A0A096MST4_PAPAN Loading...

Lysophospholipid acyltransferase 5

AlphaFold DB , UniProt , Accession A0A096MST4, Species PAPAN (Papio anubis, Olive baboon), Gene LPCAT3, Length 487 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	38.2	Very low	41.6	Very low	252 Å²	252	125.7 Å²	125.7	100%	1.241	79%	0.789	S	S	*	*				0	87.8	0	-76.7	-170.8	-95	0	0	107.7
2	A	37.4	Very low	42.2	Very low	105 Å²	105	123.1 Å²	123.1	87%	0.868	77%	0.771	S	S	*	*			trans	-114.8	113.6	168.7	0	0	0	0	0	105.1
3	S	36.7	Very low	43	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	76%	0.762	S	S	*	*			trans	-157.2	142.1	175.9	170.4	0	0	0	0	109.2
4	S	37.7	Very low	43.4	Very low	114 Å²	114	117.3 Å²	117.3	80%	0.797	74%	0.741	S	S	*	*			trans	71.5	80.5	161.2	67.7	0	0	0	0	118.7
5	A	40.9	Very low	43.5	Very low	104 Å²	104	116.9 Å²	116.9	86%	0.86	73%	0.731	S	S	*	*			trans	-138	63.4	146.5	0	0	0	0	0	109.3
6	E	40.6	Very low	43.7	Very low	197 Å²	197	112.6 Å²	112.6	92%	0.921	71%	0.71	S	S	*	*			trans	-136.6	12.1	176.3	-89.9	-174.3	162.3	0	0	112.8
7	G	42.5	Very low	43.9	Very low	63 Å²	63	108.2 Å²	108.2	65%	0.649	69%	0.692	S	S	*	*	S	Bend	trans	-96.6	-10.8	-169.9	0	0	0	0	0	117.6	T11	G7-T11 PolarHBondContact O-OG1 3.08Å
8	D	47.1	Very low	44.4	Very low	122 Å²	122	107.6 Å²	107.6	65%	0.652	69%	0.686	S	S	*	*	S	Bend	trans	-115.5	-23.4	-161.6	-137.8	7.1	0	0	0	115.2	V12	D8-V12 WeakPolarHBondContact O-CG2 3.5Å; D8-V12 PolarHBondContact O-N 3.3Å
9	E	44.4	Very low	44.4	Very low	171 Å²	171	107 Å²	107	80%	0.799	68%	0.676	S	S	*	*	H	α-helix	trans	-69.8	-34.7	176.9	-77.1	-171.6	154.6	0	0	112.7	T11 V13	E9-T11 VanDerWaalsContact C-N 3.34Å; E9-T11 PolarHBondContact O-N 3.33Å; E9-V13 VanDerWaalsContact O-CG2 3.29Å; E9-V13 WeakPolarHBondContact O-CG2 3.05Å; E9-V13 PolarHBondContact O-N 2.92Å
10	G	43.4	Very low	44.5	Very low	56 Å²	56	108.6 Å²	108.6	58%	0.577	68%	0.675	S	S	*	*	H	α-helix	trans	-66.8	-33.6	179	0	0	0	0	0	113.5	A14	G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.32Å; G10-A14 PolarHBondContact O-N 3.27Å; G10-A14 VanDerWaalsContact O-N 3.1Å
11	T	48.9	Very low	44.9	Very low	85 Å²	85	106.1 Å²	106.1	52%	0.521	66%	0.662	S	S	.	*	H	α-helix	trans	-76.7	-39.5	-177.5	-42.5	0	0	0	0	111.3	G7 E9 A14 L15	G7-T11 PolarHBondContact O-OG1 3.08Å; E9-T11 VanDerWaalsContact C-N 3.34Å; E9-T11 PolarHBondContact O-N 3.33Å; T11-A14 PolarHBondContact O-N 3.45Å; T11-L15 WeakPolarHBondContact O-CB 3.31Å; T11-L15 PolarHBondContact O-N 2.88Å
12	V	49.1	Very low	45.6	Very low	94 Å²	94	95.8 Å²	95.8	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-70.6	-39.2	177.9	177.9	0	0	0	0	111.6	D8 L15 A16	D8-V12 WeakPolarHBondContact O-CG2 3.5Å; D8-V12 PolarHBondContact O-N 3.3Å; V12-L15 PolarHBondContact O-N 2.75Å; V12-A16 VanDerWaalsContact O-CB 3.27Å; V12-A16 WeakPolarHBondContact O-CB 3.41Å; V12-A16 PolarHBondContact O-N 2.79Å
13	V	52.2	Low	46.4	Very low	107 Å²	107	97.9 Å²	97.9	65%	0.648	61%	0.609	S	S	*	*	H	α-helix	trans	-67	-39.9	175.1	173.3	0	0	0	0	111.3	E9 G17	E9-V13 VanDerWaalsContact O-CG2 3.29Å; E9-V13 WeakPolarHBondContact O-CG2 3.05Å; E9-V13 PolarHBondContact O-N 2.92Å; V13-G17 PolarHBondContact O-N 3.28Å
14	A	48.6	Very low	47.6	Very low	58 Å²	58	98.1 Å²	98.1	48%	0.479	60%	0.598	S	S	.	*	H	α-helix	trans	-64.9	-42.4	174.2	0	0	0	0	0	111.9	G10 T11 G17 V18	G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.32Å; G10-A14 PolarHBondContact O-N 3.27Å; G10-A14 VanDerWaalsContact O-N 3.1Å; T11-A14 PolarHBondContact O-N 3.45Å; A14-G17 PolarHBondContact O-N 3.45Å; A14-V18 WeakPolarHBondContact O-CB 3.29Å; A14-V18 VanDerWaalsContact O-CG2 3.24Å; A14-V18 WeakPolarHBondContact O-CG2 3.4Å; A14-V18 PolarHBondContact O-N 3.15Å
15	L	45.4	Very low	48.7	Very low	111 Å²	111	97.8 Å²	97.8	58%	0.581	58%	0.584	S	S	*	*	H	α-helix	trans	-67.2	-40.4	177.8	-151	83	0	0	0	111.7	T11 V12 V18 L19	T11-L15 WeakPolarHBondContact O-CB 3.31Å; T11-L15 PolarHBondContact O-N 2.88Å; V12-L15 PolarHBondContact O-N 2.75Å; L15-V18 PolarHBondContact O-N 2.94Å; L15-L19 HydrophobicContact CD2-CD1 4.36Å; L15-L19 HydrophobicContact CG-CD1 4.31Å; L15-L19 VanDerWaalsContact O-CB 3.32Å; L15-L19 WeakPolarHBondContact O-CB 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.06Å
16	A	46.5	Very low	49.7	Very low	49 Å²	49	97.5 Å²	97.5	41%	0.405	57%	0.567	S	S	.	*	H	α-helix	trans	-64.6	-40.4	175.1	0	0	0	0	0	111.7	V12 L19 Q20	V12-A16 VanDerWaalsContact O-CB 3.27Å; V12-A16 WeakPolarHBondContact O-CB 3.41Å; V12-A16 PolarHBondContact O-N 2.79Å; A16-L19 PolarHBondContact O-N 2.67Å; A16-Q20 WeakPolarHBondContact O-CB 3.34Å; A16-Q20 PolarHBondContact O-N 3.04Å
17	G	46.9	Very low	51.5	Low	38 Å²	38	91.8 Å²	91.8	39%	0.392	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-40.6	174.1	0	0	0	0	0	113	V13 A14 S21	V13-G17 PolarHBondContact O-N 3.28Å; A14-G17 PolarHBondContact O-N 3.45Å; G17-S21 VanDerWaalsContact O-CB 3.3Å; G17-S21 WeakPolarHBondContact O-CB 3.41Å; G17-S21 PolarHBondContact O-N 2.9Å; G17-S21 PolarHBondContact O-OG 2.84Å; G17-S21 VanDerWaalsContact O-OG 3.06Å
18	V	52	Low	53.5	Low	97 Å²	97	89.9 Å²	89.9	59%	0.588	52%	0.524	S	S	*	.	H	α-helix	trans	-71.3	-38.2	176.8	171.6	0	0	0	0	112	A14 L15 S21 G22	A14-V18 WeakPolarHBondContact O-CB 3.29Å; A14-V18 VanDerWaalsContact O-CG2 3.24Å; A14-V18 WeakPolarHBondContact O-CG2 3.4Å; A14-V18 PolarHBondContact O-N 3.15Å; L15-V18 PolarHBondContact O-N 2.94Å; V18-S21 WeakPolarHBondContact CA-OG 3.43Å; V18-S21 PolarHBondContact O-OG 2.76Å; V18-S21 VanDerWaalsContact O-OG 3.04Å; V18-G22 PolarHBondContact O-N 2.73Å
19	L	44.4	Very low	55.2	Low	96 Å²	96	87.8 Å²	87.8	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-68.7	-44.7	175.5	-74	167.8	0	0	0	110.6	L15 A16 G22 F23	L15-L19 HydrophobicContact CD2-CD1 4.36Å; L15-L19 HydrophobicContact CG-CD1 4.31Å; L15-L19 VanDerWaalsContact O-CB 3.32Å; L15-L19 WeakPolarHBondContact O-CB 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.06Å; A16-L19 PolarHBondContact O-N 2.67Å; L19-G22 PolarHBondContact O-N 2.82Å; L19-F23 WeakPolarHBondContact O-CB 3.41Å; L19-F23 WeakPolarHBondContact O-CD2 3.25Å; L19-F23 PolarHBondContact O-N 3.47Å
20	Q	47.6	Very low	57.1	Low	139 Å²	139	86 Å²	86	65%	0.65	50%	0.502	S	S	*	.	H	α-helix	trans	-66.7	-41.2	179.6	-168.8	171.8	7.1	0	0	112	A16 F23 Q24	A16-Q20 WeakPolarHBondContact O-CB 3.34Å; A16-Q20 PolarHBondContact O-N 3.04Å; Q20-F23 PolarHBondContact O-N 3.44Å; Q20-Q24 WeakPolarHBondContact O-CB 3.35Å; Q20-Q24 PolarHBondContact O-N 2.93Å
21	S	52.4	Low	59.1	Low	57 Å²	57	87.4 Å²	87.4	40%	0.399	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-43.1	172.7	67.5	0	0	0	0	111.4	G17 V18 F23 Q24 E25	G17-S21 VanDerWaalsContact O-CB 3.3Å; G17-S21 WeakPolarHBondContact O-CB 3.41Å; G17-S21 PolarHBondContact O-N 2.9Å; G17-S21 PolarHBondContact O-OG 2.84Å; G17-S21 VanDerWaalsContact O-OG 3.06Å; V18-S21 WeakPolarHBondContact CA-OG 3.43Å; V18-S21 PolarHBondContact O-OG 2.76Å; V18-S21 VanDerWaalsContact O-OG 3.04Å; S21-F23 PolarHBondContact O-N 3.47Å; S21-Q24 PolarHBondContact O-N 3.3Å; S21-E25 WeakPolarHBondContact O-CB 3.42Å; S21-E25 WeakPolarHBondContact O-CG 3.45Å; S21-E25 PolarHBondContact O-N 3.37Å
22	G	53.7	Low	60.8	Low	34 Å²	34	83.4 Å²	83.4	35%	0.351	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-41.2	175.8	0	0	0	0	0	113.3	V18 L19 L26	V18-G22 PolarHBondContact O-N 2.73Å; L19-G22 PolarHBondContact O-N 2.82Å; G22-L26 VanDerWaalsContact O-CB 3.25Å; G22-L26 WeakPolarHBondContact O-CB 3.2Å; G22-L26 PolarHBondContact O-N 2.97Å
23	F	54.3	Low	62.4	Low	150 Å²	150	83.5 Å²	83.5	66%	0.658	47%	0.472	S	S	*	.	H	α-helix	trans	-66	-39.2	174.4	-90.4	-72.9	0	0	0	112	L19 Q20 S21 S27	L19-F23 WeakPolarHBondContact O-CB 3.41Å; L19-F23 WeakPolarHBondContact O-CD2 3.25Å; L19-F23 PolarHBondContact O-N 3.47Å; Q20-F23 PolarHBondContact O-N 3.44Å; S21-F23 PolarHBondContact O-N 3.47Å; F23-S27 VanDerWaalsContact O-CB 3.24Å; F23-S27 WeakPolarHBondContact O-CB 3.29Å; F23-S27 PolarHBondContact O-N 3.29Å
24	Q	60.6	Low	63.8	Low	119 Å²	119	82.8 Å²	82.8	56%	0.556	47%	0.472	S	S	*	.	H	α-helix	trans	-71.1	-39.3	179.2	-164.8	168.6	2.3	0	0	111.9	Q20 S21 S27 L28	Q20-Q24 WeakPolarHBondContact O-CB 3.35Å; Q20-Q24 PolarHBondContact O-N 2.93Å; S21-Q24 PolarHBondContact O-N 3.3Å; Q24-S27 PolarHBondContact O-N 2.89Å; Q24-L28 HydrophobicContact CG-CD1 4.33Å; Q24-L28 WeakPolarHBondContact O-CB 3.02Å; Q24-L28 PolarHBondContact O-N 2.92Å
25	E	60.9	Low	65.3	Low	106 Å²	106	85.1 Å²	85.1	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-64.9	-45.7	172.6	-73.2	-165.9	153.7	0	0	111.5	S21 S27 L28 N29 R43	S21-E25 WeakPolarHBondContact O-CB 3.42Å; S21-E25 WeakPolarHBondContact O-CG 3.45Å; S21-E25 PolarHBondContact O-N 3.37Å; E25-S27 PolarHBondContact O-N 2.97Å; E25-L28 PolarHBondContact O-N 2.89Å; E25-N29 WeakPolarHBondContact O-CB 3.33Å; E25-N29 PolarHBondContact O-N 2.81Å; E25-R43 IonicContact OE1-NH2 2.66Å; E25-R43 PolarHBondContact OE1-NH2 2.63Å
26	L	62.1	Low	66.9	Low	99 Å²	99	83.4 Å²	83.4	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-33.7	175.6	-158.5	83.7	0	0	0	111.8	G22 K30	G22-L26 VanDerWaalsContact O-CB 3.25Å; G22-L26 WeakPolarHBondContact O-CB 3.2Å; G22-L26 PolarHBondContact O-N 2.97Å; L26-K30 WeakPolarHBondContact O-CB 3.34Å; L26-K30 WeakPolarHBondContact O-CD 3.39Å; L26-K30 WeakPolarHBondContact O-CG 3.48Å; L26-K30 PolarHBondContact O-N 3.26Å
27	S	78.2	Confident	68.6	Low	76 Å²	76	83 Å²	83	53%	0.531	48%	0.482	S	S	.	.	H	α-helix	trans	-73.3	-41.8	176.9	-174	0	0	0	0	112.7	F23 Q24 E25 L31	F23-S27 VanDerWaalsContact O-CB 3.24Å; F23-S27 WeakPolarHBondContact O-CB 3.29Å; F23-S27 PolarHBondContact O-N 3.29Å; Q24-S27 PolarHBondContact O-N 2.89Å; E25-S27 PolarHBondContact O-N 2.97Å; S27-L31 PolarHBondContact O-N 3.44Å; S27-L31 VanDerWaalsContact O-N 3.1Å
28	L	84.7	Confident	70.5	Confident	23 Å²	23	84 Å²	84	12%	0.12	48%	0.483	C	S	.	.	H	α-helix	trans	-67.9	-42	178.8	-87.7	158.5	0	0	0	111.7	Q24 E25 K30 L31 A32 E39 L42 I46 F84	Q24-L28 HydrophobicContact CG-CD1 4.33Å; Q24-L28 WeakPolarHBondContact O-CB 3.02Å; Q24-L28 PolarHBondContact O-N 2.92Å; E25-L28 PolarHBondContact O-N 2.89Å; L28-K30 PolarHBondContact O-N 3.45Å; L28-L31 PolarHBondContact O-N 2.99Å; L28-A32 WeakPolarHBondContact O-CB 3.31Å; L28-A32 PolarHBondContact O-N 2.87Å; L28-E39 HydrophobicContact CB-CG 4.44Å; L28-L42 HydrophobicContact CD2-CD2 4.17Å; L28-I46 HydrophobicContact CD2-CD1 4Å; L28-F84 HydrophobicContact CD1-CE2 4.41Å
29	N	83.3	Confident	72.3	Confident	78 Å²	78	80.8 Å²	80.8	42%	0.417	46%	0.461	S	S	.	.	H	α-helix	trans	-62.4	-43.5	177.7	-166.1	-68.5	0	0	0	112	E25 L31 A32 T33 E39	E25-N29 WeakPolarHBondContact O-CB 3.33Å; E25-N29 PolarHBondContact O-N 2.81Å; N29-L31 PolarHBondContact O-N 3.07Å; N29-A32 PolarHBondContact O-N 3.13Å; N29-T33 WeakPolarHBondContact O-CB 3.48Å; N29-T33 PolarHBondContact O-N 3.14Å; N29-T33 PolarHBondContact O-OG1 3.39Å; N29-E39 WeakPolarHBondContact CB-OE2 3.42Å; N29-E39 PolarHBondContact ND2-OE2 3.04Å
30	K	83.3	Confident	74.5	Confident	135 Å²	135	80.8 Å²	80.8	59%	0.587	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-43.5	174.7	-76.5	174.5	-178.3	179.4	0	112.2	L26 L28 T33 S34	L26-K30 WeakPolarHBondContact O-CB 3.34Å; L26-K30 WeakPolarHBondContact O-CD 3.39Å; L26-K30 WeakPolarHBondContact O-CG 3.48Å; L26-K30 PolarHBondContact O-N 3.26Å; L28-K30 PolarHBondContact O-N 3.45Å; K30-T33 PolarHBondContact O-N 3.36Å; K30-S34 PolarHBondContact O-N 3.15Å
31	L	85.1	Confident	76.6	Confident	85 Å²	85	75.5 Å²	75.5	45%	0.445	44%	0.439	S	S	.	.	H	α-helix	trans	-66	-41	176.9	180	61	0	0	0	112	S27 L28 N29 T33 S34 L35 L42	S27-L31 PolarHBondContact O-N 3.44Å; S27-L31 VanDerWaalsContact O-N 3.1Å; L28-L31 PolarHBondContact O-N 2.99Å; N29-L31 PolarHBondContact O-N 3.07Å; L31-T33 VanDerWaalsContact C-N 3.35Å; L31-S34 PolarHBondContact O-N 3.39Å; L31-S34 PolarHBondContact O-OG 3.24Å; L31-L35 HydrophobicContact CD1-CD1 4.11Å; L31-L35 HydrophobicContact CD1-CG 4.4Å; L31-L35 HydrophobicContact CG-CD1 4.17Å; L31-L35 VanDerWaalsContact O-CG 3.3Å; L31-L35 WeakPolarHBondContact O-CG 3.48Å; L31-L35 PolarHBondContact O-N 3.23Å; L31-L42 HydrophobicContact CB-CD2 4.2Å; L31-L42 HydrophobicContact CD2-CD2 4.02Å; L31-L42 HydrophobicContact CG-CD2 3.93Å
32	A	84.9	Confident	78.4	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.008	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-45.5	176.7	0	0	0	0	0	110.9	L28 N29 S34 L35 G36 A37 E39 L42	L28-A32 WeakPolarHBondContact O-CB 3.31Å; L28-A32 PolarHBondContact O-N 2.87Å; N29-A32 PolarHBondContact O-N 3.13Å; A32-S34 PolarHBondContact O-N 3.41Å; A32-L35 CarbonylContact O-C 3.57Å; A32-L35 PolarHBondContact O-N 3.19Å; A32-L35 VanDerWaalsContact O-N 3.13Å; A32-G36 PolarHBondContact O-N 3.11Å; A32-G36 VanDerWaalsContact O-N 3.16Å; A32-A37 CarbonylContact C-O 3.52Å; A32-A37 WeakPolarHBondContact CB-O 3.43Å; A32-A37 PolarHBondContact O-N 3.39Å; A32-E39 HydrophobicContact CB-CB 4.34Å; A32-L42 HydrophobicContact CB-CB 4.09Å; A32-L42 HydrophobicContact CB-CD2 3.87Å
33	T	83.4	Confident	80.4	Confident	96 Å²	96	74.1 Å²	74.1	59%	0.589	42%	0.416	S	S	*	.	H	α-helix	trans	-61.9	-41.9	178	-55.5	0	0	0	0	112	N29 K30 L31 L35 G36	N29-T33 WeakPolarHBondContact O-CB 3.48Å; N29-T33 PolarHBondContact O-N 3.14Å; N29-T33 PolarHBondContact O-OG1 3.39Å; K30-T33 PolarHBondContact O-N 3.36Å; L31-T33 VanDerWaalsContact C-N 3.35Å; T33-L35 PolarHBondContact O-N 3.3Å; T33-G36 PolarHBondContact O-N 3.13Å
34	S	81.6	Confident	82.3	Confident	92 Å²	92	67.5 Å²	67.5	64%	0.643	39%	0.387	S	S	*	.	H	α-helix	trans	-66.6	-24.3	177.5	70.4	0	0	0	0	113.4	K30 L31 A32	K30-S34 PolarHBondContact O-N 3.15Å; L31-S34 PolarHBondContact O-N 3.39Å; L31-S34 PolarHBondContact O-OG 3.24Å; A32-S34 PolarHBondContact O-N 3.41Å
35	L	80.3	Confident	83.9	Confident	107 Å²	107	63.9 Å²	63.9	56%	0.56	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	1.7	174.4	-64.7	173.1	0	0	0	113.2	L31 A32 T33 A37 L42	L31-L35 HydrophobicContact CD1-CD1 4.11Å; L31-L35 HydrophobicContact CD1-CG 4.4Å; L31-L35 HydrophobicContact CG-CD1 4.17Å; L31-L35 VanDerWaalsContact O-CG 3.3Å; L31-L35 WeakPolarHBondContact O-CG 3.48Å; L31-L35 PolarHBondContact O-N 3.23Å; A32-L35 CarbonylContact O-C 3.57Å; A32-L35 PolarHBondContact O-N 3.19Å; A32-L35 VanDerWaalsContact O-N 3.13Å; T33-L35 PolarHBondContact O-N 3.3Å; L35-A37 VanDerWaalsContact C-N 3.26Å; L35-A37 PolarHBondContact O-N 3.27Å; L35-L42 HydrophobicContact CD1-CD1 4.29Å
36	G	78.6	Confident	85.6	Confident	75 Å²	75	61.6 Å²	61.6	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	25.9	-177	0	0	0	0	0	113.8	A32 T33	A32-G36 PolarHBondContact O-N 3.11Å; A32-G36 VanDerWaalsContact O-N 3.16Å; T33-G36 PolarHBondContact O-N 3.13Å
37	A	82.5	Confident	87.2	Confident	40 Å²	40	56.9 Å²	56.9	33%	0.331	34%	0.337	S	S	.	.			trans	-119.1	156.9	-177.6	0	0	0	0	0	111.6	A32 L35	A32-A37 CarbonylContact C-O 3.52Å; A32-A37 WeakPolarHBondContact CB-O 3.43Å; A32-A37 PolarHBondContact O-N 3.39Å; L35-A37 VanDerWaalsContact C-N 3.26Å; L35-A37 PolarHBondContact O-N 3.27Å
38	S	86.9	Confident	88.1	Confident	60 Å²	60	53.8 Å²	53.8	42%	0.42	31%	0.314	S	S	.	.			trans	-72.5	151	168.2	68.7	0	0	0	0	110.7	Q40 A41 L42	S38-Q40 PolarHBondContact O-N 3.15Å; S38-A41 WeakPolarHBondContact O-CB 3.47Å; S38-A41 PolarHBondContact O-N 2.76Å; S38-A41 VanDerWaalsContact O-N 3.08Å; S38-A41 WeakPolarHBondContact OG-CB 3.37Å; S38-A41 PolarHBondContact OG-N 2.97Å; S38-L42 PolarHBondContact O-N 3.16Å
39	E	89.8	Confident	88.7	Confident	29 Å²	29	55.6 Å²	55.6	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-57.7	-38.4	177.1	-170.5	-176.3	150.1	0	0	111.6	L28 N29 A32 A41 L42 R43	L28-E39 HydrophobicContact CB-CG 4.44Å; N29-E39 WeakPolarHBondContact CB-OE2 3.42Å; N29-E39 PolarHBondContact ND2-OE2 3.04Å; A32-E39 HydrophobicContact CB-CB 4.34Å; E39-A41 PolarHBondContact O-N 2.9Å; E39-L42 PolarHBondContact O-N 2.63Å; E39-R43 WeakPolarHBondContact O-CG 3.29Å; E39-R43 PolarHBondContact O-N 3.12Å; E39-R43 IonicContact OE1-CZ 3.35Å; E39-R43 VanDerWaalsContact OE1-CZ 3.23Å; E39-R43 IonicContact OE1-NE 3.63Å; E39-R43 PolarHBondContact OE1-NE 3.11Å; E39-R43 IonicContact OE1-NH2 2.82Å; E39-R43 PolarHBondContact OE1-NH2 3.15Å
40	Q	91.1	Very high	89.4	Confident	96 Å²	96	55 Å²	55	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-37.9	177.4	-57.4	83.9	-5.2	0	0	112	S38 R43 L44 I139	S38-Q40 PolarHBondContact O-N 3.15Å; Q40-R43 PolarHBondContact O-N 3.37Å; Q40-L44 WeakPolarHBondContact O-CB 3.39Å; Q40-L44 PolarHBondContact O-N 3.42Å; Q40-I139 HydrophobicContact CB-CB 3.88Å; Q40-I139 HydrophobicContact CB-CD1 4.43Å; Q40-I139 HydrophobicContact CB-CG2 4.26Å
41	A	90.2	Very high	90.1	Very high	28 Å²	28	48.7 Å²	48.7	23%	0.231	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-41.1	174.6	0	0	0	0	0	111.2	S38 E39 L44 I45 I139	S38-A41 WeakPolarHBondContact O-CB 3.47Å; S38-A41 PolarHBondContact O-N 2.76Å; S38-A41 VanDerWaalsContact O-N 3.08Å; S38-A41 WeakPolarHBondContact OG-CB 3.37Å; S38-A41 PolarHBondContact OG-N 2.97Å; E39-A41 PolarHBondContact O-N 2.9Å; A41-L44 WeakPolarHBondContact O-CB 3.23Å; A41-L44 PolarHBondContact O-N 3.1Å; A41-I45 WeakPolarHBondContact O-CG1 3.45Å; A41-I45 PolarHBondContact O-N 3.32Å; A41-I139 HydrophobicContact CB-CD1 3.92Å
42	L	91.9	Very high	90.7	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-45.5	175.8	-177.2	60.1	0	0	0	111.9	L28 L31 A32 L35 S38 E39 L44 I45 I46	L28-L42 HydrophobicContact CD2-CD2 4.17Å; L31-L42 HydrophobicContact CB-CD2 4.2Å; L31-L42 HydrophobicContact CD2-CD2 4.02Å; L31-L42 HydrophobicContact CG-CD2 3.93Å; A32-L42 HydrophobicContact CB-CB 4.09Å; A32-L42 HydrophobicContact CB-CD2 3.87Å; L35-L42 HydrophobicContact CD1-CD1 4.29Å; S38-L42 PolarHBondContact O-N 3.16Å; E39-L42 PolarHBondContact O-N 2.63Å; L42-L44 VanDerWaalsContact C-N 3.3Å; L42-L44 PolarHBondContact O-N 2.97Å; L42-I45 PolarHBondContact O-N 3.4Å; L42-I46 HydrophobicContact CD1-CD1 4.16Å; L42-I46 HydrophobicContact CD1-CG1 4.32Å; L42-I46 HydrophobicContact CG-CD1 3.92Å; L42-I46 WeakPolarHBondContact O-CG1 3.47Å; L42-I46 PolarHBondContact O-N 3.35Å
43	R	94.6	Very high	91.4	Very high	40 Å²	40	48.8 Å²	48.8	15%	0.151	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-42.6	175.2	-71.7	179.4	-176.9	-151.1	7.3	111.5	E25 E39 Q40 I46 S47 F84 N85	E25-R43 IonicContact OE1-NH2 2.66Å; E25-R43 PolarHBondContact OE1-NH2 2.63Å; E39-R43 WeakPolarHBondContact O-CG 3.29Å; E39-R43 PolarHBondContact O-N 3.12Å; E39-R43 IonicContact OE1-CZ 3.35Å; E39-R43 VanDerWaalsContact OE1-CZ 3.23Å; E39-R43 IonicContact OE1-NE 3.63Å; E39-R43 PolarHBondContact OE1-NE 3.11Å; E39-R43 IonicContact OE1-NH2 2.82Å; E39-R43 PolarHBondContact OE1-NH2 3.15Å; Q40-R43 PolarHBondContact O-N 3.37Å; R43-I46 PolarHBondContact O-N 2.85Å; R43-S47 WeakPolarHBondContact O-CB 3.45Å; R43-S47 PolarHBondContact O-N 3.35Å; R43-S47 PolarHBondContact O-OG 2.91Å; R43-F84 HydrophobicContact CB-CD1 4.38Å; R43-F84 HydrophobicContact CB-CE1 3.81Å; R43-F84 HydrophobicContact CB-CZ 4.32Å; R43-F84 HydrophobicContact CG-CE1 3.94Å; R43-F84 HydrophobicContact CG-CZ 3.94Å; R43-F84 PolarHBondContact NH1-O 3.32Å; R43-N85 VanDerWaalsContact C-OD1 3.28Å; R43-N85 PolarHBondContact O-OD1 3.33Å
44	L	94.7	Very high	92.1	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-50.4	175.7	174	60.6	0	0	0	111.6	Q40 A41 L42 S47 I48 N85 I139 M143 L198 V199	Q40-L44 WeakPolarHBondContact O-CB 3.39Å; Q40-L44 PolarHBondContact O-N 3.42Å; A41-L44 WeakPolarHBondContact O-CB 3.23Å; A41-L44 PolarHBondContact O-N 3.1Å; L42-L44 VanDerWaalsContact C-N 3.3Å; L42-L44 PolarHBondContact O-N 2.97Å; L44-S47 WeakPolarHBondContact O-CB 3.41Å; L44-S47 PolarHBondContact O-N 3.1Å; L44-I48 HydrophobicContact CD1-CG2 4.3Å; L44-I48 PolarHBondContact O-N 2.92Å; L44-N85 PolarHBondContact N-OD1 3.47Å; L44-I139 HydrophobicContact CB-CD1 4.42Å; L44-I139 HydrophobicContact CD2-CD1 3.8Å; L44-I139 HydrophobicContact CD2-CG1 4.46Å; L44-M143 HydrophobicContact CD1-CE 3.7Å; L44-M143 HydrophobicContact CD2-CE 4.13Å; L44-L198 HydrophobicContact CD1-CB 4.04Å; L44-L198 HydrophobicContact CD1-CD1 3.87Å; L44-L198 HydrophobicContact CD1-CG 4.38Å; L44-V199 HydrophobicContact CD1-CG1 3.92Å
45	I	94.5	Very high	92.9	Very high	44 Å²	44	42 Å²	42	23%	0.226	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-50.8	178.9	-67.3	-61.7	0	0	0	110.4	A41 L42 S47 I48 F49	A41-I45 WeakPolarHBondContact O-CG1 3.45Å; A41-I45 PolarHBondContact O-N 3.32Å; L42-I45 PolarHBondContact O-N 3.4Å; I45-S47 PolarHBondContact O-N 2.91Å; I45-I48 HydrophobicContact CD1-CD1 3.91Å; I45-I48 WeakPolarHBondContact O-CG1 3.36Å; I45-I48 PolarHBondContact O-N 3.46Å; I45-F49 HydrophobicContact CG2-CD2 3.79Å; I45-F49 HydrophobicContact CG2-CE2 3.82Å; I45-F49 VanDerWaalsContact O-CD2 3.26Å; I45-F49 WeakPolarHBondContact O-CD2 3.5Å; I45-F49 PolarHBondContact O-N 2.91Å; I45-F49 VanDerWaalsContact O-N 3.13Å
46	I	95.6	Very high	93.7	Very high	57 Å²	57	41.3 Å²	41.3	29%	0.292	24%	0.241	S	C	.	.	H	α-helix	trans	-53	-44.2	176.9	-69.1	167.6	0	0	0	110.7	L28 L42 R43 F49 L50 F84	L28-I46 HydrophobicContact CD2-CD1 4Å; L42-I46 HydrophobicContact CD1-CD1 4.16Å; L42-I46 HydrophobicContact CD1-CG1 4.32Å; L42-I46 HydrophobicContact CG-CD1 3.92Å; L42-I46 WeakPolarHBondContact O-CG1 3.47Å; L42-I46 PolarHBondContact O-N 3.35Å; R43-I46 PolarHBondContact O-N 2.85Å; I46-F49 PolarHBondContact O-N 3.32Å; I46-L50 HydrophobicContact CG2-CD1 4.09Å; I46-L50 HydrophobicContact CG2-CG 4.3Å; I46-L50 WeakPolarHBondContact O-CG 3.44Å; I46-L50 PolarHBondContact O-N 3.42Å; I46-F84 HydrophobicContact CB-CE1 4.38Å; I46-F84 HydrophobicContact CG2-CE1 4.19Å; I46-F84 HydrophobicContact CG2-CZ 4.43Å
47	S	96.9	Very high	94.7	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-40.1	-176.5	-58.1	0	0	0	0	114.2	R43 L44 I45 F49 L50 G51 F84 N85	R43-S47 WeakPolarHBondContact O-CB 3.45Å; R43-S47 PolarHBondContact O-N 3.35Å; R43-S47 PolarHBondContact O-OG 2.91Å; L44-S47 WeakPolarHBondContact O-CB 3.41Å; L44-S47 PolarHBondContact O-N 3.1Å; I45-S47 PolarHBondContact O-N 2.91Å; S47-F49 VanDerWaalsContact C-N 3.29Å; S47-F49 PolarHBondContact O-N 2.91Å; S47-L50 PolarHBondContact O-N 2.85Å; S47-G51 PolarHBondContact O-N 3.3Å; S47-F84 WeakPolarHBondContact OG-CD1 3.45Å; S47-N85 PolarHBondContact OG-ND2 3.37Å
48	I	96.6	Very high	95.4	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.051	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-33.4	175.5	62	173.5	0	0	0	111.1	L44 I45 G51 L198 V199 C287 V290	L44-I48 HydrophobicContact CD1-CG2 4.3Å; L44-I48 PolarHBondContact O-N 2.92Å; I45-I48 HydrophobicContact CD1-CD1 3.91Å; I45-I48 WeakPolarHBondContact O-CG1 3.36Å; I45-I48 PolarHBondContact O-N 3.46Å; I48-G51 PolarHBondContact O-N 3.38Å; I48-L198 HydrophobicContact CG2-CD1 4.28Å; I48-V199 HydrophobicContact CG2-CG2 4.41Å; I48-C287 HydrophobicContact CD1-CB 4.48Å; I48-V290 HydrophobicContact CB-CG1 4.43Å; I48-V290 HydrophobicContact CD1-CB 4.07Å; I48-V290 HydrophobicContact CD1-CG1 3.96Å; I48-V290 HydrophobicContact CG1-CG1 4.07Å
49	F	97.6	Very high	95.9	Very high	61 Å²	61	39.5 Å²	39.5	27%	0.268	20%	0.196	S	C	.	.	H	α-helix	trans	-71.8	-35.1	174.5	-84.3	-86.2	0	0	0	112.6	I45 I46 S47 G51 Y52 P53 L234 L238 L241 V290	I45-F49 HydrophobicContact CG2-CD2 3.79Å; I45-F49 HydrophobicContact CG2-CE2 3.82Å; I45-F49 VanDerWaalsContact O-CD2 3.26Å; I45-F49 WeakPolarHBondContact O-CD2 3.5Å; I45-F49 PolarHBondContact O-N 2.91Å; I45-F49 VanDerWaalsContact O-N 3.13Å; I46-F49 PolarHBondContact O-N 3.32Å; S47-F49 VanDerWaalsContact C-N 3.29Å; S47-F49 PolarHBondContact O-N 2.91Å; F49-G51 PolarHBondContact O-N 3.02Å; F49-G51 VanDerWaalsContact O-N 3.13Å; F49-Y52 PolarHBondContact O-N 3.35Å; F49-P53 VanDerWaalsContact O-CD 3.27Å; F49-P53 WeakPolarHBondContact O-CD 3.36Å; F49-L234 HydrophobicContact CE1-CD1 3.8Å; F49-L234 HydrophobicContact CZ-CD1 4.41Å; F49-L238 HydrophobicContact CE1-CD2 3.93Å; F49-L238 HydrophobicContact CZ-CD2 3.59Å; F49-L241 HydrophobicContact CE2-CD2 4.32Å; F49-L241 HydrophobicContact CZ-CD2 4.38Å; F49-V290 HydrophobicContact CD1-CG1 4.5Å; F49-V290 HydrophobicContact CD2-CG1 4.3Å; F49-V290 HydrophobicContact CE1-CG1 4.35Å; F49-V290 HydrophobicContact CE2-CG1 4.12Å; F49-V290 HydrophobicContact CE2-CG2 4.42Å; F49-V290 HydrophobicContact CG-CG1 4.48Å; F49-V290 HydrophobicContact CZ-CG1 4.14Å; F49-V290 HydrophobicContact CZ-CG2 4.18Å
50	L	97.4	Very high	96.2	Very high	66 Å²	66	44.9 Å²	44.9	35%	0.346	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-19.5	171.5	-75.6	175.1	0	0	0	113	I46 S47 Y52 P53 F54	I46-L50 HydrophobicContact CG2-CD1 4.09Å; I46-L50 HydrophobicContact CG2-CG 4.3Å; I46-L50 WeakPolarHBondContact O-CG 3.44Å; I46-L50 PolarHBondContact O-N 3.42Å; S47-L50 PolarHBondContact O-N 2.85Å; L50-Y52 PolarHBondContact O-N 2.99Å; L50-P53 HydrophobicContact CD2-CG 4.32Å; L50-P53 WeakPolarHBondContact O-CD 3.43Å; L50-P53 VanDerWaalsContact O-CG 3.23Å; L50-P53 WeakPolarHBondContact O-CG 3.25Å; L50-F54 HydrophobicContact CB-CE2 4.18Å; L50-F54 HydrophobicContact CB-CZ 4.48Å; L50-F54 VanDerWaalsContact O-CD2 3.3Å; L50-F54 WeakPolarHBondContact O-CD2 3.39Å; L50-F54 VanDerWaalsContact O-CG 3.29Å; L50-F54 WeakPolarHBondContact O-CG 3.48Å; L50-F54 PolarHBondContact O-N 3.3Å
51	G	97.9	Very high	96.5	Very high	2 Å²	2	46.5 Å²	46.5	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-31.4	171.1	0	0	0	0	0	113.7	S47 I48 F49 A55 Y194 V294	S47-G51 PolarHBondContact O-N 3.3Å; I48-G51 PolarHBondContact O-N 3.38Å; F49-G51 PolarHBondContact O-N 3.02Å; F49-G51 VanDerWaalsContact O-N 3.13Å; G51-A55 VanDerWaalsContact O-CB 3.27Å; G51-A55 WeakPolarHBondContact O-CB 3.48Å; G51-A55 PolarHBondContact O-N 3.13Å; G51-Y194 WeakPolarHBondContact O-CE2 3.26Å; G51-V294 WeakPolarHBondContact O-CG1 3.31Å
52	Y	98.5	Very high	96.9	Very high	23 Å²	23	46.3 Å²	46.3	9%	0.09	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-53.5	178.6	-73.1	-93.4	0	0	0	113.7	F49 L50 F54 A55 L56 L234 V290 G293 V294 L297	F49-Y52 PolarHBondContact O-N 3.35Å; L50-Y52 PolarHBondContact O-N 2.99Å; Y52-F54 PolarHBondContact O-N 3.06Å; Y52-A55 PolarHBondContact O-N 2.94Å; Y52-A55 VanDerWaalsContact O-N 3.17Å; Y52-L56 WeakPolarHBondContact O-CG 3.05Å; Y52-L56 PolarHBondContact O-N 2.95Å; Y52-L234 HydrophobicContact CD1-CD2 4.3Å; Y52-L234 HydrophobicContact CE1-CB 4.12Å; Y52-L234 HydrophobicContact CE1-CD1 4.45Å; Y52-L234 HydrophobicContact CE1-CD2 3.83Å; Y52-L234 HydrophobicContact CE1-CG 4.35Å; Y52-L234 HydrophobicContact CE2-CD1 3.91Å; Y52-L234 HydrophobicContact CE2-CD2 4.48Å; Y52-L234 WeakPolarHBondContact OH-CB 3.32Å; Y52-V290 HydrophobicContact CE2-CG1 3.86Å; Y52-V290 WeakPolarHBondContact CE2-O 3.43Å; Y52-V290 PolarHBondContact OH-O 3.45Å; Y52-G293 VanDerWaalsContact OH-CA 3.31Å; Y52-G293 WeakPolarHBondContact OH-CA 3.37Å; Y52-V294 HydrophobicContact CD2-CG2 3.52Å; Y52-V294 HydrophobicContact CE1-CG2 4.43Å; Y52-V294 HydrophobicContact CE2-CG2 3.35Å; Y52-V294 HydrophobicContact CG-CG2 4.11Å; Y52-L297 HydrophobicContact CD1-CD2 3.92Å
53	P	98.3	Very high	97.1	Very high	65 Å²	65	46.2 Å²	46.2	42%	0.422	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-34.6	174.9	21.1	-30.9	0	0	0	112	F49 L50 L56 F57	F49-P53 VanDerWaalsContact O-CD 3.27Å; F49-P53 WeakPolarHBondContact O-CD 3.36Å; L50-P53 HydrophobicContact CD2-CG 4.32Å; L50-P53 WeakPolarHBondContact O-CD 3.43Å; L50-P53 VanDerWaalsContact O-CG 3.23Å; L50-P53 WeakPolarHBondContact O-CG 3.25Å; P53-L56 PolarHBondContact O-N 2.98Å; P53-F57 WeakPolarHBondContact O-CB 3.44Å; P53-F57 PolarHBondContact O-N 3.03Å
54	F	98.6	Very high	97.1	Very high	47 Å²	47	51.5 Å²	51.5	21%	0.206	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-42.8	173.1	-64.3	-22.4	0	0	0	112.7	L50 Y52 L56 F57 Y58 Y73 T77 I81 Y194	L50-F54 HydrophobicContact CB-CE2 4.18Å; L50-F54 HydrophobicContact CB-CZ 4.48Å; L50-F54 VanDerWaalsContact O-CD2 3.3Å; L50-F54 WeakPolarHBondContact O-CD2 3.39Å; L50-F54 VanDerWaalsContact O-CG 3.29Å; L50-F54 WeakPolarHBondContact O-CG 3.48Å; L50-F54 PolarHBondContact O-N 3.3Å; Y52-F54 PolarHBondContact O-N 3.06Å; F54-L56 PolarHBondContact O-N 2.86Å; F54-F57 PolarHBondContact O-N 3.17Å; F54-Y58 WeakPolarHBondContact O-CB 3.21Å; F54-Y58 PolarHBondContact O-N 3.06Å; F54-Y73 WeakPolarHBondContact CA-OH 3.44Å; F54-Y73 VanDerWaalsContact CB-OH 3.32Å; F54-Y73 WeakPolarHBondContact CB-OH 3.41Å; F54-Y73 PolarHBondContact O-OH 3.17Å; F54-T77 HydrophobicContact CD1-CG2 4.14Å; F54-T77 HydrophobicContact CD2-CG2 4.2Å; F54-T77 HydrophobicContact CE1-CG2 4.27Å; F54-T77 HydrophobicContact CE2-CG2 4.32Å; F54-T77 HydrophobicContact CG-CG2 4.12Å; F54-T77 HydrophobicContact CZ-CG2 4.36Å; F54-I81 HydrophobicContact CD2-CD1 4.21Å; F54-I81 HydrophobicContact CE2-CD1 3.88Å; F54-I81 HydrophobicContact CE2-CG1 4.06Å; F54-Y194 HydrophobicContact CB-CD1 4.27Å; F54-Y194 HydrophobicContact CB-CD2 3.79Å; F54-Y194 HydrophobicContact CB-CE1 4.18Å; F54-Y194 HydrophobicContact CB-CE2 3.73Å; F54-Y194 HydrophobicContact CB-CG 4.08Å; F54-Y194 HydrophobicContact CD2-CD2 4.25Å; F54-Y194 HydrophobicContact CD2-CG 4.09Å
55	A	98.3	Very high	97.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-41.3	174.4	0	0	0	0	0	112.7	G51 Y52 R59 Y194 V294 L297 T298	G51-A55 VanDerWaalsContact O-CB 3.27Å; G51-A55 WeakPolarHBondContact O-CB 3.48Å; G51-A55 PolarHBondContact O-N 3.13Å; Y52-A55 PolarHBondContact O-N 2.94Å; Y52-A55 VanDerWaalsContact O-N 3.17Å; A55-R59 WeakPolarHBondContact O-CB 3.45Å; A55-R59 PolarHBondContact O-N 3.27Å; A55-Y194 VanDerWaalsContact CA-OH 3.25Å; A55-Y194 WeakPolarHBondContact CA-OH 3.48Å; A55-Y194 HydrophobicContact CB-CE2 4.2Å; A55-Y194 PolarHBondContact N-OH 2.93Å; A55-V294 HydrophobicContact CB-CG1 4.27Å; A55-L297 HydrophobicContact CB-CB 4.13Å; A55-L297 HydrophobicContact CB-CD2 3.84Å; A55-L297 HydrophobicContact CB-CG 3.93Å; A55-T298 HydrophobicContact CB-CG2 3.46Å; A55-T298 VanDerWaalsContact CB-CG2 3.46Å
56	L	98.3	Very high	97.4	Very high	92 Å²	92	59.4 Å²	59.4	48%	0.482	27%	0.272	S	S	.	.	H	α-helix	trans	-65.8	-41.4	176.1	-69	173.3	0	0	0	112	Y52 P53 F54 R59 H60 L297	Y52-L56 WeakPolarHBondContact O-CG 3.05Å; Y52-L56 PolarHBondContact O-N 2.95Å; P53-L56 PolarHBondContact O-N 2.98Å; F54-L56 PolarHBondContact O-N 2.86Å; L56-R59 PolarHBondContact O-N 2.96Å; L56-H60 WeakPolarHBondContact O-CB 3.31Å; L56-H60 PolarHBondContact O-N 2.79Å; L56-L297 HydrophobicContact CD2-CD1 4.41Å; L56-L297 HydrophobicContact CD2-CD2 4.01Å; L56-L297 HydrophobicContact CG-CD2 4.1Å
57	F	98.4	Very high	97.4	Very high	91 Å²	91	59 Å²	59	40%	0.399	27%	0.274	S	S	.	.	H	α-helix	trans	-62.4	-49.6	175.5	-176.7	-85.3	0	0	0	111.2	P53 F54 R59 H60 Y61 L62 Y73	P53-F57 WeakPolarHBondContact O-CB 3.44Å; P53-F57 PolarHBondContact O-N 3.03Å; F54-F57 PolarHBondContact O-N 3.17Å; F57-R59 VanDerWaalsContact C-N 3.3Å; F57-R59 PolarHBondContact O-N 3.08Å; F57-H60 PolarHBondContact O-N 2.9Å; F57-Y61 HydrophobicContact CD1-CD2 4.37Å; F57-Y61 AromaticContact CD2-CD2 3.46Å; F57-Y61 HydrophobicContact CD2-CD2 3.46Å; F57-Y61 VanDerWaalsContact CD2-CD2 3.46Å; F57-Y61 AromaticContact CD2-CE2 3.75Å; F57-Y61 HydrophobicContact CD2-CE2 3.75Å; F57-Y61 HydrophobicContact CD2-CG 4.45Å; F57-Y61 HydrophobicContact CE1-CD2 4.46Å; F57-Y61 AromaticContact CE2-CD2 3.58Å; F57-Y61 HydrophobicContact CE2-CD2 3.58Å; F57-Y61 AromaticContact CE2-CE2 3.96Å; F57-Y61 HydrophobicContact CE2-CE2 3.96Å; F57-Y61 HydrophobicContact CE2-CG 4.2Å; F57-Y61 AromaticContact CG-CD2 3.88Å; F57-Y61 HydrophobicContact CG-CD2 3.88Å; F57-Y61 HydrophobicContact CG-CE2 4.49Å; F57-Y61 HydrophobicContact CZ-CD2 4.1Å; F57-Y61 HydrophobicContact CZ-CG 4.35Å; F57-Y61 WeakPolarHBondContact O-CD2 3.33Å; F57-Y61 PolarHBondContact O-N 3.46Å; F57-L62 HydrophobicContact CD1-CD1 4.23Å; F57-L62 HydrophobicContact CD1-CG 4.46Å; F57-L62 HydrophobicContact CE1-CD1 4.03Å; F57-L62 HydrophobicContact CE1-CG 4.15Å; F57-Y73 HydrophobicContact CD1-CD2 4.24Å; F57-Y73 AromaticContact CD1-CE2 3.48Å; F57-Y73 HydrophobicContact CD1-CE2 3.48Å; F57-Y73 VanDerWaalsContact CD1-CE2 3.48Å; F57-Y73 AromaticContact CD1-CZ 3.67Å; F57-Y73 HydrophobicContact CE1-CD2 4.23Å; F57-Y73 AromaticContact CE1-CE2 3.82Å; F57-Y73 HydrophobicContact CE1-CE2 3.82Å; F57-Y73 HydrophobicContact CG-CE2 4.42Å
58	Y	98	Very high	97.4	Very high	1 Å²	1	65 Å²	65	0%	0.004	30%	0.297	C	S	.	.	I	π-helix	trans	-53.7	-49.5	174	163.3	-101.3	0	0	0	111.4	F54 H60 L62 F63 I70 T298	F54-Y58 WeakPolarHBondContact O-CB 3.21Å; F54-Y58 PolarHBondContact O-N 3.06Å; Y58-H60 VanDerWaalsContact C-N 3.33Å; Y58-H60 PolarHBondContact O-N 3.31Å; Y58-L62 HydrophobicContact CD2-CB 3.85Å; Y58-L62 HydrophobicContact CE2-CB 4.42Å; Y58-L62 CarbonylContact O-C 3.6Å; Y58-L62 WeakPolarHBondContact O-CA 3.17Å; Y58-L62 PolarHBondContact O-N 3.43Å; Y58-F63 HydrophobicContact CE1-CD2 4.13Å; Y58-F63 PolarHBondContact O-N 2.91Å; Y58-I70 HydrophobicContact CD2-CG2 4.15Å; Y58-I70 HydrophobicContact CE2-CB 4.45Å; Y58-I70 HydrophobicContact CE2-CD1 4.02Å; Y58-I70 HydrophobicContact CE2-CG1 4Å; Y58-I70 HydrophobicContact CE2-CG2 3.63Å; Y58-T298 WeakPolarHBondContact CE1-O 3.48Å
59	R	96.9	Very high	97.5	Very high	45 Å²	45	66.9 Å²	66.9	17%	0.17	31%	0.307	C	S	.	.	I	π-helix	trans	-59	-42.3	-178.1	-173.8	-174.3	178.7	84.3	5.2	112.6	A55 L56 F57 I223 P224	A55-R59 WeakPolarHBondContact O-CB 3.45Å; A55-R59 PolarHBondContact O-N 3.27Å; L56-R59 PolarHBondContact O-N 2.96Å; F57-R59 VanDerWaalsContact C-N 3.3Å; F57-R59 PolarHBondContact O-N 3.08Å; R59-I223 HydrophobicContact CG-CG2 3.43Å; R59-I223 VanDerWaalsContact CG-CG2 3.43Å; R59-I223 VanDerWaalsContact NH2-CG2 3.31Å; R59-P224 PolarHBondContact NH1-O 2.91Å; R59-P224 PolarHBondContact NH2-O 3.47Å
60	H	96.3	Very high	97.5	Very high	141 Å²	141	64 Å²	64	65%	0.653	30%	0.295	S	S	*	.	I	π-helix	trans	-84.5	-38.2	-173.9	-168.6	86.6	0	0	0	112.9	L56 F57 Y58	L56-H60 WeakPolarHBondContact O-CB 3.31Å; L56-H60 PolarHBondContact O-N 2.79Å; F57-H60 PolarHBondContact O-N 2.9Å; Y58-H60 VanDerWaalsContact C-N 3.33Å; Y58-H60 PolarHBondContact O-N 3.31Å
61	Y	97.5	Very high	97.6	Very high	131 Å²	131	61.2 Å²	61.2	51%	0.514	28%	0.28	S	S	.	.	I	π-helix	trans	-109.8	-27.1	-169.2	-60.1	-76.8	0	0	0	114.4	F57 K65	F57-Y61 HydrophobicContact CD1-CD2 4.37Å; F57-Y61 AromaticContact CD2-CD2 3.46Å; F57-Y61 HydrophobicContact CD2-CD2 3.46Å; F57-Y61 VanDerWaalsContact CD2-CD2 3.46Å; F57-Y61 AromaticContact CD2-CE2 3.75Å; F57-Y61 HydrophobicContact CD2-CE2 3.75Å; F57-Y61 HydrophobicContact CD2-CG 4.45Å; F57-Y61 HydrophobicContact CE1-CD2 4.46Å; F57-Y61 AromaticContact CE2-CD2 3.58Å; F57-Y61 HydrophobicContact CE2-CD2 3.58Å; F57-Y61 AromaticContact CE2-CE2 3.96Å; F57-Y61 HydrophobicContact CE2-CE2 3.96Å; F57-Y61 HydrophobicContact CE2-CG 4.2Å; F57-Y61 AromaticContact CG-CD2 3.88Å; F57-Y61 HydrophobicContact CG-CD2 3.88Å; F57-Y61 HydrophobicContact CG-CE2 4.49Å; F57-Y61 HydrophobicContact CZ-CD2 4.1Å; F57-Y61 HydrophobicContact CZ-CG 4.35Å; F57-Y61 WeakPolarHBondContact O-CD2 3.33Å; F57-Y61 PolarHBondContact O-N 3.46Å; Y61-K65 VanDerWaalsContact O-CG 3.29Å; Y61-K65 WeakPolarHBondContact O-CG 3.18Å
62	L	97.6	Very high	97.6	Very high	23 Å²	23	65.8 Å²	65.8	12%	0.12	30%	0.304	C	S	.	.	I	π-helix	trans	-114.9	-17	-168.2	-59.5	-178.9	0	0	0	114.8	F57 Y58 Y64 K65 I70 Y73	F57-L62 HydrophobicContact CD1-CD1 4.23Å; F57-L62 HydrophobicContact CD1-CG 4.46Å; F57-L62 HydrophobicContact CE1-CD1 4.03Å; F57-L62 HydrophobicContact CE1-CG 4.15Å; Y58-L62 HydrophobicContact CD2-CB 3.85Å; Y58-L62 HydrophobicContact CE2-CB 4.42Å; Y58-L62 CarbonylContact O-C 3.6Å; Y58-L62 WeakPolarHBondContact O-CA 3.17Å; Y58-L62 PolarHBondContact O-N 3.43Å; L62-Y64 PolarHBondContact O-N 3.23Å; L62-Y64 VanDerWaalsContact O-N 3.15Å; L62-K65 HydrophobicContact CD2-CG 4.28Å; L62-K65 WeakPolarHBondContact O-CB 3.41Å; L62-K65 PolarHBondContact O-N 2.87Å; L62-I70 HydrophobicContact CB-CG1 4.38Å; L62-Y73 VanDerWaalsContact CD1-CB 3.49Å; L62-Y73 HydrophobicContact CD1-CD1 3.6Å; L62-Y73 HydrophobicContact CD1-CD2 3.63Å; L62-Y73 HydrophobicContact CD1-CE1 4.24Å; L62-Y73 HydrophobicContact CD1-CE2 4.25Å; L62-Y73 HydrophobicContact CD1-CG 3.26Å
