; F26-Y306 HydrophobicContact CD2-CG 3.33Å; F26-Y306 AromaticContact CD2-CZ 3.48Å; F26-Y306 VanDerWaalsContact CD2-CZ 3.48Å; F26-Y306 HydrophobicContact CE1-CE1 4.43Å; F26-Y306 AromaticContact CE2-CD1 3.06Å; F26-Y306 HydrophobicContact CE2-CD1 3.06Å; F26-Y306 AromaticContact CE2-CE1 3.06Å; F26-Y306 HydrophobicContact CE2-CE1 3.06Å; F26-Y306 AromaticContact CE2-CG 3.88Å; F26-Y306 HydrophobicContact CE2-CG 3.88Å; F26-Y306 AromaticContact CE2-CZ 3.89Å; F26-Y306 HydrophobicContact CG-CD1 4.01Å; F26-Y306 HydrophobicContact CG-CD2 4.2Å; F26-Y306 AromaticContact CG-CE1 3.7Å; F26-Y306 HydrophobicContact CG-CE1 3.7Å; F26-Y306 AromaticContact CG-CE2 3.91Å; F26-Y306 HydrophobicContact CG-CE2 3.91Å; F26-Y306 HydrophobicContact CG-CG 4.23Å; F26-Y306 AromaticContact CG-CZ 3.62Å; F26-Y306 HydrophobicContact CZ-CD1 4.14Å; F26-Y306 AromaticContact CZ-CE1 3.73Å; F26-Y306 HydrophobicContact CZ-CE1 3.73Å
27	I	66.9	Low	59.6	Low	48 Å²	48	74.1 Å²	74.1	25%	0.246	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.2	164.7	-79.7	172	0	0	0	107.2	S25 I208 V297	S25-I27 PolarHBondContact O-N 3.21Å; S25-I27 WeakPolarHBondContact OG-CD1 3.43Å; S25-I27 VanDerWaalsContact OG-CG1 3.22Å; S25-I27 WeakPolarHBondContact OG-CG1 3.48Å; I27-I208 HydrophobicContact CB-CD1 4.12Å; I27-I208 HydrophobicContact CD1-CD1 4.21Å; I27-I208 HydrophobicContact CG1-CD1 4.01Å; I27-I208 HydrophobicContact CG2-CD1 3.15Å; I27-I208 HydrophobicContact CG2-CG1 4.06Å; I27-V297 HydrophobicContact CD1-CG1 4.43Å; I27-V297 HydrophobicContact CD1-CG2 4.26Å; I27-V297 HydrophobicContact CG1-CG2 4.36Å
28	G	64.3	Low	61.3	Low	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	117.3	174.5	0	0	0	0	0	111.3	F26 T35 T36 I206 V207 I208	F26-G28 PolarHBondContact O-N 2.72Å; G28-T35 VanDerWaalsContact C-CG2 3.5Å; G28-T36 CarbonylContact C-O 3.6Å; G28-T36 VanDerWaalsContact CA-O 3.26Å; G28-T36 WeakPolarHBondContact CA-O 3.32Å; G28-I206 PolarHBondContact N-O 3.25Å; G28-V207 CarbonylContact O-C 3.49Å; G28-V207 WeakPolarHBondContact O-CA 3.38Å; G28-I208 PolarHBondContact O-N 3.42Å
29	I	72.8	Confident	63.1	Low	85 Å²	85	75.3 Å²	75.3	44%	0.436	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	115.7	172.1	-56.3	172.4	0	0	0	107.9	T31 T35 T36	I29-T31 PolarHBondContact O-N 2.97Å; I29-T35 WeakPolarHBondContact O-CA 3.38Å; I29-T36 PolarHBondContact N-O 3.22Å; I29-T36 PolarHBondContact O-N 2.95Å; I29-T36 PolarHBondContact O-OG1 3.45Å; I29-T36 VanDerWaalsContact O-OG1 3.05Å
30	K	75.9	Confident	65.1	Low	117 Å²	117	72.7 Å²	72.7	51%	0.509	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.6	176.4	-161.4	171	-177.1	172.2	0	109.1	V207 I208 Q210	K30-V207 HydrophobicContact CB-CG1 3.73Å; K30-V207 HydrophobicContact CD-CG1 4.02Å; K30-V207 HydrophobicContact CG-CG1 4.15Å; K30-I208 WeakPolarHBondContact CB-O 3.31Å; K30-I208 PolarHBondContact N-O 3.02Å; K30-Q210 WeakPolarHBondContact O-CB 3.49Å; K30-Q210 WeakPolarHBondContact O-CG 3.27Å
31	T	75.7	Confident	67	Low	27 Å²	27	65 Å²	65	17%	0.166	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	166.7	171.9	68.5	0	0	0	0	109.9	I29 D33 G34 T36 Q210	I29-T31 PolarHBondContact O-N 2.97Å; T31-D33 PolarHBondContact O-N 3.47Å; T31-D33 VanDerWaalsContact O-N 3.13Å; T31-G34 CarbonylContact C-O 3.56Å; T31-G34 WeakPolarHBondContact CA-O 3.47Å; T31-G34 WeakPolarHBondContact CB-O 3.28Å; T31-G34 PolarHBondContact N-O 3.1Å; T31-G34 PolarHBondContact O-N 3.39Å; T31-G34 PolarHBondContact OG1-O 3.46Å; T31-T36 HydrophobicContact CG2-CG2 3.96Å; T31-Q210 VanDerWaalsContact CA-OE1 3.31Å
32	E	72.9	Confident	69.3	Low	186 Å²	186	64.1 Å²	64.1	87%	0.869	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.9	177.4	-67.8	-174.4	165.3	0	0	113.2
33	D	74.3	Confident	71.7	Confident	114 Å²	114	58.1 Å²	58.1	61%	0.61	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	1.8	-179	-51.2	-51.5	0	0	0	114.6	T31 K195	T31-D33 PolarHBondContact O-N 3.47Å; T31-D33 VanDerWaalsContact O-N 3.13Å; D33-K195 HydrophobicContact CB-CD 4.31Å; D33-K195 WeakPolarHBondContact OD2-CE 3.15Å; D33-K195 IonicContact OD2-NZ 2.8Å; D33-K195 PolarHBondContact OD2-NZ 3Å
34	G	79.5	Confident	73.8	Confident	15 Å²	15	58.5 Å²	58.5	16%	0.155	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.4	-173.1	-174.3	0	0	0	0	0	113.8	T31	T31-G34 CarbonylContact C-O 3.56Å; T31-G34 WeakPolarHBondContact CA-O 3.47Å; T31-G34 WeakPolarHBondContact CB-O 3.28Å; T31-G34 PolarHBondContact N-O 3.1Å; T31-G34 PolarHBondContact O-N 3.39Å; T31-G34 PolarHBondContact OG1-O 3.46Å
35	T	81.4	Confident	75.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.6	-176.6	-69.2	0	0	0	0	111.9	G28 I29 I37 T192 K193 I194 K195 V205	G28-T35 VanDerWaalsContact C-CG2 3.5Å; I29-T35 WeakPolarHBondContact O-CA 3.38Å; T35-I37 HydrophobicContact CG2-CG2 4.19Å; T35-T192 WeakPolarHBondContact CB-OG1 3.25Å; T35-T192 HydrophobicContact CG2-CG2 4.31Å; T35-T192 PolarHBondContact OG1-OG1 3.38Å; T35-K193 PolarHBondContact N-O 3.26Å; T35-I194 HydrophobicContact CG2-CD1 4.41Å; T35-I194 WeakPolarHBondContact O-CA 3.32Å; T35-K195 PolarHBondContact O-N 3.26Å; T35-V205 HydrophobicContact CG2-CG1 4.29Å
36	T	80	Confident	77.1	Confident	51 Å²	51	55.7 Å²	55.7	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.5	173.1	54.4	0	0	0	0	110.2	G28 I29 T31 K195	G28-T36 CarbonylContact C-O 3.6Å; G28-T36 VanDerWaalsContact CA-O 3.26Å; G28-T36 WeakPolarHBondContact CA-O 3.32Å; I29-T36 PolarHBondContact N-O 3.22Å; I29-T36 PolarHBondContact O-N 2.95Å; I29-T36 PolarHBondContact O-OG1 3.45Å; I29-T36 VanDerWaalsContact O-OG1 3.05Å; T31-T36 HydrophobicContact CG2-CG2 3.96Å; T36-K195 HydrophobicContact CG2-CB 4.02Å; T36-K195 HydrophobicContact CG2-CD 3.61Å; T36-K195 HydrophobicContact CG2-CG 4.37Å
37	I	79.4	Confident	78.5	Confident	28 Å²	28	57.2 Å²	57.2	14%	0.144	31%	0.309	C	S	.	.			trans	-128.5	160	179.1	59.6	172.5	0	0	0	109.8	F26 T35 A41 L42 L45 I194 V205	F26-I37 HydrophobicContact CE1-CD1 4.37Å; T35-I37 HydrophobicContact CG2-CG2 4.19Å; I37-A41 HydrophobicContact CB-CB 4.45Å; I37-A41 HydrophobicContact CD1-CB 4.45Å; I37-L42 HydrophobicContact CD1-CB 3.91Å; I37-L42 HydrophobicContact CD1-CD1 4.04Å; I37-L42 HydrophobicContact CG1-CB 4.2Å; I37-L45 HydrophobicContact CD1-CD1 4.01Å; I37-I194 HydrophobicContact CD1-CD1 4.28Å; I37-I194 HydrophobicContact CD1-CG1 4.5Å; I37-I194 HydrophobicContact CD1-CG2 3.9Å; I37-I194 HydrophobicContact CG1-CG2 3.98Å; I37-I194 HydrophobicContact CG2-CD1 4.01Å; I37-V205 HydrophobicContact CG2-CG1 3.88Å; I37-V205 HydrophobicContact CG2-CG2 4.49Å
38	D	79.7	Confident	79.6	Confident	52 Å²	52	57 Å²	57	28%	0.278	32%	0.319	S	S	.	.			trans	-62.3	151.1	176.2	-171	72.3	0	0	0	112.3	R24 V40 A41 L42	R24-D38 HydrophobicContact CB-CB 4.34Å; D38-V40 VanDerWaalsContact C-N 3.3Å; D38-V40 PolarHBondContact O-N 3.09Å; D38-V40 WeakPolarHBondContact OD2-CB 3.33Å; D38-V40 PolarHBondContact OD2-N 2.69Å; D38-A41 HydrophobicContact CB-CB 4.14Å; D38-A41 WeakPolarHBondContact O-CA 3.5Å; D38-A41 VanDerWaalsContact O-CB 3.25Å; D38-A41 WeakPolarHBondContact O-CB 3.32Å; D38-A41 PolarHBondContact O-N 3.01Å; D38-A41 VanDerWaalsContact O-N 3.13Å; D38-L42 PolarHBondContact O-N 2.61Å
39	D	78.9	Confident	80.7	Confident	129 Å²	129	59.7 Å²	59.7	69%	0.69	33%	0.333	S	S	*	.	H	α-helix	trans	-63.8	-35.6	-177.7	-70.4	-34.6	0	0	0	112.2	A41 L42 A43	D39-A41 VanDerWaalsContact C-N 3.29Å; D39-A41 PolarHBondContact O-N 3.05Å; D39-L42 PolarHBondContact O-N 3.47Å; D39-A43 VanDerWaalsContact O-CB 3.31Å; D39-A43 WeakPolarHBondContact O-CB 3.24Å; D39-A43 PolarHBondContact O-N 3.42Å
40	V	77.6	Confident	81.6	Confident	66 Å²	66	55.8 Å²	55.8	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-67.4	-37.2	176.9	-178	0	0	0	0	110.6	D38 T44	D38-V40 VanDerWaalsContact C-N 3.3Å; D38-V40 PolarHBondContact O-N 3.09Å; D38-V40 WeakPolarHBondContact OD2-CB 3.33Å; D38-V40 PolarHBondContact OD2-N 2.69Å; V40-T44 WeakPolarHBondContact O-CB 3.39Å; V40-T44 PolarHBondContact O-N 3.38Å; V40-T44 PolarHBondContact O-OG1 2.97Å
41	A	77.8	Confident	82.4	Confident	1 Å²	1	52 Å²	52	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-63.4	-53	173.5	0	0	0	0	0	110.7	F26 I37 D38 D39 A43 T44 L45	F26-A41 HydrophobicContact CB-CB 4.44Å; F26-A41 HydrophobicContact CD1-CB 3.29Å; F26-A41 HydrophobicContact CD2-CB 3.52Å; F26-A41 HydrophobicContact CE1-CB 3.26Å; F26-A41 WeakPolarHBondContact CE1-O 3.48Å; F26-A41 HydrophobicContact CE2-CB 3.58Å; F26-A41 HydrophobicContact CG-CB 3.48Å; F26-A41 VanDerWaalsContact CG-CB 3.48Å; F26-A41 HydrophobicContact CZ-CB 3.54Å; F26-A41 WeakPolarHBondContact CZ-O 3.37Å; I37-A41 HydrophobicContact CB-CB 4.45Å; I37-A41 HydrophobicContact CD1-CB 4.45Å; D38-A41 HydrophobicContact CB-CB 4.14Å; D38-A41 WeakPolarHBondContact O-CA 3.5Å; D38-A41 VanDerWaalsContact O-CB 3.25Å; D38-A41 WeakPolarHBondContact O-CB 3.32Å; D38-A41 PolarHBondContact O-N 3.01Å; D38-A41 VanDerWaalsContact O-N 3.13Å; D39-A41 VanDerWaalsContact C-N 3.29Å; D39-A41 PolarHBondContact O-N 3.05Å; A41-A43 VanDerWaalsContact C-N 3.29Å; A41-A43 PolarHBondContact O-N 3.37Å; A41-T44 PolarHBondContact O-N 3.45Å; A41-L45 PolarHBondContact O-N 2.97Å
42	L	83.1	Confident	83.1	Confident	40 Å²	40	54.6 Å²	54.6	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-56.5	-43.9	177	-175.8	61.2	0	0	0	112.2	I37 D38 D39 T44 L45 Q46 I194 T197	I37-L42 HydrophobicContact CD1-CB 3.91Å; I37-L42 HydrophobicContact CD1-CD1 4.04Å; I37-L42 HydrophobicContact CG1-CB 4.2Å; D38-L42 PolarHBondContact O-N 2.61Å; D39-L42 PolarHBondContact O-N 3.47Å; L42-T44 VanDerWaalsContact C-N 3.32Å; L42-T44 PolarHBondContact O-N 3Å; L42-L45 PolarHBondContact O-N 2.83Å; L42-Q46 WeakPolarHBondContact O-CG 3.41Å; L42-Q46 PolarHBondContact O-N 2.79Å; L42-I194 HydrophobicContact CD1-CG2 4.32Å; L42-T197 HydrophobicContact CD1-CG2 4.08Å
43	A	84.3	Confident	84.1	Confident	57 Å²	57	49.7 Å²	49.7	47%	0.471	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-38.2	176.2	0	0	0	0	0	112.5	D39 A41 Q46 S47	D39-A43 VanDerWaalsContact O-CB 3.31Å; D39-A43 WeakPolarHBondContact O-CB 3.24Å; D39-A43 PolarHBondContact O-N 3.42Å; A41-A43 VanDerWaalsContact C-N 3.29Å; A41-A43 PolarHBondContact O-N 3.37Å; A43-Q46 CarbonylContact O-C 3.56Å; A43-Q46 PolarHBondContact O-N 2.71Å; A43-S47 WeakPolarHBondContact O-CB 3.25Å; A43-S47 PolarHBondContact O-N 2.85Å
44	T	83.9	Confident	85	Confident	29 Å²	29	44.5 Å²	44.5	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-68.8	-40.3	177.4	-59.7	0	0	0	0	111.6	F26 V40 A41 L42 Q46 S47 T50 I310	F26-T44 HydrophobicContact CE2-CG2 4.21Å; F26-T44 HydrophobicContact CZ-CG2 4.2Å; V40-T44 WeakPolarHBondContact O-CB 3.39Å; V40-T44 PolarHBondContact O-N 3.38Å; V40-T44 PolarHBondContact O-OG1 2.97Å; A41-T44 PolarHBondContact O-N 3.45Å; L42-T44 VanDerWaalsContact C-N 3.32Å; L42-T44 PolarHBondContact O-N 3Å; T44-Q46 PolarHBondContact O-N 3.19Å; T44-S47 WeakPolarHBondContact O-CB 3.02Å; T44-S47 PolarHBondContact O-N 2.77Å; T44-S47 PolarHBondContact O-OG 3.06Å; T44-T50 WeakPolarHBondContact O-CG2 3.34Å; T44-T50 PolarHBondContact O-OG1 3.01Å; T44-I310 HydrophobicContact CG2-CD1 3.84Å
45	L	84.3	Confident	85.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-27.9	172.1	-76.9	171.2	0	0	0	112.3	F26 I37 A41 L42 T50 N115 M199 T201 D204 V205	F26-L45 HydrophobicContact CD1-CD1 4.09Å; F26-L45 HydrophobicContact CD1-CG 4.45Å; F26-L45 HydrophobicContact CE1-CB 4.44Å; F26-L45 HydrophobicContact CE1-CD1 3.35Å; F26-L45 HydrophobicContact CE1-CD2 4.28Å; F26-L45 HydrophobicContact CE1-CG 3.39Å; F26-L45 HydrophobicContact CZ-CD1 4.23Å; F26-L45 HydrophobicContact CZ-CG 3.75Å; I37-L45 HydrophobicContact CD1-CD1 4.01Å; A41-L45 PolarHBondContact O-N 2.97Å; L42-L45 PolarHBondContact O-N 2.83Å; L45-T50 PolarHBondContact O-OG1 2.87Å; L45-N115 HydrophobicContact CD2-CB 4.32Å; L45-N115 PolarHBondContact O-ND2 3.46Å; L45-M199 HydrophobicContact CB-CE 4.05Å; L45-M199 HydrophobicContact CD1-CE 3.5Å; L45-M199 VanDerWaalsContact CD1-CE 3.5Å; L45-M199 HydrophobicContact CG-CE 4.23Å; L45-T201 HydrophobicContact CD1-CG2 3.9Å; L45-D204 HydrophobicContact CD2-CB 4.23Å; L45-V205 HydrophobicContact CD1-CG2 4.28Å
46	Q	86.6	Confident	86.5	Confident	119 Å²	119	48.7 Å²	48.7	56%	0.556	28%	0.282	S	S	*	.	H	α-helix	trans	-92	-6.3	177	-67.1	178.3	-18.7	0	0	113.2	L42 A43 T44	L42-Q46 WeakPolarHBondContact O-CG 3.41Å; L42-Q46 PolarHBondContact O-N 2.79Å; A43-Q46 CarbonylContact O-C 3.56Å; A43-Q46 PolarHBondContact O-N 2.71Å; T44-Q46 PolarHBondContact O-N 3.19Å
47	S	88.8	Confident	87.3	Confident	36 Å²	36	47.7 Å²	47.7	25%	0.252	27%	0.274	S	S	.	.	S	Bend	trans	-71.6	159.8	-175.8	74.9	0	0	0	0	113.1	A43 T44 L49 T50 T51	A43-S47 WeakPolarHBondContact O-CB 3.25Å; A43-S47 PolarHBondContact O-N 2.85Å; T44-S47 WeakPolarHBondContact O-CB 3.02Å; T44-S47 PolarHBondContact O-N 2.77Å; T44-S47 PolarHBondContact O-OG 3.06Å; S47-L49 PolarHBondContact O-N 2.64Å; S47-L49 VanDerWaalsContact O-N 3.15Å; S47-L49 WeakPolarHBondContact OG-CB 3.43Å; S47-L49 PolarHBondContact OG-N 2.92Å; S47-T50 PolarHBondContact O-N 3.04Å; S47-T50 PolarHBondContact O-OG1 3.13Å; S47-T51 PolarHBondContact O-N 3.2Å; S47-T51 VanDerWaalsContact O-N 3.15Å; S47-T51 PolarHBondContact O-OG1 3.05Å
48	G	89.8	Confident	88.1	Confident	44 Å²	44	46.5 Å²	46.5	45%	0.454	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-16.2	171.9	0	0	0	0	0	114.1	V52 F53	G48-V52 WeakPolarHBondContact O-CA 3.46Å; G48-V52 VanDerWaalsContact O-CB 3.27Å; G48-V52 WeakPolarHBondContact O-CB 3.31Å; G48-V52 PolarHBondContact O-N 3.36Å; G48-F53 PolarHBondContact O-N 2.95Å
49	L	89.1	Confident	88.9	Confident	55 Å²	55	47 Å²	47	29%	0.288	27%	0.273	S	S	.	.	I	π-helix	trans	-62.1	-50.2	174.8	178.1	66.2	0	0	0	110.7	S47 F53 F54 I310	S47-L49 PolarHBondContact O-N 2.64Å; S47-L49 VanDerWaalsContact O-N 3.15Å; S47-L49 WeakPolarHBondContact OG-CB 3.43Å; S47-L49 PolarHBondContact OG-N 2.92Å; L49-F53 HydrophobicContact CD1-CB 4.45Å; L49-F53 HydrophobicContact CD1-CD1 3.73Å; L49-F53 HydrophobicContact CD1-CE1 4.43Å; L49-F53 HydrophobicContact CD1-CG 4.38Å; L49-F53 WeakPolarHBondContact O-CB 3.45Å; L49-F53 PolarHBondContact O-N 3.22Å; L49-F54 HydrophobicContact CD1-CE1 4.04Å; L49-F54 HydrophobicContact CG-CE1 4.04Å; L49-F54 HydrophobicContact CG-CZ 4.35Å; L49-F54 WeakPolarHBondContact O-CD1 3.45Å; L49-F54 PolarHBondContact O-N 3.5Å; L49-I310 HydrophobicContact CD2-CD1 4.22Å
50	T	90.3	Very high	89.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	26%	0.261	C	S	.	.	I	π-helix	trans	-85.8	-34.5	-176.9	57.4	0	0	0	0	112	T44 L45 S47 F54 P55 H111 N115 I310	T44-T50 WeakPolarHBondContact O-CG2 3.34Å; T44-T50 PolarHBondContact O-OG1 3.01Å; L45-T50 PolarHBondContact O-OG1 2.87Å; S47-T50 PolarHBondContact O-N 3.04Å; S47-T50 PolarHBondContact O-OG1 3.13Å; T50-F54 HydrophobicContact CG2-CD2 4.29Å; T50-F54 HydrophobicContact CG2-CE2 3.99Å; T50-P55 VanDerWaalsContact O-CD 3.24Å; T50-P55 WeakPolarHBondContact O-CD 3.35Å; T50-H111 WeakPolarHBondContact O-CB 3.32Å; T50-H111 PolarHBondContact O-ND1 2.82Å; T50-N115 WeakPolarHBondContact CB-ND2 3.38Å; T50-N115 PolarHBondContact OG1-ND2 2.95Å; T50-I310 HydrophobicContact CG2-CD1 3.76Å
51	T	92.4	Very high	90.7	Very high	37 Å²	37	41.1 Å²	41.1	23%	0.227	24%	0.242	C	C	.	.	I	π-helix	trans	-91.1	-14.2	-174	58.8	0	0	0	0	114.7	S47	S47-T51 PolarHBondContact O-N 3.2Å; S47-T51 VanDerWaalsContact O-N 3.15Å; S47-T51 PolarHBondContact O-OG1 3.05Å
52	V	92.3	Very high	91.7	Very high	82 Å²	82	43.9 Å²	43.9	50%	0.497	25%	0.254	S	S	.	.	I	π-helix	trans	-126.3	-57.7	179.5	-176.6	0	0	0	0	111.4	G48 P55 I56	G48-V52 WeakPolarHBondContact O-CA 3.46Å; G48-V52 VanDerWaalsContact O-CB 3.27Å; G48-V52 WeakPolarHBondContact O-CB 3.31Å; G48-V52 PolarHBondContact O-N 3.36Å; V52-P55 WeakPolarHBondContact O-CD 3.47Å; V52-I56 HydrophobicContact CG1-CD1 3.88Å; V52-I56 WeakPolarHBondContact O-CD1 3.3Å; V52-I56 VanDerWaalsContact O-CG1 3.28Å; V52-I56 WeakPolarHBondContact O-CG1 3.46Å; V52-I56 PolarHBondContact O-N 3.45Å
53	F	93.3	Very high	92.3	Very high	84 Å²	84	45.8 Å²	45.8	37%	0.368	27%	0.267	S	S	.	.	I	π-helix	trans	-64.9	-46.7	-173.9	175.2	-102.9	0	0	0	112.5	G48 L49 I56 I57	G48-F53 PolarHBondContact O-N 2.95Å; L49-F53 HydrophobicContact CD1-CB 4.45Å; L49-F53 HydrophobicContact CD1-CD1 3.73Å; L49-F53 HydrophobicContact CD1-CE1 4.43Å; L49-F53 HydrophobicContact CD1-CG 4.38Å; L49-F53 WeakPolarHBondContact O-CB 3.45Å; L49-F53 PolarHBondContact O-N 3.22Å; F53-I56 PolarHBondContact O-N 3.38Å; F53-I57 HydrophobicContact CD2-CG1 4.43Å; F53-I57 HydrophobicContact CE1-CG1 4.08Å; F53-I57 HydrophobicContact CE2-CD1 4.08Å; F53-I57 HydrophobicContact CE2-CG1 4Å; F53-I57 HydrophobicContact CZ-CD1 4.08Å; F53-I57 HydrophobicContact CZ-CG1 3.81Å; F53-I57 WeakPolarHBondContact O-CG1 3.42Å; F53-I57 PolarHBondContact O-N 3.11Å; F53-I57 VanDerWaalsContact O-N 3.09Å
54	F	93.8	Very high	92.9	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-50.3	177.4	-75.2	9.2	0	0	0	113.5	L49 T50 I56 I57 Y58 H111 I310 C314	L49-F54 HydrophobicContact CD1-CE1 4.04Å; L49-F54 HydrophobicContact CG-CE1 4.04Å; L49-F54 HydrophobicContact CG-CZ 4.35Å; L49-F54 WeakPolarHBondContact O-CD1 3.45Å; L49-F54 PolarHBondContact O-N 3.5Å; T50-F54 HydrophobicContact CG2-CD2 4.29Å; T50-F54 HydrophobicContact CG2-CE2 3.99Å; F54-I56 VanDerWaalsContact C-N 3.26Å; F54-I56 PolarHBondContact O-N 3.46Å; F54-I57 PolarHBondContact O-N 3.43Å; F54-Y58 HydrophobicContact CB-CD2 4.2Å; F54-Y58 HydrophobicContact CB-CE2 3.81Å; F54-Y58 HydrophobicContact CD2-CE2 4.42Å; F54-Y58 HydrophobicContact CG-CE2 4.34Å; F54-Y58 WeakPolarHBondContact O-CD2 3.4Å; F54-Y58 PolarHBondContact O-N 3.42Å; F54-H111 AromaticContact CD2-CE1 3.78Å; F54-I310 HydrophobicContact CE2-CB 4.01Å; F54-I310 HydrophobicContact CE2-CD1 4.13Å; F54-I310 HydrophobicContact CE2-CG1 4.32Å; F54-I310 HydrophobicContact CZ-CB 3.9Å; F54-I310 HydrophobicContact CZ-CD1 3.95Å; F54-I310 HydrophobicContact CZ-CG1 3.9Å; F54-I310 WeakPolarHBondContact CZ-O 3.36Å; F54-C314 HydrophobicContact CD1-CB 3.75Å; F54-C314 VanDerWaalsContact CD1-SG 3.54Å; F54-C314 HydrophobicContact CE1-CB 3.66Å; F54-C314 HydrophobicContact CE2-CB 4.44Å; F54-C314 HydrophobicContact CG-CB 4.22Å; F54-C314 HydrophobicContact CZ-CB 4.03Å
55	P	95.6	Very high	93.4	Very high	9 Å²	9	44.4 Å²	44.4	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-52.3	-41.4	172.9	-28.7	30.6	0	0	0	113.9	T50 V52 Y58 T59 I108 H111 V112	T50-P55 VanDerWaalsContact O-CD 3.24Å; T50-P55 WeakPolarHBondContact O-CD 3.35Å; V52-P55 WeakPolarHBondContact O-CD 3.47Å; P55-Y58 PolarHBondContact O-N 3.28Å; P55-T59 VanDerWaalsContact O-CB 3.28Å; P55-T59 WeakPolarHBondContact O-CB 3.26Å; P55-T59 PolarHBondContact O-N 3.06Å; P55-T59 PolarHBondContact O-OG1 3.16Å; P55-I108 HydrophobicContact CB-CG2 4.39Å; P55-H111 HydrophobicContact CG-CB 3.55Å; P55-V112 HydrophobicContact CB-CG2 3.85Å; P55-V112 HydrophobicContact CG-CG2 3.92Å
56	I	96.1	Very high	94	Very high	95 Å²	95	47.5 Å²	47.5	49%	0.487	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-49.9	178.8	-69	166	0	0	0	110	V52 F53 F54 T59 V60	V52-I56 HydrophobicContact CG1-CD1 3.88Å; V52-I56 WeakPolarHBondContact O-CD1 3.3Å; V52-I56 VanDerWaalsContact O-CG1 3.28Å; V52-I56 WeakPolarHBondContact O-CG1 3.46Å; V52-I56 PolarHBondContact O-N 3.45Å; F53-I56 PolarHBondContact O-N 3.38Å; F54-I56 VanDerWaalsContact C-N 3.26Å; F54-I56 PolarHBondContact O-N 3.46Å; I56-T59 WeakPolarHBondContact O-CB 3.42Å; I56-T59 PolarHBondContact O-N 3.41Å; I56-V60 WeakPolarHBondContact O-CG2 3.4Å; I56-V60 PolarHBondContact O-N 2.9Å
57	I	95.8	Very high	94.4	Very high	29 Å²	29	46.1 Å²	46.1	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-47.8	178.9	-63.2	-59.7	0	0	0	111	F53 F54 T59 V60 V61 L318	F53-I57 HydrophobicContact CD2-CG1 4.43Å; F53-I57 HydrophobicContact CE1-CG1 4.08Å; F53-I57 HydrophobicContact CE2-CD1 4.08Å; F53-I57 HydrophobicContact CE2-CG1 4Å; F53-I57 HydrophobicContact CZ-CD1 4.08Å; F53-I57 HydrophobicContact CZ-CG1 3.81Å; F53-I57 WeakPolarHBondContact O-CG1 3.42Å; F53-I57 PolarHBondContact O-N 3.11Å; F53-I57 VanDerWaalsContact O-N 3.09Å; F54-I57 PolarHBondContact O-N 3.43Å; I57-T59 VanDerWaalsContact C-N 3.27Å; I57-T59 PolarHBondContact O-N 3.25Å; I57-V60 WeakPolarHBondContact O-CB 3.22Å; I57-V60 PolarHBondContact O-N 2.74Å; I57-V60 VanDerWaalsContact O-N 3.13Å; I57-V61 HydrophobicContact CG2-CG2 4.42Å; I57-V61 WeakPolarHBondContact O-CG2 3.46Å; I57-V61 PolarHBondContact O-N 3.25Å; I57-L318 HydrophobicContact CG2-CD2 4.09Å; I57-L318 HydrophobicContact CG2-CG 4.25Å
58	Y	96.6	Very high	94.6	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-31.4	177.8	-63.9	-42	0	0	0	112.7	F54 P55 V61 F62 M104 K107 H111 S317	F54-Y58 HydrophobicContact CB-CD2 4.2Å; F54-Y58 HydrophobicContact CB-CE2 3.81Å; F54-Y58 HydrophobicContact CD2-CE2 4.42Å; F54-Y58 HydrophobicContact CG-CE2 4.34Å; F54-Y58 WeakPolarHBondContact O-CD2 3.4Å; F54-Y58 PolarHBondContact O-N 3.42Å; P55-Y58 PolarHBondContact O-N 3.28Å; Y58-V61 PolarHBondContact O-N 3.33Å; Y58-F62 WeakPolarHBondContact O-CB 3.28Å; Y58-F62 PolarHBondContact O-N 2.82Å; Y58-M104 HydrophobicContact CD1-SD 3.94Å; Y58-M104 HydrophobicContact CG-SD 4.34Å; Y58-K107 HydrophobicContact CD1-CD 4.5Å; Y58-K107 HydrophobicContact CD2-CD 4.2Å; Y58-K107 HydrophobicContact CD2-CG 4.34Å; Y58-K107 HydrophobicContact CE1-CD 4.14Å; Y58-K107 HydrophobicContact CE2-CD 3.83Å; Y58-K107 HydrophobicContact CE2-CG 4.18Å; Y58-K107 WeakPolarHBondContact OH-CE 3.4Å; Y58-K107 PolarHBondContact OH-NZ 3.31Å; Y58-H111 AromaticContact CD2-CD2 3.78Å; Y58-H111 AromaticContact CE2-CD2 3.45Å; Y58-H111 VanDerWaalsContact CE2-CD2 3.45Å; Y58-H111 WeakPolarHBondContact CE2-CD2 3.31Å; Y58-H111 AromaticContact CE2-NE2 3.42Å; Y58-H111 WeakPolarHBondContact CE2-NE2 3.47Å; Y58-S317 WeakPolarHBondContact CE1-OG 3.42Å
59	T	97.6	Very high	94.9	Very high	63 Å²	63	43 Å²	43	39%	0.387	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-44.1	172.6	-58.5	0	0	0	0	111.1	P55 I56 I57 V61 F62 V63	P55-T59 VanDerWaalsContact O-CB 3.28Å; P55-T59 WeakPolarHBondContact O-CB 3.26Å; P55-T59 PolarHBondContact O-N 3.06Å; P55-T59 PolarHBondContact O-OG1 3.16Å; I56-T59 WeakPolarHBondContact O-CB 3.42Å; I56-T59 PolarHBondContact O-N 3.41Å; I57-T59 VanDerWaalsContact C-N 3.27Å; I57-T59 PolarHBondContact O-N 3.25Å; T59-V61 VanDerWaalsContact C-N 3.34Å; T59-F62 PolarHBondContact O-N 3.01Å; T59-V63 WeakPolarHBondContact O-CG2 3.42Å; T59-V63 PolarHBondContact O-N 3.24Å
60	V	96.5	Very high	95.2	Very high	70 Å²	70	41.8 Å²	41.8	42%	0.424	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-46.3	173.8	172.4	0	0	0	0	110.5	I56 I57 F62 V63 V64	I56-V60 WeakPolarHBondContact O-CG2 3.4Å; I56-V60 PolarHBondContact O-N 2.9Å; I57-V60 WeakPolarHBondContact O-CB 3.22Å; I57-V60 PolarHBondContact O-N 2.74Å; I57-V60 VanDerWaalsContact O-N 3.13Å; V60-F62 VanDerWaalsContact C-N 3.29Å; V60-F62 PolarHBondContact O-N 3.19Å; V60-V63 PolarHBondContact O-N 3.28Å; V60-V64 HydrophobicContact CG1-CG2 4.11Å; V60-V64 WeakPolarHBondContact O-CB 3.22Å; V60-V64 WeakPolarHBondContact O-CG2 3.16Å; V60-V64 PolarHBondContact O-N 2.67Å
61	V	96.9	Very high	95.3	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-41.6	176.6	171.4	0	0	0	0	111.5	I57 Y58 T59 G65 F100 V101 M104 S317 L318	I57-V61 HydrophobicContact CG2-CG2 4.42Å; I57-V61 WeakPolarHBondContact O-CG2 3.46Å; I57-V61 PolarHBondContact O-N 3.25Å; Y58-V61 PolarHBondContact O-N 3.33Å; T59-V61 VanDerWaalsContact C-N 3.34Å; V61-G65 WeakPolarHBondContact O-CA 3.29Å; V61-G65 PolarHBondContact O-N 3.35Å; V61-F100 HydrophobicContact CG1-CE1 4.17Å; V61-V101 HydrophobicContact CG1-CG2 4.22Å; V61-M104 HydrophobicContact CG1-CG 4.32Å; V61-M104 HydrophobicContact CG1-SD 4.37Å; V61-S317 WeakPolarHBondContact CG1-O 3.45Å; V61-S317 WeakPolarHBondContact CG2-O 3.47Å; V61-L318 HydrophobicContact CG2-CD2 3.87Å; V61-L318 HydrophobicContact CG2-CG 4.46Å
62	F	97.9	Very high	95.4	Very high	59 Å²	59	42.2 Å²	42.2	26%	0.259	24%	0.241	S	C	.	.	H	α-helix	trans	-62.5	-54	177	178.4	-110.9	0	0	0	112.1	Y58 T59 V60 L66 V101 M104 P105 I108	Y58-F62 WeakPolarHBondContact O-CB 3.28Å; Y58-F62 PolarHBondContact O-N 2.82Å; T59-F62 PolarHBondContact O-N 3.01Å; V60-F62 VanDerWaalsContact C-N 3.29Å; V60-F62 PolarHBondContact O-N 3.19Å; F62-L66 HydrophobicContact CE2-CD2 3.97Å; F62-L66 HydrophobicContact CZ-CD2 3.87Å; F62-L66 WeakPolarHBondContact O-CB 3.4Å; F62-L66 PolarHBondContact O-N 2.94Å; F62-V101 HydrophobicContact CD2-CG1 3.81Å; F62-V101 WeakPolarHBondContact CD2-O 3.4Å; F62-M104 HydrophobicContact CB-CB 4.05Å; F62-M104 HydrophobicContact CD2-CB 4.19Å; F62-P105 HydrophobicContact CD2-CG 3.88Å; F62-P105 HydrophobicContact CE1-CG 4.45Å; F62-P105 HydrophobicContact CE2-CG 3.55Å; F62-P105 HydrophobicContact CG-CG 4.45Å; F62-P105 HydrophobicContact CZ-CG 3.87Å; F62-I108 HydrophobicContact CB-CD1 4.29Å
63	V	96.9	Very high	95.4	Very high	81 Å²	81	39.8 Å²	39.8	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-66	-50.3	-175.8	174.6	0	0	0	0	111.3	T59 V60 T67	T59-V63 WeakPolarHBondContact O-CG2 3.42Å; T59-V63 PolarHBondContact O-N 3.24Å; V60-V63 PolarHBondContact O-N 3.28Å; V63-T67 WeakPolarHBondContact O-CB 3.27Å; V63-T67 VanDerWaalsContact O-CG2 3.29Å; V63-T67 WeakPolarHBondContact O-CG2 3.3Å; V63-T67 PolarHBondContact O-N 3.43Å; V63-T67 PolarHBondContact O-OG1 3.42Å
64	V	95.7	Very high	95.4	Very high	57 Å²	57	41.6 Å²	41.6	35%	0.345	23%	0.229	S	C	.	.	H	α-helix	trans	-71.8	-47.6	-177.2	177.6	0	0	0	0	110.5	V60 L66 T67 A68 C321	V60-V64 HydrophobicContact CG1-CG2 4.11Å; V60-V64 WeakPolarHBondContact O-CB 3.22Å; V60-V64 WeakPolarHBondContact O-CG2 3.16Å; V60-V64 PolarHBondContact O-N 2.67Å; V64-L66 PolarHBondContact O-N 3.48Å; V64-T67 PolarHBondContact O-N 3.5Å; V64-T67 PolarHBondContact O-OG1 2.98Å; V64-A68 WeakPolarHBondContact O-CB 3.45Å; V64-A68 PolarHBondContact O-N 3.22Å; V64-C321 HydrophobicContact CG1-CB 4.05Å
65	G	95.8	Very high	95.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-45	-178.6	0	0	0	0	0	112.2	V61 N69	V61-G65 WeakPolarHBondContact O-CA 3.29Å; V61-G65 PolarHBondContact O-N 3.35Å; G65-N69 WeakPolarHBondContact O-CB 3.4Å; G65-N69 PolarHBondContact O-N 3.19Å; G65-N69 VanDerWaalsContact O-N 3.12Å; G65-N69 PolarHBondContact O-ND2 3.13Å
66	L	96.3	Very high	94.9	Very high	67 Å²	67	41 Å²	41	35%	0.351	23%	0.226	S	C	.	.	H	α-helix	trans	-66.3	-48.1	-179.6	-174	66.2	0	0	0	111.6	F62 V64 G70 L98 V101	F62-L66 HydrophobicContact CE2-CD2 3.97Å; F62-L66 HydrophobicContact CZ-CD2 3.87Å; F62-L66 WeakPolarHBondContact O-CB 3.4Å; F62-L66 PolarHBondContact O-N 2.94Å; V64-L66 PolarHBondContact O-N 3.48Å; L66-G70 WeakPolarHBondContact O-CA 3.04Å; L66-G70 PolarHBondContact O-N 2.74Å; L66-L98 HydrophobicContact CD1-CD2 3.87Å; L66-V101 HydrophobicContact CB-CG1 4.01Å
67	T	94.3	Very high	94.4	Very high	90 Å²	90	40.9 Å²	40.9	55%	0.552	23%	0.225	S	C	*	.	H	α-helix	trans	-69.7	-47	-176	55	0	0	0	0	112.2	V63 V64 M71	V63-T67 WeakPolarHBondContact O-CB 3.27Å; V63-T67 VanDerWaalsContact O-CG2 3.29Å; V63-T67 WeakPolarHBondContact O-CG2 3.3Å; V63-T67 PolarHBondContact O-N 3.43Å; V63-T67 PolarHBondContact O-OG1 3.42Å; V64-T67 PolarHBondContact O-N 3.5Å; V64-T67 PolarHBondContact O-OG1 2.98Å; T67-M71 WeakPolarHBondContact O-CB 3.4Å; T67-M71 PolarHBondContact O-N 2.89Å
68	A	93.9	Very high	93.9	Very high	15 Å²	15	46.7 Å²	46.7	12%	0.124	25%	0.25	C	S	.	.	H	α-helix	trans	-72.6	-44.5	-175.5	0	0	0	0	0	112.4	V64 M71 A72 P324	V64-A68 WeakPolarHBondContact O-CB 3.45Å; V64-A68 PolarHBondContact O-N 3.22Å; A68-M71 PolarHBondContact O-N 3.34Å; A68-A72 WeakPolarHBondContact O-CB 3.34Å; A68-A72 PolarHBondContact O-N 2.86Å; A68-P324 HydrophobicContact CB-CB 3.88Å; A68-P324 HydrophobicContact CB-CG 3.4Å; A68-P324 VanDerWaalsContact CB-CG 3.4Å
69	N	96.3	Very high	93.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-72.9	-32.9	177.8	-65.6	-66.7	0	0	0	112	G65 A72 I73 A94 D97 L98 S320 Y327	G65-N69 WeakPolarHBondContact O-CB 3.4Å; G65-N69 PolarHBondContact O-N 3.19Å; G65-N69 VanDerWaalsContact O-N 3.12Å; G65-N69 PolarHBondContact O-ND2 3.13Å; N69-A72 WeakPolarHBondContact O-CB 3.4Å; N69-A72 PolarHBondContact O-N 3.45Å; N69-I73 PolarHBondContact O-N 2.82Å; N69-A94 HydrophobicContact CB-CB 4.19Å; N69-D97 HydrophobicContact CB-CB 4.18Å; N69-D97 PolarHBondContact OD1-OD2 2.89Å; N69-D97 VanDerWaalsContact OD1-OD2 3.09Å; N69-L98 HydrophobicContact CB-CD1 4.4Å; N69-L98 HydrophobicContact CB-CD2 4.03Å; N69-L98 HydrophobicContact CB-CG 3.82Å; N69-S320 PolarHBondContact ND2-O 3.18Å; N69-Y327 VanDerWaalsContact OD1-CE2 3.28Å; N69-Y327 WeakPolarHBondContact OD1-CE2 3.3Å; N69-Y327 PolarHBondContact OD1-OH 3.34Å
70	G	95.6	Very high	92.4	Very high	28 Å²	28	48 Å²	48	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-60.3	-47.2	171.6	0	0	0	0	0	112	L66 A72 I73 W74	L66-G70 WeakPolarHBondContact O-CA 3.04Å; L66-G70 PolarHBondContact O-N 2.74Å; G70-A72 VanDerWaalsContact C-N 3.33Å; G70-A72 PolarHBondContact O-N 2.98Å; G70-I73 PolarHBondContact O-N 2.54Å; G70-W74 PolarHBondContact O-N 3.18Å
71	M	92.6	Very high	91.3	Very high	50 Å²	50	53.6 Å²	53.6	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-40.7	172.8	-179.7	174.1	56.5	0	0	111.7	T67 A68 W74 V75 F334 V338	T67-M71 WeakPolarHBondContact O-CB 3.4Å; T67-M71 PolarHBondContact O-N 2.89Å; A68-M71 PolarHBondContact O-N 3.34Å; M71-W74 PolarHBondContact O-N 3.23Å; M71-V75 HydrophobicContact CG-CG2 4.37Å; M71-V75 WeakPolarHBondContact O-CG2 3.18Å; M71-V75 PolarHBondContact O-N 2.88Å; M71-F334 HydrophobicContact CE-CE2 4.03Å; M71-F334 HydrophobicContact CE-CZ 4.01Å; M71-F334 HydrophobicContact CG-CE2 4.33Å; M71-V338 HydrophobicContact CE-CG2 3.58Å; M71-V338 HydrophobicContact SD-CG2 4.44Å
72	A	93.2	Very high	90.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-49.6	179.2	0	0	0	0	0	111.9	A68 N69 G70 W74 V75 F76 A94 Y327 F334	A68-A72 WeakPolarHBondContact O-CB 3.34Å; A68-A72 PolarHBondContact O-N 2.86Å; N69-A72 WeakPolarHBondContact O-CB 3.4Å; N69-A72 PolarHBondContact O-N 3.45Å; G70-A72 VanDerWaalsContact C-N 3.33Å; G70-A72 PolarHBondContact O-N 2.98Å; A72-W74 VanDerWaalsContact C-N 3.33Å; A72-W74 PolarHBondContact O-N 3.43Å; A72-V75 PolarHBondContact O-N 3.36Å; A72-F76 HydrophobicContact CB-CD2 4.25Å; A72-F76 HydrophobicContact CB-CE2 3.94Å; A72-F76 WeakPolarHBondContact O-CB 3.33Å; A72-F76 WeakPolarHBondContact O-CD2 3.46Å; A72-F76 VanDerWaalsContact O-CG 3.29Å; A72-F76 WeakPolarHBondContact O-CG 3.2Å; A72-F76 PolarHBondContact O-N 2.61Å; A72-A94 HydrophobicContact CB-CB 4.07Å; A72-Y327 HydrophobicContact CB-CD2 3.63Å; A72-Y327 HydrophobicContact CB-CE2 3.85Å; A72-F334 VanDerWaalsContact CA-CE2 3.49Å; A72-F334 HydrophobicContact CB-CD2 4.15Å; A72-F334 HydrophobicContact CB-CE2 3.61Å; A72-F334 HydrophobicContact CB-CZ 4.26Å