63	F	95.9	Very high	97.6	Very high	19 Å²	19	66.1 Å²	66.1	8%	0.083	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-37.5	-174.6	-174.5	-91.1	0	0	0	113.7	Y58 K222 I223	Y58-F63 HydrophobicContact CE1-CD2 4.13Å; Y58-F63 PolarHBondContact O-N 2.91Å; F63-K222 VanDerWaalsContact CE1-C 3.49Å; F63-K222 VanDerWaalsContact CZ-O 3.25Å; F63-K222 WeakPolarHBondContact CZ-O 3.45Å; F63-I223 HydrophobicContact CB-CG1 4.27Å; F63-I223 HydrophobicContact CD1-CB 4.41Å; F63-I223 HydrophobicContact CD1-CG1 3.57Å; F63-I223 HydrophobicContact CD2-CG1 4.49Å; F63-I223 HydrophobicContact CE1-CB 4.47Å; F63-I223 HydrophobicContact CE1-CG1 4.01Å; F63-I223 HydrophobicContact CG-CG1 3.84Å
64	Y	96.1	Very high	97.7	Very high	152 Å²	152	63 Å²	63	60%	0.596	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	12.3	179.2	-63.6	-62.9	0	0	0	114	L62 G221 I223	L62-Y64 PolarHBondContact O-N 3.23Å; L62-Y64 VanDerWaalsContact O-N 3.15Å; Y64-G221 WeakPolarHBondContact CE1-O 3.25Å; Y64-I223 HydrophobicContact CE2-CD1 3.89Å; Y64-I223 HydrophobicContact CE2-CG1 3.83Å
65	K	97	Very high	97.7	Very high	113 Å²	113	61.7 Å²	61.7	49%	0.491	28%	0.28	S	S	.	.	S	Bend	trans	-95.7	169.1	-178.2	-61.1	-61.6	-175.9	179.8	0	111.3	Y61 L62 L69	Y61-K65 VanDerWaalsContact O-CG 3.29Å; Y61-K65 WeakPolarHBondContact O-CG 3.18Å; L62-K65 HydrophobicContact CD2-CG 4.28Å; L62-K65 WeakPolarHBondContact O-CB 3.41Å; L62-K65 PolarHBondContact O-N 2.87Å; K65-L69 HydrophobicContact CB-CD1 4.07Å
66	E	97	Very high	97.7	Very high	108 Å²	108	68.2 Å²	68.2	51%	0.505	31%	0.309	S	S	.	.			trans	-63.8	145.7	179.9	-57.2	90.2	164.4	0	0	111.9	Y68 L69 I70	E66-Y68 HydrophobicContact CB-CD1 3.49Å; E66-Y68 VanDerWaalsContact CB-CD1 3.49Å; E66-Y68 HydrophobicContact CB-CE1 3.46Å; E66-Y68 VanDerWaalsContact CB-CE1 3.46Å; E66-Y68 HydrophobicContact CG-CD1 4.35Å; E66-Y68 HydrophobicContact CG-CE1 3.91Å; E66-Y68 PolarHBondContact O-N 3.44Å; E66-Y68 VanDerWaalsContact O-N 3.07Å; E66-L69 WeakPolarHBondContact O-CB 3.31Å; E66-L69 PolarHBondContact O-N 3.43Å; E66-L69 WeakPolarHBondContact OE2-CD1 3.5Å; E66-I70 PolarHBondContact O-N 2.93Å
67	S	96.7	Very high	97.7	Very high	47 Å²	47	64.1 Å²	64.1	33%	0.329	29%	0.288	S	S	.	.	H	α-helix	trans	-52.4	-35.7	-177.7	-57.5	0	0	0	0	114	L69 I70 H71 V212	S67-L69 VanDerWaalsContact C-N 3.34Å; S67-L69 PolarHBondContact O-N 2.91Å; S67-I70 PolarHBondContact O-N 3.04Å; S67-H71 PolarHBondContact O-CD2 3.33Å; S67-H71 VanDerWaalsContact O-CG 3.25Å; S67-H71 PolarHBondContact O-N 3.27Å; S67-V212 VanDerWaalsContact CB-CG1 3.48Å
68	Y	97.3	Very high	97.7	Very high	127 Å²	127	59.8 Å²	59.8	50%	0.498	27%	0.269	S	S	.	.	H	α-helix	trans	-64.7	-36.2	-179.9	81.7	-90.5	0	0	0	112.5	E66 I70 H71 L72	E66-Y68 HydrophobicContact CB-CD1 3.49Å; E66-Y68 VanDerWaalsContact CB-CD1 3.49Å; E66-Y68 HydrophobicContact CB-CE1 3.46Å; E66-Y68 VanDerWaalsContact CB-CE1 3.46Å; E66-Y68 HydrophobicContact CG-CD1 4.35Å; E66-Y68 HydrophobicContact CG-CE1 3.91Å; E66-Y68 PolarHBondContact O-N 3.44Å; E66-Y68 VanDerWaalsContact O-N 3.07Å; Y68-I70 VanDerWaalsContact C-N 3.34Å; Y68-H71 PolarHBondContact O-N 3.14Å; Y68-L72 WeakPolarHBondContact O-CB 3.41Å; Y68-L72 PolarHBondContact O-N 3.27Å
69	L	98.2	Very high	97.6	Very high	50 Å²	50	61.9 Å²	61.9	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-67	-38.6	176	-69.6	176.8	0	0	0	110.9	K65 E66 S67 L72 Y73	K65-L69 HydrophobicContact CB-CD1 4.07Å; E66-L69 WeakPolarHBondContact O-CB 3.31Å; E66-L69 PolarHBondContact O-N 3.43Å; E66-L69 WeakPolarHBondContact OE2-CD1 3.5Å; S67-L69 VanDerWaalsContact C-N 3.34Å; S67-L69 PolarHBondContact O-N 2.91Å; L69-L72 PolarHBondContact O-N 3.48Å; L69-Y73 VanDerWaalsContact O-CB 3.29Å; L69-Y73 WeakPolarHBondContact O-CB 3.34Å; L69-Y73 PolarHBondContact O-N 3.24Å
70	I	98.4	Very high	97.7	Very high	1 Å²	1	62 Å²	62	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-67.2	-44.4	176.9	-59.4	169.1	0	0	0	110.4	Y58 L62 E66 S67 Y68 L72 Y73 H74 V212	Y58-I70 HydrophobicContact CD2-CG2 4.15Å; Y58-I70 HydrophobicContact CE2-CB 4.45Å; Y58-I70 HydrophobicContact CE2-CD1 4.02Å; Y58-I70 HydrophobicContact CE2-CG1 4Å; Y58-I70 HydrophobicContact CE2-CG2 3.63Å; L62-I70 HydrophobicContact CB-CG1 4.38Å; E66-I70 PolarHBondContact O-N 2.93Å; S67-I70 PolarHBondContact O-N 3.04Å; Y68-I70 VanDerWaalsContact C-N 3.34Å; I70-L72 VanDerWaalsContact C-N 3.34Å; I70-L72 PolarHBondContact O-N 2.98Å; I70-Y73 PolarHBondContact O-N 3.1Å; I70-H74 VanDerWaalsContact CG2-CE1 3.41Å; I70-H74 WeakPolarHBondContact CG2-CE1 3.35Å; I70-H74 WeakPolarHBondContact O-CB 3.35Å; I70-H74 VanDerWaalsContact O-CG 3.28Å; I70-H74 PolarHBondContact O-N 3.08Å; I70-V212 HydrophobicContact CB-CG1 3.93Å; I70-V212 HydrophobicContact CD1-CG1 4.14Å; I70-V212 WeakPolarHBondContact CD1-O 3.23Å; I70-V212 HydrophobicContact CG2-CB 4.34Å; I70-V212 HydrophobicContact CG2-CG1 4.01Å; I70-V212 HydrophobicContact CG2-CG2 3.85Å
71	H	98.5	Very high	97.7	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.032	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-41.6	175.3	-63.2	-44	0	0	0	112.3	S67 Y68 H74 T75 L185 E186 Y208	S67-H71 PolarHBondContact O-CD2 3.33Å; S67-H71 VanDerWaalsContact O-CG 3.25Å; S67-H71 PolarHBondContact O-N 3.27Å; Y68-H71 PolarHBondContact O-N 3.14Å; H71-H74 PolarHBondContact O-N 2.93Å; H71-T75 WeakPolarHBondContact O-CB 3.1Å; H71-T75 PolarHBondContact O-N 3.14Å; H71-T75 PolarHBondContact O-OG1 3.41Å; H71-L185 HydrophobicContact CB-CD1 4.01Å; H71-L185 HydrophobicContact CB-CD2 4.17Å; H71-L185 HydrophobicContact CB-CG 3.65Å; H71-E186 WeakPolarHBondContact NE2-CG 3.48Å; H71-Y208 AromaticContact CE1-CE1 3.64Å; H71-Y208 AromaticContact ND1-CE1 3.46Å; H71-Y208 WeakPolarHBondContact ND1-CE1 3.37Å; H71-Y208 AromaticContact ND1-CZ 3.57Å; H71-Y208 PolarHBondContact ND1-OH 2.8Å
72	L	98.6	Very high	97.7	Very high	98 Å²	98	49.2 Å²	49.2	51%	0.513	23%	0.233	S	C	.	.	H	α-helix	trans	-63.7	-44.4	176.6	-175.5	64.8	0	0	0	110.8	Y68 L69 I70 T75 F76 L185	Y68-L72 WeakPolarHBondContact O-CB 3.41Å; Y68-L72 PolarHBondContact O-N 3.27Å; L69-L72 PolarHBondContact O-N 3.48Å; I70-L72 VanDerWaalsContact C-N 3.34Å; I70-L72 PolarHBondContact O-N 2.98Å; L72-T75 PolarHBondContact O-N 2.85Å; L72-F76 VanDerWaalsContact O-CB 3.32Å; L72-F76 WeakPolarHBondContact O-CB 3.48Å; L72-F76 PolarHBondContact O-N 2.71Å; L72-L185 HydrophobicContact CB-CD1 4.5Å
73	Y	98.7	Very high	97.7	Very high	31 Å²	31	54.8 Å²	54.8	12%	0.122	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-49	176.3	178.5	-106.6	0	0	0	112.3	F54 F57 L62 L69 I70 T75 F76 T77 Y194	F54-Y73 WeakPolarHBondContact CA-OH 3.44Å; F54-Y73 VanDerWaalsContact CB-OH 3.32Å; F54-Y73 WeakPolarHBondContact CB-OH 3.41Å; F54-Y73 PolarHBondContact O-OH 3.17Å; F57-Y73 HydrophobicContact CD1-CD2 4.24Å; F57-Y73 AromaticContact CD1-CE2 3.48Å; F57-Y73 HydrophobicContact CD1-CE2 3.48Å; F57-Y73 VanDerWaalsContact CD1-CE2 3.48Å; F57-Y73 AromaticContact CD1-CZ 3.67Å; F57-Y73 HydrophobicContact CE1-CD2 4.23Å; F57-Y73 AromaticContact CE1-CE2 3.82Å; F57-Y73 HydrophobicContact CE1-CE2 3.82Å; F57-Y73 HydrophobicContact CG-CE2 4.42Å; L62-Y73 VanDerWaalsContact CD1-CB 3.49Å; L62-Y73 HydrophobicContact CD1-CD1 3.6Å; L62-Y73 HydrophobicContact CD1-CD2 3.63Å; L62-Y73 HydrophobicContact CD1-CE1 4.24Å; L62-Y73 HydrophobicContact CD1-CE2 4.25Å; L62-Y73 HydrophobicContact CD1-CG 3.26Å; L69-Y73 VanDerWaalsContact O-CB 3.29Å; L69-Y73 WeakPolarHBondContact O-CB 3.34Å; L69-Y73 PolarHBondContact O-N 3.24Å; I70-Y73 PolarHBondContact O-N 3.1Å; Y73-T75 VanDerWaalsContact C-N 3.34Å; Y73-T75 PolarHBondContact O-N 3.21Å; Y73-F76 PolarHBondContact O-N 2.98Å; Y73-T77 HydrophobicContact CD2-CG2 4.01Å; Y73-T77 HydrophobicContact CE1-CG2 4.21Å; Y73-T77 HydrophobicContact CE2-CG2 3.53Å; Y73-T77 WeakPolarHBondContact O-CB 3.46Å; Y73-T77 WeakPolarHBondContact O-CG2 3.18Å; Y73-T77 PolarHBondContact O-N 3.44Å; Y73-T77 PolarHBondContact O-OG1 3Å; Y73-Y194 HydrophobicContact CD1-CE1 4.19Å; Y73-Y194 HydrophobicContact CE1-CD1 4.36Å; Y73-Y194 AromaticContact CE1-CE1 3.63Å; Y73-Y194 HydrophobicContact CE1-CE1 3.63Å
74	H	98.6	Very high	97.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-44.8	175.8	-68.9	166.6	0	0	0	111.7	I70 H71 T77 G78 F193 Y194 Y208	I70-H74 VanDerWaalsContact CG2-CE1 3.41Å; I70-H74 WeakPolarHBondContact CG2-CE1 3.35Å; I70-H74 WeakPolarHBondContact O-CB 3.35Å; I70-H74 VanDerWaalsContact O-CG 3.28Å; I70-H74 PolarHBondContact O-N 3.08Å; H71-H74 PolarHBondContact O-N 2.93Å; H74-T77 PolarHBondContact O-OG1 3.37Å; H74-G78 PolarHBondContact O-N 3.41Å; H74-F193 AromaticContact CD2-CD2 3.82Å; H74-F193 AromaticContact CE1-CD2 3.76Å; H74-F193 AromaticContact CE1-CE2 3.98Å; H74-F193 AromaticContact CG-CD2 3.87Å; H74-F193 AromaticContact ND1-CD2 3.85Å; H74-F193 AromaticContact NE2-CD2 3.74Å; H74-F193 AromaticContact NE2-CE2 3.72Å; H74-Y194 AromaticContact CD2-CE1 3.53Å; H74-Y194 AromaticContact NE2-CE1 3.92Å; H74-Y208 AromaticContact ND1-CE2 3.35Å; H74-Y208 VanDerWaalsContact ND1-CE2 3.35Å; H74-Y208 WeakPolarHBondContact ND1-CE2 3.29Å; H74-Y208 AromaticContact ND1-CZ 3.65Å; H74-Y208 PolarHBondContact ND1-OH 3.43Å; H74-Y208 VanDerWaalsContact ND1-OH 3.11Å
75	T	98.6	Very high	97.6	Very high	18 Å²	18	50.2 Å²	50.2	11%	0.11	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-50.9	177.9	-57.3	0	0	0	0	111.3	H71 L72 Y73 L79 A188 G189 Y192	H71-T75 WeakPolarHBondContact O-CB 3.1Å; H71-T75 PolarHBondContact O-N 3.14Å; H71-T75 PolarHBondContact O-OG1 3.41Å; L72-T75 PolarHBondContact O-N 2.85Å; Y73-T75 VanDerWaalsContact C-N 3.34Å; Y73-T75 PolarHBondContact O-N 3.21Å; T75-L79 HydrophobicContact CG2-CD1 3.8Å; T75-L79 HydrophobicContact CG2-CG 4.47Å; T75-L79 WeakPolarHBondContact O-CB 3.45Å; T75-L79 VanDerWaalsContact O-CG 3.24Å; T75-L79 WeakPolarHBondContact O-CG 3.39Å; T75-L79 PolarHBondContact O-N 3.14Å; T75-A188 HydrophobicContact CG2-CB 3.88Å; T75-G189 VanDerWaalsContact OG1-CA 3.3Å; T75-G189 WeakPolarHBondContact OG1-CA 3.33Å; T75-G189 PolarHBondContact OG1-N 3.46Å; T75-G189 VanDerWaalsContact OG1-N 3.1Å; T75-Y192 HydrophobicContact CG2-CD2 4.34Å
76	F	98.5	Very high	97.5	Very high	138 Å²	138	46.2 Å²	46.2	61%	0.605	22%	0.22	S	C	*	.	H	α-helix	trans	-63.1	-52.5	-177.2	179.9	-99.1	0	0	0	111.8	L72 Y73 G78 L79 S80	L72-F76 VanDerWaalsContact O-CB 3.32Å; L72-F76 WeakPolarHBondContact O-CB 3.48Å; L72-F76 PolarHBondContact O-N 2.71Å; Y73-F76 PolarHBondContact O-N 2.98Å; F76-G78 PolarHBondContact O-N 3.18Å; F76-L79 PolarHBondContact O-N 2.76Å; F76-S80 PolarHBondContact O-N 3.29Å; F76-S80 PolarHBondContact O-OG 3.12Å
77	T	98.5	Very high	97.4	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-39.4	-179	50	0	0	0	0	112.7	F54 Y73 H74 S80 I81 Y194	F54-T77 HydrophobicContact CD1-CG2 4.14Å; F54-T77 HydrophobicContact CD2-CG2 4.2Å; F54-T77 HydrophobicContact CE1-CG2 4.27Å; F54-T77 HydrophobicContact CE2-CG2 4.32Å; F54-T77 HydrophobicContact CG-CG2 4.12Å; F54-T77 HydrophobicContact CZ-CG2 4.36Å; Y73-T77 HydrophobicContact CD2-CG2 4.01Å; Y73-T77 HydrophobicContact CE1-CG2 4.21Å; Y73-T77 HydrophobicContact CE2-CG2 3.53Å; Y73-T77 WeakPolarHBondContact O-CB 3.46Å; Y73-T77 WeakPolarHBondContact O-CG2 3.18Å; Y73-T77 PolarHBondContact O-N 3.44Å; Y73-T77 PolarHBondContact O-OG1 3Å; H74-T77 PolarHBondContact O-OG1 3.37Å; T77-S80 PolarHBondContact O-N 3.49Å; T77-I81 WeakPolarHBondContact O-CG1 3.21Å; T77-I81 PolarHBondContact O-N 3.36Å; T77-Y194 VanDerWaalsContact OG1-CD1 3.24Å; T77-Y194 WeakPolarHBondContact OG1-CD1 3.37Å
78	G	98	Very high	97.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.9	-38.9	173.9	0	0	0	0	0	113.7	H74 F76 S80 I81 A82 Y192	H74-G78 PolarHBondContact O-N 3.41Å; F76-G78 PolarHBondContact O-N 3.18Å; G78-S80 VanDerWaalsContact C-N 3.35Å; G78-I81 PolarHBondContact O-N 3.02Å; G78-A82 WeakPolarHBondContact O-CB 3.36Å; G78-A82 PolarHBondContact O-N 3.33Å; G78-Y192 WeakPolarHBondContact CA-O 3.34Å
79	L	97.8	Very high	97.2	Very high	46 Å²	46	43.9 Å²	43.9	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-39.5	173	-76.6	170.5	0	0	0	111.8	T75 F76 A82 Y83 L90 L94 Y192	T75-L79 HydrophobicContact CG2-CD1 3.8Å; T75-L79 HydrophobicContact CG2-CG 4.47Å; T75-L79 WeakPolarHBondContact O-CB 3.45Å; T75-L79 VanDerWaalsContact O-CG 3.24Å; T75-L79 WeakPolarHBondContact O-CG 3.39Å; T75-L79 PolarHBondContact O-N 3.14Å; F76-L79 PolarHBondContact O-N 2.76Å; L79-A82 PolarHBondContact O-N 3.12Å; L79-Y83 WeakPolarHBondContact O-CB 3.43Å; L79-Y83 PolarHBondContact O-N 3.22Å; L79-L90 HydrophobicContact CD2-CD1 4.12Å; L79-L94 HydrophobicContact CD2-CD2 3.89Å; L79-L94 HydrophobicContact CD2-CG 4.31Å; L79-Y192 HydrophobicContact CD2-CD1 4.2Å; L79-Y192 HydrophobicContact CD2-CD2 4.25Å; L79-Y192 HydrophobicContact CD2-CE1 3.71Å; L79-Y192 HydrophobicContact CD2-CE2 3.74Å; L79-Y192 HydrophobicContact CD2-CG 4.46Å; L79-Y192 VanDerWaalsContact CD2-CZ 3.46Å; L79-Y192 HydrophobicContact CG-CD1 4.33Å; L79-Y192 HydrophobicContact CG-CD2 4.19Å; L79-Y192 HydrophobicContact CG-CE1 4.34Å; L79-Y192 HydrophobicContact CG-CE2 4.17Å; L79-Y192 HydrophobicContact CG-CG 4.28Å
80	S	97.8	Very high	97	Very high	48 Å²	48	42.8 Å²	42.8	34%	0.336	21%	0.213	S	C	.	.	H	α-helix	trans	-60.8	-44.4	173.9	-53.9	0	0	0	0	111.5	F76 T77 G78 Y83 F84	F76-S80 PolarHBondContact O-N 3.29Å; F76-S80 PolarHBondContact O-OG 3.12Å; T77-S80 PolarHBondContact O-N 3.49Å; G78-S80 VanDerWaalsContact C-N 3.35Å; S80-Y83 PolarHBondContact O-N 3.07Å; S80-F84 WeakPolarHBondContact O-CB 3.42Å; S80-F84 PolarHBondContact O-N 3.12Å
81	I	97.4	Very high	96.9	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-45.3	173.7	-73.8	173	0	0	0	110.9	F54 T77 G78 Y83 F84 N85 F197 L198	F54-I81 HydrophobicContact CD2-CD1 4.21Å; F54-I81 HydrophobicContact CE2-CD1 3.88Å; F54-I81 HydrophobicContact CE2-CG1 4.06Å; T77-I81 WeakPolarHBondContact O-CG1 3.21Å; T77-I81 PolarHBondContact O-N 3.36Å; G78-I81 PolarHBondContact O-N 3.02Å; I81-Y83 PolarHBondContact O-N 2.84Å; I81-F84 PolarHBondContact O-N 3.34Å; I81-N85 PolarHBondContact O-N 3.28Å; I81-N85 VanDerWaalsContact O-N 3.16Å; I81-N85 PolarHBondContact O-ND2 2.98Å; I81-F197 HydrophobicContact CG2-CD1 4.06Å; I81-L198 HydrophobicContact CG2-CD1 3.47Å; I81-L198 VanDerWaalsContact CG2-CD1 3.47Å; I81-L198 HydrophobicContact CG2-CD2 3.96Å; I81-L198 HydrophobicContact CG2-CG 3.66Å
82	A	96.8	Very high	96.9	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-46.5	179.3	0	0	0	0	0	111.7	G78 L79 N85 F86 L90 Y192 F197	G78-A82 WeakPolarHBondContact O-CB 3.36Å; G78-A82 PolarHBondContact O-N 3.33Å; L79-A82 PolarHBondContact O-N 3.12Å; A82-N85 PolarHBondContact O-N 2.86Å; A82-F86 WeakPolarHBondContact O-CD2 3.42Å; A82-F86 PolarHBondContact O-N 3.17Å; A82-L90 HydrophobicContact CB-CB 4.08Å; A82-Y192 HydrophobicContact CB-CE1 4.5Å; A82-F197 HydrophobicContact CB-CD1 4.47Å; A82-F197 HydrophobicContact CB-CE1 3.5Å; A82-F197 VanDerWaalsContact CB-CE1 3.5Å; A82-F197 HydrophobicContact CB-CE2 4.45Å; A82-F197 HydrophobicContact CB-CZ 3.48Å; A82-F197 VanDerWaalsContact CB-CZ 3.48Å
83	Y	96.6	Very high	96.8	Very high	139 Å²	139	44.7 Å²	44.7	55%	0.545	22%	0.216	S	C	.	.	H	α-helix	trans	-64.4	-43.1	178.2	-174.7	-102	0	0	0	111.9	L79 S80 I81 N85 F86 G87 L90	L79-Y83 WeakPolarHBondContact O-CB 3.43Å; L79-Y83 PolarHBondContact O-N 3.22Å; S80-Y83 PolarHBondContact O-N 3.07Å; I81-Y83 PolarHBondContact O-N 2.84Å; Y83-N85 VanDerWaalsContact C-N 3.29Å; Y83-N85 PolarHBondContact O-N 2.69Å; Y83-F86 PolarHBondContact O-N 2.86Å; Y83-G87 WeakPolarHBondContact O-CA 3.4Å; Y83-G87 PolarHBondContact O-N 3.17Å; Y83-L90 HydrophobicContact CD2-CD2 3.62Å; Y83-L90 HydrophobicContact CG-CD2 4.11Å
84	F	96	Very high	96.7	Very high	61 Å²	61	46.4 Å²	46.4	27%	0.268	23%	0.227	S	C	.	.	H	α-helix	trans	-59.8	-38.8	178.1	177.3	-109.9	0	0	0	112.9	L28 R43 I46 S47 S80 I81	L28-F84 HydrophobicContact CD1-CE2 4.41Å; R43-F84 HydrophobicContact CB-CD1 4.38Å; R43-F84 HydrophobicContact CB-CE1 3.81Å; R43-F84 HydrophobicContact CB-CZ 4.32Å; R43-F84 HydrophobicContact CG-CE1 3.94Å; R43-F84 HydrophobicContact CG-CZ 3.94Å; R43-F84 PolarHBondContact NH1-O 3.32Å; I46-F84 HydrophobicContact CB-CE1 4.38Å; I46-F84 HydrophobicContact CG2-CE1 4.19Å; I46-F84 HydrophobicContact CG2-CZ 4.43Å; S47-F84 WeakPolarHBondContact OG-CD1 3.45Å; S80-F84 WeakPolarHBondContact O-CB 3.42Å; S80-F84 PolarHBondContact O-N 3.12Å; I81-F84 PolarHBondContact O-N 3.34Å
85	N	95.3	Very high	96.7	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.08	25%	0.245	C	C	.	.	H	α-helix	trans	-83.5	-36.5	-178.9	-72.9	-88	0	0	0	113.5	R43 L44 S47 I81 A82 Y83	R43-N85 VanDerWaalsContact C-OD1 3.28Å; R43-N85 PolarHBondContact O-OD1 3.33Å; L44-N85 PolarHBondContact N-OD1 3.47Å; S47-N85 PolarHBondContact OG-ND2 3.37Å; I81-N85 PolarHBondContact O-N 3.28Å; I81-N85 VanDerWaalsContact O-N 3.16Å; I81-N85 PolarHBondContact O-ND2 2.98Å; A82-N85 PolarHBondContact O-N 2.86Å; Y83-N85 VanDerWaalsContact C-N 3.29Å; Y83-N85 PolarHBondContact O-N 2.69Å
86	F	95.3	Very high	96.7	Very high	28 Å²	28	49 Å²	49	12%	0.123	24%	0.239	C	C	.	.	H	α-helix	trans	-128	-0.6	-165.7	-48.9	-65.2	0	0	0	114.4	A82 Y83 N88 Q89 I139 K140 W141 M143 P144 L198	A82-F86 WeakPolarHBondContact O-CD2 3.42Å; A82-F86 PolarHBondContact O-N 3.17Å; Y83-F86 PolarHBondContact O-N 2.86Å; F86-N88 PolarHBondContact O-N 3.47Å; F86-Q89 HydrophobicContact CB-CB 4.24Å; F86-Q89 WeakPolarHBondContact O-CB 3.43Å; F86-Q89 PolarHBondContact O-N 3.35Å; F86-Q89 VanDerWaalsContact O-N 3.15Å; F86-I139 HydrophobicContact CE1-CG2 4.28Å; F86-K140 VanDerWaalsContact CE1-O 3.29Å; F86-K140 WeakPolarHBondContact CE1-O 3.34Å; F86-W141 HydrophobicContact CB-CB 4.24Å; F86-W141 HydrophobicContact CD1-CB 4.19Å; F86-W141 HydrophobicContact CG-CB 4.11Å; F86-M143 HydrophobicContact CZ-CE 4.5Å; F86-P144 HydrophobicContact CD2-CG 4.34Å; F86-P144 HydrophobicContact CE2-CG 3.54Å; F86-P144 HydrophobicContact CZ-CG 3.83Å; F86-L198 HydrophobicContact CE2-CD2 3.77Å; F86-L198 HydrophobicContact CZ-CD2 4.14Å
87	G	94.7	Very high	96.7	Very high	22 Å²	22	42.5 Å²	42.5	23%	0.227	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	53.5	-132	-178.3	0	0	0	0	0	111.8	Y83 Q89 L90	Y83-G87 WeakPolarHBondContact O-CA 3.4Å; Y83-G87 PolarHBondContact O-N 3.17Å; G87-Q89 PolarHBondContact O-N 3.24Å; G87-Q89 VanDerWaalsContact O-N 3.14Å; G87-L90 WeakPolarHBondContact O-CD2 3.39Å; G87-L90 PolarHBondContact O-N 2.72Å
88	N	94.2	Very high	96.7	Very high	130 Å²	130	45.2 Å²	45.2	70%	0.695	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-61.9	-23.1	-177.9	-67.5	-23.2	0	0	0	113.5	F86 L90 Y91	F86-N88 PolarHBondContact O-N 3.47Å; N88-L90 PolarHBondContact O-N 2.63Å; N88-Y91 WeakPolarHBondContact O-CD1 3.41Å; N88-Y91 PolarHBondContact O-N 3.27Å; N88-Y91 VanDerWaalsContact O-N 3.15Å
89	Q	95.1	Very high	96.7	Very high	82 Å²	82	47.9 Å²	47.9	38%	0.383	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-63.3	-8	-178.9	-57.7	-71	26.8	0	0	113.8	F86 G87 Y91 H92 W141	F86-Q89 HydrophobicContact CB-CB 4.24Å; F86-Q89 WeakPolarHBondContact O-CB 3.43Å; F86-Q89 PolarHBondContact O-N 3.35Å; F86-Q89 VanDerWaalsContact O-N 3.15Å; G87-Q89 PolarHBondContact O-N 3.24Å; G87-Q89 VanDerWaalsContact O-N 3.14Å; Q89-Y91 PolarHBondContact O-N 3.05Å; Q89-Y91 VanDerWaalsContact O-N 3.13Å; Q89-Y91 VanDerWaalsContact OE1-CE1 3.26Å; Q89-H92 PolarHBondContact O-CD2 2.6Å; Q89-H92 PolarHBondContact O-N 2.93Å; Q89-H92 PolarHBondContact OE1-NE2 3.18Å; Q89-W141 HydrophobicContact CB-CB 4.02Å; Q89-W141 HydrophobicContact CB-CG 4.13Å
90	L	94.3	Very high	96.7	Very high	27 Å²	27	45.7 Å²	45.7	14%	0.141	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-58.9	-20.9	170.9	75	89.7	0	0	0	113	L79 A82 Y83 G87 N88 H92 S93 L94	L79-L90 HydrophobicContact CD2-CD1 4.12Å; A82-L90 HydrophobicContact CB-CB 4.08Å; Y83-L90 HydrophobicContact CD2-CD2 3.62Å; Y83-L90 HydrophobicContact CG-CD2 4.11Å; G87-L90 WeakPolarHBondContact O-CD2 3.39Å; G87-L90 PolarHBondContact O-N 2.72Å; N88-L90 PolarHBondContact O-N 2.63Å; L90-H92 PolarHBondContact O-N 3.41Å; L90-H92 VanDerWaalsContact O-N 3.12Å; L90-S93 PolarHBondContact O-N 3.38Å; L90-S93 PolarHBondContact O-OG 3.08Å; L90-L94 HydrophobicContact CD1-CD1 3.35Å; L90-L94 HydrophobicContact CD1-CG 3.84Å; L90-L94 PolarHBondContact O-N 3.3Å
91	Y	95.8	Very high	96.8	Very high	118 Å²	118	45.2 Å²	45.2	46%	0.463	22%	0.222	S	C	.	.	H	α-helix	trans	-54.4	-31.7	176.8	80.3	-100.6	0	0	0	112.5	N88 Q89 S93 L94 L95	N88-Y91 WeakPolarHBondContact O-CD1 3.41Å; N88-Y91 PolarHBondContact O-N 3.27Å; N88-Y91 VanDerWaalsContact O-N 3.15Å; Q89-Y91 PolarHBondContact O-N 3.05Å; Q89-Y91 VanDerWaalsContact O-N 3.13Å; Q89-Y91 VanDerWaalsContact OE1-CE1 3.26Å; Y91-S93 VanDerWaalsContact C-N 3.34Å; Y91-S93 PolarHBondContact O-N 3.04Å; Y91-L94 PolarHBondContact O-N 2.68Å; Y91-L95 WeakPolarHBondContact O-CB 3.31Å; Y91-L95 PolarHBondContact O-N 3.13Å
92	H	97.6	Very high	96.8	Very high	19 Å²	19	48.4 Å²	48.4	9%	0.088	24%	0.239	C	C	.	.	H	α-helix	trans	-56.9	-47.4	175.7	-71.9	-65.4	0	0	0	111.7	Q89 L90 C96 Y124 W141	Q89-H92 PolarHBondContact O-CD2 2.6Å; Q89-H92 PolarHBondContact O-N 2.93Å; Q89-H92 PolarHBondContact OE1-NE2 3.18Å; L90-H92 PolarHBondContact O-N 3.41Å; L90-H92 VanDerWaalsContact O-N 3.12Å; H92-C96 PolarHBondContact O-N 3.41Å; H92-Y124 HydrophobicContact CB-CE1 4.06Å; H92-Y124 AromaticContact ND1-CE1 3.6Å; H92-Y124 AromaticContact ND1-CZ 3.59Å; H92-Y124 PolarHBondContact ND1-OH 3.15Å; H92-W141 HydrophobicContact CB-CD2 4.07Å; H92-W141 HydrophobicContact CB-CE3 3.55Å; H92-W141 HydrophobicContact CB-CH2 4.04Å; H92-W141 HydrophobicContact CB-CZ2 4.49Å; H92-W141 HydrophobicContact CB-CZ3 3.54Å; H92-W141 AromaticContact CD2-CD1 3.88Å; H92-W141 AromaticContact CD2-CD2 3.38Å; H92-W141 AromaticContact CD2-CE2 3.26Å; H92-W141 AromaticContact CD2-CE3 3.82Å; H92-W141 AromaticContact CD2-CG 3.82Å; H92-W141 AromaticContact CD2-CZ2 3.62Å; H92-W141 AromaticContact CD2-NE1 3.55Å; H92-W141 AromaticContact CE1-CE2 3.95Å; H92-W141 AromaticContact CE1-CZ2 3.59Å; H92-W141 AromaticContact CG-CD2 3.82Å; H92-W141 AromaticContact CG-CE2 3.8Å; H92-W141 AromaticContact CG-CE3 3.75Å; H92-W141 AromaticContact CG-CH2 3.71Å; H92-W141 AromaticContact CG-CZ2 3.76Å; H92-W141 AromaticContact CG-CZ3 3.71Å; H92-W141 AromaticContact ND1-CH2 3.71Å; H92-W141 AromaticContact ND1-CZ2 3.74Å; H92-W141 AromaticContact NE2-CE2 3.39Å; H92-W141 AromaticContact NE2-CZ2 3.51Å; H92-W141 AromaticContact NE2-NE1 3.46Å; H92-W141 PolarHBondContact NE2-NE1 3.41Å
93	S	97.5	Very high	96.8	Very high	9 Å²	9	49.4 Å²	49.4	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-41.1	177.8	61.5	0	0	0	0	112.4	L90 Y91 C96 I97 Y192	L90-S93 PolarHBondContact O-N 3.38Å; L90-S93 PolarHBondContact O-OG 3.08Å; Y91-S93 VanDerWaalsContact C-N 3.34Å; Y91-S93 PolarHBondContact O-N 3.04Å; S93-C96 PolarHBondContact O-N 3.47Å; S93-I97 WeakPolarHBondContact O-CD1 3.45Å; S93-I97 VanDerWaalsContact O-CG1 3.25Å; S93-I97 WeakPolarHBondContact O-CG1 3.27Å; S93-I97 PolarHBondContact O-N 3.35Å; S93-Y192 WeakPolarHBondContact CB-OH 3.47Å; S93-Y192 PolarHBondContact OG-OH 3.35Å
94	L	97.5	Very high	96.9	Very high	66 Å²	66	42.9 Å²	42.9	35%	0.346	22%	0.218	S	C	.	.	H	α-helix	trans	-60.7	-47	177.2	-77.1	177.2	0	0	0	111.7	L79 L90 Y91 C96 I97 V98 Y192	L79-L94 HydrophobicContact CD2-CD2 3.89Å; L79-L94 HydrophobicContact CD2-CG 4.31Å; L90-L94 HydrophobicContact CD1-CD1 3.35Å; L90-L94 HydrophobicContact CD1-CG 3.84Å; L90-L94 PolarHBondContact O-N 3.3Å; Y91-L94 PolarHBondContact O-N 2.68Å; L94-C96 PolarHBondContact O-N 3.07Å; L94-I97 PolarHBondContact O-N 3.08Å; L94-V98 WeakPolarHBondContact O-CG2 3.31Å; L94-V98 PolarHBondContact O-N 3.31Å; L94-Y192 HydrophobicContact CD2-CE2 3.97Å; L94-Y192 WeakPolarHBondContact CD2-OH 3.26Å; L94-Y192 WeakPolarHBondContact CG-OH 3.31Å; L94-Y192 PolarHBondContact N-OH 2.85Å
95	L	98.1	Very high	96.9	Very high	72 Å²	72	45.4 Å²	45.4	38%	0.377	23%	0.226	S	C	.	.	H	α-helix	trans	-56.7	-50.8	178.5	178.3	65.3	0	0	0	110.8	Y91 I97 V98 L99 Y124	Y91-L95 WeakPolarHBondContact O-CB 3.31Å; Y91-L95 PolarHBondContact O-N 3.13Å; L95-I97 VanDerWaalsContact C-N 3.3Å; L95-I97 PolarHBondContact O-N 3.2Å; L95-V98 PolarHBondContact O-N 2.91Å; L95-L99 HydrophobicContact CD1-CD1 3.79Å; L95-L99 HydrophobicContact CD1-CG 4.09Å; L95-L99 HydrophobicContact CG-CD1 3.83Å; L95-L99 HydrophobicContact CG-CG 4.45Å; L95-L99 WeakPolarHBondContact O-CB 3.46Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.17Å; L95-L99 PolarHBondContact O-N 2.95Å; L95-Y124 HydrophobicContact CD2-CE2 3.81Å
96	C	98.4	Very high	96.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-35.6	179.6	-76.7	0	0	0	0	113.2	H92 S93 L94 Q100 Q121 Y124 H145 L152	H92-C96 PolarHBondContact O-N 3.41Å; S93-C96 PolarHBondContact O-N 3.47Å; L94-C96 PolarHBondContact O-N 3.07Å; C96-Q100 VanDerWaalsContact O-CB 3.25Å; C96-Q100 WeakPolarHBondContact O-CB 3.47Å; C96-Q100 PolarHBondContact O-N 3.2Å; C96-Q121 PolarHBondContact O-NE2 3Å; C96-Q121 PolarHBondContact SG-OE1 3.09Å; C96-Y124 VanDerWaalsContact SG-CD1 3.6Å; C96-H145 VanDerWaalsContact SG-CE1 3.54Å; C96-L152 HydrophobicContact CB-CD1 4.07Å
97	I	98.6	Very high	97	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-69.4	-46.3	177.6	-71.8	163.4	0	0	0	111.2	S93 L94 L95 Q100 F101 L148 L152 L184 V187 S191 Y192	S93-I97 WeakPolarHBondContact O-CD1 3.45Å; S93-I97 VanDerWaalsContact O-CG1 3.25Å; S93-I97 WeakPolarHBondContact O-CG1 3.27Å; S93-I97 PolarHBondContact O-N 3.35Å; L94-I97 PolarHBondContact O-N 3.08Å; L95-I97 VanDerWaalsContact C-N 3.3Å; L95-I97 PolarHBondContact O-N 3.2Å; I97-Q100 PolarHBondContact O-N 3.11Å; I97-F101 PolarHBondContact O-N 3.48Å; I97-L148 HydrophobicContact CD1-CD1 4.25Å; I97-L148 HydrophobicContact CD1-CD2 4.28Å; I97-L148 HydrophobicContact CG1-CD1 4.1Å; I97-L148 HydrophobicContact CG1-CD2 4.24Å; I97-L152 HydrophobicContact CG1-CD1 4.45Å; I97-L184 HydrophobicContact CG2-CD1 4.4Å; I97-V187 HydrophobicContact CG2-CG1 4.09Å; I97-S191 VanDerWaalsContact CD1-CB 3.42Å; I97-Y192 HydrophobicContact CD1-CD2 3.9Å; I97-Y192 HydrophobicContact CD1-CE1 4.43Å; I97-Y192 HydrophobicContact CD1-CE2 3.21Å
98	V	98.4	Very high	97	Very high	62 Å²	62	52.8 Å²	52.8	38%	0.376	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-47	178.2	171.8	0	0	0	0	110.3	L94 L95 Q100 F101 L102 L184	L94-V98 WeakPolarHBondContact O-CG2 3.31Å; L94-V98 PolarHBondContact O-N 3.31Å; L95-V98 PolarHBondContact O-N 2.91Å; V98-Q100 VanDerWaalsContact C-N 3.3Å; V98-Q100 PolarHBondContact O-N 2.83Å; V98-F101 WeakPolarHBondContact O-CB 3.32Å; V98-F101 PolarHBondContact O-N 2.96Å; V98-L102 HydrophobicContact CG1-CD1 4.19Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 3.1Å; V98-L184 HydrophobicContact CG2-CD1 4.47Å
99	L	98.1	Very high	97.1	Very high	55 Å²	55	50.7 Å²	50.7	29%	0.288	25%	0.247	S	C	.	.	H	α-helix	trans	-62	-38.9	176.5	-70.3	175.5	0	0	0	111.6	L95 F101 L102 I103 F120	L95-L99 HydrophobicContact CD1-CD1 3.79Å; L95-L99 HydrophobicContact CD1-CG 4.09Å; L95-L99 HydrophobicContact CG-CD1 3.83Å; L95-L99 HydrophobicContact CG-CG 4.45Å; L95-L99 WeakPolarHBondContact O-CB 3.46Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.17Å; L95-L99 PolarHBondContact O-N 2.95Å; L99-F101 PolarHBondContact O-N 3.38Å; L99-L102 HydrophobicContact CD2-CD1 4.5Å; L99-L102 PolarHBondContact O-N 3.49Å; L99-I103 VanDerWaalsContact O-CG1 3.28Å; L99-I103 WeakPolarHBondContact O-CG1 3.27Å; L99-I103 PolarHBondContact O-N 2.74Å; L99-F120 HydrophobicContact CB-CE1 4.28Å; L99-F120 HydrophobicContact CD1-CE1 3.65Å; L99-F120 HydrophobicContact CD1-CE2 3.89Å; L99-F120 HydrophobicContact CD1-CZ 3.19Å
100	Q	98.3	Very high	97.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-47.7	174.6	-170.9	61.2	45.1	0	0	111.5	C96 I97 V98 L102 I103 L104 T117 L152 L155	C96-Q100 VanDerWaalsContact O-CB 3.25Å; C96-Q100 WeakPolarHBondContact O-CB 3.47Å; C96-Q100 PolarHBondContact O-N 3.2Å; I97-Q100 PolarHBondContact O-N 3.11Å; V98-Q100 VanDerWaalsContact C-N 3.3Å; V98-Q100 PolarHBondContact O-N 2.83Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 PolarHBondContact O-N 3.26Å; Q100-I103 PolarHBondContact O-N 3.03Å; Q100-L104 HydrophobicContact CG-CD1 4.34Å; Q100-L104 VanDerWaalsContact O-CG 3.3Å; Q100-L104 WeakPolarHBondContact O-CG 3.33Å; Q100-L104 PolarHBondContact O-N 2.96Å; Q100-T117 PolarHBondContact NE2-OG1 3.34Å; Q100-L152 HydrophobicContact CB-CD1 4.21Å; Q100-L152 HydrophobicContact CB-CD2 4.06Å; Q100-L152 HydrophobicContact CB-CG 4.47Å; Q100-L152 HydrophobicContact CG-CB 4.01Å; Q100-L152 HydrophobicContact CG-CD2 3.89Å; Q100-L152 HydrophobicContact CG-CG 4.35Å; Q100-L155 HydrophobicContact CG-CD2 4.37Å
101	F	98.2	Very high	97.2	Very high	39 Å²	39	52.5 Å²	52.5	17%	0.171	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-44.7	176.7	168.1	-100.4	0	0	0	111.7	I97 V98 L99 L104 R105 L184	I97-F101 PolarHBondContact O-N 3.48Å; V98-F101 WeakPolarHBondContact O-CB 3.32Å; V98-F101 PolarHBondContact O-N 2.96Å; L99-F101 PolarHBondContact O-N 3.38Å; F101-L104 PolarHBondContact O-N 3.43Å; F101-R105 HydrophobicContact CD1-CG 4.48Å; F101-R105 HydrophobicContact CD2-CG 4.11Å; F101-R105 HydrophobicContact CE1-CG 4.08Å; F101-R105 HydrophobicContact CE2-CG 3.68Å; F101-R105 HydrophobicContact CG-CG 4.49Å; F101-R105 HydrophobicContact CZ-CG 3.67Å; F101-R105 WeakPolarHBondContact O-CB 3.12Å; F101-R105 VanDerWaalsContact O-CG 3.27Å; F101-R105 WeakPolarHBondContact O-CG 3.29Å; F101-R105 PolarHBondContact O-N 2.91Å; F101-L184 HydrophobicContact CB-CD1 3.79Å; F101-L184 HydrophobicContact CD1-CB 4.22Å; F101-L184 HydrophobicContact CD1-CD1 4.18Å; F101-L184 HydrophobicContact CD2-CB 3.94Å; F101-L184 HydrophobicContact CD2-CD1 4.47Å; F101-L184 HydrophobicContact CE1-CB 4.27Å; F101-L184 HydrophobicContact CE2-CB 3.99Å; F101-L184 VanDerWaalsContact CE2-N 3.27Å; F101-L184 HydrophobicContact CG-CB 4.05Å; F101-L184 HydrophobicContact CG-CD1 3.89Å; F101-L184 HydrophobicContact CZ-CB 4.15Å
102	L	98.1	Very high	97.3	Very high	70 Å²	70	50.6 Å²	50.6	37%	0.366	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-43	177.1	-67.2	175.9	0	0	0	112.1	V98 L99 Q100 L104 R105 L106	V98-L102 HydrophobicContact CG1-CD1 4.19Å; V98-L102 WeakPolarHBondContact O-CG 3.4Å; V98-L102 PolarHBondContact O-N 3.1Å; L99-L102 HydrophobicContact CD2-CD1 4.5Å; L99-L102 PolarHBondContact O-N 3.49Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 PolarHBondContact O-N 3.26Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-L104 PolarHBondContact O-N 3.45Å; L102-R105 PolarHBondContact O-N 3.09Å; L102-L106 HydrophobicContact CB-CD1 4.3Å; L102-L106 VanDerWaalsContact O-CB 3.28Å; L102-L106 WeakPolarHBondContact O-CB 3.48Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.34Å; L102-L106 PolarHBondContact O-N 3.29Å
103	I	97.9	Very high	97.3	Very high	20 Å²	20	49.8 Å²	49.8	10%	0.103	26%	0.258	C	S	.	.	H	α-helix	trans	-57.2	-48.9	175.2	-71.8	162.9	0	0	0	110.4	L99 Q100 R105 M107 A113 T116 T117	L99-I103 VanDerWaalsContact O-CG1 3.28Å; L99-I103 WeakPolarHBondContact O-CG1 3.27Å; L99-I103 PolarHBondContact O-N 2.74Å; Q100-I103 PolarHBondContact O-N 3.03Å; I103-R105 VanDerWaalsContact C-N 3.3Å; I103-R105 PolarHBondContact O-N 3.27Å; I103-M107 HydrophobicContact CB-SD 4.43Å; I103-M107 HydrophobicContact CG1-SD 4.36Å; I103-M107 HydrophobicContact CG2-SD 3.84Å; I103-M107 VanDerWaalsContact O-CB 3.27Å; I103-M107 WeakPolarHBondContact O-CB 3.1Å; I103-M107 PolarHBondContact O-N 2.83Å; I103-A113 HydrophobicContact CG2-CB 4.08Å; I103-T116 HydrophobicContact CD1-CG2 4.06Å; I103-T116 HydrophobicContact CG1-CG2 4.32Å; I103-T117 WeakPolarHBondContact CG2-OG1 3.24Å
104	L	97	Very high	97.3	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-35.6	-179.7	-62.4	173.9	0	0	0	112.6	Q100 F101 L102 G108 L155 A156 Y159	Q100-L104 HydrophobicContact CG-CD1 4.34Å; Q100-L104 VanDerWaalsContact O-CG 3.3Å; Q100-L104 WeakPolarHBondContact O-CG 3.33Å; Q100-L104 PolarHBondContact O-N 2.96Å; F101-L104 PolarHBondContact O-N 3.43Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-L104 PolarHBondContact O-N 3.45Å; L104-G108 WeakPolarHBondContact O-CA 3.38Å; L104-G108 PolarHBondContact O-N 3.39Å; L104-L155 HydrophobicContact CD1-CD2 3.76Å; L104-L155 HydrophobicContact CD1-CG 3.89Å; L104-A156 HydrophobicContact CD2-CB 4.19Å; L104-Y159 HydrophobicContact CB-CD1 4.41Å; L104-Y159 HydrophobicContact CB-CE1 4.33Å; L104-Y159 HydrophobicContact CD2-CD1 3.65Å; L104-Y159 HydrophobicContact CD2-CE1 4.36Å; L104-Y159 HydrophobicContact CD2-CG 4.24Å
105	R	96.2	Very high	97.3	Very high	115 Å²	115	52 Å²	52	43%	0.434	27%	0.27	S	S	.	.	H	α-helix	trans	-78.3	-44.7	-178.8	-72.7	-75.5	173.9	178.5	-3	113.1	F101 L102 I103 V181 P182	F101-R105 HydrophobicContact CD1-CG 4.48Å; F101-R105 HydrophobicContact CD2-CG 4.11Å; F101-R105 HydrophobicContact CE1-CG 4.08Å; F101-R105 HydrophobicContact CE2-CG 3.68Å; F101-R105 HydrophobicContact CG-CG 4.49Å; F101-R105 HydrophobicContact CZ-CG 3.67Å; F101-R105 WeakPolarHBondContact O-CB 3.12Å; F101-R105 VanDerWaalsContact O-CG 3.27Å; F101-R105 WeakPolarHBondContact O-CG 3.29Å; F101-R105 PolarHBondContact O-N 2.91Å; L102-R105 PolarHBondContact O-N 3.09Å; I103-R105 VanDerWaalsContact C-N 3.3Å; I103-R105 PolarHBondContact O-N 3.27Å; R105-V181 PolarHBondContact NH2-O 3.02Å; R105-V181 VanDerWaalsContact NH2-O 3.14Å; R105-P182 PolarHBondContact NE-O 3.07Å; R105-P182 PolarHBondContact NH2-O 3.32Å
106	L	96.7	Very high	97.3	Very high	141 Å²	141	51.1 Å²	51.1	74%	0.738	27%	0.267	S	S	*	.	H	α-helix	trans	-86.6	-36.2	-172.1	-60.8	176.6	0	0	0	112.5	L102	L102-L106 HydrophobicContact CB-CD1 4.3Å; L102-L106 VanDerWaalsContact O-CB 3.28Å; L102-L106 WeakPolarHBondContact O-CB 3.48Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.34Å; L102-L106 PolarHBondContact O-N 3.29Å
107	M	96.8	Very high	97.3	Very high	58 Å²	58	51.2 Å²	51.2	29%	0.286	27%	0.268	S	S	.	.	S	Bend	trans	-97.8	-10	-177.5	-53.7	177.7	68.1	0	0	113	I103 T110 T112 A113 T116	I103-M107 HydrophobicContact CB-SD 4.43Å; I103-M107 HydrophobicContact CG1-SD 4.36Å; I103-M107 HydrophobicContact CG2-SD 3.84Å; I103-M107 VanDerWaalsContact O-CB 3.27Å; I103-M107 WeakPolarHBondContact O-CB 3.1Å; I103-M107 PolarHBondContact O-N 2.83Å; M107-T110 VanDerWaalsContact O-CG2 3.25Å; M107-T110 WeakPolarHBondContact O-CG2 3.24Å; M107-T110 PolarHBondContact O-OG1 3.11Å; M107-T112 HydrophobicContact CE-CG2 3.51Å; M107-A113 HydrophobicContact CB-CB 3.74Å; M107-T116 HydrophobicContact CE-CG2 4.42Å; M107-T116 WeakPolarHBondContact CE-OG1 3.34Å; M107-T116 HydrophobicContact SD-CG2 4.06Å
108	G	94.2	Very high	97.3	Very high	21 Å²	21	54 Å²	54	22%	0.216	28%	0.28	C	S	.	.			trans	60.8	-150.7	175.9	0	0	0	0	0	113.8	L104 T110 A113	L104-G108 WeakPolarHBondContact O-CA 3.38Å; L104-G108 PolarHBondContact O-N 3.39Å; G108-T110 VanDerWaalsContact C-N 3.27Å; G108-T110 PolarHBondContact O-N 2.6Å; G108-T110 VanDerWaalsContact O-N 3.13Å; G108-A113 WeakPolarHBondContact O-CB 3.3Å
109	R	95.5	Very high	97.3	Very high	86 Å²	86	54.8 Å²	54.8	33%	0.325	29%	0.287	S	S	.	.	S	Bend	trans	-89	58.1	-177.9	-61.1	-172.8	174.9	155.1	0.8	111.9	Y159 F160 G162 I178 R179	R109-Y159 WeakPolarHBondContact CD-O 3.39Å; R109-Y159 HydrophobicContact CG-CD1 3.97Å; R109-Y159 HydrophobicContact CG-CD2 4.36Å; R109-Y159 HydrophobicContact CG-CE1 3.59Å; R109-Y159 HydrophobicContact CG-CE2 3.97Å; R109-Y159 HydrophobicContact CG-CG 4.36Å; R109-Y159 PolarHBondContact NE-O 3.12Å; R109-F160 WeakPolarHBondContact O-CD2 3.08Å; R109-G162 PolarHBondContact NH1-O 3.19Å; R109-G162 VanDerWaalsContact NH1-O 3.16Å; R109-I178 PolarHBondContact NH2-O 3.15Å; R109-R179 PolarHBondContact NH2-O 2.83Å
110	T	96.7	Very high	97.3	Very high	55 Å²	55	55.1 Å²	55.1	34%	0.337	29%	0.287	S	S	.	.			trans	-110.1	154	-177.8	59.4	0	0	0	0	111.6	M107 G108 T112 A113 V114	M107-T110 VanDerWaalsContact O-CG2 3.25Å; M107-T110 WeakPolarHBondContact O-CG2 3.24Å; M107-T110 PolarHBondContact O-OG1 3.11Å; G108-T110 VanDerWaalsContact C-N 3.27Å; G108-T110 PolarHBondContact O-N 2.6Å; G108-T110 VanDerWaalsContact O-N 3.13Å; T110-T112 PolarHBondContact O-N 2.73Å; T110-A113 WeakPolarHBondContact O-CB 3.49Å; T110-A113 PolarHBondContact O-N 2.67Å; T110-A113 VanDerWaalsContact O-N 3.17Å; T110-A113 PolarHBondContact OG1-N 2.93Å; T110-A113 VanDerWaalsContact OG1-N 3.14Å; T110-V114 PolarHBondContact O-N 3.43Å
111	I	96	Very high	97.3	Very high	92 Å²	92	55.1 Å²	55.1	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-31.5	169.7	-170.4	61.4	0	0	0	110.9	A113 V114 L115 F160	I111-A113 VanDerWaalsContact C-N 3.35Å; I111-A113 PolarHBondContact O-N 2.87Å; I111-V114 HydrophobicContact CD1-CB 4.42Å; I111-V114 WeakPolarHBondContact O-CB 3.29Å; I111-V114 PolarHBondContact O-N 2.66Å; I111-L115 HydrophobicContact CG1-CD1 4.31Å; I111-L115 HydrophobicContact CG1-CG 4.38Å; I111-L115 WeakPolarHBondContact O-CG 3.24Å; I111-L115 PolarHBondContact O-N 3.43Å; I111-F160 HydrophobicContact CB-CE2 4.42Å; I111-F160 HydrophobicContact CB-CZ 4.23Å; I111-F160 HydrophobicContact CD1-CE1 4.28Å; I111-F160 HydrophobicContact CD1-CZ 4.41Å
112	T	97.3	Very high	97.3	Very high	77 Å²	77	54 Å²	54	47%	0.472	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-43.5	174.5	-41.2	0	0	0	0	111.2	M107 T110 V114 L115 T116	M107-T112 HydrophobicContact CE-CG2 3.51Å; T110-T112 PolarHBondContact O-N 2.73Å; T112-V114 VanDerWaalsContact C-N 3.3Å; T112-V114 PolarHBondContact O-N 3.4Å; T112-L115 PolarHBondContact O-N 2.8Å; T112-T116 VanDerWaalsContact O-CB 3.31Å; T112-T116 WeakPolarHBondContact O-CB 3.44Å; T112-T116 PolarHBondContact O-N 3.29Å; T112-T116 PolarHBondContact O-OG1 3.26Å; T112-T116 VanDerWaalsContact O-OG1 3.05Å
113	A	97.5	Very high	97.4	Very high	3 Å²	3	53.4 Å²	53.4	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-39.6	175.7	0	0	0	0	0	112.4	I103 M107 G108 T110 I111 T117	I103-A113 HydrophobicContact CG2-CB 4.08Å; M107-A113 HydrophobicContact CB-CB 3.74Å; G108-A113 WeakPolarHBondContact O-CB 3.3Å; T110-A113 WeakPolarHBondContact O-CB 3.49Å; T110-A113 PolarHBondContact O-N 2.67Å; T110-A113 VanDerWaalsContact O-N 3.17Å; T110-A113 PolarHBondContact OG1-N 2.93Å; T110-A113 VanDerWaalsContact OG1-N 3.14Å; I111-A113 VanDerWaalsContact C-N 3.35Å; I111-A113 PolarHBondContact O-N 2.87Å; A113-T117 VanDerWaalsContact O-CB 3.25Å; A113-T117 WeakPolarHBondContact O-CB 3.43Å; A113-T117 PolarHBondContact O-N 3.44Å; A113-T117 PolarHBondContact O-OG1 3.35Å
114	V	98.1	Very high	97.4	Very high	20 Å²	20	54.8 Å²	54.8	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-48.4	176.4	176.1	0	0	0	0	110.9	T110 I111 T112 T117 F118 V157 F160	T110-V114 PolarHBondContact O-N 3.43Å; I111-V114 HydrophobicContact CD1-CB 4.42Å; I111-V114 WeakPolarHBondContact O-CB 3.29Å; I111-V114 PolarHBondContact O-N 2.66Å; T112-V114 VanDerWaalsContact C-N 3.3Å; T112-V114 PolarHBondContact O-N 3.4Å; V114-T117 PolarHBondContact O-N 2.97Å; V114-F118 WeakPolarHBondContact O-CB 3.26Å; V114-F118 PolarHBondContact O-N 2.82Å; V114-V157 HydrophobicContact CG1-CG2 3.79Å; V114-F160 HydrophobicContact CG2-CB 3.6Å; V114-F160 HydrophobicContact CG2-CD1 4.17Å; V114-F160 HydrophobicContact CG2-CG 3.87Å
115	L	97.9	Very high	97.4	Very high	101 Å²	101	54.7 Å²	54.7	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-65.6	-44.4	179.8	-67.8	176.3	0	0	0	111.8	I111 T112 T117 F118 C119	I111-L115 HydrophobicContact CG1-CD1 4.31Å; I111-L115 HydrophobicContact CG1-CG 4.38Å; I111-L115 WeakPolarHBondContact O-CG 3.24Å; I111-L115 PolarHBondContact O-N 3.43Å; T112-L115 PolarHBondContact O-N 2.8Å; L115-T117 VanDerWaalsContact C-N 3.35Å; L115-T117 PolarHBondContact O-N 3.36Å; L115-F118 PolarHBondContact O-N 3.13Å; L115-C119 WeakPolarHBondContact O-CB 3.35Å; L115-C119 PolarHBondContact O-N 3.3Å; L115-C119 PolarHBondContact O-SG 2.94Å; L115-C119 VanDerWaalsContact O-SG 3.32Å
116	T	98.4	Very high	97.5	Very high	54 Å²	54	51.2 Å²	51.2	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-60.9	-44.5	175.6	-65.1	0	0	0	0	111.1	I103 M107 T112 F120	I103-T116 HydrophobicContact CD1-CG2 4.06Å; I103-T116 HydrophobicContact CG1-CG2 4.32Å; M107-T116 HydrophobicContact CE-CG2 4.42Å; M107-T116 WeakPolarHBondContact CE-OG1 3.34Å; M107-T116 HydrophobicContact SD-CG2 4.06Å; T112-T116 VanDerWaalsContact O-CB 3.31Å; T112-T116 WeakPolarHBondContact O-CB 3.44Å; T112-T116 PolarHBondContact O-N 3.29Å; T112-T116 PolarHBondContact O-OG1 3.26Å; T112-T116 VanDerWaalsContact O-OG1 3.05Å; T116-F120 WeakPolarHBondContact O-CB 3.39Å; T116-F120 PolarHBondContact O-N 3.49Å
117	T	98.4	Very high	97.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-58.3	-51.7	173.7	-64.3	0	0	0	0	111	Q100 I103 A113 V114 L115 C119 F120 Q121 I153 A156	Q100-T117 PolarHBondContact NE2-OG1 3.34Å; I103-T117 WeakPolarHBondContact CG2-OG1 3.24Å; A113-T117 VanDerWaalsContact O-CB 3.25Å; A113-T117 WeakPolarHBondContact O-CB 3.43Å; A113-T117 PolarHBondContact O-N 3.44Å; A113-T117 PolarHBondContact O-OG1 3.35Å; V114-T117 PolarHBondContact O-N 2.97Å; L115-T117 VanDerWaalsContact C-N 3.35Å; L115-T117 PolarHBondContact O-N 3.36Å; T117-C119 PolarHBondContact O-N 3.23Å; T117-F120 PolarHBondContact O-N 3.41Å; T117-Q121 HydrophobicContact CG2-CG 3.98Å; T117-Q121 WeakPolarHBondContact O-CB 3.18Å; T117-Q121 WeakPolarHBondContact O-CG 3.38Å; T117-Q121 PolarHBondContact O-N 2.85Å; T117-I153 HydrophobicContact CG2-CG1 4.11Å; T117-A156 HydrophobicContact CG2-CB 3.74Å
118	F	98.3	Very high	97.5	Very high	62 Å²	62	43.9 Å²	43.9	27%	0.272	25%	0.25	S	S	.	.	H	α-helix	trans	-58.3	-52.3	-177.9	-174.1	-85	0	0	0	111.4	V114 L115 M122 I153 F349 F369	V114-F118 WeakPolarHBondContact O-CB 3.26Å; V114-F118 PolarHBondContact O-N 2.82Å; L115-F118 PolarHBondContact O-N 3.13Å; F118-M122 HydrophobicContact CD1-CG 4.44Å; F118-M122 HydrophobicContact CE1-CG 4.15Å; F118-M122 HydrophobicContact CE2-CG 4.49Å; F118-M122 HydrophobicContact CZ-CG 4.16Å; F118-M122 VanDerWaalsContact O-CB 3.27Å; F118-M122 WeakPolarHBondContact O-CB 3.22Å; F118-M122 VanDerWaalsContact O-CG 3.3Å; F118-M122 WeakPolarHBondContact O-CG 3.32Å; F118-M122 PolarHBondContact O-N 3.3Å; F118-M122 VanDerWaalsContact O-N 3.09Å; F118-I153 HydrophobicContact CD2-CD1 4Å; F118-I153 HydrophobicContact CD2-CG2 3.91Å; F118-I153 HydrophobicContact CE2-CD1 4.4Å; F118-F349 HydrophobicContact CE2-CD2 4.12Å; F118-F349 AromaticContact CE2-CE2 3.93Å; F118-F349 HydrophobicContact CE2-CE2 3.93Å; F118-F349 HydrophobicContact CZ-CD2 4.39Å; F118-F349 AromaticContact CZ-CE2 3.75Å; F118-F349 HydrophobicContact CZ-CE2 3.75Å; F118-F369 HydrophobicContact CE2-CD2 4.21Å; F118-F369 AromaticContact CE2-CE2 3.77Å; F118-F369 HydrophobicContact CE2-CE2 3.77Å; F118-F369 AromaticContact CZ-CD2 3.87Å; F118-F369 HydrophobicContact CZ-CD2 3.87Å; F118-F369 AromaticContact CZ-CE2 3.78Å; F118-F369 HydrophobicContact CZ-CE2 3.78Å
119	C	98.3	Very high	97.6	Very high	79 Å²	79	44.1 Å²	44.1	53%	0.534	25%	0.245	S	C	.	.	H	α-helix	trans	-62.9	-47.1	-179.4	-68.4	0	0	0	0	111.8	L115 T117 A123	L115-C119 WeakPolarHBondContact O-CB 3.35Å; L115-C119 PolarHBondContact O-N 3.3Å; L115-C119 PolarHBondContact O-SG 2.94Å; L115-C119 VanDerWaalsContact O-SG 3.32Å; T117-C119 PolarHBondContact O-N 3.23Å; C119-A123 WeakPolarHBondContact O-CB 3.34Å; C119-A123 PolarHBondContact O-N 2.84Å
120	F	98.4	Very high	97.6	Very high	61 Å²	61	48 Å²	48	27%	0.268	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-52.1	-178.5	178	-96.2	0	0	0	112	L99 T116 T117 M122 A123 Y124	L99-F120 HydrophobicContact CB-CE1 4.28Å; L99-F120 HydrophobicContact CD1-CE1 3.65Å; L99-F120 HydrophobicContact CD1-CE2 3.89Å; L99-F120 HydrophobicContact CD1-CZ 3.19Å; T116-F120 WeakPolarHBondContact O-CB 3.39Å; T116-F120 PolarHBondContact O-N 3.49Å; T117-F120 PolarHBondContact O-N 3.41Å; F120-M122 VanDerWaalsContact C-N 3.33Å; F120-M122 PolarHBondContact O-N 3.41Å; F120-A123 PolarHBondContact O-N 3.49Å; F120-Y124 HydrophobicContact CE2-CD2 4.4Å; F120-Y124 AromaticContact CZ-CD2 3.95Å; F120-Y124 HydrophobicContact CZ-CD2 3.95Å; F120-Y124 HydrophobicContact CZ-CG 4.47Å; F120-Y124 WeakPolarHBondContact O-CB 3.4Å; F120-Y124 PolarHBondContact O-N 3.15Å
121	Q	98.5	Very high	97.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-37.1	-175.3	-60.2	-65.5	-8.8	0	0	111.6	C96 T117 L125 T149 L152 I153	C96-Q121 PolarHBondContact O-NE2 3Å; C96-Q121 PolarHBondContact SG-OE1 3.09Å; T117-Q121 HydrophobicContact CG2-CG 3.98Å; T117-Q121 WeakPolarHBondContact O-CB 3.18Å; T117-Q121 WeakPolarHBondContact O-CG 3.38Å; T117-Q121 PolarHBondContact O-N 2.85Å; Q121-L125 WeakPolarHBondContact O-CB 3.3Å; Q121-L125 PolarHBondContact O-N 2.98Å; Q121-L125 VanDerWaalsContact O-N 3.16Å; Q121-T149 HydrophobicContact CB-CG2 3.95Å; Q121-L152 HydrophobicContact CG-CB 4.25Å; Q121-I153 HydrophobicContact CB-CD1 4.27Å; Q121-I153 HydrophobicContact CB-CG1 4.1Å; Q121-I153 HydrophobicContact CG-CG1 4.41Å
122	M	98.3	Very high	97.2	Very high	15 Å²	15	51.3 Å²	51.3	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-47.5	173.5	-71.5	-59.1	-59.9	0	0	111.8	F118 F120 Y124 L125 L126 T149 I153 F369 W373	F118-M122 HydrophobicContact CD1-CG 4.44Å; F118-M122 HydrophobicContact CE1-CG 4.15Å; F118-M122 HydrophobicContact CE2-CG 4.49Å; F118-M122 HydrophobicContact CZ-CG 4.16Å; F118-M122 VanDerWaalsContact O-CB 3.27Å; F118-M122 WeakPolarHBondContact O-CB 3.22Å; F118-M122 VanDerWaalsContact O-CG 3.3Å; F118-M122 WeakPolarHBondContact O-CG 3.32Å; F118-M122 PolarHBondContact O-N 3.3Å; F118-M122 VanDerWaalsContact O-N 3.09Å; F120-M122 VanDerWaalsContact C-N 3.33Å; F120-M122 PolarHBondContact O-N 3.41Å; M122-Y124 VanDerWaalsContact C-N 3.3Å; M122-Y124 PolarHBondContact O-N 3.04Å; M122-L125 PolarHBondContact O-N 3.27Å; M122-L126 WeakPolarHBondContact O-CB 3.43Å; M122-L126 VanDerWaalsContact O-CG 3.25Å; M122-L126 WeakPolarHBondContact O-CG 3.42Å; M122-L126 PolarHBondContact O-N 3.13Å; M122-T149 HydrophobicContact SD-CG2 3.75Å; M122-I153 HydrophobicContact CG-CD1 4.02Å; M122-I153 HydrophobicContact SD-CD1 4.21Å; M122-F369 HydrophobicContact CE-CD2 4.38Å; M122-F369 HydrophobicContact CE-CE2 3.97Å; M122-F369 HydrophobicContact CG-CE2 4.39Å; M122-F369 HydrophobicContact SD-CE2 3.68Å; M122-F369 HydrophobicContact SD-CZ 4.2Å; M122-W373 HydrophobicContact CE-CB 4.42Å
123	A	98.3	Very high	96.5	Very high	58 Å²	58	50 Å²	50	48%	0.479	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-40.8	179.4	0	0	0	0	0	111.9	C119 F120 L126 A127	C119-A123 WeakPolarHBondContact O-CB 3.34Å; C119-A123 PolarHBondContact O-N 2.84Å; F120-A123 PolarHBondContact O-N 3.49Å; A123-L126 PolarHBondContact O-N 3.4Å; A123-A127 VanDerWaalsContact O-CB 3.3Å; A123-A127 WeakPolarHBondContact O-CB 3.36Å; A123-A127 PolarHBondContact O-N 3.13Å
124	Y	98.4	Very high	95.8	Very high	50 Å²	50	52.6 Å²	52.6	20%	0.196	28%	0.278	C	S	.	.	H	α-helix	trans	-65.4	-43.3	177.6	-159.9	-87.6	0	0	0	112	H92 L95 C96 F120 M122 A127 G128 W141 H145	H92-Y124 HydrophobicContact CB-CE1 4.06Å; H92-Y124 AromaticContact ND1-CE1 3.6Å; H92-Y124 AromaticContact ND1-CZ 3.59Å; H92-Y124 PolarHBondContact ND1-OH 3.15Å; L95-Y124 HydrophobicContact CD2-CE2 3.81Å; C96-Y124 VanDerWaalsContact SG-CD1 3.6Å; F120-Y124 HydrophobicContact CE2-CD2 4.4Å; F120-Y124 AromaticContact CZ-CD2 3.95Å; F120-Y124 HydrophobicContact CZ-CD2 3.95Å; F120-Y124 HydrophobicContact CZ-CG 4.47Å; F120-Y124 WeakPolarHBondContact O-CB 3.4Å; F120-Y124 PolarHBondContact O-N 3.15Å; M122-Y124 VanDerWaalsContact C-N 3.3Å; M122-Y124 PolarHBondContact O-N 3.04Å; Y124-A127 PolarHBondContact O-N 3.32Å; Y124-G128 PolarHBondContact O-N 3.49Å; Y124-W141 HydrophobicContact CD1-CH2 4.4Å; Y124-W141 HydrophobicContact CE1-CH2 4.03Å; Y124-W141 HydrophobicContact CE1-CZ3 4.29Å; Y124-H145 AromaticContact CD1-NE2 3.6Å
125	L	98.2	Very high	94.7	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-47.1	174.8	178.5	64.6	0	0	0	111.6	Q121 M122 A127 G128 Y129 H145 C146 T149	Q121-L125 WeakPolarHBondContact O-CB 3.3Å; Q121-L125 PolarHBondContact O-N 2.98Å; Q121-L125 VanDerWaalsContact O-N 3.16Å; M122-L125 PolarHBondContact O-N 3.27Å; L125-A127 PolarHBondContact O-N 3.35Å; L125-G128 WeakPolarHBondContact O-CA 3.39Å; L125-G128 PolarHBondContact O-N 3.26Å; L125-G128 VanDerWaalsContact O-N 3.15Å; L125-Y129 HydrophobicContact CD1-CE1 4.12Å; L125-Y129 HydrophobicContact CD1-CE2 3.87Å; L125-Y129 HydrophobicContact CD2-CE2 3.97Å; L125-Y129 HydrophobicContact CG-CD2 4.16Å; L125-Y129 HydrophobicContact CG-CE2 3.58Å; L125-Y129 WeakPolarHBondContact O-CD2 3.31Å; L125-Y129 PolarHBondContact O-N 3.29Å; L125-H145 HydrophobicContact CD1-CB 4.42Å; L125-C146 HydrophobicContact CD1-CB 3.99Å; L125-C146 HydrophobicContact CD2-CB 4.01Å; L125-T149 HydrophobicContact CD2-CG2 4.14Å
126	L	97.8	Very high	93.7	Very high	41 Å²	41	53 Å²	53	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-39.6	179	-66.9	-179.3	0	0	0	112	M122 A123 G128 Y129 Y130 L372 L376	M122-L126 WeakPolarHBondContact O-CB 3.43Å; M122-L126 VanDerWaalsContact O-CG 3.25Å; M122-L126 WeakPolarHBondContact O-CG 3.42Å; M122-L126 PolarHBondContact O-N 3.13Å; A123-L126 PolarHBondContact O-N 3.4Å; L126-G128 VanDerWaalsContact C-N 3.34Å; L126-Y129 HydrophobicContact CD2-CD2 4.17Å; L126-Y129 PolarHBondContact O-N 3.13Å; L126-Y130 PolarHBondContact O-N 2.88Å; L126-L372 HydrophobicContact CD2-CB 4.49Å; L126-L372 WeakPolarHBondContact CD2-O 3.43Å; L126-L376 HydrophobicContact CD2-CD2 3.84Å; L126-L376 HydrophobicContact CD2-CG 4.37Å
127	A	97.6	Very high	92.7	Very high	39 Å²	39	54.9 Å²	54.9	32%	0.322	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-43.7	171.8	0	0	0	0	0	110.8	A123 Y124 L125 Y129 Y130 Y131	A123-A127 VanDerWaalsContact O-CB 3.3Å; A123-A127 WeakPolarHBondContact O-CB 3.36Å; A123-A127 PolarHBondContact O-N 3.13Å; Y124-A127 PolarHBondContact O-N 3.32Å; L125-A127 PolarHBondContact O-N 3.35Å; A127-Y129 VanDerWaalsContact C-N 3.32Å; A127-Y129 PolarHBondContact O-N 3.44Å; A127-Y130 WeakPolarHBondContact O-CB 3.34Å; A127-Y130 PolarHBondContact O-N 3.27Å; A127-Y130 VanDerWaalsContact O-N 3.1Å; A127-Y131 HydrophobicContact CB-CD2 4.46Å; A127-Y131 HydrophobicContact CB-CE2 4.41Å; A127-Y131 WeakPolarHBondContact O-CD2 3.39Å; A127-Y131 PolarHBondContact O-N 2.63Å
128	G	96.4	Very high	91.8	Very high	6 Å²	6	58 Å²	58	6%	0.062	31%	0.306	C	S	.	.	H	α-helix	trans	-54.5	-47.2	172.8	0	0	0	0	0	112.1	Y124 L125 L126 T132	Y124-G128 PolarHBondContact O-N 3.49Å; L125-G128 WeakPolarHBondContact O-CA 3.39Å; L125-G128 PolarHBondContact O-N 3.26Å; L125-G128 VanDerWaalsContact O-N 3.15Å; L126-G128 VanDerWaalsContact C-N 3.34Å; G128-T132 VanDerWaalsContact O-CB 3.3Å; G128-T132 WeakPolarHBondContact O-CB 3.22Å; G128-T132 WeakPolarHBondContact O-CG2 3.4Å; G128-T132 PolarHBondContact O-N 3.07Å; G128-T132 PolarHBondContact O-OG1 2.89Å
129	Y	95.4	Very high	91.2	Very high	26 Å²	26	56.1 Å²	56.1	10%	0.102	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-44.8	173.4	-64.9	-40.6	0	0	0	112.3	L125 L126 A127 Y131 T132 A133 T142 C146 W373	L125-Y129 HydrophobicContact CD1-CE1 4.12Å; L125-Y129 HydrophobicContact CD1-CE2 3.87Å; L125-Y129 HydrophobicContact CD2-CE2 3.97Å; L125-Y129 HydrophobicContact CG-CD2 4.16Å; L125-Y129 HydrophobicContact CG-CE2 3.58Å; L125-Y129 WeakPolarHBondContact O-CD2 3.31Å; L125-Y129 PolarHBondContact O-N 3.29Å; L126-Y129 HydrophobicContact CD2-CD2 4.17Å; L126-Y129 PolarHBondContact O-N 3.13Å; A127-Y129 VanDerWaalsContact C-N 3.32Å; A127-Y129 PolarHBondContact O-N 3.44Å; Y129-Y131 VanDerWaalsContact C-N 3.33Å; Y129-Y131 PolarHBondContact O-N 3.36Å; Y129-T132 PolarHBondContact O-N 3.46Å; Y129-A133 WeakPolarHBondContact O-CA 3.3Å; Y129-A133 WeakPolarHBondContact O-CB 3.49Å; Y129-A133 PolarHBondContact O-N 3.21Å; Y129-T142 HydrophobicContact CD1-CG2 4.11Å; Y129-T142 HydrophobicContact CE1-CG2 4.37Å; Y129-C146 WeakPolarHBondContact OH-CB 3.47Å; Y129-W373 VanDerWaalsContact CE2-O 3.27Å; Y129-W373 WeakPolarHBondContact CE2-O 3.16Å; Y129-W373 PolarHBondContact OH-O 3.46Å
130	Y	94.6	Very high	90.9	Very high	168 Å²	168	54.9 Å²	54.9	66%	0.659	28%	0.284	S	S	*	.	H	α-helix	trans	-57.9	-44.9	179.5	-179.8	-97.8	0	0	0	112.5	L126 A127 L376	L126-Y130 PolarHBondContact O-N 2.88Å; A127-Y130 WeakPolarHBondContact O-CB 3.34Å; A127-Y130 PolarHBondContact O-N 3.27Å; A127-Y130 VanDerWaalsContact O-N 3.1Å; Y130-L376 HydrophobicContact CD2-CD1 4.42Å
131	Y	93.9	Very high	90.7	Very high	187 Å²	187	52.9 Å²	52.9	73%	0.733	28%	0.275	S	S	*	.	H	α-helix	trans	-79.9	-18	-178.5	-71.3	-66.4	0	0	0	114.2	A127 Y129	A127-Y131 HydrophobicContact CB-CD2 4.46Å; A127-Y131 HydrophobicContact CB-CE2 4.41Å; A127-Y131 WeakPolarHBondContact O-CD2 3.39Å; A127-Y131 PolarHBondContact O-N 2.63Å; Y129-Y131 VanDerWaalsContact C-N 3.33Å; Y129-Y131 PolarHBondContact O-N 3.36Å
132	T	90.4	Very high	90.6	Very high	30 Å²	30	53.5 Å²	53.5	18%	0.184	28%	0.278	C	S	.	.	H	α-helix	trans	-120.7	-2.4	-174.5	70.2	0	0	0	0	114.2	G128 Y129 K140	G128-T132 VanDerWaalsContact O-CB 3.3Å; G128-T132 WeakPolarHBondContact O-CB 3.22Å; G128-T132 WeakPolarHBondContact O-CG2 3.4Å; G128-T132 PolarHBondContact O-N 3.07Å; G128-T132 PolarHBondContact O-OG1 2.89Å; Y129-T132 PolarHBondContact O-N 3.46Å; T132-K140 WeakPolarHBondContact O-CD 3.38Å; T132-K140 PolarHBondContact O-NZ 3.03Å
133	A	83.9	Confident	90.4	Very high	50 Å²	50	54.3 Å²	54.3	41%	0.413	28%	0.282	S	S	.	.			trans	-64.7	140.4	178.8	0	0	0	0	0	111.3	Y129	Y129-A133 WeakPolarHBondContact O-CA 3.3Å; Y129-A133 WeakPolarHBondContact O-CB 3.49Å; Y129-A133 PolarHBondContact O-N 3.21Å
134	T	82.8	Confident	90.3	Very high	56 Å²	56	51.8 Å²	51.8	34%	0.344	26%	0.261	S	S	.	.			trans	-129.8	172.6	169.8	63.8	0	0	0	0	108.3	N136 D138 H377	T134-N136 PolarHBondContact O-N 3.16Å; T134-N136 PolarHBondContact OG1-N 3.33Å; T134-N136 PolarHBondContact OG1-O 2.91Å; T134-N136 VanDerWaalsContact OG1-O 3.08Å; T134-D138 WeakPolarHBondContact CB-OD2 3.19Å; T134-D138 WeakPolarHBondContact CG2-OD2 3.3Å; T134-D138 PolarHBondContact OG1-OD2 3.08Å; T134-H377 PolarHBondContact O-CE1 3.41Å; T134-H377 VanDerWaalsContact O-CE1 3.31Å; T134-H377 PolarHBondContact O-NE2 3.44Å; T134-H377 VanDerWaalsContact O-NE2 3.11Å
135	G	74.4	Confident	90.2	Very high	29 Å²	29	49.5 Å²	49.5	30%	0.299	25%	0.252	S	S	.	.	S	Bend	trans	-72.5	-0.5	175.2	0	0	0	0	0	114.6	K446	G135-K446 PolarHBondContact O-NZ 2.95Å
136	N	76.4	Confident	90.2	Very high	101 Å²	101	50.3 Å²	50.3	54%	0.54	26%	0.258	S	S	.	.	S	Bend	trans	-129.5	165.8	-172.3	-62.9	-24.8	0	0	0	111	T134 D138 K446	T134-N136 PolarHBondContact O-N 3.16Å; T134-N136 PolarHBondContact OG1-N 3.33Å; T134-N136 PolarHBondContact OG1-O 2.91Å; T134-N136 VanDerWaalsContact OG1-O 3.08Å; N136-D138 PolarHBondContact O-N 2.76Å; N136-K446 PolarHBondContact OD1-NZ 2.97Å
137	Y	77.1	Confident	90.1	Very high	93 Å²	93	49 Å²	49	37%	0.365	25%	0.251	S	S	.	.			trans	-76.5	108.2	178.4	-178.5	-100.2	0	0	0	110.3	I139 F442	Y137-I139 HydrophobicContact CE1-CG1 4.04Å; Y137-F442 AromaticContact CD2-CZ 3.96Å; Y137-F442 HydrophobicContact CD2-CZ 3.96Å; Y137-F442 HydrophobicContact CG-CZ 4.43Å
138	D	80.9	Confident	90.2	Very high	68 Å²	68	47.4 Å²	47.4	36%	0.364	24%	0.237	S	C	.	.			trans	-113.1	137.8	177.3	-63.4	-35.9	0	0	0	112.2	T134 N136 K140	T134-D138 WeakPolarHBondContact CB-OD2 3.19Å; T134-D138 WeakPolarHBondContact CG2-OD2 3.3Å; T134-D138 PolarHBondContact OG1-OD2 3.08Å; N136-D138 PolarHBondContact O-N 2.76Å; D138-K140 HydrophobicContact CB-CD 3.97Å; D138-K140 HydrophobicContact CB-CG 3.87Å; D138-K140 PolarHBondContact O-N 3.22Å; D138-K140 VanDerWaalsContact OD2-CE 3.24Å; D138-K140 WeakPolarHBondContact OD2-CE 3.47Å; D138-K140 IonicContact OD2-NZ 3.82Å; D138-K140 PolarHBondContact OD2-NZ 2.68Å
139	I	85.2	Confident	90.3	Very high	22 Å²	22	47.1 Å²	47.1	11%	0.113	23%	0.234	C	C	.	.			trans	-85.6	104.9	170.6	-63.4	165.1	0	0	0	108.1	Q40 A41 L44 F86 Y137 M143	Q40-I139 HydrophobicContact CB-CB 3.88Å; Q40-I139 HydrophobicContact CB-CD1 4.43Å; Q40-I139 HydrophobicContact CB-CG2 4.26Å; A41-I139 HydrophobicContact CB-CD1 3.92Å; L44-I139 HydrophobicContact CB-CD1 4.42Å; L44-I139 HydrophobicContact CD2-CD1 3.8Å; L44-I139 HydrophobicContact CD2-CG1 4.46Å; F86-I139 HydrophobicContact CE1-CG2 4.28Å; Y137-I139 HydrophobicContact CE1-CG1 4.04Å; I139-M143 HydrophobicContact CG2-CE 4.04Å
140	K	92.4	Very high	90.4	Very high	52 Å²	52	46 Å²	46	23%	0.226	23%	0.23	C	C	.	.			trans	-125.9	171.1	-177	-63.5	-175.4	173.9	154.9	0	111	F86 T132 D138 T142 M143	F86-K140 VanDerWaalsContact CE1-O 3.29Å; F86-K140 WeakPolarHBondContact CE1-O 3.34Å; T132-K140 WeakPolarHBondContact O-CD 3.38Å; T132-K140 PolarHBondContact O-NZ 3.03Å; D138-K140 HydrophobicContact CB-CD 3.97Å; D138-K140 HydrophobicContact CB-CG 3.87Å; D138-K140 PolarHBondContact O-N 3.22Å; D138-K140 VanDerWaalsContact OD2-CE 3.24Å; D138-K140 WeakPolarHBondContact OD2-CE 3.47Å; D138-K140 IonicContact OD2-NZ 3.82Å; D138-K140 PolarHBondContact OD2-NZ 2.68Å; K140-T142 PolarHBondContact O-N 3.08Å; K140-M143 VanDerWaalsContact O-CB 3.24Å; K140-M143 WeakPolarHBondContact O-CB 3.48Å; K140-M143 PolarHBondContact O-N 3.17Å
141	W	94.6	Very high	90.6	Very high	20 Å²	20	38.1 Å²	38.1	8%	0.076	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-24.4	178.4	69.9	-99.2	0	0	0	112.8	F86 Q89 H92 Y124 M143 P144 H145	F86-W141 HydrophobicContact CB-CB 4.24Å; F86-W141 HydrophobicContact CD1-CB 4.19Å; F86-W141 HydrophobicContact CG-CB 4.11Å; Q89-W141 HydrophobicContact CB-CB 4.02Å; Q89-W141 HydrophobicContact CB-CG 4.13Å; H92-W141 HydrophobicContact CB-CD2 4.07Å; H92-W141 HydrophobicContact CB-CE3 3.55Å; H92-W141 HydrophobicContact CB-CH2 4.04Å; H92-W141 HydrophobicContact CB-CZ2 4.49Å; H92-W141 HydrophobicContact CB-CZ3 3.54Å; H92-W141 AromaticContact CD2-CD1 3.88Å; H92-W141 AromaticContact CD2-CD2 3.38Å; H92-W141 AromaticContact CD2-CE2 3.26Å; H92-W141 AromaticContact CD2-CE3 3.82Å; H92-W141 AromaticContact CD2-CG 3.82Å; H92-W141 AromaticContact CD2-CZ2 3.62Å; H92-W141 AromaticContact CD2-NE1 3.55Å; H92-W141 AromaticContact CE1-CE2 3.95Å; H92-W141 AromaticContact CE1-CZ2 3.59Å; H92-W141 AromaticContact CG-CD2 3.82Å; H92-W141 AromaticContact CG-CE2 3.8Å; H92-W141 AromaticContact CG-CE3 3.75Å; H92-W141 AromaticContact CG-CH2 3.71Å; H92-W141 AromaticContact CG-CZ2 3.76Å; H92-W141 AromaticContact CG-CZ3 3.71Å; H92-W141 AromaticContact ND1-CH2 3.71Å; H92-W141 AromaticContact ND1-CZ2 3.74Å; H92-W141 AromaticContact NE2-CE2 3.39Å; H92-W141 AromaticContact NE2-CZ2 3.51Å; H92-W141 AromaticContact NE2-NE1 3.46Å; H92-W141 PolarHBondContact NE2-NE1 3.41Å; Y124-W141 HydrophobicContact CD1-CH2 4.4Å; Y124-W141 HydrophobicContact CE1-CH2 4.03Å; Y124-W141 HydrophobicContact CE1-CZ3 4.29Å; W141-M143 PolarHBondContact O-N 3.38Å; W141-P144 VanDerWaalsContact O-CD 3.26Å; W141-P144 WeakPolarHBondContact O-CD 3.34Å; W141-P144 VanDerWaalsContact O-CG 3.28Å; W141-P144 WeakPolarHBondContact O-CG 3.35Å; W141-H145 HydrophobicContact CE3-CB 3.89Å; W141-H145 AromaticContact CE3-CG 3.96Å; W141-H145 AromaticContact CE3-ND1 4Å; W141-H145 HydrophobicContact CZ3-CB 3.92Å; W141-H145 AromaticContact CZ3-CD2 3.88Å; W141-H145 AromaticContact CZ3-CG 3.58Å; W141-H145 AromaticContact CZ3-ND1 3.7Å; W141-H145 WeakPolarHBondContact O-CB 3.47Å; W141-H145 PolarHBondContact O-N 3.2Å
142	T	95.1	Very high	90.8	Very high	12 Å²	12	29.2 Å²	29.2	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-23.2	175.8	50.7	0	0	0	0	113.3	Y129 K140 H145 C146	Y129-T142 HydrophobicContact CD1-CG2 4.11Å; Y129-T142 HydrophobicContact CE1-CG2 4.37Å; K140-T142 PolarHBondContact O-N 3.08Å; T142-H145 PolarHBondContact O-N 3.02Å; T142-C146 PolarHBondContact O-N 3.18Å
143	M	94.2	Very high	91.2	Very high	32 Å²	32	28 Å²	28	16%	0.158	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-55	-179.6	-173.7	-83.8	-72.8	0	0	112.9	L44 F86 I139 K140 W141 H145 C146 V199	L44-M143 HydrophobicContact CD1-CE 3.7Å; L44-M143 HydrophobicContact CD2-CE 4.13Å; F86-M143 HydrophobicContact CZ-CE 4.5Å; I139-M143 HydrophobicContact CG2-CE 4.04Å; K140-M143 VanDerWaalsContact O-CB 3.24Å; K140-M143 WeakPolarHBondContact O-CB 3.48Å; K140-M143 PolarHBondContact O-N 3.17Å; W141-M143 PolarHBondContact O-N 3.38Å; M143-H145 VanDerWaalsContact C-N 3.26Å; M143-H145 PolarHBondContact O-N 2.99Å; M143-C146 PolarHBondContact O-SG 3.1Å; M143-V199 HydrophobicContact CE-CG1 4.13Å; M143-V199 HydrophobicContact SD-CG1 3.89Å
144	P	95.9	Very high	91.9	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.032	14%	0.137	C	C	.	.	H	α-helix	trans	-68.7	-28.1	169.2	28.2	-37.3	0	0	0	112.6	F86 W141 C146 V147 L148 F197 L198	F86-P144 HydrophobicContact CD2-CG 4.34Å; F86-P144 HydrophobicContact CE2-CG 3.54Å; F86-P144 HydrophobicContact CZ-CG 3.83Å; W141-P144 VanDerWaalsContact O-CD 3.26Å; W141-P144 WeakPolarHBondContact O-CD 3.34Å; W141-P144 VanDerWaalsContact O-CG 3.28Å; W141-P144 WeakPolarHBondContact O-CG 3.35Å; P144-C146 VanDerWaalsContact C-N 3.31Å; P144-C146 PolarHBondContact O-N 2.88Å; P144-V147 PolarHBondContact O-N 2.88Å; P144-L148 PolarHBondContact O-N 2.85Å; P144-F197 HydrophobicContact CB-CE1 4.06Å; P144-F197 HydrophobicContact CB-CE2 4.23Å; P144-F197 HydrophobicContact CB-CZ 3.91Å; P144-F197 WeakPolarHBondContact CB-O 3.3Å; P144-F197 HydrophobicContact CG-CE1 4.32Å; P144-F197 HydrophobicContact CG-CZ 4.11Å; P144-L198 VanDerWaalsContact CA-O 3.31Å; P144-L198 WeakPolarHBondContact CA-O 3.42Å
145	H	97.4	Very high	92.6	Very high	3 Å²	3	23 Å²	23	1%	0.014	12%	0.121	C	C	.	.	H	α-helix	trans	-65.9	-33.5	-176.5	-156.7	88.5	0	0	0	112.3	C96 Y124 L125 W141 T142 M143 V147 L148 T149	C96-H145 VanDerWaalsContact SG-CE1 3.54Å; Y124-H145 AromaticContact CD1-NE2 3.6Å; L125-H145 HydrophobicContact CD1-CB 4.42Å; W141-H145 HydrophobicContact CE3-CB 3.89Å; W141-H145 AromaticContact CE3-CG 3.96Å; W141-H145 AromaticContact CE3-ND1 4Å; W141-H145 HydrophobicContact CZ3-CB 3.92Å; W141-H145 AromaticContact CZ3-CD2 3.88Å; W141-H145 AromaticContact CZ3-CG 3.58Å; W141-H145 AromaticContact CZ3-ND1 3.7Å; W141-H145 WeakPolarHBondContact O-CB 3.47Å; W141-H145 PolarHBondContact O-N 3.2Å; T142-H145 PolarHBondContact O-N 3.02Å; M143-H145 VanDerWaalsContact C-N 3.26Å; M143-H145 PolarHBondContact O-N 2.99Å; H145-V147 VanDerWaalsContact C-N 3.3Å; H145-V147 PolarHBondContact O-N 3.17Å; H145-L148 CarbonylContact O-C 3.19Å; H145-L148 WeakPolarHBondContact O-CB 3.23Å; H145-L148 PolarHBondContact O-N 3.32Å; H145-L148 VanDerWaalsContact O-N 3.15Å; H145-T149 PolarHBondContact O-N 3.37Å; H145-T149 PolarHBondContact O-OG1 3Å; H145-T149 VanDerWaalsContact O-OG1 3.09Å
146	C	96.8	Very high	93.7	Very high	17 Å²	17	21.8 Å²	21.8	12%	0.115	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-38.3	177.3	76.2	0	0	0	0	111.7	L125 Y129 T142 M143 P144 T149 L150 W373	L125-C146 HydrophobicContact CD1-CB 3.99Å; L125-C146 HydrophobicContact CD2-CB 4.01Å; Y129-C146 WeakPolarHBondContact OH-CB 3.47Å; T142-C146 PolarHBondContact O-N 3.18Å; M143-C146 PolarHBondContact O-SG 3.1Å; P144-C146 VanDerWaalsContact C-N 3.31Å; P144-C146 PolarHBondContact O-N 2.88Å; C146-T149 WeakPolarHBondContact O-CB 3.44Å; C146-T149 PolarHBondContact O-N 3.19Å; C146-L150 PolarHBondContact O-N 2.77Å; C146-W373 HydrophobicContact CB-CZ2 3.85Å; C146-W373 PolarHBondContact O-NE1 3.4Å; C146-W373 WeakPolarHBondContact SG-CZ2 3.45Å
147	V	96.9	Very high	94.8	Very high	13 Å²	13	17.6 Å²	17.6	8%	0.079	9%	0.086	C	C	.	.	H	α-helix	trans	-67.7	-41.1	173.5	178.2	0	0	0	0	110.7	P144 H145 T149 L150 K151	P144-V147 PolarHBondContact O-N 2.88Å; H145-V147 VanDerWaalsContact C-N 3.3Å; H145-V147 PolarHBondContact O-N 3.17Å; V147-T149 PolarHBondContact O-N 3.16Å; V147-L150 PolarHBondContact O-N 3.13Å; V147-K151 PolarHBondContact O-N 2.97Å
148	L	98.3	Very high	95.8	Very high	6 Å²	6	13.2 Å²	13.2	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-59.4	-44.4	175.5	-179.1	63.3	0	0	0	111.8	I97 P144 H145 L150 K151 L152	I97-L148 HydrophobicContact CD1-CD1 4.25Å; I97-L148 HydrophobicContact CD1-CD2 4.28Å; I97-L148 HydrophobicContact CG1-CD1 4.1Å; I97-L148 HydrophobicContact CG1-CD2 4.24Å; P144-L148 PolarHBondContact O-N 2.85Å; H145-L148 CarbonylContact O-C 3.19Å; H145-L148 WeakPolarHBondContact O-CB 3.23Å; H145-L148 PolarHBondContact O-N 3.32Å; H145-L148 VanDerWaalsContact O-N 3.15Å; L148-L150 VanDerWaalsContact C-N 3.29Å; L148-L150 PolarHBondContact O-N 2.87Å; L148-K151 WeakPolarHBondContact O-CB 3.38Å; L148-K151 PolarHBondContact O-N 2.82Å; L148-K151 VanDerWaalsContact O-N 3.07Å; L148-L152 HydrophobicContact CD1-CD1 3.97Å; L148-L152 HydrophobicContact CD1-CD2 4.13Å; L148-L152 HydrophobicContact CD1-CG 3.89Å; L148-L152 HydrophobicContact CD2-CD1 4.41Å; L148-L152 HydrophobicContact CG-CD1 3.85Å; L148-L152 HydrophobicContact CG-CG 4.15Å; L148-L152 WeakPolarHBondContact O-CG 3.49Å; L148-L152 PolarHBondContact O-N 3.13Å
149	T	98.5	Very high	96.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-52.6	-46.9	174.9	-64.3	0	0	0	0	111.2	Q121 M122 L125 H145 C146 V147 L152 I153	Q121-T149 HydrophobicContact CB-CG2 3.95Å; M122-T149 HydrophobicContact SD-CG2 3.75Å; L125-T149 HydrophobicContact CD2-CG2 4.14Å; H145-T149 PolarHBondContact O-N 3.37Å; H145-T149 PolarHBondContact O-OG1 3Å; H145-T149 VanDerWaalsContact O-OG1 3.09Å; C146-T149 WeakPolarHBondContact O-CB 3.44Å; C146-T149 PolarHBondContact O-N 3.19Å; V147-T149 PolarHBondContact O-N 3.16Å; T149-L152 PolarHBondContact O-N 2.73Å; T149-I153 HydrophobicContact CG2-CD1 3.76Å; T149-I153 WeakPolarHBondContact O-CB 3.38Å; T149-I153 VanDerWaalsContact O-CG1 3.26Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 3.46Å
150	L	98.4	Very high	97.1	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-65	-41.7	177	-58.2	-173.6	0	0	0	112.3	C146 V147 L148 G154 Q202 T341 W344 F369 W373	C146-L150 PolarHBondContact O-N 2.77Å; V147-L150 PolarHBondContact O-N 3.13Å; L148-L150 VanDerWaalsContact C-N 3.29Å; L148-L150 PolarHBondContact O-N 2.87Å; L150-G154 PolarHBondContact O-N 3Å; L150-Q202 HydrophobicContact CB-CG 4.32Å; L150-T341 HydrophobicContact CD1-CG2 3.92Å; L150-W344 HydrophobicContact CB-CD2 4.13Å; L150-W344 HydrophobicContact CB-CG 4.47Å; L150-W344 HydrophobicContact CB-CZ2 4.16Å; L150-W344 HydrophobicContact CD1-CD2 4.43Å; L150-W344 HydrophobicContact CD1-CE3 4.48Å; L150-W344 HydrophobicContact CD2-CD2 4.14Å; L150-W344 HydrophobicContact CD2-CE3 3.84Å; L150-W344 HydrophobicContact CD2-CH2 3.75Å; L150-W344 HydrophobicContact CD2-CZ2 4.01Å; L150-W344 HydrophobicContact CD2-CZ3 3.66Å; L150-W344 HydrophobicContact CG-CD2 4.46Å; L150-W344 WeakPolarHBondContact O-CZ2 3.33Å; L150-W344 PolarHBondContact O-NE1 3.31Å; L150-F369 HydrophobicContact CD2-CE1 4.11Å; L150-F369 HydrophobicContact CD2-CZ 3.81Å; L150-W373 HydrophobicContact CD1-CD2 4.49Å; L150-W373 HydrophobicContact CD1-CH2 4.38Å; L150-W373 HydrophobicContact CD1-CZ2 3.66Å; L150-W373 HydrophobicContact CD2-CG 4.35Å; L150-W373 HydrophobicContact CG-CZ2 4.2Å
151	K	98.3	Very high	97.3	Very high	3 Å²	3	9.1 Å²	9.1	1%	0.013	5%	0.047	C	C	.	.	H	α-helix	trans	-58.5	-47.6	176.5	-79.2	-173.7	175.2	-175.3	0	111.7	V147 L148 G154 L155 F190 S191	V147-K151 PolarHBondContact O-N 2.97Å; L148-K151 WeakPolarHBondContact O-CB 3.38Å; L148-K151 PolarHBondContact O-N 2.82Å; L148-K151 VanDerWaalsContact O-N 3.07Å; K151-G154 PolarHBondContact O-N 3.05Å; K151-L155 VanDerWaalsContact O-CB 3.32Å; K151-L155 WeakPolarHBondContact O-CB 3.42Å; K151-L155 PolarHBondContact O-N 2.88Å; K151-F190 HydrophobicContact CB-CE1 3.62Å; K151-F190 HydrophobicContact CB-CZ 3.61Å; K151-F190 HydrophobicContact CD-CE1 4.14Å; K151-F190 HydrophobicContact CD-CE2 4.09Å; K151-F190 HydrophobicContact CD-CZ 3.8Å; K151-F190 HydrophobicContact CG-CE1 4.09Å; K151-F190 HydrophobicContact CG-CE2 4.24Å; K151-F190 HydrophobicContact CG-CZ 3.6Å; K151-F190 PolarHBondContact NZ-O 3.07Å; K151-S191 PolarHBondContact NZ-O 3.4Å
152	L	98.6	Very high	97.4	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-72.7	-38.4	-176.3	-60.4	179.8	0	0	0	112.2	C96 I97 Q100 Q121 L148 T149 L155 A156 V187	C96-L152 HydrophobicContact CB-CD1 4.07Å; I97-L152 HydrophobicContact CG1-CD1 4.45Å; Q100-L152 HydrophobicContact CB-CD1 4.21Å; Q100-L152 HydrophobicContact CB-CD2 4.06Å; Q100-L152 HydrophobicContact CB-CG 4.47Å; Q100-L152 HydrophobicContact CG-CB 4.01Å; Q100-L152 HydrophobicContact CG-CD2 3.89Å; Q100-L152 HydrophobicContact CG-CG 4.35Å; Q121-L152 HydrophobicContact CG-CB 4.25Å; L148-L152 HydrophobicContact CD1-CD1 3.97Å; L148-L152 HydrophobicContact CD1-CD2 4.13Å; L148-L152 HydrophobicContact CD1-CG 3.89Å; L148-L152 HydrophobicContact CD2-CD1 4.41Å; L148-L152 HydrophobicContact CG-CD1 3.85Å; L148-L152 HydrophobicContact CG-CG 4.15Å; L148-L152 WeakPolarHBondContact O-CG 3.49Å; L148-L152 PolarHBondContact O-N 3.13Å; T149-L152 PolarHBondContact O-N 2.73Å; L152-L155 WeakPolarHBondContact O-CB 3.4Å; L152-L155 PolarHBondContact O-N 2.71Å; L152-A156 PolarHBondContact O-N 3.02Å; L152-A156 VanDerWaalsContact O-N 3.13Å; L152-V187 HydrophobicContact CD2-CG1 4.28Å
153	I	98.6	Very high	97.4	Very high	4 Å²	4	10 Å²	10	2%	0.021	7%	0.065	C	C	.	.	H	α-helix	trans	-63.5	-47.4	172.1	-67	169.8	0	0	0	110.7	T117 F118 Q121 M122 T149 L155 A156 V157 W344	T117-I153 HydrophobicContact CG2-CG1 4.11Å; F118-I153 HydrophobicContact CD2-CD1 4Å; F118-I153 HydrophobicContact CD2-CG2 3.91Å; F118-I153 HydrophobicContact CE2-CD1 4.4Å; Q121-I153 HydrophobicContact CB-CD1 4.27Å; Q121-I153 HydrophobicContact CB-CG1 4.1Å; Q121-I153 HydrophobicContact CG-CG1 4.41Å; M122-I153 HydrophobicContact CG-CD1 4.02Å; M122-I153 HydrophobicContact SD-CD1 4.21Å; T149-I153 HydrophobicContact CG2-CD1 3.76Å; T149-I153 WeakPolarHBondContact O-CB 3.38Å; T149-I153 VanDerWaalsContact O-CG1 3.26Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 3.46Å; I153-L155 VanDerWaalsContact C-N 3.31Å; I153-L155 PolarHBondContact O-N 2.94Å; I153-A156 PolarHBondContact O-N 3Å; I153-V157 WeakPolarHBondContact O-CG2 3.3Å; I153-V157 PolarHBondContact O-N 2.87Å; I153-V157 VanDerWaalsContact O-N 3.13Å; I153-W344 HydrophobicContact CB-CH2 4.32Å; I153-W344 HydrophobicContact CB-CZ2 3.87Å; I153-W344 HydrophobicContact CG2-CH2 3.86Å; I153-W344 HydrophobicContact CG2-CZ2 3.68Å
154	G	98.2	Very high	97.4	Very high	1 Å²	1	12 Å²	12	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-58.4	-43.4	177.4	0	0	0	0	0	112.1	L150 K151 A156 V157 D158	L150-G154 PolarHBondContact O-N 3Å; K151-G154 PolarHBondContact O-N 3.05Å; G154-A156 PolarHBondContact O-N 2.93Å; G154-V157 PolarHBondContact O-N 3.25Å; G154-D158 WeakPolarHBondContact O-CB 3.16Å; G154-D158 VanDerWaalsContact O-CG 3.3Å; G154-D158 PolarHBondContact O-N 3.27Å