73	I	93.8	Very high	89.1	Confident	30 Å²	30	62.1 Å²	62.1	15%	0.154	30%	0.304	C	S	.	.	H	α-helix	trans	-56.7	-47.9	174	-74.6	-153.6	0	0	0	110.9	N69 G70 V75 F76 L77 A94 L95 L98	N69-I73 PolarHBondContact O-N 2.82Å; G70-I73 PolarHBondContact O-N 2.54Å; I73-V75 VanDerWaalsContact C-N 3.34Å; I73-V75 PolarHBondContact O-N 2.92Å; I73-F76 PolarHBondContact O-N 3.08Å; I73-L77 HydrophobicContact CG2-CD1 3.54Å; I73-L77 HydrophobicContact CG2-CG 4.06Å; I73-L77 VanDerWaalsContact O-CB 3.3Å; I73-L77 WeakPolarHBondContact O-CB 3.3Å; I73-L77 WeakPolarHBondContact O-CG 3.47Å; I73-L77 PolarHBondContact O-N 3.44Å; I73-A94 HydrophobicContact CG1-CB 3.75Å; I73-L95 HydrophobicContact CD1-CB 3.86Å; I73-L95 HydrophobicContact CD1-CD1 3.99Å; I73-L98 HydrophobicContact CB-CD1 4.43Å; I73-L98 HydrophobicContact CD1-CD1 3.52Å; I73-L98 HydrophobicContact CG1-CD1 3.86Å
74	W	92.4	Very high	88.5	Confident	122 Å²	122	62.2 Å²	62.2	46%	0.462	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-44.9	-179.1	175.5	81.4	0	0	0	112	G70 M71 A72 F78 R79 H337	G70-W74 PolarHBondContact O-N 3.18Å; M71-W74 PolarHBondContact O-N 3.23Å; A72-W74 VanDerWaalsContact C-N 3.33Å; A72-W74 PolarHBondContact O-N 3.43Å; W74-F78 AromaticContact CD1-CD2 3.57Å; W74-F78 HydrophobicContact CG-CD2 4.24Å; W74-F78 WeakPolarHBondContact O-CB 3.32Å; W74-F78 WeakPolarHBondContact O-CD2 3.39Å; W74-F78 PolarHBondContact O-N 3.32Å; W74-R79 HydrophobicContact CD2-CG 4.39Å; W74-R79 HydrophobicContact CE3-CG 4.08Å; W74-R79 HydrophobicContact CH2-CG 3.64Å; W74-R79 HydrophobicContact CZ2-CG 3.96Å; W74-R79 HydrophobicContact CZ3-CG 3.71Å; W74-H337 AromaticContact CZ3-CD2 3.78Å
75	V	89.3	Confident	88	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-62.1	-51.4	175.7	172.1	0	0	0	0	110.5	M71 A72 I73 L77 R79 T80 E333 F334 H337	M71-V75 HydrophobicContact CG-CG2 4.37Å; M71-V75 WeakPolarHBondContact O-CG2 3.18Å; M71-V75 PolarHBondContact O-N 2.88Å; A72-V75 PolarHBondContact O-N 3.36Å; I73-V75 VanDerWaalsContact C-N 3.34Å; I73-V75 PolarHBondContact O-N 2.92Å; V75-L77 VanDerWaalsContact C-N 3.32Å; V75-L77 PolarHBondContact O-N 2.98Å; V75-R79 HydrophobicContact CG1-CB 4.27Å; V75-R79 CarbonylContact O-C 3.58Å; V75-R79 WeakPolarHBondContact O-CA 3.49Å; V75-R79 WeakPolarHBondContact O-CB 3.22Å; V75-R79 PolarHBondContact O-N 2.55Å; V75-T80 PolarHBondContact O-N 3.49Å; V75-T80 PolarHBondContact O-OG1 3.39Å; V75-E333 HydrophobicContact CG1-CB 4.39Å; V75-F334 HydrophobicContact CB-CD2 4.35Å; V75-F334 HydrophobicContact CG1-CB 4.38Å; V75-F334 HydrophobicContact CG2-CD2 4.3Å; V75-H337 HydrophobicContact CG2-CB 3.82Å
76	F	88.8	Confident	87.6	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.009	29%	0.288	C	S	.	.	I	π-helix	trans	-67.6	-31.5	-174.6	-66.2	-43.4	0	0	0	113.1	A72 I73 K83 M90 A91 Y327 F334	A72-F76 HydrophobicContact CB-CD2 4.25Å; A72-F76 HydrophobicContact CB-CE2 3.94Å; A72-F76 WeakPolarHBondContact O-CB 3.33Å; A72-F76 WeakPolarHBondContact O-CD2 3.46Å; A72-F76 VanDerWaalsContact O-CG 3.29Å; A72-F76 WeakPolarHBondContact O-CG 3.2Å; A72-F76 PolarHBondContact O-N 2.61Å; I73-F76 PolarHBondContact O-N 3.08Å; F76-K83 PolarHBondContact O-NZ 2.78Å; F76-M90 HydrophobicContact CD2-CB 4.12Å; F76-M90 HydrophobicContact CE1-CB 4.39Å; F76-M90 HydrophobicContact CE1-CE 3.67Å; F76-M90 HydrophobicContact CE1-SD 4.12Å; F76-M90 HydrophobicContact CE2-CB 3.49Å; F76-M90 VanDerWaalsContact CE2-CB 3.49Å; F76-M90 HydrophobicContact CE2-CG 4.47Å; F76-M90 HydrophobicContact CE2-SD 4.34Å; F76-M90 HydrophobicContact CZ-CB 3.66Å; F76-M90 HydrophobicContact CZ-CE 3.76Å; F76-M90 HydrophobicContact CZ-CG 4.24Å; F76-M90 HydrophobicContact CZ-SD 3.57Å; F76-M90 VanDerWaalsContact CZ-SD 3.57Å; F76-A91 HydrophobicContact CB-CB 3.98Å; F76-A91 HydrophobicContact CD2-CB 4.31Å; F76-A91 HydrophobicContact CG-CB 4.47Å; F76-Y327 HydrophobicContact CE2-CD1 4.23Å; F76-Y327 HydrophobicContact CE2-CD2 4.47Å; F76-Y327 HydrophobicContact CE2-CG 4.13Å; F76-Y327 HydrophobicContact CZ-CD1 4.38Å; F76-Y327 HydrophobicContact CZ-CG 4.22Å; F76-F334 HydrophobicContact CE1-CB 4.32Å; F76-F334 HydrophobicContact CZ-CB 4.32Å
77	L	87.1	Confident	87.3	Confident	91 Å²	91	57.7 Å²	57.7	48%	0.476	28%	0.275	S	S	.	.	I	π-helix	trans	-82.2	-49	177.7	-68.2	-175.6	0	0	0	112.2	I73 V75 K83	I73-L77 HydrophobicContact CG2-CD1 3.54Å; I73-L77 HydrophobicContact CG2-CG 4.06Å; I73-L77 VanDerWaalsContact O-CB 3.3Å; I73-L77 WeakPolarHBondContact O-CB 3.3Å; I73-L77 WeakPolarHBondContact O-CG 3.47Å; I73-L77 PolarHBondContact O-N 3.44Å; V75-L77 VanDerWaalsContact C-N 3.32Å; V75-L77 PolarHBondContact O-N 2.98Å; L77-K83 PolarHBondContact O-NZ 2.7Å
78	F	85.4	Confident	87.2	Confident	152 Å²	152	54.6 Å²	54.6	67%	0.667	26%	0.255	S	S	*	.	I	π-helix	trans	-107.6	-20.2	-166.3	-57.7	-72	0	0	0	115.1	W74	W74-F78 AromaticContact CD1-CD2 3.57Å; W74-F78 HydrophobicContact CG-CD2 4.24Å; W74-F78 WeakPolarHBondContact O-CB 3.32Å; W74-F78 WeakPolarHBondContact O-CD2 3.39Å; W74-F78 PolarHBondContact O-N 3.32Å
79	R	82.9	Confident	87.2	Confident	85 Å²	85	54.5 Å²	54.5	32%	0.321	25%	0.252	S	S	.	.	I	π-helix	trans	-108.3	-22.3	-175.7	-55.6	-64.3	-71.9	172.2	-3	113.5	W74 V75 K81 H337 S347	W74-R79 HydrophobicContact CD2-CG 4.39Å; W74-R79 HydrophobicContact CE3-CG 4.08Å; W74-R79 HydrophobicContact CH2-CG 3.64Å; W74-R79 HydrophobicContact CZ2-CG 3.96Å; W74-R79 HydrophobicContact CZ3-CG 3.71Å; V75-R79 HydrophobicContact CG1-CB 4.27Å; V75-R79 CarbonylContact O-C 3.58Å; V75-R79 WeakPolarHBondContact O-CA 3.49Å; V75-R79 WeakPolarHBondContact O-CB 3.22Å; V75-R79 PolarHBondContact O-N 2.55Å; R79-K81 PolarHBondContact O-N 2.75Å; R79-H337 PolarHBondContact NE-NE2 3.37Å; R79-S347 PolarHBondContact NH2-OG 3.28Å
80	T	79.5	Confident	87.1	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.055	25%	0.252	C	S	.	.			trans	-72.1	105	175.4	-62.4	0	0	0	0	111.9	V75 K82 K83 E333	V75-T80 PolarHBondContact O-N 3.49Å; V75-T80 PolarHBondContact O-OG1 3.39Å; T80-K82 WeakPolarHBondContact CG2-O 3.15Å; T80-K83 HydrophobicContact CG2-CD 4.17Å; T80-E333 WeakPolarHBondContact CA-OE2 3.45Å; T80-E333 WeakPolarHBondContact CB-OE2 3.28Å; T80-E333 WeakPolarHBondContact CG2-OE2 3.34Å; T80-E333 PolarHBondContact OG1-OE2 3.39Å
81	K	71.9	Confident	87	Confident	188 Å²	188	54 Å²	54	82%	0.817	25%	0.245	S	C	*	.	S	Bend	trans	-70.7	-31.8	-178.3	-65.9	-175.3	-179.6	-177.4	0	112.8	R79	R79-K81 PolarHBondContact O-N 2.75Å
82	K	72.6	Confident	87.2	Confident	154 Å²	154	53 Å²	53	67%	0.67	24%	0.241	S	C	*	.	S	Bend	trans	-123.5	109.9	177.8	-70.5	-177.1	179.5	177.1	0	109.9	T80 H84	T80-K82 WeakPolarHBondContact CG2-O 3.15Å; K82-H84 PolarHBondContact O-CD2 3.49Å; K82-H84 PolarHBondContact O-N 3.47Å
83	K	77.8	Confident	87.4	Confident	83 Å²	83	53 Å²	53	36%	0.361	24%	0.241	S	C	.	.			trans	-72.6	115.7	177.3	-55.5	-69.9	174	159.9	0	108.9	F76 L77 T80 N164	F76-K83 PolarHBondContact O-NZ 2.78Å; L77-K83 PolarHBondContact O-NZ 2.7Å; T80-K83 HydrophobicContact CG2-CD 4.17Å; K83-N164 PolarHBondContact O-ND2 3.48Å; K83-N164 PolarHBondContact O-OD1 3.37Å
84	H	83	Confident	87.5	Confident	84 Å²	84	51.6 Å²	51.6	39%	0.389	23%	0.233	S	C	.	.			trans	-106.2	155	171.1	-70.5	-71.3	0	0	0	109.7	K82 S86 S87 I88	K82-H84 PolarHBondContact O-CD2 3.49Å; K82-H84 PolarHBondContact O-N 3.47Å; H84-S86 PolarHBondContact O-N 2.85Å; H84-S86 VanDerWaalsContact O-N 3.14Å; H84-S87 WeakPolarHBondContact O-CB 3.43Å; H84-S87 PolarHBondContact O-N 2.98Å; H84-I88 PolarHBondContact O-N 3.25Å
85	P	86.8	Confident	87.7	Confident	4 Å²	4	49 Å²	49	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-48.8	-42.2	177.4	-33.7	39.4	0	0	0	114.1	S87 I88 Y89 Q148 N164 A167	P85-S87 VanDerWaalsContact C-N 3.33Å; P85-S87 PolarHBondContact O-N 3.35Å; P85-I88 WeakPolarHBondContact O-CB 3.09Å; P85-I88 PolarHBondContact O-N 2.83Å; P85-I88 VanDerWaalsContact O-N 3.12Å; P85-Y89 HydrophobicContact CB-CE2 4.46Å; P85-Y89 VanDerWaalsContact O-CD2 3.32Å; P85-Y89 WeakPolarHBondContact O-CD2 3.41Å; P85-Y89 PolarHBondContact O-N 3.36Å; P85-Y89 VanDerWaalsContact O-N 3.09Å; P85-Q148 HydrophobicContact CB-CG 4.3Å; P85-N164 WeakPolarHBondContact CD-OD1 3.47Å; P85-A167 HydrophobicContact CB-CB 3.8Å; P85-A167 HydrophobicContact CG-CB 4.35Å
86	S	87.4	Confident	88.1	Confident	11 Å²	11	49.2 Å²	49.2	8%	0.077	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-38.3	176.8	-55.6	0	0	0	0	113.3	H84 I88 Y89 M90 Q148	H84-S86 PolarHBondContact O-N 2.85Å; H84-S86 VanDerWaalsContact O-N 3.14Å; S86-I88 VanDerWaalsContact C-N 3.29Å; S86-I88 PolarHBondContact O-N 2.88Å; S86-Y89 PolarHBondContact O-N 3.41Å; S86-M90 WeakPolarHBondContact O-CB 3.19Å; S86-M90 WeakPolarHBondContact O-CE 3.25Å; S86-M90 VanDerWaalsContact O-CG 3.31Å; S86-M90 WeakPolarHBondContact O-CG 3.43Å; S86-M90 PolarHBondContact O-N 2.67Å; S86-Q148 WeakPolarHBondContact OG-CG 3.44Å
87	S	89	Confident	88.5	Confident	13 Å²	13	49.1 Å²	49.1	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-31.6	176.6	-56.9	0	0	0	0	112.1	H84 P85 A91	H84-S87 WeakPolarHBondContact O-CB 3.43Å; H84-S87 PolarHBondContact O-N 2.98Å; P85-S87 VanDerWaalsContact C-N 3.33Å; P85-S87 PolarHBondContact O-N 3.35Å; S87-A91 VanDerWaalsContact O-CB 3.29Å; S87-A91 WeakPolarHBondContact O-CB 3.13Å; S87-A91 PolarHBondContact O-N 3.46Å
88	I	92.4	Very high	89	Confident	25 Å²	25	46.1 Å²	46.1	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-68.7	-47.5	176.5	-59.3	171.3	0	0	0	109.8	H84 P85 S86 A91 N92 N164 A167 I168	H84-I88 PolarHBondContact O-N 3.25Å; P85-I88 WeakPolarHBondContact O-CB 3.09Å; P85-I88 PolarHBondContact O-N 2.83Å; P85-I88 VanDerWaalsContact O-N 3.12Å; S86-I88 VanDerWaalsContact C-N 3.29Å; S86-I88 PolarHBondContact O-N 2.88Å; I88-A91 PolarHBondContact O-N 3.35Å; I88-N92 PolarHBondContact O-N 2.89Å; I88-N92 VanDerWaalsContact O-N 3.09Å; I88-N92 PolarHBondContact O-ND2 2.85Å; I88-N164 HydrophobicContact CD1-CB 3.86Å; I88-A167 HydrophobicContact CB-CB 4.49Å; I88-A167 HydrophobicContact CD1-CB 4.08Å; I88-I168 HydrophobicContact CD1-CG1 4.11Å; I88-I168 HydrophobicContact CG2-CG1 4.29Å
89	Y	94.1	Very high	89.6	Confident	13 Å²	13	42 Å²	42	5%	0.051	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-43.6	175.9	-62	-47.2	0	0	0	112.3	P85 S86 A91 N92 L93 F141 C144 L145 Q148 A167 V170 C171	P85-Y89 HydrophobicContact CB-CE2 4.46Å; P85-Y89 VanDerWaalsContact O-CD2 3.32Å; P85-Y89 WeakPolarHBondContact O-CD2 3.41Å; P85-Y89 PolarHBondContact O-N 3.36Å; P85-Y89 VanDerWaalsContact O-N 3.09Å; S86-Y89 PolarHBondContact O-N 3.41Å; Y89-A91 VanDerWaalsContact C-N 3.34Å; Y89-A91 PolarHBondContact O-N 3.5Å; Y89-N92 PolarHBondContact O-N 3.37Å; Y89-L93 PolarHBondContact O-N 3.15Å; Y89-F141 HydrophobicContact CD1-CD1 4.04Å; Y89-F141 HydrophobicContact CD1-CE1 4.28Å; Y89-C144 HydrophobicContact CD1-CB 3.97Å; Y89-C144 HydrophobicContact CD2-CB 4.11Å; Y89-C144 HydrophobicContact CE1-CB 3.9Å; Y89-C144 HydrophobicContact CE2-CB 4.03Å; Y89-C144 HydrophobicContact CG-CB 4.09Å; Y89-L145 HydrophobicContact CD2-CD2 4.29Å; Y89-L145 HydrophobicContact CG-CD2 4.5Å; Y89-Q148 HydrophobicContact CE2-CB 4.22Å; Y89-Q148 HydrophobicContact CE2-CG 4.44Å; Y89-A167 HydrophobicContact CE1-CB 4.34Å; Y89-A167 HydrophobicContact CE2-CB 4.48Å; Y89-V170 HydrophobicContact CE1-CB 4.18Å; Y89-V170 HydrophobicContact CE1-CG1 3.91Å; Y89-C171 WeakPolarHBondContact CD1-SG 3.15Å
90	M	93.4	Very high	90.3	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-37.8	176.4	-71.5	-175.9	-72.4	0	0	112.7	F76 S86 N92 L93 A94 L145 Y327 V330	F76-M90 HydrophobicContact CD2-CB 4.12Å; F76-M90 HydrophobicContact CE1-CB 4.39Å; F76-M90 HydrophobicContact CE1-CE 3.67Å; F76-M90 HydrophobicContact CE1-SD 4.12Å; F76-M90 HydrophobicContact CE2-CB 3.49Å; F76-M90 VanDerWaalsContact CE2-CB 3.49Å; F76-M90 HydrophobicContact CE2-CG 4.47Å; F76-M90 HydrophobicContact CE2-SD 4.34Å; F76-M90 HydrophobicContact CZ-CB 3.66Å; F76-M90 HydrophobicContact CZ-CE 3.76Å; F76-M90 HydrophobicContact CZ-CG 4.24Å; F76-M90 HydrophobicContact CZ-SD 3.57Å; F76-M90 VanDerWaalsContact CZ-SD 3.57Å; S86-M90 WeakPolarHBondContact O-CB 3.19Å; S86-M90 WeakPolarHBondContact O-CE 3.25Å; S86-M90 VanDerWaalsContact O-CG 3.31Å; S86-M90 WeakPolarHBondContact O-CG 3.43Å; S86-M90 PolarHBondContact O-N 2.67Å; M90-N92 VanDerWaalsContact C-N 3.34Å; M90-L93 PolarHBondContact O-N 3.06Å; M90-A94 WeakPolarHBondContact O-CB 3.45Å; M90-A94 PolarHBondContact O-N 3.49Å; M90-L145 HydrophobicContact CG-CD1 4.07Å; M90-L145 HydrophobicContact CG-CD2 3.97Å; M90-Y327 HydrophobicContact CB-CD1 3.83Å; M90-Y327 HydrophobicContact CB-CE1 3.96Å; M90-Y327 HydrophobicContact CG-CD1 3.7Å; M90-Y327 HydrophobicContact CG-CE1 4.11Å; M90-Y327 HydrophobicContact SD-CD1 3.87Å; M90-V330 HydrophobicContact CE-CB 4.48Å; M90-V330 HydrophobicContact CE-CG1 3.59Å; M90-V330 HydrophobicContact CG-CG1 4.22Å; M90-V330 HydrophobicContact SD-CB 3.76Å; M90-V330 HydrophobicContact SD-CG1 3.27Å; M90-V330 WeakPolarHBondContact SD-CG1 3.08Å
91	A	94.4	Very high	91.1	Very high	16 Å²	16	37.6 Å²	37.6	13%	0.132	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-38.1	176.7	0	0	0	0	0	112	F76 S87 I88 Y89 L95	F76-A91 HydrophobicContact CB-CB 3.98Å; F76-A91 HydrophobicContact CD2-CB 4.31Å; F76-A91 HydrophobicContact CG-CB 4.47Å; S87-A91 VanDerWaalsContact O-CB 3.29Å; S87-A91 WeakPolarHBondContact O-CB 3.13Å; S87-A91 PolarHBondContact O-N 3.46Å; I88-A91 PolarHBondContact O-N 3.35Å; Y89-A91 VanDerWaalsContact C-N 3.34Å; Y89-A91 PolarHBondContact O-N 3.5Å; A91-L95 WeakPolarHBondContact O-CB 3.46Å; A91-L95 PolarHBondContact O-N 3.41Å
92	N	96.6	Very high	92.3	Very high	30 Å²	30	32.7 Å²	32.7	16%	0.16	17%	0.166	C	C	.	.	H	α-helix	trans	-73	-34.4	175.8	-75.4	-90.6	0	0	0	112.5	I88 Y89 M90 L95 A96 F141 C171 W175	I88-N92 PolarHBondContact O-N 2.89Å; I88-N92 VanDerWaalsContact O-N 3.09Å; I88-N92 PolarHBondContact O-ND2 2.85Å; Y89-N92 PolarHBondContact O-N 3.37Å; M90-N92 VanDerWaalsContact C-N 3.34Å; N92-L95 PolarHBondContact O-N 3.1Å; N92-A96 PolarHBondContact O-N 3.18Å; N92-F141 HydrophobicContact CB-CD1 4.4Å; N92-F141 HydrophobicContact CB-CD2 4.16Å; N92-F141 HydrophobicContact CB-CE1 3.81Å; N92-F141 HydrophobicContact CB-CE2 3.47Å; N92-F141 VanDerWaalsContact CB-CE2 3.47Å; N92-F141 HydrophobicContact CB-CZ 3.31Å; N92-C171 PolarHBondContact ND2-SG 2.98Å; N92-W175 PolarHBondContact OD1-NE1 3.34Å
93	L	95.9	Very high	93.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-51.4	171.6	-173.2	60.8	0	0	0	110.5	Y89 M90 L95 A96 D97 S138 F141 I142 L145 D323 Y327	Y89-L93 PolarHBondContact O-N 3.15Å; M90-L93 PolarHBondContact O-N 3.06Å; L93-L95 PolarHBondContact O-N 3.06Å; L93-A96 WeakPolarHBondContact O-CB 3.39Å; L93-A96 PolarHBondContact O-N 3.12Å; L93-A96 VanDerWaalsContact O-N 3.1Å; L93-D97 PolarHBondContact O-N 3.4Å; L93-S138 WeakPolarHBondContact CD1-OG 3.41Å; L93-F141 HydrophobicContact CB-CB 4.25Å; L93-F141 HydrophobicContact CD1-CB 4.08Å; L93-I142 HydrophobicContact CD2-CG1 4.13Å; L93-L145 HydrophobicContact CD2-CD1 4.36Å; L93-D323 HydrophobicContact CD2-CB 4.06Å; L93-D323 HydrophobicContact CG-CB 4.35Å; L93-Y327 HydrophobicContact CB-CE1 4.23Å; L93-Y327 HydrophobicContact CD2-CE1 3.8Å; L93-Y327 HydrophobicContact CG-CE1 4.21Å; L93-Y327 VanDerWaalsContact CG-OH 3.26Å; L93-Y327 WeakPolarHBondContact CG-OH 3.17Å
94	A	96.8	Very high	94.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-30.6	176.8	0	0	0	0	0	112.9	N69 A72 I73 M90 L98 Y327	N69-A94 HydrophobicContact CB-CB 4.19Å; A72-A94 HydrophobicContact CB-CB 4.07Å; I73-A94 HydrophobicContact CG1-CB 3.75Å; M90-A94 WeakPolarHBondContact O-CB 3.45Å; M90-A94 PolarHBondContact O-N 3.49Å; A94-L98 WeakPolarHBondContact O-CB 3.43Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.26Å; A94-L98 PolarHBondContact O-N 3.27Å; A94-Y327 WeakPolarHBondContact CA-OH 3.44Å; A94-Y327 HydrophobicContact CB-CE2 4.15Å; A94-Y327 PolarHBondContact N-OH 3.48Å; A94-Y327 VanDerWaalsContact N-OH 3.08Å
95	L	97.5	Very high	94.9	Very high	67 Å²	67	23.3 Å²	23.3	35%	0.351	13%	0.128	S	C	.	.	H	α-helix	trans	-69.5	-43.1	174.2	-178.3	62.2	0	0	0	112	I73 A91 N92 L93 D97 L98 L99 W175	I73-L95 HydrophobicContact CD1-CB 3.86Å; I73-L95 HydrophobicContact CD1-CD1 3.99Å; A91-L95 WeakPolarHBondContact O-CB 3.46Å; A91-L95 PolarHBondContact O-N 3.41Å; N92-L95 PolarHBondContact O-N 3.1Å; L93-L95 PolarHBondContact O-N 3.06Å; L95-D97 VanDerWaalsContact C-N 3.32Å; L95-L98 PolarHBondContact O-N 2.82Å; L95-L99 HydrophobicContact CD1-CD1 4.34Å; L95-L99 HydrophobicContact CD1-CG 4.3Å; L95-L99 HydrophobicContact CG-CD1 4.13Å; L95-L99 WeakPolarHBondContact O-CB 3.22Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.49Å; L95-L99 PolarHBondContact O-N 3.13Å; L95-W175 HydrophobicContact CB-CZ2 4.48Å; L95-W175 HydrophobicContact CD2-CZ2 4.08Å; L95-W175 HydrophobicContact CG-CZ2 4.2Å
96	A	97.4	Very high	95.4	Very high	4 Å²	4	24.9 Å²	24.9	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-45.1	174.5	0	0	0	0	0	111	N92 L93 L98 L99 F100 N134 C137 W175	N92-A96 PolarHBondContact O-N 3.18Å; L93-A96 WeakPolarHBondContact O-CB 3.39Å; L93-A96 PolarHBondContact O-N 3.12Å; L93-A96 VanDerWaalsContact O-N 3.1Å; A96-L98 PolarHBondContact O-N 3.39Å; A96-L99 PolarHBondContact O-N 2.84Å; A96-F100 PolarHBondContact O-N 3.45Å; A96-N134 PolarHBondContact O-OD1 2.95Å; A96-C137 HydrophobicContact CB-CB 4.12Å; A96-W175 HydrophobicContact CB-CH2 4.07Å; A96-W175 HydrophobicContact CB-CZ2 4.35Å
97	D	97.6	Very high	95.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-45.7	176.7	-71.8	-40.8	0	0	0	112.1	N69 L93 L95 F100 V101 N134 S320 Y327	N69-D97 HydrophobicContact CB-CB 4.18Å; N69-D97 PolarHBondContact OD1-OD2 2.89Å; N69-D97 VanDerWaalsContact OD1-OD2 3.09Å; L93-D97 PolarHBondContact O-N 3.4Å; L95-D97 VanDerWaalsContact C-N 3.32Å; D97-F100 WeakPolarHBondContact O-CB 3.33Å; D97-F100 PolarHBondContact O-N 2.99Å; D97-V101 WeakPolarHBondContact O-CB 3.44Å; D97-V101 WeakPolarHBondContact O-CG2 3.37Å; D97-V101 PolarHBondContact O-N 3.22Å; D97-N134 WeakPolarHBondContact CA-OD1 3.28Å; D97-N134 PolarHBondContact N-OD1 2.96Å; D97-N134 PolarHBondContact OD1-OD1 3.35Å; D97-S320 VanDerWaalsContact OD1-CA 3.29Å; D97-S320 WeakPolarHBondContact OD1-CA 3.35Å; D97-S320 VanDerWaalsContact OD1-CB 3.24Å; D97-S320 WeakPolarHBondContact OD1-CB 3.16Å; D97-S320 PolarHBondContact OD1-OG 3.01Å; D97-Y327 PolarHBondContact OD2-OH 3.39Å
98	L	97.8	Very high	96.1	Very high	29 Å²	29	26.2 Å²	26.2	15%	0.152	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-42.6	179.2	-74.3	169.2	0	0	0	112.4	L66 N69 I73 A94 L95 A96 F100 V101 V102	L66-L98 HydrophobicContact CD1-CD2 3.87Å; N69-L98 HydrophobicContact CB-CD1 4.4Å; N69-L98 HydrophobicContact CB-CD2 4.03Å; N69-L98 HydrophobicContact CB-CG 3.82Å; I73-L98 HydrophobicContact CB-CD1 4.43Å; I73-L98 HydrophobicContact CD1-CD1 3.52Å; I73-L98 HydrophobicContact CG1-CD1 3.86Å; A94-L98 WeakPolarHBondContact O-CB 3.43Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.26Å; A94-L98 PolarHBondContact O-N 3.27Å; L95-L98 PolarHBondContact O-N 2.82Å; A96-L98 PolarHBondContact O-N 3.39Å; L98-F100 PolarHBondContact O-N 2.88Å; L98-V101 PolarHBondContact O-N 3.5Å; L98-V102 VanDerWaalsContact O-CG2 3.22Å; L98-V102 WeakPolarHBondContact O-CG2 3.27Å; L98-V102 PolarHBondContact O-N 3.47Å; L98-V102 VanDerWaalsContact O-N 3.12Å
99	L	97.1	Very high	96.3	Very high	65 Å²	65	26.5 Å²	26.5	34%	0.34	14%	0.144	S	C	.	.	H	α-helix	trans	-61.8	-27.6	176.9	-74	173.9	0	0	0	112.2	L95 A96 W103 F130 W175	L95-L99 HydrophobicContact CD1-CD1 4.34Å; L95-L99 HydrophobicContact CD1-CG 4.3Å; L95-L99 HydrophobicContact CG-CD1 4.13Å; L95-L99 WeakPolarHBondContact O-CB 3.22Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.49Å; L95-L99 PolarHBondContact O-N 3.13Å; A96-L99 PolarHBondContact O-N 2.84Å; L99-W103 PolarHBondContact O-NE1 3.04Å; L99-W103 VanDerWaalsContact O-NE1 3.08Å; L99-F130 HydrophobicContact CB-CD1 3.95Å; L99-F130 HydrophobicContact CB-CE1 3.85Å; L99-F130 HydrophobicContact CD1-CE1 4.42Å; L99-F130 HydrophobicContact CD2-CE1 4.39Å; L99-F130 HydrophobicContact CG-CE1 4.45Å; L99-F130 WeakPolarHBondContact O-CD1 3.39Å; L99-W175 HydrophobicContact CD1-CH2 3.72Å; L99-W175 HydrophobicContact CD1-CZ3 4.17Å
100	F	97	Very high	96.4	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.009	14%	0.143	C	C	.	.	H	α-helix	trans	-80.2	-51.7	172.2	163.3	-116.7	0	0	0	113	V61 A96 D97 L98 V102 W103 M104 F131 N134	V61-F100 HydrophobicContact CG1-CE1 4.17Å; A96-F100 PolarHBondContact O-N 3.45Å; D97-F100 WeakPolarHBondContact O-CB 3.33Å; D97-F100 PolarHBondContact O-N 2.99Å; L98-F100 PolarHBondContact O-N 2.88Å; F100-V102 VanDerWaalsContact C-N 3.26Å; F100-V102 PolarHBondContact O-N 3.15Å; F100-W103 PolarHBondContact O-N 2.6Å; F100-W103 VanDerWaalsContact O-N 3.1Å; F100-M104 HydrophobicContact CD2-CE 3.85Å; F100-M104 HydrophobicContact CE1-CE 4.15Å; F100-M104 HydrophobicContact CE1-SD 4.25Å; F100-M104 HydrophobicContact CE2-CE 3.03Å; F100-M104 HydrophobicContact CE2-SD 4.11Å; F100-M104 HydrophobicContact CZ-CE 3.21Å; F100-M104 HydrophobicContact CZ-CG 4.49Å; F100-M104 HydrophobicContact CZ-SD 3.65Å; F100-F131 HydrophobicContact CD2-CB 4.24Å; F100-F131 HydrophobicContact CE2-CB 3.9Å; F100-F131 AromaticContact CE2-CD2 3.51Å; F100-F131 HydrophobicContact CE2-CD2 3.51Å; F100-F131 HydrophobicContact CE2-CG 4.16Å; F100-F131 AromaticContact CZ-CD2 3.83Å; F100-F131 HydrophobicContact CZ-CD2 3.83Å; F100-F131 HydrophobicContact CZ-CE2 4.43Å; F100-N134 HydrophobicContact CB-CB 3.58Å; F100-N134 HydrophobicContact CD1-CB 4.42Å; F100-N134 WeakPolarHBondContact CD1-ND2 3.34Å; F100-N134 HydrophobicContact CD2-CB 4.44Å; F100-N134 HydrophobicContact CG-CB 3.91Å
101	V	97.3	Very high	96.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-30.5	-171.5	170.4	0	0	0	0	112.3	V61 F62 L66 D97 L98 W103 M104	V61-V101 HydrophobicContact CG1-CG2 4.22Å; F62-V101 HydrophobicContact CD2-CG1 3.81Å; F62-V101 WeakPolarHBondContact CD2-O 3.4Å; L66-V101 HydrophobicContact CB-CG1 4.01Å; D97-V101 WeakPolarHBondContact O-CB 3.44Å; D97-V101 WeakPolarHBondContact O-CG2 3.37Å; D97-V101 PolarHBondContact O-N 3.22Å; L98-V101 PolarHBondContact O-N 3.5Å; V101-W103 PolarHBondContact O-N 2.82Å; V101-W103 VanDerWaalsContact O-N 3.12Å; V101-M104 VanDerWaalsContact O-CB 3.3Å; V101-M104 WeakPolarHBondContact O-CB 3.47Å; V101-M104 WeakPolarHBondContact O-CG 3.41Å; V101-M104 PolarHBondContact O-N 3.27Å
102	V	97	Very high	96.4	Very high	84 Å²	84	29.6 Å²	29.6	51%	0.509	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26	176.6	167.8	0	0	0	0	112.9	L98 F100 P105	L98-V102 VanDerWaalsContact O-CG2 3.22Å; L98-V102 WeakPolarHBondContact O-CG2 3.27Å; L98-V102 PolarHBondContact O-N 3.47Å; L98-V102 VanDerWaalsContact O-N 3.12Å; F100-V102 VanDerWaalsContact C-N 3.26Å; F100-V102 PolarHBondContact O-N 3.15Å; V102-P105 WeakPolarHBondContact O-CD 3.42Å
103	W	95.6	Very high	96.3	Very high	69 Å²	69	32 Å²	32	26%	0.261	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.8	177.9	-53.5	104.6	0	0	0	114	L99 F100 V101 P105 L106 K107 L123 V126 F130	L99-W103 PolarHBondContact O-NE1 3.04Å; L99-W103 VanDerWaalsContact O-NE1 3.08Å; F100-W103 PolarHBondContact O-N 2.6Å; F100-W103 VanDerWaalsContact O-N 3.1Å; V101-W103 PolarHBondContact O-N 2.82Å; V101-W103 VanDerWaalsContact O-N 3.12Å; W103-P105 VanDerWaalsContact C-N 3.35Å; W103-L106 HydrophobicContact CE3-CD1 3.95Å; W103-L106 HydrophobicContact CZ3-CD1 4.48Å; W103-L106 PolarHBondContact O-N 3.23Å; W103-L106 VanDerWaalsContact O-N 3.15Å; W103-K107 PolarHBondContact O-N 3.13Å; W103-L123 HydrophobicContact CE3-CD1 4.36Å; W103-L123 HydrophobicContact CZ3-CD1 3.79Å; W103-V126 HydrophobicContact CD2-CG1 4.19Å; W103-V126 HydrophobicContact CE3-CG1 4.36Å; W103-V126 HydrophobicContact CH2-CG1 3.87Å; W103-V126 HydrophobicContact CZ2-CG1 3.67Å; W103-V126 HydrophobicContact CZ3-CG1 4.22Å; W103-F130 AromaticContact CD1-CD2 3.8Å; W103-F130 AromaticContact CD1-CG 3.82Å; W103-F130 AromaticContact CE2-CD2 3.89Å; W103-F130 HydrophobicContact CZ2-CD2 4.36Å; W103-F130 HydrophobicContact CZ2-CE2 4.05Å; W103-F130 AromaticContact NE1-CD2 3.21Å; W103-F130 AromaticContact NE1-CE2 3.56Å; W103-F130 AromaticContact NE1-CG 3.55Å
104	M	95.6	Very high	96.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-36.9	179.1	-70.3	-66	98.3	0	0	114.5	Y58 V61 F62 F100 V101 L106 K107 I108	Y58-M104 HydrophobicContact CD1-SD 3.94Å; Y58-M104 HydrophobicContact CG-SD 4.34Å; V61-M104 HydrophobicContact CG1-CG 4.32Å; V61-M104 HydrophobicContact CG1-SD 4.37Å; F62-M104 HydrophobicContact CB-CB 4.05Å; F62-M104 HydrophobicContact CD2-CB 4.19Å; F100-M104 HydrophobicContact CD2-CE 3.85Å; F100-M104 HydrophobicContact CE1-CE 4.15Å; F100-M104 HydrophobicContact CE1-SD 4.25Å; F100-M104 HydrophobicContact CE2-CE 3.03Å; F100-M104 HydrophobicContact CE2-SD 4.11Å; F100-M104 HydrophobicContact CZ-CE 3.21Å; F100-M104 HydrophobicContact CZ-CG 4.49Å; F100-M104 HydrophobicContact CZ-SD 3.65Å; V101-M104 VanDerWaalsContact O-CB 3.3Å; V101-M104 WeakPolarHBondContact O-CB 3.47Å; V101-M104 WeakPolarHBondContact O-CG 3.41Å; V101-M104 PolarHBondContact O-N 3.27Å; M104-L106 PolarHBondContact O-N 3.08Å; M104-K107 HydrophobicContact CE-CB 4.41Å; M104-K107 HydrophobicContact CE-CD 4.04Å; M104-K107 WeakPolarHBondContact O-CB 3.43Å; M104-K107 PolarHBondContact O-N 3.29Å; M104-I108 HydrophobicContact CB-CD1 4.43Å; M104-I108 VanDerWaalsContact O-CG1 3.27Å; M104-I108 WeakPolarHBondContact O-CG1 3.31Å; M104-I108 PolarHBondContact O-N 3.5Å
105	P	96.9	Very high	95.8	Very high	54 Å²	54	33.5 Å²	33.5	35%	0.351	19%	0.19	S	C	.	.	H	α-helix	trans	-55.8	-36.7	176.6	-28.3	37.6	0	0	0	113.8	F62 V102 W103 I108 S109	F62-P105 HydrophobicContact CD2-CG 3.88Å; F62-P105 HydrophobicContact CE1-CG 4.45Å; F62-P105 HydrophobicContact CE2-CG 3.55Å; F62-P105 HydrophobicContact CG-CG 4.45Å; F62-P105 HydrophobicContact CZ-CG 3.87Å; V102-P105 WeakPolarHBondContact O-CD 3.42Å; W103-P105 VanDerWaalsContact C-N 3.35Å; P105-I108 PolarHBondContact O-N 2.88Å; P105-S109 WeakPolarHBondContact O-CB 3.26Å; P105-S109 PolarHBondContact O-N 3.4Å
106	L	96.3	Very high	95.6	Very high	37 Å²	37	32 Å²	32	19%	0.194	18%	0.183	C	C	.	.	H	α-helix	trans	-69.4	-40.5	176.3	-59.6	177.5	0	0	0	111.4	W103 M104 S109 Y110 W117 Y119 L123 L127	W103-L106 HydrophobicContact CE3-CD1 3.95Å; W103-L106 HydrophobicContact CZ3-CD1 4.48Å; W103-L106 PolarHBondContact O-N 3.23Å; W103-L106 VanDerWaalsContact O-N 3.15Å; M104-L106 PolarHBondContact O-N 3.08Å; L106-S109 PolarHBondContact O-N 2.88Å; L106-Y110 WeakPolarHBondContact O-CB 3.36Å; L106-Y110 PolarHBondContact O-N 2.03Å; L106-W117 HydrophobicContact CB-CH2 4.12Å; L106-W117 HydrophobicContact CB-CZ3 4.45Å; L106-Y119 HydrophobicContact CB-CE2 4.37Å; L106-Y119 HydrophobicContact CD2-CD1 4.19Å; L106-Y119 HydrophobicContact CD2-CD2 4.37Å; L106-Y119 HydrophobicContact CD2-CE1 3.87Å; L106-Y119 HydrophobicContact CD2-CE2 4.07Å; L106-Y119 HydrophobicContact CD2-CG 4.43Å; L106-L123 HydrophobicContact CD1-CD1 4.31Å; L106-L123 HydrophobicContact CD1-CD2 3.44Å; L106-L123 VanDerWaalsContact CD1-CD2 3.44Å; L106-L123 HydrophobicContact CD1-CG 3.88Å; L106-L127 HydrophobicContact CB-CD1 4.29Å
107	K	94.9	Very high	95.5	Very high	25 Å²	25	32.2 Å²	32.2	11%	0.109	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-40.3	175.6	-152.5	178.2	-173.6	-177.5	0	112	Y58 W103 M104 Y110 H111 L127	Y58-K107 HydrophobicContact CD1-CD 4.5Å; Y58-K107 HydrophobicContact CD2-CD 4.2Å; Y58-K107 HydrophobicContact CD2-CG 4.34Å; Y58-K107 HydrophobicContact CE1-CD 4.14Å; Y58-K107 HydrophobicContact CE2-CD 3.83Å; Y58-K107 HydrophobicContact CE2-CG 4.18Å; Y58-K107 WeakPolarHBondContact OH-CE 3.4Å; Y58-K107 PolarHBondContact OH-NZ 3.31Å; W103-K107 PolarHBondContact O-N 3.13Å; M104-K107 HydrophobicContact CE-CB 4.41Å; M104-K107 HydrophobicContact CE-CD 4.04Å; M104-K107 WeakPolarHBondContact O-CB 3.43Å; M104-K107 PolarHBondContact O-N 3.29Å; K107-Y110 WeakPolarHBondContact O-CB 3.47Å; K107-Y110 PolarHBondContact O-N 2.88Å; K107-H111 PolarHBondContact O-CD2 2.96Å; K107-H111 PolarHBondContact O-N 2.83Å; K107-L127 HydrophobicContact CB-CD1 3.98Å; K107-L127 HydrophobicContact CD-CD2 4.22Å; K107-L127 HydrophobicContact CG-CD1 4.33Å; K107-L127 HydrophobicContact CG-CD2 4.37Å
108	I	96.6	Very high	95.3	Very high	27 Å²	27	37.7 Å²	37.7	14%	0.138	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-50.3	176.1	-66.1	159.8	0	0	0	109.5	P55 F62 M104 P105 Y110 H111 V112	P55-I108 HydrophobicContact CB-CG2 4.39Å; F62-I108 HydrophobicContact CB-CD1 4.29Å; M104-I108 HydrophobicContact CB-CD1 4.43Å; M104-I108 VanDerWaalsContact O-CG1 3.27Å; M104-I108 WeakPolarHBondContact O-CG1 3.31Å; M104-I108 PolarHBondContact O-N 3.5Å; P105-I108 PolarHBondContact O-N 2.88Å; I108-Y110 VanDerWaalsContact C-N 3.29Å; I108-Y110 PolarHBondContact O-N 2.5Å; I108-H111 PolarHBondContact O-N 3.36Å; I108-V112 HydrophobicContact CG2-CG2 4.22Å; I108-V112 WeakPolarHBondContact O-CG2 3.4Å; I108-V112 PolarHBondContact O-N 3.48Å
109	S	96.9	Very high	95.1	Very high	32 Å²	32	40.4 Å²	40.4	22%	0.224	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-41.9	177.3	179.6	0	0	0	0	112.2	P105 L106 H111 V112 N113 Y119	P105-S109 WeakPolarHBondContact O-CB 3.26Å; P105-S109 PolarHBondContact O-N 3.4Å; L106-S109 PolarHBondContact O-N 2.88Å; S109-H111 PolarHBondContact O-N 2.96Å; S109-V112 PolarHBondContact O-N 3.32Å; S109-N113 WeakPolarHBondContact O-CB 3.08Å; S109-N113 VanDerWaalsContact O-CG 3.32Å; S109-N113 PolarHBondContact O-N 3.4Å; S109-N113 PolarHBondContact O-ND2 3.18Å; S109-N113 PolarHBondContact OG-ND2 2.94Å; S109-Y119 VanDerWaalsContact CB-OH 3.26Å; S109-Y119 WeakPolarHBondContact CB-OH 3.47Å; S109-Y119 PolarHBondContact OG-OH 2.83Å