155	L	98.4	Very high	97.3	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-56.8	-45.9	175.7	174.1	60.9	0	0	0	112.6	Q100 L104 K151 L152 I153 D158 Y159 I178 P182 V187 M205	Q100-L155 HydrophobicContact CG-CD2 4.37Å; L104-L155 HydrophobicContact CD1-CD2 3.76Å; L104-L155 HydrophobicContact CD1-CG 3.89Å; K151-L155 VanDerWaalsContact O-CB 3.32Å; K151-L155 WeakPolarHBondContact O-CB 3.42Å; K151-L155 PolarHBondContact O-N 2.88Å; L152-L155 WeakPolarHBondContact O-CB 3.4Å; L152-L155 PolarHBondContact O-N 2.71Å; I153-L155 VanDerWaalsContact C-N 3.31Å; I153-L155 PolarHBondContact O-N 2.94Å; L155-D158 PolarHBondContact O-N 2.94Å; L155-Y159 VanDerWaalsContact O-CB 3.3Å; L155-Y159 WeakPolarHBondContact O-CB 3.29Å; L155-Y159 PolarHBondContact O-N 3.26Å; L155-I178 HydrophobicContact CD1-CD1 3.47Å; L155-I178 VanDerWaalsContact CD1-CD1 3.47Å; L155-P182 HydrophobicContact CD1-CG 4.15Å; L155-V187 HydrophobicContact CD2-CG1 4.01Å; L155-V187 HydrophobicContact CD2-CG2 3.99Å; L155-M205 HydrophobicContact CD1-CB 3.8Å; L155-M205 HydrophobicContact CD1-CG 3.75Å; L155-M205 HydrophobicContact CD1-SD 4.49Å
156	A	98.3	Very high	97	Very high	3 Å²	3	18 Å²	18	3%	0.025	10%	0.104	C	C	.	.	H	α-helix	trans	-64.3	-41.5	178.5	0	0	0	0	0	112.4	L104 T117 L152 I153 G154 F160	L104-A156 HydrophobicContact CD2-CB 4.19Å; T117-A156 HydrophobicContact CG2-CB 3.74Å; L152-A156 PolarHBondContact O-N 3.02Å; L152-A156 VanDerWaalsContact O-N 3.13Å; I153-A156 PolarHBondContact O-N 3Å; G154-A156 PolarHBondContact O-N 2.93Å; A156-F160 WeakPolarHBondContact O-CB 3.49Å; A156-F160 PolarHBondContact O-N 3.26Å
157	V	97.9	Very high	96.8	Very high	13 Å²	13	24.2 Å²	24.2	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-66	-44.3	177.2	177.9	0	0	0	0	111.2	V114 I153 G154 Y159 F160 D161 Y348	V114-V157 HydrophobicContact CG1-CG2 3.79Å; I153-V157 WeakPolarHBondContact O-CG2 3.3Å; I153-V157 PolarHBondContact O-N 2.87Å; I153-V157 VanDerWaalsContact O-N 3.13Å; G154-V157 PolarHBondContact O-N 3.25Å; V157-Y159 VanDerWaalsContact C-N 3.35Å; V157-Y159 PolarHBondContact O-N 3.36Å; V157-F160 WeakPolarHBondContact O-CB 3.46Å; V157-F160 PolarHBondContact O-N 3Å; V157-D161 PolarHBondContact O-N 3.26Å; V157-Y348 HydrophobicContact CB-CD1 3.8Å; V157-Y348 HydrophobicContact CB-CE1 4.09Å; V157-Y348 HydrophobicContact CG1-CD1 3.81Å; V157-Y348 HydrophobicContact CG1-CE1 4.19Å; V157-Y348 HydrophobicContact CG2-CD1 4.24Å
158	D	97.9	Very high	96.6	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.011	16%	0.159	C	C	.	.	H	α-helix	trans	-65.5	-38.2	179.3	-73.9	-19.6	0	0	0	111.9	G154 L155 G162 Y176 A177 I178 Y348	G154-D158 WeakPolarHBondContact O-CB 3.16Å; G154-D158 VanDerWaalsContact O-CG 3.3Å; G154-D158 PolarHBondContact O-N 3.27Å; L155-D158 PolarHBondContact O-N 2.94Å; D158-G162 PolarHBondContact O-N 3.01Å; D158-Y176 WeakPolarHBondContact CB-O 3.36Å; D158-Y176 WeakPolarHBondContact OD1-CB 3.46Å; D158-A177 WeakPolarHBondContact O-CA 3.46Å; D158-I178 HydrophobicContact CB-CD1 3.66Å; D158-I178 HydrophobicContact CB-CG1 3.95Å; D158-I178 PolarHBondContact O-N 2.89Å; D158-Y348 VanDerWaalsContact CG-OH 3.25Å; D158-Y348 WeakPolarHBondContact OD1-CE1 3.38Å; D158-Y348 PolarHBondContact OD1-OH 2.83Å; D158-Y348 VanDerWaalsContact OD1-OH 3.11Å; D158-Y348 PolarHBondContact OD2-OH 3.13Å
159	Y	97.8	Very high	96.3	Very high	15 Å²	15	27.9 Å²	27.9	6%	0.059	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-38.7	174.1	179.8	-118.8	0	0	0	112.5	L104 R109 L155 V157 G162 G180 V181	L104-Y159 HydrophobicContact CB-CD1 4.41Å; L104-Y159 HydrophobicContact CB-CE1 4.33Å; L104-Y159 HydrophobicContact CD2-CD1 3.65Å; L104-Y159 HydrophobicContact CD2-CE1 4.36Å; L104-Y159 HydrophobicContact CD2-CG 4.24Å; R109-Y159 WeakPolarHBondContact CD-O 3.39Å; R109-Y159 HydrophobicContact CG-CD1 3.97Å; R109-Y159 HydrophobicContact CG-CD2 4.36Å; R109-Y159 HydrophobicContact CG-CE1 3.59Å; R109-Y159 HydrophobicContact CG-CE2 3.97Å; R109-Y159 HydrophobicContact CG-CG 4.36Å; R109-Y159 PolarHBondContact NE-O 3.12Å; L155-Y159 VanDerWaalsContact O-CB 3.3Å; L155-Y159 WeakPolarHBondContact O-CB 3.29Å; L155-Y159 PolarHBondContact O-N 3.26Å; V157-Y159 VanDerWaalsContact C-N 3.35Å; V157-Y159 PolarHBondContact O-N 3.36Å; Y159-G162 PolarHBondContact O-N 2.9Å; Y159-G180 WeakPolarHBondContact CE2-O 3.4Å; Y159-V181 HydrophobicContact CE2-CB 4.33Å; Y159-V181 HydrophobicContact CE2-CG1 4.34Å; Y159-V181 HydrophobicContact CE2-CG2 4.1Å; Y159-V181 VanDerWaalsContact OH-CG2 3.31Å; Y159-V181 WeakPolarHBondContact OH-CG2 3.41Å
160	F	97.2	Very high	96.1	Very high	40 Å²	40	30.4 Å²	30.4	18%	0.175	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-47.8	173.4	175	-117	0	0	0	111.9	R109 I111 V114 A156 V157 G162 G163	R109-F160 WeakPolarHBondContact O-CD2 3.08Å; I111-F160 HydrophobicContact CB-CE2 4.42Å; I111-F160 HydrophobicContact CB-CZ 4.23Å; I111-F160 HydrophobicContact CD1-CE1 4.28Å; I111-F160 HydrophobicContact CD1-CZ 4.41Å; V114-F160 HydrophobicContact CG2-CB 3.6Å; V114-F160 HydrophobicContact CG2-CD1 4.17Å; V114-F160 HydrophobicContact CG2-CG 3.87Å; A156-F160 WeakPolarHBondContact O-CB 3.49Å; A156-F160 PolarHBondContact O-N 3.26Å; V157-F160 WeakPolarHBondContact O-CB 3.46Å; V157-F160 PolarHBondContact O-N 3Å; F160-G162 VanDerWaalsContact C-N 3.26Å; F160-G162 PolarHBondContact O-N 3.25Å; F160-G163 PolarHBondContact O-N 3.3Å; F160-G163 VanDerWaalsContact O-N 3.12Å
161	D	97	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-29.6	178.1	-73.9	-22.4	0	0	0	112.2	V157 G163 K164 L169 A177 R352	V157-D161 PolarHBondContact O-N 3.26Å; D161-G163 PolarHBondContact O-N 2.96Å; D161-G163 VanDerWaalsContact O-N 3.12Å; D161-K164 PolarHBondContact O-N 2.84Å; D161-K164 VanDerWaalsContact O-N 3.07Å; D161-K164 IonicContact OD1-NZ 3.41Å; D161-K164 PolarHBondContact OD1-NZ 3.05Å; D161-L169 HydrophobicContact CB-CD1 4.38Å; D161-L169 HydrophobicContact CB-CD2 4.36Å; D161-A177 HydrophobicContact CB-CB 4.5Å; D161-R352 IonicContact OD1-NH1 3.55Å; D161-R352 PolarHBondContact OD1-NH1 2.83Å; D161-R352 IonicContact OD2-CZ 3.79Å; D161-R352 IonicContact OD2-NH1 3.66Å; D161-R352 PolarHBondContact OD2-NH1 3.42Å; D161-R352 IonicContact OD2-NH2 2.6Å; D161-R352 PolarHBondContact OD2-NH2 3.32Å
162	G	96.3	Very high	95.5	Very high	7 Å²	7	37.3 Å²	37.3	7%	0.072	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.7	172.1	0	0	0	0	0	115.6	R109 D158 Y159 F160	R109-G162 PolarHBondContact NH1-O 3.19Å; R109-G162 VanDerWaalsContact NH1-O 3.16Å; D158-G162 PolarHBondContact O-N 3.01Å; Y159-G162 PolarHBondContact O-N 2.9Å; F160-G162 VanDerWaalsContact C-N 3.26Å; F160-G162 PolarHBondContact O-N 3.25Å
163	G	94.9	Very high	95.3	Very high	44 Å²	44	39.1 Å²	39.1	45%	0.454	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-7.5	172.9	0	0	0	0	0	115.2	F160 D161	F160-G163 PolarHBondContact O-N 3.3Å; F160-G163 VanDerWaalsContact O-N 3.12Å; D161-G163 PolarHBondContact O-N 2.96Å; D161-G163 VanDerWaalsContact O-N 3.12Å
164	K	94.7	Very high	95.1	Very high	74 Å²	74	42.8 Å²	42.8	32%	0.322	25%	0.247	S	C	.	.	S	Bend	trans	-92.5	158.1	-177.5	-64.8	174.5	-177.1	162.3	0	111.4	D161 Q166 L169	D161-K164 PolarHBondContact O-N 2.84Å; D161-K164 VanDerWaalsContact O-N 3.07Å; D161-K164 IonicContact OD1-NZ 3.41Å; D161-K164 PolarHBondContact OD1-NZ 3.05Å; K164-Q166 PolarHBondContact O-N 3.47Å; K164-Q166 PolarHBondContact O-NE2 3.18Å; K164-Q166 VanDerWaalsContact O-NE2 3.11Å; K164-L169 HydrophobicContact CB-CD2 4.08Å; K164-L169 HydrophobicContact CB-CG 4.39Å; K164-L169 HydrophobicContact CD-CD2 3.82Å
165	D	93.6	Very high	94.9	Very high	100 Å²	100	48 Å²	48	54%	0.535	27%	0.27	S	S	.	.			trans	-57.4	128.7	168.1	174.3	38.4	0	0	0	110.1	N167 S168	D165-N167 VanDerWaalsContact C-N 3.29Å; D165-N167 PolarHBondContact O-N 2.99Å; D165-S168 WeakPolarHBondContact O-CB 2.87Å; D165-S168 PolarHBondContact O-N 3.14Å; D165-S168 VanDerWaalsContact O-N 3.15Å; D165-S168 PolarHBondContact O-OG 3.49Å
166	Q	89.7	Confident	94.7	Very high	35 Å²	35	49.8 Å²	49.8	16%	0.164	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-68.3	-31.7	-172.2	-61.2	-66.5	-79.3	0	0	111.7	K164 S168 L169 Q174 R179	K164-Q166 PolarHBondContact O-N 3.47Å; K164-Q166 PolarHBondContact O-NE2 3.18Å; K164-Q166 VanDerWaalsContact O-NE2 3.11Å; Q166-S168 PolarHBondContact O-N 2.85Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 PolarHBondContact O-N 3.05Å; Q166-L169 VanDerWaalsContact O-N 3.12Å; Q166-Q174 PolarHBondContact O-NE2 2.61Å; Q166-R179 VanDerWaalsContact OE1-NH2 3.09Å
167	N	92.4	Very high	94.6	Very high	146 Å²	146	50.1 Å²	50.1	78%	0.781	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-69.3	-22.3	178	-60.3	-40	0	0	0	112.3	D165 L169	D165-N167 VanDerWaalsContact C-N 3.29Å; D165-N167 PolarHBondContact O-N 2.99Å; N167-L169 VanDerWaalsContact C-N 3.34Å
168	S	92.9	Very high	94.5	Very high	83 Å²	83	50.4 Å²	50.4	58%	0.58	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-78.9	-16	173.8	78.8	0	0	0	0	114	D165 Q166	D165-S168 WeakPolarHBondContact O-CB 2.87Å; D165-S168 PolarHBondContact O-N 3.14Å; D165-S168 VanDerWaalsContact O-N 3.15Å; D165-S168 PolarHBondContact O-OG 3.49Å; Q166-S168 PolarHBondContact O-N 2.85Å
169	L	93.8	Very high	94.2	Very high	13 Å²	13	58.4 Å²	58.4	7%	0.068	31%	0.31	C	S	.	.	S	Bend	trans	-88.2	146.2	-177.7	-64.8	-178.3	0	0	0	111.1	D161 K164 Q166 N167 Q173 Q174	D161-L169 HydrophobicContact CB-CD1 4.38Å; D161-L169 HydrophobicContact CB-CD2 4.36Å; K164-L169 HydrophobicContact CB-CD2 4.08Å; K164-L169 HydrophobicContact CB-CG 4.39Å; K164-L169 HydrophobicContact CD-CD2 3.82Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 PolarHBondContact O-N 3.05Å; Q166-L169 VanDerWaalsContact O-N 3.12Å; N167-L169 VanDerWaalsContact C-N 3.34Å; L169-Q173 HydrophobicContact CB-CB 3.91Å; L169-Q173 HydrophobicContact CD1-CB 4.33Å; L169-Q173 HydrophobicContact CD2-CB 4.12Å; L169-Q173 HydrophobicContact CG-CB 4.35Å; L169-Q174 HydrophobicContact CB-CG 3.72Å; L169-Q174 HydrophobicContact CD1-CG 4.43Å; L169-Q174 PolarHBondContact O-NE2 3.45Å; L169-Q174 VanDerWaalsContact O-NE2 3.15Å
170	S	93.5	Very high	93.8	Very high	54 Å²	54	59.9 Å²	59.9	38%	0.378	33%	0.33	S	S	.	.			trans	-62.1	153.8	164.5	63.4	0	0	0	0	110.9	E172 Q173 Q174	S170-E172 PolarHBondContact O-N 3.48Å; S170-E172 VanDerWaalsContact O-N 3.1Å; S170-Q173 WeakPolarHBondContact O-CB 3.48Å; S170-Q173 PolarHBondContact O-N 3.44Å; S170-Q173 VanDerWaalsContact OG-CD 3.27Å; S170-Q173 WeakPolarHBondContact OG-CG 3.32Å; S170-Q173 PolarHBondContact OG-N 3.29Å; S170-Q173 PolarHBondContact OG-OE1 2.83Å; S170-Q174 WeakPolarHBondContact O-CG 3.44Å; S170-Q174 PolarHBondContact O-N 2.92Å
171	S	93.1	Very high	93.5	Very high	98 Å²	98	60.7 Å²	60.7	69%	0.685	34%	0.338	S	S	*	.	H	α-helix	trans	-52.4	-35.1	175.6	55.5	0	0	0	0	112.9	K175	S171-K175 PolarHBondContact O-N 2.87Å
172	E	91.1	Very high	93.4	Very high	50 Å²	50	61 Å²	61	23%	0.234	34%	0.34	C	S	.	.	H	α-helix	trans	-69	-39.6	175.6	-170.1	173.6	-146	0	0	112.6	S170 Y176 R347 K351	S170-E172 PolarHBondContact O-N 3.48Å; S170-E172 VanDerWaalsContact O-N 3.1Å; E172-Y176 WeakPolarHBondContact O-CD2 3.29Å; E172-R347 HydrophobicContact CG-CG 4.2Å; E172-R347 IonicContact OE1-CZ 3.42Å; E172-R347 IonicContact OE1-NH1 3.04Å; E172-R347 PolarHBondContact OE1-NH1 2.88Å; E172-R347 IonicContact OE1-NH2 2.6Å; E172-K351 IonicContact OE1-NZ 3.6Å; E172-K351 VanDerWaalsContact OE2-CD 3.31Å; E172-K351 WeakPolarHBondContact OE2-CD 3.4Å; E172-K351 IonicContact OE2-NZ 2.72Å; E172-K351 PolarHBondContact OE2-NZ 2.94Å
173	Q	94.6	Very high	93.5	Very high	38 Å²	38	62.6 Å²	62.6	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-67.9	-42.6	175.5	-75.7	160.6	-44.3	0	0	111.5	L169 S170 K175 Y176 A177	L169-Q173 HydrophobicContact CB-CB 3.91Å; L169-Q173 HydrophobicContact CD1-CB 4.33Å; L169-Q173 HydrophobicContact CD2-CB 4.12Å; L169-Q173 HydrophobicContact CG-CB 4.35Å; S170-Q173 WeakPolarHBondContact O-CB 3.48Å; S170-Q173 PolarHBondContact O-N 3.44Å; S170-Q173 VanDerWaalsContact OG-CD 3.27Å; S170-Q173 WeakPolarHBondContact OG-CG 3.32Å; S170-Q173 PolarHBondContact OG-N 3.29Å; S170-Q173 PolarHBondContact OG-OE1 2.83Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.4Å; Q173-Y176 PolarHBondContact O-N 2.93Å; Q173-Y176 VanDerWaalsContact O-N 3.17Å; Q173-A177 WeakPolarHBondContact O-CB 3.05Å; Q173-A177 PolarHBondContact O-N 3.3Å
174	Q	94.4	Very high	93.6	Very high	82 Å²	82	64 Å²	64	38%	0.383	35%	0.347	S	S	.	.	H	α-helix	trans	-56.9	-40.7	177.9	-66.5	173.6	7.5	0	0	112	Q166 L169 S170 Y176	Q166-Q174 PolarHBondContact O-NE2 2.61Å; L169-Q174 HydrophobicContact CB-CG 3.72Å; L169-Q174 HydrophobicContact CD1-CG 4.43Å; L169-Q174 PolarHBondContact O-NE2 3.45Å; L169-Q174 VanDerWaalsContact O-NE2 3.15Å; S170-Q174 WeakPolarHBondContact O-CG 3.44Å; S170-Q174 PolarHBondContact O-N 2.92Å; Q174-Y176 VanDerWaalsContact C-N 3.25Å; Q174-Y176 PolarHBondContact O-N 3.29Å
175	K	92.9	Very high	93.8	Very high	110 Å²	110	63.3 Å²	63.3	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-30.9	-179.7	175.9	173.5	170.3	175.5	0	113.5	S171 Q173	S171-K175 PolarHBondContact O-N 2.87Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.4Å
176	Y	95.1	Very high	94	Very high	39 Å²	39	60.8 Å²	60.8	15%	0.153	33%	0.331	C	S	.	.	H	α-helix	trans	-109	-15.9	-172	-67.7	-100.3	0	0	0	113.5	D158 E172 Q173 Q174 I178 S204 R347	D158-Y176 WeakPolarHBondContact CB-O 3.36Å; D158-Y176 WeakPolarHBondContact OD1-CB 3.46Å; E172-Y176 WeakPolarHBondContact O-CD2 3.29Å; Q173-Y176 PolarHBondContact O-N 2.93Å; Q173-Y176 VanDerWaalsContact O-N 3.17Å; Q174-Y176 VanDerWaalsContact C-N 3.25Å; Q174-Y176 PolarHBondContact O-N 3.29Å; Y176-I178 PolarHBondContact O-N 3.47Å; Y176-S204 VanDerWaalsContact CD1-OG 3.29Å; Y176-S204 WeakPolarHBondContact CD1-OG 3.48Å; Y176-S204 WeakPolarHBondContact CE1-OG 3.25Å; Y176-R347 VanDerWaalsContact CZ-NH1 3.26Å; Y176-R347 PolarHBondContact OH-NH2 3.49Å; Y176-R347 VanDerWaalsContact OH-NH2 3.08Å
177	A	95.6	Very high	94.4	Very high	9 Å²	9	59.1 Å²	59.1	7%	0.074	32%	0.323	C	S	.	.			trans	-51.8	132.6	-179	0	0	0	0	0	113	D158 D161 Q173	D158-A177 WeakPolarHBondContact O-CA 3.46Å; D161-A177 HydrophobicContact CB-CB 4.5Å; Q173-A177 WeakPolarHBondContact O-CB 3.05Å; Q173-A177 PolarHBondContact O-N 3.3Å
178	I	95.6	Very high	94.7	Very high	19 Å²	19	52.7 Å²	52.7	10%	0.097	29%	0.291	C	S	.	.			trans	-106.8	109.9	-178.1	-61.7	163.9	0	0	0	109.5	R109 L155 D158 Y176 G180 P182 M205	R109-I178 PolarHBondContact NH2-O 3.15Å; L155-I178 HydrophobicContact CD1-CD1 3.47Å; L155-I178 VanDerWaalsContact CD1-CD1 3.47Å; D158-I178 HydrophobicContact CB-CD1 3.66Å; D158-I178 HydrophobicContact CB-CG1 3.95Å; D158-I178 PolarHBondContact O-N 2.89Å; Y176-I178 PolarHBondContact O-N 3.47Å; I178-G180 WeakPolarHBondContact CG2-O 3.41Å; I178-P182 HydrophobicContact CG2-CG 4.2Å; I178-M205 HydrophobicContact CD1-CB 3.69Å; I178-M205 HydrophobicContact CD1-CG 3.86Å
179	R	91.8	Very high	95	Very high	170 Å²	170	48.7 Å²	48.7	64%	0.642	26%	0.263	S	S	*	.			trans	-88.6	-20.3	-175.9	-61.3	-174.4	-174.5	-180	3.7	114.6	R109 Q166	R109-R179 PolarHBondContact NH2-O 2.83Å; Q166-R179 VanDerWaalsContact OE1-NH2 3.09Å
180	G	90.4	Very high	95.2	Very high	46 Å²	46	48.1 Å²	48.1	47%	0.474	26%	0.26	S	S	.	.	S	Bend	trans	-86.7	161.7	170.9	0	0	0	0	0	111.1	Y159 I178 P182	Y159-G180 WeakPolarHBondContact CE2-O 3.4Å; I178-G180 WeakPolarHBondContact CG2-O 3.41Å; G180-P182 WeakPolarHBondContact O-CD 3.31Å
181	V	90.9	Very high	95.5	Very high	57 Å²	57	45.7 Å²	45.7	35%	0.345	24%	0.243	S	C	.	.			trans	-89	114.3	166.2	-168.7	0	0	0	0	107.8	R105 Y159 S183	R105-V181 PolarHBondContact NH2-O 3.02Å; R105-V181 VanDerWaalsContact NH2-O 3.14Å; Y159-V181 HydrophobicContact CE2-CB 4.33Å; Y159-V181 HydrophobicContact CE2-CG1 4.34Å; Y159-V181 HydrophobicContact CE2-CG2 4.1Å; Y159-V181 VanDerWaalsContact OH-CG2 3.31Å; Y159-V181 WeakPolarHBondContact OH-CG2 3.41Å; V181-S183 PolarHBondContact O-N 2.9Å
182	P	94.6	Very high	95.7	Very high	6 Å²	6	41 Å²	41	4%	0.039	21%	0.21	C	C	.	.			trans	-58.4	136.3	-179.5	-24.2	34.6	0	0	0	112	R105 L155 I178 G180 E186 V187 M205	R105-P182 PolarHBondContact NE-O 3.07Å; R105-P182 PolarHBondContact NH2-O 3.32Å; L155-P182 HydrophobicContact CD1-CG 4.15Å; I178-P182 HydrophobicContact CG2-CG 4.2Å; G180-P182 WeakPolarHBondContact O-CD 3.31Å; P182-E186 WeakPolarHBondContact CA-OE2 3.27Å; P182-V187 HydrophobicContact CB-CG2 3.64Å; P182-M205 HydrophobicContact CB-CE 4.23Å
183	S	97.3	Very high	96.1	Very high	41 Å²	41	38.7 Å²	38.7	29%	0.287	20%	0.199	S	C	.	.			trans	-74.7	159.5	167.2	66.3	0	0	0	0	110.7	V181 L185 E186 V187	V181-S183 PolarHBondContact O-N 2.9Å; S183-L185 PolarHBondContact O-N 2.93Å; S183-E186 WeakPolarHBondContact CB-OE2 3.49Å; S183-E186 PolarHBondContact N-OE2 2.7Å; S183-E186 PolarHBondContact O-N 3.48Å; S183-E186 WeakPolarHBondContact OG-CB 3.45Å; S183-E186 VanDerWaalsContact OG-CD 3.29Å; S183-E186 WeakPolarHBondContact OG-CG 3.49Å; S183-E186 PolarHBondContact OG-N 3.44Å; S183-E186 PolarHBondContact OG-OE2 2.97Å; S183-V187 WeakPolarHBondContact O-CG2 3.42Å; S183-V187 PolarHBondContact O-N 3.31Å; S183-V187 VanDerWaalsContact O-N 3.09Å
184	L	98.2	Very high	96.2	Very high	73 Å²	73	37.3 Å²	37.3	38%	0.382	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-37.5	177.1	-179.9	60.7	0	0	0	111.4	I97 V98 F101 V187 A188	I97-L184 HydrophobicContact CG2-CD1 4.4Å; V98-L184 HydrophobicContact CG2-CD1 4.47Å; F101-L184 HydrophobicContact CB-CD1 3.79Å; F101-L184 HydrophobicContact CD1-CB 4.22Å; F101-L184 HydrophobicContact CD1-CD1 4.18Å; F101-L184 HydrophobicContact CD2-CB 3.94Å; F101-L184 HydrophobicContact CD2-CD1 4.47Å; F101-L184 HydrophobicContact CE1-CB 4.27Å; F101-L184 HydrophobicContact CE2-CB 3.99Å; F101-L184 VanDerWaalsContact CE2-N 3.27Å; F101-L184 HydrophobicContact CG-CB 4.05Å; F101-L184 HydrophobicContact CG-CD1 3.89Å; F101-L184 HydrophobicContact CZ-CB 4.15Å; L184-V187 PolarHBondContact O-N 3.27Å; L184-A188 VanDerWaalsContact O-CB 3.24Å; L184-A188 WeakPolarHBondContact O-CB 3.48Å; L184-A188 PolarHBondContact O-N 3.28Å
185	L	98.3	Very high	96.3	Very high	60 Å²	60	33.5 Å²	33.5	31%	0.314	18%	0.175	S	C	.	.	H	α-helix	trans	-66	-40.9	179.1	-178.1	59.7	0	0	0	112.2	H71 L72 S183 A188 G189	H71-L185 HydrophobicContact CB-CD1 4.01Å; H71-L185 HydrophobicContact CB-CD2 4.17Å; H71-L185 HydrophobicContact CB-CG 3.65Å; L72-L185 HydrophobicContact CB-CD1 4.5Å; S183-L185 PolarHBondContact O-N 2.93Å; L185-A188 PolarHBondContact O-N 2.96Å; L185-G189 PolarHBondContact O-N 2.94Å
186	E	98.3	Very high	96.4	Very high	47 Å²	47	28.3 Å²	28.3	22%	0.22	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-46.5	174.5	-74.2	164.7	138.5	0	0	111.1	H71 P182 S183 A188 G189 F190 M205 M209	H71-E186 WeakPolarHBondContact NE2-CG 3.48Å; P182-E186 WeakPolarHBondContact CA-OE2 3.27Å; S183-E186 WeakPolarHBondContact CB-OE2 3.49Å; S183-E186 PolarHBondContact N-OE2 2.7Å; S183-E186 PolarHBondContact O-N 3.48Å; S183-E186 WeakPolarHBondContact OG-CB 3.45Å; S183-E186 VanDerWaalsContact OG-CD 3.29Å; S183-E186 WeakPolarHBondContact OG-CG 3.49Å; S183-E186 PolarHBondContact OG-N 3.44Å; S183-E186 PolarHBondContact OG-OE2 2.97Å; E186-A188 VanDerWaalsContact C-N 3.35Å; E186-A188 PolarHBondContact O-N 3.39Å; E186-G189 PolarHBondContact O-N 2.99Å; E186-F190 VanDerWaalsContact O-CB 3.32Å; E186-F190 WeakPolarHBondContact O-CB 3.43Å; E186-F190 PolarHBondContact O-N 3.44Å; E186-M205 HydrophobicContact CB-CE 3.56Å; E186-M209 HydrophobicContact CB-SD 4.37Å; E186-M209 HydrophobicContact CG-CE 4.02Å; E186-M209 HydrophobicContact CG-SD 4.11Å; E186-M209 WeakPolarHBondContact OE1-CE 3.38Å
187	V	98.5	Very high	96.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-40.4	178.3	-178.5	0	0	0	0	111	I97 L152 L155 P182 S183 L184 S191	I97-V187 HydrophobicContact CG2-CG1 4.09Å; L152-V187 HydrophobicContact CD2-CG1 4.28Å; L155-V187 HydrophobicContact CD2-CG1 4.01Å; L155-V187 HydrophobicContact CD2-CG2 3.99Å; P182-V187 HydrophobicContact CB-CG2 3.64Å; S183-V187 WeakPolarHBondContact O-CG2 3.42Å; S183-V187 PolarHBondContact O-N 3.31Å; S183-V187 VanDerWaalsContact O-N 3.09Å; L184-V187 PolarHBondContact O-N 3.27Å; V187-S191 VanDerWaalsContact O-CB 3.27Å; V187-S191 WeakPolarHBondContact O-CB 3.39Å; V187-S191 PolarHBondContact O-N 3.44Å; V187-S191 PolarHBondContact O-OG 3.03Å
188	A	98.6	Very high	96.3	Very high	11 Å²	11	26.7 Å²	26.7	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-49.6	177	0	0	0	0	0	111.1	T75 L184 L185 E186 F190 S191 Y192	T75-A188 HydrophobicContact CG2-CB 3.88Å; L184-A188 VanDerWaalsContact O-CB 3.24Å; L184-A188 WeakPolarHBondContact O-CB 3.48Å; L184-A188 PolarHBondContact O-N 3.28Å; L185-A188 PolarHBondContact O-N 2.96Å; E186-A188 VanDerWaalsContact C-N 3.35Å; E186-A188 PolarHBondContact O-N 3.39Å; A188-F190 VanDerWaalsContact C-N 3.32Å; A188-F190 PolarHBondContact O-N 3.45Å; A188-S191 PolarHBondContact O-N 3.34Å; A188-Y192 WeakPolarHBondContact O-CB 3.24Å; A188-Y192 WeakPolarHBondContact O-CD2 3.42Å; A188-Y192 PolarHBondContact O-N 3.1Å
189	G	98.5	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.2	-36.4	179.6	0	0	0	0	0	112.8	T75 L185 E186 F193 Y208	T75-G189 VanDerWaalsContact OG1-CA 3.3Å; T75-G189 WeakPolarHBondContact OG1-CA 3.33Å; T75-G189 PolarHBondContact OG1-N 3.46Å; T75-G189 VanDerWaalsContact OG1-N 3.1Å; L185-G189 PolarHBondContact O-N 2.94Å; E186-G189 PolarHBondContact O-N 2.99Å; G189-F193 PolarHBondContact O-N 3.06Å; G189-Y208 VanDerWaalsContact CA-OH 3.22Å; G189-Y208 WeakPolarHBondContact CA-OH 3.33Å; G189-Y208 PolarHBondContact O-OH 2.96Å
190	F	98.6	Very high	96	Very high	1 Å²	1	18.9 Å²	18.9	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-62.6	-45.1	172.9	165.4	-121.3	0	0	0	112.5	K151 E186 A188 F203 M205 Y208	K151-F190 HydrophobicContact CB-CE1 3.62Å; K151-F190 HydrophobicContact CB-CZ 3.61Å; K151-F190 HydrophobicContact CD-CE1 4.14Å; K151-F190 HydrophobicContact CD-CE2 4.09Å; K151-F190 HydrophobicContact CD-CZ 3.8Å; K151-F190 HydrophobicContact CG-CE1 4.09Å; K151-F190 HydrophobicContact CG-CE2 4.24Å; K151-F190 HydrophobicContact CG-CZ 3.6Å; K151-F190 PolarHBondContact NZ-O 3.07Å; E186-F190 VanDerWaalsContact O-CB 3.32Å; E186-F190 WeakPolarHBondContact O-CB 3.43Å; E186-F190 PolarHBondContact O-N 3.44Å; A188-F190 VanDerWaalsContact C-N 3.32Å; A188-F190 PolarHBondContact O-N 3.45Å; F190-F203 HydrophobicContact CD2-CD2 4.16Å; F190-F203 AromaticContact CD2-CE2 3.58Å; F190-F203 HydrophobicContact CD2-CE2 3.58Å; F190-F203 HydrophobicContact CD2-CZ 4.37Å; F190-F203 AromaticContact CE2-CD2 3.76Å; F190-F203 HydrophobicContact CE2-CD2 3.76Å; F190-F203 AromaticContact CE2-CE2 3.6Å; F190-F203 HydrophobicContact CE2-CE2 3.6Å; F190-F203 HydrophobicContact CE2-CZ 4.43Å; F190-F203 WeakPolarHBondContact CE2-O 3.28Å; F190-M205 HydrophobicContact CB-CE 4.33Å; F190-M205 HydrophobicContact CB-SD 3.36Å; F190-M205 WeakPolarHBondContact CB-SD 3.14Å; F190-M205 HydrophobicContact CD1-CB 4.47Å; F190-M205 HydrophobicContact CD1-SD 3.65Å; F190-M205 HydrophobicContact CD2-CB 4.49Å; F190-M205 HydrophobicContact CD2-SD 3.99Å; F190-M205 HydrophobicContact CE1-CB 4.35Å; F190-M205 HydrophobicContact CE1-SD 4.41Å; F190-M205 HydrophobicContact CE2-CB 4.41Å; F190-M205 HydrophobicContact CG-SD 3.39Å; F190-M205 WeakPolarHBondContact CG-SD 3.25Å; F190-M205 HydrophobicContact CZ-CB 4.33Å; F190-Y208 HydrophobicContact CB-CD1 3.59Å; F190-Y208 HydrophobicContact CB-CE1 3.83Å; F190-Y208 HydrophobicContact CB-CG 3.96Å; F190-Y208 HydrophobicContact CD2-CD1 4.35Å; F190-Y208 AromaticContact CD2-CG 3.96Å; F190-Y208 HydrophobicContact CD2-CG 3.96Å; F190-Y208 HydrophobicContact CG-CD1 4.41Å; F190-Y208 HydrophobicContact CG-CG 4.44Å; F190-Y208 VanDerWaalsContact N-CZ 3.32Å
191	S	98.4	Very high	96.2	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-69.4	-45.1	-176.9	-60.4	0	0	0	0	111.1	I97 K151 V187 A188	I97-S191 VanDerWaalsContact CD1-CB 3.42Å; K151-S191 PolarHBondContact NZ-O 3.4Å; V187-S191 VanDerWaalsContact O-CB 3.27Å; V187-S191 WeakPolarHBondContact O-CB 3.39Å; V187-S191 PolarHBondContact O-N 3.44Å; V187-S191 PolarHBondContact O-OG 3.03Å; A188-S191 PolarHBondContact O-N 3.34Å
192	Y	98.4	Very high	96.4	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	8%	0.082	C	C	.	.	S	Bend	trans	-95.2	13.4	-176	-71.6	-63.5	0	0	0	114.4	T75 G78 L79 A82 S93 L94 I97 A188 Y194 F197	T75-Y192 HydrophobicContact CG2-CD2 4.34Å; G78-Y192 WeakPolarHBondContact CA-O 3.34Å; L79-Y192 HydrophobicContact CD2-CD1 4.2Å; L79-Y192 HydrophobicContact CD2-CD2 4.25Å; L79-Y192 HydrophobicContact CD2-CE1 3.71Å; L79-Y192 HydrophobicContact CD2-CE2 3.74Å; L79-Y192 HydrophobicContact CD2-CG 4.46Å; L79-Y192 VanDerWaalsContact CD2-CZ 3.46Å; L79-Y192 HydrophobicContact CG-CD1 4.33Å; L79-Y192 HydrophobicContact CG-CD2 4.19Å; L79-Y192 HydrophobicContact CG-CE1 4.34Å; L79-Y192 HydrophobicContact CG-CE2 4.17Å; L79-Y192 HydrophobicContact CG-CG 4.28Å; A82-Y192 HydrophobicContact CB-CE1 4.5Å; S93-Y192 WeakPolarHBondContact CB-OH 3.47Å; S93-Y192 PolarHBondContact OG-OH 3.35Å; L94-Y192 HydrophobicContact CD2-CE2 3.97Å; L94-Y192 WeakPolarHBondContact CD2-OH 3.26Å; L94-Y192 WeakPolarHBondContact CG-OH 3.31Å; L94-Y192 PolarHBondContact N-OH 2.85Å; I97-Y192 HydrophobicContact CD1-CD2 3.9Å; I97-Y192 HydrophobicContact CD1-CE1 4.43Å; I97-Y192 HydrophobicContact CD1-CE2 3.21Å; A188-Y192 WeakPolarHBondContact O-CB 3.24Å; A188-Y192 WeakPolarHBondContact O-CD2 3.42Å; A188-Y192 PolarHBondContact O-N 3.1Å; Y192-Y194 PolarHBondContact O-N 2.83Å; Y192-F197 AromaticContact CD1-CD2 3.69Å; Y192-F197 HydrophobicContact CD1-CD2 3.69Å; Y192-F197 AromaticContact CD1-CE2 3.64Å; Y192-F197 HydrophobicContact CD1-CE2 3.64Å; Y192-F197 HydrophobicContact CD1-CG 4.45Å; Y192-F197 HydrophobicContact CD1-CZ 4.38Å; Y192-F197 HydrophobicContact CE1-CD2 4.12Å; Y192-F197 AromaticContact CE1-CE2 3.57Å; Y192-F197 HydrophobicContact CE1-CE2 3.57Å; Y192-F197 HydrophobicContact CE1-CZ 4.16Å
193	F	98.5	Very high	96.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.			trans	-52.7	111.8	173.2	175.7	-110.4	0	0	0	110.8	H74 G189 G195 A196 F197 F203 Y208 L211 T298 L300	H74-F193 AromaticContact CD2-CD2 3.82Å; H74-F193 AromaticContact CE1-CD2 3.76Å; H74-F193 AromaticContact CE1-CE2 3.98Å; H74-F193 AromaticContact CG-CD2 3.87Å; H74-F193 AromaticContact ND1-CD2 3.85Å; H74-F193 AromaticContact NE2-CD2 3.74Å; H74-F193 AromaticContact NE2-CE2 3.72Å; G189-F193 PolarHBondContact O-N 3.06Å; F193-G195 PolarHBondContact O-N 2.9Å; F193-G195 VanDerWaalsContact O-N 3.08Å; F193-A196 HydrophobicContact CD1-CB 3.98Å; F193-A196 HydrophobicContact CE1-CB 4.46Å; F193-A196 PolarHBondContact O-N 3.13Å; F193-F197 PolarHBondContact O-N 3.4Å; F193-F203 HydrophobicContact CB-CZ 4.03Å; F193-F203 AromaticContact CD1-CE1 3.95Å; F193-F203 HydrophobicContact CD1-CE1 3.95Å; F193-F203 AromaticContact CD1-CZ 3.76Å; F193-F203 HydrophobicContact CD1-CZ 3.76Å; F193-F203 HydrophobicContact CG-CZ 4.17Å; F193-Y208 HydrophobicContact CB-CE2 4.39Å; F193-L211 HydrophobicContact CD2-CD2 4.47Å; F193-L211 HydrophobicContact CE2-CD2 3.99Å; F193-L211 HydrophobicContact CZ-CD2 4.37Å; F193-T298 HydrophobicContact CE2-CG2 4.28Å; F193-T298 HydrophobicContact CZ-CG2 3.97Å; F193-L300 HydrophobicContact CD1-CD2 3.85Å; F193-L300 HydrophobicContact CE1-CD2 3.43Å; F193-L300 VanDerWaalsContact CE1-CD2 3.43Å; F193-L300 HydrophobicContact CZ-CD2 4.09Å
194	Y	97.5	Very high	96.5	Very high	9 Å²	9	13.2 Å²	13.2	4%	0.035	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-35.1	-168.6	55.1	-94.9	0	0	0	113.1	G51 F54 A55 Y73 H74 T77 Y192 A196 V294 T298	G51-Y194 WeakPolarHBondContact O-CE2 3.26Å; F54-Y194 HydrophobicContact CB-CD1 4.27Å; F54-Y194 HydrophobicContact CB-CD2 3.79Å; F54-Y194 HydrophobicContact CB-CE1 4.18Å; F54-Y194 HydrophobicContact CB-CE2 3.73Å; F54-Y194 HydrophobicContact CB-CG 4.08Å; F54-Y194 HydrophobicContact CD2-CD2 4.25Å; F54-Y194 HydrophobicContact CD2-CG 4.09Å; A55-Y194 VanDerWaalsContact CA-OH 3.25Å; A55-Y194 WeakPolarHBondContact CA-OH 3.48Å; A55-Y194 HydrophobicContact CB-CE2 4.2Å; A55-Y194 PolarHBondContact N-OH 2.93Å; Y73-Y194 HydrophobicContact CD1-CE1 4.19Å; Y73-Y194 HydrophobicContact CE1-CD1 4.36Å; Y73-Y194 AromaticContact CE1-CE1 3.63Å; Y73-Y194 HydrophobicContact CE1-CE1 3.63Å; H74-Y194 AromaticContact CD2-CE1 3.53Å; H74-Y194 AromaticContact NE2-CE1 3.92Å; T77-Y194 VanDerWaalsContact OG1-CD1 3.24Å; T77-Y194 WeakPolarHBondContact OG1-CD1 3.37Å; Y192-Y194 PolarHBondContact O-N 2.83Å; Y194-A196 PolarHBondContact O-N 2.9Å; Y194-A196 VanDerWaalsContact O-N 3.17Å; Y194-V294 HydrophobicContact CD2-CG1 4.06Å; Y194-V294 HydrophobicContact CE2-CG1 3.77Å; Y194-T298 HydrophobicContact CE2-CG2 4.02Å; Y194-T298 WeakPolarHBondContact OH-CG2 3.44Å
195	G	95.5	Very high	96.4	Very high	2 Å²	2	9.9 Å²	9.9	2%	0.021	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.4	-179.2	0	0	0	0	0	114.2	F193 T291 C295	F193-G195 PolarHBondContact O-N 2.9Å; F193-G195 VanDerWaalsContact O-N 3.08Å; G195-T291 WeakPolarHBondContact O-CG2 3.36Å; G195-C295 PolarHBondContact O-SG 2.9Å
196	A	95.6	Very high	96.3	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.008	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-153.6	9.7	178.4	0	0	0	0	0	115	F193 Y194 G200 F203	F193-A196 HydrophobicContact CD1-CB 3.98Å; F193-A196 HydrophobicContact CE1-CB 4.46Å; F193-A196 PolarHBondContact O-N 3.13Å; Y194-A196 PolarHBondContact O-N 2.9Å; Y194-A196 VanDerWaalsContact O-N 3.17Å; A196-G200 WeakPolarHBondContact CA-O 3.24Å; A196-G200 WeakPolarHBondContact O-CA 3.27Å; A196-G200 PolarHBondContact O-N 3.23Å; A196-F203 HydrophobicContact CB-CD1 4.24Å; A196-F203 HydrophobicContact CB-CE1 3.48Å; A196-F203 VanDerWaalsContact CB-CE1 3.48Å; A196-F203 HydrophobicContact CB-CZ 4.42Å
197	F	95.5	Very high	96.3	Very high	9 Å²	9	8.1 Å²	8.1	4%	0.039	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-45.2	-179.7	167.6	-103	0	0	0	111.5	I81 A82 P144 Y192 F193	I81-F197 HydrophobicContact CG2-CD1 4.06Å; A82-F197 HydrophobicContact CB-CD1 4.47Å; A82-F197 HydrophobicContact CB-CE1 3.5Å; A82-F197 VanDerWaalsContact CB-CE1 3.5Å; A82-F197 HydrophobicContact CB-CE2 4.45Å; A82-F197 HydrophobicContact CB-CZ 3.48Å; A82-F197 VanDerWaalsContact CB-CZ 3.48Å; P144-F197 HydrophobicContact CB-CE1 4.06Å; P144-F197 HydrophobicContact CB-CE2 4.23Å; P144-F197 HydrophobicContact CB-CZ 3.91Å; P144-F197 WeakPolarHBondContact CB-O 3.3Å; P144-F197 HydrophobicContact CG-CE1 4.32Å; P144-F197 HydrophobicContact CG-CZ 4.11Å; Y192-F197 AromaticContact CD1-CD2 3.69Å; Y192-F197 HydrophobicContact CD1-CD2 3.69Å; Y192-F197 AromaticContact CD1-CE2 3.64Å; Y192-F197 HydrophobicContact CD1-CE2 3.64Å; Y192-F197 HydrophobicContact CD1-CG 4.45Å; Y192-F197 HydrophobicContact CD1-CZ 4.38Å; Y192-F197 HydrophobicContact CE1-CD2 4.12Å; Y192-F197 AromaticContact CE1-CE2 3.57Å; Y192-F197 HydrophobicContact CE1-CE2 3.57Å; Y192-F197 HydrophobicContact CE1-CZ 4.16Å; F193-F197 PolarHBondContact O-N 3.4Å
198	L	94.1	Very high	96.3	Very high	6 Å²	6	8.1 Å²	8.1	3%	0.031	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-62.6	-172.1	-72.4	172.8	0	0	0	113.1	L44 I48 I81 F86 P144	L44-L198 HydrophobicContact CD1-CB 4.04Å; L44-L198 HydrophobicContact CD1-CD1 3.87Å; L44-L198 HydrophobicContact CD1-CG 4.38Å; I48-L198 HydrophobicContact CG2-CD1 4.28Å; I81-L198 HydrophobicContact CG2-CD1 3.47Å; I81-L198 VanDerWaalsContact CG2-CD1 3.47Å; I81-L198 HydrophobicContact CG2-CD2 3.96Å; I81-L198 HydrophobicContact CG2-CG 3.66Å; F86-L198 HydrophobicContact CE2-CD2 3.77Å; F86-L198 HydrophobicContact CZ-CD2 4.14Å; P144-L198 VanDerWaalsContact CA-O 3.31Å; P144-L198 WeakPolarHBondContact CA-O 3.42Å
199	V	91.9	Very high	96.2	Very high	22 Å²	22	9 Å²	9	13%	0.133	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	12.1	-167.9	-62.9	0	0	0	0	113.3	L44 I48 M143 C287 W288 T291	L44-V199 HydrophobicContact CD1-CG1 3.92Å; I48-V199 HydrophobicContact CG2-CG2 4.41Å; M143-V199 HydrophobicContact CE-CG1 4.13Å; M143-V199 HydrophobicContact SD-CG1 3.89Å; V199-C287 HydrophobicContact CG1-CB 4.46Å; V199-C287 HydrophobicContact CG2-CB 4.31Å; V199-W288 PolarHBondContact O-NE1 3.11Å; V199-T291 HydrophobicContact CG2-CG2 4.18Å; V199-T291 WeakPolarHBondContact CG2-OG1 3.03Å
200	G	89	Confident	96.1	Very high	2 Å²	2	12 Å²	12	2%	0.021	6%	0.06	C	C	.	.			trans	78.6	-168.3	-162.5	0	0	0	0	0	111.6	A196 T291	A196-G200 WeakPolarHBondContact CA-O 3.24Å; A196-G200 WeakPolarHBondContact O-CA 3.27Å; A196-G200 PolarHBondContact O-N 3.23Å; G200-T291 WeakPolarHBondContact O-CG2 3.45Å
201	P	93.4	Very high	96.1	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.			cis	-74.5	157.6	15.5	25.7	-30.8	0	0	0	114.6	F203 C316 N318	P201-F203 WeakPolarHBondContact O-CD1 3.17Å; P201-C316 HydrophobicContact CB-CB 4.43Å; P201-C316 VanDerWaalsContact CB-O 3.26Å; P201-C316 WeakPolarHBondContact CB-O 3.46Å; P201-C316 HydrophobicContact CG-CB 3.59Å; P201-C316 VanDerWaalsContact CG-O 3.24Å; P201-C316 WeakPolarHBondContact CG-O 3.44Å; P201-N318 WeakPolarHBondContact CA-ND2 3.16Å
202	Q	95.3	Very high	96	Very high	15 Å²	15	12.2 Å²	12.2	7%	0.07	6%	0.061	C	C	.	.			trans	-71.2	135.6	171.2	-162.6	-65.5	-42.2	0	0	108.9	L150 N340 W344	L150-Q202 HydrophobicContact CB-CG 4.32Å; Q202-N340 HydrophobicContact CB-CB 3.98Å; Q202-N340 WeakPolarHBondContact O-CB 3.38Å; Q202-W344 HydrophobicContact CG-CB 4.27Å; Q202-W344 HydrophobicContact CG-CG 4.23Å; Q202-W344 VanDerWaalsContact NE2-CD1 3.29Å
203	F	97.2	Very high	95.9	Very high	8 Å²	8	17 Å²	17	4%	0.035	8%	0.084	C	C	.	.			trans	-148.3	165.3	169.8	57.4	-90	0	0	0	110.5	F190 F193 A196 P201 Y208 L300	F190-F203 HydrophobicContact CD2-CD2 4.16Å; F190-F203 AromaticContact CD2-CE2 3.58Å; F190-F203 HydrophobicContact CD2-CE2 3.58Å; F190-F203 HydrophobicContact CD2-CZ 4.37Å; F190-F203 AromaticContact CE2-CD2 3.76Å; F190-F203 HydrophobicContact CE2-CD2 3.76Å; F190-F203 AromaticContact CE2-CE2 3.6Å; F190-F203 HydrophobicContact CE2-CE2 3.6Å; F190-F203 HydrophobicContact CE2-CZ 4.43Å; F190-F203 WeakPolarHBondContact CE2-O 3.28Å; F193-F203 HydrophobicContact CB-CZ 4.03Å; F193-F203 AromaticContact CD1-CE1 3.95Å; F193-F203 HydrophobicContact CD1-CE1 3.95Å; F193-F203 AromaticContact CD1-CZ 3.76Å; F193-F203 HydrophobicContact CD1-CZ 3.76Å; F193-F203 HydrophobicContact CG-CZ 4.17Å; A196-F203 HydrophobicContact CB-CD1 4.24Å; A196-F203 HydrophobicContact CB-CE1 3.48Å; A196-F203 VanDerWaalsContact CB-CE1 3.48Å; A196-F203 HydrophobicContact CB-CZ 4.42Å; P201-F203 WeakPolarHBondContact O-CD1 3.17Å; F203-Y208 HydrophobicContact CE2-CD2 4.08Å; F203-Y208 HydrophobicContact CE2-CG 4.31Å; F203-L300 HydrophobicContact CD1-CD2 3.82Å; F203-L300 HydrophobicContact CD2-CD1 4.38Å; F203-L300 HydrophobicContact CD2-CD2 4.36Å; F203-L300 HydrophobicContact CE1-CD2 3.62Å; F203-L300 HydrophobicContact CE2-CD1 4.47Å; F203-L300 HydrophobicContact CE2-CD2 4.21Å; F203-L300 HydrophobicContact CG-CD2 4.19Å; F203-L300 HydrophobicContact CZ-CD2 3.86Å
204	S	97.1	Very high	95.7	Very high	8 Å²	8	17.7 Å²	17.7	6%	0.056	9%	0.091	C	C	.	.			trans	-86.5	155.6	-179	67.8	0	0	0	0	113	Y176 N206 H207 Y208	Y176-S204 VanDerWaalsContact CD1-OG 3.29Å; Y176-S204 WeakPolarHBondContact CD1-OG 3.48Å; Y176-S204 WeakPolarHBondContact CE1-OG 3.25Å; S204-N206 PolarHBondContact O-N 3.13Å; S204-H207 PolarHBondContact O-N 3.44Å; S204-H207 VanDerWaalsContact O-N 3.14Å; S204-H207 PolarHBondContact OG-N 3.01Å; S204-Y208 PolarHBondContact O-N 3.02Å
205	M	97.2	Very high	95.6	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.02	11%	0.113	C	C	.	.	H	α-helix	trans	-58	-36.8	171.8	-177.5	72.2	175	0	0	111.9	L155 I178 P182 E186 F190 H207 Y208 M209	L155-M205 HydrophobicContact CD1-CB 3.8Å; L155-M205 HydrophobicContact CD1-CG 3.75Å; L155-M205 HydrophobicContact CD1-SD 4.49Å; I178-M205 HydrophobicContact CD1-CB 3.69Å; I178-M205 HydrophobicContact CD1-CG 3.86Å; P182-M205 HydrophobicContact CB-CE 4.23Å; E186-M205 HydrophobicContact CB-CE 3.56Å; F190-M205 HydrophobicContact CB-CE 4.33Å; F190-M205 HydrophobicContact CB-SD 3.36Å; F190-M205 WeakPolarHBondContact CB-SD 3.14Å; F190-M205 HydrophobicContact CD1-CB 4.47Å; F190-M205 HydrophobicContact CD1-SD 3.65Å; F190-M205 HydrophobicContact CD2-CB 4.49Å; F190-M205 HydrophobicContact CD2-SD 3.99Å; F190-M205 HydrophobicContact CE1-CB 4.35Å; F190-M205 HydrophobicContact CE1-SD 4.41Å; F190-M205 HydrophobicContact CE2-CB 4.41Å; F190-M205 HydrophobicContact CG-SD 3.39Å; F190-M205 WeakPolarHBondContact CG-SD 3.25Å; F190-M205 HydrophobicContact CZ-CB 4.33Å; M205-H207 VanDerWaalsContact C-N 3.33Å; M205-H207 PolarHBondContact O-N 2.94Å; M205-Y208 HydrophobicContact CE-CD1 4.47Å; M205-Y208 WeakPolarHBondContact O-CB 3.29Å; M205-Y208 PolarHBondContact O-N 3.27Å; M205-Y208 HydrophobicContact SD-CD1 4.08Å; M205-M209 HydrophobicContact CE-CG 4.36Å; M205-M209 HydrophobicContact CE-SD 3.86Å; M205-M209 HydrophobicContact CG-CG 4.49Å; M205-M209 WeakPolarHBondContact O-CG 3.32Å; M205-M209 PolarHBondContact O-N 3.28Å
206	N	95.9	Very high	95.6	Very high	39 Å²	39	22.9 Å²	22.9	21%	0.209	12%	0.115	C	C	.	.	H	α-helix	trans	-58.7	-45.4	175.9	-174.1	-89.2	0	0	0	111.6	S204 Y208 M209 K210	S204-N206 PolarHBondContact O-N 3.13Å; N206-Y208 VanDerWaalsContact C-N 3.33Å; N206-Y208 PolarHBondContact O-N 3.42Å; N206-M209 PolarHBondContact O-N 3.02Å; N206-K210 WeakPolarHBondContact O-CG 3.28Å; N206-K210 PolarHBondContact O-N 3.2Å; N206-K210 VanDerWaalsContact O-N 3.15Å; N206-K210 VanDerWaalsContact OD1-CE 3.29Å; N206-K210 WeakPolarHBondContact OD1-CE 3.44Å; N206-K210 PolarHBondContact OD1-NZ 2.74Å
207	H	97.2	Very high	95.6	Very high	30 Å²	30	23.1 Å²	23.1	14%	0.139	12%	0.116	C	C	.	.	H	α-helix	trans	-66.8	-36.3	178.8	-158.1	68	0	0	0	111.9	S204 M205 K210 L211 L216 L300 F302	S204-H207 PolarHBondContact O-N 3.44Å; S204-H207 VanDerWaalsContact O-N 3.14Å; S204-H207 PolarHBondContact OG-N 3.01Å; M205-H207 VanDerWaalsContact C-N 3.33Å; M205-H207 PolarHBondContact O-N 2.94Å; H207-K210 PolarHBondContact O-N 3.49Å; H207-L211 PolarHBondContact O-N 3.39Å; H207-L211 VanDerWaalsContact O-N 3.13Å; H207-L216 WeakPolarHBondContact NE2-CD1 3.43Å; H207-L300 PolarHBondContact NE2-O 2.92Å; H207-F302 PolarHBondContact CE1-O 3.09Å
208	Y	98.1	Very high	95.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-45.6	171.2	178.8	-109.1	0	0	0	113.1	H71 H74 G189 F190 F193 F203 S204 M205 N206 K210 L211 V212	H71-Y208 AromaticContact CE1-CE1 3.64Å; H71-Y208 AromaticContact ND1-CE1 3.46Å; H71-Y208 WeakPolarHBondContact ND1-CE1 3.37Å; H71-Y208 AromaticContact ND1-CZ 3.57Å; H71-Y208 PolarHBondContact ND1-OH 2.8Å; H74-Y208 AromaticContact ND1-CE2 3.35Å; H74-Y208 VanDerWaalsContact ND1-CE2 3.35Å; H74-Y208 WeakPolarHBondContact ND1-CE2 3.29Å; H74-Y208 AromaticContact ND1-CZ 3.65Å; H74-Y208 PolarHBondContact ND1-OH 3.43Å; H74-Y208 VanDerWaalsContact ND1-OH 3.11Å; G189-Y208 VanDerWaalsContact CA-OH 3.22Å; G189-Y208 WeakPolarHBondContact CA-OH 3.33Å; G189-Y208 PolarHBondContact O-OH 2.96Å; F190-Y208 HydrophobicContact CB-CD1 3.59Å; F190-Y208 HydrophobicContact CB-CE1 3.83Å; F190-Y208 HydrophobicContact CB-CG 3.96Å; F190-Y208 HydrophobicContact CD2-CD1 4.35Å; F190-Y208 AromaticContact CD2-CG 3.96Å; F190-Y208 HydrophobicContact CD2-CG 3.96Å; F190-Y208 HydrophobicContact CG-CD1 4.41Å; F190-Y208 HydrophobicContact CG-CG 4.44Å; F190-Y208 VanDerWaalsContact N-CZ 3.32Å; F193-Y208 HydrophobicContact CB-CE2 4.39Å; F203-Y208 HydrophobicContact CE2-CD2 4.08Å; F203-Y208 HydrophobicContact CE2-CG 4.31Å; S204-Y208 PolarHBondContact O-N 3.02Å; M205-Y208 HydrophobicContact CE-CD1 4.47Å; M205-Y208 WeakPolarHBondContact O-CB 3.29Å; M205-Y208 PolarHBondContact O-N 3.27Å; M205-Y208 HydrophobicContact SD-CD1 4.08Å; N206-Y208 VanDerWaalsContact C-N 3.33Å; N206-Y208 PolarHBondContact O-N 3.42Å; Y208-K210 VanDerWaalsContact C-N 3.28Å; Y208-K210 PolarHBondContact O-N 3.4Å; Y208-L211 VanDerWaalsContact O-CB 3.31Å; Y208-L211 WeakPolarHBondContact O-CB 3.26Å; Y208-L211 PolarHBondContact O-N 3.32Å; Y208-L211 VanDerWaalsContact O-N 3.14Å; Y208-V212 HydrophobicContact CD2-CG2 4.48Å; Y208-V212 HydrophobicContact CE1-CG2 4.01Å; Y208-V212 HydrophobicContact CE2-CG2 3.96Å; Y208-V212 WeakPolarHBondContact O-CG2 3.47Å; Y208-V212 PolarHBondContact O-N 2.97Å; Y208-V212 VanDerWaalsContact O-N 3.11Å
209	M	97.6	Very high	95.3	Very high	31 Å²	31	27.1 Å²	27.1	15%	0.153	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-40.4	179.1	-67.5	-51.3	-66.5	0	0	111.1	E186 M205 N206 L211 V212 Q213	E186-M209 HydrophobicContact CB-SD 4.37Å; E186-M209 HydrophobicContact CG-CE 4.02Å; E186-M209 HydrophobicContact CG-SD 4.11Å; E186-M209 WeakPolarHBondContact OE1-CE 3.38Å; M205-M209 HydrophobicContact CE-CG 4.36Å; M205-M209 HydrophobicContact CE-SD 3.86Å; M205-M209 HydrophobicContact CG-CG 4.49Å; M205-M209 WeakPolarHBondContact O-CG 3.32Å; M205-M209 PolarHBondContact O-N 3.28Å; N206-M209 PolarHBondContact O-N 3.02Å; M209-L211 VanDerWaalsContact C-N 3.31Å; M209-L211 PolarHBondContact O-N 3.03Å; M209-V212 PolarHBondContact O-N 3.17Å; M209-V212 VanDerWaalsContact O-N 3.13Å; M209-Q213 WeakPolarHBondContact O-CB 3.38Å; M209-Q213 VanDerWaalsContact O-CG 3.23Å; M209-Q213 WeakPolarHBondContact O-CG 3.35Å; M209-Q213 PolarHBondContact O-N 3.05Å; M209-Q213 PolarHBondContact O-OE1 3.34Å
210	K	96.6	Very high	95.2	Very high	61 Å²	61	31.7 Å²	31.7	27%	0.265	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-37.2	174.4	-68.4	-178.6	172.6	166.7	0	113.3	N206 H207 Y208 G214 E215 L216	N206-K210 WeakPolarHBondContact O-CG 3.28Å; N206-K210 PolarHBondContact O-N 3.2Å; N206-K210 VanDerWaalsContact O-N 3.15Å; N206-K210 VanDerWaalsContact OD1-CE 3.29Å; N206-K210 WeakPolarHBondContact OD1-CE 3.44Å; N206-K210 PolarHBondContact OD1-NZ 2.74Å; H207-K210 PolarHBondContact O-N 3.49Å; Y208-K210 VanDerWaalsContact C-N 3.28Å; Y208-K210 PolarHBondContact O-N 3.4Å; K210-G214 PolarHBondContact O-N 2.77Å; K210-E215 HydrophobicContact CB-CB 4.13Å; K210-E215 WeakPolarHBondContact CG-OE2 3.27Å; K210-E215 PolarHBondContact O-N 2.82Å; K210-L216 HydrophobicContact CB-CD1 4.33Å; K210-L216 HydrophobicContact CB-CD2 3.8Å; K210-L216 HydrophobicContact CB-CG 3.78Å; K210-L216 HydrophobicContact CD-CD2 4.35Å
211	L	97.3	Very high	95	Very high	3 Å²	3	34 Å²	34	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-52.4	172.5	173.3	67.2	0	0	0	110	F193 H207 Y208 M209 Q213 G214 L216 T298 L300	F193-L211 HydrophobicContact CD2-CD2 4.47Å; F193-L211 HydrophobicContact CE2-CD2 3.99Å; F193-L211 HydrophobicContact CZ-CD2 4.37Å; H207-L211 PolarHBondContact O-N 3.39Å; H207-L211 VanDerWaalsContact O-N 3.13Å; Y208-L211 VanDerWaalsContact O-CB 3.31Å; Y208-L211 WeakPolarHBondContact O-CB 3.26Å; Y208-L211 PolarHBondContact O-N 3.32Å; Y208-L211 VanDerWaalsContact O-N 3.14Å; M209-L211 VanDerWaalsContact C-N 3.31Å; M209-L211 PolarHBondContact O-N 3.03Å; L211-Q213 VanDerWaalsContact C-N 3.26Å; L211-Q213 PolarHBondContact O-N 3.38Å; L211-G214 PolarHBondContact O-N 2.94Å; L211-L216 HydrophobicContact CB-CD1 3.91Å; L211-T298 VanDerWaalsContact CD1-O 3.31Å; L211-T298 WeakPolarHBondContact CD1-O 3.45Å; L211-L300 HydrophobicContact CB-CD1 3.97Å; L211-L300 HydrophobicContact CD1-CB 4.43Å; L211-L300 HydrophobicContact CD2-CB 4.19Å; L211-L300 HydrophobicContact CD2-CD1 3.98Å; L211-L300 HydrophobicContact CG-CD1 4.48Å
212	V	97.1	Very high	95	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.03	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-30.7	-174.8	177.1	0	0	0	0	111.8	S67 I70 Y208 M209 G214	S67-V212 VanDerWaalsContact CB-CG1 3.48Å; I70-V212 HydrophobicContact CB-CG1 3.93Å; I70-V212 HydrophobicContact CD1-CG1 4.14Å; I70-V212 WeakPolarHBondContact CD1-O 3.23Å; I70-V212 HydrophobicContact CG2-CB 4.34Å; I70-V212 HydrophobicContact CG2-CG1 4.01Å; I70-V212 HydrophobicContact CG2-CG2 3.85Å; Y208-V212 HydrophobicContact CD2-CG2 4.48Å; Y208-V212 HydrophobicContact CE1-CG2 4.01Å; Y208-V212 HydrophobicContact CE2-CG2 3.96Å; Y208-V212 WeakPolarHBondContact O-CG2 3.47Å; Y208-V212 PolarHBondContact O-N 2.97Å; Y208-V212 VanDerWaalsContact O-N 3.11Å; M209-V212 PolarHBondContact O-N 3.17Å; M209-V212 VanDerWaalsContact O-N 3.13Å; V212-G214 VanDerWaalsContact C-N 3.25Å; V212-G214 PolarHBondContact O-N 3.44Å
213	Q	95.5	Very high	95	Very high	103 Å²	103	41.2 Å²	41.2	48%	0.481	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-2.9	175	-69.7	165.6	-35.7	0	0	113.5	M209 L211 E215	M209-Q213 WeakPolarHBondContact O-CB 3.38Å; M209-Q213 VanDerWaalsContact O-CG 3.23Å; M209-Q213 WeakPolarHBondContact O-CG 3.35Å; M209-Q213 PolarHBondContact O-N 3.05Å; M209-Q213 PolarHBondContact O-OE1 3.34Å; L211-Q213 VanDerWaalsContact C-N 3.26Å; L211-Q213 PolarHBondContact O-N 3.38Å; Q213-E215 VanDerWaalsContact C-N 3.29Å; Q213-E215 HydrophobicContact CB-CG 4.04Å; Q213-E215 PolarHBondContact O-N 2.96Å
214	G	95.1	Very high	94.9	Very high	14 Å²	14	40.9 Å²	40.9	14%	0.144	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	19.8	-179.2	0	0	0	0	0	114.3	K210 L211 V212 T217	K210-G214 PolarHBondContact O-N 2.77Å; L211-G214 PolarHBondContact O-N 2.94Å; V212-G214 VanDerWaalsContact C-N 3.25Å; V212-G214 PolarHBondContact O-N 3.44Å; G214-T217 WeakPolarHBondContact O-CG2 3.31Å
215	E	95.4	Very high	94.8	Very high	106 Å²	106	45 Å²	45	50%	0.495	24%	0.244	S	C	.	.			trans	-83	-20.2	-179.7	-62.7	-176.5	-170.8	0	0	112.9	K210 Q213 T217	K210-E215 HydrophobicContact CB-CB 4.13Å; K210-E215 WeakPolarHBondContact CG-OE2 3.27Å; K210-E215 PolarHBondContact O-N 2.82Å; Q213-E215 VanDerWaalsContact C-N 3.29Å; Q213-E215 HydrophobicContact CB-CG 4.04Å; Q213-E215 PolarHBondContact O-N 2.96Å; E215-T217 VanDerWaalsContact C-N 3.28Å; E215-T217 PolarHBondContact O-N 3.42Å
216	L	95.9	Very high	94.8	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.068	24%	0.243	C	C	.	.	S	Bend	trans	-86.1	64.6	-177.6	-63.2	-171.7	0	0	0	112.3	H207 K210 L211 G299 L300 F302	H207-L216 WeakPolarHBondContact NE2-CD1 3.43Å; K210-L216 HydrophobicContact CB-CD1 4.33Å; K210-L216 HydrophobicContact CB-CD2 3.8Å; K210-L216 HydrophobicContact CB-CG 3.78Å; K210-L216 HydrophobicContact CD-CD2 4.35Å; L211-L216 HydrophobicContact CB-CD1 3.91Å; L216-G299 WeakPolarHBondContact CB-O 3.31Å; L216-L300 HydrophobicContact CD1-CD1 4.12Å; L216-F302 HydrophobicContact CB-CB 4.09Å; L216-F302 HydrophobicContact CB-CD1 4.49Å; L216-F302 HydrophobicContact CD2-CD1 4.38Å
217	T	94.6	Very high	94.8	Very high	6 Å²	6	45.7 Å²	45.7	4%	0.037	25%	0.25	C	S	.	.	S	Bend	trans	-140.8	149.2	-177.7	179.2	0	0	0	0	112	G214 E215 I219 K222 F302	G214-T217 WeakPolarHBondContact O-CG2 3.31Å; E215-T217 VanDerWaalsContact C-N 3.28Å; E215-T217 PolarHBondContact O-N 3.42Å; T217-I219 WeakPolarHBondContact CG2-O 3.3Å; T217-I219 PolarHBondContact O-N 3.45Å; T217-I219 PolarHBondContact OG1-N 2.93Å; T217-I219 PolarHBondContact OG1-O 3.01Å; T217-I219 VanDerWaalsContact OG1-O 3.08Å; T217-K222 VanDerWaalsContact CB-O 3.23Å; T217-K222 WeakPolarHBondContact CB-O 3.48Å; T217-K222 PolarHBondContact OG1-O 3.38Å; T217-F302 WeakPolarHBondContact O-CE1 3.36Å; T217-F302 WeakPolarHBondContact O-CZ 3.46Å
218	D	92.8	Very high	94.8	Very high	31 Å²	31	49.8 Å²	49.8	17%	0.166	27%	0.272	C	S	.	.	S	Bend	trans	-71	-19.1	174.3	61.7	-59.8	0	0	0	112.6	P224 N225 F302 F305 A311	D218-P224 WeakPolarHBondContact OD1-CA 3.45Å; D218-N225 PolarHBondContact OD1-N 3.28Å; D218-N225 WeakPolarHBondContact OD2-CB 3.37Å; D218-N225 PolarHBondContact OD2-ND2 3.33Å; D218-F302 HydrophobicContact CB-CE2 4.23Å; D218-F305 HydrophobicContact CB-CE1 4.17Å; D218-F305 HydrophobicContact CB-CZ 4.31Å; D218-F305 VanDerWaalsContact O-CZ 3.29Å; D218-F305 WeakPolarHBondContact O-CZ 3.42Å; D218-A311 HydrophobicContact CB-CB 3.79Å
219	I	91.8	Very high	94.8	Very high	69 Å²	69	51.5 Å²	51.5	35%	0.354	28%	0.283	S	S	.	.	S	Bend	trans	-130.1	111.5	171.8	-56.1	172.1	0	0	0	107.5	T217 G221 K222	T217-I219 WeakPolarHBondContact CG2-O 3.3Å; T217-I219 PolarHBondContact O-N 3.45Å; T217-I219 PolarHBondContact OG1-N 2.93Å; T217-I219 PolarHBondContact OG1-O 3.01Å; T217-I219 VanDerWaalsContact OG1-O 3.08Å; I219-G221 PolarHBondContact O-N 3.45Å; I219-K222 HydrophobicContact CB-CB 4.16Å; I219-K222 HydrophobicContact CB-CD 4.34Å; I219-K222 HydrophobicContact CB-CG 4.43Å; I219-K222 HydrophobicContact CG2-CB 4.29Å; I219-K222 HydrophobicContact CG2-CD 3.8Å; I219-K222 HydrophobicContact CG2-CG 4.01Å; I219-K222 WeakPolarHBondContact O-CB 3.27Å; I219-K222 PolarHBondContact O-N 3.18Å
220	P	88.2	Confident	94.8	Very high	118 Å²	118	50 Å²	50	77%	0.766	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	129	-175.1	-30.7	35.7	0	0	0	113.2	K222	P220-K222 PolarHBondContact O-N 3.37Å
221	G	86.3	Confident	94.9	Very high	50 Å²	50	51.5 Å²	51.5	52%	0.515	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	6.6	-179.9	0	0	0	0	0	115.3	Y64 I219	Y64-G221 WeakPolarHBondContact CE1-O 3.25Å; I219-G221 PolarHBondContact O-N 3.45Å
222	K	93.9	Very high	94.9	Very high	122 Å²	122	58.5 Å²	58.5	53%	0.53	32%	0.316	S	S	.	.	S	Bend	trans	-110.1	154.9	171.5	-63.1	-165.9	-177.7	-179.7	0	111.3	F63 T217 I219 P220	F63-K222 VanDerWaalsContact CE1-C 3.49Å; F63-K222 VanDerWaalsContact CZ-O 3.25Å; F63-K222 WeakPolarHBondContact CZ-O 3.45Å; T217-K222 VanDerWaalsContact CB-O 3.23Å; T217-K222 WeakPolarHBondContact CB-O 3.48Å; T217-K222 PolarHBondContact OG1-O 3.38Å; I219-K222 HydrophobicContact CB-CB 4.16Å; I219-K222 HydrophobicContact CB-CD 4.34Å; I219-K222 HydrophobicContact CB-CG 4.43Å; I219-K222 HydrophobicContact CG2-CB 4.29Å; I219-K222 HydrophobicContact CG2-CD 3.8Å; I219-K222 HydrophobicContact CG2-CG 4.01Å; I219-K222 WeakPolarHBondContact O-CB 3.27Å; I219-K222 PolarHBondContact O-N 3.18Å; P220-K222 PolarHBondContact O-N 3.37Å
223	I	94.6	Very high	94.9	Very high	45 Å²	45	60.3 Å²	60.3	23%	0.231	32%	0.323	C	S	.	.			trans	-56.9	129.6	173.5	-57.3	174.9	0	0	0	109	R59 F63 Y64	R59-I223 HydrophobicContact CG-CG2 3.43Å; R59-I223 VanDerWaalsContact CG-CG2 3.43Å; R59-I223 VanDerWaalsContact NH2-CG2 3.31Å; F63-I223 HydrophobicContact CB-CG1 4.27Å; F63-I223 HydrophobicContact CD1-CB 4.41Å; F63-I223 HydrophobicContact CD1-CG1 3.57Å; F63-I223 HydrophobicContact CD2-CG1 4.49Å; F63-I223 HydrophobicContact CE1-CB 4.47Å; F63-I223 HydrophobicContact CE1-CG1 4.01Å; F63-I223 HydrophobicContact CG-CG1 3.84Å; Y64-I223 HydrophobicContact CE2-CD1 3.89Å; Y64-I223 HydrophobicContact CE2-CG1 3.83Å
224	P	94.4	Very high	95.1	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	31%	0.306	C	S	.	.			trans	-61.4	138.4	-174.1	20.4	-32.5	0	0	0	112.9	R59 D218 S226 W313	R59-P224 PolarHBondContact NH1-O 2.91Å; R59-P224 PolarHBondContact NH2-O 3.47Å; D218-P224 WeakPolarHBondContact OD1-CA 3.45Å; P224-S226 PolarHBondContact O-N 3.17Å; P224-W313 HydrophobicContact CB-CH2 3.46Å; P224-W313 VanDerWaalsContact CB-CH2 3.46Å; P224-W313 HydrophobicContact CB-CZ2 4.34Å; P224-W313 HydrophobicContact CB-CZ3 4.14Å
225	N	95.3	Very high	95.2	Very high	94 Å²	94	59.5 Å²	59.5	50%	0.503	32%	0.324	S	S	.	.	S	Bend	trans	-77.6	57.9	174.2	-68.3	-53.1	0	0	0	112.2	D218	D218-N225 PolarHBondContact OD1-N 3.28Å; D218-N225 WeakPolarHBondContact OD2-CB 3.37Å; D218-N225 PolarHBondContact OD2-ND2 3.33Å
226	S	96.6	Very high	95.3	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.			trans	-106.2	-3	-169.5	63.5	0	0	0	0	114.9	P224 I228 P229 A230 I296 L297	P224-S226 PolarHBondContact O-N 3.17Å; S226-I228 PolarHBondContact O-N 3.16Å; S226-P229 WeakPolarHBondContact O-CD 3.25Å; S226-A230 VanDerWaalsContact O-CB 3.26Å; S226-A230 WeakPolarHBondContact O-CB 3.28Å; S226-A230 PolarHBondContact O-N 2.95Å; S226-I296 WeakPolarHBondContact CB-O 3.46Å; S226-I296 PolarHBondContact OG-O 3.14Å; S226-L297 PolarHBondContact OG-O 2.85Å
227	T	97.1	Very high	95.4	Very high	58 Å²	58	56.4 Å²	56.4	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-48.6	-177.4	-52.8	0	0	0	0	112.8	A230 L231	T227-A230 PolarHBondContact O-N 3.29Å; T227-L231 HydrophobicContact CG2-CD1 4.22Å; T227-L231 WeakPolarHBondContact O-CB 3.4Å; T227-L231 WeakPolarHBondContact O-CG 3.48Å; T227-L231 PolarHBondContact O-N 3.26Å
228	I	97.1	Very high	95.6	Very high	115 Å²	115	59.4 Å²	59.4	59%	0.59	33%	0.326	S	S	*	.	H	α-helix	trans	-65.8	-48	178.9	-62.6	171.4	0	0	0	111.2	S226 A230 L231 K232	S226-I228 PolarHBondContact O-N 3.16Å; I228-A230 VanDerWaalsContact C-N 3.31Å; I228-A230 PolarHBondContact O-N 3.34Å; I228-L231 PolarHBondContact O-N 3.18Å; I228-K232 HydrophobicContact CG2-CD 4.44Å; I228-K232 WeakPolarHBondContact O-CG 3.46Å; I228-K232 PolarHBondContact O-N 3.37Å
229	P	97.3	Very high	95.8	Very high	36 Å²	36	64.8 Å²	64.8	23%	0.234	35%	0.348	C	S	.	.	H	α-helix	trans	-53	-44.4	171.1	-29.7	35.4	0	0	0	114	S226 K232 R233 I296 W313	S226-P229 WeakPolarHBondContact O-CD 3.25Å; P229-K232 PolarHBondContact O-N 2.78Å; P229-R233 PolarHBondContact O-N 3.03Å; P229-R233 VanDerWaalsContact O-N 3.1Å; P229-I296 HydrophobicContact CB-CG2 3.71Å; P229-W313 HydrophobicContact CB-CB 4.26Å; P229-W313 HydrophobicContact CB-CG 3.91Å; P229-W313 HydrophobicContact CG-CG 4.15Å
230	A	98.3	Very high	96	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-46.5	178	0	0	0	0	0	111.8	S226 T227 I228 K232 R233 L234 G293 I296 L297	S226-A230 VanDerWaalsContact O-CB 3.26Å; S226-A230 WeakPolarHBondContact O-CB 3.28Å; S226-A230 PolarHBondContact O-N 2.95Å; T227-A230 PolarHBondContact O-N 3.29Å; I228-A230 VanDerWaalsContact C-N 3.31Å; I228-A230 PolarHBondContact O-N 3.34Å; A230-K232 PolarHBondContact O-N 2.88Å; A230-R233 WeakPolarHBondContact O-CB 3.43Å; A230-R233 PolarHBondContact O-N 3.36Å; A230-R233 VanDerWaalsContact O-N 3.12Å; A230-L234 PolarHBondContact O-N 3.5Å; A230-G293 VanDerWaalsContact CB-O 3.31Å; A230-G293 WeakPolarHBondContact CB-O 3.26Å; A230-I296 HydrophobicContact CB-CB 4.22Å; A230-I296 HydrophobicContact CB-CG2 3.93Å; A230-L297 HydrophobicContact CB-CB 3.78Å; A230-L297 HydrophobicContact CB-CD1 4.26Å
231	L	98.2	Very high	96.3	Very high	91 Å²	91	58.6 Å²	58.6	48%	0.476	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-41.9	177.4	-74	174.8	0	0	0	112	T227 I228 R233 L234 S235	T227-L231 HydrophobicContact CG2-CD1 4.22Å; T227-L231 WeakPolarHBondContact O-CB 3.4Å; T227-L231 WeakPolarHBondContact O-CG 3.48Å; T227-L231 PolarHBondContact O-N 3.26Å; I228-L231 PolarHBondContact O-N 3.18Å; L231-R233 PolarHBondContact O-N 2.72Å; L231-L234 HydrophobicContact CD2-CD2 4.44Å; L231-L234 PolarHBondContact O-N 2.77Å; L231-S235 WeakPolarHBondContact O-CB 3.27Å; L231-S235 PolarHBondContact O-N 3.21Å; L231-S235 PolarHBondContact O-OG 2.68Å
232	K	97.8	Very high	96.7	Very high	150 Å²	150	60.3 Å²	60.3	65%	0.652	31%	0.308	S	S	*	.	H	α-helix	trans	-58.7	-40	174.1	-74.1	-178.2	177.6	-173.6	0	111.7	I228 P229 A230 L236	I228-K232 HydrophobicContact CG2-CD 4.44Å; I228-K232 WeakPolarHBondContact O-CG 3.46Å; I228-K232 PolarHBondContact O-N 3.37Å; P229-K232 PolarHBondContact O-N 2.78Å; A230-K232 PolarHBondContact O-N 2.88Å; K232-L236 PolarHBondContact O-N 3.35Å; K232-L236 VanDerWaalsContact O-N 3.17Å
233	R	97.8	Very high	96.7	Very high	43 Å²	43	55.8 Å²	55.8	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-43.7	178.3	-153.8	70.1	175.5	157.7	-0.5	112	P229 A230 L231 L236 G237 L289 E292 I296 M319	P229-R233 PolarHBondContact O-N 3.03Å; P229-R233 VanDerWaalsContact O-N 3.1Å; A230-R233 WeakPolarHBondContact O-CB 3.43Å; A230-R233 PolarHBondContact O-N 3.36Å; A230-R233 VanDerWaalsContact O-N 3.12Å; L231-R233 PolarHBondContact O-N 2.72Å; R233-L236 PolarHBondContact O-N 3.3Å; R233-G237 PolarHBondContact O-N 3.25Å; R233-L289 WeakPolarHBondContact CG-O 3.5Å; R233-L289 VanDerWaalsContact NH2-CD2 3.28Å; R233-E292 HydrophobicContact CG-CB 3.98Å; R233-E292 IonicContact CZ-OE2 2.71Å; R233-E292 IonicContact NE-OE2 2.67Å; R233-E292 PolarHBondContact NE-OE2 3.27Å; R233-E292 IonicContact NH2-OE1 3.06Å; R233-E292 IonicContact NH2-OE2 3.23Å; R233-E292 PolarHBondContact NH2-OE2 3.16Å; R233-I296 HydrophobicContact CB-CD1 4.12Å; R233-I296 HydrophobicContact CG-CD1 4.13Å; R233-M319 PolarHBondContact NH2-O 3.03Å
234	L	98.2	Very high	96.6	Very high	26 Å²	26	56 Å²	56	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-50.5	173.5	177.3	55.6	0	0	0	111.7	F49 Y52 A230 L231 L236 G237 L238 V290	F49-L234 HydrophobicContact CE1-CD1 3.8Å; F49-L234 HydrophobicContact CZ-CD1 4.41Å; Y52-L234 HydrophobicContact CD1-CD2 4.3Å; Y52-L234 HydrophobicContact CE1-CB 4.12Å; Y52-L234 HydrophobicContact CE1-CD1 4.45Å; Y52-L234 HydrophobicContact CE1-CD2 3.83Å; Y52-L234 HydrophobicContact CE1-CG 4.35Å; Y52-L234 HydrophobicContact CE2-CD1 3.91Å; Y52-L234 HydrophobicContact CE2-CD2 4.48Å; Y52-L234 WeakPolarHBondContact OH-CB 3.32Å; A230-L234 PolarHBondContact O-N 3.5Å; L231-L234 HydrophobicContact CD2-CD2 4.44Å; L231-L234 PolarHBondContact O-N 2.77Å; L234-L236 VanDerWaalsContact C-N 3.27Å; L234-L236 PolarHBondContact O-N 2.91Å; L234-G237 CarbonylContact O-C 3.58Å; L234-G237 WeakPolarHBondContact O-CA 3.48Å; L234-G237 PolarHBondContact O-N 3.18Å; L234-L238 HydrophobicContact CD1-CD1 4.23Å; L234-L238 HydrophobicContact CD1-CG 4.14Å; L234-L238 HydrophobicContact CG-CD1 4.1Å; L234-L238 HydrophobicContact CG-CG 4.45Å; L234-L238 WeakPolarHBondContact O-CG 3.25Å; L234-L238 PolarHBondContact O-N 2.98Å; L234-V290 HydrophobicContact CD1-CG1 4.29Å; L234-V290 HydrophobicContact CD1-CG2 4.41Å
235	S	98.3	Very high	96.4	Very high	74 Å²	74	59.6 Å²	59.6	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-58.9	-39.2	179.7	-61.3	0	0	0	0	112.1	L231 L238 F239	L231-S235 WeakPolarHBondContact O-CB 3.27Å; L231-S235 PolarHBondContact O-N 3.21Å; L231-S235 PolarHBondContact O-OG 2.68Å; S235-L238 PolarHBondContact O-N 2.99Å; S235-F239 PolarHBondContact O-N 3.36Å
236	L	97.9	Very high	96.2	Very high	55 Å²	55	60.8 Å²	60.8	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-66.5	-41.4	174.6	-168.6	59.2	0	0	0	111.5	K232 R233 L234 L238 F239 Y240 L289 V321	K232-L236 PolarHBondContact O-N 3.35Å; K232-L236 VanDerWaalsContact O-N 3.17Å; R233-L236 PolarHBondContact O-N 3.3Å; L234-L236 VanDerWaalsContact C-N 3.27Å; L234-L236 PolarHBondContact O-N 2.91Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L236-L238 PolarHBondContact O-N 3.12Å; L236-F239 WeakPolarHBondContact O-CB 3.26Å; L236-F239 PolarHBondContact O-N 2.91Å; L236-Y240 HydrophobicContact CD1-CD2 4.31Å; L236-Y240 HydrophobicContact CD1-CE2 4.02Å; L236-Y240 HydrophobicContact CG-CD2 4.32Å; L236-Y240 HydrophobicContact CG-CE2 4.25Å; L236-Y240 WeakPolarHBondContact O-CD2 3.28Å; L236-Y240 PolarHBondContact O-N 2.8Å; L236-Y240 VanDerWaalsContact O-N 3.15Å; L236-L289 HydrophobicContact CB-CD1 4.3Å; L236-L289 HydrophobicContact CD2-CD1 4.21Å; L236-L289 HydrophobicContact CD2-CD2 4.13Å; L236-L289 HydrophobicContact CG-CD1 3.8Å; L236-V321 HydrophobicContact CD2-CB 4.2Å; L236-V321 HydrophobicContact CD2-CG1 4.47Å; L236-V321 HydrophobicContact CD2-CG2 3.73Å; L236-V321 HydrophobicContact CG-CG2 4.49Å
237	G	97.6	Very high	95.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-42.3	173.7	0	0	0	0	0	112.9	R233 L234 Y240 L241	R233-G237 PolarHBondContact O-N 3.25Å; L234-G237 CarbonylContact O-C 3.58Å; L234-G237 WeakPolarHBondContact O-CA 3.48Å; L234-G237 PolarHBondContact O-N 3.18Å; G237-Y240 PolarHBondContact O-N 3.43Å; G237-L241 WeakPolarHBondContact O-CB 3.32Å; G237-L241 PolarHBondContact O-N 2.95Å
238	L	97.6	Very high	95.6	Very high	68 Å²	68	63.5 Å²	63.5	36%	0.356	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-39.5	175.6	-72.3	172	0	0	0	112.4	F49 L234 S235 L236 L241 V242	F49-L238 HydrophobicContact CE1-CD2 3.93Å; F49-L238 HydrophobicContact CZ-CD2 3.59Å; L234-L238 HydrophobicContact CD1-CD1 4.23Å; L234-L238 HydrophobicContact CD1-CG 4.14Å; L234-L238 HydrophobicContact CG-CD1 4.1Å; L234-L238 HydrophobicContact CG-CG 4.45Å; L234-L238 WeakPolarHBondContact O-CG 3.25Å; L234-L238 PolarHBondContact O-N 2.98Å; S235-L238 PolarHBondContact O-N 2.99Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L236-L238 PolarHBondContact O-N 3.12Å; L238-L241 HydrophobicContact CD2-CD2 4.4Å; L238-L241 WeakPolarHBondContact O-CB 3.21Å; L238-L241 PolarHBondContact O-N 2.66Å; L238-V242 WeakPolarHBondContact O-CG2 3.46Å; L238-V242 PolarHBondContact O-N 3.3Å
239	F	97.3	Very high	95.2	Very high	145 Å²	145	62.5 Å²	62.5	64%	0.636	34%	0.338	S	S	*	.	H	α-helix	trans	-59.2	-47.8	174.8	173.4	-96.4	0	0	0	111.6	S235 L236 G243	S235-F239 PolarHBondContact O-N 3.36Å; L236-F239 WeakPolarHBondContact O-CB 3.26Å; L236-F239 PolarHBondContact O-N 2.91Å; F239-G243 PolarHBondContact O-N 3.44Å
240	Y	96.5	Very high	94.9	Very high	19 Å²	19	67.6 Å²	67.6	8%	0.075	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-35.7	176.1	-83.5	-81	0	0	0	112.7	L236 G237 G243 Y244 Y282 V285 T286 L289 V321 E325	L236-Y240 HydrophobicContact CD1-CD2 4.31Å; L236-Y240 HydrophobicContact CD1-CE2 4.02Å; L236-Y240 HydrophobicContact CG-CD2 4.32Å; L236-Y240 HydrophobicContact CG-CE2 4.25Å; L236-Y240 WeakPolarHBondContact O-CD2 3.28Å; L236-Y240 PolarHBondContact O-N 2.8Å; L236-Y240 VanDerWaalsContact O-N 3.15Å; G237-Y240 PolarHBondContact O-N 3.43Å; Y240-G243 PolarHBondContact O-N 3.45Å; Y240-Y244 VanDerWaalsContact O-CB 3.28Å; Y240-Y244 WeakPolarHBondContact O-CB 3.31Å; Y240-Y244 PolarHBondContact O-N 3.23Å; Y240-Y282 AromaticContact CD1-CD1 3.84Å; Y240-Y282 HydrophobicContact CD1-CD1 3.84Å; Y240-Y282 HydrophobicContact CD1-CD2 4.28Å; Y240-Y282 HydrophobicContact CD1-CE1 4.16Å; Y240-Y282 AromaticContact CD1-CG 3.89Å; Y240-Y282 HydrophobicContact CD1-CG 3.89Å; Y240-Y282 AromaticContact CE1-CD1 3.61Å; Y240-Y282 HydrophobicContact CE1-CD1 3.61Å; Y240-Y282 HydrophobicContact CE1-CD2 4.34Å; Y240-Y282 AromaticContact CE1-CE1 3.46Å; Y240-Y282 HydrophobicContact CE1-CE1 3.46Å; Y240-Y282 VanDerWaalsContact CE1-CE1 3.46Å; Y240-Y282 HydrophobicContact CE1-CE2 4.24Å; Y240-Y282 HydrophobicContact CE1-CG 4.05Å; Y240-Y282 AromaticContact CE1-CZ 3.78Å; Y240-V285 HydrophobicContact CD1-CG1 4.01Å; Y240-V285 HydrophobicContact CD2-CG1 3.97Å; Y240-V285 HydrophobicContact CE1-CG1 4.2Å; Y240-V285 HydrophobicContact CE2-CG1 4.16Å; Y240-V285 HydrophobicContact CG-CG1 3.89Å; Y240-T286 WeakPolarHBondContact CB-OG1 3.17Å; Y240-L289 HydrophobicContact CD2-CD1 3.6Å; Y240-L289 HydrophobicContact CE2-CD1 4.14Å; Y240-L289 HydrophobicContact CG-CD1 4.37Å; Y240-V321 HydrophobicContact CE2-CG1 3.88Å; Y240-V321 HydrophobicContact CE2-CG2 4.29Å; Y240-V321 WeakPolarHBondContact OH-CG1 3.39Å; Y240-E325 PolarHBondContact OH-OE1 3.11Å
241	L	94.7	Very high	94.7	Very high	37 Å²	37	69 Å²	69	19%	0.194	37%	0.366	C	S	.	.	H	α-helix	trans	-59.6	-52.5	175.3	-179.5	57.7	0	0	0	111	F49 G237 L238 G243 Y244 T245 T286	F49-L241 HydrophobicContact CE2-CD2 4.32Å; F49-L241 HydrophobicContact CZ-CD2 4.38Å; G237-L241 WeakPolarHBondContact O-CB 3.32Å; G237-L241 PolarHBondContact O-N 2.95Å; L238-L241 HydrophobicContact CD2-CD2 4.4Å; L238-L241 WeakPolarHBondContact O-CB 3.21Å; L238-L241 PolarHBondContact O-N 2.66Å; L241-G243 PolarHBondContact O-N 3.31Å; L241-Y244 PolarHBondContact O-N 3.16Å; L241-T245 WeakPolarHBondContact O-CB 3.38Å; L241-T245 PolarHBondContact O-N 2.79Å; L241-T245 PolarHBondContact O-OG1 2.95Å; L241-T245 VanDerWaalsContact O-OG1 3.09Å; L241-T286 HydrophobicContact CB-CG2 3.52Å; L241-T286 HydrophobicContact CD1-CG2 3.8Å; L241-T286 HydrophobicContact CG-CG2 4.16Å; L241-T286 PolarHBondContact N-OG1 3.4Å
242	V	94.3	Very high	94.4	Very high	86 Å²	86	66.3 Å²	66.3	52%	0.521	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-47.2	179.2	172.1	0	0	0	0	110.4	L238 Y244 T245 L246	L238-V242 WeakPolarHBondContact O-CG2 3.46Å; L238-V242 PolarHBondContact O-N 3.3Å; V242-Y244 VanDerWaalsContact C-N 3.33Å; V242-Y244 PolarHBondContact O-N 3.38Å; V242-T245 PolarHBondContact O-N 3.33Å; V242-L246 HydrophobicContact CG1-CD1 3.86Å; V242-L246 HydrophobicContact CG1-CG 4.4Å; V242-L246 VanDerWaalsContact O-CG 3.29Å; V242-L246 WeakPolarHBondContact O-CG 3.49Å; V242-L246 PolarHBondContact O-N 3.47Å
243	G	93.6	Very high	94.2	Very high	27 Å²	27	61 Å²	61	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-58.9	-43.4	177.3	0	0	0	0	0	112.8	F239 Y240 L241 L247	F239-G243 PolarHBondContact O-N 3.44Å; Y240-G243 PolarHBondContact O-N 3.45Å; L241-G243 PolarHBondContact O-N 3.31Å; G243-L247 WeakPolarHBondContact O-CB 3.41Å; G243-L247 VanDerWaalsContact O-CG 3.32Å; G243-L247 WeakPolarHBondContact O-CG 3.44Å; G243-L247 PolarHBondContact O-N 2.84Å; G243-L247 VanDerWaalsContact O-N 3.16Å
244	Y	92.6	Very high	94	Very high	51 Å²	51	64 Å²	64	20%	0.2	35%	0.349	C	S	.	.	H	α-helix	trans	-65.2	-48.7	177.5	-176.9	-95.4	0	0	0	111.7	Y240 L241 V242 L246 L247 S248 F279 K283	Y240-Y244 VanDerWaalsContact O-CB 3.28Å; Y240-Y244 WeakPolarHBondContact O-CB 3.31Å; Y240-Y244 PolarHBondContact O-N 3.23Å; L241-Y244 PolarHBondContact O-N 3.16Å; V242-Y244 VanDerWaalsContact C-N 3.33Å; V242-Y244 PolarHBondContact O-N 3.38Å; Y244-L246 VanDerWaalsContact C-N 3.28Å; Y244-L246 PolarHBondContact O-N 2.84Å; Y244-L247 PolarHBondContact O-N 2.86Å; Y244-S248 VanDerWaalsContact O-CB 3.24Å; Y244-S248 WeakPolarHBondContact O-CB 3.25Å; Y244-S248 PolarHBondContact O-N 3.23Å; Y244-S248 PolarHBondContact O-OG 3.48Å; Y244-F279 AromaticContact CD2-CE1 3.92Å; Y244-F279 HydrophobicContact CD2-CE1 3.92Å; Y244-F279 AromaticContact CD2-CE2 4Å; Y244-F279 HydrophobicContact CD2-CE2 4Å; Y244-F279 AromaticContact CD2-CZ 3.48Å; Y244-F279 HydrophobicContact CD2-CZ 3.48Å; Y244-F279 VanDerWaalsContact CD2-CZ 3.48Å; Y244-F279 AromaticContact CE2-CE1 3.81Å; Y244-F279 HydrophobicContact CE2-CE1 3.81Å; Y244-F279 AromaticContact CE2-CZ 3.86Å; Y244-F279 HydrophobicContact CE2-CZ 3.86Å; Y244-F279 HydrophobicContact CG-CZ 4.19Å; Y244-K283 HydrophobicContact CD2-CB 4.21Å; Y244-K283 HydrophobicContact CE1-CB 4.09Å; Y244-K283 HydrophobicContact CE2-CB 3.74Å; Y244-K283 HydrophobicContact CE2-CD 4.45Å
245	T	89.9	Confident	93.9	Very high	75 Å²	75	65 Å²	65	46%	0.46	35%	0.351	S	S	.	.	H	α-helix	trans	-59.6	-37.4	179.7	-62	0	0	0	0	112.6	L241 V242	L241-T245 WeakPolarHBondContact O-CB 3.38Å; L241-T245 PolarHBondContact O-N 2.79Å; L241-T245 PolarHBondContact O-OG1 2.95Å; L241-T245 VanDerWaalsContact O-OG1 3.09Å; V242-T245 PolarHBondContact O-N 3.33Å
246	L	91.3	Very high	93.8	Very high	119 Å²	119	61.4 Å²	61.4	62%	0.623	33%	0.327	S	S	*	.	H	α-helix	trans	-74.6	-32.2	179	-67.9	175.8	0	0	0	113.2	V242 Y244	V242-L246 HydrophobicContact CG1-CD1 3.86Å; V242-L246 HydrophobicContact CG1-CG 4.4Å; V242-L246 VanDerWaalsContact O-CG 3.29Å; V242-L246 WeakPolarHBondContact O-CG 3.49Å; V242-L246 PolarHBondContact O-N 3.47Å; Y244-L246 VanDerWaalsContact C-N 3.28Å; Y244-L246 PolarHBondContact O-N 2.84Å
247	L	91.6	Very high	93.7	Very high	80 Å²	80	60.9 Å²	60.9	42%	0.419	32%	0.324	S	S	.	.	H	α-helix	trans	-100.4	-22	-172.2	-66.7	174.6	0	0	0	113.8	G243 Y244 H250 I251 F279	G243-L247 WeakPolarHBondContact O-CB 3.41Å; G243-L247 VanDerWaalsContact O-CG 3.32Å; G243-L247 WeakPolarHBondContact O-CG 3.44Å; G243-L247 PolarHBondContact O-N 2.84Å; G243-L247 VanDerWaalsContact O-N 3.16Å; Y244-L247 PolarHBondContact O-N 2.86Å; L247-H250 PolarHBondContact O-N 3.49Å; L247-I251 PolarHBondContact O-N 3.39Å; L247-F279 HydrophobicContact CB-CD2 4.18Å; L247-F279 HydrophobicContact CB-CE1 4.5Å; L247-F279 HydrophobicContact CB-CE2 3.35Å; L247-F279 HydrophobicContact CB-CZ 3.54Å; L247-F279 HydrophobicContact CD1-CD2 4.27Å; L247-F279 HydrophobicContact CD1-CE2 3.94Å; L247-F279 HydrophobicContact CG-CE2 4.28Å
248	S	89.5	Confident	93.6	Very high	36 Å²	36	63.2 Å²	63.2	25%	0.252	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-30.7	-176.2	65.6	0	0	0	0	115.2	Y244 H250 F279	Y244-S248 VanDerWaalsContact O-CB 3.24Å; Y244-S248 WeakPolarHBondContact O-CB 3.25Å; Y244-S248 PolarHBondContact O-N 3.23Å; Y244-S248 PolarHBondContact O-OG 3.48Å; S248-H250 PolarHBondContact O-N 3.41Å; S248-F279 VanDerWaalsContact N-CZ 3.35Å
249	P	89.4	Confident	93.5	Very high	93 Å²	93	67.2 Å²	67.2	60%	0.604	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.1	172.2	-21.1	35.2	0	0	0	113.6
250	H	90.9	Very high	93.5	Very high	143 Å²	143	64.5 Å²	64.5	66%	0.662	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-28.2	-175.3	-59.8	-65.3	0	0	0	113.3	L247 S248	L247-H250 PolarHBondContact O-N 3.49Å; S248-H250 PolarHBondContact O-N 3.41Å
251	I	94.1	Very high	93.5	Very high	32 Å²	32	63.6 Å²	63.6	16%	0.164	34%	0.344	C	S	.	.	S	Bend	trans	-121.8	86.3	-178.2	-52.7	172.7	0	0	0	107.8	L247 I275 W276 F279	L247-I251 PolarHBondContact O-N 3.39Å; I251-I275 HydrophobicContact CD1-CG2 4.03Å; I251-W276 HydrophobicContact CG2-CB 3.91Å; I251-W276 HydrophobicContact CG2-CG 4.45Å; I251-F279 HydrophobicContact CB-CD1 3.7Å; I251-F279 HydrophobicContact CB-CE1 4.1Å; I251-F279 HydrophobicContact CB-CG 4.18Å; I251-F279 HydrophobicContact CD1-CD2 4.48Å; I251-F279 HydrophobicContact CD1-CG 4.28Å; I251-F279 HydrophobicContact CG2-CB 4.01Å; I251-F279 HydrophobicContact CG2-CD1 3.66Å; I251-F279 HydrophobicContact CG2-CG 4Å; I251-F279 WeakPolarHBondContact O-CD1 3.27Å; I251-F279 WeakPolarHBondContact O-CE1 3.28Å
252	T	92.3	Very high	93.5	Very high	34 Å²	34	63.9 Å²	63.9	21%	0.209	35%	0.345	C	S	.	.			trans	-119.9	148.6	-174.6	173.7	0	0	0	0	112	D254 Y255 Y272	T252-D254 HydrophobicContact CG2-CB 4.25Å; T252-D254 PolarHBondContact O-N 3.43Å; T252-D254 PolarHBondContact OG1-N 2.82Å; T252-D254 PolarHBondContact OG1-OD2 3.49Å; T252-Y255 PolarHBondContact O-N 2.98Å; T252-Y272 PolarHBondContact N-OH 2.94Å; T252-Y272 PolarHBondContact O-OH 2.91Å
253	E	92.4	Very high	93.6	Very high	38 Å²	38	66 Å²	66	18%	0.178	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-29	168.1	50.9	-97.1	-126.9	0	0	112.9	Y255 L256 W276 K283 L441	E253-Y255 PolarHBondContact O-N 3.31Å; E253-L256 VanDerWaalsContact O-CB 3.3Å; E253-L256 WeakPolarHBondContact O-CB 3.42Å; E253-L256 PolarHBondContact O-N 3.04Å; E253-L256 VanDerWaalsContact O-N 3.16Å; E253-W276 HydrophobicContact CB-CZ2 3.74Å; E253-W276 VanDerWaalsContact N-NE1 3.13Å; E253-K283 IonicContact OE1-NZ 3.94Å; E253-L441 HydrophobicContact CB-CD2 4.16Å
254	D	93.3	Very high	93.8	Very high	105 Å²	105	67.7 Å²	67.7	56%	0.561	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-64.2	-33.6	-179.2	-65.4	-39.9	0	0	0	111.7	T252 L256 L257	T252-D254 HydrophobicContact CG2-CB 4.25Å; T252-D254 PolarHBondContact O-N 3.43Å; T252-D254 PolarHBondContact OG1-N 2.82Å; T252-D254 PolarHBondContact OG1-OD2 3.49Å; D254-L256 PolarHBondContact O-N 2.78Å; D254-L257 WeakPolarHBondContact O-CB 3.44Å; D254-L257 PolarHBondContact O-N 2.84Å