110	Y	95.3	Very high	94.9	Very high	5 Å²	5	39 Å²	39	2%	0.02	22%	0.221	C	C	.	.	H	α-helix	trans	-55.1	-52.9	174.9	165.5	-108.2	0	0	0	112.6	L106 K107 I108 N113 N115 N116 W117 T201 C202 D204	L106-Y110 WeakPolarHBondContact O-CB 3.36Å; L106-Y110 PolarHBondContact O-N 2.03Å; K107-Y110 WeakPolarHBondContact O-CB 3.47Å; K107-Y110 PolarHBondContact O-N 2.88Å; I108-Y110 VanDerWaalsContact C-N 3.29Å; I108-Y110 PolarHBondContact O-N 2.5Å; Y110-N113 PolarHBondContact O-N 2.86Å; Y110-N115 HydrophobicContact CE1-CB 4.18Å; Y110-N115 HydrophobicContact CE2-CB 4.18Å; Y110-N115 WeakPolarHBondContact CE2-O 3.06Å; Y110-N115 VanDerWaalsContact O-CA 3.25Å; Y110-N115 WeakPolarHBondContact O-CA 3.14Å; Y110-N115 PolarHBondContact O-N 2.9Å; Y110-N116 PolarHBondContact O-N 3.01Å; Y110-W117 HydrophobicContact CD2-CB 3.8Å; Y110-W117 AromaticContact CD2-CE3 3.79Å; Y110-W117 HydrophobicContact CD2-CE3 3.79Å; Y110-W117 HydrophobicContact CE2-CB 3.88Å; Y110-W117 AromaticContact CG-CE3 3.93Å; Y110-W117 HydrophobicContact CG-CE3 3.93Å; Y110-T201 WeakPolarHBondContact OH-CA 3.41Å; Y110-C202 HydrophobicContact CE2-CB 4.32Å; Y110-C202 PolarHBondContact OH-N 3.13Å; Y110-D204 VanDerWaalsContact CE1-OD2 3.29Å; Y110-D204 WeakPolarHBondContact CE1-OD2 3.38Å; Y110-D204 VanDerWaalsContact CZ-OD2 3.31Å; Y110-D204 PolarHBondContact OH-OD2 2.96Å
111	H	94.3	Very high	94.7	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-69.4	-37.3	-177.9	-74.5	-61.2	0	0	0	112.8	T50 F54 P55 Y58 K107 I108 S109 N113 G114 N115	T50-H111 WeakPolarHBondContact O-CB 3.32Å; T50-H111 PolarHBondContact O-ND1 2.82Å; F54-H111 AromaticContact CD2-CE1 3.78Å; P55-H111 HydrophobicContact CG-CB 3.55Å; Y58-H111 AromaticContact CD2-CD2 3.78Å; Y58-H111 AromaticContact CE2-CD2 3.45Å; Y58-H111 VanDerWaalsContact CE2-CD2 3.45Å; Y58-H111 WeakPolarHBondContact CE2-CD2 3.31Å; Y58-H111 AromaticContact CE2-NE2 3.42Å; Y58-H111 WeakPolarHBondContact CE2-NE2 3.47Å; K107-H111 PolarHBondContact O-CD2 2.96Å; K107-H111 PolarHBondContact O-N 2.83Å; I108-H111 PolarHBondContact O-N 3.36Å; S109-H111 PolarHBondContact O-N 2.96Å; H111-N113 VanDerWaalsContact C-N 3.32Å; H111-N113 PolarHBondContact O-N 2.75Å; H111-G114 PolarHBondContact O-N 3.01Å; H111-N115 PolarHBondContact ND1-OD1 3.41Å
112	V	95	Very high	94.5	Very high	89 Å²	89	45.1 Å²	45.1	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-65.9	-34.5	176.2	171.2	0	0	0	0	111.8	P55 I108 S109 G114	P55-V112 HydrophobicContact CB-CG2 3.85Å; P55-V112 HydrophobicContact CG-CG2 3.92Å; I108-V112 HydrophobicContact CG2-CG2 4.22Å; I108-V112 WeakPolarHBondContact O-CG2 3.4Å; I108-V112 PolarHBondContact O-N 3.48Å; S109-V112 PolarHBondContact O-N 3.32Å; V112-G114 PolarHBondContact O-N 2.87Å; V112-G114 VanDerWaalsContact O-N 3.1Å
113	N	94	Very high	94.4	Very high	81 Å²	81	43.3 Å²	43.3	43%	0.433	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	25	175.4	-70.1	-47.4	0	0	0	113.2	S109 Y110 H111 N116	S109-N113 WeakPolarHBondContact O-CB 3.08Å; S109-N113 VanDerWaalsContact O-CG 3.32Å; S109-N113 PolarHBondContact O-N 3.4Å; S109-N113 PolarHBondContact O-ND2 3.18Å; S109-N113 PolarHBondContact OG-ND2 2.94Å; Y110-N113 PolarHBondContact O-N 2.86Å; H111-N113 VanDerWaalsContact C-N 3.32Å; H111-N113 PolarHBondContact O-N 2.75Å; N113-N116 VanDerWaalsContact O-CB 3.32Å; N113-N116 WeakPolarHBondContact O-CB 3.43Å
114	G	91.1	Very high	94.3	Very high	31 Å²	31	40 Å²	40	32%	0.32	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	42.4	178.7	0	0	0	0	0	113	H111 V112 N116	H111-G114 PolarHBondContact O-N 3.01Å; V112-G114 PolarHBondContact O-N 2.87Å; V112-G114 VanDerWaalsContact O-N 3.1Å; G114-N116 VanDerWaalsContact C-N 3.29Å; G114-N116 PolarHBondContact O-N 2.89Å
115	N	91.1	Very high	94.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	57.9	37.8	-177.3	-58.2	-42.9	0	0	0	113.6	L45 T50 Y110 H111 M199	L45-N115 HydrophobicContact CD2-CB 4.32Å; L45-N115 PolarHBondContact O-ND2 3.46Å; T50-N115 WeakPolarHBondContact CB-ND2 3.38Å; T50-N115 PolarHBondContact OG1-ND2 2.95Å; Y110-N115 HydrophobicContact CE1-CB 4.18Å; Y110-N115 HydrophobicContact CE2-CB 4.18Å; Y110-N115 WeakPolarHBondContact CE2-O 3.06Å; Y110-N115 VanDerWaalsContact O-CA 3.25Å; Y110-N115 WeakPolarHBondContact O-CA 3.14Å; Y110-N115 PolarHBondContact O-N 2.9Å; H111-N115 PolarHBondContact ND1-OD1 3.41Å; N115-M199 HydrophobicContact CB-CE 4.43Å; N115-M199 HydrophobicContact CB-SD 3.89Å; N115-M199 WeakPolarHBondContact O-CG 3.26Å
116	N	93.4	Very high	94.1	Very high	35 Å²	35	40.4 Å²	40.4	19%	0.187	23%	0.232	C	C	.	.			trans	-106.1	112.5	177.7	-169.9	20.9	0	0	0	111.8	Y110 N113 G114 L118 N198 M199 T200	Y110-N116 PolarHBondContact O-N 3.01Å; N113-N116 VanDerWaalsContact O-CB 3.32Å; N113-N116 WeakPolarHBondContact O-CB 3.43Å; G114-N116 VanDerWaalsContact C-N 3.29Å; G114-N116 PolarHBondContact O-N 2.89Å; N116-L118 WeakPolarHBondContact ND2-CD2 3.26Å; N116-N198 PolarHBondContact ND2-O 3.02Å; N116-M199 HydrophobicContact CB-CG 4.33Å; N116-T200 PolarHBondContact OD1-N 3.42Å
117	W	94.4	Very high	94	Very high	9 Å²	9	39.1 Å²	39.1	3%	0.034	23%	0.225	C	C	.	.			trans	-87.3	109.5	-178.2	-172.3	-98.7	0	0	0	111.3	L106 Y110 Y119 G120 L123 C124 L127 T191 T200 C202	L106-W117 HydrophobicContact CB-CH2 4.12Å; L106-W117 HydrophobicContact CB-CZ3 4.45Å; Y110-W117 HydrophobicContact CD2-CB 3.8Å; Y110-W117 AromaticContact CD2-CE3 3.79Å; Y110-W117 HydrophobicContact CD2-CE3 3.79Å; Y110-W117 HydrophobicContact CE2-CB 3.88Å; Y110-W117 AromaticContact CG-CE3 3.93Å; Y110-W117 HydrophobicContact CG-CE3 3.93Å; W117-Y119 HydrophobicContact CD2-CD2 4.05Å; W117-Y119 AromaticContact CE2-CD2 3.93Å; W117-Y119 HydrophobicContact CE3-CD2 4.06Å; W117-Y119 AromaticContact CH2-CD2 3.82Å; W117-Y119 HydrophobicContact CH2-CD2 3.82Å; W117-Y119 AromaticContact CZ2-CD2 3.84Å; W117-Y119 HydrophobicContact CZ2-CD2 3.84Å; W117-Y119 HydrophobicContact CZ2-CG 4.26Å; W117-Y119 AromaticContact CZ3-CD2 3.95Å; W117-Y119 HydrophobicContact CZ3-CD2 3.95Å; W117-Y119 HydrophobicContact CZ3-CE2 4.44Å; W117-G120 PolarHBondContact NE1-O 3.42Å; W117-L123 HydrophobicContact CZ2-CB 4.01Å; W117-L123 HydrophobicContact CZ2-CD2 4.49Å; W117-L123 HydrophobicContact CZ2-CG 4.2Å; W117-C124 HydrophobicContact CD2-CB 4.49Å; W117-C124 HydrophobicContact CZ2-CB 4.13Å; W117-L127 HydrophobicContact CH2-CB 4.47Å; W117-L127 HydrophobicContact CH2-CD1 3.54Å; W117-L127 HydrophobicContact CZ3-CD1 3.75Å; W117-T191 HydrophobicContact CG-CG2 4.43Å; W117-T200 HydrophobicContact CB-CG2 4.48Å; W117-T200 VanDerWaalsContact CB-O 3.27Å; W117-T200 WeakPolarHBondContact CB-O 3.19Å; W117-T200 PolarHBondContact N-O 3.32Å; W117-C202 HydrophobicContact CB-CB 3.96Å; W117-C202 HydrophobicContact CD2-CB 3.76Å; W117-C202 HydrophobicContact CE3-CB 3.87Å; W117-C202 HydrophobicContact CG-CB 3.79Å
118	L	94.1	Very high	93.9	Very high	114 Å²	114	38.2 Å²	38.2	60%	0.597	22%	0.221	S	C	*	.			trans	-99.3	-4.7	-174.6	-59.5	178.3	0	0	0	114.1	N116	N116-L118 WeakPolarHBondContact ND2-CD2 3.26Å
119	Y	93.9	Very high	93.8	Very high	86 Å²	86	37.2 Å²	37.2	34%	0.337	22%	0.217	S	C	.	.	S	Bend	trans	-99.6	5.6	-166.6	-48.9	-76.7	0	0	0	114.6	L106 S109 W117 L123	L106-Y119 HydrophobicContact CB-CE2 4.37Å; L106-Y119 HydrophobicContact CD2-CD1 4.19Å; L106-Y119 HydrophobicContact CD2-CD2 4.37Å; L106-Y119 HydrophobicContact CD2-CE1 3.87Å; L106-Y119 HydrophobicContact CD2-CE2 4.07Å; L106-Y119 HydrophobicContact CD2-CG 4.43Å; S109-Y119 VanDerWaalsContact CB-OH 3.26Å; S109-Y119 WeakPolarHBondContact CB-OH 3.47Å; S109-Y119 PolarHBondContact OG-OH 2.83Å; W117-Y119 HydrophobicContact CD2-CD2 4.05Å; W117-Y119 AromaticContact CE2-CD2 3.93Å; W117-Y119 HydrophobicContact CE3-CD2 4.06Å; W117-Y119 AromaticContact CH2-CD2 3.82Å; W117-Y119 HydrophobicContact CH2-CD2 3.82Å; W117-Y119 AromaticContact CZ2-CD2 3.84Å; W117-Y119 HydrophobicContact CZ2-CD2 3.84Å; W117-Y119 HydrophobicContact CZ2-CG 4.26Å; W117-Y119 AromaticContact CZ3-CD2 3.95Å; W117-Y119 HydrophobicContact CZ3-CD2 3.95Å; W117-Y119 HydrophobicContact CZ3-CE2 4.44Å; Y119-L123 VanDerWaalsContact CB-CD2 3.48Å; Y119-L123 HydrophobicContact CD1-CD2 4.45Å; Y119-L123 HydrophobicContact CG-CD2 4.05Å
120	G	93	Very high	93.7	Very high	36 Å²	36	38.6 Å²	38.6	37%	0.371	22%	0.219	S	C	.	.			trans	79.1	161.9	179.3	0	0	0	0	0	114.8	W117 P122 L123 C124	W117-G120 PolarHBondContact NE1-O 3.42Å; G120-P122 VanDerWaalsContact C-CD 3.5Å; G120-L123 PolarHBondContact O-N 2.79Å; G120-C124 PolarHBondContact O-N 2.95Å
121	E	91.2	Very high	93.7	Very high	34 Å²	34	39 Å²	39	16%	0.159	22%	0.221	C	C	.	.	H	α-helix	trans	-55	-45.2	-177.4	-179.6	63.1	-146.1	0	0	114.1	L123 C124 K125 D189 H190 T191	E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.47Å; E121-C124 WeakPolarHBondContact O-CB 3.44Å; E121-C124 PolarHBondContact O-N 3.47Å; E121-C124 VanDerWaalsContact O-N 3.11Å; E121-K125 HydrophobicContact CG-CD 4.35Å; E121-K125 PolarHBondContact O-N 2.88Å; E121-K125 WeakPolarHBondContact OE1-CE 3.17Å; E121-K125 IonicContact OE1-NZ 4Å; E121-D189 VanDerWaalsContact OE1-CA 3.29Å; E121-D189 WeakPolarHBondContact OE1-CA 3.42Å; E121-H190 IonicContact OE1-CD2 2.71Å; E121-H190 PolarHBondContact OE1-N 3.33Å; E121-T191 WeakPolarHBondContact OE2-CA 3.37Å; E121-T191 WeakPolarHBondContact OE2-CB 3.08Å; E121-T191 WeakPolarHBondContact OE2-CG2 3.31Å; E121-T191 PolarHBondContact OE2-N 3.09Å; E121-T191 PolarHBondContact OE2-OG1 3.27Å
122	P	93.6	Very high	93.7	Very high	96 Å²	96	38.9 Å²	38.9	62%	0.623	22%	0.221	S	C	*	.	H	α-helix	trans	-59.5	-38.7	-176.9	-25	35.5	0	0	0	113	G120 K125 V126	G120-P122 VanDerWaalsContact C-CD 3.5Å; P122-K125 PolarHBondContact O-N 3.46Å; P122-V126 WeakPolarHBondContact O-CG2 3.21Å; P122-V126 PolarHBondContact O-N 3.48Å
123	L	94.4	Very high	93.7	Very high	47 Å²	47	35.1 Å²	35.1	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-76	-29.1	-178.8	-159.6	63.4	0	0	0	112	W103 L106 W117 Y119 G120 E121 V126 L127	W103-L123 HydrophobicContact CE3-CD1 4.36Å; W103-L123 HydrophobicContact CZ3-CD1 3.79Å; L106-L123 HydrophobicContact CD1-CD1 4.31Å; L106-L123 HydrophobicContact CD1-CD2 3.44Å; L106-L123 VanDerWaalsContact CD1-CD2 3.44Å; L106-L123 HydrophobicContact CD1-CG 3.88Å; W117-L123 HydrophobicContact CZ2-CB 4.01Å; W117-L123 HydrophobicContact CZ2-CD2 4.49Å; W117-L123 HydrophobicContact CZ2-CG 4.2Å; Y119-L123 VanDerWaalsContact CB-CD2 3.48Å; Y119-L123 HydrophobicContact CD1-CD2 4.45Å; Y119-L123 HydrophobicContact CG-CD2 4.05Å; G120-L123 PolarHBondContact O-N 2.79Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.47Å; L123-V126 HydrophobicContact CD1-CB 4.48Å; L123-V126 PolarHBondContact O-N 2.85Å; L123-L127 WeakPolarHBondContact O-CB 3.33Å; L123-L127 PolarHBondContact O-N 3.44Å
124	C	94.4	Very high	93.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-48.2	169.7	-179.3	0	0	0	0	110.3	W117 G120 E121 V126 L127 V128 H190 T191 C202	W117-C124 HydrophobicContact CD2-CB 4.49Å; W117-C124 HydrophobicContact CZ2-CB 4.13Å; G120-C124 PolarHBondContact O-N 2.95Å; E121-C124 WeakPolarHBondContact O-CB 3.44Å; E121-C124 PolarHBondContact O-N 3.47Å; E121-C124 VanDerWaalsContact O-N 3.11Å; C124-V126 VanDerWaalsContact C-N 3.3Å; C124-V126 PolarHBondContact O-N 3.13Å; C124-L127 PolarHBondContact O-N 2.87Å; C124-V128 WeakPolarHBondContact O-CB 3.32Å; C124-V128 VanDerWaalsContact O-CG2 3.24Å; C124-V128 WeakPolarHBondContact O-CG2 3.34Å; C124-V128 PolarHBondContact O-N 3.31Å; C124-H190 WeakPolarHBondContact SG-CB 3.23Å; C124-T191 HydrophobicContact CB-CG2 3.68Å; C124-C202 VanDerWaalsContact CA-SG 3.58Å; C124-C202 HydrophobicContact CB-CB 4.07Å; C124-C202 WeakPolarHBondContact CB-SG 3.44Å; C124-C202 VanDerWaalsContact SG-CA 3.53Å; C124-C202 WeakPolarHBondContact SG-CB 3.17Å; C124-C202 CovalentContact SG-SG 2.03Å; C124-C202 PolarHBondContact SG-SG 3.48Å
125	K	93.3	Very high	94	Very high	30 Å²	30	30.2 Å²	30.2	13%	0.13	17%	0.166	C	C	.	.	H	α-helix	trans	-56.2	-43.2	175.5	-70.1	-179	-177.4	-167.6	0	112.3	E121 P122 S129 Y186 Y188 D189	E121-K125 HydrophobicContact CG-CD 4.35Å; E121-K125 PolarHBondContact O-N 2.88Å; E121-K125 WeakPolarHBondContact OE1-CE 3.17Å; E121-K125 IonicContact OE1-NZ 4Å; P122-K125 PolarHBondContact O-N 3.46Å; K125-S129 VanDerWaalsContact O-CB 3.25Å; K125-S129 WeakPolarHBondContact O-CB 3.14Å; K125-S129 PolarHBondContact O-N 3.49Å; K125-S129 PolarHBondContact O-OG 3.46Å; K125-Y186 HydrophobicContact CB-CD1 3.79Å; K125-Y186 HydrophobicContact CB-CE1 3.92Å; K125-Y186 HydrophobicContact CD-CD1 4.32Å; K125-Y186 PolarHBondContact NZ-O 3.22Å; K125-Y188 WeakPolarHBondContact CE-O 3.49Å; K125-Y188 PolarHBondContact NZ-O 3.1Å; K125-Y188 VanDerWaalsContact NZ-O 3.17Å; K125-D189 IonicContact NZ-OD1 3.93Å; K125-D189 PolarHBondContact NZ-OD1 3.12Å
126	V	94.4	Very high	94.2	Very high	33 Å²	33	30.2 Å²	30.2	20%	0.2	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-51.2	176.2	169.2	0	0	0	0	111.1	W103 P122 L123 C124 V128 S129 F130 Y186	W103-V126 HydrophobicContact CD2-CG1 4.19Å; W103-V126 HydrophobicContact CE3-CG1 4.36Å; W103-V126 HydrophobicContact CH2-CG1 3.87Å; W103-V126 HydrophobicContact CZ2-CG1 3.67Å; W103-V126 HydrophobicContact CZ3-CG1 4.22Å; P122-V126 WeakPolarHBondContact O-CG2 3.21Å; P122-V126 PolarHBondContact O-N 3.48Å; L123-V126 HydrophobicContact CD1-CB 4.48Å; L123-V126 PolarHBondContact O-N 2.85Å; C124-V126 VanDerWaalsContact C-N 3.3Å; C124-V126 PolarHBondContact O-N 3.13Å; V126-V128 PolarHBondContact O-N 3.2Å; V126-S129 PolarHBondContact O-N 3.02Å; V126-F130 HydrophobicContact CG1-CD2 3.7Å; V126-F130 HydrophobicContact CG1-CE2 3.83Å; V126-F130 WeakPolarHBondContact O-CD2 3.22Å; V126-F130 PolarHBondContact O-N 2.93Å; V126-Y186 HydrophobicContact CG2-CE1 4.49Å
127	L	94.8	Very high	94.3	Very high	10 Å²	10	28.6 Å²	28.6	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-46.8	-179.7	-175.4	156	0	0	0	111.7	L106 K107 W117 L123 C124 F130 F131	L106-L127 HydrophobicContact CB-CD1 4.29Å; K107-L127 HydrophobicContact CB-CD1 3.98Å; K107-L127 HydrophobicContact CD-CD2 4.22Å; K107-L127 HydrophobicContact CG-CD1 4.33Å; K107-L127 HydrophobicContact CG-CD2 4.37Å; W117-L127 HydrophobicContact CH2-CB 4.47Å; W117-L127 HydrophobicContact CH2-CD1 3.54Å; W117-L127 HydrophobicContact CZ3-CD1 3.75Å; L123-L127 WeakPolarHBondContact O-CB 3.33Å; L123-L127 PolarHBondContact O-N 3.44Å; C124-L127 PolarHBondContact O-N 2.87Å; L127-F130 PolarHBondContact O-N 2.91Å; L127-F131 WeakPolarHBondContact O-CB 3.38Å; L127-F131 PolarHBondContact O-N 3.4Å
128	V	93.1	Very high	94.4	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.2	173.2	0	0	0	0	111.1	C124 V126 F131 Y132 L185 H203	C124-V128 WeakPolarHBondContact O-CB 3.32Å; C124-V128 VanDerWaalsContact O-CG2 3.24Å; C124-V128 WeakPolarHBondContact O-CG2 3.34Å; C124-V128 PolarHBondContact O-N 3.31Å; V126-V128 PolarHBondContact O-N 3.2Å; V128-F131 PolarHBondContact O-N 2.95Å; V128-Y132 HydrophobicContact CG1-CD2 3.69Å; V128-Y132 HydrophobicContact CG1-CE2 3.63Å; V128-Y132 VanDerWaalsContact O-CD2 3.3Å; V128-Y132 WeakPolarHBondContact O-CD2 3.26Å; V128-Y132 PolarHBondContact O-N 2.95Å; V128-L185 HydrophobicContact CG1-CD1 4.49Å; V128-H203 HydrophobicContact CG2-CB 3.53Å
129	S	93.9	Very high	94.6	Very high	6 Å²	6	22.7 Å²	22.7	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-42.2	-179.3	-60.5	0	0	0	0	112.3	K125 V126 G133 Y186	K125-S129 VanDerWaalsContact O-CB 3.25Å; K125-S129 WeakPolarHBondContact O-CB 3.14Å; K125-S129 PolarHBondContact O-N 3.49Å; K125-S129 PolarHBondContact O-OG 3.46Å; V126-S129 PolarHBondContact O-N 3.02Å; S129-G133 VanDerWaalsContact O-CA 3.32Å; S129-G133 WeakPolarHBondContact O-CA 3.29Å; S129-G133 PolarHBondContact O-N 2.95Å; S129-Y186 VanDerWaalsContact CB-OH 3.28Å; S129-Y186 WeakPolarHBondContact CB-OH 3.24Å; S129-Y186 WeakPolarHBondContact OG-CE2 3.24Å; S129-Y186 PolarHBondContact OG-OH 3.07Å
130	F	95.6	Very high	94.7	Very high	62 Å²	62	20 Å²	20	27%	0.272	12%	0.118	S	C	.	.	H	α-helix	trans	-69.9	-31.7	175.4	-82.9	-73.5	0	0	0	112.9	L99 W103 V126 L127 N134	L99-F130 HydrophobicContact CB-CD1 3.95Å; L99-F130 HydrophobicContact CB-CE1 3.85Å; L99-F130 HydrophobicContact CD1-CE1 4.42Å; L99-F130 HydrophobicContact CD2-CE1 4.39Å; L99-F130 HydrophobicContact CG-CE1 4.45Å; L99-F130 WeakPolarHBondContact O-CD1 3.39Å; W103-F130 AromaticContact CD1-CD2 3.8Å; W103-F130 AromaticContact CD1-CG 3.82Å; W103-F130 AromaticContact CE2-CD2 3.89Å; W103-F130 HydrophobicContact CZ2-CD2 4.36Å; W103-F130 HydrophobicContact CZ2-CE2 4.05Å; W103-F130 AromaticContact NE1-CD2 3.21Å; W103-F130 AromaticContact NE1-CE2 3.56Å; W103-F130 AromaticContact NE1-CG 3.55Å; V126-F130 HydrophobicContact CG1-CD2 3.7Å; V126-F130 HydrophobicContact CG1-CE2 3.83Å; V126-F130 WeakPolarHBondContact O-CD2 3.22Å; V126-F130 PolarHBondContact O-N 2.93Å; L127-F130 PolarHBondContact O-N 2.91Å; F130-N134 WeakPolarHBondContact O-CB 3.23Å; F130-N134 PolarHBondContact O-N 2.71Å
131	F	94.9	Very high	94.9	Very high	12 Å²	12	18.2 Å²	18.2	5%	0.053	10%	0.1	C	C	.	.	H	α-helix	trans	-63.4	-55.3	173.9	173.7	-90.6	0	0	0	111.8	F100 L127 V128 N134 M135 L313 A316	F100-F131 HydrophobicContact CD2-CB 4.24Å; F100-F131 HydrophobicContact CE2-CB 3.9Å; F100-F131 AromaticContact CE2-CD2 3.51Å; F100-F131 HydrophobicContact CE2-CD2 3.51Å; F100-F131 HydrophobicContact CE2-CG 4.16Å; F100-F131 AromaticContact CZ-CD2 3.83Å; F100-F131 HydrophobicContact CZ-CD2 3.83Å; F100-F131 HydrophobicContact CZ-CE2 4.43Å; L127-F131 WeakPolarHBondContact O-CB 3.38Å; L127-F131 PolarHBondContact O-N 3.4Å; V128-F131 PolarHBondContact O-N 2.95Å; F131-N134 PolarHBondContact O-N 3.27Å; F131-M135 PolarHBondContact O-N 2.99Å; F131-L313 HydrophobicContact CE1-CD2 3.89Å; F131-L313 HydrophobicContact CZ-CB 4.25Å; F131-L313 HydrophobicContact CZ-CD2 4.04Å; F131-L313 WeakPolarHBondContact CZ-O 3.43Å; F131-A316 HydrophobicContact CZ-CB 4.11Å
132	Y	94	Very high	95	Very high	1 Å²	1	16.7 Å²	16.7	0%	0.004	9%	0.093	C	C	.	.	H	α-helix	trans	-70.7	-36.9	179.1	-70.5	-62.3	0	0	0	112.5	V128 N134 M135 Y136 L185 H203 F226 L290 L313	V128-Y132 HydrophobicContact CG1-CD2 3.69Å; V128-Y132 HydrophobicContact CG1-CE2 3.63Å; V128-Y132 VanDerWaalsContact O-CD2 3.3Å; V128-Y132 WeakPolarHBondContact O-CD2 3.26Å; V128-Y132 PolarHBondContact O-N 2.95Å; Y132-N134 VanDerWaalsContact C-N 3.32Å; Y132-N134 PolarHBondContact O-N 3.27Å; Y132-M135 HydrophobicContact CD1-CE 4.37Å; Y132-M135 PolarHBondContact O-N 3Å; Y132-Y136 HydrophobicContact CD1-CE2 4.4Å; Y132-Y136 WeakPolarHBondContact O-CD2 3.43Å; Y132-Y136 PolarHBondContact O-N 3.12Å; Y132-L185 HydrophobicContact CD2-CD1 4Å; Y132-H203 AromaticContact CE2-CE1 3.99Å; Y132-H203 AromaticContact CE2-NE2 3.33Å; Y132-H203 VanDerWaalsContact CE2-NE2 3.33Å; Y132-H203 WeakPolarHBondContact CE2-NE2 3.24Å; Y132-H203 AromaticContact CZ-CE1 3.85Å; Y132-H203 AromaticContact CZ-NE2 3.55Å; Y132-H203 PolarHBondContact OH-CE1 3.46Å; Y132-H203 PolarHBondContact OH-NE2 2.96Å; Y132-F226 HydrophobicContact CD1-CE1 4.03Å; Y132-F226 HydrophobicContact CD2-CE1 4.19Å; Y132-F226 HydrophobicContact CD2-CZ 4.34Å; Y132-F226 AromaticContact CE1-CE1 3.67Å; Y132-F226 HydrophobicContact CE1-CE1 3.67Å; Y132-F226 HydrophobicContact CE1-CZ 4.27Å; Y132-F226 AromaticContact CE2-CE1 3.81Å; Y132-F226 HydrophobicContact CE2-CE1 3.81Å; Y132-F226 AromaticContact CE2-CZ 3.69Å; Y132-F226 HydrophobicContact CE2-CZ 3.69Å; Y132-F226 HydrophobicContact CG-CE1 4.28Å; Y132-F226 AromaticContact CZ-CE1 3.53Å; Y132-F226 AromaticContact CZ-CZ 3.65Å; Y132-L290 HydrophobicContact CE1-CD1 3.6Å; Y132-L313 HydrophobicContact CE1-CD2 4.38Å
133	G	95.1	Very high	95.1	Very high	9 Å²	9	12.9 Å²	12.9	9%	0.093	7%	0.068	C	C	.	.	H	α-helix	trans	-54.6	-49.4	173	0	0	0	0	0	110.8	S129 C137	S129-G133 VanDerWaalsContact O-CA 3.32Å; S129-G133 WeakPolarHBondContact O-CA 3.29Å; S129-G133 PolarHBondContact O-N 2.95Å; G133-C137 WeakPolarHBondContact O-CB 3.41Å; G133-C137 PolarHBondContact O-N 3.45Å
134	N	96.2	Very high	95.1	Very high	6 Å²	6	11.9 Å²	11.9	3%	0.032	6%	0.064	C	C	.	.	H	α-helix	trans	-60.6	-49.9	174	-179.7	61.8	0	0	0	112.4	A96 D97 F100 F130 F131 Y132 Y136 C137 S138 N319 S320	A96-N134 PolarHBondContact O-OD1 2.95Å; D97-N134 WeakPolarHBondContact CA-OD1 3.28Å; D97-N134 PolarHBondContact N-OD1 2.96Å; D97-N134 PolarHBondContact OD1-OD1 3.35Å; F100-N134 HydrophobicContact CB-CB 3.58Å; F100-N134 HydrophobicContact CD1-CB 4.42Å; F100-N134 WeakPolarHBondContact CD1-ND2 3.34Å; F100-N134 HydrophobicContact CD2-CB 4.44Å; F100-N134 HydrophobicContact CG-CB 3.91Å; F130-N134 WeakPolarHBondContact O-CB 3.23Å; F130-N134 PolarHBondContact O-N 2.71Å; F131-N134 PolarHBondContact O-N 3.27Å; Y132-N134 VanDerWaalsContact C-N 3.32Å; Y132-N134 PolarHBondContact O-N 3.27Å; N134-Y136 VanDerWaalsContact C-N 3.34Å; N134-Y136 PolarHBondContact O-N 3.5Å; N134-C137 PolarHBondContact O-N 2.82Å; N134-S138 WeakPolarHBondContact O-CB 3.39Å; N134-S138 PolarHBondContact O-N 3.47Å; N134-S138 PolarHBondContact O-OG 2.98Å; N134-S138 PolarHBondContact OD1-OG 2.89Å; N134-N319 PolarHBondContact ND2-ND2 3.31Å; N134-N319 PolarHBondContact ND2-OD1 2.89Å; N134-S320 PolarHBondContact ND2-OG 3.43Å
135	M	94.8	Very high	95	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.015	7%	0.066	C	C	.	.	H	α-helix	trans	-51.1	-52.2	-179.2	-171.4	179.6	85.1	0	0	112.2	F131 Y132 V139 F283 N287	F131-M135 PolarHBondContact O-N 2.99Å; Y132-M135 HydrophobicContact CD1-CE 4.37Å; Y132-M135 PolarHBondContact O-N 3Å; M135-V139 WeakPolarHBondContact O-CG2 3.45Å; M135-V139 PolarHBondContact O-N 3.14Å; M135-F283 HydrophobicContact CG-CD1 3.87Å; M135-F283 HydrophobicContact CG-CE1 3.99Å; M135-N287 WeakPolarHBondContact CE-ND2 3.47Å; M135-N287 WeakPolarHBondContact CE-OD1 3.38Å
136	Y	95.8	Very high	94.9	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-76.1	-36.9	-177.7	-63.9	-56.4	0	0	0	112.8	Y132 N134 S138 V139 L140 M229 S233	Y132-Y136 HydrophobicContact CD1-CE2 4.4Å; Y132-Y136 WeakPolarHBondContact O-CD2 3.43Å; Y132-Y136 PolarHBondContact O-N 3.12Å; N134-Y136 VanDerWaalsContact C-N 3.34Å; N134-Y136 PolarHBondContact O-N 3.5Å; Y136-S138 VanDerWaalsContact C-N 3.31Å; Y136-S138 PolarHBondContact O-N 3.1Å; Y136-V139 PolarHBondContact O-N 3.13Å; Y136-L140 VanDerWaalsContact O-CG 3.3Å; Y136-L140 WeakPolarHBondContact O-CG 3.29Å; Y136-L140 PolarHBondContact O-N 3.26Å; Y136-M229 HydrophobicContact CD1-CE 4.37Å; Y136-M229 HydrophobicContact CD2-CB 4.28Å; Y136-M229 HydrophobicContact CD2-CE 3.28Å; Y136-M229 HydrophobicContact CE1-CB 3.87Å; Y136-M229 HydrophobicContact CE2-CB 3.63Å; Y136-M229 HydrophobicContact CE2-CE 3.8Å; Y136-M229 HydrophobicContact CE2-CG 4.09Å; Y136-M229 HydrophobicContact CG-CE 3.62Å; Y136-M229 WeakPolarHBondContact OH-CB 3.36Å; Y136-S233 VanDerWaalsContact CD1-CB 3.4Å
137	C	96.6	Very high	94.8	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-61	-42.6	175.2	-162.8	0	0	0	0	110.9	A96 G133 N134 L140 F141 I178	A96-C137 HydrophobicContact CB-CB 4.12Å; G133-C137 WeakPolarHBondContact O-CB 3.41Å; G133-C137 PolarHBondContact O-N 3.45Å; N134-C137 PolarHBondContact O-N 2.82Å; C137-L140 PolarHBondContact O-N 2.94Å; C137-F141 WeakPolarHBondContact O-CD2 3.29Å; C137-F141 PolarHBondContact O-N 2.98Å; C137-F141 VanDerWaalsContact SG-CD2 3.57Å; C137-F141 WeakPolarHBondContact SG-CE2 3.48Å; C137-I178 HydrophobicContact CB-CG1 4.23Å
138	S	96.6	Very high	94.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.8	-46.3	177.1	-60.6	0	0	0	0	112.3	L93 N134 Y136 L140 F141 I142	L93-S138 WeakPolarHBondContact CD1-OG 3.41Å; N134-S138 WeakPolarHBondContact O-CB 3.39Å; N134-S138 PolarHBondContact O-N 3.47Å; N134-S138 PolarHBondContact O-OG 2.98Å; N134-S138 PolarHBondContact OD1-OG 2.89Å; Y136-S138 VanDerWaalsContact C-N 3.31Å; Y136-S138 PolarHBondContact O-N 3.1Å; S138-L140 VanDerWaalsContact C-N 3.34Å; S138-L140 PolarHBondContact O-N 2.6Å; S138-F141 PolarHBondContact O-N 3.18Å; S138-I142 WeakPolarHBondContact O-CB 3.43Å; S138-I142 WeakPolarHBondContact O-CD1 3.47Å; S138-I142 WeakPolarHBondContact O-CG1 3.04Å; S138-I142 PolarHBondContact O-N 3.45Å
139	V	96.3	Very high	94.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.6	-44.3	176.9	172.2	0	0	0	0	111.6	M135 Y136 T143 S233 F234 P237 F279 F283	M135-V139 WeakPolarHBondContact O-CG2 3.45Å; M135-V139 PolarHBondContact O-N 3.14Å; Y136-V139 PolarHBondContact O-N 3.13Å; V139-T143 WeakPolarHBondContact O-CB 3.44Å; V139-T143 PolarHBondContact O-N 3.37Å; V139-T143 PolarHBondContact O-OG1 2.94Å; V139-S233 WeakPolarHBondContact CG1-O 3.42Å; V139-F234 HydrophobicContact CG2-CD2 4.45Å; V139-P237 HydrophobicContact CG1-CB 3.49Å; V139-P237 VanDerWaalsContact CG1-CB 3.49Å; V139-P237 HydrophobicContact CG1-CG 4.1Å; V139-F279 HydrophobicContact CG1-CE1 4.28Å; V139-F279 HydrophobicContact CG1-CZ 4.05Å; V139-F279 HydrophobicContact CG2-CZ 4.34Å; V139-F283 HydrophobicContact CG2-CB 4.45Å; V139-F283 HydrophobicContact CG2-CD1 3.81Å; V139-F283 HydrophobicContact CG2-CD2 3.75Å; V139-F283 HydrophobicContact CG2-CE1 3.87Å; V139-F283 HydrophobicContact CG2-CE2 3.81Å; V139-F283 HydrophobicContact CG2-CG 3.76Å; V139-F283 HydrophobicContact CG2-CZ 3.87Å
140	L	97	Very high	93.8	Very high	28 Å²	28	17.8 Å²	17.8	15%	0.147	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-44.6	178.5	-68.1	174.4	0	0	0	111.7	Y136 C137 S138 T143 C144 V174 F177 I178 P237	Y136-L140 VanDerWaalsContact O-CG 3.3Å; Y136-L140 WeakPolarHBondContact O-CG 3.29Å; Y136-L140 PolarHBondContact O-N 3.26Å; C137-L140 PolarHBondContact O-N 2.94Å; S138-L140 VanDerWaalsContact C-N 3.34Å; S138-L140 PolarHBondContact O-N 2.6Å; L140-T143 VanDerWaalsContact O-CB 3.32Å; L140-T143 WeakPolarHBondContact O-CB 3.41Å; L140-T143 PolarHBondContact O-N 3.02Å; L140-C144 PolarHBondContact O-N 3.36Å; L140-C144 PolarHBondContact O-SG 3.28Å; L140-V174 HydrophobicContact CB-CG1 4.12Å; L140-V174 HydrophobicContact CB-CG2 4.35Å; L140-V174 HydrophobicContact CD1-CG1 4.01Å; L140-F177 HydrophobicContact CD1-CD1 4.07Å; L140-F177 HydrophobicContact CD1-CE1 4.25Å; L140-I178 HydrophobicContact CD1-CD1 4.07Å; L140-I178 HydrophobicContact CD1-CG1 4.47Å; L140-P237 HydrophobicContact CD2-CG 3.9Å
141	F	96.6	Very high	93.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-68.6	-37	177.7	-77.5	-48.5	0	0	0	113.3	Y89 N92 L93 C137 S138 T143 C144 L145 C171 V174	Y89-F141 HydrophobicContact CD1-CD1 4.04Å; Y89-F141 HydrophobicContact CD1-CE1 4.28Å; N92-F141 HydrophobicContact CB-CD1 4.4Å; N92-F141 HydrophobicContact CB-CD2 4.16Å; N92-F141 HydrophobicContact CB-CE1 3.81Å; N92-F141 HydrophobicContact CB-CE2 3.47Å; N92-F141 VanDerWaalsContact CB-CE2 3.47Å; N92-F141 HydrophobicContact CB-CZ 3.31Å; L93-F141 HydrophobicContact CB-CB 4.25Å; L93-F141 HydrophobicContact CD1-CB 4.08Å; C137-F141 WeakPolarHBondContact O-CD2 3.29Å; C137-F141 PolarHBondContact O-N 2.98Å; C137-F141 VanDerWaalsContact SG-CD2 3.57Å; C137-F141 WeakPolarHBondContact SG-CE2 3.48Å; S138-F141 PolarHBondContact O-N 3.18Å; F141-T143 PolarHBondContact O-N 3.31Å; F141-C144 PolarHBondContact O-N 3.11Å; F141-L145 WeakPolarHBondContact O-CB 3.17Å; F141-L145 VanDerWaalsContact O-CG 3.32Å; F141-L145 WeakPolarHBondContact O-CG 3.2Å; F141-L145 PolarHBondContact O-N 3.34Å; F141-C171 HydrophobicContact CE1-CB 4.1Å; F141-C171 HydrophobicContact CZ-CB 4.34Å; F141-V174 HydrophobicContact CE1-CB 4.26Å; F141-V174 HydrophobicContact CE1-CG1 4.2Å; F141-V174 HydrophobicContact CE1-CG2 4.46Å; F141-V174 HydrophobicContact CE2-CG1 4.13Å; F141-V174 HydrophobicContact CZ-CB 4.16Å; F141-V174 HydrophobicContact CZ-CG1 3.85Å
142	I	94.5	Very high	92.7	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-36.8	172	-67.7	165.6	0	0	0	110.4	L93 S138 L145 S146 I241 V275 F279 F283 I326	L93-I142 HydrophobicContact CD2-CG1 4.13Å; S138-I142 WeakPolarHBondContact O-CB 3.43Å; S138-I142 WeakPolarHBondContact O-CD1 3.47Å; S138-I142 WeakPolarHBondContact O-CG1 3.04Å; S138-I142 PolarHBondContact O-N 3.45Å; I142-L145 PolarHBondContact O-N 3.23Å; I142-S146 WeakPolarHBondContact O-CB 3.34Å; I142-S146 PolarHBondContact O-N 3.16Å; I142-S146 PolarHBondContact O-OG 3.29Å; I142-I241 HydrophobicContact CG2-CD1 4.11Å; I142-V275 HydrophobicContact CG2-CG1 3.82Å; I142-V275 HydrophobicContact CG2-CG2 3.97Å; I142-F279 HydrophobicContact CG2-CE2 4.04Å; I142-F283 HydrophobicContact CD1-CE2 4.01Å; I142-F283 HydrophobicContact CD1-CZ 4.44Å; I142-I326 HydrophobicContact CD1-CD1 4.01Å; I142-I326 HydrophobicContact CG1-CD1 4Å
143	T	95.5	Very high	92	Very high	16 Å²	16	22.1 Å²	22.1	10%	0.098	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-50	174.3	-57.1	0	0	0	0	111.3	V139 L140 F141 L145 S146 V147 P237 V240 I241	V139-T143 WeakPolarHBondContact O-CB 3.44Å; V139-T143 PolarHBondContact O-N 3.37Å; V139-T143 PolarHBondContact O-OG1 2.94Å; L140-T143 VanDerWaalsContact O-CB 3.32Å; L140-T143 WeakPolarHBondContact O-CB 3.41Å; L140-T143 PolarHBondContact O-N 3.02Å; F141-T143 PolarHBondContact O-N 3.31Å; T143-L145 VanDerWaalsContact C-N 3.29Å; T143-L145 PolarHBondContact O-N 3.03Å; T143-S146 PolarHBondContact O-N 3.15Å; T143-S146 VanDerWaalsContact O-N 3.13Å; T143-V147 WeakPolarHBondContact O-CG2 3.19Å; T143-V147 PolarHBondContact O-N 2.93Å; T143-P237 WeakPolarHBondContact OG1-CB 3.48Å; T143-V240 HydrophobicContact CG2-CB 3.91Å; T143-V240 HydrophobicContact CG2-CG1 3.58Å; T143-I241 HydrophobicContact CG2-CG1 4.22Å; T143-I241 WeakPolarHBondContact OG1-CD1 3.5Å
144	C	94.4	Very high	91.4	Very high	25 Å²	25	22.9 Å²	22.9	17%	0.169	12%	0.116	C	C	.	.	H	α-helix	trans	-57	-43	175.2	-65.5	0	0	0	0	111.7	Y89 L140 F141 Q148	Y89-C144 HydrophobicContact CD1-CB 3.97Å; Y89-C144 HydrophobicContact CD2-CB 4.11Å; Y89-C144 HydrophobicContact CE1-CB 3.9Å; Y89-C144 HydrophobicContact CE2-CB 4.03Å; Y89-C144 HydrophobicContact CG-CB 4.09Å; L140-C144 PolarHBondContact O-N 3.36Å; L140-C144 PolarHBondContact O-SG 3.28Å; F141-C144 PolarHBondContact O-N 3.11Å; C144-Q148 WeakPolarHBondContact O-CB 3.48Å; C144-Q148 PolarHBondContact O-N 3.06Å
145	L	91.5	Very high	90.4	Very high	6 Å²	6	26.1 Å²	26.1	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-61.7	-44.3	175.7	-77.9	169.6	0	0	0	112	Y89 M90 L93 F141 I142 T143 Q148 R149 I326	Y89-L145 HydrophobicContact CD2-CD2 4.29Å; Y89-L145 HydrophobicContact CG-CD2 4.5Å; M90-L145 HydrophobicContact CG-CD1 4.07Å; M90-L145 HydrophobicContact CG-CD2 3.97Å; L93-L145 HydrophobicContact CD2-CD1 4.36Å; F141-L145 WeakPolarHBondContact O-CB 3.17Å; F141-L145 VanDerWaalsContact O-CG 3.32Å; F141-L145 WeakPolarHBondContact O-CG 3.2Å; F141-L145 PolarHBondContact O-N 3.34Å; I142-L145 PolarHBondContact O-N 3.23Å; T143-L145 VanDerWaalsContact C-N 3.29Å; T143-L145 PolarHBondContact O-N 3.03Å; L145-Q148 PolarHBondContact O-N 3.28Å; L145-R149 WeakPolarHBondContact O-CB 3.33Å; L145-R149 WeakPolarHBondContact O-CG 3.48Å; L145-R149 PolarHBondContact O-N 3.01Å; L145-I326 HydrophobicContact CD1-CG2 4.35Å
146	S	91.3	Very high	89.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-46.1	-179.8	-57.3	0	0	0	0	111.4	I142 T143 R149 Y150 Y245	I142-S146 WeakPolarHBondContact O-CB 3.34Å; I142-S146 PolarHBondContact O-N 3.16Å; I142-S146 PolarHBondContact O-OG 3.29Å; T143-S146 PolarHBondContact O-N 3.15Å; T143-S146 VanDerWaalsContact O-N 3.13Å; S146-R149 PolarHBondContact O-N 2.76Å; S146-Y150 PolarHBondContact O-N 3.27Å; S146-Y245 PolarHBondContact OG-OH 3.1Å; S146-Y245 VanDerWaalsContact OG-OH 3.08Å