255	Y	96.2	Very high	94	Very high	47 Å²	47	69.6 Å²	69.6	18%	0.184	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-60.3	-35.6	177.5	-176.3	-112.2	0	0	0	111.9	T252 E253 L257 T258 D260 Y261 H264 F268 Y272	T252-Y255 PolarHBondContact O-N 2.98Å; E253-Y255 PolarHBondContact O-N 3.31Å; Y255-L257 PolarHBondContact O-N 3.49Å; Y255-T258 HydrophobicContact CD2-CG2 4.41Å; Y255-T258 WeakPolarHBondContact O-CB 3.26Å; Y255-T258 PolarHBondContact O-N 3.34Å; Y255-T258 PolarHBondContact O-OG1 2.98Å; Y255-D260 HydrophobicContact CE2-CB 4.22Å; Y255-D260 WeakPolarHBondContact CE2-OD2 3.19Å; Y255-D260 PolarHBondContact OH-OD2 3.17Å; Y255-Y261 AromaticContact CD1-CD2 3.94Å; Y255-Y261 HydrophobicContact CD1-CD2 3.94Å; Y255-Y261 HydrophobicContact CD1-CG 4.46Å; Y255-Y261 AromaticContact CE1-CD2 3.73Å; Y255-Y261 HydrophobicContact CE1-CD2 3.73Å; Y255-Y261 HydrophobicContact CE1-CG 4.33Å; Y255-Y261 WeakPolarHBondContact O-CB 3.24Å; Y255-H264 PolarHBondContact OH-CD2 3.4Å; Y255-H264 VanDerWaalsContact OH-CD2 3.26Å; Y255-H264 PolarHBondContact OH-NE2 3.27Å; Y255-F268 HydrophobicContact CE1-CE1 4.22Å; Y255-Y272 WeakPolarHBondContact CB-OH 3.4Å; Y255-Y272 HydrophobicContact CD1-CD1 4.01Å; Y255-Y272 AromaticContact CD1-CD2 3.87Å; Y255-Y272 HydrophobicContact CD1-CD2 3.87Å; Y255-Y272 AromaticContact CD1-CE1 3.62Å; Y255-Y272 HydrophobicContact CD1-CE1 3.62Å; Y255-Y272 AromaticContact CD1-CE2 3.45Å; Y255-Y272 HydrophobicContact CD1-CE2 3.45Å; Y255-Y272 VanDerWaalsContact CD1-CE2 3.45Å; Y255-Y272 HydrophobicContact CD1-CG 4.14Å; Y255-Y272 AromaticContact CD1-CZ 3.32Å; Y255-Y272 HydrophobicContact CE1-CD1 4.5Å; Y255-Y272 AromaticContact CE1-CD2 3.9Å; Y255-Y272 HydrophobicContact CE1-CD2 3.9Å; Y255-Y272 HydrophobicContact CE1-CE1 4.49Å; Y255-Y272 AromaticContact CE1-CE2 3.87Å; Y255-Y272 HydrophobicContact CE1-CE2 3.87Å; Y255-Y272 HydrophobicContact CE1-CG 4.23Å; Y255-Y272 HydrophobicContact CG-CE1 4.46Å; Y255-Y272 HydrophobicContact CG-CE2 4.33Å
256	L	96	Very high	94.4	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-59.9	-22	177.7	-60.2	172.3	0	0	0	112.7	E253 D254 Y261 Y272 W276 V450	E253-L256 VanDerWaalsContact O-CB 3.3Å; E253-L256 WeakPolarHBondContact O-CB 3.42Å; E253-L256 PolarHBondContact O-N 3.04Å; E253-L256 VanDerWaalsContact O-N 3.16Å; D254-L256 PolarHBondContact O-N 2.78Å; L256-Y261 HydrophobicContact CD2-CD2 4.32Å; L256-Y261 HydrophobicContact CD2-CE1 4.38Å; L256-Y261 HydrophobicContact CD2-CE2 3.73Å; L256-Y261 WeakPolarHBondContact O-CD1 3.28Å; L256-Y272 HydrophobicContact CD2-CD1 3.53Å; L256-Y272 HydrophobicContact CD2-CE1 3.63Å; L256-Y272 HydrophobicContact CG-CD1 4.48Å; L256-Y272 HydrophobicContact CG-CE1 4.09Å; L256-W276 HydrophobicContact CD1-CD2 3.82Å; L256-W276 HydrophobicContact CD1-CE3 3.81Å; L256-W276 HydrophobicContact CD1-CH2 4.04Å; L256-W276 HydrophobicContact CD1-CZ2 4.04Å; L256-W276 HydrophobicContact CD1-CZ3 3.92Å; L256-V450 HydrophobicContact CB-CG1 4.35Å; L256-V450 HydrophobicContact CB-CG2 3.93Å; L256-V450 HydrophobicContact CD2-CG1 4.48Å; L256-V450 WeakPolarHBondContact O-CG2 3.47Å
257	L	96.2	Very high	94.6	Very high	43 Å²	43	70.8 Å²	70.8	23%	0.225	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-94.9	-5	-179.1	-60	178.6	0	0	0	113.3	D254 Y255 L441 K446 K449 V450	D254-L257 WeakPolarHBondContact O-CB 3.44Å; D254-L257 PolarHBondContact O-N 2.84Å; Y255-L257 PolarHBondContact O-N 3.49Å; L257-L441 HydrophobicContact CD1-CD2 4.07Å; L257-L441 HydrophobicContact CD2-CD1 4.05Å; L257-L441 HydrophobicContact CD2-CD2 4.37Å; L257-L441 HydrophobicContact CG-CD2 4.23Å; L257-K446 HydrophobicContact CD1-CB 4.47Å; L257-K446 HydrophobicContact CD1-CD 4.13Å; L257-K446 HydrophobicContact CD1-CG 4.17Å; L257-K446 HydrophobicContact CD2-CB 3.98Å; L257-K446 HydrophobicContact CD2-CG 4.38Å; L257-K449 PolarHBondContact O-NZ 3.43Å; L257-V450 HydrophobicContact CD2-CG2 4.02Å
258	T	96.8	Very high	94.9	Very high	50 Å²	50	71 Å²	71	31%	0.307	36%	0.36	S	S	.	.	S	Bend	trans	-80.7	155.4	-176.3	65.7	0	0	0	0	112.7	Y255 D260 Y261 D262	Y255-T258 HydrophobicContact CD2-CG2 4.41Å; Y255-T258 WeakPolarHBondContact O-CB 3.26Å; Y255-T258 PolarHBondContact O-N 3.34Å; Y255-T258 PolarHBondContact O-OG1 2.98Å; T258-D260 VanDerWaalsContact C-N 3.26Å; T258-Y261 PolarHBondContact OG1-N 3.09Å; T258-D262 PolarHBondContact O-N 2.66Å
259	E	95.6	Very high	95.3	Very high	152 Å²	152	70.5 Å²	70.5	71%	0.71	35%	0.353	S	S	*	.	H	α-helix	trans	-66.6	-31.1	170.5	-65.3	-174.8	173.9	0	0	112	D262 N263	E259-D262 PolarHBondContact O-N 3.47Å; E259-D262 VanDerWaalsContact O-N 3.14Å; E259-N263 WeakPolarHBondContact O-CB 3.09Å; E259-N263 PolarHBondContact O-N 3.07Å; E259-N263 PolarHBondContact O-ND2 3.4Å; E259-N263 VanDerWaalsContact O-ND2 3.14Å
260	D	95.8	Very high	95.7	Very high	88 Å²	88	66.1 Å²	66.1	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-48.7	176.2	-174.9	69.4	0	0	0	111.5	Y255 T258 D262 N263 H264	Y255-D260 HydrophobicContact CE2-CB 4.22Å; Y255-D260 WeakPolarHBondContact CE2-OD2 3.19Å; Y255-D260 PolarHBondContact OH-OD2 3.17Å; T258-D260 VanDerWaalsContact C-N 3.26Å; D260-D262 VanDerWaalsContact C-N 3.3Å; D260-D262 PolarHBondContact O-N 3.29Å; D260-N263 PolarHBondContact O-N 3Å; D260-H264 PolarHBondContact O-CD2 3.29Å; D260-H264 VanDerWaalsContact O-CD2 3.26Å; D260-H264 PolarHBondContact O-N 3.07Å; D260-H264 IonicContact OD2-NE2 2.76Å
261	Y	96.1	Very high	95.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57	-43.4	172.7	174.5	-98	0	0	0	112	Y255 L256 T258 N263 H264 R269 Y272 V450	Y255-Y261 AromaticContact CD1-CD2 3.94Å; Y255-Y261 HydrophobicContact CD1-CD2 3.94Å; Y255-Y261 HydrophobicContact CD1-CG 4.46Å; Y255-Y261 AromaticContact CE1-CD2 3.73Å; Y255-Y261 HydrophobicContact CE1-CD2 3.73Å; Y255-Y261 HydrophobicContact CE1-CG 4.33Å; Y255-Y261 WeakPolarHBondContact O-CB 3.24Å; L256-Y261 HydrophobicContact CD2-CD2 4.32Å; L256-Y261 HydrophobicContact CD2-CE1 4.38Å; L256-Y261 HydrophobicContact CD2-CE2 3.73Å; L256-Y261 WeakPolarHBondContact O-CD1 3.28Å; T258-Y261 PolarHBondContact OG1-N 3.09Å; Y261-N263 VanDerWaalsContact C-N 3.31Å; Y261-N263 PolarHBondContact O-N 3.15Å; Y261-H264 PolarHBondContact O-N 2.7Å; Y261-R269 HydrophobicContact CD1-CG 4.33Å; Y261-R269 HydrophobicContact CD2-CG 4.16Å; Y261-R269 HydrophobicContact CE1-CB 4.24Å; Y261-R269 HydrophobicContact CE1-CG 3.99Å; Y261-R269 HydrophobicContact CE2-CB 3.84Å; Y261-R269 HydrophobicContact CE2-CG 3.82Å; Y261-R269 HydrophobicContact CG-CG 4.42Å; Y261-R269 WeakPolarHBondContact O-CD 3.35Å; Y261-R269 VanDerWaalsContact O-CG 3.24Å; Y261-R269 WeakPolarHBondContact O-CG 3.28Å; Y261-R269 WeakPolarHBondContact OH-CB 3.5Å; Y261-R269 PolarHBondContact OH-O 3.47Å; Y261-Y272 HydrophobicContact CD2-CD1 4.3Å; Y261-Y272 AromaticContact CE2-CD1 3.98Å; Y261-Y272 HydrophobicContact CE2-CD1 3.98Å; Y261-Y272 HydrophobicContact CE2-CG 4.31Å; Y261-V450 HydrophobicContact CE1-CG1 4.2Å
262	D	94.8	Very high	96.1	Very high	42 Å²	42	62.5 Å²	62.5	23%	0.225	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-31.7	-179.3	-76.8	-29	0	0	0	113.1	T258 E259 D260 H264 R269 K449 S453	T258-D262 PolarHBondContact O-N 2.66Å; E259-D262 PolarHBondContact O-N 3.47Å; E259-D262 VanDerWaalsContact O-N 3.14Å; D260-D262 VanDerWaalsContact C-N 3.3Å; D260-D262 PolarHBondContact O-N 3.29Å; D262-H264 VanDerWaalsContact C-N 3.29Å; D262-H264 PolarHBondContact O-N 3.24Å; D262-R269 PolarHBondContact O-NH1 3.39Å; D262-K449 WeakPolarHBondContact OD2-CE 3.45Å; D262-K449 IonicContact OD2-NZ 3.35Å; D262-K449 PolarHBondContact OD2-NZ 3.26Å; D262-S453 VanDerWaalsContact OD1-CB 3.28Å; D262-S453 WeakPolarHBondContact OD1-CB 3.34Å
263	N	96.4	Very high	96.2	Very high	132 Å²	132	60.9 Å²	60.9	71%	0.706	30%	0.297	S	S	*	.	H	α-helix	trans	-76	-14.7	179.5	-72.3	-30.6	0	0	0	113.5	E259 D260 Y261	E259-N263 WeakPolarHBondContact O-CB 3.09Å; E259-N263 PolarHBondContact O-N 3.07Å; E259-N263 PolarHBondContact O-ND2 3.4Å; E259-N263 VanDerWaalsContact O-ND2 3.14Å; D260-N263 PolarHBondContact O-N 3Å; Y261-N263 VanDerWaalsContact C-N 3.31Å; Y261-N263 PolarHBondContact O-N 3.15Å
264	H	97.6	Very high	96.4	Very high	61 Å²	61	60.4 Å²	60.4	28%	0.282	30%	0.295	S	S	.	.	S	Bend	trans	-75.2	153.7	177.2	-85.5	-67.3	0	0	0	113.4	Y255 D260 Y261 D262 F268 R269	Y255-H264 PolarHBondContact OH-CD2 3.4Å; Y255-H264 VanDerWaalsContact OH-CD2 3.26Å; Y255-H264 PolarHBondContact OH-NE2 3.27Å; D260-H264 PolarHBondContact O-CD2 3.29Å; D260-H264 VanDerWaalsContact O-CD2 3.26Å; D260-H264 PolarHBondContact O-N 3.07Å; D260-H264 IonicContact OD2-NE2 2.76Å; Y261-H264 PolarHBondContact O-N 2.7Å; D262-H264 VanDerWaalsContact C-N 3.29Å; D262-H264 PolarHBondContact O-N 3.24Å; H264-F268 HydrophobicContact CB-CB 4.07Å; H264-F268 HydrophobicContact CB-CD1 3.31Å; H264-F268 HydrophobicContact CB-CE1 3.94Å; H264-F268 HydrophobicContact CB-CG 3.87Å; H264-F268 AromaticContact CD2-CD1 3.7Å; H264-F268 AromaticContact CD2-CE1 3.34Å; H264-F268 WeakPolarHBondContact CD2-CE1 3.34Å; H264-F268 AromaticContact CD2-CZ 3.93Å; H264-F268 AromaticContact CG-CD1 3.36Å; H264-F268 AromaticContact CG-CE1 3.53Å; H264-F268 AromaticContact CG-CG 3.9Å; H264-F268 AromaticContact ND1-CD1 3.9Å; H264-F268 AromaticContact NE2-CE1 3.77Å; H264-F268 AromaticContact NE2-CZ 3.85Å; H264-R269 HydrophobicContact CB-CG 4.35Å; H264-R269 PolarHBondContact O-NE 2.7Å
265	P	97.8	Very high	96.6	Very high	91 Å²	91	59.9 Å²	59.9	59%	0.591	29%	0.292	S	S	*	.			trans	-55.6	151.9	175.4	-24.7	34	0	0	0	112.8	W267 F268 R269	P265-W267 VanDerWaalsContact C-N 3.29Å; P265-W267 PolarHBondContact O-N 3.24Å; P265-W267 VanDerWaalsContact O-N 3.16Å; P265-F268 WeakPolarHBondContact O-CB 3.37Å; P265-F268 PolarHBondContact O-N 3.38Å; P265-R269 PolarHBondContact O-N 3.19Å
266	F	97.4	Very high	96.6	Very high	52 Å²	52	57.7 Å²	57.7	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-46.6	-48.8	-179.7	173.9	-99.7	0	0	0	113.7	F268 R269 C270 I454 Y455 L457	F266-F268 VanDerWaalsContact C-N 3.34Å; F266-F268 PolarHBondContact O-N 3.31Å; F266-R269 WeakPolarHBondContact O-CB 3.5Å; F266-R269 PolarHBondContact O-N 2.8Å; F266-C270 VanDerWaalsContact CZ-SG 3.59Å; F266-C270 PolarHBondContact O-N 3.05Å; F266-C270 PolarHBondContact O-SG 3.36Å; F266-I454 HydrophobicContact CE2-CB 4.1Å; F266-Y455 AromaticContact CD2-CD2 3.87Å; F266-Y455 HydrophobicContact CD2-CD2 3.87Å; F266-Y455 HydrophobicContact CD2-CE2 4.04Å; F266-Y455 AromaticContact CE2-CD2 3.91Å; F266-Y455 HydrophobicContact CE2-CD2 3.91Å; F266-L457 HydrophobicContact CZ-CD1 4.24Å; F266-L457 HydrophobicContact CZ-CD2 3.99Å; F266-L457 HydrophobicContact CZ-CG 4.48Å
267	W	96.3	Very high	96.6	Very high	168 Å²	168	57.7 Å²	57.7	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-68.7	-31.4	-177.8	-68.7	118.5	0	0	0	113.7	P265 C270 M271	P265-W267 VanDerWaalsContact C-N 3.29Å; P265-W267 PolarHBondContact O-N 3.24Å; P265-W267 VanDerWaalsContact O-N 3.16Å; W267-C270 HydrophobicContact CE3-CB 4.36Å; W267-C270 PolarHBondContact O-N 3.24Å; W267-M271 WeakPolarHBondContact O-CB 3.34Å; W267-M271 VanDerWaalsContact O-CG 3.26Å; W267-M271 WeakPolarHBondContact O-CG 3.5Å; W267-M271 PolarHBondContact O-N 3.23Å
268	F	97.5	Very high	96.5	Very high	85 Å²	85	57.9 Å²	57.9	37%	0.373	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-47.9	173.1	177.6	-85.8	0	0	0	110.3	Y255 H264 P265 F266 C270 M271 Y272	Y255-F268 HydrophobicContact CE1-CE1 4.22Å; H264-F268 HydrophobicContact CB-CB 4.07Å; H264-F268 HydrophobicContact CB-CD1 3.31Å; H264-F268 HydrophobicContact CB-CE1 3.94Å; H264-F268 HydrophobicContact CB-CG 3.87Å; H264-F268 AromaticContact CD2-CD1 3.7Å; H264-F268 AromaticContact CD2-CE1 3.34Å; H264-F268 WeakPolarHBondContact CD2-CE1 3.34Å; H264-F268 AromaticContact CD2-CZ 3.93Å; H264-F268 AromaticContact CG-CD1 3.36Å; H264-F268 AromaticContact CG-CE1 3.53Å; H264-F268 AromaticContact CG-CG 3.9Å; H264-F268 AromaticContact ND1-CD1 3.9Å; H264-F268 AromaticContact NE2-CE1 3.77Å; H264-F268 AromaticContact NE2-CZ 3.85Å; P265-F268 WeakPolarHBondContact O-CB 3.37Å; P265-F268 PolarHBondContact O-N 3.38Å; F266-F268 VanDerWaalsContact C-N 3.34Å; F266-F268 PolarHBondContact O-N 3.31Å; F268-C270 VanDerWaalsContact C-N 3.33Å; F268-C270 PolarHBondContact O-N 3.49Å; F268-M271 PolarHBondContact O-N 3.4Å; F268-M271 VanDerWaalsContact O-N 3.13Å; F268-Y272 PolarHBondContact O-N 3.46Å
269	R	97.6	Very high	96.4	Very high	25 Å²	25	56 Å²	56	9%	0.094	27%	0.269	C	S	.	.	H	α-helix	trans	-57	-45.4	177.4	-69.6	-176.3	-68.8	-176.1	5.4	112	Y261 D262 H264 P265 F266 M273 S453 I454	Y261-R269 HydrophobicContact CD1-CG 4.33Å; Y261-R269 HydrophobicContact CD2-CG 4.16Å; Y261-R269 HydrophobicContact CE1-CB 4.24Å; Y261-R269 HydrophobicContact CE1-CG 3.99Å; Y261-R269 HydrophobicContact CE2-CB 3.84Å; Y261-R269 HydrophobicContact CE2-CG 3.82Å; Y261-R269 HydrophobicContact CG-CG 4.42Å; Y261-R269 WeakPolarHBondContact O-CD 3.35Å; Y261-R269 VanDerWaalsContact O-CG 3.24Å; Y261-R269 WeakPolarHBondContact O-CG 3.28Å; Y261-R269 WeakPolarHBondContact OH-CB 3.5Å; Y261-R269 PolarHBondContact OH-O 3.47Å; D262-R269 PolarHBondContact O-NH1 3.39Å; H264-R269 HydrophobicContact CB-CG 4.35Å; H264-R269 PolarHBondContact O-NE 2.7Å; P265-R269 PolarHBondContact O-N 3.19Å; F266-R269 WeakPolarHBondContact O-CB 3.5Å; F266-R269 PolarHBondContact O-N 2.8Å; R269-M273 WeakPolarHBondContact O-CB 3.01Å; R269-M273 PolarHBondContact O-N 3.11Å; R269-S453 PolarHBondContact NH1-O 3.22Å; R269-S453 VanDerWaalsContact NH1-O 3.08Å; R269-S453 PolarHBondContact NH2-O 2.83Å; R269-I454 HydrophobicContact CB-CG2 3.85Å
270	C	97.7	Very high	96.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-43.8	174.6	-66.6	0	0	0	0	113.2	F266 W267 F268 M273 L274 L430	F266-C270 VanDerWaalsContact CZ-SG 3.59Å; F266-C270 PolarHBondContact O-N 3.05Å; F266-C270 PolarHBondContact O-SG 3.36Å; W267-C270 HydrophobicContact CE3-CB 4.36Å; W267-C270 PolarHBondContact O-N 3.24Å; F268-C270 VanDerWaalsContact C-N 3.33Å; F268-C270 PolarHBondContact O-N 3.49Å; C270-M273 PolarHBondContact O-N 2.95Å; C270-L274 PolarHBondContact O-N 3.22Å; C270-L430 HydrophobicContact CB-CD1 3.86Å; C270-L430 VanDerWaalsContact O-CD1 3.24Å; C270-L430 WeakPolarHBondContact O-CD1 3.25Å
271	M	96.6	Very high	96.2	Very high	72 Å²	72	44.8 Å²	44.8	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-70.4	-37.6	-179.5	-69.7	-56.5	99.4	0	0	112.4	W267 F268 M273 L274 I275	W267-M271 WeakPolarHBondContact O-CB 3.34Å; W267-M271 VanDerWaalsContact O-CG 3.26Å; W267-M271 WeakPolarHBondContact O-CG 3.5Å; W267-M271 PolarHBondContact O-N 3.23Å; F268-M271 PolarHBondContact O-N 3.4Å; F268-M271 VanDerWaalsContact O-N 3.13Å; M271-M273 VanDerWaalsContact C-N 3.35Å; M271-L274 HydrophobicContact CE-CD1 4.24Å; M271-L274 WeakPolarHBondContact O-CB 3.17Å; M271-L274 PolarHBondContact O-N 3.26Å; M271-L274 HydrophobicContact SD-CD1 4.33Å; M271-I275 WeakPolarHBondContact O-CG1 3.27Å; M271-I275 PolarHBondContact O-N 3.44Å
272	Y	97.2	Very high	96.2	Very high	28 Å²	28	46.7 Å²	46.7	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-47.5	172.1	-176.8	-85.7	0	0	0	110.4	T252 Y255 L256 Y261 F268 L274 I275 W276	T252-Y272 PolarHBondContact N-OH 2.94Å; T252-Y272 PolarHBondContact O-OH 2.91Å; Y255-Y272 WeakPolarHBondContact CB-OH 3.4Å; Y255-Y272 HydrophobicContact CD1-CD1 4.01Å; Y255-Y272 AromaticContact CD1-CD2 3.87Å; Y255-Y272 HydrophobicContact CD1-CD2 3.87Å; Y255-Y272 AromaticContact CD1-CE1 3.62Å; Y255-Y272 HydrophobicContact CD1-CE1 3.62Å; Y255-Y272 AromaticContact CD1-CE2 3.45Å; Y255-Y272 HydrophobicContact CD1-CE2 3.45Å; Y255-Y272 VanDerWaalsContact CD1-CE2 3.45Å; Y255-Y272 HydrophobicContact CD1-CG 4.14Å; Y255-Y272 AromaticContact CD1-CZ 3.32Å; Y255-Y272 HydrophobicContact CE1-CD1 4.5Å; Y255-Y272 AromaticContact CE1-CD2 3.9Å; Y255-Y272 HydrophobicContact CE1-CD2 3.9Å; Y255-Y272 HydrophobicContact CE1-CE1 4.49Å; Y255-Y272 AromaticContact CE1-CE2 3.87Å; Y255-Y272 HydrophobicContact CE1-CE2 3.87Å; Y255-Y272 HydrophobicContact CE1-CG 4.23Å; Y255-Y272 HydrophobicContact CG-CE1 4.46Å; Y255-Y272 HydrophobicContact CG-CE2 4.33Å; L256-Y272 HydrophobicContact CD2-CD1 3.53Å; L256-Y272 HydrophobicContact CD2-CE1 3.63Å; L256-Y272 HydrophobicContact CG-CD1 4.48Å; L256-Y272 HydrophobicContact CG-CE1 4.09Å; Y261-Y272 HydrophobicContact CD2-CD1 4.3Å; Y261-Y272 AromaticContact CE2-CD1 3.98Å; Y261-Y272 HydrophobicContact CE2-CD1 3.98Å; Y261-Y272 HydrophobicContact CE2-CG 4.31Å; F268-Y272 PolarHBondContact O-N 3.46Å; Y272-L274 VanDerWaalsContact C-N 3.3Å; Y272-L274 PolarHBondContact O-N 3.35Å; Y272-I275 PolarHBondContact O-N 2.84Å; Y272-W276 HydrophobicContact CD1-CB 4.2Å; Y272-W276 HydrophobicContact CE1-CB 3.85Å; Y272-W276 HydrophobicContact CE1-CG 4.25Å; Y272-W276 VanDerWaalsContact O-CB 3.25Å; Y272-W276 WeakPolarHBondContact O-CB 3.39Å; Y272-W276 PolarHBondContact O-N 3.5Å
273	M	96.1	Very high	96	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-38.8	177.2	-177.4	179	-69.1	0	0	113	R269 C270 M271 G277 Y434 V450 I454	R269-M273 WeakPolarHBondContact O-CB 3.01Å; R269-M273 PolarHBondContact O-N 3.11Å; C270-M273 PolarHBondContact O-N 2.95Å; M271-M273 VanDerWaalsContact C-N 3.35Å; M273-G277 WeakPolarHBondContact O-CA 3.19Å; M273-G277 PolarHBondContact O-N 3Å; M273-Y434 VanDerWaalsContact SD-CA 3.51Å; M273-Y434 HydrophobicContact SD-CD2 3.95Å; M273-Y434 HydrophobicContact SD-CG 4.46Å; M273-V450 HydrophobicContact CE-CG1 3.5Å; M273-I454 HydrophobicContact CE-CD1 3.44Å; M273-I454 VanDerWaalsContact CE-CD1 3.44Å; M273-I454 HydrophobicContact CE-CG1 4.29Å; M273-I454 HydrophobicContact SD-CD1 3.62Å
274	L	96.5	Very high	95.9	Very high	28 Å²	28	42 Å²	42	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-52.4	173.9	-179.5	162.8	0	0	0	111.1	C270 M271 Y272 G277 K278 T426 W429 L430	C270-L274 PolarHBondContact O-N 3.22Å; M271-L274 HydrophobicContact CE-CD1 4.24Å; M271-L274 WeakPolarHBondContact O-CB 3.17Å; M271-L274 PolarHBondContact O-N 3.26Å; M271-L274 HydrophobicContact SD-CD1 4.33Å; Y272-L274 VanDerWaalsContact C-N 3.3Å; Y272-L274 PolarHBondContact O-N 3.35Å; L274-G277 PolarHBondContact O-N 2.93Å; L274-K278 PolarHBondContact O-N 2.87Å; L274-T426 HydrophobicContact CD1-CG2 3.96Å; L274-T426 WeakPolarHBondContact CD1-O 3.22Å; L274-W429 HydrophobicContact CD1-CB 4.28Å; L274-W429 HydrophobicContact CD2-CB 3.8Å; L274-W429 HydrophobicContact CG-CB 3.62Å; L274-L430 HydrophobicContact CB-CB 4.48Å; L274-L430 HydrophobicContact CB-CD1 4.42Å; L274-L430 HydrophobicContact CD1-CB 4.14Å
275	I	96.6	Very high	95.8	Very high	94 Å²	94	39.1 Å²	39.1	48%	0.482	18%	0.179	S	C	.	.	H	α-helix	trans	-65.2	-49.8	-177.3	-66.8	169	0	0	0	110.2	I251 M271 Y272 G277 K278 F279	I251-I275 HydrophobicContact CD1-CG2 4.03Å; M271-I275 WeakPolarHBondContact O-CG1 3.27Å; M271-I275 PolarHBondContact O-N 3.44Å; Y272-I275 PolarHBondContact O-N 2.84Å; I275-G277 VanDerWaalsContact C-N 3.34Å; I275-G277 PolarHBondContact O-N 3.41Å; I275-K278 PolarHBondContact O-N 3.36Å; I275-F279 WeakPolarHBondContact O-CB 3.13Å; I275-F279 PolarHBondContact O-N 3.3Å
276	W	96.9	Very high	95.7	Very high	0 Å²	0	35 Å²	35	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.6	-44.8	177.6	167.9	82	0	0	0	111.8	I251 E253 L256 Y272 K278 F279 V280 M436 C440	I251-W276 HydrophobicContact CG2-CB 3.91Å; I251-W276 HydrophobicContact CG2-CG 4.45Å; E253-W276 HydrophobicContact CB-CZ2 3.74Å; E253-W276 VanDerWaalsContact N-NE1 3.13Å; L256-W276 HydrophobicContact CD1-CD2 3.82Å; L256-W276 HydrophobicContact CD1-CE3 3.81Å; L256-W276 HydrophobicContact CD1-CH2 4.04Å; L256-W276 HydrophobicContact CD1-CZ2 4.04Å; L256-W276 HydrophobicContact CD1-CZ3 3.92Å; Y272-W276 HydrophobicContact CD1-CB 4.2Å; Y272-W276 HydrophobicContact CE1-CB 3.85Å; Y272-W276 HydrophobicContact CE1-CG 4.25Å; Y272-W276 VanDerWaalsContact O-CB 3.25Å; Y272-W276 WeakPolarHBondContact O-CB 3.39Å; Y272-W276 PolarHBondContact O-N 3.5Å; W276-K278 VanDerWaalsContact C-N 3.28Å; W276-K278 PolarHBondContact O-N 3.3Å; W276-F279 PolarHBondContact O-N 2.92Å; W276-V280 HydrophobicContact CH2-CG1 4.4Å; W276-V280 HydrophobicContact CZ2-CB 4.19Å; W276-V280 HydrophobicContact CZ2-CG1 4.12Å; W276-V280 HydrophobicContact CZ2-CG2 4.08Å; W276-V280 WeakPolarHBondContact O-CB 3.18Å; W276-V280 WeakPolarHBondContact O-CG1 3.31Å; W276-V280 PolarHBondContact O-N 3.1Å; W276-M436 HydrophobicContact CH2-CB 4.27Å; W276-M436 HydrophobicContact CZ3-CB 4.21Å; W276-C440 HydrophobicContact CH2-CB 3.89Å; W276-C440 HydrophobicContact CZ2-CB 3.8Å
277	G	95	Very high	95.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-36.5	-179	0	0	0	0	0	114.1	M273 L274 I275 V280	M273-G277 WeakPolarHBondContact O-CA 3.19Å; M273-G277 PolarHBondContact O-N 3Å; L274-G277 PolarHBondContact O-N 2.93Å; I275-G277 VanDerWaalsContact C-N 3.34Å; I275-G277 PolarHBondContact O-N 3.41Å; G277-V280 WeakPolarHBondContact O-CG1 3.4Å
278	K	93.4	Very high	95.7	Very high	48 Å²	48	26.3 Å²	26.3	21%	0.209	12%	0.12	C	C	.	.	H	α-helix	trans	-71.3	-47.9	172.1	-174.5	173.8	-174	-171.8	0	111.2	L274 I275 W276 L281 Y282 E325 W429	L274-K278 PolarHBondContact O-N 2.87Å; I275-K278 PolarHBondContact O-N 3.36Å; W276-K278 VanDerWaalsContact C-N 3.28Å; W276-K278 PolarHBondContact O-N 3.3Å; K278-L281 PolarHBondContact O-N 2.86Å; K278-Y282 VanDerWaalsContact CE-OH 3.24Å; K278-Y282 WeakPolarHBondContact CE-OH 3.39Å; K278-E325 WeakPolarHBondContact CE-OE2 3.29Å; K278-E325 IonicContact NZ-OE2 2.73Å; K278-E325 PolarHBondContact NZ-OE2 3.08Å; K278-W429 HydrophobicContact CB-CD2 3.98Å; K278-W429 HydrophobicContact CB-CE3 3.57Å; K278-W429 HydrophobicContact CB-CH2 4.39Å; K278-W429 HydrophobicContact CB-CZ3 3.82Å; K278-W429 HydrophobicContact CD-CD2 3.95Å; K278-W429 HydrophobicContact CD-CE3 4.3Å; K278-W429 HydrophobicContact CD-CG 4.48Å; K278-W429 HydrophobicContact CD-CH2 4.31Å; K278-W429 HydrophobicContact CD-CZ2 3.93Å; K278-W429 HydrophobicContact CD-CZ3 4.48Å; K278-W429 HydrophobicContact CG-CD2 4.05Å; K278-W429 HydrophobicContact CG-CE3 3.88Å; K278-W429 HydrophobicContact CG-CH2 3.84Å; K278-W429 HydrophobicContact CG-CZ2 3.98Å; K278-W429 HydrophobicContact CG-CZ3 3.78Å
279	F	94.6	Very high	95.8	Very high	9 Å²	9	22.2 Å²	22.2	4%	0.039	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-42.2	-173.9	178	-100.8	0	0	0	113.2	Y244 L247 S248 I251 I275 W276 L281 Y282	Y244-F279 AromaticContact CD2-CE1 3.92Å; Y244-F279 HydrophobicContact CD2-CE1 3.92Å; Y244-F279 AromaticContact CD2-CE2 4Å; Y244-F279 HydrophobicContact CD2-CE2 4Å; Y244-F279 AromaticContact CD2-CZ 3.48Å; Y244-F279 HydrophobicContact CD2-CZ 3.48Å; Y244-F279 VanDerWaalsContact CD2-CZ 3.48Å; Y244-F279 AromaticContact CE2-CE1 3.81Å; Y244-F279 HydrophobicContact CE2-CE1 3.81Å; Y244-F279 AromaticContact CE2-CZ 3.86Å; Y244-F279 HydrophobicContact CE2-CZ 3.86Å; Y244-F279 HydrophobicContact CG-CZ 4.19Å; L247-F279 HydrophobicContact CB-CD2 4.18Å; L247-F279 HydrophobicContact CB-CE1 4.5Å; L247-F279 HydrophobicContact CB-CE2 3.35Å; L247-F279 HydrophobicContact CB-CZ 3.54Å; L247-F279 HydrophobicContact CD1-CD2 4.27Å; L247-F279 HydrophobicContact CD1-CE2 3.94Å; L247-F279 HydrophobicContact CG-CE2 4.28Å; S248-F279 VanDerWaalsContact N-CZ 3.35Å; I251-F279 HydrophobicContact CB-CD1 3.7Å; I251-F279 HydrophobicContact CB-CE1 4.1Å; I251-F279 HydrophobicContact CB-CG 4.18Å; I251-F279 HydrophobicContact CD1-CD2 4.48Å; I251-F279 HydrophobicContact CD1-CG 4.28Å; I251-F279 HydrophobicContact CG2-CB 4.01Å; I251-F279 HydrophobicContact CG2-CD1 3.66Å; I251-F279 HydrophobicContact CG2-CG 4Å; I251-F279 WeakPolarHBondContact O-CD1 3.27Å; I251-F279 WeakPolarHBondContact O-CE1 3.28Å; I275-F279 WeakPolarHBondContact O-CB 3.13Å; I275-F279 PolarHBondContact O-N 3.3Å; W276-F279 PolarHBondContact O-N 2.92Å; F279-L281 PolarHBondContact O-N 2.85Å; F279-L281 VanDerWaalsContact O-N 3.08Å; F279-Y282 AromaticContact CD2-CD2 3.87Å; F279-Y282 HydrophobicContact CD2-CD2 3.87Å; F279-Y282 HydrophobicContact CD2-CE2 4.48Å; F279-Y282 HydrophobicContact CE2-CD2 4.36Å; F279-Y282 VanDerWaalsContact O-CB 3.29Å; F279-Y282 WeakPolarHBondContact O-CB 3.45Å; F279-Y282 PolarHBondContact O-N 3.36Å
280	V	93.8	Very high	95.8	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.006	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.7	-178.8	72.4	0	0	0	0	112.4	W276 G277 Y282 K283	W276-V280 HydrophobicContact CH2-CG1 4.4Å; W276-V280 HydrophobicContact CZ2-CB 4.19Å; W276-V280 HydrophobicContact CZ2-CG1 4.12Å; W276-V280 HydrophobicContact CZ2-CG2 4.08Å; W276-V280 WeakPolarHBondContact O-CB 3.18Å; W276-V280 WeakPolarHBondContact O-CG1 3.31Å; W276-V280 PolarHBondContact O-N 3.1Å; G277-V280 WeakPolarHBondContact O-CG1 3.4Å; V280-Y282 VanDerWaalsContact C-N 3.32Å; V280-K283 WeakPolarHBondContact O-CG 3.48Å
281	L	94.5	Very high	95.8	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.4	177.2	-65	177.1	0	0	0	113.2	K278 F279 K283 Y284 V285 F324 F337 W429 M436	K278-L281 PolarHBondContact O-N 2.86Å; F279-L281 PolarHBondContact O-N 2.85Å; F279-L281 VanDerWaalsContact O-N 3.08Å; L281-K283 VanDerWaalsContact C-N 3.26Å; L281-K283 PolarHBondContact O-N 2.76Å; L281-Y284 HydrophobicContact CD2-CD2 4.31Å; L281-Y284 PolarHBondContact O-N 2.71Å; L281-Y284 VanDerWaalsContact O-N 3.09Å; L281-V285 WeakPolarHBondContact O-CG2 3.5Å; L281-V285 PolarHBondContact O-N 3.08Å; L281-V285 VanDerWaalsContact O-N 3.11Å; L281-F324 HydrophobicContact CB-CZ 4.1Å; L281-F324 HydrophobicContact CD1-CE2 4.1Å; L281-F324 HydrophobicContact CD1-CZ 3.8Å; L281-F337 HydrophobicContact CB-CE2 4.02Å; L281-F337 HydrophobicContact CD1-CE2 4.47Å; L281-F337 HydrophobicContact CD2-CE1 4.47Å; L281-F337 HydrophobicContact CD2-CE2 4.07Å; L281-F337 HydrophobicContact CD2-CZ 3.8Å; L281-F337 HydrophobicContact CG-CE2 4.42Å; L281-W429 HydrophobicContact CD1-CZ3 4.37Å; L281-M436 HydrophobicContact CD2-CE 3.67Å; L281-M436 HydrophobicContact CD2-CG 4.44Å; L281-M436 HydrophobicContact CD2-SD 3.98Å
282	Y	95.1	Very high	95.9	Very high	39 Å²	39	18 Å²	18	15%	0.153	8%	0.084	C	C	.	.	H	α-helix	trans	-66.6	-22.9	-177.8	-67.8	-19.7	0	0	0	114	Y240 K278 F279 V280 Y284 V285 T286 F324 E325	Y240-Y282 AromaticContact CD1-CD1 3.84Å; Y240-Y282 HydrophobicContact CD1-CD1 3.84Å; Y240-Y282 HydrophobicContact CD1-CD2 4.28Å; Y240-Y282 HydrophobicContact CD1-CE1 4.16Å; Y240-Y282 AromaticContact CD1-CG 3.89Å; Y240-Y282 HydrophobicContact CD1-CG 3.89Å; Y240-Y282 AromaticContact CE1-CD1 3.61Å; Y240-Y282 HydrophobicContact CE1-CD1 3.61Å; Y240-Y282 HydrophobicContact CE1-CD2 4.34Å; Y240-Y282 AromaticContact CE1-CE1 3.46Å; Y240-Y282 HydrophobicContact CE1-CE1 3.46Å; Y240-Y282 VanDerWaalsContact CE1-CE1 3.46Å; Y240-Y282 HydrophobicContact CE1-CE2 4.24Å; Y240-Y282 HydrophobicContact CE1-CG 4.05Å; Y240-Y282 AromaticContact CE1-CZ 3.78Å; K278-Y282 VanDerWaalsContact CE-OH 3.24Å; K278-Y282 WeakPolarHBondContact CE-OH 3.39Å; F279-Y282 AromaticContact CD2-CD2 3.87Å; F279-Y282 HydrophobicContact CD2-CD2 3.87Å; F279-Y282 HydrophobicContact CD2-CE2 4.48Å; F279-Y282 HydrophobicContact CE2-CD2 4.36Å; F279-Y282 VanDerWaalsContact O-CB 3.29Å; F279-Y282 WeakPolarHBondContact O-CB 3.45Å; F279-Y282 PolarHBondContact O-N 3.36Å; V280-Y282 VanDerWaalsContact C-N 3.32Å; Y282-Y284 VanDerWaalsContact C-N 3.34Å; Y282-Y284 PolarHBondContact O-N 2.94Å; Y282-V285 HydrophobicContact CD1-CG2 4.19Å; Y282-V285 PolarHBondContact O-N 2.69Å; Y282-T286 WeakPolarHBondContact O-CB 3.32Å; Y282-T286 PolarHBondContact O-N 2.87Å; Y282-T286 PolarHBondContact O-OG1 3.48Å; Y282-F324 HydrophobicContact CD1-CE1 4.44Å; Y282-F324 AromaticContact CE1-CE1 3.94Å; Y282-F324 HydrophobicContact CE1-CE1 3.94Å; Y282-E325 VanDerWaalsContact CE1-OE1 3.28Å; Y282-E325 WeakPolarHBondContact CE1-OE1 3.33Å; Y282-E325 PolarHBondContact OH-OE1 2.95Å; Y282-E325 PolarHBondContact OH-OE2 3.24Å
283	K	91.8	Very high	95.9	Very high	31 Å²	31	16.7 Å²	16.7	14%	0.135	8%	0.079	C	C	.	.	H	α-helix	trans	-62.1	-41	170.1	71.1	-164.8	173.4	-174.7	0	112.3	Y244 E253 V280 L281 C287	Y244-K283 HydrophobicContact CD2-CB 4.21Å; Y244-K283 HydrophobicContact CE1-CB 4.09Å; Y244-K283 HydrophobicContact CE2-CB 3.74Å; Y244-K283 HydrophobicContact CE2-CD 4.45Å; E253-K283 IonicContact OE1-NZ 3.94Å; V280-K283 WeakPolarHBondContact O-CG 3.48Å; L281-K283 VanDerWaalsContact C-N 3.26Å; L281-K283 PolarHBondContact O-N 2.76Å; K283-C287 PolarHBondContact O-N 2.9Å; K283-C287 PolarHBondContact O-SG 3.26Å
284	Y	94.1	Very high	96	Very high	45 Å²	45	16.8 Å²	16.8	18%	0.176	8%	0.079	C	C	.	.	H	α-helix	trans	-73.1	-42.3	176.9	-56	-73.5	0	0	0	111.4	L281 Y282 T286 C287 W288 F337	L281-Y284 HydrophobicContact CD2-CD2 4.31Å; L281-Y284 PolarHBondContact O-N 2.71Å; L281-Y284 VanDerWaalsContact O-N 3.09Å; Y282-Y284 VanDerWaalsContact C-N 3.34Å; Y282-Y284 PolarHBondContact O-N 2.94Å; Y284-T286 VanDerWaalsContact C-N 3.27Å; Y284-T286 PolarHBondContact O-N 3.27Å; Y284-C287 PolarHBondContact O-N 3.26Å; Y284-W288 WeakPolarHBondContact O-CB 3.46Å; Y284-W288 PolarHBondContact O-N 3.41Å; Y284-F337 HydrophobicContact CD2-CZ 4.26Å; Y284-F337 HydrophobicContact CG-CZ 4.36Å
285	V	96.5	Very high	96.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-54.6	-46.8	175.5	174.8	0	0	0	0	110.3	Y240 L281 Y282 W288 L289 M319 F337	Y240-V285 HydrophobicContact CD1-CG1 4.01Å; Y240-V285 HydrophobicContact CD2-CG1 3.97Å; Y240-V285 HydrophobicContact CE1-CG1 4.2Å; Y240-V285 HydrophobicContact CE2-CG1 4.16Å; Y240-V285 HydrophobicContact CG-CG1 3.89Å; L281-V285 WeakPolarHBondContact O-CG2 3.5Å; L281-V285 PolarHBondContact O-N 3.08Å; L281-V285 VanDerWaalsContact O-N 3.11Å; Y282-V285 HydrophobicContact CD1-CG2 4.19Å; Y282-V285 PolarHBondContact O-N 2.69Å; V285-W288 PolarHBondContact O-N 3.4Å; V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.13Å; V285-L289 WeakPolarHBondContact O-CB 3.39Å; V285-L289 WeakPolarHBondContact O-CG 3.41Å; V285-L289 PolarHBondContact O-N 2.94Å; V285-M319 HydrophobicContact CB-CE 4.17Å; V285-M319 HydrophobicContact CG1-CE 4.42Å; V285-M319 HydrophobicContact CG1-CG 4.18Å; V285-M319 HydrophobicContact CG2-CE 3.29Å; V285-M319 HydrophobicContact CG2-SD 4.23Å; V285-F337 HydrophobicContact CG2-CE2 4.31Å
286	T	95.8	Very high	96.2	Very high	4 Å²	4	11.3 Å²	11.3	3%	0.025	5%	0.051	C	C	.	.	H	α-helix	trans	-55.6	-57.7	177.5	-63.2	0	0	0	0	111.8	Y240 L241 Y282 Y284 W288 L289 V290	Y240-T286 WeakPolarHBondContact CB-OG1 3.17Å; L241-T286 HydrophobicContact CB-CG2 3.52Å; L241-T286 HydrophobicContact CD1-CG2 3.8Å; L241-T286 HydrophobicContact CG-CG2 4.16Å; L241-T286 PolarHBondContact N-OG1 3.4Å; Y282-T286 WeakPolarHBondContact O-CB 3.32Å; Y282-T286 PolarHBondContact O-N 2.87Å; Y282-T286 PolarHBondContact O-OG1 3.48Å; Y284-T286 VanDerWaalsContact C-N 3.27Å; Y284-T286 PolarHBondContact O-N 3.27Å; T286-W288 VanDerWaalsContact C-N 3.32Å; T286-W288 PolarHBondContact O-N 3.45Å; T286-L289 PolarHBondContact O-N 3.48Å; T286-V290 WeakPolarHBondContact O-CG2 3.48Å; T286-V290 PolarHBondContact O-N 3.09Å; T286-V290 VanDerWaalsContact O-N 3.13Å
287	C	96.1	Very high	96.3	Very high	19 Å²	19	11.8 Å²	11.8	13%	0.128	5%	0.053	C	C	.	.	H	α-helix	trans	-60.2	-41.7	-177.4	-68.3	0	0	0	0	112.1	I48 V199 K283 Y284 T291	I48-C287 HydrophobicContact CD1-CB 4.48Å; V199-C287 HydrophobicContact CG1-CB 4.46Å; V199-C287 HydrophobicContact CG2-CB 4.31Å; K283-C287 PolarHBondContact O-N 2.9Å; K283-C287 PolarHBondContact O-SG 3.26Å; Y284-C287 PolarHBondContact O-N 3.26Å; C287-T291 VanDerWaalsContact O-CB 3.24Å; C287-T291 WeakPolarHBondContact O-CB 3.37Å; C287-T291 PolarHBondContact O-N 3.32Å; C287-T291 VanDerWaalsContact O-N 3.08Å; C287-T291 PolarHBondContact O-OG1 3.05Å
288	W	97.5	Very high	96.4	Very high	19 Å²	19	11.9 Å²	11.9	7%	0.072	5%	0.054	C	C	.	.	H	α-helix	trans	-67.4	-45	177.6	-70.8	-27.3	0	0	0	112.5	V199 Y284 V285 T286 V290 T291 E292 N318 M319 F337 N338	V199-W288 PolarHBondContact O-NE1 3.11Å; Y284-W288 WeakPolarHBondContact O-CB 3.46Å; Y284-W288 PolarHBondContact O-N 3.41Å; V285-W288 PolarHBondContact O-N 3.4Å; T286-W288 VanDerWaalsContact C-N 3.32Å; T286-W288 PolarHBondContact O-N 3.45Å; W288-V290 PolarHBondContact O-N 2.84Å; W288-T291 PolarHBondContact O-N 3.31Å; W288-E292 VanDerWaalsContact O-CB 3.24Å; W288-E292 WeakPolarHBondContact O-CB 3.31Å; W288-E292 WeakPolarHBondContact O-CG 3.24Å; W288-E292 PolarHBondContact O-N 2.95Å; W288-N318 HydrophobicContact CB-CB 4.18Å; W288-N318 HydrophobicContact CD2-CB 3.88Å; W288-N318 HydrophobicContact CE3-CB 4.14Å; W288-N318 HydrophobicContact CG-CB 3.9Å; W288-M319 HydrophobicContact CE3-CE 4.03Å; W288-M319 HydrophobicContact CZ3-CE 4.12Å; W288-F337 AromaticContact CH2-CD1 3.96Å; W288-F337 HydrophobicContact CH2-CD1 3.96Å; W288-F337 AromaticContact CH2-CE1 3.4Å; W288-F337 HydrophobicContact CH2-CE1 3.4Å; W288-F337 VanDerWaalsContact CH2-CE1 3.4Å; W288-F337 HydrophobicContact CH2-CE2 4.23Å; W288-F337 AromaticContact CH2-CZ 3.54Å; W288-F337 HydrophobicContact CH2-CZ 3.54Å; W288-F337 AromaticContact CZ3-CD1 3.88Å; W288-F337 HydrophobicContact CZ3-CD1 3.88Å; W288-F337 AromaticContact CZ3-CD2 3.95Å; W288-F337 HydrophobicContact CZ3-CD2 3.95Å; W288-F337 AromaticContact CZ3-CE1 3.57Å; W288-F337 HydrophobicContact CZ3-CE1 3.57Å; W288-F337 AromaticContact CZ3-CE2 3.59Å; W288-F337 HydrophobicContact CZ3-CE2 3.59Å; W288-F337 HydrophobicContact CZ3-CG 4.06Å; W288-F337 AromaticContact CZ3-CZ 3.38Å; W288-F337 HydrophobicContact CZ3-CZ 3.38Å; W288-N338 HydrophobicContact CH2-CB 3.55Å; W288-N338 HydrophobicContact CZ2-CB 4.14Å; W288-N338 HydrophobicContact CZ3-CB 4.13Å
289	L	98.1	Very high	96.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-60.6	-44.2	-179.9	-71.3	175.1	0	0	0	112.4	R233 L236 Y240 V285 T286 G293 M319 V321	R233-L289 WeakPolarHBondContact CG-O 3.5Å; R233-L289 VanDerWaalsContact NH2-CD2 3.28Å; L236-L289 HydrophobicContact CB-CD1 4.3Å; L236-L289 HydrophobicContact CD2-CD1 4.21Å; L236-L289 HydrophobicContact CD2-CD2 4.13Å; L236-L289 HydrophobicContact CG-CD1 3.8Å; Y240-L289 HydrophobicContact CD2-CD1 3.6Å; Y240-L289 HydrophobicContact CE2-CD1 4.14Å; Y240-L289 HydrophobicContact CG-CD1 4.37Å; V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.13Å; V285-L289 WeakPolarHBondContact O-CB 3.39Å; V285-L289 WeakPolarHBondContact O-CG 3.41Å; V285-L289 PolarHBondContact O-N 2.94Å; T286-L289 PolarHBondContact O-N 3.48Å; L289-G293 PolarHBondContact O-N 3.45Å; L289-G293 VanDerWaalsContact O-N 3.13Å; L289-M319 HydrophobicContact CD2-CB 4.34Å; L289-M319 HydrophobicContact CD2-CG 4.46Å; L289-V321 HydrophobicContact CD1-CG2 4.14Å; L289-V321 HydrophobicContact CD2-CG2 3.96Å
290	V	98.1	Very high	96.7	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.006	4%	0.042	C	C	.	.	H	α-helix	trans	-62.1	-46.1	176.6	175.4	0	0	0	0	110.4	I48 F49 Y52 L234 T286 W288 G293 V294	I48-V290 HydrophobicContact CB-CG1 4.43Å; I48-V290 HydrophobicContact CD1-CB 4.07Å; I48-V290 HydrophobicContact CD1-CG1 3.96Å; I48-V290 HydrophobicContact CG1-CG1 4.07Å; F49-V290 HydrophobicContact CD1-CG1 4.5Å; F49-V290 HydrophobicContact CD2-CG1 4.3Å; F49-V290 HydrophobicContact CE1-CG1 4.35Å; F49-V290 HydrophobicContact CE2-CG1 4.12Å; F49-V290 HydrophobicContact CE2-CG2 4.42Å; F49-V290 HydrophobicContact CG-CG1 4.48Å; F49-V290 HydrophobicContact CZ-CG1 4.14Å; F49-V290 HydrophobicContact CZ-CG2 4.18Å; Y52-V290 HydrophobicContact CE2-CG1 3.86Å; Y52-V290 WeakPolarHBondContact CE2-O 3.43Å; Y52-V290 PolarHBondContact OH-O 3.45Å; L234-V290 HydrophobicContact CD1-CG1 4.29Å; L234-V290 HydrophobicContact CD1-CG2 4.41Å; T286-V290 WeakPolarHBondContact O-CG2 3.48Å; T286-V290 PolarHBondContact O-N 3.09Å; T286-V290 VanDerWaalsContact O-N 3.13Å; W288-V290 PolarHBondContact O-N 2.84Å; V290-G293 PolarHBondContact O-N 3.02Å; V290-V294 PolarHBondContact O-N 2.83Å
291	T	97.6	Very high	96.9	Very high	5 Å²	5	9.1 Å²	9.1	3%	0.031	4%	0.042	C	C	.	.	H	α-helix	trans	-70.1	-37.4	-177.1	-55.7	0	0	0	0	112.5	G195 V199 G200 C287 W288 G293 V294 C295	G195-T291 WeakPolarHBondContact O-CG2 3.36Å; V199-T291 HydrophobicContact CG2-CG2 4.18Å; V199-T291 WeakPolarHBondContact CG2-OG1 3.03Å; G200-T291 WeakPolarHBondContact O-CG2 3.45Å; C287-T291 VanDerWaalsContact O-CB 3.24Å; C287-T291 WeakPolarHBondContact O-CB 3.37Å; C287-T291 PolarHBondContact O-N 3.32Å; C287-T291 VanDerWaalsContact O-N 3.08Å; C287-T291 PolarHBondContact O-OG1 3.05Å; W288-T291 PolarHBondContact O-N 3.31Å; T291-G293 VanDerWaalsContact C-N 3.3Å; T291-G293 PolarHBondContact O-N 3.48Å; T291-V294 WeakPolarHBondContact O-CA 3.35Å; T291-V294 VanDerWaalsContact O-CB 3.3Å; T291-V294 WeakPolarHBondContact O-CB 3.49Å; T291-V294 PolarHBondContact O-N 3.04Å; T291-V294 VanDerWaalsContact O-N 3.08Å; T291-C295 PolarHBondContact O-N 3.31Å
292	E	98.2	Very high	97	Very high	3 Å²	3	9.8 Å²	9.8	1%	0.014	4%	0.044	C	C	.	.	H	α-helix	trans	-61.1	-38.8	172.4	-75.6	176.7	-151.5	0	0	112	R233 W288 V294 C295 I296 C316 N318 M319	R233-E292 HydrophobicContact CG-CB 3.98Å; R233-E292 IonicContact CZ-OE2 2.71Å; R233-E292 IonicContact NE-OE2 2.67Å; R233-E292 PolarHBondContact NE-OE2 3.27Å; R233-E292 IonicContact NH2-OE1 3.06Å; R233-E292 IonicContact NH2-OE2 3.23Å; R233-E292 PolarHBondContact NH2-OE2 3.16Å; W288-E292 VanDerWaalsContact O-CB 3.24Å; W288-E292 WeakPolarHBondContact O-CB 3.31Å; W288-E292 WeakPolarHBondContact O-CG 3.24Å; W288-E292 PolarHBondContact O-N 2.95Å; E292-V294 VanDerWaalsContact C-N 3.26Å; E292-V294 PolarHBondContact O-N 2.84Å; E292-C295 PolarHBondContact O-N 3.41Å; E292-I296 WeakPolarHBondContact O-CB 3.29Å; E292-I296 WeakPolarHBondContact O-CG1 3.37Å; E292-I296 PolarHBondContact O-N 2.98Å; E292-C316 WeakPolarHBondContact CG-O 3.37Å; E292-N318 WeakPolarHBondContact OE1-CA 3.35Å; E292-N318 PolarHBondContact OE1-N 3.33Å; E292-M319 PolarHBondContact OE1-N 2.86Å
293	G	98.3	Very high	97	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.9	-36.7	173.3	0	0	0	0	0	112.4	Y52 A230 L289 V290 T291 I296 L297	Y52-G293 VanDerWaalsContact OH-CA 3.31Å; Y52-G293 WeakPolarHBondContact OH-CA 3.37Å; A230-G293 VanDerWaalsContact CB-O 3.31Å; A230-G293 WeakPolarHBondContact CB-O 3.26Å; L289-G293 PolarHBondContact O-N 3.45Å; L289-G293 VanDerWaalsContact O-N 3.13Å; V290-G293 PolarHBondContact O-N 3.02Å; T291-G293 VanDerWaalsContact C-N 3.3Å; T291-G293 PolarHBondContact O-N 3.48Å; G293-I296 PolarHBondContact O-N 3.25Å; G293-L297 WeakPolarHBondContact O-CB 3.46Å; G293-L297 PolarHBondContact O-N 3.39Å
294	V	98.4	Very high	97.1	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-62.8	-50.7	171.5	-179.5	0	0	0	0	110.7	G51 Y52 A55 Y194 V290 T291 E292 I296 L297 T298	G51-V294 WeakPolarHBondContact O-CG1 3.31Å; Y52-V294 HydrophobicContact CD2-CG2 3.52Å; Y52-V294 HydrophobicContact CE1-CG2 4.43Å; Y52-V294 HydrophobicContact CE2-CG2 3.35Å; Y52-V294 HydrophobicContact CG-CG2 4.11Å; A55-V294 HydrophobicContact CB-CG1 4.27Å; Y194-V294 HydrophobicContact CD2-CG1 4.06Å; Y194-V294 HydrophobicContact CE2-CG1 3.77Å; V290-V294 PolarHBondContact O-N 2.83Å; T291-V294 WeakPolarHBondContact O-CA 3.35Å; T291-V294 VanDerWaalsContact O-CB 3.3Å; T291-V294 WeakPolarHBondContact O-CB 3.49Å; T291-V294 PolarHBondContact O-N 3.04Å; T291-V294 VanDerWaalsContact O-N 3.08Å; E292-V294 VanDerWaalsContact C-N 3.26Å; E292-V294 PolarHBondContact O-N 2.84Å; V294-I296 VanDerWaalsContact C-N 3.27Å; V294-I296 PolarHBondContact O-N 3.36Å; V294-L297 PolarHBondContact O-N 3.28Å; V294-L297 VanDerWaalsContact O-N 3.13Å; V294-T298 WeakPolarHBondContact O-CG2 3.31Å; V294-T298 PolarHBondContact O-N 2.96Å
295	C	98.4	Very high	97.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.8	-37.2	177.6	-62.1	0	0	0	0	112.9	G195 T291 E292 T298 G299 L300 G301 C316	G195-C295 PolarHBondContact O-SG 2.9Å; T291-C295 PolarHBondContact O-N 3.31Å; E292-C295 PolarHBondContact O-N 3.41Å; C295-T298 PolarHBondContact O-OG1 2.87Å; C295-G299 PolarHBondContact O-N 3.07Å; C295-L300 HydrophobicContact CB-CB 4.28Å; C295-L300 HydrophobicContact CB-CD2 4.46Å; C295-L300 WeakPolarHBondContact O-CA 3.25Å; C295-L300 WeakPolarHBondContact O-CB 3.4Å; C295-L300 PolarHBondContact O-N 3.09Å; C295-G301 PolarHBondContact O-N 3.37Å; C295-C316 HydrophobicContact CB-CB 3.69Å
296	I	98.4	Very high	96.8	Very high	8 Å²	8	17.7 Å²	17.7	4%	0.041	9%	0.092	C	C	.	.	H	α-helix	trans	-66.8	-46.4	176.2	-68.8	167	0	0	0	109.5	S226 P229 A230 R233 E292 G293 V294 T298 G299 W313	S226-I296 WeakPolarHBondContact CB-O 3.46Å; S226-I296 PolarHBondContact OG-O 3.14Å; P229-I296 HydrophobicContact CB-CG2 3.71Å; A230-I296 HydrophobicContact CB-CB 4.22Å; A230-I296 HydrophobicContact CB-CG2 3.93Å; R233-I296 HydrophobicContact CB-CD1 4.12Å; R233-I296 HydrophobicContact CG-CD1 4.13Å; E292-I296 WeakPolarHBondContact O-CB 3.29Å; E292-I296 WeakPolarHBondContact O-CG1 3.37Å; E292-I296 PolarHBondContact O-N 2.98Å; G293-I296 PolarHBondContact O-N 3.25Å; V294-I296 VanDerWaalsContact C-N 3.27Å; V294-I296 PolarHBondContact O-N 3.36Å; I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 3.43Å; I296-G299 PolarHBondContact O-N 3.03Å; I296-W313 HydrophobicContact CD1-CB 4.28Å; I296-W313 HydrophobicContact CG1-CB 4.12Å; I296-W313 HydrophobicContact CG2-CB 4.05Å; I296-W313 HydrophobicContact CG2-CD2 4.12Å; I296-W313 HydrophobicContact CG2-CE3 4.03Å; I296-W313 HydrophobicContact CG2-CG 4.15Å
297	L	98.1	Very high	96.1	Very high	9 Å²	9	27.4 Å²	27.4	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-35.7	-178.1	-172.3	56.6	0	0	0	112.8	Y52 A55 L56 S226 A230 G293 V294 G299	Y52-L297 HydrophobicContact CD1-CD2 3.92Å; A55-L297 HydrophobicContact CB-CB 4.13Å; A55-L297 HydrophobicContact CB-CD2 3.84Å; A55-L297 HydrophobicContact CB-CG 3.93Å; L56-L297 HydrophobicContact CD2-CD1 4.41Å; L56-L297 HydrophobicContact CD2-CD2 4.01Å; L56-L297 HydrophobicContact CG-CD2 4.1Å; S226-L297 PolarHBondContact OG-O 2.85Å; A230-L297 HydrophobicContact CB-CB 3.78Å; A230-L297 HydrophobicContact CB-CD1 4.26Å; G293-L297 WeakPolarHBondContact O-CB 3.46Å; G293-L297 PolarHBondContact O-N 3.39Å; V294-L297 PolarHBondContact O-N 3.28Å; V294-L297 VanDerWaalsContact O-N 3.13Å; L297-G299 VanDerWaalsContact C-N 3.33Å
298	T	97.2	Very high	95.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-74.7	-21.3	175.8	62	0	0	0	0	113.7	A55 Y58 F193 Y194 L211 V294 C295 I296 L300	A55-T298 HydrophobicContact CB-CG2 3.46Å; A55-T298 VanDerWaalsContact CB-CG2 3.46Å; Y58-T298 WeakPolarHBondContact CE1-O 3.48Å; F193-T298 HydrophobicContact CE2-CG2 4.28Å; F193-T298 HydrophobicContact CZ-CG2 3.97Å; Y194-T298 HydrophobicContact CE2-CG2 4.02Å; Y194-T298 WeakPolarHBondContact OH-CG2 3.44Å; L211-T298 VanDerWaalsContact CD1-O 3.31Å; L211-T298 WeakPolarHBondContact CD1-O 3.45Å; V294-T298 WeakPolarHBondContact O-CG2 3.31Å; V294-T298 PolarHBondContact O-N 2.96Å; C295-T298 PolarHBondContact O-OG1 2.87Å; I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 3.43Å; T298-L300 PolarHBondContact OG1-N 3.48Å
299	G	97.3	Very high	94.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.3	-17	-173.1	0	0	0	0	0	113.7	L216 C295 I296 L297 G301 F302	L216-G299 WeakPolarHBondContact CB-O 3.31Å; C295-G299 PolarHBondContact O-N 3.07Å; I296-G299 PolarHBondContact O-N 3.03Å; L297-G299 VanDerWaalsContact C-N 3.33Å; G299-G301 PolarHBondContact O-N 3.08Å; G299-G301 VanDerWaalsContact O-N 3.08Å; G299-F302 VanDerWaalsContact O-CB 3.31Å; G299-F302 WeakPolarHBondContact O-CB 3.31Å; G299-F302 PolarHBondContact O-N 3.35Å
300	L	97.9	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.5	-178.8	-167.3	69	0	0	0	112.6	F193 F203 H207 L211 L216 C295 T298 F302	F193-L300 HydrophobicContact CD1-CD2 3.85Å; F193-L300 HydrophobicContact CE1-CD2 3.43Å; F193-L300 VanDerWaalsContact CE1-CD2 3.43Å; F193-L300 HydrophobicContact CZ-CD2 4.09Å; F203-L300 HydrophobicContact CD1-CD2 3.82Å; F203-L300 HydrophobicContact CD2-CD1 4.38Å; F203-L300 HydrophobicContact CD2-CD2 4.36Å; F203-L300 HydrophobicContact CE1-CD2 3.62Å; F203-L300 HydrophobicContact CE2-CD1 4.47Å; F203-L300 HydrophobicContact CE2-CD2 4.21Å; F203-L300 HydrophobicContact CG-CD2 4.19Å; F203-L300 HydrophobicContact CZ-CD2 3.86Å; H207-L300 PolarHBondContact NE2-O 2.92Å; L211-L300 HydrophobicContact CB-CD1 3.97Å; L211-L300 HydrophobicContact CD1-CB 4.43Å; L211-L300 HydrophobicContact CD2-CB 4.19Å; L211-L300 HydrophobicContact CD2-CD1 3.98Å; L211-L300 HydrophobicContact CG-CD1 4.48Å; L216-L300 HydrophobicContact CD1-CD1 4.12Å; C295-L300 HydrophobicContact CB-CB 4.28Å; C295-L300 HydrophobicContact CB-CD2 4.46Å; C295-L300 WeakPolarHBondContact O-CA 3.25Å; C295-L300 WeakPolarHBondContact O-CB 3.4Å; C295-L300 PolarHBondContact O-N 3.09Å; T298-L300 PolarHBondContact OG1-N 3.48Å; L300-F302 PolarHBondContact O-N 3.49Å
301	G	97.3	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.4	175.8	0	0	0	0	0	115.5	C295 G299 W313 D314 A315	C295-G301 PolarHBondContact O-N 3.37Å; G299-G301 PolarHBondContact O-N 3.08Å; G299-G301 VanDerWaalsContact O-N 3.08Å; G301-W313 CarbonylContact O-C 3.51Å; G301-W313 WeakPolarHBondContact O-CA 3.39Å; G301-D314 PolarHBondContact O-N 3.06Å; G301-A315 WeakPolarHBondContact O-CB 3.43Å; G301-A315 PolarHBondContact O-N 2.95Å
302	F	97.5	Very high	94.3	Very high	19 Å²	19	47.9 Å²	47.9	8%	0.083	24%	0.243	C	C	.	.			trans	-66	134.1	-176	-174.4	-112.4	0	0	0	112.8	H207 L216 T217 D218 G299 L300 G304 F305 A311 K312 W313 A315	H207-F302 PolarHBondContact CE1-O 3.09Å; L216-F302 HydrophobicContact CB-CB 4.09Å; L216-F302 HydrophobicContact CB-CD1 4.49Å; L216-F302 HydrophobicContact CD2-CD1 4.38Å; T217-F302 WeakPolarHBondContact O-CE1 3.36Å; T217-F302 WeakPolarHBondContact O-CZ 3.46Å; D218-F302 HydrophobicContact CB-CE2 4.23Å; G299-F302 VanDerWaalsContact O-CB 3.31Å; G299-F302 WeakPolarHBondContact O-CB 3.31Å; G299-F302 PolarHBondContact O-N 3.35Å; L300-F302 PolarHBondContact O-N 3.49Å; F302-G304 WeakPolarHBondContact CE2-O 3.26Å; F302-F305 HydrophobicContact CE2-CZ 4.41Å; F302-F305 HydrophobicContact CZ-CD2 4.43Å; F302-F305 AromaticContact CZ-CE2 3.9Å; F302-F305 HydrophobicContact CZ-CE2 3.9Å; F302-F305 HydrophobicContact CZ-CZ 4.04Å; F302-A311 HydrophobicContact CD2-CB 4.4Å; F302-A311 HydrophobicContact CE2-CB 3.95Å; F302-K312 CarbonylContact C-O 3.52Å; F302-K312 WeakPolarHBondContact CA-O 3.28Å; F302-W313 HydrophobicContact CB-CE3 4.1Å; F302-W313 HydrophobicContact CB-CH2 4.11Å; F302-W313 HydrophobicContact CB-CZ3 3.59Å; F302-W313 AromaticContact CD2-CH2 3.86Å; F302-W313 HydrophobicContact CD2-CH2 3.86Å; F302-W313 HydrophobicContact CD2-CZ2 4.17Å; F302-W313 HydrophobicContact CD2-CZ3 4.1Å; F302-W313 HydrophobicContact CG-CH2 4.36Å; F302-W313 HydrophobicContact CG-CZ3 4.3Å; F302-A315 WeakPolarHBondContact O-CB 3.4Å
303	N	95	Very high	94.2	Very high	69 Å²	69	49.4 Å²	49.4	37%	0.369	25%	0.248	S	C	.	.			trans	-138.4	37.7	-178.3	-160.4	19	0	0	0	112.7	K312 D314 A315	N303-K312 HydrophobicContact CB-CB 4.11Å; N303-K312 PolarHBondContact N-O 3.39Å; N303-D314 WeakPolarHBondContact CB-OD1 3.25Å; N303-D314 PolarHBondContact ND2-OD1 3.47Å; N303-A315 HydrophobicContact CB-CB 3.93Å
304	G	94.2	Very high	94.1	Very high	24 Å²	24	52.7 Å²	52.7	25%	0.247	27%	0.266	C	S	.	.			trans	77	-149.9	-177.3	0	0	0	0	0	112.9	F302 K312	F302-G304 WeakPolarHBondContact CE2-O 3.26Å; G304-K312 PolarHBondContact O-N 2.98Å
305	F	93.9	Very high	94	Very high	101 Å²	101	53.5 Å²	53.5	44%	0.443	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-119.6	154	-173	-59.3	-89.3	0	0	0	112.6	D218 F302 G309 K310 A311 K312	D218-F305 HydrophobicContact CB-CE1 4.17Å; D218-F305 HydrophobicContact CB-CZ 4.31Å; D218-F305 VanDerWaalsContact O-CZ 3.29Å; D218-F305 WeakPolarHBondContact O-CZ 3.42Å; F302-F305 HydrophobicContact CE2-CZ 4.41Å; F302-F305 HydrophobicContact CZ-CD2 4.43Å; F302-F305 AromaticContact CZ-CE2 3.9Å; F302-F305 HydrophobicContact CZ-CE2 3.9Å; F302-F305 HydrophobicContact CZ-CZ 4.04Å; F305-G309 VanDerWaalsContact CD1-O 3.31Å; F305-G309 WeakPolarHBondContact CD1-O 3.18Å; F305-K310 CarbonylContact C-O 3.54Å; F305-K310 WeakPolarHBondContact CA-O 3.33Å; F305-A311 HydrophobicContact CD1-CB 4.33Å; F305-A311 HydrophobicContact CE1-CB 4.23Å; F305-K312 WeakPolarHBondContact O-CE 3.41Å
306	E	89.3	Confident	93.9	Very high	88 Å²	88	53.6 Å²	53.6	41%	0.411	27%	0.273	S	S	.	.			trans	-74.4	165.7	162.2	-72.2	177.5	-178.6	0	0	111.1	K308 G309 K310 K312	E306-K308 PolarHBondContact O-N 3.49Å; E306-G309 PolarHBondContact O-N 3.32Å; E306-K310 HydrophobicContact CB-CB 4.47Å; E306-K310 PolarHBondContact N-O 3.28Å; E306-K312 HydrophobicContact CG-CD 4.11Å; E306-K312 HydrophobicContact CG-CG 3.71Å
307	E	81.4	Confident	93.8	Very high	208 Å²	208	53.8 Å²	53.8	97%	0.972	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-28	176	-66.7	176.9	177.3	0	0	112.8	G309	E307-G309 VanDerWaalsContact C-N 3.3Å; E307-G309 PolarHBondContact O-N 3.4Å
308	K	82.2	Confident	93.7	Very high	195 Å²	195	53.4 Å²	53.4	85%	0.848	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	11.8	177.4	-61.2	-176.5	179	-178.8	0	114.1	E306 K310	E306-K308 PolarHBondContact O-N 3.49Å; K308-K310 VanDerWaalsContact C-N 3.27Å; K308-K310 PolarHBondContact O-N 2.92Å
309	G	86	Confident	93.7	Very high	54 Å²	54	53.4 Å²	53.4	56%	0.557	27%	0.274	S	S	*	.	S	Bend	trans	74.9	8.7	179.6	0	0	0	0	0	115.1	F305 E306 E307	F305-G309 VanDerWaalsContact CD1-O 3.31Å; F305-G309 WeakPolarHBondContact CD1-O 3.18Å; E306-G309 PolarHBondContact O-N 3.32Å; E307-G309 VanDerWaalsContact C-N 3.3Å; E307-G309 PolarHBondContact O-N 3.4Å
310	K	91	Very high	93.7	Very high	136 Å²	136	58 Å²	58	59%	0.591	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-83.1	131.3	178.2	-172.7	-177.5	176.6	-171.8	0	110.9	F305 E306 K308 K312	F305-K310 CarbonylContact C-O 3.54Å; F305-K310 WeakPolarHBondContact CA-O 3.33Å; E306-K310 HydrophobicContact CB-CB 4.47Å; E306-K310 PolarHBondContact N-O 3.28Å; K308-K310 VanDerWaalsContact C-N 3.27Å; K308-K310 PolarHBondContact O-N 2.92Å; K310-K312 PolarHBondContact O-N 2.79Å
311	A	94.6	Very high	93.6	Very high	18 Å²	18	58.9 Å²	58.9	15%	0.149	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-60.8	132.5	176.6	0	0	0	0	0	112.1	D218 F302 F305 W313	D218-A311 HydrophobicContact CB-CB 3.79Å; F302-A311 HydrophobicContact CD2-CB 4.4Å; F302-A311 HydrophobicContact CE2-CB 3.95Å; F305-A311 HydrophobicContact CD1-CB 4.33Å; F305-A311 HydrophobicContact CE1-CB 4.23Å; A311-W313 HydrophobicContact CB-CZ2 4.15Å
312	K	95.6	Very high	93.6	Very high	70 Å²	70	68.6 Å²	68.6	30%	0.304	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-90.5	131.1	173.9	-69.5	-179.9	177.7	167.1	0	110.1	F302 N303 G304 F305 E306 K310	F302-K312 CarbonylContact C-O 3.52Å; F302-K312 WeakPolarHBondContact CA-O 3.28Å; N303-K312 HydrophobicContact CB-CB 4.11Å; N303-K312 PolarHBondContact N-O 3.39Å; G304-K312 PolarHBondContact O-N 2.98Å; F305-K312 WeakPolarHBondContact O-CE 3.41Å; E306-K312 HydrophobicContact CG-CD 4.11Å; E306-K312 HydrophobicContact CG-CG 3.71Å; K310-K312 PolarHBondContact O-N 2.79Å
313	W	96.4	Very high	93.5	Very high	36 Å²	36	70.2 Å²	70.2	14%	0.136	35%	0.346	C	S	.	.			trans	-118.8	42.5	-178.9	-63.1	101.7	0	0	0	111.4	P224 P229 I296 G301 F302 A311	P224-W313 HydrophobicContact CB-CH2 3.46Å; P224-W313 VanDerWaalsContact CB-CH2 3.46Å; P224-W313 HydrophobicContact CB-CZ2 4.34Å; P224-W313 HydrophobicContact CB-CZ3 4.14Å; P229-W313 HydrophobicContact CB-CB 4.26Å; P229-W313 HydrophobicContact CB-CG 3.91Å; P229-W313 HydrophobicContact CG-CG 4.15Å; I296-W313 HydrophobicContact CD1-CB 4.28Å; I296-W313 HydrophobicContact CG1-CB 4.12Å; I296-W313 HydrophobicContact CG2-CB 4.05Å; I296-W313 HydrophobicContact CG2-CD2 4.12Å; I296-W313 HydrophobicContact CG2-CE3 4.03Å; I296-W313 HydrophobicContact CG2-CG 4.15Å; G301-W313 CarbonylContact O-C 3.51Å; G301-W313 WeakPolarHBondContact O-CA 3.39Å; F302-W313 HydrophobicContact CB-CE3 4.1Å; F302-W313 HydrophobicContact CB-CH2 4.11Å; F302-W313 HydrophobicContact CB-CZ3 3.59Å; F302-W313 AromaticContact CD2-CH2 3.86Å; F302-W313 HydrophobicContact CD2-CH2 3.86Å; F302-W313 HydrophobicContact CD2-CZ2 4.17Å; F302-W313 HydrophobicContact CD2-CZ3 4.1Å; F302-W313 HydrophobicContact CG-CH2 4.36Å; F302-W313 HydrophobicContact CG-CZ3 4.3Å; A311-W313 HydrophobicContact CB-CZ2 4.15Å
314	D	95.9	Very high	93.6	Very high	68 Å²	68	67 Å²	67	36%	0.364	33%	0.328	S	S	.	.			trans	-119.3	6.4	-172	70.3	-10.4	0	0	0	114.6	G301 N303 C316 A317	G301-D314 PolarHBondContact O-N 3.06Å; N303-D314 WeakPolarHBondContact CB-OD1 3.25Å; N303-D314 PolarHBondContact ND2-OD1 3.47Å; D314-C316 PolarHBondContact O-N 2.91Å; D314-A317 HydrophobicContact CB-CB 4.11Å; D314-A317 WeakPolarHBondContact O-CB 3.39Å; D314-A317 PolarHBondContact O-N 3.39Å
315	A	96.4	Very high	93.6	Very high	18 Å²	18	67.5 Å²	67.5	15%	0.149	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.2	178.8	0	0	0	0	0	112.8	G301 F302 N303 N340	G301-A315 WeakPolarHBondContact O-CB 3.43Å; G301-A315 PolarHBondContact O-N 2.95Å; F302-A315 WeakPolarHBondContact O-CB 3.4Å; N303-A315 HydrophobicContact CB-CB 3.93Å; A315-N340 PolarHBondContact O-OD1 3.48Å
316	C	96.4	Very high	93.6	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.014	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	5.9	178.8	-74.5	0	0	0	0	112.8	P201 E292 C295 D314 N318 N340	P201-C316 HydrophobicContact CB-CB 4.43Å; P201-C316 VanDerWaalsContact CB-O 3.26Å; P201-C316 WeakPolarHBondContact CB-O 3.46Å; P201-C316 HydrophobicContact CG-CB 3.59Å; P201-C316 VanDerWaalsContact CG-O 3.24Å; P201-C316 WeakPolarHBondContact CG-O 3.44Å; E292-C316 WeakPolarHBondContact CG-O 3.37Å; C295-C316 HydrophobicContact CB-CB 3.69Å; D314-C316 PolarHBondContact O-N 2.91Å; C316-N318 PolarHBondContact O-N 3.49Å; C316-N318 VanDerWaalsContact O-N 3.08Å; C316-N340 VanDerWaalsContact C-ND2 3.34Å; C316-N340 PolarHBondContact O-ND2 3Å
317	A	96.5	Very high	93.9	Very high	12 Å²	12	62.4 Å²	62.4	10%	0.099	31%	0.306	C	S	.	.			trans	-67.7	111.4	-176.5	0	0	0	0	0	110.9	D314 I339 N340	D314-A317 HydrophobicContact CB-CB 4.11Å; D314-A317 WeakPolarHBondContact O-CB 3.39Å; D314-A317 PolarHBondContact O-N 3.39Å; A317-I339 WeakPolarHBondContact O-CB 3.42Å; A317-N340 PolarHBondContact O-ND2 2.79Å; A317-N340 VanDerWaalsContact O-ND2 3.09Å
318	N	96.4	Very high	94.5	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.011	27%	0.267	C	S	.	.			trans	-89.7	-18.9	168.8	-93.8	-3.7	0	0	0	112.1	P201 W288 E292 C316 F337 N338 I339 N340	P201-N318 WeakPolarHBondContact CA-ND2 3.16Å; W288-N318 HydrophobicContact CB-CB 4.18Å; W288-N318 HydrophobicContact CD2-CB 3.88Å; W288-N318 HydrophobicContact CE3-CB 4.14Å; W288-N318 HydrophobicContact CG-CB 3.9Å; E292-N318 WeakPolarHBondContact OE1-CA 3.35Å; E292-N318 PolarHBondContact OE1-N 3.33Å; C316-N318 PolarHBondContact O-N 3.49Å; C316-N318 VanDerWaalsContact O-N 3.08Å; N318-F337 CarbonylContact O-C 3.58Å; N318-N338 WeakPolarHBondContact O-CA 3.38Å; N318-N338 PolarHBondContact O-N 2.94Å; N318-I339 PolarHBondContact O-N 3.14Å; N318-I339 VanDerWaalsContact O-N 3.13Å; N318-N340 VanDerWaalsContact OD1-CB 3.3Å; N318-N340 WeakPolarHBondContact OD1-CB 3.43Å; N318-N340 PolarHBondContact OD1-N 3.02Å; N318-N340 PolarHBondContact OD1-ND2 3.29Å
319	M	96.6	Very high	95.1	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-124.4	129.1	-178.7	-177.4	56.1	60.1	0	0	112.9	R233 V285 W288 L289 E292 V321 F324 S336 F337	R233-M319 PolarHBondContact NH2-O 3.03Å; V285-M319 HydrophobicContact CB-CE 4.17Å; V285-M319 HydrophobicContact CG1-CE 4.42Å; V285-M319 HydrophobicContact CG1-CG 4.18Å; V285-M319 HydrophobicContact CG2-CE 3.29Å; V285-M319 HydrophobicContact CG2-SD 4.23Å; W288-M319 HydrophobicContact CE3-CE 4.03Å; W288-M319 HydrophobicContact CZ3-CE 4.12Å; L289-M319 HydrophobicContact CD2-CB 4.34Å; L289-M319 HydrophobicContact CD2-CG 4.46Å; E292-M319 PolarHBondContact OE1-N 2.86Å; M319-V321 HydrophobicContact CG-CG2 3.53Å; M319-F324 HydrophobicContact SD-CB 3.93Å; M319-F324 HydrophobicContact SD-CD1 4.47Å; M319-F324 HydrophobicContact SD-CD2 4.33Å; M319-F324 HydrophobicContact SD-CG 4Å; M319-S336 CarbonylContact C-O 3.06Å; M319-S336 VanDerWaalsContact CA-O 3.27Å; M319-S336 WeakPolarHBondContact CA-O 3.26Å; M319-F337 HydrophobicContact CE-CB 4.43Å; M319-F337 HydrophobicContact CE-CD2 3.28Å; M319-F337 HydrophobicContact CE-CE2 3.75Å; M319-F337 HydrophobicContact CE-CG 4.12Å
320	K	96.9	Very high	95.4	Very high	96 Å²	96	48.6 Å²	48.6	42%	0.417	23%	0.226	S	C	.	.			trans	-108.5	81.5	164.7	-77.4	170.7	-178.4	177.2	0	109.2	W322 L323 F324 S336 I339	K320-W322 VanDerWaalsContact C-N 3.35Å; K320-W322 PolarHBondContact O-N 3.07Å; K320-L323 HydrophobicContact CB-CB 3.97Å; K320-L323 HydrophobicContact CD-CD2 4.29Å; K320-L323 WeakPolarHBondContact O-CA 3.46Å; K320-L323 WeakPolarHBondContact O-CB 3.29Å; K320-L323 PolarHBondContact O-N 2.95Å; K320-F324 PolarHBondContact O-N 3.46Å; K320-S336 PolarHBondContact N-O 3.43Å; K320-I339 HydrophobicContact CB-CD1 4.15Å; K320-I339 HydrophobicContact CD-CD1 3.73Å; K320-I339 HydrophobicContact CG-CD1 3.54Å
321	V	96.6	Very high	95.5	Very high	19 Å²	19	44.9 Å²	44.9	12%	0.115	22%	0.215	C	C	.	.	H	α-helix	trans	-47.9	-51.7	-171.4	175.1	0	0	0	0	113	L236 Y240 L289 M319 L323 F324 E325	L236-V321 HydrophobicContact CD2-CB 4.2Å; L236-V321 HydrophobicContact CD2-CG1 4.47Å; L236-V321 HydrophobicContact CD2-CG2 3.73Å; L236-V321 HydrophobicContact CG-CG2 4.49Å; Y240-V321 HydrophobicContact CE2-CG1 3.88Å; Y240-V321 HydrophobicContact CE2-CG2 4.29Å; Y240-V321 WeakPolarHBondContact OH-CG1 3.39Å; L289-V321 HydrophobicContact CD1-CG2 4.14Å; L289-V321 HydrophobicContact CD2-CG2 3.96Å; M319-V321 HydrophobicContact CG-CG2 3.53Å; V321-L323 VanDerWaalsContact C-N 3.32Å; V321-L323 PolarHBondContact O-N 3.37Å; V321-F324 WeakPolarHBondContact O-CB 3.31Å; V321-F324 PolarHBondContact O-N 3.11Å; V321-F324 VanDerWaalsContact O-N 3.16Å; V321-E325 HydrophobicContact CG1-CG 4.13Å; V321-E325 WeakPolarHBondContact O-CB 3.34Å; V321-E325 VanDerWaalsContact O-CG 3.29Å; V321-E325 WeakPolarHBondContact O-CG 3.49Å; V321-E325 PolarHBondContact O-N 3.35Å
322	W	96.1	Very high	95.5	Very high	204 Å²	204	44.2 Å²	44.2	77%	0.773	21%	0.21	S	C	*	.	H	α-helix	trans	-59.9	-43	-179.4	-173.5	-98.7	0	0	0	112.7	K320 E325 T326	K320-W322 VanDerWaalsContact C-N 3.35Å; K320-W322 PolarHBondContact O-N 3.07Å; W322-E325 PolarHBondContact O-N 3.26Å; W322-T326 HydrophobicContact CD2-CG2 4.09Å; W322-T326 HydrophobicContact CE3-CG2 4.4Å; W322-T326 HydrophobicContact CH2-CG2 4.31Å; W322-T326 HydrophobicContact CZ2-CG2 3.97Å; W322-T326 WeakPolarHBondContact O-CB 3.35Å; W322-T326 WeakPolarHBondContact O-CG2 3.46Å; W322-T326 PolarHBondContact O-N 3.34Å; W322-T326 PolarHBondContact O-OG1 3.44Å
323	L	96.4	Very high	95.4	Very high	53 Å²	53	41.3 Å²	41.3	28%	0.277	20%	0.198	S	C	.	.	H	α-helix	trans	-66.9	-39.6	177.7	-174.8	65.4	0	0	0	111.3	K320 V321 N327 A335	K320-L323 HydrophobicContact CB-CB 3.97Å; K320-L323 HydrophobicContact CD-CD2 4.29Å; K320-L323 WeakPolarHBondContact O-CA 3.46Å; K320-L323 WeakPolarHBondContact O-CB 3.29Å; K320-L323 PolarHBondContact O-N 2.95Å; V321-L323 VanDerWaalsContact C-N 3.32Å; V321-L323 PolarHBondContact O-N 3.37Å; L323-N327 HydrophobicContact CD1-CB 3.91Å; L323-N327 WeakPolarHBondContact CD1-ND2 3.32Å; L323-N327 HydrophobicContact CG-CB 4.41Å; L323-N327 WeakPolarHBondContact O-CB 3.35Å; L323-N327 PolarHBondContact O-N 3Å; L323-A335 HydrophobicContact CD2-CB 4.3Å
324	F	95.8	Very high	95.3	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-42.7	176.8	-178.8	-101.1	0	0	0	111.9	L281 Y282 M319 K320 V321 T333 S336 F337 W429	L281-F324 HydrophobicContact CB-CZ 4.1Å; L281-F324 HydrophobicContact CD1-CE2 4.1Å; L281-F324 HydrophobicContact CD1-CZ 3.8Å; Y282-F324 HydrophobicContact CD1-CE1 4.44Å; Y282-F324 AromaticContact CE1-CE1 3.94Å; Y282-F324 HydrophobicContact CE1-CE1 3.94Å; M319-F324 HydrophobicContact SD-CB 3.93Å; M319-F324 HydrophobicContact SD-CD1 4.47Å; M319-F324 HydrophobicContact SD-CD2 4.33Å; M319-F324 HydrophobicContact SD-CG 4Å; K320-F324 PolarHBondContact O-N 3.46Å; V321-F324 WeakPolarHBondContact O-CB 3.31Å; V321-F324 PolarHBondContact O-N 3.11Å; V321-F324 VanDerWaalsContact O-N 3.16Å; F324-T333 HydrophobicContact CD2-CG2 4.26Å; F324-T333 HydrophobicContact CE2-CG2 4.04Å; F324-S336 WeakPolarHBondContact CA-OG 3.28Å; F324-F337 HydrophobicContact CD2-CB 4.27Å; F324-F337 HydrophobicContact CD2-CD2 4.17Å; F324-F337 HydrophobicContact CE2-CB 4.32Å; F324-F337 AromaticContact CE2-CD2 3.65Å; F324-F337 HydrophobicContact CE2-CD2 3.65Å; F324-F337 HydrophobicContact CE2-CE2 4.45Å; F324-F337 HydrophobicContact CE2-CG 4.35Å; F324-F337 HydrophobicContact CZ-CD2 4.23Å; F324-W429 HydrophobicContact CD1-CH2 4.42Å; F324-W429 HydrophobicContact CD2-CH2 4.45Å; F324-W429 AromaticContact CE1-CH2 3.79Å; F324-W429 HydrophobicContact CE1-CH2 3.79Å; F324-W429 HydrophobicContact CE1-CZ2 4.44Å; F324-W429 AromaticContact CE2-CH2 3.85Å; F324-W429 HydrophobicContact CE2-CH2 3.85Å; F324-W429 AromaticContact CZ-CH2 3.5Å; F324-W429 HydrophobicContact CZ-CH2 3.5Å; F324-W429 VanDerWaalsContact CZ-CH2 3.5Å; F324-W429 HydrophobicContact CZ-CZ2 4.5Å; F324-W429 HydrophobicContact CZ-CZ3 4.18Å
325	E	94.8	Very high	95.2	Very high	35 Å²	35	41.3 Å²	41.3	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-76.1	-33	-177	-67.1	-64.6	165.7	0	0	113.3	Y240 K278 Y282 V321 W322 Q425	Y240-E325 PolarHBondContact OH-OE1 3.11Å; K278-E325 WeakPolarHBondContact CE-OE2 3.29Å; K278-E325 IonicContact NZ-OE2 2.73Å; K278-E325 PolarHBondContact NZ-OE2 3.08Å; Y282-E325 VanDerWaalsContact CE1-OE1 3.28Å; Y282-E325 WeakPolarHBondContact CE1-OE1 3.33Å; Y282-E325 PolarHBondContact OH-OE1 2.95Å; Y282-E325 PolarHBondContact OH-OE2 3.24Å; V321-E325 HydrophobicContact CG1-CG 4.13Å; V321-E325 WeakPolarHBondContact O-CB 3.34Å; V321-E325 VanDerWaalsContact O-CG 3.29Å; V321-E325 WeakPolarHBondContact O-CG 3.49Å; V321-E325 PolarHBondContact O-N 3.35Å; W322-E325 PolarHBondContact O-N 3.26Å; E325-Q425 PolarHBondContact O-NE2 3.05Å; E325-Q425 VanDerWaalsContact O-NE2 3.12Å
326	T	94.9	Very high	95.3	Very high	42 Å²	42	40.4 Å²	40.4	26%	0.258	20%	0.2	S	C	.	.	H	α-helix	trans	-112.1	-10.3	-167.7	65.5	0	0	0	0	115.2	W322 P328 Y421	W322-T326 HydrophobicContact CD2-CG2 4.09Å; W322-T326 HydrophobicContact CE3-CG2 4.4Å; W322-T326 HydrophobicContact CH2-CG2 4.31Å; W322-T326 HydrophobicContact CZ2-CG2 3.97Å; W322-T326 WeakPolarHBondContact O-CB 3.35Å; W322-T326 WeakPolarHBondContact O-CG2 3.46Å; W322-T326 PolarHBondContact O-N 3.34Å; W322-T326 PolarHBondContact O-OG1 3.44Å; T326-P328 WeakPolarHBondContact O-CD 3.29Å; T326-Y421 VanDerWaalsContact O-CE2 3.25Å; T326-Y421 WeakPolarHBondContact O-CE2 3.09Å; T326-Y421 PolarHBondContact O-OH 3.31Å
327	N	94.1	Very high	95.2	Very high	40 Å²	40	42 Å²	42	21%	0.214	21%	0.207	C	C	.	.			trans	-86	123.9	-179.9	-162.4	-55.9	0	0	0	111.1	L323 R329 Q425 H428	L323-N327 HydrophobicContact CD1-CB 3.91Å; L323-N327 WeakPolarHBondContact CD1-ND2 3.32Å; L323-N327 HydrophobicContact CG-CB 4.41Å; L323-N327 WeakPolarHBondContact O-CB 3.35Å; L323-N327 PolarHBondContact O-N 3Å; N327-R329 PolarHBondContact O-N 3.2Å; N327-R329 VanDerWaalsContact OD1-CB 3.31Å; N327-R329 WeakPolarHBondContact OD1-CB 3.37Å; N327-R329 PolarHBondContact OD1-N 3.25Å; N327-Q425 PolarHBondContact O-OE1 3.4Å; N327-H428 PolarHBondContact O-CE1 3.43Å; N327-H428 PolarHBondContact O-ND1 3.43Å
328	P	94.6	Very high	95.2	Very high	24 Å²	24	42.3 Å²	42.3	16%	0.156	21%	0.206	C	C	.	.			trans	-89.8	21.4	-176.6	40.6	-39.7	0	0	0	113.5	T326 Y421 Q424 Q425	T326-P328 WeakPolarHBondContact O-CD 3.29Å; P328-Y421 HydrophobicContact CB-CD2 4.25Å; P328-Y421 HydrophobicContact CB-CE2 4.26Å; P328-Y421 HydrophobicContact CG-CD2 4.01Å; P328-Y421 HydrophobicContact CG-CE2 4.17Å; P328-Q424 HydrophobicContact CB-CB 3.66Å; P328-Q424 HydrophobicContact CG-CB 4.25Å; P328-Q425 HydrophobicContact CB-CB 4.3Å
329	R	94.3	Very high	95.3	Very high	127 Å²	127	43.6 Å²	43.6	48%	0.479	21%	0.213	S	C	.	.	S	Bend	trans	-123.7	146.5	-178.5	-58.8	-175.1	-176.4	175.7	2.1	111	N327 T331 G332 T333 E394	N327-R329 PolarHBondContact O-N 3.2Å; N327-R329 VanDerWaalsContact OD1-CB 3.31Å; N327-R329 WeakPolarHBondContact OD1-CB 3.37Å; N327-R329 PolarHBondContact OD1-N 3.25Å; R329-T331 VanDerWaalsContact C-N 3.32Å; R329-T331 PolarHBondContact O-N 3.13Å; R329-G332 WeakPolarHBondContact O-CA 3.48Å; R329-G332 PolarHBondContact O-N 2.93Å; R329-T333 PolarHBondContact O-N 3.12Å; R329-E394 WeakPolarHBondContact CA-OE2 3.35Å; R329-E394 WeakPolarHBondContact CB-OE2 3.21Å
330	F	94	Very high	95.3	Very high	16 Å²	16	44.7 Å²	44.7	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-39.2	177.6	-64.6	-89.2	0	0	0	111.4	G332 T333 I334 I390 E394 H428 F431 M432 F462	F330-G332 PolarHBondContact O-N 3.3Å; F330-T333 WeakPolarHBondContact O-CB 3.48Å; F330-T333 PolarHBondContact O-N 2.71Å; F330-I334 WeakPolarHBondContact O-CG1 3.38Å; F330-I334 PolarHBondContact O-N 3.48Å; F330-I390 HydrophobicContact CB-CG2 3.87Å; F330-I390 HydrophobicContact CD1-CD1 4.36Å; F330-I390 HydrophobicContact CD1-CG2 3.58Å; F330-I390 HydrophobicContact CD2-CG2 3.33Å; F330-I390 HydrophobicContact CE1-CD1 4.08Å; F330-I390 HydrophobicContact CE1-CG2 3.92Å; F330-I390 HydrophobicContact CE2-CG2 3.69Å; F330-I390 HydrophobicContact CG-CG2 3.29Å; F330-I390 HydrophobicContact CZ-CG2 3.98Å; F330-E394 WeakPolarHBondContact CD2-OE2 3.48Å; F330-E394 PolarHBondContact N-OE2 2.86Å; F330-H428 AromaticContact CD1-CD2 3.75Å; F330-H428 AromaticContact CE1-CD2 3.82Å; F330-H428 WeakPolarHBondContact CE1-O 3.36Å; F330-H428 HydrophobicContact CZ-CB 4.5Å; F330-F431 HydrophobicContact CE1-CB 3.98Å; F330-F431 HydrophobicContact CZ-CB 3.76Å; F330-F431 HydrophobicContact CZ-CD2 4.44Å; F330-M432 HydrophobicContact CD1-CG 3.98Å; F330-M432 HydrophobicContact CD1-SD 3.58Å; F330-M432 VanDerWaalsContact CD1-SD 3.58Å; F330-M432 HydrophobicContact CE1-CG 3.85Å; F330-M432 HydrophobicContact CE1-SD 3.97Å; F330-F462 HydrophobicContact CE2-CZ 4.26Å; F330-F462 HydrophobicContact CZ-CZ 4.18Å
331	T	93.1	Very high	95.3	Very high	58 Å²	58	40.4 Å²	40.4	36%	0.356	20%	0.201	S	C	.	.	H	α-helix	trans	-61.4	-27.4	172.3	45.2	0	0	0	0	113.1	R329 A335 E394	R329-T331 VanDerWaalsContact C-N 3.32Å; R329-T331 PolarHBondContact O-N 3.13Å; T331-A335 VanDerWaalsContact O-CB 3.26Å; T331-A335 WeakPolarHBondContact O-CB 3.12Å; T331-A335 PolarHBondContact O-N 3.09Å; T331-E394 VanDerWaalsContact CB-OE1 3.25Å; T331-E394 WeakPolarHBondContact CB-OE1 3.32Å; T331-E394 WeakPolarHBondContact CG2-OE1 3.46Å; T331-E394 PolarHBondContact N-OE1 3.4Å; T331-E394 PolarHBondContact OG1-OE1 3.22Å
332	G	94.1	Very high	95.3	Very high	4 Å²	4	41.6 Å²	41.6	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-41.5	171.5	0	0	0	0	0	112.5	R329 F330 A335 S336	R329-G332 WeakPolarHBondContact O-CA 3.48Å; R329-G332 PolarHBondContact O-N 2.93Å; F330-G332 PolarHBondContact O-N 3.3Å; G332-A335 PolarHBondContact O-N 3.43Å; G332-S336 VanDerWaalsContact O-CB 3.31Å; G332-S336 WeakPolarHBondContact O-CB 3.24Å; G332-S336 PolarHBondContact O-N 3.45Å; G332-S336 VanDerWaalsContact O-N 3.12Å; G332-S336 PolarHBondContact O-OG 3.29Å
333	T	93.9	Very high	95.3	Very high	8 Å²	8	33.6 Å²	33.6	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-64.6	-47.1	173.7	-63.9	0	0	0	0	111.7	F324 R329 F330 A335 S336 F337 H428 M432	F324-T333 HydrophobicContact CD2-CG2 4.26Å; F324-T333 HydrophobicContact CE2-CG2 4.04Å; R329-T333 PolarHBondContact O-N 3.12Å; F330-T333 WeakPolarHBondContact O-CB 3.48Å; F330-T333 PolarHBondContact O-N 2.71Å; T333-A335 PolarHBondContact O-N 2.78Å; T333-S336 WeakPolarHBondContact CA-OG 3.29Å; T333-S336 PolarHBondContact O-N 3.26Å; T333-S336 PolarHBondContact O-OG 3.09Å; T333-S336 VanDerWaalsContact O-OG 3.13Å; T333-F337 HydrophobicContact CG2-CB 4.33Å; T333-F337 VanDerWaalsContact O-CB 3.32Å; T333-F337 WeakPolarHBondContact O-CB 3.36Å; T333-F337 PolarHBondContact O-N 3.47Å; T333-H428 PolarHBondContact OG1-CE1 3.06Å; T333-H428 PolarHBondContact OG1-NE2 3.44Å; T333-M432 HydrophobicContact CG2-CE 3.69Å; T333-M432 HydrophobicContact CG2-SD 4.26Å
334	I	93.4	Very high	95.4	Very high	54 Å²	54	31.1 Å²	31.1	28%	0.277	17%	0.171	S	C	.	.	H	α-helix	trans	-58.6	-38.2	175.7	-63.2	166.6	0	0	0	111.3	F330 S336 N342 E387 V391	F330-I334 WeakPolarHBondContact O-CG1 3.38Å; F330-I334 PolarHBondContact O-N 3.48Å; I334-S336 VanDerWaalsContact C-N 3.28Å; I334-S336 PolarHBondContact O-N 3.02Å; I334-N342 PolarHBondContact O-ND2 3.29Å; I334-E387 HydrophobicContact CD1-CG 4.07Å; I334-E387 WeakPolarHBondContact CD1-OE1 3.17Å; I334-V391 HydrophobicContact CD1-CG2 3.66Å
335	A	94.9	Very high	95.5	Very high	50 Å²	50	31.5 Å²	31.5	41%	0.413	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.1	178.9	0	0	0	0	0	114.4	L323 T331 G332 T333	L323-A335 HydrophobicContact CD2-CB 4.3Å; T331-A335 VanDerWaalsContact O-CB 3.26Å; T331-A335 WeakPolarHBondContact O-CB 3.12Å; T331-A335 PolarHBondContact O-N 3.09Å; G332-A335 PolarHBondContact O-N 3.43Å; T333-A335 PolarHBondContact O-N 2.78Å
336	S	96.8	Very high	95.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-19	-175	59.3	0	0	0	0	114.4	M319 K320 F324 G332 T333 I334	M319-S336 CarbonylContact C-O 3.06Å; M319-S336 VanDerWaalsContact CA-O 3.27Å; M319-S336 WeakPolarHBondContact CA-O 3.26Å; K320-S336 PolarHBondContact N-O 3.43Å; F324-S336 WeakPolarHBondContact CA-OG 3.28Å; G332-S336 VanDerWaalsContact O-CB 3.31Å; G332-S336 WeakPolarHBondContact O-CB 3.24Å; G332-S336 PolarHBondContact O-N 3.45Å; G332-S336 VanDerWaalsContact O-N 3.12Å; G332-S336 PolarHBondContact O-OG 3.29Å; T333-S336 WeakPolarHBondContact CA-OG 3.29Å; T333-S336 PolarHBondContact O-N 3.26Å; T333-S336 PolarHBondContact O-OG 3.09Å; T333-S336 VanDerWaalsContact O-OG 3.13Å; I334-S336 VanDerWaalsContact C-N 3.28Å; I334-S336 PolarHBondContact O-N 3.02Å
337	F	95.8	Very high	95.6	Very high	35 Å²	35	30.5 Å²	30.5	15%	0.154	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-113.5	134	-176.7	-169.1	-86.7	0	0	0	110.8	L281 Y284 V285 W288 N318 M319 F324 T333 I339 N342	L281-F337 HydrophobicContact CB-CE2 4.02Å; L281-F337 HydrophobicContact CD1-CE2 4.47Å; L281-F337 HydrophobicContact CD2-CE1 4.47Å; L281-F337 HydrophobicContact CD2-CE2 4.07Å; L281-F337 HydrophobicContact CD2-CZ 3.8Å; L281-F337 HydrophobicContact CG-CE2 4.42Å; Y284-F337 HydrophobicContact CD2-CZ 4.26Å; Y284-F337 HydrophobicContact CG-CZ 4.36Å; V285-F337 HydrophobicContact CG2-CE2 4.31Å; W288-F337 AromaticContact CH2-CD1 3.96Å; W288-F337 HydrophobicContact CH2-CD1 3.96Å; W288-F337 AromaticContact CH2-CE1 3.4Å; W288-F337 HydrophobicContact CH2-CE1 3.4Å; W288-F337 VanDerWaalsContact CH2-CE1 3.4Å; W288-F337 HydrophobicContact CH2-CE2 4.23Å; W288-F337 AromaticContact CH2-CZ 3.54Å; W288-F337 HydrophobicContact CH2-CZ 3.54Å; W288-F337 AromaticContact CZ3-CD1 3.88Å; W288-F337 HydrophobicContact CZ3-CD1 3.88Å; W288-F337 AromaticContact CZ3-CD2 3.95Å; W288-F337 HydrophobicContact CZ3-CD2 3.95Å; W288-F337 AromaticContact CZ3-CE1 3.57Å; W288-F337 HydrophobicContact CZ3-CE1 3.57Å; W288-F337 AromaticContact CZ3-CE2 3.59Å; W288-F337 HydrophobicContact CZ3-CE2 3.59Å; W288-F337 HydrophobicContact CZ3-CG 4.06Å; W288-F337 AromaticContact CZ3-CZ 3.38Å; W288-F337 HydrophobicContact CZ3-CZ 3.38Å; N318-F337 CarbonylContact O-C 3.58Å; M319-F337 HydrophobicContact CE-CB 4.43Å; M319-F337 HydrophobicContact CE-CD2 3.28Å; M319-F337 HydrophobicContact CE-CE2 3.75Å; M319-F337 HydrophobicContact CE-CG 4.12Å; F324-F337 HydrophobicContact CD2-CB 4.27Å; F324-F337 HydrophobicContact CD2-CD2 4.17Å; F324-F337 HydrophobicContact CE2-CB 4.32Å; F324-F337 AromaticContact CE2-CD2 3.65Å; F324-F337 HydrophobicContact CE2-CD2 3.65Å; F324-F337 HydrophobicContact CE2-CE2 4.45Å; F324-F337 HydrophobicContact CE2-CG 4.35Å; F324-F337 HydrophobicContact CZ-CD2 4.23Å; T333-F337 HydrophobicContact CG2-CB 4.33Å; T333-F337 VanDerWaalsContact O-CB 3.32Å; T333-F337 WeakPolarHBondContact O-CB 3.36Å; T333-F337 PolarHBondContact O-N 3.47Å; F337-I339 VanDerWaalsContact C-N 3.28Å; F337-I339 PolarHBondContact O-N 3.23Å; F337-N342 PolarHBondContact O-ND2 3.49Å; F337-N342 VanDerWaalsContact O-ND2 3.09Å