147	V	91.6	Very high	87.6	Confident	55 Å²	55	38.8 Å²	38.8	33%	0.333	20%	0.201	S	C	.	.	H	α-helix	trans	-64.3	-46.2	175.9	174.3	0	0	0	0	111.1	T143 R149 Y150 W151 V240 A244	T143-V147 WeakPolarHBondContact O-CG2 3.19Å; T143-V147 PolarHBondContact O-N 2.93Å; V147-R149 VanDerWaalsContact C-N 3.25Å; V147-R149 PolarHBondContact O-N 2.93Å; V147-Y150 PolarHBondContact O-N 3.38Å; V147-W151 WeakPolarHBondContact O-CB 3.37Å; V147-W151 PolarHBondContact O-N 3.28Å; V147-V240 HydrophobicContact CG2-CG1 3.61Å; V147-A244 HydrophobicContact CG2-CB 4.29Å
148	Q	88.1	Confident	85.9	Confident	26 Å²	26	40.4 Å²	40.4	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-41	176.8	-179.1	63.2	29.2	0	0	110.9	P85 S86 Y89 C144 L145 W151 V152	P85-Q148 HydrophobicContact CB-CG 4.3Å; S86-Q148 WeakPolarHBondContact OG-CG 3.44Å; Y89-Q148 HydrophobicContact CE2-CB 4.22Å; Y89-Q148 HydrophobicContact CE2-CG 4.44Å; C144-Q148 WeakPolarHBondContact O-CB 3.48Å; C144-Q148 PolarHBondContact O-N 3.06Å; L145-Q148 PolarHBondContact O-N 3.28Å; Q148-W151 PolarHBondContact O-N 2.93Å; Q148-V152 VanDerWaalsContact O-CG2 3.3Å; Q148-V152 WeakPolarHBondContact O-CG2 3.3Å; Q148-V152 PolarHBondContact O-N 3.48Å
149	R	85.8	Confident	84	Confident	65 Å²	65	45.7 Å²	45.7	25%	0.245	25%	0.25	C	C	.	.	H	α-helix	trans	-64.6	-46.6	178.3	-76.7	-64.3	-178.1	-169.4	0.5	112.4	L145 S146 V147 V153 L271 V330	L145-R149 WeakPolarHBondContact O-CB 3.33Å; L145-R149 WeakPolarHBondContact O-CG 3.48Å; L145-R149 PolarHBondContact O-N 3.01Å; S146-R149 PolarHBondContact O-N 2.76Å; V147-R149 VanDerWaalsContact C-N 3.25Å; V147-R149 PolarHBondContact O-N 2.93Å; R149-V153 WeakPolarHBondContact O-CG2 3.34Å; R149-V153 PolarHBondContact O-N 3.43Å; R149-L271 HydrophobicContact CG-CD2 4.19Å; R149-V330 PolarHBondContact NH2-O 2.88Å
150	Y	87.3	Confident	82	Confident	57 Å²	57	51.2 Å²	51.2	22%	0.224	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-51.5	172.3	165.6	-114.8	0	0	0	111.3	S146 V147 V152 V153 A154 L247 L248	S146-Y150 PolarHBondContact O-N 3.27Å; V147-Y150 PolarHBondContact O-N 3.38Å; Y150-V152 VanDerWaalsContact C-N 3.35Å; Y150-V152 PolarHBondContact O-N 3.43Å; Y150-V153 PolarHBondContact O-N 3.4Å; Y150-V153 VanDerWaalsContact O-N 3.09Å; Y150-A154 HydrophobicContact CD2-CB 4.18Å; Y150-A154 HydrophobicContact CE2-CB 3.64Å; Y150-A154 WeakPolarHBondContact O-CB 3.48Å; Y150-A154 PolarHBondContact O-N 2.82Å; Y150-L247 HydrophobicContact CD2-CB 3.7Å; Y150-L247 HydrophobicContact CE1-CB 4.39Å; Y150-L247 HydrophobicContact CE1-CD1 3.96Å; Y150-L247 HydrophobicContact CE2-CB 3.35Å; Y150-L247 HydrophobicContact CE2-CD1 4.33Å; Y150-L247 HydrophobicContact CE2-CG 4.42Å; Y150-L247 HydrophobicContact CG-CB 4.36Å; Y150-L248 HydrophobicContact CD2-CB 4.35Å
151	W	84.8	Confident	80.1	Confident	97 Å²	97	54.7 Å²	54.7	37%	0.367	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-44.4	-177	-168.3	-71.7	0	0	0	112.8	V147 Q148 V153 N155	V147-W151 WeakPolarHBondContact O-CB 3.37Å; V147-W151 PolarHBondContact O-N 3.28Å; Q148-W151 PolarHBondContact O-N 2.93Å; W151-V153 VanDerWaalsContact C-N 3.29Å; W151-V153 PolarHBondContact O-N 2.95Å; W151-N155 PolarHBondContact O-N 3.47Å
152	V	82.2	Confident	78.5	Confident	25 Å²	25	61.9 Å²	61.9	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-63.1	-34.5	179	168.1	0	0	0	0	112.4	Q148 Y150 R161	Q148-V152 VanDerWaalsContact O-CG2 3.3Å; Q148-V152 WeakPolarHBondContact O-CG2 3.3Å; Q148-V152 PolarHBondContact O-N 3.48Å; Y150-V152 VanDerWaalsContact C-N 3.35Å; Y150-V152 PolarHBondContact O-N 3.43Å; V152-R161 HydrophobicContact CG2-CG 3.99Å
153	V	80.6	Confident	77.6	Confident	43 Å²	43	64.8 Å²	64.8	26%	0.261	33%	0.333	S	S	.	.	H	α-helix	trans	-82.2	-39.4	-179.1	173.9	0	0	0	0	111.4	R149 Y150 W151 L248 T251 L252	R149-V153 WeakPolarHBondContact O-CG2 3.34Å; R149-V153 PolarHBondContact O-N 3.43Å; Y150-V153 PolarHBondContact O-N 3.4Å; Y150-V153 VanDerWaalsContact O-N 3.09Å; W151-V153 VanDerWaalsContact C-N 3.29Å; W151-V153 PolarHBondContact O-N 2.95Å; V153-L248 HydrophobicContact CB-CD1 3.71Å; V153-L248 HydrophobicContact CG1-CD1 3.88Å; V153-L248 HydrophobicContact CG2-CD1 3.76Å; V153-T251 HydrophobicContact CG1-CG2 4.03Å; V153-L252 HydrophobicContact CG1-CD2 4.29Å; V153-L252 HydrophobicContact CG1-CG 4.25Å
154	A	81.2	Confident	77.1	Confident	26 Å²	26	66.3 Å²	66.3	22%	0.215	34%	0.341	C	S	.	.	H	α-helix	trans	-73.3	-35.1	-179.9	0	0	0	0	0	113.4	Y150 P156 T251	Y150-A154 HydrophobicContact CD2-CB 4.18Å; Y150-A154 HydrophobicContact CE2-CB 3.64Å; Y150-A154 WeakPolarHBondContact O-CB 3.48Å; Y150-A154 PolarHBondContact O-N 2.82Å; A154-P156 WeakPolarHBondContact O-CD 3.47Å; A154-T251 HydrophobicContact CB-CG2 4.48Å
155	N	75.7	Confident	76.8	Confident	74 Å²	74	69.7 Å²	69.7	40%	0.396	36%	0.361	S	S	.	.			trans	-124.9	72.7	-173.5	-65.6	-61.9	0	0	0	112.2	W151 M157 S158	W151-N155 PolarHBondContact O-N 3.47Å; N155-M157 VanDerWaalsContact C-N 3.26Å; N155-M157 PolarHBondContact O-N 2.94Å; N155-S158 PolarHBondContact O-N 3.28Å
156	P	68.3	Low	76.6	Confident	83 Å²	83	73.2 Å²	73.2	54%	0.539	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.6	-172.9	23.3	-33.1	0	0	0	114.5	A154 R161	A154-P156 WeakPolarHBondContact O-CD 3.47Å; P156-R161 PolarHBondContact O-NH1 2.74Å
157	M	64.3	Low	76.6	Confident	185 Å²	185	73.3 Å²	73.3	91%	0.911	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-1.3	-176.5	-60.6	-155.8	-66.6	0	0	115.2	N155 S159	N155-M157 VanDerWaalsContact C-N 3.26Å; N155-M157 PolarHBondContact O-N 2.94Å; M157-S159 PolarHBondContact O-N 2.93Å
158	S	61.4	Low	76.7	Confident	36 Å²	36	74.9 Å²	74.9	25%	0.252	39%	0.389	S	S	.	.			trans	-71.3	128.2	-178.4	175.8	0	0	0	0	112	N155 Q160 R161	N155-S158 PolarHBondContact O-N 3.28Å; S158-Q160 PolarHBondContact O-N 2.92Å; S158-Q160 PolarHBondContact OG-N 3.49Å; S158-R161 WeakPolarHBondContact O-CB 3.41Å; S158-R161 PolarHBondContact O-N 3.27Å
159	S	55.2	Low	77	Confident	110 Å²	110	76.9 Å²	76.9	77%	0.769	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-64.8	-25	175.6	76.9	0	0	0	0	112.6	M157 R161 K162	M157-S159 PolarHBondContact O-N 2.93Å; S159-R161 PolarHBondContact O-N 3.29Å; S159-K162 PolarHBondContact O-N 3.27Å
160	Q	54	Low	77.4	Confident	117 Å²	117	76 Å²	76	55%	0.547	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-65.4	-17.4	175.8	-75	178.5	-18.2	0	0	113.4	S158 K162 N163	S158-Q160 PolarHBondContact O-N 2.92Å; S158-Q160 PolarHBondContact OG-N 3.49Å; Q160-K162 PolarHBondContact O-N 3.36Å; Q160-N163 PolarHBondContact O-N 2.79Å
161	R	58.6	Low	77.8	Confident	101 Å²	101	73.5 Å²	73.5	38%	0.381	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-52.2	-22.8	173.8	179.6	174.2	173.5	-173.1	3.7	113.7	V152 P156 S158 S159	V152-R161 HydrophobicContact CG2-CG 3.99Å; P156-R161 PolarHBondContact O-NH1 2.74Å; S158-R161 WeakPolarHBondContact O-CB 3.41Å; S158-R161 PolarHBondContact O-N 3.27Å; S159-R161 PolarHBondContact O-N 3.29Å
162	K	61.5	Low	78.4	Confident	151 Å²	151	72.8 Å²	72.8	66%	0.657	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-116.5	8.6	-175.7	-61.3	177	-176.9	170.7	0	113.3	S159 Q160 N164	S159-K162 PolarHBondContact O-N 3.27Å; Q160-K162 PolarHBondContact O-N 3.36Å; K162-N164 VanDerWaalsContact C-N 3.32Å; K162-N164 PolarHBondContact O-N 2.87Å
163	N	76.9	Confident	79.2	Confident	62 Å²	62	74.4 Å²	74.4	33%	0.332	42%	0.42	S	S	.	.			trans	-76.8	87.7	-176.7	-165.3	-11.9	0	0	0	110.9	Q160 T165 V166 A167	Q160-N163 PolarHBondContact O-N 2.79Å; N163-T165 PolarHBondContact O-N 2.82Å; N163-T165 WeakPolarHBondContact OD1-CB 3.29Å; N163-T165 PolarHBondContact OD1-N 2.82Å; N163-T165 PolarHBondContact OD1-OG1 3.35Å; N163-V166 HydrophobicContact CB-CG2 4.29Å; N163-V166 WeakPolarHBondContact ND2-CG2 3.39Å; N163-V166 PolarHBondContact O-N 3.03Å; N163-V166 PolarHBondContact OD1-N 3.45Å; N163-A167 PolarHBondContact O-N 2.89Å
164	N	84.6	Confident	80	Confident	48 Å²	48	73 Å²	73	26%	0.257	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-27.1	175.9	-69.8	-14.1	0	0	0	111.9	K83 P85 I88 K162 A167 I168	K83-N164 PolarHBondContact O-ND2 3.48Å; K83-N164 PolarHBondContact O-OD1 3.37Å; P85-N164 WeakPolarHBondContact CD-OD1 3.47Å; I88-N164 HydrophobicContact CD1-CB 3.86Å; K162-N164 VanDerWaalsContact C-N 3.32Å; K162-N164 PolarHBondContact O-N 2.87Å; N164-A167 PolarHBondContact O-N 3.42Å; N164-I168 WeakPolarHBondContact O-CB 3.49Å; N164-I168 WeakPolarHBondContact O-CD1 3.07Å; N164-I168 WeakPolarHBondContact O-CG1 3.42Å; N164-I168 PolarHBondContact O-N 2.95Å
165	T	87.4	Confident	80.8	Confident	96 Å²	96	74 Å²	74	59%	0.589	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-46.9	177.4	-48.7	0	0	0	0	110.9	N163 A167 I168 S169	N163-T165 PolarHBondContact O-N 2.82Å; N163-T165 WeakPolarHBondContact OD1-CB 3.29Å; N163-T165 PolarHBondContact OD1-N 2.82Å; N163-T165 PolarHBondContact OD1-OG1 3.35Å; T165-A167 VanDerWaalsContact C-N 3.32Å; T165-A167 PolarHBondContact O-N 3.43Å; T165-I168 PolarHBondContact O-N 2.98Å; T165-S169 WeakPolarHBondContact O-CB 3.24Å; T165-S169 PolarHBondContact O-N 3.47Å; T165-S169 PolarHBondContact O-OG 3.35Å
166	V	88.7	Confident	81.8	Confident	81 Å²	81	74.1 Å²	74.1	49%	0.491	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-43.4	176.5	173.5	0	0	0	0	110.8	N163 I168 S169 V170	N163-V166 HydrophobicContact CB-CG2 4.29Å; N163-V166 WeakPolarHBondContact ND2-CG2 3.39Å; N163-V166 PolarHBondContact O-N 3.03Å; N163-V166 PolarHBondContact OD1-N 3.45Å; V166-I168 PolarHBondContact O-N 2.99Å; V166-S169 PolarHBondContact O-N 3.46Å; V166-V170 HydrophobicContact CG1-CG2 4.35Å; V166-V170 WeakPolarHBondContact O-CB 3.42Å; V166-V170 VanDerWaalsContact O-CG2 3.27Å; V166-V170 WeakPolarHBondContact O-CG2 3.32Å; V166-V170 PolarHBondContact O-N 3.26Å
167	A	90.4	Very high	83.2	Confident	1 Å²	1	73 Å²	73	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-61.5	-43.7	178.5	0	0	0	0	0	112.2	P85 I88 Y89 N163 N164 T165 V170 C171	P85-A167 HydrophobicContact CB-CB 3.8Å; P85-A167 HydrophobicContact CG-CB 4.35Å; I88-A167 HydrophobicContact CB-CB 4.49Å; I88-A167 HydrophobicContact CD1-CB 4.08Å; Y89-A167 HydrophobicContact CE1-CB 4.34Å; Y89-A167 HydrophobicContact CE2-CB 4.48Å; N163-A167 PolarHBondContact O-N 2.89Å; N164-A167 PolarHBondContact O-N 3.42Å; T165-A167 VanDerWaalsContact C-N 3.32Å; T165-A167 PolarHBondContact O-N 3.43Å; A167-V170 PolarHBondContact O-N 3Å; A167-C171 PolarHBondContact O-N 3.42Å; A167-C171 PolarHBondContact O-SG 3.18Å
168	I	93.2	Very high	84.7	Confident	88 Å²	88	64.4 Å²	64.4	45%	0.451	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-48	176.2	-68.1	164.5	0	0	0	110.3	I88 N164 T165 V166 V170 C171 V172	I88-I168 HydrophobicContact CD1-CG1 4.11Å; I88-I168 HydrophobicContact CG2-CG1 4.29Å; N164-I168 WeakPolarHBondContact O-CB 3.49Å; N164-I168 WeakPolarHBondContact O-CD1 3.07Å; N164-I168 WeakPolarHBondContact O-CG1 3.42Å; N164-I168 PolarHBondContact O-N 2.95Å; T165-I168 PolarHBondContact O-N 2.98Å; V166-I168 PolarHBondContact O-N 2.99Å; I168-V170 VanDerWaalsContact C-N 3.29Å; I168-V170 PolarHBondContact O-N 2.89Å; I168-C171 PolarHBondContact O-N 3.49Å; I168-C171 VanDerWaalsContact O-N 3.09Å; I168-V172 HydrophobicContact CG2-CG2 4.3Å; I168-V172 WeakPolarHBondContact O-CG2 3.38Å; I168-V172 PolarHBondContact O-N 3.49Å
169	S	94.4	Very high	86.2	Confident	69 Å²	69	71.5 Å²	71.5	48%	0.483	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-43.1	176.9	-64.4	0	0	0	0	111.8	T165 V166 V172 A173	T165-S169 WeakPolarHBondContact O-CB 3.24Å; T165-S169 PolarHBondContact O-N 3.47Å; T165-S169 PolarHBondContact O-OG 3.35Å; V166-S169 PolarHBondContact O-N 3.46Å; S169-V172 PolarHBondContact O-N 2.93Å; S169-A173 WeakPolarHBondContact O-CB 3.41Å; S169-A173 PolarHBondContact O-N 3.39Å
170	V	95.2	Very high	88.1	Confident	46 Å²	46	71.7 Å²	71.7	28%	0.279	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-43.5	175.4	171	0	0	0	0	111.1	Y89 V166 A167 I168 V172 A173 V174	Y89-V170 HydrophobicContact CE1-CB 4.18Å; Y89-V170 HydrophobicContact CE1-CG1 3.91Å; V166-V170 HydrophobicContact CG1-CG2 4.35Å; V166-V170 WeakPolarHBondContact O-CB 3.42Å; V166-V170 VanDerWaalsContact O-CG2 3.27Å; V166-V170 WeakPolarHBondContact O-CG2 3.32Å; V166-V170 PolarHBondContact O-N 3.26Å; A167-V170 PolarHBondContact O-N 3Å; I168-V170 VanDerWaalsContact C-N 3.29Å; I168-V170 PolarHBondContact O-N 2.89Å; V170-V172 PolarHBondContact O-N 3Å; V170-A173 PolarHBondContact O-N 2.9Å; V170-V174 HydrophobicContact CG1-CG2 4.47Å; V170-V174 WeakPolarHBondContact O-CG2 3.45Å; V170-V174 PolarHBondContact O-N 3.34Å
171	C	96.6	Very high	89.9	Confident	4 Å²	4	67 Å²	67	3%	0.027	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-45.5	177	-64.5	0	0	0	0	112	Y89 N92 F141 A167 I168 A173 V174 W175	Y89-C171 WeakPolarHBondContact CD1-SG 3.15Å; N92-C171 PolarHBondContact ND2-SG 2.98Å; F141-C171 HydrophobicContact CE1-CB 4.1Å; F141-C171 HydrophobicContact CZ-CB 4.34Å; A167-C171 PolarHBondContact O-N 3.42Å; A167-C171 PolarHBondContact O-SG 3.18Å; I168-C171 PolarHBondContact O-N 3.49Å; I168-C171 VanDerWaalsContact O-N 3.09Å; C171-A173 VanDerWaalsContact C-N 3.32Å; C171-A173 PolarHBondContact O-N 3.15Å; C171-V174 PolarHBondContact O-N 2.95Å; C171-W175 PolarHBondContact O-N 3.45Å
172	V	97.3	Very high	91.3	Very high	83 Å²	83	62.7 Å²	62.7	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-44	176.3	172.6	0	0	0	0	110.4	I168 S169 V170 V174 W175 V176	I168-V172 HydrophobicContact CG2-CG2 4.3Å; I168-V172 WeakPolarHBondContact O-CG2 3.38Å; I168-V172 PolarHBondContact O-N 3.49Å; S169-V172 PolarHBondContact O-N 2.93Å; V170-V172 PolarHBondContact O-N 3Å; V172-V174 PolarHBondContact O-N 3.06Å; V172-W175 PolarHBondContact O-N 3.4Å; V172-V176 HydrophobicContact CG1-CG2 4.28Å; V172-V176 WeakPolarHBondContact O-CB 3.3Å; V172-V176 VanDerWaalsContact O-CG2 3.3Å; V172-V176 WeakPolarHBondContact O-CG2 3.48Å; V172-V176 PolarHBondContact O-N 3.05Å
173	A	97.5	Very high	92.6	Very high	58 Å²	58	59.1 Å²	59.1	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177	0	0	0	0	0	112.3	S169 V170 C171 F177	S169-A173 WeakPolarHBondContact O-CB 3.41Å; S169-A173 PolarHBondContact O-N 3.39Å; V170-A173 PolarHBondContact O-N 2.9Å; C171-A173 VanDerWaalsContact C-N 3.32Å; C171-A173 PolarHBondContact O-N 3.15Å; A173-F177 WeakPolarHBondContact O-CB 3.24Å; A173-F177 PolarHBondContact O-N 2.88Å
174	V	97.7	Very high	93	Very high	15 Å²	15	57.9 Å²	57.9	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-48.1	175.1	169.8	0	0	0	0	110.6	L140 F141 V170 C171 V172 F177 I178	L140-V174 HydrophobicContact CB-CG1 4.12Å; L140-V174 HydrophobicContact CB-CG2 4.35Å; L140-V174 HydrophobicContact CD1-CG1 4.01Å; F141-V174 HydrophobicContact CE1-CB 4.26Å; F141-V174 HydrophobicContact CE1-CG1 4.2Å; F141-V174 HydrophobicContact CE1-CG2 4.46Å; F141-V174 HydrophobicContact CE2-CG1 4.13Å; F141-V174 HydrophobicContact CZ-CB 4.16Å; F141-V174 HydrophobicContact CZ-CG1 3.85Å; V170-V174 HydrophobicContact CG1-CG2 4.47Å; V170-V174 WeakPolarHBondContact O-CG2 3.45Å; V170-V174 PolarHBondContact O-N 3.34Å; C171-V174 PolarHBondContact O-N 2.95Å; V172-V174 PolarHBondContact O-N 3.06Å; V174-F177 PolarHBondContact O-N 2.9Å; V174-I178 HydrophobicContact CG1-CG1 4.39Å; V174-I178 WeakPolarHBondContact O-CG1 3.38Å; V174-I178 PolarHBondContact O-N 3.12Å
175	W	97.7	Very high	93	Very high	47 Å²	47	55.6 Å²	55.6	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-47.7	178.4	-82.3	113.3	0	0	0	112.8	N92 L95 A96 L99 C171 V172 F177 I178 W179	N92-W175 PolarHBondContact OD1-NE1 3.34Å; L95-W175 HydrophobicContact CB-CZ2 4.48Å; L95-W175 HydrophobicContact CD2-CZ2 4.08Å; L95-W175 HydrophobicContact CG-CZ2 4.2Å; A96-W175 HydrophobicContact CB-CH2 4.07Å; A96-W175 HydrophobicContact CB-CZ2 4.35Å; L99-W175 HydrophobicContact CD1-CH2 3.72Å; L99-W175 HydrophobicContact CD1-CZ3 4.17Å; C171-W175 PolarHBondContact O-N 3.45Å; V172-W175 PolarHBondContact O-N 3.4Å; W175-F177 VanDerWaalsContact C-N 3.32Å; W175-F177 PolarHBondContact O-N 2.89Å; W175-I178 PolarHBondContact O-N 3Å; W175-W179 AromaticContact CE3-NE1 3.91Å; W175-W179 WeakPolarHBondContact O-CB 3.44Å; W175-W179 PolarHBondContact O-N 2.93Å
176	V	97.5	Very high	93	Very high	76 Å²	76	55.5 Å²	55.5	46%	0.461	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-44.3	177.2	169.9	0	0	0	0	110.6	V172 W179 I180	V172-V176 HydrophobicContact CG1-CG2 4.28Å; V172-V176 WeakPolarHBondContact O-CB 3.3Å; V172-V176 VanDerWaalsContact O-CG2 3.3Å; V172-V176 WeakPolarHBondContact O-CG2 3.48Å; V172-V176 PolarHBondContact O-N 3.05Å; V176-W179 PolarHBondContact O-N 2.95Å; V176-I180 HydrophobicContact CG1-CD1 3.61Å; V176-I180 HydrophobicContact CG1-CG1 4.33Å; V176-I180 WeakPolarHBondContact O-CB 3.24Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.27Å; V176-I180 PolarHBondContact O-N 3.36Å
177	F	97.2	Very high	92.7	Very high	58 Å²	58	57.4 Å²	57.4	25%	0.254	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-48.6	176.9	173.8	-98.6	0	0	0	111.8	L140 A173 V174 W175 W179 I180 T181 F228 M229 V232 S233	L140-F177 HydrophobicContact CD1-CD1 4.07Å; L140-F177 HydrophobicContact CD1-CE1 4.25Å; A173-F177 WeakPolarHBondContact O-CB 3.24Å; A173-F177 PolarHBondContact O-N 2.88Å; V174-F177 PolarHBondContact O-N 2.9Å; W175-F177 VanDerWaalsContact C-N 3.32Å; W175-F177 PolarHBondContact O-N 2.89Å; F177-W179 PolarHBondContact O-N 3.05Å; F177-I180 PolarHBondContact O-N 3.44Å; F177-T181 HydrophobicContact CD2-CG2 4.04Å; F177-T181 HydrophobicContact CE1-CG2 4.29Å; F177-T181 HydrophobicContact CE2-CG2 3.69Å; F177-T181 HydrophobicContact CG-CG2 4.49Å; F177-T181 HydrophobicContact CZ-CG2 3.83Å; F177-T181 WeakPolarHBondContact O-CB 2.87Å; F177-T181 VanDerWaalsContact O-CG2 3.28Å; F177-T181 WeakPolarHBondContact O-CG2 3.06Å; F177-T181 PolarHBondContact O-N 3.12Å; F177-T181 PolarHBondContact O-OG1 3.33Å; F177-F228 HydrophobicContact CE2-CE1 4.31Å; F177-F228 HydrophobicContact CE2-CZ 4.39Å; F177-F228 HydrophobicContact CZ-CE1 4.16Å; F177-M229 HydrophobicContact CE1-CE 4.43Å; F177-M229 HydrophobicContact CE1-SD 4.49Å; F177-M229 HydrophobicContact CZ-SD 4.4Å; F177-V232 HydrophobicContact CE2-CG1 4.4Å; F177-V232 HydrophobicContact CZ-CG1 3.81Å; F177-S233 WeakPolarHBondContact CE1-OG 3.25Å
178	I	96.3	Very high	92.3	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-41.5	178.5	-66.3	-60.9	0	0	0	111.2	C137 L140 V174 W175 T181 S182 M229	C137-I178 HydrophobicContact CB-CG1 4.23Å; L140-I178 HydrophobicContact CD1-CD1 4.07Å; L140-I178 HydrophobicContact CD1-CG1 4.47Å; V174-I178 HydrophobicContact CG1-CG1 4.39Å; V174-I178 WeakPolarHBondContact O-CG1 3.38Å; V174-I178 PolarHBondContact O-N 3.12Å; W175-I178 PolarHBondContact O-N 3Å; I178-T181 WeakPolarHBondContact CA-OG1 3.29Å; I178-T181 PolarHBondContact O-OG1 2.82Å; I178-S182 VanDerWaalsContact O-CB 3.3Å; I178-S182 WeakPolarHBondContact O-CB 3.24Å; I178-S182 PolarHBondContact O-N 2.97Å; I178-S182 PolarHBondContact O-OG 3.11Å; I178-M229 HydrophobicContact CD1-CE 4.19Å
179	W	93.4	Very high	91.8	Very high	186 Å²	186	60.5 Å²	60.5	71%	0.705	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-50.2	177.6	-85.3	35.4	0	0	0	112.3	W175 V176 F177 T181 S182	W175-W179 AromaticContact CE3-NE1 3.91Å; W175-W179 WeakPolarHBondContact O-CB 3.44Å; W175-W179 PolarHBondContact O-N 2.93Å; V176-W179 PolarHBondContact O-N 2.95Å; F177-W179 PolarHBondContact O-N 3.05Å; W179-T181 VanDerWaalsContact C-N 3.35Å; W179-T181 PolarHBondContact O-N 3.24Å; W179-S182 PolarHBondContact O-N 3.33Å
180	I	94.1	Very high	91.4	Very high	114 Å²	114	57.5 Å²	57.5	59%	0.585	30%	0.298	S	S	*	.	H	α-helix	trans	-59.9	-49	178.7	-70	171	0	0	0	110	V176 F177 S182 T183	V176-I180 HydrophobicContact CG1-CD1 3.61Å; V176-I180 HydrophobicContact CG1-CG1 4.33Å; V176-I180 WeakPolarHBondContact O-CB 3.24Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.27Å; V176-I180 PolarHBondContact O-N 3.36Å; F177-I180 PolarHBondContact O-N 3.44Å; I180-S182 PolarHBondContact O-N 3.26Å; I180-T183 VanDerWaalsContact O-CB 3.3Å; I180-T183 WeakPolarHBondContact O-CB 3.19Å; I180-T183 PolarHBondContact O-N 3.49Å; I180-T183 VanDerWaalsContact O-N 3.17Å; I180-T183 PolarHBondContact O-OG1 3.29Å
181	T	91.6	Very high	91	Very high	17 Å²	17	57.1 Å²	57.1	10%	0.104	30%	0.296	C	S	.	.	H	α-helix	trans	-70.3	-19.6	-177.6	55.4	0	0	0	0	113.1	F177 I178 W179 T183 P184 Y225 F228 M229	F177-T181 HydrophobicContact CD2-CG2 4.04Å; F177-T181 HydrophobicContact CE1-CG2 4.29Å; F177-T181 HydrophobicContact CE2-CG2 3.69Å; F177-T181 HydrophobicContact CG-CG2 4.49Å; F177-T181 HydrophobicContact CZ-CG2 3.83Å; F177-T181 WeakPolarHBondContact O-CB 2.87Å; F177-T181 VanDerWaalsContact O-CG2 3.28Å; F177-T181 WeakPolarHBondContact O-CG2 3.06Å; F177-T181 PolarHBondContact O-N 3.12Å; F177-T181 PolarHBondContact O-OG1 3.33Å; I178-T181 WeakPolarHBondContact CA-OG1 3.29Å; I178-T181 PolarHBondContact O-OG1 2.82Å; W179-T181 VanDerWaalsContact C-N 3.35Å; W179-T181 PolarHBondContact O-N 3.24Å; T181-T183 VanDerWaalsContact C-N 3.3Å; T181-P184 WeakPolarHBondContact O-CD 3.4Å; T181-Y225 WeakPolarHBondContact O-CD2 3.4Å; T181-Y225 WeakPolarHBondContact O-CE2 3.49Å; T181-F228 HydrophobicContact CG2-CE1 4Å; T181-M229 HydrophobicContact CG2-SD 3.99Å
182	S	88.8	Confident	90.5	Very high	12 Å²	12	57.6 Å²	57.6	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-75.5	-17.4	173.8	-60.4	0	0	0	0	113.1	I178 W179 I180 P184 L185	I178-S182 VanDerWaalsContact O-CB 3.3Å; I178-S182 WeakPolarHBondContact O-CB 3.24Å; I178-S182 PolarHBondContact O-N 2.97Å; I178-S182 PolarHBondContact O-OG 3.11Å; W179-S182 PolarHBondContact O-N 3.33Å; I180-S182 PolarHBondContact O-N 3.26Å; S182-P184 VanDerWaalsContact C-CD 3.47Å; S182-L185 VanDerWaalsContact O-CB 3.31Å; S182-L185 WeakPolarHBondContact O-CB 3.5Å; S182-L185 PolarHBondContact O-N 2.98Å
183	T	87.3	Confident	90.1	Very high	75 Å²	75	59 Å²	59	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-51.3	-45.9	-178.4	-48.6	0	0	0	0	114	I180 T181 L185 Y186	I180-T183 VanDerWaalsContact O-CB 3.3Å; I180-T183 WeakPolarHBondContact O-CB 3.19Å; I180-T183 PolarHBondContact O-N 3.49Å; I180-T183 VanDerWaalsContact O-N 3.17Å; I180-T183 PolarHBondContact O-OG1 3.29Å; T181-T183 VanDerWaalsContact C-N 3.3Å; T183-L185 PolarHBondContact O-N 3.34Å; T183-L185 VanDerWaalsContact O-N 3.16Å; T183-Y186 WeakPolarHBondContact O-CB 3.22Å; T183-Y186 PolarHBondContact O-N 2.94Å
184	P	85.5	Confident	89.5	Confident	36 Å²	36	56.3 Å²	56.3	23%	0.234	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-27.8	177.7	-25.5	37.2	0	0	0	114.6	T181 S182 Y186 L187 Y188 Y225	T181-P184 WeakPolarHBondContact O-CD 3.4Å; S182-P184 VanDerWaalsContact C-CD 3.47Å; P184-Y186 PolarHBondContact O-N 3.44Å; P184-L187 PolarHBondContact O-N 3.22Å; P184-Y188 VanDerWaalsContact O-CD1 3.27Å; P184-Y188 WeakPolarHBondContact O-CD1 3.33Å; P184-Y188 WeakPolarHBondContact O-CE1 3.39Å; P184-Y225 HydrophobicContact CB-CD2 4.3Å; P184-Y225 HydrophobicContact CG-CD2 4.33Å
185	L	85.8	Confident	88.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-22.8	175.6	-66.1	178.6	0	0	0	112.4	V128 Y132 S182 T183 Y188 H190 Y225 F226	V128-L185 HydrophobicContact CG1-CD1 4.49Å; Y132-L185 HydrophobicContact CD2-CD1 4Å; S182-L185 VanDerWaalsContact O-CB 3.31Å; S182-L185 WeakPolarHBondContact O-CB 3.5Å; S182-L185 PolarHBondContact O-N 2.98Å; T183-L185 PolarHBondContact O-N 3.34Å; T183-L185 VanDerWaalsContact O-N 3.16Å; L185-Y188 HydrophobicContact CD2-CE1 4.15Å; L185-Y188 VanDerWaalsContact CD2-OH 3.28Å; L185-Y188 WeakPolarHBondContact CD2-OH 3.28Å; L185-H190 PolarHBondContact O-NE2 3.15Å; L185-Y225 HydrophobicContact CD1-CE1 4.02Å; L185-Y225 WeakPolarHBondContact CD1-OH 3.5Å; L185-Y225 HydrophobicContact CD2-CD1 3.77Å; L185-Y225 HydrophobicContact CD2-CE1 3.43Å; L185-Y225 VanDerWaalsContact CD2-CE1 3.43Å; L185-Y225 HydrophobicContact CG-CD1 4.35Å; L185-Y225 HydrophobicContact CG-CE1 3.78Å; L185-Y225 HydrophobicContact CG-CE2 4.39Å; L185-F226 HydrophobicContact CD2-CZ 4.22Å
186	Y	86.6	Confident	88.1	Confident	95 Å²	95	61.5 Å²	61.5	37%	0.373	32%	0.322	S	S	.	.	H	α-helix	trans	-86.1	-16	177.3	-68.6	-86.4	0	0	0	113.3	K125 V126 S129 T183 P184	K125-Y186 HydrophobicContact CB-CD1 3.79Å; K125-Y186 HydrophobicContact CB-CE1 3.92Å; K125-Y186 HydrophobicContact CD-CD1 4.32Å; K125-Y186 PolarHBondContact NZ-O 3.22Å; V126-Y186 HydrophobicContact CG2-CE1 4.49Å; S129-Y186 VanDerWaalsContact CB-OH 3.28Å; S129-Y186 WeakPolarHBondContact CB-OH 3.24Å; S129-Y186 WeakPolarHBondContact OG-CE2 3.24Å; S129-Y186 PolarHBondContact OG-OH 3.07Å; T183-Y186 WeakPolarHBondContact O-CB 3.22Å; T183-Y186 PolarHBondContact O-N 2.94Å; P184-Y186 PolarHBondContact O-N 3.44Å
187	L	83.7	Confident	87.5	Confident	120 Å²	120	59.2 Å²	59.2	63%	0.628	31%	0.309	S	S	*	.	S	Bend	trans	-81.5	-14.1	-171.7	-60.1	-178.1	0	0	0	114.1	P184	P184-L187 PolarHBondContact O-N 3.22Å
188	Y	80.6	Confident	86.8	Confident	43 Å²	43	63.4 Å²	63.4	17%	0.169	33%	0.333	C	S	.	.	S	Bend	trans	-126.3	159.6	176.3	67.4	-88.4	0	0	0	110.7	K125 P184 L185 H190 P222	K125-Y188 WeakPolarHBondContact CE-O 3.49Å; K125-Y188 PolarHBondContact NZ-O 3.1Å; K125-Y188 VanDerWaalsContact NZ-O 3.17Å; P184-Y188 VanDerWaalsContact O-CD1 3.27Å; P184-Y188 WeakPolarHBondContact O-CD1 3.33Å; P184-Y188 WeakPolarHBondContact O-CE1 3.39Å; L185-Y188 HydrophobicContact CD2-CE1 4.15Å; L185-Y188 VanDerWaalsContact CD2-OH 3.28Å; L185-Y188 WeakPolarHBondContact CD2-OH 3.28Å; Y188-H190 AromaticContact CD2-NE2 3.94Å; Y188-H190 AromaticContact CE2-CE1 3.22Å; Y188-H190 WeakPolarHBondContact CE2-CE1 3.36Å; Y188-H190 AromaticContact CE2-ND1 3.74Å; Y188-H190 AromaticContact CE2-NE2 3.5Å; Y188-H190 WeakPolarHBondContact CE2-NE2 3.49Å; Y188-H190 AromaticContact CZ-CE1 3.32Å; Y188-H190 AromaticContact CZ-NE2 3.66Å; Y188-H190 PolarHBondContact O-CD2 3.39Å; Y188-H190 PolarHBondContact OH-CE1 3.01Å; Y188-H190 VanDerWaalsContact OH-CE1 3.27Å; Y188-P222 HydrophobicContact CE1-CB 4.21Å
189	D	83.1	Confident	86.5	Confident	111 Å²	111	63.7 Å²	63.7	59%	0.594	34%	0.335	S	S	*	.			trans	-87.1	137.7	-178	-64.1	-25.3	0	0	0	111.3	E121 K125	E121-D189 VanDerWaalsContact OE1-CA 3.29Å; E121-D189 WeakPolarHBondContact OE1-CA 3.42Å; K125-D189 IonicContact NZ-OD1 3.93Å; K125-D189 PolarHBondContact NZ-OD1 3.12Å
190	H	85.1	Confident	86.3	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.032	31%	0.312	C	S	.	.			trans	-104.5	-18.9	-178.7	-66.2	-97.4	0	0	0	112.1	E121 C124 L185 Y188 H203	E121-H190 IonicContact OE1-CD2 2.71Å; E121-H190 PolarHBondContact OE1-N 3.33Å; C124-H190 WeakPolarHBondContact SG-CB 3.23Å; L185-H190 PolarHBondContact O-NE2 3.15Å; Y188-H190 AromaticContact CD2-NE2 3.94Å; Y188-H190 AromaticContact CE2-CE1 3.22Å; Y188-H190 WeakPolarHBondContact CE2-CE1 3.36Å; Y188-H190 AromaticContact CE2-ND1 3.74Å; Y188-H190 AromaticContact CE2-NE2 3.5Å; Y188-H190 WeakPolarHBondContact CE2-NE2 3.49Å; Y188-H190 AromaticContact CZ-CE1 3.32Å; Y188-H190 AromaticContact CZ-NE2 3.66Å; Y188-H190 PolarHBondContact O-CD2 3.39Å; Y188-H190 PolarHBondContact OH-CE1 3.01Å; Y188-H190 VanDerWaalsContact OH-CE1 3.27Å; H190-H203 HydrophobicContact CB-CB 4.34Å; H190-H203 AromaticContact ND1-CD2 3.46Å; H190-H203 PolarHBondContact ND1-CD2 3.01Å; H190-H203 PolarHBondContact O-N 3.4Å
191	T	87.9	Confident	86	Confident	37 Å²	37	51.2 Å²	51.2	23%	0.227	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	141.9	177.9	71.6	0	0	0	0	112.7	W117 E121 C124 T200 T201 C202	W117-T191 HydrophobicContact CG-CG2 4.43Å; E121-T191 WeakPolarHBondContact OE2-CA 3.37Å; E121-T191 WeakPolarHBondContact OE2-CB 3.08Å; E121-T191 WeakPolarHBondContact OE2-CG2 3.31Å; E121-T191 PolarHBondContact OE2-N 3.09Å; E121-T191 PolarHBondContact OE2-OG1 3.27Å; C124-T191 HydrophobicContact CB-CG2 3.68Å; T191-T200 HydrophobicContact CG2-CG2 4.5Å; T191-T201 WeakPolarHBondContact CA-O 3.21Å; T191-C202 HydrophobicContact CG2-CB 4.4Å
192	T	85.9	Confident	85.9	Confident	15 Å²	15	50.8 Å²	50.8	9%	0.092	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	147	168.8	-168.3	0	0	0	0	111.6	T35 I194 T200 T201 V205 V207	T35-T192 WeakPolarHBondContact CB-OG1 3.25Å; T35-T192 HydrophobicContact CG2-CG2 4.31Å; T35-T192 PolarHBondContact OG1-OG1 3.38Å; T192-I194 HydrophobicContact CG2-CD1 4.04Å; T192-T200 CarbonylContact O-C 3.6Å; T192-T200 VanDerWaalsContact O-CA 3.3Å; T192-T200 WeakPolarHBondContact O-CA 3.09Å; T192-T201 WeakPolarHBondContact CG2-OG1 3.46Å; T192-T201 PolarHBondContact N-O 3.4Å; T192-T201 PolarHBondContact O-N 3.07Å; T192-T201 PolarHBondContact O-OG1 3.33Å; T192-V205 HydrophobicContact CG2-CB 4.1Å; T192-V205 HydrophobicContact CG2-CG1 4.28Å; T192-V207 VanDerWaalsContact CB-CG2 3.5Å; T192-V207 HydrophobicContact CG2-CG2 3.6Å
193	K	88.2	Confident	85.7	Confident	112 Å²	112	51.7 Å²	51.7	49%	0.487	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.2	175.8	-171.1	179	-178.4	-175.8	0	109.4	T35	T35-K193 PolarHBondContact N-O 3.26Å
194	I	86.3	Confident	85.1	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-82.5	125.5	-179.1	-56.7	-55.8	0	0	0	110.5	T35 I37 L42 T192 T197 M199 T201 V205	T35-I194 HydrophobicContact CG2-CD1 4.41Å; T35-I194 WeakPolarHBondContact O-CA 3.32Å; I37-I194 HydrophobicContact CD1-CD1 4.28Å; I37-I194 HydrophobicContact CD1-CG1 4.5Å; I37-I194 HydrophobicContact CD1-CG2 3.9Å; I37-I194 HydrophobicContact CG1-CG2 3.98Å; I37-I194 HydrophobicContact CG2-CD1 4.01Å; L42-I194 HydrophobicContact CD1-CG2 4.32Å; T192-I194 HydrophobicContact CG2-CD1 4.04Å; I194-T197 WeakPolarHBondContact CB-OG1 3.36Å; I194-T197 HydrophobicContact CG2-CG2 4.42Å; I194-T197 PolarHBondContact O-N 3.27Å; I194-T197 VanDerWaalsContact O-O 3.1Å; I194-T197 PolarHBondContact O-OG1 3.07Å; I194-M199 HydrophobicContact CG1-CE 3.87Å; I194-M199 PolarHBondContact N-O 3.25Å; I194-T201 HydrophobicContact CD1-CG2 4.28Å; I194-T201 HydrophobicContact CG1-CG2 3.98Å; I194-V205 HydrophobicContact CD1-CG2 4.18Å
195	K	84.9	Confident	84.4	Confident	86 Å²	86	48 Å²	48	37%	0.374	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	138.5	-179.9	-171.9	172.8	-170.5	157.1	0	110.4	D33 T35 T36 T197	D33-K195 HydrophobicContact CB-CD 4.31Å; D33-K195 WeakPolarHBondContact OD2-CE 3.15Å; D33-K195 IonicContact OD2-NZ 2.8Å; D33-K195 PolarHBondContact OD2-NZ 3Å; T35-K195 PolarHBondContact O-N 3.26Å; T36-K195 HydrophobicContact CG2-CB 4.02Å; T36-K195 HydrophobicContact CG2-CD 3.61Å; T36-K195 HydrophobicContact CG2-CG 4.37Å; K195-T197 PolarHBondContact O-N 3.32Å
196	G	81	Confident	83.7	Confident	84 Å²	84	49 Å²	49	87%	0.866	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	3.4	-178.8	0	0	0	0	0	114.6
197	T	83.3	Confident	82.8	Confident	29 Å²	29	46.5 Å²	46.5	18%	0.178	26%	0.26	C	S	.	.	S	Bend	trans	-135	162.1	175.7	73.5	0	0	0	0	111.2	L42 I194 K195 M199	L42-T197 HydrophobicContact CD1-CG2 4.08Å; I194-T197 WeakPolarHBondContact CB-OG1 3.36Å; I194-T197 HydrophobicContact CG2-CG2 4.42Å; I194-T197 PolarHBondContact O-N 3.27Å; I194-T197 VanDerWaalsContact O-O 3.1Å; I194-T197 PolarHBondContact O-OG1 3.07Å; K195-T197 PolarHBondContact O-N 3.32Å; T197-M199 PolarHBondContact O-N 3.08Å; T197-M199 WeakPolarHBondContact OG1-CB 3.18Å; T197-M199 PolarHBondContact OG1-N 2.95Å
198	N	84.5	Confident	82	Confident	145 Å²	145	41.8 Å²	41.8	78%	0.775	24%	0.236	S	C	*	.	S	Bend	trans	-92.3	27.9	171	-75.7	-28.3	0	0	0	112.3	N116	N116-N198 PolarHBondContact ND2-O 3.02Å
199	M	88.3	Confident	80.9	Confident	12 Å²	12	41.2 Å²	41.2	6%	0.059	24%	0.243	C	C	.	.			trans	-104.9	129.3	-173.1	-171.8	177.8	93.3	0	0	111.3	L45 N115 N116 I194 T197 T201	L45-M199 HydrophobicContact CB-CE 4.05Å; L45-M199 HydrophobicContact CD1-CE 3.5Å; L45-M199 VanDerWaalsContact CD1-CE 3.5Å; L45-M199 HydrophobicContact CG-CE 4.23Å; N115-M199 HydrophobicContact CB-CE 4.43Å; N115-M199 HydrophobicContact CB-SD 3.89Å; N115-M199 WeakPolarHBondContact O-CG 3.26Å; N116-M199 HydrophobicContact CB-CG 4.33Å; I194-M199 HydrophobicContact CG1-CE 3.87Å; I194-M199 PolarHBondContact N-O 3.25Å; T197-M199 PolarHBondContact O-N 3.08Å; T197-M199 WeakPolarHBondContact OG1-CB 3.18Å; T197-M199 PolarHBondContact OG1-N 2.95Å; M199-T201 HydrophobicContact CE-CG2 3.39Å
200	T	89.6	Confident	79.4	Confident	37 Å²	37	41.3 Å²	41.3	23%	0.227	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113	168.8	-57.1	0	0	0	0	108.9	N116 W117 T191 T192	N116-T200 PolarHBondContact OD1-N 3.42Å; W117-T200 HydrophobicContact CB-CG2 4.48Å; W117-T200 VanDerWaalsContact CB-O 3.27Å; W117-T200 WeakPolarHBondContact CB-O 3.19Å; W117-T200 PolarHBondContact N-O 3.32Å; T191-T200 HydrophobicContact CG2-CG2 4.5Å; T192-T200 CarbonylContact O-C 3.6Å; T192-T200 VanDerWaalsContact O-CA 3.3Å; T192-T200 WeakPolarHBondContact O-CA 3.09Å
201	T	88.9	Confident	77.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	152.2	176.8	51.5	0	0	0	0	110.9	L45 Y110 T191 T192 I194 M199 V205	L45-T201 HydrophobicContact CD1-CG2 3.9Å; Y110-T201 WeakPolarHBondContact OH-CA 3.41Å; T191-T201 WeakPolarHBondContact CA-O 3.21Å; T192-T201 WeakPolarHBondContact CG2-OG1 3.46Å; T192-T201 PolarHBondContact N-O 3.4Å; T192-T201 PolarHBondContact O-N 3.07Å; T192-T201 PolarHBondContact O-OG1 3.33Å; I194-T201 HydrophobicContact CD1-CG2 4.28Å; I194-T201 HydrophobicContact CG1-CG2 3.98Å; M199-T201 HydrophobicContact CE-CG2 3.39Å; T201-V205 HydrophobicContact CG2-CG2 4.03Å
202	C	89.1	Confident	75.9	Confident	9 Å²	9	49.6 Å²	49.6	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	113.6	170.2	168	0	0	0	0	109.2	Y110 W117 C124 T191 D204	Y110-C202 HydrophobicContact CE2-CB 4.32Å; Y110-C202 PolarHBondContact OH-N 3.13Å; W117-C202 HydrophobicContact CB-CB 3.96Å; W117-C202 HydrophobicContact CD2-CB 3.76Å; W117-C202 HydrophobicContact CE3-CB 3.87Å; W117-C202 HydrophobicContact CG-CB 3.79Å; C124-C202 VanDerWaalsContact CA-SG 3.58Å; C124-C202 HydrophobicContact CB-CB 4.07Å; C124-C202 WeakPolarHBondContact CB-SG 3.44Å; C124-C202 VanDerWaalsContact SG-CA 3.53Å; C124-C202 WeakPolarHBondContact SG-CB 3.17Å; C124-C202 CovalentContact SG-SG 2.03Å; C124-C202 PolarHBondContact SG-SG 3.48Å; T191-C202 HydrophobicContact CG2-CB 4.4Å; C202-D204 PolarHBondContact O-N 3.47Å
203	H	84.9	Confident	74	Confident	30 Å²	30	57.6 Å²	57.6	14%	0.139	34%	0.336	C	S	.	.	S	Bend	trans	64.2	-14	177.3	177.9	-76.7	0	0	0	116.3	V128 Y132 H190 V205	V128-H203 HydrophobicContact CG2-CB 3.53Å; Y132-H203 AromaticContact CE2-CE1 3.99Å; Y132-H203 AromaticContact CE2-NE2 3.33Å; Y132-H203 VanDerWaalsContact CE2-NE2 3.33Å; Y132-H203 WeakPolarHBondContact CE2-NE2 3.24Å; Y132-H203 AromaticContact CZ-CE1 3.85Å; Y132-H203 AromaticContact CZ-NE2 3.55Å; Y132-H203 PolarHBondContact OH-CE1 3.46Å; Y132-H203 PolarHBondContact OH-NE2 2.96Å; H190-H203 HydrophobicContact CB-CB 4.34Å; H190-H203 AromaticContact ND1-CD2 3.46Å; H190-H203 PolarHBondContact ND1-CD2 3.01Å; H190-H203 PolarHBondContact O-N 3.4Å; H203-V205 VanDerWaalsContact C-N 3.32Å; H203-V205 PolarHBondContact O-N 3.48Å
204	D	73.7	Confident	72.5	Confident	25 Å²	25	57 Å²	57	13%	0.134	34%	0.337	C	S	.	.	S	Bend	trans	-69.3	-26.3	-179.5	-64	-34.6	0	0	0	113.3	L45 Y110 C202 Y306	L45-D204 HydrophobicContact CD2-CB 4.23Å; Y110-D204 VanDerWaalsContact CE1-OD2 3.29Å; Y110-D204 WeakPolarHBondContact CE1-OD2 3.38Å; Y110-D204 VanDerWaalsContact CZ-OD2 3.31Å; Y110-D204 PolarHBondContact OH-OD2 2.96Å; C202-D204 PolarHBondContact O-N 3.47Å; D204-Y306 PolarHBondContact O-OH 3.3Å
205	V	71.6	Confident	71.2	Confident	8 Å²	8	58.9 Å²	58.9	5%	0.048	35%	0.347	C	S	.	.	S	Bend	trans	-118.3	127.4	-175.7	-178.4	0	0	0	0	111	F26 T35 I37 L45 T192 I194 T201 H203 V207	F26-V205 HydrophobicContact CD1-CG2 4.05Å; T35-V205 HydrophobicContact CG2-CG1 4.29Å; I37-V205 HydrophobicContact CG2-CG1 3.88Å; I37-V205 HydrophobicContact CG2-CG2 4.49Å; L45-V205 HydrophobicContact CD1-CG2 4.28Å; T192-V205 HydrophobicContact CG2-CB 4.1Å; T192-V205 HydrophobicContact CG2-CG1 4.28Å; I194-V205 HydrophobicContact CD1-CG2 4.18Å; T201-V205 HydrophobicContact CG2-CG2 4.03Å; H203-V205 VanDerWaalsContact C-N 3.32Å; H203-V205 PolarHBondContact O-N 3.48Å; V205-V207 PolarHBondContact O-N 3.31Å
206	I	70.6	Confident	70.1	Confident	22 Å²	22	60.1 Å²	60.1	11%	0.113	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.4	169.5	-60.4	-176.6	0	0	0	108	F26 G28 I219 H293 Y294	F26-I206 PolarHBondContact O-N 3.49Å; G28-I206 PolarHBondContact N-O 3.25Å; I206-I219 HydrophobicContact CG2-CD1 4.47Å; I206-I219 HydrophobicContact CG2-CG1 4.04Å; I206-H293 WeakPolarHBondContact CD1-NE2 3.38Å; I206-Y294 HydrophobicContact CD1-CD1 4.34Å; I206-Y294 HydrophobicContact CD1-CE1 3.65Å
207	V	67.9	Low	69.3	Low	42 Å²	42	61.6 Å²	61.6	26%	0.255	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.1	178.6	-173.7	0	0	0	0	110.3	G28 K30 T192 V205	G28-V207 CarbonylContact O-C 3.49Å; G28-V207 WeakPolarHBondContact O-CA 3.38Å; K30-V207 HydrophobicContact CB-CG1 3.73Å; K30-V207 HydrophobicContact CD-CG1 4.02Å; K30-V207 HydrophobicContact CG-CG1 4.15Å; T192-V207 VanDerWaalsContact CB-CG2 3.5Å; T192-V207 HydrophobicContact CG2-CG2 3.6Å; V205-V207 PolarHBondContact O-N 3.31Å
208	I	66.1	Low	68.4	Low	22 Å²	22	63.1 Å²	63.1	11%	0.113	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.7	173.1	-52.4	176.8	0	0	0	108	I27 G28 K30 L215 I219	I27-I208 HydrophobicContact CB-CD1 4.12Å; I27-I208 HydrophobicContact CD1-CD1 4.21Å; I27-I208 HydrophobicContact CG1-CD1 4.01Å; I27-I208 HydrophobicContact CG2-CD1 3.15Å; I27-I208 HydrophobicContact CG2-CG1 4.06Å; G28-I208 PolarHBondContact O-N 3.42Å; K30-I208 WeakPolarHBondContact CB-O 3.31Å; K30-I208 PolarHBondContact N-O 3.02Å; I208-L215 HydrophobicContact CD1-CD1 3.45Å; I208-L215 VanDerWaalsContact CD1-CD1 3.45Å; I208-L215 HydrophobicContact CG1-CD1 4.08Å; I208-L215 HydrophobicContact CG2-CD1 3.78Å; I208-I219 HydrophobicContact CD1-CD1 4.43Å; I208-I219 HydrophobicContact CG1-CD1 4.29Å
209	G	57.6	Low	67.9	Low	31 Å²	31	56.6 Å²	56.6	32%	0.32	31%	0.312	S	S	.	.			trans	-61.1	147	176.9	0	0	0	0	0	112.8	D211	G209-D211 VanDerWaalsContact C-N 3.25Å; G209-D211 PolarHBondContact O-N 3.23Å
210	Q	51.2	Low	67.5	Low	112 Å²	112	59.3 Å²	59.3	52%	0.523	32%	0.323	S	S	.	.	S	Bend	trans	-64.3	-29.4	-177.3	-151	173	-15.4	0	0	113.1	K30 T31 G212	K30-Q210 WeakPolarHBondContact O-CB 3.49Å; K30-Q210 WeakPolarHBondContact O-CG 3.27Å; T31-Q210 VanDerWaalsContact CA-OE1 3.31Å; Q210-G212 PolarHBondContact O-N 3.03Å
211	D	49.5	Very low	67	Low	138 Å²	138	64 Å²	64	74%	0.738	34%	0.338	S	S	*	.	S	Bend	trans	-82.5	105.6	173	-65.4	-38.9	0	0	0	107.9	G209 K213	G209-D211 VanDerWaalsContact C-N 3.25Å; G209-D211 PolarHBondContact O-N 3.23Å; D211-K213 PolarHBondContact O-N 2.82Å
212	G	51.1	Low	66.7	Low	81 Å²	81	64.3 Å²	64.3	84%	0.835	34%	0.34	S	S	*	.			trans	-60.4	24.2	173.4	0	0	0	0	0	115.3	Q210	Q210-G212 PolarHBondContact O-N 3.03Å
213	K	46.5	Very low	66.5	Low	183 Å²	183	64.4 Å²	64.4	80%	0.796	34%	0.339	S	S	*	.	S	Bend	trans	-99.3	32.4	176.4	-73.5	-172.5	175	177	0	112.8	D211	D211-K213 PolarHBondContact O-N 2.82Å
214	D	55.3	Low	66.5	Low	98 Å²	98	67.8 Å²	67.8	52%	0.524	35%	0.354	S	S	.	.			trans	162.9	82.5	136.9	-76	-27	0	0	0	109.6	Y216 E217	D214-Y216 PolarHBondContact O-N 3.42Å; D214-E217 HydrophobicContact CB-CB 3.82Å; D214-E217 HydrophobicContact CB-CG 3.6Å; D214-E217 PolarHBondContact O-N 3.26Å
215	L	59.5	Low	67.2	Low	42 Å²	42	67.2 Å²	67.2	22%	0.22	35%	0.35	C	S	.	.	H	α-helix	trans	-42.2	-37.5	163.3	177.2	67.3	0	0	0	111.3	I208 I219 E300	I208-L215 HydrophobicContact CD1-CD1 3.45Å; I208-L215 VanDerWaalsContact CD1-CD1 3.45Å; I208-L215 HydrophobicContact CG1-CD1 4.08Å; I208-L215 HydrophobicContact CG2-CD1 3.78Å; L215-I219 HydrophobicContact CD1-CD1 3.54Å; L215-I219 HydrophobicContact CG-CD1 4.1Å; L215-I219 WeakPolarHBondContact O-CD1 3.46Å; L215-I219 PolarHBondContact O-N 3.27Å; L215-E300 HydrophobicContact CD2-CG 3.72Å; L215-E300 WeakPolarHBondContact CD2-OE1 3.43Å
216	Y	61.6	Low	68	Low	112 Å²	112	66.9 Å²	66.9	44%	0.439	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-45.4	177.4	-177.5	-112.6	0	0	0	113.6	D214 S218 I219 K220	D214-Y216 PolarHBondContact O-N 3.42Å; Y216-S218 PolarHBondContact O-N 2.93Å; Y216-I219 PolarHBondContact O-N 3.44Å; Y216-K220 HydrophobicContact CE1-CD 4.04Å; Y216-K220 HydrophobicContact CE1-CG 4.4Å; Y216-K220 WeakPolarHBondContact O-CA 3.21Å; Y216-K220 WeakPolarHBondContact O-CB 3.44Å; Y216-K220 PolarHBondContact O-N 2.96Å
217	E	65.3	Low	68.9	Low	116 Å²	116	68.5 Å²	68.5	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-41.9	-176.1	-80.5	-102.4	127.3	0	0	112.2	D214 I219	D214-E217 HydrophobicContact CB-CB 3.82Å; D214-E217 HydrophobicContact CB-CG 3.6Å; D214-E217 PolarHBondContact O-N 3.26Å; E217-I219 PolarHBondContact O-N 2.91Å
218	S	63.9	Low	70.1	Confident	61 Å²	61	71.2 Å²	71.2	43%	0.427	37%	0.365	S	S	.	.	H	α-helix	trans	-70.6	-30.4	-178.2	-61.1	0	0	0	0	113	Y216	Y216-S218 PolarHBondContact O-N 2.93Å
219	I	74.1	Confident	71.4	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.036	36%	0.359	C	S	.	.	H	α-helix	trans	-103.5	-10.1	-175.5	-65.9	150.5	0	0	0	112.2	I206 I208 L215 Y216 E217 Y221 P222 F223 Y294 V297	I206-I219 HydrophobicContact CG2-CD1 4.47Å; I206-I219 HydrophobicContact CG2-CG1 4.04Å; I208-I219 HydrophobicContact CD1-CD1 4.43Å; I208-I219 HydrophobicContact CG1-CD1 4.29Å; L215-I219 HydrophobicContact CD1-CD1 3.54Å; L215-I219 HydrophobicContact CG-CD1 4.1Å; L215-I219 WeakPolarHBondContact O-CD1 3.46Å; L215-I219 PolarHBondContact O-N 3.27Å; Y216-I219 PolarHBondContact O-N 3.44Å; E217-I219 PolarHBondContact O-N 2.91Å; I219-Y221 PolarHBondContact O-N 2.79Å; I219-P222 VanDerWaalsContact O-CD 3.25Å; I219-P222 WeakPolarHBondContact O-CD 3.44Å; I219-P222 VanDerWaalsContact O-CG 3.32Å; I219-P222 WeakPolarHBondContact O-CG 3Å; I219-F223 HydrophobicContact CG2-CB 4.1Å; I219-F223 WeakPolarHBondContact O-CB 3.28Å; I219-F223 PolarHBondContact O-N 3.17Å; I219-Y294 HydrophobicContact CG2-CD1 4.01Å; I219-Y294 HydrophobicContact CG2-CE1 4.35Å; I219-V297 HydrophobicContact CD1-CG1 3.41Å; I219-V297 VanDerWaalsContact CD1-CG1 3.41Å; I219-V297 HydrophobicContact CG1-CG1 4.27Å; I219-V297 HydrophobicContact CG2-CG1 4.33Å
220	K	79.3	Confident	73	Confident	69 Å²	69	68.8 Å²	68.8	30%	0.3	35%	0.345	S	S	.	.	H	α-helix	trans	-51.7	-55.6	-177.7	-173.1	177.8	179.8	-176.8	0	112.2	Y216 F224	Y216-K220 HydrophobicContact CE1-CD 4.04Å; Y216-K220 HydrophobicContact CE1-CG 4.4Å; Y216-K220 WeakPolarHBondContact O-CA 3.21Å; Y216-K220 WeakPolarHBondContact O-CB 3.44Å; Y216-K220 PolarHBondContact O-N 2.96Å; K220-F224 HydrophobicContact CG-CD2 3.79Å; K220-F224 HydrophobicContact CG-CE2 3.81Å; K220-F224 WeakPolarHBondContact O-CD2 3.22Å; K220-F224 PolarHBondContact O-N 3.26Å
221	Y	80.2	Confident	74.9	Confident	137 Å²	137	66.4 Å²	66.4	54%	0.537	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-54.7	-177.2	-64.3	-74.5	0	0	0	112.9	I219 F223 F224 Y225	I219-Y221 PolarHBondContact O-N 2.79Å; Y221-F223 PolarHBondContact O-N 2.91Å; Y221-F224 PolarHBondContact O-N 2.92Å; Y221-Y225 VanDerWaalsContact O-CB 3.24Å; Y221-Y225 WeakPolarHBondContact O-CB 3.24Å; Y221-Y225 PolarHBondContact O-N 3.39Å
222	P	81.8	Confident	77	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.032	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-40.4	178.4	23.9	-33.2	0	0	0	112.1	Y188 I219 F224 Y225 F226 Y294	Y188-P222 HydrophobicContact CE1-CB 4.21Å; I219-P222 VanDerWaalsContact O-CD 3.25Å; I219-P222 WeakPolarHBondContact O-CD 3.44Å; I219-P222 VanDerWaalsContact O-CG 3.32Å; I219-P222 WeakPolarHBondContact O-CG 3Å; P222-F224 PolarHBondContact O-N 2.71Å; P222-Y225 PolarHBondContact O-N 3.35Å; P222-F226 HydrophobicContact CB-CD2 4.06Å; P222-F226 HydrophobicContact CB-CE2 4.09Å; P222-F226 VanDerWaalsContact O-CB 3.31Å; P222-F226 WeakPolarHBondContact O-CB 3.45Å; P222-F226 WeakPolarHBondContact O-CD2 3.5Å; P222-F226 PolarHBondContact O-N 3.05Å; P222-Y294 HydrophobicContact CB-CE1 3.66Å; P222-Y294 HydrophobicContact CG-CE1 4Å
223	F	83.9	Confident	79	Confident	12 Å²	12	58.2 Å²	58.2	5%	0.053	28%	0.277	C	S	.	.	H	α-helix	trans	-55.7	-53.2	177.1	175.8	-90	0	0	0	112.2	I219 Y221 L227 Y294 V295 K298	I219-F223 HydrophobicContact CG2-CB 4.1Å; I219-F223 WeakPolarHBondContact O-CB 3.28Å; I219-F223 PolarHBondContact O-N 3.17Å; Y221-F223 PolarHBondContact O-N 2.91Å; F223-L227 HydrophobicContact CE1-CD2 4.07Å; F223-L227 HydrophobicContact CZ-CD2 4.13Å; F223-L227 VanDerWaalsContact O-CB 3.26Å; F223-L227 WeakPolarHBondContact O-CB 3.5Å; F223-L227 PolarHBondContact O-N 2.89Å; F223-Y294 HydrophobicContact CB-CD1 4.44Å; F223-Y294 WeakPolarHBondContact CD2-O 3.32Å; F223-V295 HydrophobicContact CE2-CG2 4.18Å; F223-K298 HydrophobicContact CD2-CB 4.42Å; F223-K298 HydrophobicContact CD2-CD 4.15Å; F223-K298 HydrophobicContact CE1-CD 4.23Å; F223-K298 HydrophobicContact CE2-CB 4.3Å; F223-K298 HydrophobicContact CE2-CD 3.64Å; F223-K298 HydrophobicContact CZ-CD 3.7Å
224	F	85.9	Confident	81.3	Confident	101 Å²	101	49.7 Å²	49.7	44%	0.443	24%	0.239	S	C	.	.	H	α-helix	trans	-68.1	-40.4	-179.1	-79.4	-66.6	0	0	0	112.1	K220 Y221 P222 F228	K220-F224 HydrophobicContact CG-CD2 3.79Å; K220-F224 HydrophobicContact CG-CE2 3.81Å; K220-F224 WeakPolarHBondContact O-CD2 3.22Å; K220-F224 PolarHBondContact O-N 3.26Å; Y221-F224 PolarHBondContact O-N 2.92Å; P222-F224 PolarHBondContact O-N 2.71Å; F224-F228 WeakPolarHBondContact O-CB 3.32Å; F224-F228 PolarHBondContact O-N 3.03Å
225	Y	88.9	Confident	83	Confident	13 Å²	13	48.4 Å²	48.4	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-56.9	-54.2	176.1	166.7	-103.5	0	0	0	111.2	T181 P184 L185 Y221 P222 F228 M229	T181-Y225 WeakPolarHBondContact O-CD2 3.4Å; T181-Y225 WeakPolarHBondContact O-CE2 3.49Å; P184-Y225 HydrophobicContact CB-CD2 4.3Å; P184-Y225 HydrophobicContact CG-CD2 4.33Å; L185-Y225 HydrophobicContact CD1-CE1 4.02Å; L185-Y225 WeakPolarHBondContact CD1-OH 3.5Å; L185-Y225 HydrophobicContact CD2-CD1 3.77Å; L185-Y225 HydrophobicContact CD2-CE1 3.43Å; L185-Y225 VanDerWaalsContact CD2-CE1 3.43Å; L185-Y225 HydrophobicContact CG-CD1 4.35Å; L185-Y225 HydrophobicContact CG-CE1 3.78Å; L185-Y225 HydrophobicContact CG-CE2 4.39Å; Y221-Y225 VanDerWaalsContact O-CB 3.24Å; Y221-Y225 WeakPolarHBondContact O-CB 3.24Å; Y221-Y225 PolarHBondContact O-N 3.39Å; P222-Y225 PolarHBondContact O-N 3.35Å; Y225-F228 PolarHBondContact O-N 3.3Å; Y225-M229 HydrophobicContact CD2-CG 3.87Å; Y225-M229 HydrophobicContact CE1-CG 4.39Å; Y225-M229 HydrophobicContact CE2-CG 3.41Å; Y225-M229 VanDerWaalsContact CE2-CG 3.41Å; Y225-M229 HydrophobicContact CE2-SD 4.21Å; Y225-M229 WeakPolarHBondContact O-CB 3.47Å; Y225-M229 VanDerWaalsContact O-CG 3.27Å; Y225-M229 WeakPolarHBondContact O-CG 3.21Å; Y225-M229 PolarHBondContact O-N 3.16Å
226	F	88.9	Confident	84.6	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-70.6	-37.5	-174.2	-79.2	-58.7	0	0	0	113.1	Y132 L185 P222 M229 A230 L290 Y294	Y132-F226 HydrophobicContact CD1-CE1 4.03Å; Y132-F226 HydrophobicContact CD2-CE1 4.19Å; Y132-F226 HydrophobicContact CD2-CZ 4.34Å; Y132-F226 AromaticContact CE1-CE1 3.67Å; Y132-F226 HydrophobicContact CE1-CE1 3.67Å; Y132-F226 HydrophobicContact CE1-CZ 4.27Å; Y132-F226 AromaticContact CE2-CE1 3.81Å; Y132-F226 HydrophobicContact CE2-CE1 3.81Å; Y132-F226 AromaticContact CE2-CZ 3.69Å; Y132-F226 HydrophobicContact CE2-CZ 3.69Å; Y132-F226 HydrophobicContact CG-CE1 4.28Å; Y132-F226 AromaticContact CZ-CE1 3.53Å; Y132-F226 AromaticContact CZ-CZ 3.65Å; L185-F226 HydrophobicContact CD2-CZ 4.22Å; P222-F226 HydrophobicContact CB-CD2 4.06Å; P222-F226 HydrophobicContact CB-CE2 4.09Å; P222-F226 VanDerWaalsContact O-CB 3.31Å; P222-F226 WeakPolarHBondContact O-CB 3.45Å; P222-F226 WeakPolarHBondContact O-CD2 3.5Å; P222-F226 PolarHBondContact O-N 3.05Å; F226-M229 PolarHBondContact O-N 3Å; F226-A230 WeakPolarHBondContact O-CB 2.97Å; F226-A230 PolarHBondContact O-N 3.32Å; F226-L290 HydrophobicContact CB-CD2 3.21Å; F226-L290 HydrophobicContact CD1-CD1 3.65Å; F226-L290 HydrophobicContact CD1-CD2 3.19Å; F226-L290 HydrophobicContact CD1-CG 4.03Å; F226-L290 HydrophobicContact CD2-CD2 3.79Å; F226-L290 HydrophobicContact CE1-CD1 3.62Å; F226-L290 HydrophobicContact CE1-CD2 3.9Å; F226-L290 HydrophobicContact CE1-CG 4.33Å; F226-L290 HydrophobicContact CE2-CD2 4.43Å; F226-L290 HydrophobicContact CG-CD1 4.4Å; F226-L290 HydrophobicContact CG-CD2 3.12Å; F226-L290 HydrophobicContact CG-CG 4.3Å; F226-L290 HydrophobicContact CZ-CD1 4.36Å; F226-L290 HydrophobicContact CZ-CD2 4.48Å; F226-Y294 HydrophobicContact CB-CD2 4.22Å; F226-Y294 HydrophobicContact CB-CE2 4.4Å; F226-Y294 AromaticContact CD2-CD2 3.8Å; F226-Y294 HydrophobicContact CD2-CD2 3.8Å; F226-Y294 HydrophobicContact CD2-CE1 4.34Å; F226-Y294 AromaticContact CD2-CE2 3.15Å; F226-Y294 HydrophobicContact CD2-CE2 3.15Å; F226-Y294 AromaticContact CD2-CZ 3.48Å; F226-Y294 VanDerWaalsContact CD2-CZ 3.48Å; F226-Y294 AromaticContact CE2-CE2 3.49Å; F226-Y294 HydrophobicContact CE2-CE2 3.49Å; F226-Y294 VanDerWaalsContact CE2-CE2 3.49Å; F226-Y294 AromaticContact CE2-CZ 3.58Å; F226-Y294 VanDerWaalsContact CE2-OH 3.24Å; F226-Y294 WeakPolarHBondContact CE2-OH 3.3Å; F226-Y294 HydrophobicContact CG-CD2 4.26Å; F226-Y294 AromaticContact CG-CE2 3.94Å; F226-Y294 HydrophobicContact CG-CE2 3.94Å; F226-Y294 HydrophobicContact CZ-CE2 4.45Å
227	L	89.6	Confident	86.2	Confident	55 Å²	55	45.6 Å²	45.6	29%	0.288	22%	0.221	S	C	.	.	H	α-helix	trans	-64.6	-42.7	173.8	-173.8	66.5	0	0	0	111.5	F223 T231 V291	F223-L227 HydrophobicContact CE1-CD2 4.07Å; F223-L227 HydrophobicContact CZ-CD2 4.13Å; F223-L227 VanDerWaalsContact O-CB 3.26Å; F223-L227 WeakPolarHBondContact O-CB 3.5Å; F223-L227 PolarHBondContact O-N 2.89Å; L227-T231 WeakPolarHBondContact O-CB 3.32Å; L227-T231 PolarHBondContact O-N 3.45Å; L227-T231 VanDerWaalsContact O-N 3.07Å; L227-T231 PolarHBondContact O-OG1 3.26Å; L227-V291 HydrophobicContact CD1-CG1 4.18Å
228	F	92.2	Very high	87.5	Confident	99 Å²	99	40.9 Å²	40.9	43%	0.434	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-50.3	176	174.2	-97.5	0	0	0	111.1	F177 T181 F224 Y225 T231 V232	F177-F228 HydrophobicContact CE2-CE1 4.31Å; F177-F228 HydrophobicContact CE2-CZ 4.39Å; F177-F228 HydrophobicContact CZ-CE1 4.16Å; T181-F228 HydrophobicContact CG2-CE1 4Å; F224-F228 WeakPolarHBondContact O-CB 3.32Å; F224-F228 PolarHBondContact O-N 3.03Å; Y225-F228 PolarHBondContact O-N 3.3Å; F228-T231 PolarHBondContact O-N 3.33Å; F228-V232 HydrophobicContact CD2-CG2 4.01Å; F228-V232 HydrophobicContact CE1-CG2 4.46Å; F228-V232 HydrophobicContact CE2-CG2 3.68Å; F228-V232 HydrophobicContact CZ-CB 4.4Å; F228-V232 HydrophobicContact CZ-CG2 3.93Å; F228-V232 WeakPolarHBondContact O-CB 3.35Å; F228-V232 PolarHBondContact O-N 2.95Å
229	M	93.7	Very high	88.9	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-41.3	-178.7	-67.6	-61.2	-75.9	0	0	112.4	Y136 F177 I178 T181 Y225 F226 T231 S233 F234	Y136-M229 HydrophobicContact CD1-CE 4.37Å; Y136-M229 HydrophobicContact CD2-CB 4.28Å; Y136-M229 HydrophobicContact CD2-CE 3.28Å; Y136-M229 HydrophobicContact CE1-CB 3.87Å; Y136-M229 HydrophobicContact CE2-CB 3.63Å; Y136-M229 HydrophobicContact CE2-CE 3.8Å; Y136-M229 HydrophobicContact CE2-CG 4.09Å; Y136-M229 HydrophobicContact CG-CE 3.62Å; Y136-M229 WeakPolarHBondContact OH-CB 3.36Å; F177-M229 HydrophobicContact CE1-CE 4.43Å; F177-M229 HydrophobicContact CE1-SD 4.49Å; F177-M229 HydrophobicContact CZ-SD 4.4Å; I178-M229 HydrophobicContact CD1-CE 4.19Å; T181-M229 HydrophobicContact CG2-SD 3.99Å; Y225-M229 HydrophobicContact CD2-CG 3.87Å; Y225-M229 HydrophobicContact CE1-CG 4.39Å; Y225-M229 HydrophobicContact CE2-CG 3.41Å; Y225-M229 VanDerWaalsContact CE2-CG 3.41Å; Y225-M229 HydrophobicContact CE2-SD 4.21Å; Y225-M229 WeakPolarHBondContact O-CB 3.47Å; Y225-M229 VanDerWaalsContact O-CG 3.27Å; Y225-M229 WeakPolarHBondContact O-CG 3.21Å; Y225-M229 PolarHBondContact O-N 3.16Å; F226-M229 PolarHBondContact O-N 3Å; M229-T231 PolarHBondContact O-N 3.19Å; M229-S233 VanDerWaalsContact O-CA 3.3Å; M229-S233 WeakPolarHBondContact O-CA 3.37Å; M229-S233 WeakPolarHBondContact O-CB 3.45Å; M229-S233 PolarHBondContact O-N 3.11Å; M229-F234 PolarHBondContact O-N 2.8Å
230	A	91.4	Very high	89.9	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-38.4	174	0	0	0	0	0	111.4	F226 F234 F235 V291	F226-A230 WeakPolarHBondContact O-CB 2.97Å; F226-A230 PolarHBondContact O-N 3.32Å; A230-F234 CarbonylContact O-C 3.54Å; A230-F234 WeakPolarHBondContact O-CA 3.17Å; A230-F234 VanDerWaalsContact O-CB 3.27Å; A230-F234 WeakPolarHBondContact O-CB 3.37Å; A230-F234 PolarHBondContact O-N 2.96Å; A230-F235 HydrophobicContact CB-CE2 4.3Å; A230-F235 WeakPolarHBondContact O-CD2 3.5Å; A230-F235 PolarHBondContact O-N 3.3Å; A230-V291 HydrophobicContact CB-CG2 3.52Å
231	T	89.9	Confident	90.6	Very high	62 Å²	62	42.7 Å²	42.7	38%	0.38	21%	0.21	S	C	.	.	I	π-helix	trans	-72	-56.1	179	-54.9	0	0	0	0	111.9	L227 F228 M229 F235 I236	L227-T231 WeakPolarHBondContact O-CB 3.32Å; L227-T231 PolarHBondContact O-N 3.45Å; L227-T231 VanDerWaalsContact O-N 3.07Å; L227-T231 PolarHBondContact O-OG1 3.26Å; F228-T231 PolarHBondContact O-N 3.33Å; M229-T231 PolarHBondContact O-N 3.19Å; T231-F235 PolarHBondContact O-N 3.14Å; T231-I236 WeakPolarHBondContact O-CG1 3.28Å; T231-I236 PolarHBondContact O-N 3.17Å; T231-I236 VanDerWaalsContact O-N 3.07Å
232	V	93.8	Very high	91.2	Very high	48 Å²	48	41.8 Å²	41.8	29%	0.291	21%	0.213	S	C	.	.	I	π-helix	trans	-77.6	-38.3	-170.9	175.8	0	0	0	0	112.2	F177 F228 P237	F177-V232 HydrophobicContact CE2-CG1 4.4Å; F177-V232 HydrophobicContact CZ-CG1 3.81Å; F228-V232 HydrophobicContact CD2-CG2 4.01Å; F228-V232 HydrophobicContact CE1-CG2 4.46Å; F228-V232 HydrophobicContact CE2-CG2 3.68Å; F228-V232 HydrophobicContact CZ-CB 4.4Å; F228-V232 HydrophobicContact CZ-CG2 3.93Å; F228-V232 WeakPolarHBondContact O-CB 3.35Å; F228-V232 PolarHBondContact O-N 2.95Å; V232-P237 WeakPolarHBondContact O-CD 3.18Å
233	S	93.8	Very high	91.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-105	-3.4	-171.1	-51	0	0	0	0	113.3	Y136 V139 F177 M229	Y136-S233 VanDerWaalsContact CD1-CB 3.4Å; V139-S233 WeakPolarHBondContact CG1-O 3.42Å; F177-S233 WeakPolarHBondContact CE1-OG 3.25Å; M229-S233 VanDerWaalsContact O-CA 3.3Å; M229-S233 WeakPolarHBondContact O-CA 3.37Å; M229-S233 WeakPolarHBondContact O-CB 3.45Å; M229-S233 PolarHBondContact O-N 3.11Å
234	F	93.8	Very high	92.1	Very high	3 Å²	3	45 Å²	45	1%	0.013	23%	0.234	C	C	.	.	I	π-helix	trans	-128.9	-63	175.5	175.3	-103.5	0	0	0	113.5	V139 M229 A230 P237 C238 F279 F283 I284 N287	V139-F234 HydrophobicContact CG2-CD2 4.45Å; M229-F234 PolarHBondContact O-N 2.8Å; A230-F234 CarbonylContact O-C 3.54Å; A230-F234 WeakPolarHBondContact O-CA 3.17Å; A230-F234 VanDerWaalsContact O-CB 3.27Å; A230-F234 WeakPolarHBondContact O-CB 3.37Å; A230-F234 PolarHBondContact O-N 2.96Å; F234-P237 WeakPolarHBondContact O-CD 3.26Å; F234-C238 WeakPolarHBondContact CE2-SG 3.5Å; F234-C238 WeakPolarHBondContact O-CB 3.39Å; F234-C238 PolarHBondContact O-N 2.88Å; F234-C238 PolarHBondContact O-SG 2.86Å; F234-F279 HydrophobicContact CD2-CE1 4.43Å; F234-F279 AromaticContact CE2-CD1 3.94Å; F234-F279 HydrophobicContact CE2-CD1 3.94Å; F234-F279 HydrophobicContact CE2-CE1 4.06Å; F234-F283 HydrophobicContact CD2-CB 4.02Å; F234-F283 HydrophobicContact CE2-CB 3.51Å; F234-F283 HydrophobicContact CZ-CB 4.47Å; F234-I284 HydrophobicContact CE2-CG1 4.32Å; F234-I284 HydrophobicContact CZ-CB 4.22Å; F234-I284 HydrophobicContact CZ-CG1 3.63Å; F234-N287 HydrophobicContact CB-CB 4.46Å; F234-N287 HydrophobicContact CD1-CB 3.49Å; F234-N287 VanDerWaalsContact CD1-CB 3.49Å; F234-N287 HydrophobicContact CD2-CB 4.36Å; F234-N287 HydrophobicContact CE1-CB 3.73Å; F234-N287 HydrophobicContact CG-CB 3.83Å; F234-N287 HydrophobicContact CZ-CB 4.27Å
235	F	91.4	Very high	92.3	Very high	71 Å²	71	40.9 Å²	40.9	31%	0.311	22%	0.216	S	C	.	.	I	π-helix	trans	-65.1	-45.1	-174.6	-72.4	-64.6	0	0	0	113.4	A230 T231 C238 I239	A230-F235 HydrophobicContact CB-CE2 4.3Å; A230-F235 WeakPolarHBondContact O-CD2 3.5Å; A230-F235 PolarHBondContact O-N 3.3Å; T231-F235 PolarHBondContact O-N 3.14Å; F235-C238 WeakPolarHBondContact O-CB 3.11Å; F235-C238 PolarHBondContact O-N 3.32Å; F235-I239 WeakPolarHBondContact O-CG1 3.42Å; F235-I239 PolarHBondContact O-N 3.23Å; F235-I239 VanDerWaalsContact O-N 3.17Å
236	I	93.5	Very high	92.3	Very high	90 Å²	90	43 Å²	43	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-61.2	-52.2	175.4	-71.1	172.9	0	0	0	110.9	T231 C238 I239 V240	T231-I236 WeakPolarHBondContact O-CG1 3.28Å; T231-I236 PolarHBondContact O-N 3.17Å; T231-I236 VanDerWaalsContact O-N 3.07Å; I236-C238 VanDerWaalsContact C-N 3.32Å; I236-C238 PolarHBondContact O-N 3.07Å; I236-I239 PolarHBondContact O-N 3.07Å; I236-I239 VanDerWaalsContact O-N 3.14Å; I236-V240 WeakPolarHBondContact O-CG2 3.31Å; I236-V240 PolarHBondContact O-N 2.85Å
237	P	94.8	Very high	92.3	Very high	5 Å²	5	46 Å²	46	3%	0.032	25%	0.252	C	S	.	.	H	α-helix	trans	-51.3	-43	171.8	-36.8	41.9	0	0	0	114.8	V139 L140 T143 V232 F234 I239 V240 I241	V139-P237 HydrophobicContact CG1-CB 3.49Å; V139-P237 VanDerWaalsContact CG1-CB 3.49Å; V139-P237 HydrophobicContact CG1-CG 4.1Å; L140-P237 HydrophobicContact CD2-CG 3.9Å; T143-P237 WeakPolarHBondContact OG1-CB 3.48Å; V232-P237 WeakPolarHBondContact O-CD 3.18Å; F234-P237 WeakPolarHBondContact O-CD 3.26Å; P237-I239 PolarHBondContact O-N 3.46Å; P237-V240 PolarHBondContact O-N 3.34Å; P237-I241 WeakPolarHBondContact O-CB 3.43Å; P237-I241 VanDerWaalsContact O-CG1 3.29Å; P237-I241 WeakPolarHBondContact O-CG1 3.27Å; P237-I241 PolarHBondContact O-N 3.49Å
238	C	92.9	Very high	92.2	Very high	18 Å²	18	43.5 Å²	43.5	12%	0.122	24%	0.239	C	C	.	.	H	α-helix	trans	-56.3	-48.6	175.8	-72.7	0	0	0	0	111.8	F234 F235 I236 V240 I241 I242 F279	F234-C238 WeakPolarHBondContact CE2-SG 3.5Å; F234-C238 WeakPolarHBondContact O-CB 3.39Å; F234-C238 PolarHBondContact O-N 2.88Å; F234-C238 PolarHBondContact O-SG 2.86Å; F235-C238 WeakPolarHBondContact O-CB 3.11Å; F235-C238 PolarHBondContact O-N 3.32Å; I236-C238 VanDerWaalsContact C-N 3.32Å; I236-C238 PolarHBondContact O-N 3.07Å; C238-V240 VanDerWaalsContact C-N 3.33Å; C238-V240 PolarHBondContact O-N 3.49Å; C238-I241 PolarHBondContact O-N 2.88Å; C238-I242 VanDerWaalsContact O-CG1 3.27Å; C238-I242 WeakPolarHBondContact O-CG1 3.35Å; C238-I242 PolarHBondContact O-N 2.97Å; C238-F279 WeakPolarHBondContact SG-CE1 3.42Å
239	I	93.8	Very high	91.8	Very high	107 Å²	107	42.3 Å²	42.3	55%	0.549	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-44.8	179.4	-64.2	165.4	0	0	0	110.1	F235 I236 P237 I241 I242 V243	F235-I239 WeakPolarHBondContact O-CG1 3.42Å; F235-I239 PolarHBondContact O-N 3.23Å; F235-I239 VanDerWaalsContact O-N 3.17Å; I236-I239 PolarHBondContact O-N 3.07Å; I236-I239 VanDerWaalsContact O-N 3.14Å; P237-I239 PolarHBondContact O-N 3.46Å; I239-I241 VanDerWaalsContact C-N 3.35Å; I239-I241 PolarHBondContact O-N 2.87Å; I239-I242 PolarHBondContact O-N 2.98Å; I239-V243 HydrophobicContact CG2-CG2 4.43Å; I239-V243 WeakPolarHBondContact O-CG2 3.45Å; I239-V243 PolarHBondContact O-N 3.5Å
240	V	95.1	Very high	91.5	Very high	56 Å²	56	50.1 Å²	50.1	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-43.4	178.3	175.7	0	0	0	0	111.3	T143 V147 I236 P237 C238 V243 A244	T143-V240 HydrophobicContact CG2-CB 3.91Å; T143-V240 HydrophobicContact CG2-CG1 3.58Å; V147-V240 HydrophobicContact CG2-CG1 3.61Å; I236-V240 WeakPolarHBondContact O-CG2 3.31Å; I236-V240 PolarHBondContact O-N 2.85Å; P237-V240 PolarHBondContact O-N 3.34Å; C238-V240 VanDerWaalsContact C-N 3.33Å; C238-V240 PolarHBondContact O-N 3.49Å; V240-V243 PolarHBondContact O-N 3.02Å; V240-A244 WeakPolarHBondContact O-CB 3.49Å; V240-A244 PolarHBondContact O-N 3.43Å
241	I	93.2	Very high	91.1	Very high	11 Å²	11	51.7 Å²	51.7	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-47.2	176.9	-72.5	168.4	0	0	0	110.9	I142 T143 P237 C238 I239 V243 A244 Y245 V275 F279	I142-I241 HydrophobicContact CG2-CD1 4.11Å; T143-I241 HydrophobicContact CG2-CG1 4.22Å; T143-I241 WeakPolarHBondContact OG1-CD1 3.5Å; P237-I241 WeakPolarHBondContact O-CB 3.43Å; P237-I241 VanDerWaalsContact O-CG1 3.29Å; P237-I241 WeakPolarHBondContact O-CG1 3.27Å; P237-I241 PolarHBondContact O-N 3.49Å; C238-I241 PolarHBondContact O-N 2.88Å; I239-I241 VanDerWaalsContact C-N 3.35Å; I239-I241 PolarHBondContact O-N 2.87Å; I241-V243 PolarHBondContact O-N 2.78Å; I241-A244 PolarHBondContact O-N 3.34Å; I241-Y245 HydrophobicContact CG2-CD2 3.51Å; I241-Y245 HydrophobicContact CG2-CE2 3.51Å; I241-Y245 WeakPolarHBondContact O-CD2 3.44Å; I241-Y245 PolarHBondContact O-N 3.29Å; I241-V275 HydrophobicContact CG2-CG1 4.22Å; I241-F279 HydrophobicContact CD1-CE1 4.07Å; I241-F279 HydrophobicContact CD1-CE2 3.71Å; I241-F279 HydrophobicContact CD1-CZ 3.25Å
242	I	92	Very high	90.6	Very high	118 Å²	118	49.3 Å²	49.3	61%	0.605	27%	0.265	S	S	*	.	H	α-helix	trans	-59.3	-48.3	179.4	-69.7	165.3	0	0	0	110.2	C238 I239 Y245 A246	C238-I242 VanDerWaalsContact O-CG1 3.27Å; C238-I242 WeakPolarHBondContact O-CG1 3.35Å; C238-I242 PolarHBondContact O-N 2.97Å; I239-I242 PolarHBondContact O-N 2.98Å; I242-Y245 PolarHBondContact O-N 3.19Å; I242-A246 WeakPolarHBondContact O-CB 3.11Å; I242-A246 PolarHBondContact O-N 3.36Å
243	V	93.4	Very high	89.6	Confident	77 Å²	77	48.8 Å²	48.8	47%	0.467	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-46.9	178.2	173.6	0	0	0	0	110.8	I239 V240 I241 Y245 A246 L247	I239-V243 HydrophobicContact CG2-CG2 4.43Å; I239-V243 WeakPolarHBondContact O-CG2 3.45Å; I239-V243 PolarHBondContact O-N 3.5Å; V240-V243 PolarHBondContact O-N 3.02Å; I241-V243 PolarHBondContact O-N 2.78Å; V243-Y245 VanDerWaalsContact C-N 3.32Å; V243-Y245 PolarHBondContact O-N 3.18Å; V243-A246 PolarHBondContact O-N 3.46Å; V243-L247 HydrophobicContact CG1-CD1 3.88Å; V243-L247 HydrophobicContact CG1-CG 4.33Å; V243-L247 WeakPolarHBondContact O-CB 3.42Å; V243-L247 VanDerWaalsContact O-CG 3.25Å; V243-L247 WeakPolarHBondContact O-CG 3.35Å; V243-L247 PolarHBondContact O-N 3.25Å
244	A	91.8	Very high	88.5	Confident	7 Å²	7	53.3 Å²	53.3	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-42.4	179.8	0	0	0	0	0	112	V147 V240 I241 L248	V147-A244 HydrophobicContact CG2-CB 4.29Å; V240-A244 WeakPolarHBondContact O-CB 3.49Å; V240-A244 PolarHBondContact O-N 3.43Å; I241-A244 PolarHBondContact O-N 3.34Å; A244-L248 VanDerWaalsContact O-CB 3.31Å; A244-L248 WeakPolarHBondContact O-CB 3.27Å; A244-L248 PolarHBondContact O-N 2.93Å
245	Y	89.6	Confident	87.1	Confident	16 Å²	16	57.7 Å²	57.7	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-75.1	-36.1	178.3	-75	-45.8	0	0	0	113.7	S146 I241 I242 V243 L247 L248 L249 I272 V275	S146-Y245 PolarHBondContact OG-OH 3.1Å; S146-Y245 VanDerWaalsContact OG-OH 3.08Å; I241-Y245 HydrophobicContact CG2-CD2 3.51Å; I241-Y245 HydrophobicContact CG2-CE2 3.51Å; I241-Y245 WeakPolarHBondContact O-CD2 3.44Å; I241-Y245 PolarHBondContact O-N 3.29Å; I242-Y245 PolarHBondContact O-N 3.19Å; V243-Y245 VanDerWaalsContact C-N 3.32Å; V243-Y245 PolarHBondContact O-N 3.18Å; Y245-L247 VanDerWaalsContact C-N 3.32Å; Y245-L247 PolarHBondContact O-N 2.91Å; Y245-L248 HydrophobicContact CD1-CD2 3.82Å; Y245-L248 HydrophobicContact CE1-CD2 4.14Å; Y245-L248 PolarHBondContact O-N 3.37Å; Y245-L249 WeakPolarHBondContact O-CB 3.48Å; Y245-L249 WeakPolarHBondContact O-CG 3.27Å; Y245-L249 PolarHBondContact O-N 3.09Å; Y245-I272 HydrophobicContact CD1-CD1 3.86Å; Y245-I272 HydrophobicContact CD1-CG1 3.38Å; Y245-I272 HydrophobicContact CD2-CG1 4.05Å; Y245-I272 HydrophobicContact CE1-CG1 3.66Å; Y245-I272 HydrophobicContact CE2-CG1 4.28Å; Y245-I272 HydrophobicContact CG-CD1 4.1Å; Y245-I272 HydrophobicContact CG-CG1 3.61Å; Y245-V275 HydrophobicContact CE2-CB 4.2Å; Y245-V275 HydrophobicContact CE2-CG1 4.03Å; Y245-V275 HydrophobicContact CE2-CG2 4.47Å; Y245-V275 WeakPolarHBondContact OH-CG2 3.5Å
246	A	89.4	Confident	85.4	Confident	57 Å²	57	59.1 Å²	59.1	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-59.5	-45.2	172.5	0	0	0	0	0	111.1	I242 V243 L249 K250	I242-A246 WeakPolarHBondContact O-CB 3.11Å; I242-A246 PolarHBondContact O-N 3.36Å; V243-A246 PolarHBondContact O-N 3.46Å; A246-L249 PolarHBondContact O-N 2.76Å; A246-K250 WeakPolarHBondContact O-CB 3.17Å; A246-K250 PolarHBondContact O-N 3.47Å
247	L	89.9	Confident	83.6	Confident	63 Å²	63	61.6 Å²	61.6	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-42.7	175.7	-64.8	173.9	0	0	0	111.7	Y150 V243 Y245 L249 K250 T251	Y150-L247 HydrophobicContact CD2-CB 3.7Å; Y150-L247 HydrophobicContact CE1-CB 4.39Å; Y150-L247 HydrophobicContact CE1-CD1 3.96Å; Y150-L247 HydrophobicContact CE2-CB 3.35Å; Y150-L247 HydrophobicContact CE2-CD1 4.33Å; Y150-L247 HydrophobicContact CE2-CG 4.42Å; Y150-L247 HydrophobicContact CG-CB 4.36Å; V243-L247 HydrophobicContact CG1-CD1 3.88Å; V243-L247 HydrophobicContact CG1-CG 4.33Å; V243-L247 WeakPolarHBondContact O-CB 3.42Å; V243-L247 VanDerWaalsContact O-CG 3.25Å; V243-L247 WeakPolarHBondContact O-CG 3.35Å; V243-L247 PolarHBondContact O-N 3.25Å; Y245-L247 VanDerWaalsContact C-N 3.32Å; Y245-L247 PolarHBondContact O-N 2.91Å; L247-L249 VanDerWaalsContact C-N 3.35Å; L247-L249 PolarHBondContact O-N 2.92Å; L247-K250 PolarHBondContact O-N 3.07Å; L247-T251 PolarHBondContact O-N 3.5Å; L247-T251 PolarHBondContact O-OG1 3.46Å; L247-T251 VanDerWaalsContact O-OG1 3.08Å
248	L	86.3	Confident	82	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-57.2	-46.6	175.7	178.1	64.4	0	0	0	111.8	Y150 V153 A244 Y245 T251 L252 A268	Y150-L248 HydrophobicContact CD2-CB 4.35Å; V153-L248 HydrophobicContact CB-CD1 3.71Å; V153-L248 HydrophobicContact CG1-CD1 3.88Å; V153-L248 HydrophobicContact CG2-CD1 3.76Å; A244-L248 VanDerWaalsContact O-CB 3.31Å; A244-L248 WeakPolarHBondContact O-CB 3.27Å; A244-L248 PolarHBondContact O-N 2.93Å; Y245-L248 HydrophobicContact CD1-CD2 3.82Å; Y245-L248 HydrophobicContact CE1-CD2 4.14Å; Y245-L248 PolarHBondContact O-N 3.37Å; L248-T251 PolarHBondContact O-N 3.32Å; L248-L252 HydrophobicContact CD1-CD1 3.89Å; L248-L252 HydrophobicContact CD1-CG 4.43Å; L248-L252 HydrophobicContact CG-CD1 3.81Å; L248-L252 WeakPolarHBondContact O-CB 3.3Å; L248-L252 WeakPolarHBondContact O-CD1 3.45Å; L248-L252 WeakPolarHBondContact O-CG 3.46Å; L248-L252 PolarHBondContact O-N 3.2Å; L248-A268 HydrophobicContact CD2-CB 4.06Å
249	L	85.1	Confident	80.3	Confident	74 Å²	74	70.1 Å²	70.1	39%	0.387	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-40.8	178.1	-72.2	174	0	0	0	111.9	Y245 A246 L247 L252 G253 V269 I272	Y245-L249 WeakPolarHBondContact O-CB 3.48Å; Y245-L249 WeakPolarHBondContact O-CG 3.27Å; Y245-L249 PolarHBondContact O-N 3.09Å; A246-L249 PolarHBondContact O-N 2.76Å; L247-L249 VanDerWaalsContact C-N 3.35Å; L247-L249 PolarHBondContact O-N 2.92Å; L249-L252 PolarHBondContact O-N 3.3Å; L249-G253 PolarHBondContact O-N 3.4Å; L249-V269 HydrophobicContact CD2-CG2 4.27Å; L249-I272 HydrophobicContact CD1-CD1 4.02Å; L249-I272 HydrophobicContact CD2-CD1 3.83Å; L249-I272 HydrophobicContact CG-CD1 3.84Å
250	K	86.7	Confident	78.8	Confident	164 Å²	164	70.5 Å²	70.5	71%	0.713	41%	0.412	S	S	*	.	H	α-helix	trans	-61	-47.3	175.7	-174.5	179.5	179	179.9	0	111.5	A246 L247 L252 G253 S254	A246-K250 WeakPolarHBondContact O-CB 3.17Å; A246-K250 PolarHBondContact O-N 3.47Å; L247-K250 PolarHBondContact O-N 3.07Å; K250-L252 VanDerWaalsContact C-N 3.35Å; K250-L252 PolarHBondContact O-N 2.9Å; K250-G253 PolarHBondContact O-N 3.15Å; K250-S254 PolarHBondContact O-N 3.11Å
251	T	82.6	Confident	77.4	Confident	34 Å²	34	69 Å²	69	21%	0.209	41%	0.405	C	S	.	.	H	α-helix	trans	-63	-40.6	177.5	-56.7	0	0	0	0	111.8	V153 A154 L247 L248 N255	V153-T251 HydrophobicContact CG1-CG2 4.03Å; A154-T251 HydrophobicContact CB-CG2 4.48Å; L247-T251 PolarHBondContact O-N 3.5Å; L247-T251 PolarHBondContact O-OG1 3.46Å; L247-T251 VanDerWaalsContact O-OG1 3.08Å; L248-T251 PolarHBondContact O-N 3.32Å; T251-N255 PolarHBondContact O-ND2 2.86Å
252	L	79.3	Confident	76.2	Confident	13 Å²	13	72.7 Å²	72.7	7%	0.068	43%	0.428	C	S	.	.	H	α-helix	trans	-68.8	-33.1	176.8	-76.3	160.1	0	0	0	112.9	V153 L248 L249 K250 S254 T264 R265 A268	V153-L252 HydrophobicContact CG1-CD2 4.29Å; V153-L252 HydrophobicContact CG1-CG 4.25Å; L248-L252 HydrophobicContact CD1-CD1 3.89Å; L248-L252 HydrophobicContact CD1-CG 4.43Å; L248-L252 HydrophobicContact CG-CD1 3.81Å; L248-L252 WeakPolarHBondContact O-CB 3.3Å; L248-L252 WeakPolarHBondContact O-CD1 3.45Å; L248-L252 WeakPolarHBondContact O-CG 3.46Å; L248-L252 PolarHBondContact O-N 3.2Å; L249-L252 PolarHBondContact O-N 3.3Å; K250-L252 VanDerWaalsContact C-N 3.35Å; K250-L252 PolarHBondContact O-N 2.9Å; L252-S254 VanDerWaalsContact C-N 3.35Å; L252-T264 HydrophobicContact CD2-CG2 4.3Å; L252-R265 HydrophobicContact CD2-CB 4.28Å; L252-A268 HydrophobicContact CD1-CB 3.68Å
253	G	74.1	Confident	75.2	Confident	36 Å²	36	73.6 Å²	73.6	37%	0.371	43%	0.428	S	S	.	.	H	α-helix	trans	-71.9	-25.1	178.8	0	0	0	0	0	114.1	L249 K250 T256	L249-G253 PolarHBondContact O-N 3.4Å; K250-G253 PolarHBondContact O-N 3.15Å; G253-T256 VanDerWaalsContact O-CG2 3.29Å; G253-T256 WeakPolarHBondContact O-CG2 2.99Å
254	S	69.7	Low	74.1	Confident	96 Å²	96	73.1 Å²	73.1	67%	0.671	43%	0.425	S	S	*	.	H	α-helix	trans	-79.9	-17.2	178.4	-168.9	0	0	0	0	113.9	K250 L252	K250-S254 PolarHBondContact O-N 3.11Å; L252-S254 VanDerWaalsContact C-N 3.35Å
255	N	64.6	Low	73.4	Confident	94 Å²	94	78.8 Å²	78.8	50%	0.503	45%	0.445	S	S	.	.			trans	-103.4	38.9	-170.9	-67.8	-24	0	0	0	112.9	T251 V257	T251-N255 PolarHBondContact O-ND2 2.86Å; N255-V257 VanDerWaalsContact C-N 3.25Å; N255-V257 PolarHBondContact O-N 3.19Å
256	T	55.5	Low	72.8	Confident	102 Å²	102	87.3 Å²	87.3	63%	0.626	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	4	-163.3	33.5	0	0	0	0	117.6	G253	G253-T256 VanDerWaalsContact O-CG2 3.29Å; G253-T256 WeakPolarHBondContact O-CG2 2.99Å
257	V	56.5	Low	72.3	Confident	141 Å²	141	88.2 Å²	88.2	86%	0.855	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-7.3	-170.8	-167.1	0	0	0	0	114.2	N255	N255-V257 VanDerWaalsContact C-N 3.25Å; N255-V257 PolarHBondContact O-N 3.19Å
258	D	60.2	Low	71.6	Confident	116 Å²	116	85.7 Å²	85.7	62%	0.62	46%	0.459	S	S	*	.			trans	-109.8	132.2	-174.7	-100.7	-32	0	0	0	115.6	N260 A261 T262	D258-N260 PolarHBondContact O-N 2.78Å; D258-A261 HydrophobicContact CB-CB 4.07Å; D258-A261 WeakPolarHBondContact O-CA 3.47Å; D258-A261 WeakPolarHBondContact O-CB 3.24Å; D258-A261 PolarHBondContact O-N 2.97Å; D258-T262 PolarHBondContact O-N 2.98Å
259	S	58.4	Low	71.4	Confident	86 Å²	86	88.2 Å²	88.2	60%	0.601	47%	0.474	S	S	*	.	H	α-helix	trans	-56.2	-34.4	173.2	171.6	0	0	0	0	112.9	A261 T262	S259-A261 VanDerWaalsContact C-N 3.33Å; S259-A261 PolarHBondContact O-N 2.91Å; S259-T262 PolarHBondContact O-N 2.71Å; S259-T262 PolarHBondContact O-OG1 2.9Å
260	N	62.4	Low	71.3	Confident	116 Å²	116	86.7 Å²	86.7	62%	0.62	47%	0.468	S	S	*	.	H	α-helix	trans	-71.7	-25.8	174.4	-76.4	-28	0	0	0	113.3	D258 T264	D258-N260 PolarHBondContact O-N 2.78Å; N260-T264 PolarHBondContact O-N 3.1Å; N260-T264 PolarHBondContact O-OG1 3.43Å
261	A	64.8	Low	71.2	Confident	23 Å²	23	79.4 Å²	79.4	19%	0.19	44%	0.436	C	S	.	.	H	α-helix	trans	-68.8	-35	175.9	0	0	0	0	0	111.2	D258 S259 T264 R265	D258-A261 HydrophobicContact CB-CB 4.07Å; D258-A261 WeakPolarHBondContact O-CA 3.47Å; D258-A261 WeakPolarHBondContact O-CB 3.24Å; D258-A261 PolarHBondContact O-N 2.97Å; S259-A261 VanDerWaalsContact C-N 3.33Å; S259-A261 PolarHBondContact O-N 2.91Å; A261-T264 PolarHBondContact O-N 2.94Å; A261-R265 VanDerWaalsContact O-CB 3.22Å; A261-R265 WeakPolarHBondContact O-CB 3.27Å; A261-R265 PolarHBondContact O-N 3.08Å
262	T	68	Low	71.3	Confident	89 Å²	89	79.3 Å²	79.3	55%	0.546	43%	0.434	S	S	.	.	H	α-helix	trans	-66.5	-42.4	177.9	67.2	0	0	0	0	113	D258 S259 R265 R266	D258-T262 PolarHBondContact O-N 2.98Å; S259-T262 PolarHBondContact O-N 2.71Å; S259-T262 PolarHBondContact O-OG1 2.9Å; T262-R265 PolarHBondContact O-N 3.4Å; T262-R266 PolarHBondContact O-N 3.01Å
263	K	70.3	Confident	71.7	Confident	138 Å²	138	83.2 Å²	83.2	60%	0.6	46%	0.455	S	S	*	.	H	α-helix	trans	-64.2	-41.7	174.7	-71.7	-179.6	-176.8	171.8	0	112	R266 K267	K263-R266 PolarHBondContact O-N 2.76Å; K263-K267 WeakPolarHBondContact O-CG 3.42Å; K263-K267 PolarHBondContact O-N 2.97Å; K263-K267 VanDerWaalsContact O-N 3.13Å
264	T	70.9	Confident	72.4	Confident	66 Å²	66	82.6 Å²	82.6	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-67.2	-42.1	178.3	-55.8	0	0	0	0	111.2	L252 N260 A261 K267 A268	L252-T264 HydrophobicContact CD2-CG2 4.3Å; N260-T264 PolarHBondContact O-N 3.1Å; N260-T264 PolarHBondContact O-OG1 3.43Å; A261-T264 PolarHBondContact O-N 2.94Å; T264-K267 PolarHBondContact O-N 3.22Å; T264-A268 PolarHBondContact O-N 3.23Å
265	R	76.3	Confident	73.3	Confident	127 Å²	127	78.2 Å²	78.2	48%	0.479	41%	0.413	S	S	.	.	H	α-helix	trans	-59.9	-45.4	173.7	-176.6	177.6	175.5	-174.3	-1.1	111.9	L252 A261 T262 K267 A268 V269	L252-R265 HydrophobicContact CD2-CB 4.28Å; A261-R265 VanDerWaalsContact O-CB 3.22Å; A261-R265 WeakPolarHBondContact O-CB 3.27Å; A261-R265 PolarHBondContact O-N 3.08Å; T262-R265 PolarHBondContact O-N 3.4Å; R265-K267 PolarHBondContact O-N 3.4Å; R265-A268 PolarHBondContact O-N 3.46Å; R265-V269 HydrophobicContact CG-CG2 4.49Å; R265-V269 WeakPolarHBondContact O-CG2 3.47Å; R265-V269 PolarHBondContact O-N 3.27Å
266	R	77.9	Confident	74.5	Confident	195 Å²	195	78 Å²	78	74%	0.736	41%	0.412	S	S	*	.	H	α-helix	trans	-60.8	-44.5	176.9	-172.4	176.8	178.9	-176.7	0.6	112	T262 K263 A268 V269 V270	T262-R266 PolarHBondContact O-N 3.01Å; K263-R266 PolarHBondContact O-N 2.76Å; R266-A268 VanDerWaalsContact C-N 3.33Å; R266-A268 PolarHBondContact O-N 3.5Å; R266-V269 PolarHBondContact O-N 3.43Å; R266-V270 VanDerWaalsContact O-CG2 3.32Å; R266-V270 WeakPolarHBondContact O-CG2 3.41Å; R266-V270 PolarHBondContact O-N 3.44Å
267	K	77.9	Confident	76.1	Confident	76 Å²	76	76.3 Å²	76.3	33%	0.33	40%	0.401	S	S	.	.	H	α-helix	trans	-60.8	-42	175.2	-71.5	177.9	-177.7	172	0	111.7	K263 T264 R265 L271 E332	K263-K267 WeakPolarHBondContact O-CG 3.42Å; K263-K267 PolarHBondContact O-N 2.97Å; K263-K267 VanDerWaalsContact O-N 3.13Å; T264-K267 PolarHBondContact O-N 3.22Å; R265-K267 PolarHBondContact O-N 3.4Å; K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 PolarHBondContact O-N 3.08Å; K267-E332 IonicContact NZ-OE1 3.99Å; K267-E332 PolarHBondContact NZ-OE1 3.22Å
268	A	76.7	Confident	77.8	Confident	10 Å²	10	69.6 Å²	69.6	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-44.7	177.4	0	0	0	0	0	112.4	L248 L252 T264 R265 R266 L271 I272	L248-A268 HydrophobicContact CD2-CB 4.06Å; L252-A268 HydrophobicContact CD1-CB 3.68Å; T264-A268 PolarHBondContact O-N 3.23Å; R265-A268 PolarHBondContact O-N 3.46Å; R266-A268 VanDerWaalsContact C-N 3.33Å; R266-A268 PolarHBondContact O-N 3.5Å; A268-L271 PolarHBondContact O-N 2.73Å; A268-I272 VanDerWaalsContact O-CG1 3.26Å; A268-I272 WeakPolarHBondContact O-CG1 3.47Å; A268-I272 PolarHBondContact O-N 3.13Å
269	V	81.8	Confident	79.2	Confident	57 Å²	57	64.7 Å²	64.7	35%	0.345	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-44.6	176.8	171	0	0	0	0	111.3	L249 R265 R266 L271 I272 L273	L249-V269 HydrophobicContact CD2-CG2 4.27Å; R265-V269 HydrophobicContact CG-CG2 4.49Å; R265-V269 WeakPolarHBondContact O-CG2 3.47Å; R265-V269 PolarHBondContact O-N 3.27Å; R266-V269 PolarHBondContact O-N 3.43Å; V269-L271 VanDerWaalsContact C-N 3.34Å; V269-L271 PolarHBondContact O-N 2.88Å; V269-I272 WeakPolarHBondContact O-CB 3.4Å; V269-I272 PolarHBondContact O-N 3.42Å; V269-L273 HydrophobicContact CG1-CD1 4.27Å; V269-L273 WeakPolarHBondContact O-CG 3.14Å; V269-L273 PolarHBondContact O-N 3.2Å
270	V	82.8	Confident	80.7	Confident	41 Å²	41	65.1 Å²	65.1	25%	0.248	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-39.7	177.7	176.8	0	0	0	0	111.4	R266 I272 L273 V274 F329	R266-V270 VanDerWaalsContact O-CG2 3.32Å; R266-V270 WeakPolarHBondContact O-CG2 3.41Å; R266-V270 PolarHBondContact O-N 3.44Å; V270-I272 PolarHBondContact O-N 3.41Å; V270-L273 PolarHBondContact O-N 2.84Å; V270-V274 HydrophobicContact CG1-CG2 4.49Å; V270-V274 WeakPolarHBondContact O-CG2 3.16Å; V270-V274 PolarHBondContact O-N 3.41Å; V270-F329 HydrophobicContact CB-CD1 4.4Å; V270-F329 HydrophobicContact CB-CE1 4.41Å; V270-F329 HydrophobicContact CG1-CD1 3.77Å; V270-F329 HydrophobicContact CG1-CD2 3.79Å; V270-F329 HydrophobicContact CG1-CE1 3.49Å; V270-F329 VanDerWaalsContact CG1-CE1 3.49Å; V270-F329 HydrophobicContact CG1-CE2 3.52Å; V270-F329 HydrophobicContact CG1-CG 3.94Å; V270-F329 HydrophobicContact CG1-CZ 3.37Å
271	L	83.8	Confident	81.9	Confident	11 Å²	11	62.9 Å²	62.9	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-44.2	173.4	176.9	63	0	0	0	112	R149 K267 A268 V269 L273 V274 V275 I326 V330	R149-L271 HydrophobicContact CG-CD2 4.19Å; K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 PolarHBondContact O-N 3.08Å; A268-L271 PolarHBondContact O-N 2.73Å; V269-L271 VanDerWaalsContact C-N 3.34Å; V269-L271 PolarHBondContact O-N 2.88Å; L271-L273 VanDerWaalsContact C-N 3.32Å; L271-L273 PolarHBondContact O-N 2.97Å; L271-V274 PolarHBondContact O-N 2.86Å; L271-V275 HydrophobicContact CD1-CG2 4.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.48Å; L271-V275 PolarHBondContact O-N 2.85Å; L271-I326 HydrophobicContact CD1-CG2 3.93Å; L271-V330 HydrophobicContact CD1-CG2 3.69Å; L271-V330 HydrophobicContact CD2-CG2 3.87Å; L271-V330 HydrophobicContact CG-CG2 4.41Å
272	I	86.6	Confident	83.2	Confident	32 Å²	32	61.8 Å²	61.8	16%	0.164	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-45	175.3	-69.6	164.6	0	0	0	110.4	Y245 L249 A268 V269 V270 V275 L276	Y245-I272 HydrophobicContact CD1-CD1 3.86Å; Y245-I272 HydrophobicContact CD1-CG1 3.38Å; Y245-I272 HydrophobicContact CD2-CG1 4.05Å; Y245-I272 HydrophobicContact CE1-CG1 3.66Å; Y245-I272 HydrophobicContact CE2-CG1 4.28Å; Y245-I272 HydrophobicContact CG-CD1 4.1Å; Y245-I272 HydrophobicContact CG-CG1 3.61Å; L249-I272 HydrophobicContact CD1-CD1 4.02Å; L249-I272 HydrophobicContact CD2-CD1 3.83Å; L249-I272 HydrophobicContact CG-CD1 3.84Å; A268-I272 VanDerWaalsContact O-CG1 3.26Å; A268-I272 WeakPolarHBondContact O-CG1 3.47Å; A268-I272 PolarHBondContact O-N 3.13Å; V269-I272 WeakPolarHBondContact O-CB 3.4Å; V269-I272 PolarHBondContact O-N 3.42Å; V270-I272 PolarHBondContact O-N 3.41Å; I272-V275 PolarHBondContact O-N 3.31Å; I272-L276 VanDerWaalsContact O-CB 3.24Å; I272-L276 WeakPolarHBondContact O-CB 3.47Å; I272-L276 PolarHBondContact O-N 3.33Å
273	L	86.5	Confident	84.3	Confident	96 Å²	96	57.6 Å²	57.6	50%	0.503	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-44.4	178	-71.5	172.5	0	0	0	111.9	V269 V270 L271 L276 V277	V269-L273 HydrophobicContact CG1-CD1 4.27Å; V269-L273 WeakPolarHBondContact O-CG 3.14Å; V269-L273 PolarHBondContact O-N 3.2Å; V270-L273 PolarHBondContact O-N 2.84Å; L271-L273 VanDerWaalsContact C-N 3.32Å; L271-L273 PolarHBondContact O-N 2.97Å; L273-L276 PolarHBondContact O-N 2.93Å; L273-V277 WeakPolarHBondContact O-CB 3.04Å; L273-V277 VanDerWaalsContact O-CG2 3.26Å; L273-V277 WeakPolarHBondContact O-CG2 3.29Å; L273-V277 PolarHBondContact O-N 2.93Å
274	V	88.7	Confident	85.3	Confident	23 Å²	23	53.4 Å²	53.4	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-49.8	176.5	172.2	0	0	0	0	110.4	V270 L271 L276 V277 T278 F325 I326 F329	V270-V274 HydrophobicContact CG1-CG2 4.49Å; V270-V274 WeakPolarHBondContact O-CG2 3.16Å; V270-V274 PolarHBondContact O-N 3.41Å; L271-V274 PolarHBondContact O-N 2.86Å; V274-L276 VanDerWaalsContact C-N 3.34Å; V274-L276 PolarHBondContact O-N 3.31Å; V274-V277 PolarHBondContact O-N 3.41Å; V274-T278 PolarHBondContact O-N 2.75Å; V274-T278 PolarHBondContact O-OG1 2.92Å; V274-F325 HydrophobicContact CG1-CB 3.94Å; V274-F325 HydrophobicContact CG2-CB 4.23Å; V274-I326 HydrophobicContact CG1-CG1 3.65Å; V274-F329 HydrophobicContact CG2-CD2 4.01Å; V274-F329 HydrophobicContact CG2-CE2 3.9Å
275	V	89.4	Confident	86.1	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-43.4	178.8	172.9	0	0	0	0	111.1	I142 I241 Y245 L271 I272 V277 T278 F279 I326	I142-V275 HydrophobicContact CG2-CG1 3.82Å; I142-V275 HydrophobicContact CG2-CG2 3.97Å; I241-V275 HydrophobicContact CG2-CG1 4.22Å; Y245-V275 HydrophobicContact CE2-CB 4.2Å; Y245-V275 HydrophobicContact CE2-CG1 4.03Å; Y245-V275 HydrophobicContact CE2-CG2 4.47Å; Y245-V275 WeakPolarHBondContact OH-CG2 3.5Å; L271-V275 HydrophobicContact CD1-CG2 4.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.48Å; L271-V275 PolarHBondContact O-N 2.85Å; I272-V275 PolarHBondContact O-N 3.31Å; V275-V277 PolarHBondContact O-N 3.35Å; V275-T278 PolarHBondContact O-N 2.65Å; V275-F279 HydrophobicContact CG1-CD2 3.75Å; V275-F279 HydrophobicContact CG1-CE2 3.78Å; V275-F279 VanDerWaalsContact O-CD2 3.24Å; V275-F279 WeakPolarHBondContact O-CD2 3.42Å; V275-F279 PolarHBondContact O-N 3.24Å; V275-I326 HydrophobicContact CG2-CD1 4.14Å
276	L	89.3	Confident	86.7	Confident	90 Å²	90	45.5 Å²	45.5	47%	0.471	23%	0.231	S	C	.	.	H	α-helix	trans	-59	-46.3	177	-178.6	68	0	0	0	111.5	I272 L273 V274 F279 L280	I272-L276 VanDerWaalsContact O-CB 3.24Å; I272-L276 WeakPolarHBondContact O-CB 3.47Å; I272-L276 PolarHBondContact O-N 3.33Å; L273-L276 PolarHBondContact O-N 2.93Å; V274-L276 VanDerWaalsContact C-N 3.34Å; V274-L276 PolarHBondContact O-N 3.31Å; L276-F279 PolarHBondContact O-N 3.32Å; L276-L280 HydrophobicContact CD1-CD1 4.08Å; L276-L280 HydrophobicContact CD1-CG 4.23Å; L276-L280 HydrophobicContact CD2-CD1 4.39Å; L276-L280 HydrophobicContact CG-CD1 3.8Å; L276-L280 HydrophobicContact CG-CG 4.33Å; L276-L280 WeakPolarHBondContact O-CB 3.36Å; L276-L280 VanDerWaalsContact O-CG 3.27Å; L276-L280 WeakPolarHBondContact O-CG 3.43Å; L276-L280 PolarHBondContact O-N 3.23Å
277	V	89.4	Confident	87.3	Confident	65 Å²	65	36.2 Å²	36.2	39%	0.394	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-45.5	177.2	169.8	0	0	0	0	110.9	L273 V274 V275 F279 L280 I281	L273-V277 WeakPolarHBondContact O-CB 3.04Å; L273-V277 VanDerWaalsContact O-CG2 3.26Å; L273-V277 WeakPolarHBondContact O-CG2 3.29Å; L273-V277 PolarHBondContact O-N 2.93Å; V274-V277 PolarHBondContact O-N 3.41Å; V275-V277 PolarHBondContact O-N 3.35Å; V277-F279 VanDerWaalsContact C-N 3.32Å; V277-F279 PolarHBondContact O-N 3.05Å; V277-L280 PolarHBondContact O-N 2.69Å; V277-I281 HydrophobicContact CG1-CD1 3.64Å; V277-I281 HydrophobicContact CG1-CG1 4.36Å; V277-I281 WeakPolarHBondContact O-CB 3.26Å; V277-I281 WeakPolarHBondContact O-CG1 3.5Å; V277-I281 PolarHBondContact O-N 3.46Å
278	T	91.3	Very high	87.8	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-43.4	176.1	-53.8	0	0	0	0	111.3	V274 V275 C282 F283 N319 L322	V274-T278 PolarHBondContact O-N 2.75Å; V274-T278 PolarHBondContact O-OG1 2.92Å; V275-T278 PolarHBondContact O-N 2.65Å; T278-C282 HydrophobicContact CG2-CB 4.41Å; T278-C282 WeakPolarHBondContact O-CA 3.47Å; T278-C282 WeakPolarHBondContact O-CB 3.35Å; T278-C282 PolarHBondContact O-N 3.17Å; T278-F283 HydrophobicContact CG2-CD2 4.11Å; T278-F283 HydrophobicContact CG2-CE2 3.51Å; T278-F283 HydrophobicContact CG2-CZ 4.09Å; T278-F283 PolarHBondContact O-N 2.89Å; T278-N319 HydrophobicContact CG2-CB 4.29Å; T278-L322 HydrophobicContact CG2-CB 4.4Å; T278-L322 HydrophobicContact CG2-CD1 4.17Å
279	F	91.1	Very high	88.1	Confident	12 Å²	12	33.4 Å²	33.4	5%	0.053	18%	0.182	C	C	.	.	I	π-helix	trans	-67.5	-44.4	177.8	-87.1	-104.8	0	0	0	112.4	V139 I142 F234 C238 I241 V275 L276 V277 I281 F283 I284	V139-F279 HydrophobicContact CG1-CE1 4.28Å; V139-F279 HydrophobicContact CG1-CZ 4.05Å; V139-F279 HydrophobicContact CG2-CZ 4.34Å; I142-F279 HydrophobicContact CG2-CE2 4.04Å; F234-F279 HydrophobicContact CD2-CE1 4.43Å; F234-F279 AromaticContact CE2-CD1 3.94Å; F234-F279 HydrophobicContact CE2-CD1 3.94Å; F234-F279 HydrophobicContact CE2-CE1 4.06Å; C238-F279 WeakPolarHBondContact SG-CE1 3.42Å; I241-F279 HydrophobicContact CD1-CE1 4.07Å; I241-F279 HydrophobicContact CD1-CE2 3.71Å; I241-F279 HydrophobicContact CD1-CZ 3.25Å; V275-F279 HydrophobicContact CG1-CD2 3.75Å; V275-F279 HydrophobicContact CG1-CE2 3.78Å; V275-F279 VanDerWaalsContact O-CD2 3.24Å; V275-F279 WeakPolarHBondContact O-CD2 3.42Å; V275-F279 PolarHBondContact O-N 3.24Å; L276-F279 PolarHBondContact O-N 3.32Å; V277-F279 VanDerWaalsContact C-N 3.32Å; V277-F279 PolarHBondContact O-N 3.05Å; F279-I281 PolarHBondContact O-N 2.93Å; F279-F283 HydrophobicContact CD1-CB 4.35Å; F279-F283 HydrophobicContact CD1-CD2 4.19Å; F279-F283 AromaticContact CD2-CD2 3.85Å; F279-F283 HydrophobicContact CD2-CD2 3.85Å; F279-F283 HydrophobicContact CD2-CE2 4.32Å; F279-F283 HydrophobicContact CE1-CD2 4.26Å; F279-F283 AromaticContact CE2-CD2 3.95Å; F279-F283 HydrophobicContact CE2-CD2 3.95Å; F279-F283 HydrophobicContact CE2-CE2 4.16Å; F279-F283 AromaticContact CG-CD2 3.99Å; F279-F283 HydrophobicContact CG-CD2 3.99Å; F279-F283 HydrophobicContact CZ-CD2 4.15Å; F279-F283 PolarHBondContact O-N 3.36Å; F279-I284 HydrophobicContact CB-CD1 4.21Å; F279-I284 VanDerWaalsContact O-CB 3.32Å; F279-I284 WeakPolarHBondContact O-CB 3.1Å; F279-I284 WeakPolarHBondContact O-CG1 3.31Å; F279-I284 PolarHBondContact O-N 2.99Å
280	L	88.7	Confident	88.2	Confident	95 Å²	95	30.7 Å²	30.7	50%	0.497	17%	0.166	S	C	.	.	I	π-helix	trans	-65.9	-36.5	-178.8	-73.2	173	0	0	0	113	L276 V277 I284 P285	L276-L280 HydrophobicContact CD1-CD1 4.08Å; L276-L280 HydrophobicContact CD1-CG 4.23Å; L276-L280 HydrophobicContact CD2-CD1 4.39Å; L276-L280 HydrophobicContact CG-CD1 3.8Å; L276-L280 HydrophobicContact CG-CG 4.33Å; L276-L280 WeakPolarHBondContact O-CB 3.36Å; L276-L280 VanDerWaalsContact O-CG 3.27Å; L276-L280 WeakPolarHBondContact O-CG 3.43Å; L276-L280 PolarHBondContact O-N 3.23Å; V277-L280 PolarHBondContact O-N 2.69Å; L280-I284 HydrophobicContact CD2-CD1 3.94Å; L280-P285 VanDerWaalsContact O-CD 3.23Å; L280-P285 WeakPolarHBondContact O-CD 3.47Å; L280-P285 WeakPolarHBondContact O-CG 3.46Å
281	I	88.3	Confident	88.2	Confident	70 Å²	70	29 Å²	29	36%	0.359	16%	0.156	S	C	.	.	I	π-helix	trans	-91.5	-46.1	-176.3	-61.2	179.3	0	0	0	111.3	V277 F279 L315	V277-I281 HydrophobicContact CG1-CD1 3.64Å; V277-I281 HydrophobicContact CG1-CG1 4.36Å; V277-I281 WeakPolarHBondContact O-CB 3.26Å; V277-I281 WeakPolarHBondContact O-CG1 3.5Å; V277-I281 PolarHBondContact O-N 3.46Å; F279-I281 PolarHBondContact O-N 2.93Å; I281-L315 HydrophobicContact CG2-CB 4.42Å
282	C	91.4	Very high	88.2	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-98.4	-38.4	-166.5	-56.4	0	0	0	0	113.6	T278 S286 L315 A316 N319	T278-C282 HydrophobicContact CG2-CB 4.41Å; T278-C282 WeakPolarHBondContact O-CA 3.47Å; T278-C282 WeakPolarHBondContact O-CB 3.35Å; T278-C282 PolarHBondContact O-N 3.17Å; C282-S286 PolarHBondContact O-OG 2.9Å; C282-L315 PolarHBondContact SG-O 3.45Å; C282-A316 VanDerWaalsContact O-CA 3.26Å; C282-A316 WeakPolarHBondContact O-CA 3.29Å; C282-A316 WeakPolarHBondContact O-CB 3.35Å; C282-N319 HydrophobicContact CB-CB 4.08Å; C282-N319 PolarHBondContact SG-N 3.28Å
283	F	92.4	Very high	87.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	I	π-helix	trans	-106.1	-44.2	-167.8	-57.6	-49.6	0	0	0	114.6	M135 V139 I142 F234 T278 F279 S286 N287 N319	M135-F283 HydrophobicContact CG-CD1 3.87Å; M135-F283 HydrophobicContact CG-CE1 3.99Å; V139-F283 HydrophobicContact CG2-CB 4.45Å; V139-F283 HydrophobicContact CG2-CD1 3.81Å; V139-F283 HydrophobicContact CG2-CD2 3.75Å; V139-F283 HydrophobicContact CG2-CE1 3.87Å; V139-F283 HydrophobicContact CG2-CE2 3.81Å; V139-F283 HydrophobicContact CG2-CG 3.76Å; V139-F283 HydrophobicContact CG2-CZ 3.87Å; I142-F283 HydrophobicContact CD1-CE2 4.01Å; I142-F283 HydrophobicContact CD1-CZ 4.44Å; F234-F283 HydrophobicContact CD2-CB 4.02Å; F234-F283 HydrophobicContact CE2-CB 3.51Å; F234-F283 HydrophobicContact CZ-CB 4.47Å; T278-F283 HydrophobicContact CG2-CD2 4.11Å; T278-F283 HydrophobicContact CG2-CE2 3.51Å; T278-F283 HydrophobicContact CG2-CZ 4.09Å; T278-F283 PolarHBondContact O-N 2.89Å; F279-F283 HydrophobicContact CD1-CB 4.35Å; F279-F283 HydrophobicContact CD1-CD2 4.19Å; F279-F283 AromaticContact CD2-CD2 3.85Å; F279-F283 HydrophobicContact CD2-CD2 3.85Å; F279-F283 HydrophobicContact CD2-CE2 4.32Å; F279-F283 HydrophobicContact CE1-CD2 4.26Å; F279-F283 AromaticContact CE2-CD2 3.95Å; F279-F283 HydrophobicContact CE2-CD2 3.95Å; F279-F283 HydrophobicContact CE2-CE2 4.16Å; F279-F283 AromaticContact CG-CD2 3.99Å; F279-F283 HydrophobicContact CG-CD2 3.99Å; F279-F283 HydrophobicContact CZ-CD2 4.15Å; F279-F283 PolarHBondContact O-N 3.36Å; F283-S286 PolarHBondContact O-OG 3.42Å; F283-N287 WeakPolarHBondContact O-CB 3.38Å; F283-N287 PolarHBondContact O-N 3.45Å; F283-N287 PolarHBondContact O-ND2 3.29Å; F283-N319 HydrophobicContact CE1-CB 3.89Å; F283-N319 WeakPolarHBondContact CE1-ND2 3.3Å; F283-N319 HydrophobicContact CZ-CB 3.7Å
284	I	89.7	Confident	87.3	Confident	51 Å²	51	23.7 Å²	23.7	26%	0.262	13%	0.128	S	C	.	.	H	α-helix	trans	-62.4	-52.6	-178.8	-71.5	164.4	0	0	0	111	F234 F279 L280 S286 I288	F234-I284 HydrophobicContact CE2-CG1 4.32Å; F234-I284 HydrophobicContact CZ-CB 4.22Å; F234-I284 HydrophobicContact CZ-CG1 3.63Å; F279-I284 HydrophobicContact CB-CD1 4.21Å; F279-I284 VanDerWaalsContact O-CB 3.32Å; F279-I284 WeakPolarHBondContact O-CB 3.1Å; F279-I284 WeakPolarHBondContact O-CG1 3.31Å; F279-I284 PolarHBondContact O-N 2.99Å; L280-I284 HydrophobicContact CD2-CD1 3.94Å; I284-S286 PolarHBondContact O-N 3.44Å; I284-I288 HydrophobicContact CG2-CD1 3.51Å; I284-I288 HydrophobicContact CG2-CG1 4.33Å; I284-I288 WeakPolarHBondContact O-CB 3.15Å; I284-I288 VanDerWaalsContact O-CG1 3.26Å; I284-I288 WeakPolarHBondContact O-CG1 3.27Å; I284-I288 PolarHBondContact O-N 2.92Å
285	P	88.9	Confident	86.8	Confident	26 Å²	26	22.9 Å²	22.9	17%	0.169	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-43.7	-176.2	-22.9	36.2	0	0	0	111.6	L280 M289 F308	L280-P285 VanDerWaalsContact O-CD 3.23Å; L280-P285 WeakPolarHBondContact O-CD 3.47Å; L280-P285 WeakPolarHBondContact O-CG 3.46Å; P285-M289 VanDerWaalsContact O-CB 3.22Å; P285-M289 WeakPolarHBondContact O-CB 3.26Å; P285-M289 WeakPolarHBondContact O-CG 3.29Å; P285-M289 PolarHBondContact O-N 3.47Å; P285-F308 HydrophobicContact CB-CZ 4.45Å
286	S	89.4	Confident	86.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-50.8	-179.5	54.4	0	0	0	0	112.3	C282 F283 I284 M289 L290 S312	C282-S286 PolarHBondContact O-OG 2.9Å; F283-S286 PolarHBondContact O-OG 3.42Å; I284-S286 PolarHBondContact O-N 3.44Å; S286-M289 PolarHBondContact O-N 2.92Å; S286-L290 WeakPolarHBondContact O-CB 3.44Å; S286-L290 PolarHBondContact O-N 3.36Å; S286-S312 WeakPolarHBondContact CA-OG 3.33Å
287	N	90.2	Very high	85.2	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68.3	-38.5	-178.2	-76.3	-91.2	0	0	0	112.6	M135 F234 F283 V291	M135-N287 WeakPolarHBondContact CE-ND2 3.47Å; M135-N287 WeakPolarHBondContact CE-OD1 3.38Å; F234-N287 HydrophobicContact CB-CB 4.46Å; F234-N287 HydrophobicContact CD1-CB 3.49Å; F234-N287 VanDerWaalsContact CD1-CB 3.49Å; F234-N287 HydrophobicContact CD2-CB 4.36Å; F234-N287 HydrophobicContact CE1-CB 3.73Å; F234-N287 HydrophobicContact CG-CB 3.83Å; F234-N287 HydrophobicContact CZ-CB 4.27Å; F283-N287 WeakPolarHBondContact O-CB 3.38Å; F283-N287 PolarHBondContact O-N 3.45Å; F283-N287 PolarHBondContact O-ND2 3.29Å; N287-V291 WeakPolarHBondContact O-CG2 3.32Å; N287-V291 PolarHBondContact O-N 3.47Å; N287-V291 VanDerWaalsContact O-N 3.1Å
288	I	87.3	Confident	84.4	Confident	21 Å²	21	21.5 Å²	21.5	11%	0.108	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-51.3	174.9	-69.9	176.5	0	0	0	109.6	I13 F17 I284 L290 V291 V292	I13-I288 HydrophobicContact CG2-CD1 4.17Å; I13-I288 HydrophobicContact CG2-CG2 3.97Å; F17-I288 HydrophobicContact CE2-CD1 4.47Å; I284-I288 HydrophobicContact CG2-CD1 3.51Å; I284-I288 HydrophobicContact CG2-CG1 4.33Å; I284-I288 WeakPolarHBondContact O-CB 3.15Å; I284-I288 VanDerWaalsContact O-CG1 3.26Å; I284-I288 WeakPolarHBondContact O-CG1 3.27Å; I284-I288 PolarHBondContact O-N 2.92Å; I288-L290 VanDerWaalsContact C-N 3.25Å; I288-L290 PolarHBondContact O-N 3.44Å; I288-V291 PolarHBondContact O-N 3.45Å; I288-V292 HydrophobicContact CG2-CG2 4.06Å; I288-V292 WeakPolarHBondContact O-CB 3.39Å; I288-V292 VanDerWaalsContact O-CG2 3.24Å; I288-V292 WeakPolarHBondContact O-CG2 3.22Å; I288-V292 PolarHBondContact O-N 3.23Å
289	M	83.6	Confident	83.4	Confident	6 Å²	6	24.2 Å²	24.2	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-64.2	-34.2	-177.5	-73	-54.5	-60.8	0	0	112.4	P285 S286 V292 H293 G305 F308 Y309	P285-M289 VanDerWaalsContact O-CB 3.22Å; P285-M289 WeakPolarHBondContact O-CB 3.26Å; P285-M289 WeakPolarHBondContact O-CG 3.29Å; P285-M289 PolarHBondContact O-N 3.47Å; S286-M289 PolarHBondContact O-N 2.92Å; M289-V292 PolarHBondContact O-N 3.42Å; M289-H293 WeakPolarHBondContact O-CB 3.39Å; M289-H293 PolarHBondContact O-N 2.96Å; M289-G305 VanDerWaalsContact CE-O 3.31Å; M289-G305 WeakPolarHBondContact CE-O 3.43Å; M289-F308 HydrophobicContact CE-CD1 3.98Å; M289-F308 HydrophobicContact CG-CD1 3.49Å; M289-F308 VanDerWaalsContact CG-CD1 3.49Å; M289-F308 HydrophobicContact CG-CE1 3.58Å; M289-F308 HydrophobicContact SD-CD1 3.49Å; M289-F308 WeakPolarHBondContact SD-CD1 3.35Å; M289-F308 HydrophobicContact SD-CE1 3.8Å; M289-Y309 HydrophobicContact CB-CD2 3.82Å; M289-Y309 HydrophobicContact CB-CG 4.46Å
290	L	83.3	Confident	82.2	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-65.4	-47.1	176.6	-156.1	159.1	0	0	0	110.6	Y132 F226 S286 I288 H293 Y294 Y309	Y132-L290 HydrophobicContact CE1-CD1 3.6Å; F226-L290 HydrophobicContact CB-CD2 3.21Å; F226-L290 HydrophobicContact CD1-CD1 3.65Å; F226-L290 HydrophobicContact CD1-CD2 3.19Å; F226-L290 HydrophobicContact CD1-CG 4.03Å; F226-L290 HydrophobicContact CD2-CD2 3.79Å; F226-L290 HydrophobicContact CE1-CD1 3.62Å; F226-L290 HydrophobicContact CE1-CD2 3.9Å; F226-L290 HydrophobicContact CE1-CG 4.33Å; F226-L290 HydrophobicContact CE2-CD2 4.43Å; F226-L290 HydrophobicContact CG-CD1 4.4Å; F226-L290 HydrophobicContact CG-CD2 3.12Å; F226-L290 HydrophobicContact CG-CG 4.3Å; F226-L290 HydrophobicContact CZ-CD1 4.36Å; F226-L290 HydrophobicContact CZ-CD2 4.48Å; S286-L290 WeakPolarHBondContact O-CB 3.44Å; S286-L290 PolarHBondContact O-N 3.36Å; I288-L290 VanDerWaalsContact C-N 3.25Å; I288-L290 PolarHBondContact O-N 3.44Å; L290-H293 PolarHBondContact O-N 3.31Å; L290-Y294 HydrophobicContact CD2-CD2 3.62Å; L290-Y294 HydrophobicContact CD2-CE2 3.76Å; L290-Y294 HydrophobicContact CG-CD2 4.37Å; L290-Y294 HydrophobicContact CG-CE2 4.31Å; L290-Y294 VanDerWaalsContact O-CD2 3.29Å; L290-Y294 WeakPolarHBondContact O-CD2 3.4Å; L290-Y294 PolarHBondContact O-N 3.32Å; L290-Y294 VanDerWaalsContact O-N 3.12Å; L290-Y309 HydrophobicContact CB-CE2 4.14Å; L290-Y309 HydrophobicContact CG-CE2 4.14Å
291	V	84.1	Confident	80.9	Confident	5 Å²	5	31.7 Å²	31.7	3%	0.03	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-45.5	175.6	173.2	0	0	0	0	111.4	L10 L227 A230 N287 I288 Y294 V295	L10-V291 HydrophobicContact CD1-CG1 3.63Å; L10-V291 HydrophobicContact CD2-CG1 3.9Å; L10-V291 HydrophobicContact CG-CG1 4.25Å; L227-V291 HydrophobicContact CD1-CG1 4.18Å; A230-V291 HydrophobicContact CB-CG2 3.52Å; N287-V291 WeakPolarHBondContact O-CG2 3.32Å; N287-V291 PolarHBondContact O-N 3.47Å; N287-V291 VanDerWaalsContact O-N 3.1Å; I288-V291 PolarHBondContact O-N 3.45Å; V291-Y294 PolarHBondContact O-N 3.3Å; V291-V295 HydrophobicContact CG1-CG2 4.26Å; V291-V295 WeakPolarHBondContact O-CB 3.46Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 2.87Å
292	V	81.8	Confident	79.6	Confident	12 Å²	12	33 Å²	33	7%	0.073	16%	0.164	C	C	.	.	H	α-helix	trans	-60.4	-47.8	178.7	169.2	0	0	0	0	110.6	I288 M289 Y294 V295 L296	I288-V292 HydrophobicContact CG2-CG2 4.06Å; I288-V292 WeakPolarHBondContact O-CB 3.39Å; I288-V292 VanDerWaalsContact O-CG2 3.24Å; I288-V292 WeakPolarHBondContact O-CG2 3.22Å; I288-V292 PolarHBondContact O-N 3.23Å; M289-V292 PolarHBondContact O-N 3.42Å; V292-Y294 PolarHBondContact O-N 3.25Å; V292-V295 PolarHBondContact O-N 3.24Å; V292-L296 HydrophobicContact CG1-CD1 3.55Å; V292-L296 HydrophobicContact CG1-CG 4.09Å; V292-L296 WeakPolarHBondContact O-CB 3.33Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.2Å; V292-L296 PolarHBondContact O-N 3.03Å
293	H	77.8	Confident	78.2	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-56.9	-52	179.3	-179	66.5	0	0	0	111.4	I206 M289 L290 V295 L296 V297 D303 Y306	I206-H293 WeakPolarHBondContact CD1-NE2 3.38Å; M289-H293 WeakPolarHBondContact O-CB 3.39Å; M289-H293 PolarHBondContact O-N 2.96Å; L290-H293 PolarHBondContact O-N 3.31Å; H293-V295 VanDerWaalsContact C-N 3.35Å; H293-V295 PolarHBondContact O-N 2.91Å; H293-L296 PolarHBondContact O-N 2.84Å; H293-V297 WeakPolarHBondContact O-CB 3.33Å; H293-V297 WeakPolarHBondContact O-CG2 3.38Å; H293-V297 PolarHBondContact O-N 3.45Å; H293-D303 IonicContact CE1-OD2 3.6Å; H293-D303 IonicContact CG-OD2 3.82Å; H293-D303 IonicContact ND1-OD2 2.75Å; H293-D303 PolarHBondContact ND1-OD2 2.96Å; H293-Y306 AromaticContact CE1-CD2 3.99Å
294	Y	77.1	Confident	76.8	Confident	12 Å²	12	39.6 Å²	39.6	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-68.6	-30.1	179.9	-82.6	-72.4	0	0	0	113.7	I206 I219 P222 F223 F226 L290 V291 V292 K298	I206-Y294 HydrophobicContact CD1-CD1 4.34Å; I206-Y294 HydrophobicContact CD1-CE1 3.65Å; I219-Y294 HydrophobicContact CG2-CD1 4.01Å; I219-Y294 HydrophobicContact CG2-CE1 4.35Å; P222-Y294 HydrophobicContact CB-CE1 3.66Å; P222-Y294 HydrophobicContact CG-CE1 4Å; F223-Y294 HydrophobicContact CB-CD1 4.44Å; F223-Y294 WeakPolarHBondContact CD2-O 3.32Å; F226-Y294 HydrophobicContact CB-CD2 4.22Å; F226-Y294 HydrophobicContact CB-CE2 4.4Å; F226-Y294 AromaticContact CD2-CD2 3.8Å; F226-Y294 HydrophobicContact CD2-CD2 3.8Å; F226-Y294 HydrophobicContact CD2-CE1 4.34Å; F226-Y294 AromaticContact CD2-CE2 3.15Å; F226-Y294 HydrophobicContact CD2-CE2 3.15Å; F226-Y294 AromaticContact CD2-CZ 3.48Å; F226-Y294 VanDerWaalsContact CD2-CZ 3.48Å; F226-Y294 AromaticContact CE2-CE2 3.49Å; F226-Y294 HydrophobicContact CE2-CE2 3.49Å; F226-Y294 VanDerWaalsContact CE2-CE2 3.49Å; F226-Y294 AromaticContact CE2-CZ 3.58Å; F226-Y294 VanDerWaalsContact CE2-OH 3.24Å; F226-Y294 WeakPolarHBondContact CE2-OH 3.3Å; F226-Y294 HydrophobicContact CG-CD2 4.26Å; F226-Y294 AromaticContact CG-CE2 3.94Å; F226-Y294 HydrophobicContact CG-CE2 3.94Å; F226-Y294 HydrophobicContact CZ-CE2 4.45Å; L290-Y294 HydrophobicContact CD2-CD2 3.62Å; L290-Y294 HydrophobicContact CD2-CE2 3.76Å; L290-Y294 HydrophobicContact CG-CD2 4.37Å; L290-Y294 HydrophobicContact CG-CE2 4.31Å; L290-Y294 VanDerWaalsContact O-CD2 3.29Å; L290-Y294 WeakPolarHBondContact O-CD2 3.4Å; L290-Y294 PolarHBondContact O-N 3.32Å; L290-Y294 VanDerWaalsContact O-N 3.12Å; V291-Y294 PolarHBondContact O-N 3.3Å; V292-Y294 PolarHBondContact O-N 3.25Å; Y294-K298 WeakPolarHBondContact O-CB 3.46Å; Y294-K298 PolarHBondContact O-N 3.05Å
295	V	78.6	Confident	75.6	Confident	7 Å²	7	37.5 Å²	37.5	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-46.6	173.1	169.5	0	0	0	0	111	L7 L11 F223 V291 V292 H293 V297 K298 T299	L7-V295 HydrophobicContact CD1-CG1 4.17Å; L7-V295 HydrophobicContact CD1-CG2 4.24Å; L11-V295 HydrophobicContact CD2-CG1 4.42Å; F223-V295 HydrophobicContact CE2-CG2 4.18Å; V291-V295 HydrophobicContact CG1-CG2 4.26Å; V291-V295 WeakPolarHBondContact O-CB 3.46Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 2.87Å; V292-V295 PolarHBondContact O-N 3.24Å; H293-V295 VanDerWaalsContact C-N 3.35Å; H293-V295 PolarHBondContact O-N 2.91Å; V295-V297 PolarHBondContact O-N 2.92Å; V295-K298 WeakPolarHBondContact O-CB 3.33Å; V295-K298 PolarHBondContact O-N 2.84Å; V295-K298 VanDerWaalsContact O-N 3.13Å; V295-T299 PolarHBondContact O-N 3.35Å; V295-T299 PolarHBondContact O-OG1 2.83Å; V295-T299 VanDerWaalsContact O-OG1 3.06Å
296	L	73.9	Confident	74.6	Confident	23 Å²	23	36.7 Å²	36.7	12%	0.12	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-43.7	-179.9	-71.7	174.6	0	0	0	111.6	V292 H293 K298 T299 E300 M301 D303	V292-L296 HydrophobicContact CG1-CD1 3.55Å; V292-L296 HydrophobicContact CG1-CG 4.09Å; V292-L296 WeakPolarHBondContact O-CB 3.33Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.2Å; V292-L296 PolarHBondContact O-N 3.03Å; H293-L296 PolarHBondContact O-N 2.84Å; L296-K298 VanDerWaalsContact C-N 3.29Å; L296-K298 PolarHBondContact O-N 3.36Å; L296-T299 WeakPolarHBondContact CA-OG1 3.45Å; L296-T299 CarbonylContact O-C 3.49Å; L296-T299 PolarHBondContact O-N 3.49Å; L296-T299 PolarHBondContact O-OG1 2.97Å; L296-E300 PolarHBondContact O-N 2.9Å; L296-M301 HydrophobicContact CD2-CB 3.8Å; L296-M301 PolarHBondContact O-N 3.38Å; L296-M301 VanDerWaalsContact O-N 3.1Å; L296-D303 HydrophobicContact CB-CB 4.05Å; L296-D303 HydrophobicContact CD1-CB 3.67Å
297	V	71.6	Confident	73.7	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-41.9	173.6	170.5	0	0	0	0	110.9	I27 I219 H293 V295 E300	I27-V297 HydrophobicContact CD1-CG1 4.43Å; I27-V297 HydrophobicContact CD1-CG2 4.26Å; I27-V297 HydrophobicContact CG1-CG2 4.36Å; I219-V297 HydrophobicContact CD1-CG1 3.41Å; I219-V297 VanDerWaalsContact CD1-CG1 3.41Å; I219-V297 HydrophobicContact CG1-CG1 4.27Å; I219-V297 HydrophobicContact CG2-CG1 4.33Å; H293-V297 WeakPolarHBondContact O-CB 3.33Å; H293-V297 WeakPolarHBondContact O-CG2 3.38Å; H293-V297 PolarHBondContact O-N 3.45Å; V295-V297 PolarHBondContact O-N 2.92Å; V297-E300 PolarHBondContact O-N 3.44Å
298	K	72.1	Confident	73.1	Confident	104 Å²	104	42.7 Å²	42.7	45%	0.452	21%	0.208	S	C	.	.	H	α-helix	trans	-68	-34.3	177.3	179.5	179.8	177.3	-178.5	0	113.2	F223 Y294 V295 L296 E300	F223-K298 HydrophobicContact CD2-CB 4.42Å; F223-K298 HydrophobicContact CD2-CD 4.15Å; F223-K298 HydrophobicContact CE1-CD 4.23Å; F223-K298 HydrophobicContact CE2-CB 4.3Å; F223-K298 HydrophobicContact CE2-CD 3.64Å; F223-K298 HydrophobicContact CZ-CD 3.7Å; Y294-K298 WeakPolarHBondContact O-CB 3.46Å; Y294-K298 PolarHBondContact O-N 3.05Å; V295-K298 WeakPolarHBondContact O-CB 3.33Å; V295-K298 PolarHBondContact O-N 2.84Å; V295-K298 VanDerWaalsContact O-N 3.13Å; L296-K298 VanDerWaalsContact C-N 3.29Å; L296-K298 PolarHBondContact O-N 3.36Å; K298-E300 VanDerWaalsContact C-N 3.32Å
299	T	69.8	Low	72.8	Confident	59 Å²	59	42 Å²	42	36%	0.362	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	4.2	-179.3	53.7	0	0	0	0	113.5	V295 L296 M301	V295-T299 PolarHBondContact O-N 3.35Å; V295-T299 PolarHBondContact O-OG1 2.83Å; V295-T299 VanDerWaalsContact O-OG1 3.06Å; L296-T299 WeakPolarHBondContact CA-OG1 3.45Å; L296-T299 CarbonylContact O-C 3.49Å; L296-T299 PolarHBondContact O-N 3.49Å; L296-T299 PolarHBondContact O-OG1 2.97Å; T299-M301 PolarHBondContact O-N 3.06Å; T299-M301 VanDerWaalsContact O-N 3.12Å
300	E	67.4	Low	72.8	Confident	157 Å²	157	42.1 Å²	42.1	73%	0.734	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	28.1	-176.6	-59	177.8	-170.3	0	0	113.2	L215 L296 V297 K298	L215-E300 HydrophobicContact CD2-CG 3.72Å; L215-E300 WeakPolarHBondContact CD2-OE1 3.43Å; L296-E300 PolarHBondContact O-N 2.9Å; V297-E300 PolarHBondContact O-N 3.44Å; K298-E300 VanDerWaalsContact C-N 3.32Å
301	M	61.3	Low	72.9	Confident	106 Å²	106	43.6 Å²	43.6	52%	0.522	21%	0.214	S	C	.	.			trans	-90.6	148.1	179.5	-70.4	-169.6	68.4	0	0	110.6	L296 T299 D303	L296-M301 HydrophobicContact CD2-CB 3.8Å; L296-M301 PolarHBondContact O-N 3.38Å; L296-M301 VanDerWaalsContact O-N 3.1Å; T299-M301 PolarHBondContact O-N 3.06Å; T299-M301 VanDerWaalsContact O-N 3.12Å; M301-D303 PolarHBondContact O-N 3.34Å
302	E	60.1	Low	73.2	Confident	98 Å²	98	43.4 Å²	43.4	46%	0.458	21%	0.213	S	C	.	.			trans	-60.7	112.2	177.4	-71.8	-172.7	168.1	0	0	111.1	R304	E302-R304 HydrophobicContact CB-CG 4.48Å; E302-R304 PolarHBondContact O-N 2.95Å; E302-R304 IonicContact OE2-CZ 3.33Å; E302-R304 IonicContact OE2-NE 3.08Å; E302-R304 PolarHBondContact OE2-NE 2.73Å; E302-R304 VanDerWaalsContact OE2-NE 3.08Å; E302-R304 IonicContact OE2-NH2 2.72Å; E302-R304 PolarHBondContact OE2-NH2 2.98Å
303	D	62.2	Low	73.5	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.027	21%	0.213	C	C	.	.			trans	-89.4	99.8	168.7	171.1	25	0	0	0	110.1	S25 H293 L296 M301 G305	S25-D303 PolarHBondContact N-O 3.04Å; H293-D303 IonicContact CE1-OD2 3.6Å; H293-D303 IonicContact CG-OD2 3.82Å; H293-D303 IonicContact ND1-OD2 2.75Å; H293-D303 PolarHBondContact ND1-OD2 2.96Å; L296-D303 HydrophobicContact CB-CB 4.05Å; L296-D303 HydrophobicContact CD1-CB 3.67Å; M301-D303 PolarHBondContact O-N 3.34Å; D303-G305 VanDerWaalsContact C-N 3.34Å; D303-G305 WeakPolarHBondContact OD1-CA 3.29Å; D303-G305 PolarHBondContact OD1-N 2.89Å
304	R	62.4	Low	74.2	Confident	133 Å²	133	43.2 Å²	43.2	50%	0.502	21%	0.212	S	C	.	.			trans	-88.6	-0.9	176.6	-63.5	179.7	-173.7	175.8	1.2	112.8	A21 E302	A21-R304 WeakPolarHBondContact O-CB 3.3Å; A21-R304 WeakPolarHBondContact O-CD 3.3Å; E302-R304 HydrophobicContact CB-CG 4.48Å; E302-R304 PolarHBondContact O-N 2.95Å; E302-R304 IonicContact OE2-CZ 3.33Å; E302-R304 IonicContact OE2-NE 3.08Å; E302-R304 PolarHBondContact OE2-NE 2.73Å; E302-R304 VanDerWaalsContact OE2-NE 3.08Å; E302-R304 IonicContact OE2-NH2 2.72Å; E302-R304 PolarHBondContact OE2-NH2 2.98Å
305	G	64.8	Low	74.9	Confident	7 Å²	7	45 Å²	45	7%	0.072	22%	0.222	C	C	.	.			trans	-98.9	6.3	-171.3	0	0	0	0	0	114.7	M289 D303 G307 F308 Y309	M289-G305 VanDerWaalsContact CE-O 3.31Å; M289-G305 WeakPolarHBondContact CE-O 3.43Å; D303-G305 VanDerWaalsContact C-N 3.34Å; D303-G305 WeakPolarHBondContact OD1-CA 3.29Å; D303-G305 PolarHBondContact OD1-N 2.89Å; G305-G307 PolarHBondContact O-N 3.4Å; G305-F308 CarbonylContact O-C 3.59Å; G305-F308 WeakPolarHBondContact O-CA 3.22Å; G305-F308 WeakPolarHBondContact O-CB 3.29Å; G305-F308 PolarHBondContact O-N 3.42Å; G305-Y309 PolarHBondContact O-N 3.34Å
306	Y	67.6	Low	75.6	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-41.7	-169.5	-176.2	-83.5	0	0	0	114	F26 D204 H293 F308 Y309 I310	F26-Y306 HydrophobicContact CB-CD2 3.91Å; F26-Y306 HydrophobicContact CB-CE1 4.32Å; F26-Y306 HydrophobicContact CB-CE2 3.59Å; F26-Y306 HydrophobicContact CB-CG 4.38Å; F26-Y306 HydrophobicContact CD1-CE1 4.39Å; F26-Y306 AromaticContact CD2-CD1 3Å; F26-Y306 HydrophobicContact CD2-CD1 3Å; F26-Y306 AromaticContact CD2-CD2 3.75Å; F26-Y306 HydrophobicContact CD2-CD2 3.75Å; F26-Y306 AromaticContact CD2-CE1 3.07Å; F26-Y306 HydrophobicContact CD2-CE1 3.07Å; F26-Y306 AromaticContact CD2-CE2 3.81Å; F26-Y306 HydrophobicContact CD2-CE2 3.81Å; F26-Y306 AromaticContact CD2-CG 3.33Å; F26-Y306 HydrophobicContact CD2-CG 3.33Å; F26-Y306 AromaticContact CD2-CZ 3.48Å; F26-Y306 VanDerWaalsContact CD2-CZ 3.48Å; F26-Y306 HydrophobicContact CE1-CE1 4.43Å; F26-Y306 AromaticContact CE2-CD1 3.06Å; F26-Y306 HydrophobicContact CE2-CD1 3.06Å; F26-Y306 AromaticContact CE2-CE1 3.06Å; F26-Y306 HydrophobicContact CE2-CE1 3.06Å; F26-Y306 AromaticContact CE2-CG 3.88Å; F26-Y306 HydrophobicContact CE2-CG 3.88Å; F26-Y306 AromaticContact CE2-CZ 3.89Å; F26-Y306 HydrophobicContact CG-CD1 4.01Å; F26-Y306 HydrophobicContact CG-CD2 4.2Å; F26-Y306 AromaticContact CG-CE1 3.7Å; F26-Y306 HydrophobicContact CG-CE1 3.7Å; F26-Y306 AromaticContact CG-CE2 3.91Å; F26-Y306 HydrophobicContact CG-CE2 3.91Å; F26-Y306 HydrophobicContact CG-CG 4.23Å; F26-Y306 AromaticContact CG-CZ 3.62Å; F26-Y306 HydrophobicContact CZ-CD1 4.14Å; F26-Y306 AromaticContact CZ-CE1 3.73Å; F26-Y306 HydrophobicContact CZ-CE1 3.73Å; D204-Y306 PolarHBondContact O-OH 3.3Å; H293-Y306 AromaticContact CE1-CD2 3.99Å; Y306-F308 PolarHBondContact O-N 2.83Å; Y306-Y309 AromaticContact CD2-CD1 3.82Å; Y306-Y309 HydrophobicContact CD2-CD1 3.82Å; Y306-Y309 HydrophobicContact CD2-CE1 4.46Å; Y306-Y309 AromaticContact CE2-CD1 3.71Å; Y306-Y309 HydrophobicContact CE2-CD1 3.71Å; Y306-Y309 AromaticContact CE2-CE1 3.98Å; Y306-Y309 HydrophobicContact CE2-CE1 3.98Å; Y306-Y309 WeakPolarHBondContact O-CA 3.49Å; Y306-Y309 VanDerWaalsContact O-CB 3.3Å; Y306-Y309 WeakPolarHBondContact O-CB 3.31Å; Y306-Y309 PolarHBondContact O-N 3.38Å; Y306-I310 HydrophobicContact CD1-CD1 4.41Å; Y306-I310 HydrophobicContact CD1-CG1 4.32Å; Y306-I310 HydrophobicContact CD1-CG2 3.97Å; Y306-I310 HydrophobicContact CE1-CB 4.26Å; Y306-I310 HydrophobicContact CE1-CD1 4.04Å; Y306-I310 HydrophobicContact CE1-CG1 4.13Å; Y306-I310 HydrophobicContact CE1-CG2 3.2Å; Y306-I310 HydrophobicContact CE2-CG2 4.15Å; Y306-I310 WeakPolarHBondContact O-CG1 3.4Å; Y306-I310 PolarHBondContact O-N 2.56Å; Y306-I310 WeakPolarHBondContact OH-CG2 3.5Å
307	G	70.2	Confident	76.6	Confident	30 Å²	30	43.7 Å²	43.7	31%	0.309	22%	0.215	S	C	.	.	H	α-helix	trans	-56.6	-35.8	175.6	0	0	0	0	0	112.3	G305 I310 T311	G305-G307 PolarHBondContact O-N 3.4Å; G307-I310 VanDerWaalsContact O-CG1 3.31Å; G307-I310 WeakPolarHBondContact O-CG1 3.12Å; G307-T311 VanDerWaalsContact O-CB 3.32Å; G307-T311 WeakPolarHBondContact O-CB 3.33Å; G307-T311 PolarHBondContact O-N 2.93Å; G307-T311 PolarHBondContact O-OG1 2.9Å
308	F	79.1	Confident	77.7	Confident	95 Å²	95	45.3 Å²	45.3	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-73	-37.5	173.3	-175.8	-98.5	0	0	0	112	P285 M289 G305 Y306 T311 S312	P285-F308 HydrophobicContact CB-CZ 4.45Å; M289-F308 HydrophobicContact CE-CD1 3.98Å; M289-F308 HydrophobicContact CG-CD1 3.49Å; M289-F308 VanDerWaalsContact CG-CD1 3.49Å; M289-F308 HydrophobicContact CG-CE1 3.58Å; M289-F308 HydrophobicContact SD-CD1 3.49Å; M289-F308 WeakPolarHBondContact SD-CD1 3.35Å; M289-F308 HydrophobicContact SD-CE1 3.8Å; G305-F308 CarbonylContact O-C 3.59Å; G305-F308 WeakPolarHBondContact O-CA 3.22Å; G305-F308 WeakPolarHBondContact O-CB 3.29Å; G305-F308 PolarHBondContact O-N 3.42Å; Y306-F308 PolarHBondContact O-N 2.83Å; F308-T311 PolarHBondContact O-N 3.27Å; F308-S312 VanDerWaalsContact O-CB 3.3Å; F308-S312 WeakPolarHBondContact O-CB 3.25Å; F308-S312 PolarHBondContact O-N 3.37Å; F308-S312 PolarHBondContact O-OG 3.46Å
309	Y	81.2	Confident	78.8	Confident	8 Å²	8	40.4 Å²	40.4	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-58.3	-54.6	172.4	165.6	-110.1	0	0	0	112.4	M289 L290 G305 Y306 T311 S312 L313	M289-Y309 HydrophobicContact CB-CD2 3.82Å; M289-Y309 HydrophobicContact CB-CG 4.46Å; L290-Y309 HydrophobicContact CB-CE2 4.14Å; L290-Y309 HydrophobicContact CG-CE2 4.14Å; G305-Y309 PolarHBondContact O-N 3.34Å; Y306-Y309 AromaticContact CD2-CD1 3.82Å; Y306-Y309 HydrophobicContact CD2-CD1 3.82Å; Y306-Y309 HydrophobicContact CD2-CE1 4.46Å; Y306-Y309 AromaticContact CE2-CD1 3.71Å; Y306-Y309 HydrophobicContact CE2-CD1 3.71Å; Y306-Y309 AromaticContact CE2-CE1 3.98Å; Y306-Y309 HydrophobicContact CE2-CE1 3.98Å; Y306-Y309 WeakPolarHBondContact O-CA 3.49Å; Y306-Y309 VanDerWaalsContact O-CB 3.3Å; Y306-Y309 WeakPolarHBondContact O-CB 3.31Å; Y306-Y309 PolarHBondContact O-N 3.38Å; Y309-T311 VanDerWaalsContact C-N 3.27Å; Y309-T311 PolarHBondContact O-N 2.97Å; Y309-S312 WeakPolarHBondContact O-CB 3.48Å; Y309-S312 PolarHBondContact O-N 3.47Å; Y309-S312 VanDerWaalsContact O-N 3.08Å; Y309-S312 PolarHBondContact O-OG 2.83Å; Y309-L313 HydrophobicContact CD1-CD1 4.43Å; Y309-L313 HydrophobicContact CD2-CD1 4.38Å; Y309-L313 HydrophobicContact CD2-CG 4.35Å; Y309-L313 HydrophobicContact CE1-CD1 3.78Å; Y309-L313 HydrophobicContact CE2-CD1 3.73Å; Y309-L313 HydrophobicContact CE2-CD2 4.3Å; Y309-L313 HydrophobicContact CE2-CG 3.96Å; Y309-L313 VanDerWaalsContact CZ-CD1 3.41Å; Y309-L313 PolarHBondContact O-N 3.44Å
310	I	82.3	Confident	79.9	Confident	7 Å²	7	37.6 Å²	37.6	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-35.4	180	54.8	167.5	0	0	0	112.2	T44 L49 T50 F54 Y306 G307 S312 L313 C314	T44-I310 HydrophobicContact CG2-CD1 3.84Å; L49-I310 HydrophobicContact CD2-CD1 4.22Å; T50-I310 HydrophobicContact CG2-CD1 3.76Å; F54-I310 HydrophobicContact CE2-CB 4.01Å; F54-I310 HydrophobicContact CE2-CD1 4.13Å; F54-I310 HydrophobicContact CE2-CG1 4.32Å; F54-I310 HydrophobicContact CZ-CB 3.9Å; F54-I310 HydrophobicContact CZ-CD1 3.95Å; F54-I310 HydrophobicContact CZ-CG1 3.9Å; F54-I310 WeakPolarHBondContact CZ-O 3.36Å; Y306-I310 HydrophobicContact CD1-CD1 4.41Å; Y306-I310 HydrophobicContact CD1-CG1 4.32Å; Y306-I310 HydrophobicContact CD1-CG2 3.97Å; Y306-I310 HydrophobicContact CE1-CB 4.26Å; Y306-I310 HydrophobicContact CE1-CD1 4.04Å; Y306-I310 HydrophobicContact CE1-CG1 4.13Å; Y306-I310 HydrophobicContact CE1-CG2 3.2Å; Y306-I310 HydrophobicContact CE2-CG2 4.15Å; Y306-I310 WeakPolarHBondContact O-CG1 3.4Å; Y306-I310 PolarHBondContact O-N 2.56Å; Y306-I310 WeakPolarHBondContact OH-CG2 3.5Å; G307-I310 VanDerWaalsContact O-CG1 3.31Å; G307-I310 WeakPolarHBondContact O-CG1 3.12Å; I310-S312 VanDerWaalsContact C-N 3.34Å; I310-L313 PolarHBondContact O-N 2.67Å; I310-C314 PolarHBondContact O-N 3.47Å
311	T	86.4	Confident	81.2	Confident	32 Å²	32	30.8 Å²	30.8	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-65.2	-42	174.7	-58.7	0	0	0	0	110.3	G307 F308 Y309 L313 C314 L315	G307-T311 VanDerWaalsContact O-CB 3.32Å; G307-T311 WeakPolarHBondContact O-CB 3.33Å; G307-T311 PolarHBondContact O-N 2.93Å; G307-T311 PolarHBondContact O-OG1 2.9Å; F308-T311 PolarHBondContact O-N 3.27Å; Y309-T311 VanDerWaalsContact C-N 3.27Å; Y309-T311 PolarHBondContact O-N 2.97Å; T311-L313 VanDerWaalsContact C-N 3.34Å; T311-L313 PolarHBondContact O-N 2.97Å; T311-C314 WeakPolarHBondContact O-CB 3.36Å; T311-C314 PolarHBondContact O-N 3.09Å; T311-L315 HydrophobicContact CG2-CD1 4.3Å; T311-L315 HydrophobicContact CG2-CG 4.46Å; T311-L315 WeakPolarHBondContact O-CG 3.4Å; T311-L315 PolarHBondContact O-N 3.28Å
312	S	89.3	Confident	82.7	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-37.3	176.6	76.5	0	0	0	0	112.8	S286 F308 Y309 I310 L315 A316	S286-S312 WeakPolarHBondContact CA-OG 3.33Å; F308-S312 VanDerWaalsContact O-CB 3.3Å; F308-S312 WeakPolarHBondContact O-CB 3.25Å; F308-S312 PolarHBondContact O-N 3.37Å; F308-S312 PolarHBondContact O-OG 3.46Å; Y309-S312 WeakPolarHBondContact O-CB 3.48Å; Y309-S312 PolarHBondContact O-N 3.47Å; Y309-S312 VanDerWaalsContact O-N 3.08Å; Y309-S312 PolarHBondContact O-OG 2.83Å; I310-S312 VanDerWaalsContact C-N 3.34Å; S312-L315 PolarHBondContact O-N 3.32Å; S312-A316 WeakPolarHBondContact O-CB 3.36Å; S312-A316 PolarHBondContact O-N 2.9Å
313	L	88.9	Confident	84.3	Confident	11 Å²	11	22.8 Å²	22.8	6%	0.058	12%	0.117	C	C	.	.	H	α-helix	trans	-67.5	-38.1	173	-71.1	179.6	0	0	0	112.1	F131 Y132 Y309 I310 T311 A316	F131-L313 HydrophobicContact CE1-CD2 3.89Å; F131-L313 HydrophobicContact CZ-CB 4.25Å; F131-L313 HydrophobicContact CZ-CD2 4.04Å; F131-L313 WeakPolarHBondContact CZ-O 3.43Å; Y132-L313 HydrophobicContact CE1-CD2 4.38Å; Y309-L313 HydrophobicContact CD1-CD1 4.43Å; Y309-L313 HydrophobicContact CD2-CD1 4.38Å; Y309-L313 HydrophobicContact CD2-CG 4.35Å; Y309-L313 HydrophobicContact CE1-CD1 3.78Å; Y309-L313 HydrophobicContact CE2-CD1 3.73Å; Y309-L313 HydrophobicContact CE2-CD2 4.3Å; Y309-L313 HydrophobicContact CE2-CG 3.96Å; Y309-L313 VanDerWaalsContact CZ-CD1 3.41Å; Y309-L313 PolarHBondContact O-N 3.44Å; I310-L313 PolarHBondContact O-N 2.67Å; T311-L313 VanDerWaalsContact C-N 3.34Å; T311-L313 PolarHBondContact O-N 2.97Å; L313-A316 WeakPolarHBondContact O-CB 3.15Å; L313-A316 PolarHBondContact O-N 2.92Å
314	C	92.3	Very high	85.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-48.6	172.5	-177	0	0	0	0	110.5	F54 I310 T311 A316 S317	F54-C314 HydrophobicContact CD1-CB 3.75Å; F54-C314 VanDerWaalsContact CD1-SG 3.54Å; F54-C314 HydrophobicContact CE1-CB 3.66Å; F54-C314 HydrophobicContact CE2-CB 4.44Å; F54-C314 HydrophobicContact CG-CB 4.22Å; F54-C314 HydrophobicContact CZ-CB 4.03Å; I310-C314 PolarHBondContact O-N 3.47Å; T311-C314 WeakPolarHBondContact O-CB 3.36Å; T311-C314 PolarHBondContact O-N 3.09Å; C314-A316 VanDerWaalsContact C-N 3.26Å; C314-A316 PolarHBondContact O-N 3.09Å; C314-S317 WeakPolarHBondContact O-CB 3.49Å; C314-S317 PolarHBondContact O-N 3.33Å; C314-S317 VanDerWaalsContact O-N 3.13Å; C314-S317 PolarHBondContact O-OG 2.89Å
315	L	91.9	Very high	86.9	Confident	48 Å²	48	22.2 Å²	22.2	25%	0.251	12%	0.119	S	C	.	.	H	α-helix	trans	-64.7	-28.2	177.5	-65.5	177.7	0	0	0	113.1	I281 C282 T311 S312 S317 L318	I281-L315 HydrophobicContact CG2-CB 4.42Å; C282-L315 PolarHBondContact SG-O 3.45Å; T311-L315 HydrophobicContact CG2-CD1 4.3Å; T311-L315 HydrophobicContact CG2-CG 4.46Å; T311-L315 WeakPolarHBondContact O-CG 3.4Å; T311-L315 PolarHBondContact O-N 3.28Å; S312-L315 PolarHBondContact O-N 3.32Å; L315-S317 PolarHBondContact O-N 2.88Å; L315-L318 HydrophobicContact CD2-CD1 3.71Å; L315-L318 VanDerWaalsContact O-CB 3.31Å; L315-L318 WeakPolarHBondContact O-CB 3.38Å; L315-L318 PolarHBondContact O-N 3.22Å; L315-L318 VanDerWaalsContact O-N 3.08Å
316	A	93.5	Very high	88	Confident	2 Å²	2	22 Å²	22	2%	0.017	12%	0.117	C	C	.	.	H	α-helix	trans	-58.5	-34.2	174	0	0	0	0	0	112.5	F131 C282 S312 L313 C314 L318 N319	F131-A316 HydrophobicContact CZ-CB 4.11Å; C282-A316 VanDerWaalsContact O-CA 3.26Å; C282-A316 WeakPolarHBondContact O-CA 3.29Å; C282-A316 WeakPolarHBondContact O-CB 3.35Å; S312-A316 WeakPolarHBondContact O-CB 3.36Å; S312-A316 PolarHBondContact O-N 2.9Å; L313-A316 WeakPolarHBondContact O-CB 3.15Å; L313-A316 PolarHBondContact O-N 2.92Å; C314-A316 VanDerWaalsContact C-N 3.26Å; C314-A316 PolarHBondContact O-N 3.09Å; A316-L318 PolarHBondContact O-N 3.3Å; A316-N319 WeakPolarHBondContact O-CB 3.49Å; A316-N319 PolarHBondContact O-N 3.05Å; A316-N319 VanDerWaalsContact O-N 3.16Å; A316-N319 PolarHBondContact O-OD1 3.32Å
317	S	94.6	Very high	89	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.007	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.8	177.8	72.4	0	0	0	0	114.3	Y58 V61 C314 L315 N319	Y58-S317 WeakPolarHBondContact CE1-OG 3.42Å; V61-S317 WeakPolarHBondContact CG1-O 3.45Å; V61-S317 WeakPolarHBondContact CG2-O 3.47Å; C314-S317 WeakPolarHBondContact O-CB 3.49Å; C314-S317 PolarHBondContact O-N 3.33Å; C314-S317 VanDerWaalsContact O-N 3.13Å; C314-S317 PolarHBondContact O-OG 2.89Å; L315-S317 PolarHBondContact O-N 2.88Å; S317-N319 PolarHBondContact O-N 3.46Å
318	L	94.4	Very high	89.9	Confident	37 Å²	37	23.2 Å²	23.2	19%	0.194	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-12.3	174.6	-68	168.4	0	0	0	112.5	I57 V61 L315 A316 S320 C321 L322	I57-L318 HydrophobicContact CG2-CD2 4.09Å; I57-L318 HydrophobicContact CG2-CG 4.25Å; V61-L318 HydrophobicContact CG2-CD2 3.87Å; V61-L318 HydrophobicContact CG2-CG 4.46Å; L315-L318 HydrophobicContact CD2-CD1 3.71Å; L315-L318 VanDerWaalsContact O-CB 3.31Å; L315-L318 WeakPolarHBondContact O-CB 3.38Å; L315-L318 PolarHBondContact O-N 3.22Å; L315-L318 VanDerWaalsContact O-N 3.08Å; A316-L318 PolarHBondContact O-N 3.3Å; L318-S320 PolarHBondContact O-N 3.4Å; L318-C321 WeakPolarHBondContact O-CA 3.07Å; L318-C321 WeakPolarHBondContact O-CB 3.38Å; L318-C321 PolarHBondContact O-N 2.87Å; L318-L322 WeakPolarHBondContact O-CG 3.42Å; L318-L322 PolarHBondContact O-N 2.95Å; L318-L322 VanDerWaalsContact O-N 3.14Å
319	N	94.3	Very high	90.1	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-53.1	-43.3	176.6	70	-17.6	0	0	0	111.7	N134 T278 C282 F283 A316 S317 C321 L322 D323	N134-N319 PolarHBondContact ND2-ND2 3.31Å; N134-N319 PolarHBondContact ND2-OD1 2.89Å; T278-N319 HydrophobicContact CG2-CB 4.29Å; C282-N319 HydrophobicContact CB-CB 4.08Å; C282-N319 PolarHBondContact SG-N 3.28Å; F283-N319 HydrophobicContact CE1-CB 3.89Å; F283-N319 WeakPolarHBondContact CE1-ND2 3.3Å; F283-N319 HydrophobicContact CZ-CB 3.7Å; A316-N319 WeakPolarHBondContact O-CB 3.49Å; A316-N319 PolarHBondContact O-N 3.05Å; A316-N319 VanDerWaalsContact O-N 3.16Å; A316-N319 PolarHBondContact O-OD1 3.32Å; S317-N319 PolarHBondContact O-N 3.46Å; N319-C321 PolarHBondContact O-N 3.35Å; N319-C321 VanDerWaalsContact O-N 3.13Å; N319-L322 WeakPolarHBondContact O-CA 3.5Å; N319-L322 PolarHBondContact O-N 2.91Å; N319-D323 PolarHBondContact O-N 3.27Å
320	S	94.4	Very high	90.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66	-17.6	179.1	-58.8	0	0	0	0	113.4	N69 D97 N134 L318 P324	N69-S320 PolarHBondContact ND2-O 3.18Å; D97-S320 VanDerWaalsContact OD1-CA 3.29Å; D97-S320 WeakPolarHBondContact OD1-CA 3.35Å; D97-S320 VanDerWaalsContact OD1-CB 3.24Å; D97-S320 WeakPolarHBondContact OD1-CB 3.16Å; D97-S320 PolarHBondContact OD1-OG 3.01Å; N134-S320 PolarHBondContact ND2-OG 3.43Å; L318-S320 PolarHBondContact O-N 3.4Å; S320-P324 WeakPolarHBondContact O-CD 3.14Å
321	C	94.1	Very high	90.2	Very high	13 Å²	13	21.6 Å²	21.6	9%	0.088	11%	0.107	C	C	.	.	H	α-helix	trans	-88.1	-25.4	171.1	-62.1	0	0	0	0	112.7	V64 L318 N319	V64-C321 HydrophobicContact CG1-CB 4.05Å; L318-C321 WeakPolarHBondContact O-CA 3.07Å; L318-C321 WeakPolarHBondContact O-CB 3.38Å; L318-C321 PolarHBondContact O-N 2.87Å; N319-C321 PolarHBondContact O-N 3.35Å; N319-C321 VanDerWaalsContact O-N 3.13Å
322	L	92.6	Very high	89.9	Confident	37 Å²	37	25.1 Å²	25.1	19%	0.194	12%	0.121	C	C	.	.	H	α-helix	trans	-87.2	-29.4	-178.5	-64	179.2	0	0	0	112.3	T278 L318 N319 F325	T278-L322 HydrophobicContact CG2-CB 4.4Å; T278-L322 HydrophobicContact CG2-CD1 4.17Å; L318-L322 WeakPolarHBondContact O-CG 3.42Å; L318-L322 PolarHBondContact O-N 2.95Å; L318-L322 VanDerWaalsContact O-N 3.14Å; N319-L322 WeakPolarHBondContact O-CA 3.5Å; N319-L322 PolarHBondContact O-N 2.91Å; L322-F325 WeakPolarHBondContact O-CB 3.4Å; L322-F325 WeakPolarHBondContact O-CD2 3.21Å; L322-F325 PolarHBondContact O-N 3.47Å
323	D	92.8	Very high	89.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-35.7	179.3	-70.7	-20	0	0	0	114.2	L93 N319 F325 I326 Y327	L93-D323 HydrophobicContact CD2-CB 4.06Å; L93-D323 HydrophobicContact CG-CB 4.35Å; N319-D323 PolarHBondContact O-N 3.27Å; D323-F325 PolarHBondContact O-N 3.31Å; D323-F325 VanDerWaalsContact O-N 3.15Å; D323-I326 WeakPolarHBondContact O-CA 3.48Å; D323-I326 VanDerWaalsContact O-CB 3.24Å; D323-I326 WeakPolarHBondContact O-CB 3.32Å; D323-I326 PolarHBondContact O-N 2.91Å; D323-I326 WeakPolarHBondContact OD1-CD1 3.19Å; D323-Y327 HydrophobicContact CB-CE1 4.43Å; D323-Y327 HydrophobicContact CB-CE2 4.26Å; D323-Y327 WeakPolarHBondContact CB-OH 3.29Å; D323-Y327 WeakPolarHBondContact O-CD1 3.46Å; D323-Y327 PolarHBondContact O-N 3.3Å
324	P	91.1	Very high	89.2	Confident	15 Å²	15	27.5 Å²	27.5	10%	0.097	13%	0.132	C	C	.	.	H	α-helix	trans	-52.7	-32.3	168.3	-30.8	36.8	0	0	0	115.6	A68 S320 Y327 Y328	A68-P324 HydrophobicContact CB-CB 3.88Å; A68-P324 HydrophobicContact CB-CG 3.4Å; A68-P324 VanDerWaalsContact CB-CG 3.4Å; S320-P324 WeakPolarHBondContact O-CD 3.14Å; P324-Y327 VanDerWaalsContact CA-CD2 3.45Å; P324-Y327 HydrophobicContact CB-CD2 4.42Å; P324-Y327 HydrophobicContact CG-CE2 4.42Å; P324-Y327 PolarHBondContact O-N 2.9Å; P324-Y328 WeakPolarHBondContact O-CB 3.34Å; P324-Y328 PolarHBondContact O-N 2.93Å
325	F	89.9	Confident	88.9	Confident	110 Å²	110	29.6 Å²	29.6	48%	0.482	14%	0.14	S	C	.	.	H	α-helix	trans	-70.2	-39.4	174.6	-64.5	-89.7	0	0	0	110.9	V274 L322 D323 Y327 Y328 F329	V274-F325 HydrophobicContact CG1-CB 3.94Å; V274-F325 HydrophobicContact CG2-CB 4.23Å; L322-F325 WeakPolarHBondContact O-CB 3.4Å; L322-F325 WeakPolarHBondContact O-CD2 3.21Å; L322-F325 PolarHBondContact O-N 3.47Å; D323-F325 PolarHBondContact O-N 3.31Å; D323-F325 VanDerWaalsContact O-N 3.15Å; F325-Y327 VanDerWaalsContact C-N 3.31Å; F325-Y327 PolarHBondContact O-N 2.88Å; F325-Y328 PolarHBondContact O-N 3.48Å; F325-F329 HydrophobicContact CB-CE2 4.34Å; F325-F329 WeakPolarHBondContact O-CD2 3.2Å; F325-F329 PolarHBondContact O-N 2.78Å; F325-F329 VanDerWaalsContact O-N 3.11Å
326	I	87.7	Confident	88.6	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.015	15%	0.146	C	C	.	.	H	α-helix	trans	-56	-49.7	171.7	-58.8	179.8	0	0	0	108.9	I142 L145 L271 V274 V275 D323 Y328 F329 V330	I142-I326 HydrophobicContact CD1-CD1 4.01Å; I142-I326 HydrophobicContact CG1-CD1 4Å; L145-I326 HydrophobicContact CD1-CG2 4.35Å; L271-I326 HydrophobicContact CD1-CG2 3.93Å; V274-I326 HydrophobicContact CG1-CG1 3.65Å; V275-I326 HydrophobicContact CG2-CD1 4.14Å; D323-I326 WeakPolarHBondContact O-CA 3.48Å; D323-I326 VanDerWaalsContact O-CB 3.24Å; D323-I326 WeakPolarHBondContact O-CB 3.32Å; D323-I326 PolarHBondContact O-N 2.91Å; D323-I326 WeakPolarHBondContact OD1-CD1 3.19Å; I326-Y328 VanDerWaalsContact C-N 3.32Å; I326-Y328 PolarHBondContact O-N 3.38Å; I326-F329 PolarHBondContact O-N 3.03Å; I326-V330 HydrophobicContact CG2-CG2 4.03Å; I326-V330 WeakPolarHBondContact O-CB 3.45Å; I326-V330 WeakPolarHBondContact O-CG2 3.43Å; I326-V330 PolarHBondContact O-N 3.47Å
327	Y	88.4	Confident	88	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-41.1	178.6	-50	-29.9	0	0	0	112.8	N69 A72 F76 M90 L93 A94 D97 D323 P324 F325 F329 V330 S331 F334	N69-Y327 VanDerWaalsContact OD1-CE2 3.28Å; N69-Y327 WeakPolarHBondContact OD1-CE2 3.3Å; N69-Y327 PolarHBondContact OD1-OH 3.34Å; A72-Y327 HydrophobicContact CB-CD2 3.63Å; A72-Y327 HydrophobicContact CB-CE2 3.85Å; F76-Y327 HydrophobicContact CE2-CD1 4.23Å; F76-Y327 HydrophobicContact CE2-CD2 4.47Å; F76-Y327 HydrophobicContact CE2-CG 4.13Å; F76-Y327 HydrophobicContact CZ-CD1 4.38Å; F76-Y327 HydrophobicContact CZ-CG 4.22Å; M90-Y327 HydrophobicContact CB-CD1 3.83Å; M90-Y327 HydrophobicContact CB-CE1 3.96Å; M90-Y327 HydrophobicContact CG-CD1 3.7Å; M90-Y327 HydrophobicContact CG-CE1 4.11Å; M90-Y327 HydrophobicContact SD-CD1 3.87Å; L93-Y327 HydrophobicContact CB-CE1 4.23Å; L93-Y327 HydrophobicContact CD2-CE1 3.8Å; L93-Y327 HydrophobicContact CG-CE1 4.21Å; L93-Y327 VanDerWaalsContact CG-OH 3.26Å; L93-Y327 WeakPolarHBondContact CG-OH 3.17Å; A94-Y327 WeakPolarHBondContact CA-OH 3.44Å; A94-Y327 HydrophobicContact CB-CE2 4.15Å; A94-Y327 PolarHBondContact N-OH 3.48Å; A94-Y327 VanDerWaalsContact N-OH 3.08Å; D97-Y327 PolarHBondContact OD2-OH 3.39Å; D323-Y327 HydrophobicContact CB-CE1 4.43Å; D323-Y327 HydrophobicContact CB-CE2 4.26Å; D323-Y327 WeakPolarHBondContact CB-OH 3.29Å; D323-Y327 WeakPolarHBondContact O-CD1 3.46Å; D323-Y327 PolarHBondContact O-N 3.3Å; P324-Y327 VanDerWaalsContact CA-CD2 3.45Å; P324-Y327 HydrophobicContact CB-CD2 4.42Å; P324-Y327 HydrophobicContact CG-CE2 4.42Å; P324-Y327 PolarHBondContact O-N 2.9Å; F325-Y327 VanDerWaalsContact C-N 3.31Å; F325-Y327 PolarHBondContact O-N 2.88Å; Y327-F329 PolarHBondContact O-N 3.3Å; Y327-V330 PolarHBondContact O-N 3.08Å; Y327-S331 WeakPolarHBondContact O-CA 3.29Å; Y327-S331 WeakPolarHBondContact O-CB 3.37Å; Y327-S331 PolarHBondContact O-N 2.89Å; Y327-F334 HydrophobicContact CD2-CE1 4.48Å; Y327-F334 HydrophobicContact CD2-CZ 4.31Å
328	Y	88.1	Confident	87.5	Confident	66 Å²	66	33.4 Å²	33.4	26%	0.259	16%	0.157	S	C	.	.	H	α-helix	trans	-64.5	-38	-179.6	-176.1	-90.8	0	0	0	113.4	P324 F325 I326 R335 V338 K339	P324-Y328 WeakPolarHBondContact O-CB 3.34Å; P324-Y328 PolarHBondContact O-N 2.93Å; F325-Y328 PolarHBondContact O-N 3.48Å; I326-Y328 VanDerWaalsContact C-N 3.32Å; I326-Y328 PolarHBondContact O-N 3.38Å; Y328-R335 HydrophobicContact CD2-CB 3.94Å; Y328-R335 HydrophobicContact CD2-CG 3.99Å; Y328-R335 HydrophobicContact CE1-CG 4.22Å; Y328-R335 HydrophobicContact CE2-CB 3.93Å; Y328-R335 HydrophobicContact CE2-CG 3.46Å; Y328-R335 VanDerWaalsContact CE2-CG 3.46Å; Y328-R335 HydrophobicContact CG-CB 4.44Å; Y328-V338 HydrophobicContact CD2-CB 4.32Å; Y328-V338 HydrophobicContact CD2-CG1 4.24Å; Y328-V338 HydrophobicContact CD2-CG2 4.48Å; Y328-V338 HydrophobicContact CE2-CB 4.41Å; Y328-V338 HydrophobicContact CE2-CG1 4.19Å; Y328-K339 WeakPolarHBondContact OH-CE 3.32Å
329	F	83.9	Confident	87	Confident	55 Å²	55	36.5 Å²	36.5	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-83.2	-27.5	178.6	-65.8	-62.9	0	0	0	112.9	V270 V274 F325 I326 Y327	V270-F329 HydrophobicContact CB-CD1 4.4Å; V270-F329 HydrophobicContact CB-CE1 4.41Å; V270-F329 HydrophobicContact CG1-CD1 3.77Å; V270-F329 HydrophobicContact CG1-CD2 3.79Å; V270-F329 HydrophobicContact CG1-CE1 3.49Å; V270-F329 VanDerWaalsContact CG1-CE1 3.49Å; V270-F329 HydrophobicContact CG1-CE2 3.52Å; V270-F329 HydrophobicContact CG1-CG 3.94Å; V270-F329 HydrophobicContact CG1-CZ 3.37Å; V274-F329 HydrophobicContact CG2-CD2 4.01Å; V274-F329 HydrophobicContact CG2-CE2 3.9Å; F325-F329 HydrophobicContact CB-CE2 4.34Å; F325-F329 WeakPolarHBondContact O-CD2 3.2Å; F325-F329 PolarHBondContact O-N 2.78Å; F325-F329 VanDerWaalsContact O-N 3.11Å; I326-F329 PolarHBondContact O-N 3.03Å; Y327-F329 PolarHBondContact O-N 3.3Å
330	V	81.9	Confident	86.4	Confident	13 Å²	13	38 Å²	38	8%	0.079	18%	0.177	C	C	.	.	H	α-helix	trans	-86.8	-45.4	-177	171.9	0	0	0	0	111	M90 R149 L271 I326 Y327	M90-V330 HydrophobicContact CE-CB 4.48Å; M90-V330 HydrophobicContact CE-CG1 3.59Å; M90-V330 HydrophobicContact CG-CG1 4.22Å; M90-V330 HydrophobicContact SD-CB 3.76Å; M90-V330 HydrophobicContact SD-CG1 3.27Å; M90-V330 WeakPolarHBondContact SD-CG1 3.08Å; R149-V330 PolarHBondContact NH2-O 2.88Å; L271-V330 HydrophobicContact CD1-CG2 3.69Å; L271-V330 HydrophobicContact CD2-CG2 3.87Å; L271-V330 HydrophobicContact CG-CG2 4.41Å; I326-V330 HydrophobicContact CG2-CG2 4.03Å; I326-V330 WeakPolarHBondContact O-CB 3.45Å; I326-V330 WeakPolarHBondContact O-CG2 3.43Å; I326-V330 PolarHBondContact O-N 3.47Å; Y327-V330 PolarHBondContact O-N 3.08Å
331	S	82.7	Confident	85.7	Confident	7 Å²	7	42.3 Å²	42.3	5%	0.049	20%	0.204	C	C	.	.			trans	-103.7	120.2	-176.1	179.5	0	0	0	0	112.5	Y327 E333 F334 R335	Y327-S331 WeakPolarHBondContact O-CA 3.29Å; Y327-S331 WeakPolarHBondContact O-CB 3.37Å; Y327-S331 PolarHBondContact O-N 2.89Å; S331-E333 VanDerWaalsContact C-N 3.34Å; S331-E333 PolarHBondContact OG-N 3.47Å; S331-F334 PolarHBondContact OG-N 2.98Å; S331-F334 VanDerWaalsContact OG-N 3.11Å; S331-R335 WeakPolarHBondContact O-CB 3.42Å; S331-R335 PolarHBondContact O-N 2.85Å; S331-R335 VanDerWaalsContact O-N 3.15Å
332	E	81.1	Confident	84.8	Confident	107 Å²	107	48.2 Å²	48.2	50%	0.5	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-35.5	173.5	-52.3	-150.7	129.6	0	0	111.9	K267 R335 E336	K267-E332 IonicContact NZ-OE1 3.99Å; K267-E332 PolarHBondContact NZ-OE1 3.22Å; E332-R335 PolarHBondContact O-N 2.94Å; E332-R335 IonicContact OE1-CZ 2.91Å; E332-R335 IonicContact OE1-NH2 3.89Å; E332-R335 PolarHBondContact OE1-NH2 3.02Å; E332-E336 WeakPolarHBondContact O-CG 3.45Å; E332-E336 PolarHBondContact O-N 3.47Å
333	E	81.5	Confident	83.9	Confident	58 Å²	58	51.7 Å²	51.7	27%	0.271	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-44.8	178.3	-62.6	173.7	157.9	0	0	111.1	V75 T80 S331 E336 H337	V75-E333 HydrophobicContact CG1-CB 4.39Å; T80-E333 WeakPolarHBondContact CA-OE2 3.45Å; T80-E333 WeakPolarHBondContact CB-OE2 3.28Å; T80-E333 WeakPolarHBondContact CG2-OE2 3.34Å; T80-E333 PolarHBondContact OG1-OE2 3.39Å; S331-E333 VanDerWaalsContact C-N 3.34Å; S331-E333 PolarHBondContact OG-N 3.47Å; E333-E336 PolarHBondContact O-N 2.95Å; E333-H337 PolarHBondContact O-N 2.94Å; E333-H337 VanDerWaalsContact O-N 3.09Å; E333-H337 PolarHBondContact O-ND1 2.99Å
334	F	81.4	Confident	82.6	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-45	176	-177.7	-102.7	0	0	0	110.8	M71 A72 V75 F76 Y327 S331 E336 H337 V338	M71-F334 HydrophobicContact CE-CE2 4.03Å; M71-F334 HydrophobicContact CE-CZ 4.01Å; M71-F334 HydrophobicContact CG-CE2 4.33Å; A72-F334 VanDerWaalsContact CA-CE2 3.49Å; A72-F334 HydrophobicContact CB-CD2 4.15Å; A72-F334 HydrophobicContact CB-CE2 3.61Å; A72-F334 HydrophobicContact CB-CZ 4.26Å; V75-F334 HydrophobicContact CB-CD2 4.35Å; V75-F334 HydrophobicContact CG1-CB 4.38Å; V75-F334 HydrophobicContact CG2-CD2 4.3Å; F76-F334 HydrophobicContact CE1-CB 4.32Å; F76-F334 HydrophobicContact CZ-CB 4.32Å; Y327-F334 HydrophobicContact CD2-CE1 4.48Å; Y327-F334 HydrophobicContact CD2-CZ 4.31Å; S331-F334 PolarHBondContact OG-N 2.98Å; S331-F334 VanDerWaalsContact OG-N 3.11Å; F334-E336 VanDerWaalsContact C-N 3.33Å; F334-E336 PolarHBondContact O-N 3.42Å; F334-H337 PolarHBondContact O-N 2.71Å; F334-V338 HydrophobicContact CD1-CG2 3.87Å; F334-V338 HydrophobicContact CD2-CG2 4.46Å; F334-V338 HydrophobicContact CE1-CG2 3.55Å; F334-V338 HydrophobicContact CE2-CG2 4.15Å; F334-V338 HydrophobicContact CG-CG2 4.33Å; F334-V338 HydrophobicContact CZ-CG2 3.7Å; F334-V338 VanDerWaalsContact O-CG2 3.27Å; F334-V338 WeakPolarHBondContact O-CG2 3.36Å; F334-V338 PolarHBondContact O-N 2.97Å
335	R	87.6	Confident	81.1	Confident	44 Å²	44	62.8 Å²	62.8	17%	0.166	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-42.6	175.2	173.5	168.6	77.8	-134.8	-3.8	113.1	Y328 S331 E332 K339	Y328-R335 HydrophobicContact CD2-CB 3.94Å; Y328-R335 HydrophobicContact CD2-CG 3.99Å; Y328-R335 HydrophobicContact CE1-CG 4.22Å; Y328-R335 HydrophobicContact CE2-CB 3.93Å; Y328-R335 HydrophobicContact CE2-CG 3.46Å; Y328-R335 VanDerWaalsContact CE2-CG 3.46Å; Y328-R335 HydrophobicContact CG-CB 4.44Å; S331-R335 WeakPolarHBondContact O-CB 3.42Å; S331-R335 PolarHBondContact O-N 2.85Å; S331-R335 VanDerWaalsContact O-N 3.15Å; E332-R335 PolarHBondContact O-N 2.94Å; E332-R335 IonicContact OE1-CZ 2.91Å; E332-R335 IonicContact OE1-NH2 3.89Å; E332-R335 PolarHBondContact OE1-NH2 3.02Å; R335-K339 HydrophobicContact CG-CD 4.38Å; R335-K339 WeakPolarHBondContact O-CB 3.45Å; R335-K339 VanDerWaalsContact O-CG 3.31Å; R335-K339 WeakPolarHBondContact O-CG 3.43Å; R335-K339 PolarHBondContact O-N 2.73Å
336	E	83.7	Confident	79.6	Confident	84 Å²	84	60.8 Å²	60.8	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-44.2	176.6	-76.4	-169	165.2	0	0	111.7	E332 E333 F334 K339 N340 K354	E332-E336 WeakPolarHBondContact O-CG 3.45Å; E332-E336 PolarHBondContact O-N 3.47Å; E333-E336 PolarHBondContact O-N 2.95Å; F334-E336 VanDerWaalsContact C-N 3.33Å; F334-E336 PolarHBondContact O-N 3.42Å; E336-K339 PolarHBondContact O-N 2.93Å; E336-N340 WeakPolarHBondContact O-CB 3.49Å; E336-N340 PolarHBondContact O-N 3.33Å; E336-N340 PolarHBondContact O-ND2 3.26Å; E336-N340 PolarHBondContact O-OD1 3.12Å; E336-K354 IonicContact OE1-NZ 3.19Å; E336-K354 PolarHBondContact OE1-NZ 3.21Å; E336-K354 IonicContact OE2-NZ 2.9Å; E336-K354 PolarHBondContact OE2-NZ 3.06Å
337	H	82.7	Confident	78.2	Confident	26 Å²	26	63.2 Å²	63.2	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-65.8	-43.3	178.7	-71.6	82.1	0	0	0	111.8	W74 V75 R79 E333 F334 K339 N340 T341	W74-H337 AromaticContact CZ3-CD2 3.78Å; V75-H337 HydrophobicContact CG2-CB 3.82Å; R79-H337 PolarHBondContact NE-NE2 3.37Å; E333-H337 PolarHBondContact O-N 2.94Å; E333-H337 VanDerWaalsContact O-N 3.09Å; E333-H337 PolarHBondContact O-ND1 2.99Å; F334-H337 PolarHBondContact O-N 2.71Å; H337-K339 VanDerWaalsContact C-N 3.33Å; H337-K339 PolarHBondContact O-N 3.18Å; H337-N340 PolarHBondContact O-N 3.26Å; H337-T341 PolarHBondContact O-N 3.14Å; H337-T341 PolarHBondContact O-OG1 3.43Å
338	V	83.6	Confident	76.7	Confident	22 Å²	22	73 Å²	73	13%	0.133	36%	0.363	C	S	.	.	H	α-helix	trans	-56	-47.6	173.8	171.4	0	0	0	0	110.9	M71 Y328 F334 N340 T341 L342	M71-V338 HydrophobicContact CE-CG2 3.58Å; M71-V338 HydrophobicContact SD-CG2 4.44Å; Y328-V338 HydrophobicContact CD2-CB 4.32Å; Y328-V338 HydrophobicContact CD2-CG1 4.24Å; Y328-V338 HydrophobicContact CD2-CG2 4.48Å; Y328-V338 HydrophobicContact CE2-CB 4.41Å; Y328-V338 HydrophobicContact CE2-CG1 4.19Å; F334-V338 HydrophobicContact CD1-CG2 3.87Å; F334-V338 HydrophobicContact CD2-CG2 4.46Å; F334-V338 HydrophobicContact CE1-CG2 3.55Å; F334-V338 HydrophobicContact CE2-CG2 4.15Å; F334-V338 HydrophobicContact CG-CG2 4.33Å; F334-V338 HydrophobicContact CZ-CG2 3.7Å; F334-V338 VanDerWaalsContact O-CG2 3.27Å; F334-V338 WeakPolarHBondContact O-CG2 3.36Å; F334-V338 PolarHBondContact O-N 2.97Å; V338-N340 PolarHBondContact O-N 2.63Å; V338-T341 PolarHBondContact O-N 3.11Å; V338-L342 HydrophobicContact CG1-CD1 3.73Å; V338-L342 HydrophobicContact CG1-CG 4.32Å; V338-L342 WeakPolarHBondContact O-CB 3.3Å; V338-L342 VanDerWaalsContact O-CG 3.29Å; V338-L342 WeakPolarHBondContact O-CG 3.21Å; V338-L342 PolarHBondContact O-N 2.96Å
339	K	84.2	Confident	75.3	Confident	101 Å²	101	72 Å²	72	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-43	177.5	-75.9	179.7	177.1	-166.6	0	112.2	Y328 R335 E336 H337 L342 L343	Y328-K339 WeakPolarHBondContact OH-CE 3.32Å; R335-K339 HydrophobicContact CG-CD 4.38Å; R335-K339 WeakPolarHBondContact O-CB 3.45Å; R335-K339 VanDerWaalsContact O-CG 3.31Å; R335-K339 WeakPolarHBondContact O-CG 3.43Å; R335-K339 PolarHBondContact O-N 2.73Å; E336-K339 PolarHBondContact O-N 2.93Å; H337-K339 VanDerWaalsContact C-N 3.33Å; H337-K339 PolarHBondContact O-N 3.18Å; K339-L342 PolarHBondContact O-N 2.83Å; K339-L343 VanDerWaalsContact O-CB 3.24Å; K339-L343 WeakPolarHBondContact O-CB 3.44Å; K339-L343 WeakPolarHBondContact O-CD1 3.38Å; K339-L343 WeakPolarHBondContact O-CG 3.45Å; K339-L343 PolarHBondContact O-N 2.86Å
340	N	81.4	Confident	74.2	Confident	34 Å²	34	70.3 Å²	70.3	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-66.6	-41	-179.6	-65.8	-19.5	0	0	0	111.7	E336 H337 V338 C344 R345	E336-N340 WeakPolarHBondContact O-CB 3.49Å; E336-N340 PolarHBondContact O-N 3.33Å; E336-N340 PolarHBondContact O-ND2 3.26Å; E336-N340 PolarHBondContact O-OD1 3.12Å; H337-N340 PolarHBondContact O-N 3.26Å; V338-N340 PolarHBondContact O-N 2.63Å; N340-C344 PolarHBondContact O-N 3.45Å; N340-R345 PolarHBondContact O-N 3.09Å
341	T	78.4	Confident	73.3	Confident	90 Å²	90	75 Å²	75	55%	0.552	38%	0.384	S	S	*	.	H	α-helix	trans	-64.3	-47	175.5	-55.8	0	0	0	0	111.5	H337 V338 L343 C344	H337-T341 PolarHBondContact O-N 3.14Å; H337-T341 PolarHBondContact O-OG1 3.43Å; V338-T341 PolarHBondContact O-N 3.11Å; T341-L343 VanDerWaalsContact C-N 3.34Å; T341-L343 PolarHBondContact O-N 3.5Å; T341-C344 PolarHBondContact O-N 3.46Å; T341-C344 VanDerWaalsContact O-N 3.15Å
342	L	76.6	Confident	72.3	Confident	136 Å²	136	81.3 Å²	81.3	71%	0.712	41%	0.413	S	S	*	.	H	α-helix	trans	-67.9	-31	179.8	-70.4	175.2	0	0	0	113.4	V338 K339 C344	V338-L342 HydrophobicContact CG1-CD1 3.73Å; V338-L342 HydrophobicContact CG1-CG 4.32Å; V338-L342 WeakPolarHBondContact O-CB 3.3Å; V338-L342 VanDerWaalsContact O-CG 3.29Å; V338-L342 WeakPolarHBondContact O-CG 3.21Å; V338-L342 PolarHBondContact O-N 2.96Å; K339-L342 PolarHBondContact O-N 2.83Å; L342-C344 PolarHBondContact O-N 3.28Å
343	L	73.9	Confident	71.6	Confident	111 Å²	111	81.4 Å²	81.4	58%	0.581	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	8.1	175.7	-64.7	170.4	0	0	0	112.7	K339 T341 R345	K339-L343 VanDerWaalsContact O-CB 3.24Å; K339-L343 WeakPolarHBondContact O-CB 3.44Å; K339-L343 WeakPolarHBondContact O-CD1 3.38Å; K339-L343 WeakPolarHBondContact O-CG 3.45Å; K339-L343 PolarHBondContact O-N 2.86Å; T341-L343 VanDerWaalsContact C-N 3.34Å; T341-L343 PolarHBondContact O-N 3.5Å; L343-R345 HydrophobicContact CB-CG 4.08Å; L343-R345 PolarHBondContact O-N 3.34Å
344	C	64.1	Low	70.9	Confident	121 Å²	121	83.4 Å²	83.4	82%	0.818	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	28.1	-174.5	-60.7	0	0	0	0	113.7	N340 T341 L342 S346	N340-C344 PolarHBondContact O-N 3.45Å; T341-C344 PolarHBondContact O-N 3.46Å; T341-C344 VanDerWaalsContact O-N 3.15Å; L342-C344 PolarHBondContact O-N 3.28Å; C344-S346 PolarHBondContact O-N 2.96Å
345	R	59.6	Low	70.1	Confident	126 Å²	126	86.1 Å²	86.1	48%	0.475	44%	0.444	S	S	.	.			trans	-83.6	118.1	-179.8	-73.7	-171.3	176.9	-160.3	0.5	108.9	N340 L343 S347 V350 E353	N340-R345 PolarHBondContact O-N 3.09Å; L343-R345 HydrophobicContact CB-CG 4.08Å; L343-R345 PolarHBondContact O-N 3.34Å; R345-S347 PolarHBondContact O-N 3.39Å; R345-V350 HydrophobicContact CB-CG2 3.93Å; R345-E353 IonicContact NH1-OE1 2.95Å; R345-E353 IonicContact NH1-OE2 2.73Å; R345-E353 PolarHBondContact NH1-OE2 3.45Å
346	S	59.5	Low	69	Low	68 Å²	68	86.4 Å²	86.4	48%	0.476	46%	0.455	S	S	.	.			trans	-52.4	132.2	171.5	168.6	0	0	0	0	110.6	C344 R348 A349 V350	C344-S346 PolarHBondContact O-N 2.96Å; S346-R348 PolarHBondContact O-N 3.09Å; S346-R348 VanDerWaalsContact O-N 3.1Å; S346-R348 PolarHBondContact OG-N 3.32Å; S346-A349 WeakPolarHBondContact O-CB 3.27Å; S346-A349 PolarHBondContact O-N 2.91Å; S346-V350 PolarHBondContact O-N 2.89Å
347	S	58.4	Low	68.1	Low	55 Å²	55	90.2 Å²	90.2	39%	0.385	47%	0.468	S	S	.	.	H	α-helix	trans	-51.2	-34.2	174.7	-171.9	0	0	0	0	111.9	R79 R345 E351	R79-S347 PolarHBondContact NH2-OG 3.28Å; R345-S347 PolarHBondContact O-N 3.39Å; S347-E351 WeakPolarHBondContact O-CB 3.35Å; S347-E351 PolarHBondContact O-N 2.98Å
348	R	56.4	Low	67.3	Low	204 Å²	204	92.6 Å²	92.6	77%	0.77	49%	0.487	S	S	*	.	H	α-helix	trans	-67.5	-39.6	175.7	-69.5	-176.7	178.8	-180	-0	113	S346 V350 E351 Q352	S346-R348 PolarHBondContact O-N 3.09Å; S346-R348 VanDerWaalsContact O-N 3.1Å; S346-R348 PolarHBondContact OG-N 3.32Å; R348-V350 VanDerWaalsContact C-N 3.35Å; R348-E351 PolarHBondContact O-N 2.96Å; R348-Q352 WeakPolarHBondContact O-CB 3.3Å; R348-Q352 WeakPolarHBondContact O-CG 3.46Å; R348-Q352 PolarHBondContact O-N 3.37Å
349	A	58.8	Low	66.1	Low	47 Å²	47	94.9 Å²	94.9	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-38.7	178.7	0	0	0	0	0	111.3	S346 E353	S346-A349 WeakPolarHBondContact O-CB 3.27Å; S346-A349 PolarHBondContact O-N 2.91Å; A349-E353 WeakPolarHBondContact O-CB 3.37Å; A349-E353 PolarHBondContact O-N 3.35Å
350	V	61.1	Low	64.9	Low	19 Å²	19	96.4 Å²	96.4	12%	0.115	51%	0.514	C	S	.	.	H	α-helix	trans	-70.4	-38.2	177.3	179.5	0	0	0	0	111.9	R345 S346 R348 E353 K354	R345-V350 HydrophobicContact CB-CG2 3.93Å; S346-V350 PolarHBondContact O-N 2.89Å; R348-V350 VanDerWaalsContact C-N 3.35Å; V350-E353 PolarHBondContact O-N 3.47Å; V350-K354 WeakPolarHBondContact O-CB 3.48Å; V350-K354 PolarHBondContact O-N 2.75Å
351	E	63.7	Low	63.8	Low	110 Å²	110	98.4 Å²	98.4	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-69.8	-37	177.2	-162	150.6	-153.9	0	0	111.5	S347 R348 A355	S347-E351 WeakPolarHBondContact O-CB 3.35Å; S347-E351 PolarHBondContact O-N 2.98Å; R348-E351 PolarHBondContact O-N 2.96Å; E351-A355 VanDerWaalsContact O-CB 3.32Å; E351-A355 WeakPolarHBondContact O-CB 3.36Å; E351-A355 PolarHBondContact O-N 3.05Å
352	Q	60.6	Low	62.7	Low	141 Å²	141	101.7 Å²	101.7	66%	0.659	53%	0.531	S	S	*	.	H	α-helix	trans	-64.5	-41.7	169.7	-77.9	177.7	-28.7	0	0	112.4	R348 A355 A356	R348-Q352 WeakPolarHBondContact O-CB 3.3Å; R348-Q352 WeakPolarHBondContact O-CG 3.46Å; R348-Q352 PolarHBondContact O-N 3.37Å; Q352-A355 PolarHBondContact O-N 3.48Å; Q352-A356 VanDerWaalsContact O-CB 3.29Å; Q352-A356 WeakPolarHBondContact O-CB 3.44Å; Q352-A356 PolarHBondContact O-N 3.5Å
353	E	65.7	Low	61.7	Low	109 Å²	109	98 Å²	98	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-42.9	176.8	-166.8	-178.5	178.2	0	0	111.5	R345 A349 V350 A355 A356 Y357	R345-E353 IonicContact NH1-OE1 2.95Å; R345-E353 IonicContact NH1-OE2 2.73Å; R345-E353 PolarHBondContact NH1-OE2 3.45Å; A349-E353 WeakPolarHBondContact O-CB 3.37Å; A349-E353 PolarHBondContact O-N 3.35Å; V350-E353 PolarHBondContact O-N 3.47Å; E353-A355 PolarHBondContact O-N 2.88Å; E353-A356 PolarHBondContact O-N 3.38Å; E353-Y357 WeakPolarHBondContact O-CB 3.36Å; E353-Y357 PolarHBondContact O-N 2.94Å
354	K	67.4	Low	60.7	Low	100 Å²	100	100.6 Å²	100.6	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-37.7	174.1	-81.6	-174.9	175.4	-175.6	0	112.2	E336 V350 S358	E336-K354 IonicContact OE1-NZ 3.19Å; E336-K354 PolarHBondContact OE1-NZ 3.21Å; E336-K354 IonicContact OE2-NZ 2.9Å; E336-K354 PolarHBondContact OE2-NZ 3.06Å; V350-K354 WeakPolarHBondContact O-CB 3.48Å; V350-K354 PolarHBondContact O-N 2.75Å; K354-S358 VanDerWaalsContact O-CB 3.3Å; K354-S358 WeakPolarHBondContact O-CB 3.47Å; K354-S358 PolarHBondContact O-N 3.16Å; K354-S358 PolarHBondContact O-OG 3.11Å
355	A	64.9	Low	60.2	Low	60 Å²	60	102.1 Å²	102.1	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-68.4	-41.4	174.8	0	0	0	0	0	112	E351 Q352 E353 S358 S359	E351-A355 VanDerWaalsContact O-CB 3.32Å; E351-A355 WeakPolarHBondContact O-CB 3.36Å; E351-A355 PolarHBondContact O-N 3.05Å; Q352-A355 PolarHBondContact O-N 3.48Å; E353-A355 PolarHBondContact O-N 2.88Å; A355-S358 PolarHBondContact O-N 3.44Å; A355-S359 WeakPolarHBondContact O-CB 3.33Å; A355-S359 PolarHBondContact O-N 2.96Å; A355-S359 PolarHBondContact O-OG 3.37Å
356	A	63.8	Low	59.6	Low	50 Å²	50	100.3 Å²	100.3	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-43.2	174	0	0	0	0	0	111.5	Q352 E353 S359 M360	Q352-A356 VanDerWaalsContact O-CB 3.29Å; Q352-A356 WeakPolarHBondContact O-CB 3.44Å; Q352-A356 PolarHBondContact O-N 3.5Å; E353-A356 PolarHBondContact O-N 3.38Å; A356-S359 WeakPolarHBondContact CA-OG 3.48Å; A356-S359 PolarHBondContact O-N 3.28Å; A356-S359 PolarHBondContact O-OG 2.95Å; A356-M360 WeakPolarHBondContact O-CG 3.21Å; A356-M360 PolarHBondContact O-N 2.87Å
357	Y	65.1	Low	59.1	Low	165 Å²	165	106.2 Å²	106.2	65%	0.647	53%	0.528	S	S	*	.	H	α-helix	trans	-67.3	-41	177.1	-164.1	-93.1	0	0	0	112.3	E353 M360 T361	E353-Y357 WeakPolarHBondContact O-CB 3.36Å; E353-Y357 PolarHBondContact O-N 2.94Å; Y357-M360 PolarHBondContact O-N 3.32Å; Y357-T361 WeakPolarHBondContact O-CB 3.46Å; Y357-T361 PolarHBondContact O-N 3.05Å; Y357-T361 PolarHBondContact O-OG1 2.88Å
358	S	66.5	Low	58.6	Low	76 Å²	76	107.3 Å²	107.3	53%	0.531	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-39.6	177.7	-59.1	0	0	0	0	111.9	K354 A355 T361 Y362	K354-S358 VanDerWaalsContact O-CB 3.3Å; K354-S358 WeakPolarHBondContact O-CB 3.47Å; K354-S358 PolarHBondContact O-N 3.16Å; K354-S358 PolarHBondContact O-OG 3.11Å; A355-S358 PolarHBondContact O-N 3.44Å; S358-T361 PolarHBondContact O-N 3.29Å; S358-Y362 WeakPolarHBondContact O-CB 3.43Å; S358-Y362 PolarHBondContact O-N 3.45Å
359	S	58.3	Low	58.1	Low	70 Å²	70	105.7 Å²	105.7	49%	0.49	53%	0.534	S	S	.	.	H	α-helix	trans	-68.9	-38.5	175.2	59.8	0	0	0	0	112.8	A355 A356 T361 Y362 S363	A355-S359 WeakPolarHBondContact O-CB 3.33Å; A355-S359 PolarHBondContact O-N 2.96Å; A355-S359 PolarHBondContact O-OG 3.37Å; A356-S359 WeakPolarHBondContact CA-OG 3.48Å; A356-S359 PolarHBondContact O-N 3.28Å; A356-S359 PolarHBondContact O-OG 2.95Å; S359-T361 VanDerWaalsContact C-N 3.32Å; S359-T361 PolarHBondContact O-N 2.89Å; S359-Y362 PolarHBondContact O-N 3.24Å; S359-S363 WeakPolarHBondContact O-CB 3.13Å; S359-S363 PolarHBondContact O-N 3.42Å
360	M	58.3	Low	57.6	Low	132 Å²	132	110.6 Å²	110.6	65%	0.65	55%	0.551	S	S	*	*	H	α-helix	trans	-62.9	-38.3	171.9	-75.1	178.5	88.9	0	0	112.3	A356 Y357 S363 K364	A356-M360 WeakPolarHBondContact O-CG 3.21Å; A356-M360 PolarHBondContact O-N 2.87Å; Y357-M360 PolarHBondContact O-N 3.32Å; M360-S363 PolarHBondContact O-N 3.41Å; M360-K364 PolarHBondContact O-N 3.3Å
361	T	58.5	Low	56.9	Low	77 Å²	77	114.8 Å²	114.8	47%	0.472	58%	0.581	S	S	.	*	H	α-helix	trans	-70.4	-38.9	178.6	-46.9	0	0	0	0	111.3	Y357 S358 S359 K364 K365	Y357-T361 WeakPolarHBondContact O-CB 3.46Å; Y357-T361 PolarHBondContact O-N 3.05Å; Y357-T361 PolarHBondContact O-OG1 2.88Å; S358-T361 PolarHBondContact O-N 3.29Å; S359-T361 VanDerWaalsContact C-N 3.32Å; S359-T361 PolarHBondContact O-N 2.89Å; T361-K364 PolarHBondContact O-N 2.85Å; T361-K365 PolarHBondContact O-N 3.34Å; T361-K365 VanDerWaalsContact O-N 3.11Å
362	Y	55.6	Low	55.9	Low	159 Å²	159	112.9 Å²	112.9	62%	0.624	59%	0.591	S	S	*	*	H	α-helix	trans	-64.8	-42.8	172.7	-173.6	-99.7	0	0	0	112	S358 S359 K364 K365 N366	S358-Y362 WeakPolarHBondContact O-CB 3.43Å; S358-Y362 PolarHBondContact O-N 3.45Å; S359-Y362 PolarHBondContact O-N 3.24Å; Y362-K364 PolarHBondContact O-N 3.03Å; Y362-K365 PolarHBondContact O-N 3.2Å; Y362-K365 VanDerWaalsContact O-N 3.16Å; Y362-N366 PolarHBondContact O-N 3.31Å
363	S	55.4	Low	55.2	Low	57 Å²	57	110.4 Å²	110.4	40%	0.399	59%	0.589	S	S	.	*	H	α-helix	trans	-62.4	-41.4	176.3	-173.8	0	0	0	0	112.5	S359 M360 K365 N366 R367	S359-S363 WeakPolarHBondContact O-CB 3.13Å; S359-S363 PolarHBondContact O-N 3.42Å; M360-S363 PolarHBondContact O-N 3.41Å; S363-K365 VanDerWaalsContact C-N 3.34Å; S363-K365 PolarHBondContact O-N 3.28Å; S363-N366 PolarHBondContact O-N 3.04Å; S363-R367 PolarHBondContact O-N 3.21Å
364	K	54.2	Low	54	Low	167 Å²	167	111.9 Å²	111.9	73%	0.726	60%	0.601	S	S	*	*	H	α-helix	trans	-61.1	-41.3	172.2	-91.2	-177.7	174.1	178.5	0	112.3	M360 T361 Y362 R367 S368	M360-K364 PolarHBondContact O-N 3.3Å; T361-K364 PolarHBondContact O-N 2.85Å; Y362-K364 PolarHBondContact O-N 3.03Å; K364-R367 PolarHBondContact O-N 3.38Å; K364-S368 PolarHBondContact O-N 3.16Å; K364-S368 PolarHBondContact O-OG 3.46Å
365	K	52.8	Low	52.8	Low	153 Å²	153	114.9 Å²	114.9	67%	0.665	62%	0.622	S	S	*	*	H	α-helix	trans	-67.1	-35.9	178.3	-159.4	176.4	-177	-177.7	0	112.4	T361 Y362 S363 S368 F369	T361-K365 PolarHBondContact O-N 3.34Å; T361-K365 VanDerWaalsContact O-N 3.11Å; Y362-K365 PolarHBondContact O-N 3.2Å; Y362-K365 VanDerWaalsContact O-N 3.16Å; S363-K365 VanDerWaalsContact C-N 3.34Å; S363-K365 PolarHBondContact O-N 3.28Å; K365-S368 WeakPolarHBondContact CA-OG 3.18Å; K365-S368 PolarHBondContact O-OG 3.19Å; K365-F369 PolarHBondContact O-N 3.43Å
366	N	46.8	Very low	51.7	Low	87 Å²	87	117.7 Å²	117.7	47%	0.465	63%	0.633	S	S	.	*	H	α-helix	trans	-71.1	-37.7	173.9	-112.9	19.3	0	0	0	112.7	Y362 S363 F369 M370	Y362-N366 PolarHBondContact O-N 3.31Å; S363-N366 PolarHBondContact O-N 3.04Å; N366-F369 PolarHBondContact O-N 3.2Å; N366-F369 VanDerWaalsContact O-N 3.16Å; N366-M370 PolarHBondContact O-N 3.35Å
367	R	48.6	Very low	50.7	Low	192 Å²	192	123.8 Å²	123.8	73%	0.725	65%	0.653	S	S	*	*	H	α-helix	trans	-64.6	-37.8	173.7	-77.1	-174.5	-175.3	-175	1.5	112.5	S363 K364 F369 S371	S363-R367 PolarHBondContact O-N 3.21Å; K364-R367 PolarHBondContact O-N 3.38Å; R367-F369 VanDerWaalsContact C-N 3.28Å; R367-F369 PolarHBondContact O-N 3.25Å; R367-S371 WeakPolarHBondContact O-CB 3.45Å; R367-S371 PolarHBondContact O-N 2.97Å
368	S	48.5	Very low	49.2	Very low	79 Å²	79	123.2 Å²	123.2	55%	0.552	66%	0.661	S	S	*	*	H	α-helix	trans	-67.3	-27.3	172.6	49.5	0	0	0	0	113.4	K364 K365	K364-S368 PolarHBondContact O-N 3.16Å; K364-S368 PolarHBondContact O-OG 3.46Å; K365-S368 WeakPolarHBondContact CA-OG 3.18Å; K365-S368 PolarHBondContact O-OG 3.19Å
369	F	45.9	Very low	47.7	Very low	170 Å²	170	127.3 Å²	127.3	75%	0.746	68%	0.675	S	S	*	*	H	α-helix	trans	-78.8	-37.8	176.9	-136.7	-94.1	0	0	0	112.1	K365 N366 R367 G372	K365-F369 PolarHBondContact O-N 3.43Å; N366-F369 PolarHBondContact O-N 3.2Å; N366-F369 VanDerWaalsContact O-N 3.16Å; R367-F369 VanDerWaalsContact C-N 3.28Å; R367-F369 PolarHBondContact O-N 3.25Å; F369-G372 PolarHBondContact O-N 3.36Å
370	M	47.1	Very low	46.8	Very low	149 Å²	149	129.9 Å²	129.9	73%	0.734	69%	0.688	S	S	*	*	H	α-helix	trans	-74.8	-27.7	175.6	-69.5	-143.6	84.2	0	0	113.6	N366 G372 S373	N366-M370 PolarHBondContact O-N 3.35Å; M370-G372 PolarHBondContact O-N 3.39Å; M370-S373 PolarHBondContact O-N 3.45Å
371	S	46.5	Very low	45.6	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-8	175.2	-162.4	0	0	0	0	113.8	R367	R367-S371 WeakPolarHBondContact O-CB 3.45Å; R367-S371 PolarHBondContact O-N 2.97Å
372	G	44.2	Very low	45	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	4.7	175.7	0	0	0	0	0	115	F369 M370	F369-G372 PolarHBondContact O-N 3.36Å; M370-G372 PolarHBondContact O-N 3.39Å
373	S	44.8	Very low	44.4	Very low	90 Å²	90	134.9 Å²	134.9	63%	0.629	74%	0.741	S	S	*	*			trans	-122	28.1	-172.6	-168.3	0	0	0	0	114.7	M370	M370-S373 PolarHBondContact O-N 3.45Å
374	N	42	Very low	43.8	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	76%	0.76	S	S	*	*			trans	-111.3	67.9	169.1	-80.2	2.7	0	0	0	110.6
375	N	41.9	Very low	43.2	Very low	164 Å²	164	137.6 Å²	137.6	88%	0.877	76%	0.762	S	S	*	*			trans	-97	89.9	153.7	-86	-0.2	0	0	0	107	E377	N375-E377 PolarHBondContact O-N 3.21Å
376	T	41.9	Very low	42.6	Very low	119 Å²	119	136.7 Å²	136.7	73%	0.73	77%	0.768	S	S	*	*			trans	-75.6	107.2	166.1	-38.4	0	0	0	0	106.7	N378	T376-N378 PolarHBondContact O-N 3.35Å
377	E	41.8	Very low	42.3	Very low	177 Å²	177	140 Å²	140	83%	0.827	79%	0.789	S	S	*	*			trans	-64.9	111.8	168.9	-74.6	-178.8	158.4	0	0	108.7	N375 I379	N375-E377 PolarHBondContact O-N 3.21Å; E377-I379 PolarHBondContact O-N 3.44Å
378	N	33.3	Very low	41.9	Very low	153 Å²	153	136.3 Å²	136.3	82%	0.818	79%	0.793	S	S	*	*			trans	-76.9	112.8	166.3	-87.6	-12.1	0	0	0	108.6	T376	T376-N378 PolarHBondContact O-N 3.35Å
379	I	35.2	Very low	41.4	Very low	162 Å²	162	140.7 Å²	140.7	83%	0.831	81%	0.812	S	S	*	*			trans	-80.1	119.8	166.7	-63.8	172.7	0	0	0	107.6	E377	E377-I379 PolarHBondContact O-N 3.44Å
380	T	40.3	Very low	41	Very low	124 Å²	124	138.3 Å²	138.3	76%	0.761	82%	0.817	S	S	*	*			trans	-76.2	142.2	175.8	45.1	0	0	0	0	112.4
381	C	33.1	Very low	40.4	Very low	205 Å²	205	137.3 Å²	137.3	100%	1.385	83%	0.825	S	S	*	*			trans	-117.3	0	141	-88.9	0	0	0	0	108.5

Retrieved 381 of 381 residues in 481.4 ms (Link to these results)

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