338	N	96.2	Very high	95.7	Very high	18 Å²	18	29.2 Å²	29.2	10%	0.096	16%	0.163	C	C	.	.	S	Bend	trans	51.8	42	-178.6	-156.2	3.2	0	0	0	114.3	W288 N318 N340 T341 N342	W288-N338 HydrophobicContact CH2-CB 3.55Å; W288-N338 HydrophobicContact CZ2-CB 4.14Å; W288-N338 HydrophobicContact CZ3-CB 4.13Å; N318-N338 WeakPolarHBondContact O-CA 3.38Å; N318-N338 PolarHBondContact O-N 2.94Å; N338-N340 PolarHBondContact O-N 2.87Å; N338-T341 VanDerWaalsContact CG-CB 3.47Å; N338-T341 PolarHBondContact ND2-OG1 3.46Å; N338-T341 PolarHBondContact O-N 2.93Å; N338-T341 VanDerWaalsContact O-N 3.14Å; N338-T341 WeakPolarHBondContact OD1-CB 3.45Å; N338-T341 PolarHBondContact OD1-OG1 3.01Å; N338-N342 PolarHBondContact O-N 3.44Å
339	I	97.4	Very high	95.8	Very high	30 Å²	30	29.8 Å²	29.8	15%	0.154	16%	0.163	C	C	.	.	H	α-helix	trans	-55.6	-44.3	-166.9	-63.8	164.7	0	0	0	113	A317 N318 K320 F337 T341 N342 A343	A317-I339 WeakPolarHBondContact O-CB 3.42Å; N318-I339 PolarHBondContact O-N 3.14Å; N318-I339 VanDerWaalsContact O-N 3.13Å; K320-I339 HydrophobicContact CB-CD1 4.15Å; K320-I339 HydrophobicContact CD-CD1 3.73Å; K320-I339 HydrophobicContact CG-CD1 3.54Å; F337-I339 VanDerWaalsContact C-N 3.28Å; F337-I339 PolarHBondContact O-N 3.23Å; I339-T341 PolarHBondContact O-N 3.3Å; I339-N342 PolarHBondContact O-N 3.44Å; I339-A343 WeakPolarHBondContact O-CB 3.48Å; I339-A343 PolarHBondContact O-N 3.35Å
340	N	96.9	Very high	95.9	Very high	24 Å²	24	26.5 Å²	26.5	13%	0.128	15%	0.152	C	C	.	.	H	α-helix	trans	-70.7	-33.1	-177	-69.3	-68.7	0	0	0	112.6	Q202 A315 C316 A317 N318 N338 A343 W344	Q202-N340 HydrophobicContact CB-CB 3.98Å; Q202-N340 WeakPolarHBondContact O-CB 3.38Å; A315-N340 PolarHBondContact O-OD1 3.48Å; C316-N340 VanDerWaalsContact C-ND2 3.34Å; C316-N340 PolarHBondContact O-ND2 3Å; A317-N340 PolarHBondContact O-ND2 2.79Å; A317-N340 VanDerWaalsContact O-ND2 3.09Å; N318-N340 VanDerWaalsContact OD1-CB 3.3Å; N318-N340 WeakPolarHBondContact OD1-CB 3.43Å; N318-N340 PolarHBondContact OD1-N 3.02Å; N318-N340 PolarHBondContact OD1-ND2 3.29Å; N338-N340 PolarHBondContact O-N 2.87Å; N340-A343 PolarHBondContact O-N 2.96Å; N340-W344 WeakPolarHBondContact O-CB 3.32Å; N340-W344 PolarHBondContact O-N 3.35Å
341	T	97.1	Very high	96	Very high	6 Å²	6	30.8 Å²	30.8	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-66.6	-42.6	172.9	-55.1	0	0	0	0	110.6	L150 N338 I339 A343 W344 V345 L370 W373	L150-T341 HydrophobicContact CD1-CG2 3.92Å; N338-T341 VanDerWaalsContact CG-CB 3.47Å; N338-T341 PolarHBondContact ND2-OG1 3.46Å; N338-T341 PolarHBondContact O-N 2.93Å; N338-T341 VanDerWaalsContact O-N 3.14Å; N338-T341 WeakPolarHBondContact OD1-CB 3.45Å; N338-T341 PolarHBondContact OD1-OG1 3.01Å; I339-T341 PolarHBondContact O-N 3.3Å; T341-A343 VanDerWaalsContact C-N 3.34Å; T341-A343 PolarHBondContact O-N 2.83Å; T341-W344 WeakPolarHBondContact O-CB 3.25Å; T341-W344 PolarHBondContact O-N 3.01Å; T341-W344 VanDerWaalsContact O-N 3.15Å; T341-V345 WeakPolarHBondContact O-CG2 3.39Å; T341-V345 PolarHBondContact O-N 3.48Å; T341-L370 HydrophobicContact CG2-CD2 4.18Å; T341-W373 HydrophobicContact CG2-CH2 4.14Å; T341-W373 HydrophobicContact CG2-CZ3 4.14Å
342	N	96.6	Very high	96	Very high	44 Å²	44	31.2 Å²	31.2	24%	0.235	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-41.5	174.7	-73.9	-23	0	0	0	111.9	I334 F337 N338 I339 W344 V345 A346	I334-N342 PolarHBondContact O-ND2 3.29Å; F337-N342 PolarHBondContact O-ND2 3.49Å; F337-N342 VanDerWaalsContact O-ND2 3.09Å; N338-N342 PolarHBondContact O-N 3.44Å; I339-N342 PolarHBondContact O-N 3.44Å; N342-W344 VanDerWaalsContact C-N 3.33Å; N342-W344 PolarHBondContact O-N 2.9Å; N342-V345 PolarHBondContact O-N 3.46Å; N342-A346 VanDerWaalsContact O-CB 3.29Å; N342-A346 WeakPolarHBondContact O-CB 3.12Å; N342-A346 PolarHBondContact O-N 2.89Å
343	A	96.6	Very high	96.1	Very high	36 Å²	36	32.2 Å²	32.2	30%	0.298	17%	0.17	S	C	.	.	H	α-helix	trans	-64.4	-37.6	173.9	0	0	0	0	0	112.2	I339 N340 T341 R347	I339-A343 WeakPolarHBondContact O-CB 3.48Å; I339-A343 PolarHBondContact O-N 3.35Å; N340-A343 PolarHBondContact O-N 2.96Å; T341-A343 VanDerWaalsContact C-N 3.34Å; T341-A343 PolarHBondContact O-N 2.83Å; A343-R347 WeakPolarHBondContact O-CB 3.32Å; A343-R347 PolarHBondContact O-N 3.16Å
344	W	97.7	Very high	96.1	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-52.4	175.1	-173.3	97.7	0	0	0	110.9	L150 I153 Q202 N340 T341 N342 A346 R347 Y348 F369	L150-W344 HydrophobicContact CB-CD2 4.13Å; L150-W344 HydrophobicContact CB-CG 4.47Å; L150-W344 HydrophobicContact CB-CZ2 4.16Å; L150-W344 HydrophobicContact CD1-CD2 4.43Å; L150-W344 HydrophobicContact CD1-CE3 4.48Å; L150-W344 HydrophobicContact CD2-CD2 4.14Å; L150-W344 HydrophobicContact CD2-CE3 3.84Å; L150-W344 HydrophobicContact CD2-CH2 3.75Å; L150-W344 HydrophobicContact CD2-CZ2 4.01Å; L150-W344 HydrophobicContact CD2-CZ3 3.66Å; L150-W344 HydrophobicContact CG-CD2 4.46Å; L150-W344 WeakPolarHBondContact O-CZ2 3.33Å; L150-W344 PolarHBondContact O-NE1 3.31Å; I153-W344 HydrophobicContact CB-CH2 4.32Å; I153-W344 HydrophobicContact CB-CZ2 3.87Å; I153-W344 HydrophobicContact CG2-CH2 3.86Å; I153-W344 HydrophobicContact CG2-CZ2 3.68Å; Q202-W344 HydrophobicContact CG-CB 4.27Å; Q202-W344 HydrophobicContact CG-CG 4.23Å; Q202-W344 VanDerWaalsContact NE2-CD1 3.29Å; N340-W344 WeakPolarHBondContact O-CB 3.32Å; N340-W344 PolarHBondContact O-N 3.35Å; T341-W344 WeakPolarHBondContact O-CB 3.25Å; T341-W344 PolarHBondContact O-N 3.01Å; T341-W344 VanDerWaalsContact O-N 3.15Å; N342-W344 VanDerWaalsContact C-N 3.33Å; N342-W344 PolarHBondContact O-N 2.9Å; W344-A346 VanDerWaalsContact C-N 3.29Å; W344-A346 PolarHBondContact O-N 3.09Å; W344-R347 PolarHBondContact O-N 2.92Å; W344-R347 VanDerWaalsContact O-N 3.1Å; W344-Y348 HydrophobicContact CB-CD2 4.28Å; W344-Y348 AromaticContact CD1-CD2 3.26Å; W344-Y348 AromaticContact CD1-CE2 3.35Å; W344-Y348 AromaticContact CD2-CD2 3.71Å; W344-Y348 HydrophobicContact CD2-CD2 3.71Å; W344-Y348 HydrophobicContact CD2-CG 4.33Å; W344-Y348 AromaticContact CE2-CD2 3.56Å; W344-Y348 AromaticContact CE2-CG 3.94Å; W344-Y348 AromaticContact CG-CD2 3.54Å; W344-Y348 HydrophobicContact CG-CD2 3.54Å; W344-Y348 HydrophobicContact CG-CE2 4.01Å; W344-Y348 HydrophobicContact CZ2-CD2 4.3Å; W344-Y348 HydrophobicContact CZ2-CG 4.24Å; W344-Y348 AromaticContact NE1-CD2 3.32Å; W344-Y348 VanDerWaalsContact NE1-CD2 3.32Å; W344-Y348 AromaticContact NE1-CE2 3.57Å; W344-Y348 VanDerWaalsContact O-CD2 3.31Å; W344-Y348 WeakPolarHBondContact O-CD2 3.3Å; W344-Y348 PolarHBondContact O-N 3.44Å; W344-F369 HydrophobicContact CE3-CE1 4.33Å; W344-F369 HydrophobicContact CH2-CE1 4.33Å; W344-F369 AromaticContact CH2-CZ 3.9Å; W344-F369 HydrophobicContact CH2-CZ 3.9Å; W344-F369 AromaticContact CZ3-CE1 3.54Å; W344-F369 HydrophobicContact CZ3-CE1 3.54Å; W344-F369 AromaticContact CZ3-CZ 3.59Å; W344-F369 HydrophobicContact CZ3-CZ 3.59Å
345	V	97.8	Very high	96.1	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.048	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-40.9	179.3	173.8	0	0	0	0	110.6	T341 N342 R347 F349 F350 F369 L370	T341-V345 WeakPolarHBondContact O-CG2 3.39Å; T341-V345 PolarHBondContact O-N 3.48Å; N342-V345 PolarHBondContact O-N 3.46Å; V345-R347 VanDerWaalsContact C-N 3.33Å; V345-R347 PolarHBondContact O-N 2.87Å; V345-F349 HydrophobicContact CG1-CB 4.28Å; V345-F349 CarbonylContact O-C 3.46Å; V345-F349 WeakPolarHBondContact O-CA 3.32Å; V345-F349 VanDerWaalsContact O-CB 3.31Å; V345-F349 WeakPolarHBondContact O-CB 3.29Å; V345-F349 PolarHBondContact O-N 2.88Å; V345-F350 PolarHBondContact O-N 3.41Å; V345-F369 HydrophobicContact CG2-CD1 4.21Å; V345-F369 HydrophobicContact CG2-CE1 4.09Å; V345-L370 HydrophobicContact CG1-CD1 4.34Å; V345-L370 HydrophobicContact CG1-CG 4.49Å; V345-L370 HydrophobicContact CG2-CD1 4.24Å; V345-L370 HydrophobicContact CG2-CD2 3.71Å; V345-L370 HydrophobicContact CG2-CG 3.9Å
346	A	96.6	Very high	96.1	Very high	34 Å²	34	45.7 Å²	45.7	28%	0.281	22%	0.219	S	C	.	.	I	π-helix	trans	-57.5	-45.7	175.1	0	0	0	0	0	112.1	N342 W344 K351	N342-A346 VanDerWaalsContact O-CB 3.29Å; N342-A346 WeakPolarHBondContact O-CB 3.12Å; N342-A346 PolarHBondContact O-N 2.89Å; W344-A346 VanDerWaalsContact C-N 3.29Å; W344-A346 PolarHBondContact O-N 3.09Å; A346-K351 VanDerWaalsContact O-CB 3.3Å; A346-K351 WeakPolarHBondContact O-CB 3.36Å; A346-K351 WeakPolarHBondContact O-CG 3.44Å; A346-K351 PolarHBondContact O-N 3.38Å
347	R	96	Very high	96	Very high	22 Å²	22	49.4 Å²	49.4	8%	0.083	26%	0.257	C	S	.	.	I	π-helix	trans	-78.2	-50.1	-174.5	-171	-163.3	-40.8	-71.8	-13	113.5	E172 Y176 A343 W344 V345 R352	E172-R347 HydrophobicContact CG-CG 4.2Å; E172-R347 IonicContact OE1-CZ 3.42Å; E172-R347 IonicContact OE1-NH1 3.04Å; E172-R347 PolarHBondContact OE1-NH1 2.88Å; E172-R347 IonicContact OE1-NH2 2.6Å; Y176-R347 VanDerWaalsContact CZ-NH1 3.26Å; Y176-R347 PolarHBondContact OH-NH2 3.49Å; Y176-R347 VanDerWaalsContact OH-NH2 3.08Å; A343-R347 WeakPolarHBondContact O-CB 3.32Å; A343-R347 PolarHBondContact O-N 3.16Å; W344-R347 PolarHBondContact O-N 2.92Å; W344-R347 VanDerWaalsContact O-N 3.1Å; V345-R347 VanDerWaalsContact C-N 3.33Å; V345-R347 PolarHBondContact O-N 2.87Å; R347-R352 PolarHBondContact O-NE 3.44Å
348	Y	96.6	Very high	96	Very high	14 Å²	14	51.5 Å²	51.5	6%	0.055	27%	0.27	C	S	.	.	I	π-helix	trans	-92.8	-17.1	-168.6	-64	-76.3	0	0	0	113	V157 D158 W344 R352	V157-Y348 HydrophobicContact CB-CD1 3.8Å; V157-Y348 HydrophobicContact CB-CE1 4.09Å; V157-Y348 HydrophobicContact CG1-CD1 3.81Å; V157-Y348 HydrophobicContact CG1-CE1 4.19Å; V157-Y348 HydrophobicContact CG2-CD1 4.24Å; D158-Y348 VanDerWaalsContact CG-OH 3.25Å; D158-Y348 WeakPolarHBondContact OD1-CE1 3.38Å; D158-Y348 PolarHBondContact OD1-OH 2.83Å; D158-Y348 VanDerWaalsContact OD1-OH 3.11Å; D158-Y348 PolarHBondContact OD2-OH 3.13Å; W344-Y348 HydrophobicContact CB-CD2 4.28Å; W344-Y348 AromaticContact CD1-CD2 3.26Å; W344-Y348 AromaticContact CD1-CE2 3.35Å; W344-Y348 AromaticContact CD2-CD2 3.71Å; W344-Y348 HydrophobicContact CD2-CD2 3.71Å; W344-Y348 HydrophobicContact CD2-CG 4.33Å; W344-Y348 AromaticContact CE2-CD2 3.56Å; W344-Y348 AromaticContact CE2-CG 3.94Å; W344-Y348 AromaticContact CG-CD2 3.54Å; W344-Y348 HydrophobicContact CG-CD2 3.54Å; W344-Y348 HydrophobicContact CG-CE2 4.01Å; W344-Y348 HydrophobicContact CZ2-CD2 4.3Å; W344-Y348 HydrophobicContact CZ2-CG 4.24Å; W344-Y348 AromaticContact NE1-CD2 3.32Å; W344-Y348 VanDerWaalsContact NE1-CD2 3.32Å; W344-Y348 AromaticContact NE1-CE2 3.57Å; W344-Y348 VanDerWaalsContact O-CD2 3.31Å; W344-Y348 WeakPolarHBondContact O-CD2 3.3Å; W344-Y348 PolarHBondContact O-N 3.44Å; Y348-R352 VanDerWaalsContact O-CG 3.32Å; Y348-R352 WeakPolarHBondContact O-CG 3.48Å
349	F	95.9	Very high	95.9	Very high	36 Å²	36	57.1 Å²	57.1	16%	0.158	29%	0.294	C	S	.	.	I	π-helix	trans	-121.6	-70.8	-177.7	-155.3	-91.8	0	0	0	111.6	F118 V345 K351 R352 L353 L365 F369	F118-F349 HydrophobicContact CE2-CD2 4.12Å; F118-F349 AromaticContact CE2-CE2 3.93Å; F118-F349 HydrophobicContact CE2-CE2 3.93Å; F118-F349 HydrophobicContact CZ-CD2 4.39Å; F118-F349 AromaticContact CZ-CE2 3.75Å; F118-F349 HydrophobicContact CZ-CE2 3.75Å; V345-F349 HydrophobicContact CG1-CB 4.28Å; V345-F349 CarbonylContact O-C 3.46Å; V345-F349 WeakPolarHBondContact O-CA 3.32Å; V345-F349 VanDerWaalsContact O-CB 3.31Å; V345-F349 WeakPolarHBondContact O-CB 3.29Å; V345-F349 PolarHBondContact O-N 2.88Å; F349-K351 PolarHBondContact O-N 3.41Å; F349-R352 WeakPolarHBondContact O-CA 3.27Å; F349-R352 WeakPolarHBondContact O-CB 3.24Å; F349-R352 PolarHBondContact O-N 3.43Å; F349-L353 HydrophobicContact CD1-CD1 3.76Å; F349-L353 HydrophobicContact CD1-CG 4.46Å; F349-L353 HydrophobicContact CE1-CD1 3.53Å; F349-L353 HydrophobicContact CE1-CG 4.45Å; F349-L353 HydrophobicContact CZ-CD1 4.36Å; F349-L353 WeakPolarHBondContact O-CG 3.39Å; F349-L353 PolarHBondContact O-N 3.48Å; F349-L365 HydrophobicContact CE1-CB 4.15Å; F349-L365 WeakPolarHBondContact CE1-O 3.24Å; F349-F369 HydrophobicContact CD1-CB 4.26Å; F349-F369 HydrophobicContact CD2-CB 4.46Å; F349-F369 HydrophobicContact CD2-CD2 4.05Å; F349-F369 HydrophobicContact CD2-CE2 4.49Å; F349-F369 HydrophobicContact CD2-CG 4.07Å; F349-F369 HydrophobicContact CE1-CB 3.83Å; F349-F369 HydrophobicContact CE1-CG 4.45Å; F349-F369 HydrophobicContact CE2-CB 4.06Å; F349-F369 AromaticContact CE2-CD2 3.76Å; F349-F369 HydrophobicContact CE2-CD2 3.76Å; F349-F369 HydrophobicContact CE2-CE2 4.48Å; F349-F369 AromaticContact CE2-CG 3.97Å; F349-F369 HydrophobicContact CE2-CG 3.97Å; F349-F369 HydrophobicContact CG-CG 4.38Å; F349-F369 HydrophobicContact CZ-CB 3.73Å; F349-F369 HydrophobicContact CZ-CD2 4.25Å; F349-F369 HydrophobicContact CZ-CG 4.16Å
350	F	96.7	Very high	95.7	Very high	58 Å²	58	58.7 Å²	58.7	25%	0.254	30%	0.301	S	S	.	.	I	π-helix	trans	-56.1	-53	-172.7	177.7	-99.9	0	0	0	113.5	V345 R352 L353 K359 Q363 S366	V345-F350 PolarHBondContact O-N 3.41Å; F350-R352 PolarHBondContact O-N 2.94Å; F350-L353 PolarHBondContact O-N 3.11Å; F350-L353 VanDerWaalsContact O-N 3.17Å; F350-K359 HydrophobicContact CE2-CG 4.49Å; F350-K359 HydrophobicContact CZ-CG 3.96Å; F350-Q363 HydrophobicContact CE2-CB 4.02Å; F350-S366 WeakPolarHBondContact CA-OG 3.49Å; F350-S366 WeakPolarHBondContact CB-OG 3.41Å
351	K	95.6	Very high	95.7	Very high	106 Å²	106	61.5 Å²	61.5	46%	0.461	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.8	179.7	-73.7	176.1	-171.6	179.8	0	112.7	E172 A346 F349 K354	E172-K351 IonicContact OE1-NZ 3.6Å; E172-K351 VanDerWaalsContact OE2-CD 3.31Å; E172-K351 WeakPolarHBondContact OE2-CD 3.4Å; E172-K351 IonicContact OE2-NZ 2.72Å; E172-K351 PolarHBondContact OE2-NZ 2.94Å; A346-K351 VanDerWaalsContact O-CB 3.3Å; A346-K351 WeakPolarHBondContact O-CB 3.36Å; A346-K351 WeakPolarHBondContact O-CG 3.44Å; A346-K351 PolarHBondContact O-N 3.38Å; F349-K351 PolarHBondContact O-N 3.41Å; K351-K354 VanDerWaalsContact O-CB 3.31Å; K351-K354 WeakPolarHBondContact O-CB 3.3Å; K351-K354 PolarHBondContact O-N 3.05Å
352	R	94.4	Very high	95.7	Very high	67 Å²	67	61.4 Å²	61.4	25%	0.253	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-76	-26.2	176	-57.5	-63	176	148.3	2.7	111.8	D161 R347 Y348 F349 F350 K354 F355	D161-R352 IonicContact OD1-NH1 3.55Å; D161-R352 PolarHBondContact OD1-NH1 2.83Å; D161-R352 IonicContact OD2-CZ 3.79Å; D161-R352 IonicContact OD2-NH1 3.66Å; D161-R352 PolarHBondContact OD2-NH1 3.42Å; D161-R352 IonicContact OD2-NH2 2.6Å; D161-R352 PolarHBondContact OD2-NH2 3.32Å; R347-R352 PolarHBondContact O-NE 3.44Å; Y348-R352 VanDerWaalsContact O-CG 3.32Å; Y348-R352 WeakPolarHBondContact O-CG 3.48Å; F349-R352 WeakPolarHBondContact O-CA 3.27Å; F349-R352 WeakPolarHBondContact O-CB 3.24Å; F349-R352 PolarHBondContact O-N 3.43Å; F350-R352 PolarHBondContact O-N 2.94Å; R352-K354 PolarHBondContact O-N 3.19Å; R352-F355 WeakPolarHBondContact O-CD1 3.46Å
353	L	95.9	Very high	95.6	Very high	24 Å²	24	60.4 Å²	60.4	13%	0.126	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-76.6	4.4	173.1	-66	179.2	0	0	0	114.2	F349 F350 F355 L356 S362 L365	F349-L353 HydrophobicContact CD1-CD1 3.76Å; F349-L353 HydrophobicContact CD1-CG 4.46Å; F349-L353 HydrophobicContact CE1-CD1 3.53Å; F349-L353 HydrophobicContact CE1-CG 4.45Å; F349-L353 HydrophobicContact CZ-CD1 4.36Å; F349-L353 WeakPolarHBondContact O-CG 3.39Å; F349-L353 PolarHBondContact O-N 3.48Å; F350-L353 PolarHBondContact O-N 3.11Å; F350-L353 VanDerWaalsContact O-N 3.17Å; L353-F355 HydrophobicContact CD2-CE1 3.96Å; L353-F355 HydrophobicContact CD2-CZ 4.17Å; L353-F355 PolarHBondContact O-N 3.1Å; L353-L356 HydrophobicContact CB-CD1 4.05Å; L353-L356 HydrophobicContact CD2-CD1 4.16Å; L353-L356 HydrophobicContact CG-CD1 4.48Å; L353-L356 WeakPolarHBondContact O-CB 3.47Å; L353-L356 WeakPolarHBondContact O-CG 3.43Å; L353-L356 PolarHBondContact O-N 3.49Å; L353-S362 PolarHBondContact O-OG 2.87Å; L353-L365 HydrophobicContact CD1-CB 3.71Å; L353-L365 HydrophobicContact CD1-CD1 3.94Å
354	K	92.8	Very high	95.7	Very high	175 Å²	175	59.8 Å²	59.8	76%	0.761	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-54.8	-26.5	179.6	-174.3	177.5	178.1	-172.8	0	113.4	K351 R352 L356 G357	K351-K354 VanDerWaalsContact O-CB 3.31Å; K351-K354 WeakPolarHBondContact O-CB 3.3Å; K351-K354 PolarHBondContact O-N 3.05Å; R352-K354 PolarHBondContact O-N 3.19Å; K354-L356 PolarHBondContact O-N 3.31Å; K354-G357 PolarHBondContact O-N 3.13Å; K354-G357 VanDerWaalsContact O-N 3.16Å
355	F	94.1	Very high	95.7	Very high	162 Å²	162	62.6 Å²	62.6	71%	0.711	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-61.5	-19.3	175.8	71.8	-93.9	0	0	0	113.7	R352 L353 G357	R352-F355 WeakPolarHBondContact O-CD1 3.46Å; L353-F355 HydrophobicContact CD2-CE1 3.96Å; L353-F355 HydrophobicContact CD2-CZ 4.17Å; L353-F355 PolarHBondContact O-N 3.1Å; F355-G357 PolarHBondContact O-N 2.94Å
356	L	94.8	Very high	95.7	Very high	58 Å²	58	62.6 Å²	62.6	30%	0.304	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-71	-14.1	176.5	-63.9	177.7	0	0	0	113.4	L353 K354 N358 L361 L365	L353-L356 HydrophobicContact CB-CD1 4.05Å; L353-L356 HydrophobicContact CD2-CD1 4.16Å; L353-L356 HydrophobicContact CG-CD1 4.48Å; L353-L356 WeakPolarHBondContact O-CB 3.47Å; L353-L356 WeakPolarHBondContact O-CG 3.43Å; L353-L356 PolarHBondContact O-N 3.49Å; K354-L356 PolarHBondContact O-N 3.31Å; L356-N358 PolarHBondContact O-N 3.43Å; L356-L361 HydrophobicContact CB-CD2 4.38Å; L356-L361 HydrophobicContact CD1-CD2 4.04Å; L356-L361 HydrophobicContact CD1-CG 4.11Å; L356-L365 HydrophobicContact CD1-CD1 3.57Å
357	G	95.3	Very high	95.7	Very high	78 Å²	78	61.5 Å²	61.5	80%	0.804	31%	0.31	S	S	*	.	S	Bend	trans	67	-1.4	179.4	0	0	0	0	0	115.5	K354 F355	K354-G357 PolarHBondContact O-N 3.13Å; K354-G357 VanDerWaalsContact O-N 3.16Å; F355-G357 PolarHBondContact O-N 2.94Å
358	N	95.5	Very high	95.8	Very high	79 Å²	79	64.2 Å²	64.2	42%	0.422	33%	0.326	S	S	.	.			trans	-125	115.1	-178.7	-175.2	-26.4	0	0	0	111.1	L356 E360 L361 S362	L356-N358 PolarHBondContact O-N 3.43Å; N358-E360 PolarHBondContact OD1-N 3.29Å; N358-L361 HydrophobicContact CB-CB 3.85Å; N358-L361 PolarHBondContact OD1-N 3.1Å; N358-L361 VanDerWaalsContact OD1-N 3.09Å; N358-S362 PolarHBondContact O-N 2.92Å; N358-S362 PolarHBondContact O-OG 2.83Å
359	K	93.6	Very high	95.9	Very high	137 Å²	137	64 Å²	64	60%	0.596	33%	0.325	S	S	*	.	H	α-helix	trans	-66	-39.8	-178.5	-173	178.3	174.2	176.5	0	112.5	F350 S362 Q363	F350-K359 HydrophobicContact CE2-CG 4.49Å; F350-K359 HydrophobicContact CZ-CG 3.96Å; K359-S362 PolarHBondContact O-N 3.48Å; K359-Q363 WeakPolarHBondContact O-CB 3.27Å; K359-Q363 PolarHBondContact O-N 2.96Å
360	E	93.8	Very high	96	Very high	62 Å²	62	62.7 Å²	62.7	29%	0.29	32%	0.32	S	S	.	.	H	α-helix	trans	-70.5	-40.3	-179.2	-60.1	-60.6	167.2	0	0	110.8	N358 S362 Q363 G364 F388 R395	N358-E360 PolarHBondContact OD1-N 3.29Å; E360-S362 PolarHBondContact O-N 3.31Å; E360-Q363 PolarHBondContact O-N 2.96Å; E360-G364 PolarHBondContact O-N 3.39Å; E360-F388 HydrophobicContact CB-CZ 4.44Å; E360-R395 IonicContact OE1-CZ 3.18Å; E360-R395 IonicContact OE1-NH2 2.69Å; E360-R395 PolarHBondContact OE1-NH2 3.34Å; E360-R395 IonicContact OE2-CZ 2.66Å; E360-R395 IonicContact OE2-NH2 2.8Å; E360-R395 PolarHBondContact OE2-NH2 3.43Å
361	L	95.9	Very high	96	Very high	83 Å²	83	60 Å²	60	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-44.5	172.6	-179.4	59.9	0	0	0	111.5	L356 N358 Q363 G364 L365	L356-L361 HydrophobicContact CB-CD2 4.38Å; L356-L361 HydrophobicContact CD1-CD2 4.04Å; L356-L361 HydrophobicContact CD1-CG 4.11Å; N358-L361 HydrophobicContact CB-CB 3.85Å; N358-L361 PolarHBondContact OD1-N 3.1Å; N358-L361 VanDerWaalsContact OD1-N 3.09Å; L361-Q363 VanDerWaalsContact C-N 3.3Å; L361-Q363 PolarHBondContact O-N 3.21Å; L361-G364 PolarHBondContact O-N 2.92Å; L361-L365 HydrophobicContact CD1-CD1 4.31Å; L361-L365 HydrophobicContact CD1-CG 4.3Å; L361-L365 HydrophobicContact CG-CD1 4.23Å; L361-L365 WeakPolarHBondContact O-CG 3.27Å; L361-L365 PolarHBondContact O-N 3.32Å
362	S	96.8	Very high	96.1	Very high	4 Å²	4	57.9 Å²	57.9	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-39.5	176.9	-56.8	0	0	0	0	111.7	L353 N358 K359 E360 S366	L353-S362 PolarHBondContact O-OG 2.87Å; N358-S362 PolarHBondContact O-N 2.92Å; N358-S362 PolarHBondContact O-OG 2.83Å; K359-S362 PolarHBondContact O-N 3.48Å; E360-S362 PolarHBondContact O-N 3.31Å; S362-S366 WeakPolarHBondContact O-CB 3.32Å; S362-S366 PolarHBondContact O-N 2.8Å; S362-S366 VanDerWaalsContact O-N 3.08Å; S362-S366 PolarHBondContact O-OG 3.31Å
363	Q	95.9	Very high	96.2	Very high	24 Å²	24	55.1 Å²	55.1	11%	0.112	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-47	176.2	-176.7	179.3	-15.5	0	0	111	F350 K359 E360 L361 L365 S366 L367 F388	F350-Q363 HydrophobicContact CE2-CB 4.02Å; K359-Q363 WeakPolarHBondContact O-CB 3.27Å; K359-Q363 PolarHBondContact O-N 2.96Å; E360-Q363 PolarHBondContact O-N 2.96Å; L361-Q363 VanDerWaalsContact C-N 3.3Å; L361-Q363 PolarHBondContact O-N 3.21Å; Q363-L365 PolarHBondContact O-N 2.86Å; Q363-S366 WeakPolarHBondContact O-CB 3.43Å; Q363-S366 PolarHBondContact O-N 3.21Å; Q363-S366 VanDerWaalsContact O-N 3.1Å; Q363-L367 HydrophobicContact CG-CD1 4.17Å; Q363-L367 WeakPolarHBondContact O-CG 3.38Å; Q363-L367 PolarHBondContact O-N 2.97Å; Q363-F388 HydrophobicContact CB-CE2 4.16Å; Q363-F388 HydrophobicContact CG-CD2 4.06Å; Q363-F388 HydrophobicContact CG-CE2 4.13Å
364	G	97.2	Very high	96.2	Very high	23 Å²	23	56 Å²	56	24%	0.237	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-44.2	177.9	0	0	0	0	0	112.5	E360 L361 S366 L367 L368	E360-G364 PolarHBondContact O-N 3.39Å; L361-G364 PolarHBondContact O-N 2.92Å; G364-S366 VanDerWaalsContact C-N 3.32Å; G364-S366 PolarHBondContact O-N 3.16Å; G364-L367 PolarHBondContact O-N 2.91Å; G364-L368 WeakPolarHBondContact O-CB 3.29Å; G364-L368 PolarHBondContact O-N 3.3Å
365	L	97.9	Very high	96.3	Very high	61 Å²	61	47.8 Å²	47.8	32%	0.319	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-35.6	174.7	-70.6	173.9	0	0	0	112.5	F349 L353 L356 L361 Q363 L368 F369	F349-L365 HydrophobicContact CE1-CB 4.15Å; F349-L365 WeakPolarHBondContact CE1-O 3.24Å; L353-L365 HydrophobicContact CD1-CB 3.71Å; L353-L365 HydrophobicContact CD1-CD1 3.94Å; L356-L365 HydrophobicContact CD1-CD1 3.57Å; L361-L365 HydrophobicContact CD1-CD1 4.31Å; L361-L365 HydrophobicContact CD1-CG 4.3Å; L361-L365 HydrophobicContact CG-CD1 4.23Å; L361-L365 WeakPolarHBondContact O-CG 3.27Å; L361-L365 PolarHBondContact O-N 3.32Å; Q363-L365 PolarHBondContact O-N 2.86Å; L365-L368 PolarHBondContact O-N 2.84Å; L365-F369 WeakPolarHBondContact O-CB 3.24Å; L365-F369 PolarHBondContact O-N 3Å
366	S	97.8	Very high	96.3	Very high	7 Å²	7	43.9 Å²	43.9	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-39.3	177.2	-57.4	0	0	0	0	112.1	F350 S362 Q363 G364 F369 L370	F350-S366 WeakPolarHBondContact CA-OG 3.49Å; F350-S366 WeakPolarHBondContact CB-OG 3.41Å; S362-S366 WeakPolarHBondContact O-CB 3.32Å; S362-S366 PolarHBondContact O-N 2.8Å; S362-S366 VanDerWaalsContact O-N 3.08Å; S362-S366 PolarHBondContact O-OG 3.31Å; Q363-S366 WeakPolarHBondContact O-CB 3.43Å; Q363-S366 PolarHBondContact O-N 3.21Å; Q363-S366 VanDerWaalsContact O-N 3.1Å; G364-S366 VanDerWaalsContact C-N 3.32Å; G364-S366 PolarHBondContact O-N 3.16Å; S366-F369 WeakPolarHBondContact O-CB 3.08Å; S366-F369 PolarHBondContact O-N 2.9Å; S366-L370 PolarHBondContact O-N 3.48Å
367	L	97.6	Very high	96.3	Very high	11 Å²	11	43.1 Å²	43.1	6%	0.058	24%	0.241	C	C	.	.	H	α-helix	trans	-72.7	-35.4	175.9	-67.3	174	0	0	0	111.9	Q363 G364 L370 A371 F384 E387 F388	Q363-L367 HydrophobicContact CG-CD1 4.17Å; Q363-L367 WeakPolarHBondContact O-CG 3.38Å; Q363-L367 PolarHBondContact O-N 2.97Å; G364-L367 PolarHBondContact O-N 2.91Å; L367-L370 HydrophobicContact CD2-CD1 4.24Å; L367-L370 PolarHBondContact O-N 3.06Å; L367-A371 WeakPolarHBondContact O-CB 3.38Å; L367-A371 PolarHBondContact O-N 2.97Å; L367-F384 HydrophobicContact CB-CB 4.31Å; L367-F384 HydrophobicContact CD2-CD1 3.96Å; L367-E387 VanDerWaalsContact CD2-CD 3.48Å; L367-E387 HydrophobicContact CD2-CG 4.28Å; L367-E387 WeakPolarHBondContact CD2-OE1 3.3Å; L367-F388 HydrophobicContact CD1-CB 3.53Å; L367-F388 HydrophobicContact CD1-CD2 3.8Å; L367-F388 HydrophobicContact CD1-CG 4.12Å
368	L	97.9	Very high	96.4	Very high	80 Å²	80	41.2 Å²	41.2	42%	0.419	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-43.4	170.6	178.9	61.2	0	0	0	111.4	G364 L365 L370 A371 L372 L381	G364-L368 WeakPolarHBondContact O-CB 3.29Å; G364-L368 PolarHBondContact O-N 3.3Å; L365-L368 PolarHBondContact O-N 2.84Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L368-L370 PolarHBondContact O-N 3.04Å; L368-A371 PolarHBondContact O-N 3.35Å; L368-L372 HydrophobicContact CD1-CD1 4.33Å; L368-L372 HydrophobicContact CD1-CG 4.36Å; L368-L372 HydrophobicContact CG-CD1 4.26Å; L368-L372 WeakPolarHBondContact O-CG 3.3Å; L368-L372 PolarHBondContact O-N 3.21Å; L368-L381 HydrophobicContact CD1-CD2 3.84Å
369	F	97.9	Very high	96.4	Very high	9 Å²	9	37.4 Å²	37.4	4%	0.039	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-47.1	173	168.3	-92.1	0	0	0	111.3	F118 M122 L150 W344 V345 F349 L365 S366 A371 L372 W373	F118-F369 HydrophobicContact CE2-CD2 4.21Å; F118-F369 AromaticContact CE2-CE2 3.77Å; F118-F369 HydrophobicContact CE2-CE2 3.77Å; F118-F369 AromaticContact CZ-CD2 3.87Å; F118-F369 HydrophobicContact CZ-CD2 3.87Å; F118-F369 AromaticContact CZ-CE2 3.78Å; F118-F369 HydrophobicContact CZ-CE2 3.78Å; M122-F369 HydrophobicContact CE-CD2 4.38Å; M122-F369 HydrophobicContact CE-CE2 3.97Å; M122-F369 HydrophobicContact CG-CE2 4.39Å; M122-F369 HydrophobicContact SD-CE2 3.68Å; M122-F369 HydrophobicContact SD-CZ 4.2Å; L150-F369 HydrophobicContact CD2-CE1 4.11Å; L150-F369 HydrophobicContact CD2-CZ 3.81Å; W344-F369 HydrophobicContact CE3-CE1 4.33Å; W344-F369 HydrophobicContact CH2-CE1 4.33Å; W344-F369 AromaticContact CH2-CZ 3.9Å; W344-F369 HydrophobicContact CH2-CZ 3.9Å; W344-F369 AromaticContact CZ3-CE1 3.54Å; W344-F369 HydrophobicContact CZ3-CE1 3.54Å; W344-F369 AromaticContact CZ3-CZ 3.59Å; W344-F369 HydrophobicContact CZ3-CZ 3.59Å; V345-F369 HydrophobicContact CG2-CD1 4.21Å; V345-F369 HydrophobicContact CG2-CE1 4.09Å; F349-F369 HydrophobicContact CD1-CB 4.26Å; F349-F369 HydrophobicContact CD2-CB 4.46Å; F349-F369 HydrophobicContact CD2-CD2 4.05Å; F349-F369 HydrophobicContact CD2-CE2 4.49Å; F349-F369 HydrophobicContact CD2-CG 4.07Å; F349-F369 HydrophobicContact CE1-CB 3.83Å; F349-F369 HydrophobicContact CE1-CG 4.45Å; F349-F369 HydrophobicContact CE2-CB 4.06Å; F349-F369 AromaticContact CE2-CD2 3.76Å; F349-F369 HydrophobicContact CE2-CD2 3.76Å; F349-F369 HydrophobicContact CE2-CE2 4.48Å; F349-F369 AromaticContact CE2-CG 3.97Å; F349-F369 HydrophobicContact CE2-CG 3.97Å; F349-F369 HydrophobicContact CG-CG 4.38Å; F349-F369 HydrophobicContact CZ-CB 3.73Å; F349-F369 HydrophobicContact CZ-CD2 4.25Å; F349-F369 HydrophobicContact CZ-CG 4.16Å; L365-F369 WeakPolarHBondContact O-CB 3.24Å; L365-F369 PolarHBondContact O-N 3Å; S366-F369 WeakPolarHBondContact O-CB 3.08Å; S366-F369 PolarHBondContact O-N 2.9Å; F369-A371 PolarHBondContact O-N 3.39Å; F369-L372 PolarHBondContact O-N 3.47Å; F369-W373 HydrophobicContact CE1-CB 4.4Å; F369-W373 HydrophobicContact CZ-CB 4.5Å; F369-W373 VanDerWaalsContact O-CB 3.24Å; F369-W373 WeakPolarHBondContact O-CB 3.16Å; F369-W373 PolarHBondContact O-N 2.94Å
370	L	97.6	Very high	96.6	Very high	9 Å²	9	32.1 Å²	32.1	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-60.8	-42.8	176.8	-82.4	168.4	0	0	0	112.3	T341 V345 S366 L367 L368 L372 W373 H374 F384	T341-L370 HydrophobicContact CG2-CD2 4.18Å; V345-L370 HydrophobicContact CG1-CD1 4.34Å; V345-L370 HydrophobicContact CG1-CG 4.49Å; V345-L370 HydrophobicContact CG2-CD1 4.24Å; V345-L370 HydrophobicContact CG2-CD2 3.71Å; V345-L370 HydrophobicContact CG2-CG 3.9Å; S366-L370 PolarHBondContact O-N 3.48Å; L367-L370 HydrophobicContact CD2-CD1 4.24Å; L367-L370 PolarHBondContact O-N 3.06Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L368-L370 PolarHBondContact O-N 3.04Å; L370-L372 PolarHBondContact O-N 2.94Å; L370-W373 HydrophobicContact CD2-CE3 4.13Å; L370-W373 PolarHBondContact O-N 2.84Å; L370-H374 PolarHBondContact O-CD2 3.48Å; L370-H374 PolarHBondContact O-N 2.86Å; L370-F384 HydrophobicContact CB-CD1 4.08Å; L370-F384 HydrophobicContact CB-CE1 3.72Å; L370-F384 HydrophobicContact CB-CE2 4.31Å; L370-F384 HydrophobicContact CB-CZ 3.86Å; L370-F384 HydrophobicContact CD1-CE1 4.13Å; L370-F384 HydrophobicContact CG-CE1 4.47Å
371	A	97.5	Very high	96.8	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-58.7	-48.7	176.7	0	0	0	0	0	111.9	L367 L368 F369 H374 G375 L381 F384	L367-A371 WeakPolarHBondContact O-CB 3.38Å; L367-A371 PolarHBondContact O-N 2.97Å; L368-A371 PolarHBondContact O-N 3.35Å; F369-A371 PolarHBondContact O-N 3.39Å; A371-H374 PolarHBondContact O-N 2.91Å; A371-G375 PolarHBondContact O-N 3.1Å; A371-G375 VanDerWaalsContact O-N 3.09Å; A371-G375 VanDerWaalsContact O-O 3.09Å; A371-L381 HydrophobicContact CB-CD2 3.81Å; A371-F384 HydrophobicContact CB-CB 4.08Å; A371-F384 HydrophobicContact CB-CD2 3.51Å; A371-F384 HydrophobicContact CB-CE2 4.34Å; A371-F384 HydrophobicContact CB-CG 4.07Å
372	L	97.4	Very high	96.9	Very high	61 Å²	61	29.9 Å²	29.9	32%	0.319	16%	0.162	S	C	.	.	H	α-helix	trans	-66.9	-37.5	177.9	-66.3	173.8	0	0	0	112.2	L126 L368 F369 L370 H374 G375	L126-L372 HydrophobicContact CD2-CB 4.49Å; L126-L372 WeakPolarHBondContact CD2-O 3.43Å; L368-L372 HydrophobicContact CD1-CD1 4.33Å; L368-L372 HydrophobicContact CD1-CG 4.36Å; L368-L372 HydrophobicContact CG-CD1 4.26Å; L368-L372 WeakPolarHBondContact O-CG 3.3Å; L368-L372 PolarHBondContact O-N 3.21Å; F369-L372 PolarHBondContact O-N 3.47Å; L370-L372 PolarHBondContact O-N 2.94Å; L372-H374 VanDerWaalsContact C-N 3.29Å; L372-H374 PolarHBondContact O-N 3.4Å; L372-G375 PolarHBondContact O-N 3.17Å
373	W	97.6	Very high	96.9	Very high	10 Å²	10	30.2 Å²	30.2	4%	0.038	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-34.3	175.8	173.4	76.5	0	0	0	112.4	M122 Y129 C146 L150 T341 F369 L370	M122-W373 HydrophobicContact CE-CB 4.42Å; Y129-W373 VanDerWaalsContact CE2-O 3.27Å; Y129-W373 WeakPolarHBondContact CE2-O 3.16Å; Y129-W373 PolarHBondContact OH-O 3.46Å; C146-W373 HydrophobicContact CB-CZ2 3.85Å; C146-W373 PolarHBondContact O-NE1 3.4Å; C146-W373 WeakPolarHBondContact SG-CZ2 3.45Å; L150-W373 HydrophobicContact CD1-CD2 4.49Å; L150-W373 HydrophobicContact CD1-CH2 4.38Å; L150-W373 HydrophobicContact CD1-CZ2 3.66Å; L150-W373 HydrophobicContact CD2-CG 4.35Å; L150-W373 HydrophobicContact CG-CZ2 4.2Å; T341-W373 HydrophobicContact CG2-CH2 4.14Å; T341-W373 HydrophobicContact CG2-CZ3 4.14Å; F369-W373 HydrophobicContact CE1-CB 4.4Å; F369-W373 HydrophobicContact CZ-CB 4.5Å; F369-W373 VanDerWaalsContact O-CB 3.24Å; F369-W373 WeakPolarHBondContact O-CB 3.16Å; F369-W373 PolarHBondContact O-N 2.94Å; L370-W373 HydrophobicContact CD2-CE3 4.13Å; L370-W373 PolarHBondContact O-N 2.84Å
374	H	95.3	Very high	97	Very high	42 Å²	42	29.9 Å²	29.9	19%	0.194	16%	0.163	C	C	.	.	H	α-helix	trans	-72.3	-35.3	172.9	-86.9	-72.4	0	0	0	113.2	L370 A371 L372 Y380 F384 F439	L370-H374 PolarHBondContact O-CD2 3.48Å; L370-H374 PolarHBondContact O-N 2.86Å; A371-H374 PolarHBondContact O-N 2.91Å; L372-H374 VanDerWaalsContact C-N 3.29Å; L372-H374 PolarHBondContact O-N 3.4Å; H374-Y380 HydrophobicContact CB-CD1 3.86Å; H374-Y380 HydrophobicContact CB-CD2 4.18Å; H374-Y380 HydrophobicContact CB-CE1 4.07Å; H374-Y380 HydrophobicContact CB-CE2 4.36Å; H374-Y380 HydrophobicContact CB-CG 3.91Å; H374-Y380 WeakPolarHBondContact O-CE2 3.27Å; H374-F384 HydrophobicContact CB-CE2 4.42Å; H374-F384 AromaticContact CD2-CE2 3.38Å; H374-F384 WeakPolarHBondContact CD2-CE2 3.45Å; H374-F384 AromaticContact CD2-CZ 3.3Å; H374-F384 WeakPolarHBondContact CD2-CZ 3.34Å; H374-F384 AromaticContact NE2-CZ 3.65Å; H374-F439 HydrophobicContact CB-CE2 4.46Å; H374-F439 AromaticContact CE1-CZ 3.7Å; H374-F439 AromaticContact CG-CE2 3.93Å; H374-F439 AromaticContact ND1-CE2 3.88Å; H374-F439 AromaticContact ND1-CZ 3.56Å
375	G	94.8	Very high	97	Very high	3 Å²	3	34 Å²	34	3%	0.031	18%	0.176	C	C	.	.			trans	156.3	-170.8	170.5	0	0	0	0	0	114.9	A371 L372	A371-G375 PolarHBondContact O-N 3.1Å; A371-G375 VanDerWaalsContact O-N 3.09Å; A371-G375 VanDerWaalsContact O-O 3.09Å; L372-G375 PolarHBondContact O-N 3.17Å
376	L	94.5	Very high	97	Very high	80 Å²	80	31.1 Å²	31.1	42%	0.419	16%	0.161	S	C	.	.	S	Bend	trans	-95.1	-3.9	-175.4	-64.1	177.5	0	0	0	114	L126 Y130	L126-L376 HydrophobicContact CD2-CD2 3.84Å; L126-L376 HydrophobicContact CD2-CG 4.37Å; Y130-L376 HydrophobicContact CD2-CD1 4.42Å
377	H	94.9	Very high	97	Very high	41 Å²	41	32.9 Å²	32.9	19%	0.19	17%	0.168	C	C	.	.	S	Bend	trans	-70.8	141.1	178.8	-72.2	-63.4	0	0	0	111.9	T134 G379 Y380 F442	T134-H377 PolarHBondContact O-CE1 3.41Å; T134-H377 VanDerWaalsContact O-CE1 3.31Å; T134-H377 PolarHBondContact O-NE2 3.44Å; T134-H377 VanDerWaalsContact O-NE2 3.11Å; H377-G379 PolarHBondContact O-N 3.02Å; H377-Y380 HydrophobicContact CB-CD2 4Å; H377-Y380 HydrophobicContact CB-CE2 4.08Å; H377-Y380 PolarHBondContact O-N 3.26Å; H377-F442 HydrophobicContact CB-CB 3.93Å; H377-F442 WeakPolarHBondContact CB-O 3.38Å
378	S	96.3	Very high	97	Very high	38 Å²	38	35.1 Å²	35.1	27%	0.266	18%	0.177	S	C	.	.	H	α-helix	trans	-60.2	-30.1	-178.3	59.3	0	0	0	0	112.8	Y380 L381 V382 W444 W447	S378-Y380 VanDerWaalsContact C-N 3.27Å; S378-Y380 PolarHBondContact O-N 3.21Å; S378-L381 PolarHBondContact O-N 3.48Å; S378-V382 WeakPolarHBondContact O-CG2 3.24Å; S378-V382 PolarHBondContact O-N 3.27Å; S378-V382 VanDerWaalsContact O-N 3.1Å; S378-W444 PolarHBondContact OG-N 3.37Å; S378-W447 PolarHBondContact OG-NE1 3.26Å; S378-W447 VanDerWaalsContact OG-NE1 3.1Å
379	G	96.8	Very high	97	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-54.8	-38.9	176.9	0	0	0	0	0	114.3	H377 V382 C383 A438 F442	H377-G379 PolarHBondContact O-N 3.02Å; G379-V382 PolarHBondContact O-N 2.67Å; G379-C383 WeakPolarHBondContact O-CB 3.41Å; G379-C383 PolarHBondContact O-N 3.04Å; G379-A438 CarbonylContact C-O 3.56Å; G379-A438 WeakPolarHBondContact CA-O 3.42Å; G379-A438 CarbonylContact O-C 3.59Å; G379-F442 WeakPolarHBondContact CA-O 3.37Å; G379-F442 PolarHBondContact N-O 3.45Å
380	Y	97.1	Very high	96.9	Very high	26 Å²	26	31.8 Å²	31.8	10%	0.102	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-46.8	177	-61	-48.6	0	0	0	111.5	H374 H377 S378 V382 C383 F384 F439 F442	H374-Y380 HydrophobicContact CB-CD1 3.86Å; H374-Y380 HydrophobicContact CB-CD2 4.18Å; H374-Y380 HydrophobicContact CB-CE1 4.07Å; H374-Y380 HydrophobicContact CB-CE2 4.36Å; H374-Y380 HydrophobicContact CB-CG 3.91Å; H374-Y380 WeakPolarHBondContact O-CE2 3.27Å; H377-Y380 HydrophobicContact CB-CD2 4Å; H377-Y380 HydrophobicContact CB-CE2 4.08Å; H377-Y380 PolarHBondContact O-N 3.26Å; S378-Y380 VanDerWaalsContact C-N 3.27Å; S378-Y380 PolarHBondContact O-N 3.21Å; Y380-V382 VanDerWaalsContact C-N 3.3Å; Y380-V382 PolarHBondContact O-N 3.08Å; Y380-C383 PolarHBondContact O-N 3.06Å; Y380-F384 WeakPolarHBondContact O-CD2 3.42Å; Y380-F384 PolarHBondContact O-N 3.48Å; Y380-F439 HydrophobicContact CD1-CD1 4.49Å; Y380-F439 AromaticContact CD1-CD2 3.52Å; Y380-F439 HydrophobicContact CD1-CD2 3.52Å; Y380-F439 HydrophobicContact CD1-CE1 4.47Å; Y380-F439 AromaticContact CD1-CE2 3.49Å; Y380-F439 HydrophobicContact CD1-CE2 3.49Å; Y380-F439 VanDerWaalsContact CD1-CE2 3.49Å; Y380-F439 HydrophobicContact CD1-CG 4.04Å; Y380-F439 AromaticContact CD1-CZ 3.99Å; Y380-F439 HydrophobicContact CD1-CZ 3.99Å; Y380-F439 HydrophobicContact CE1-CD1 4.15Å; Y380-F439 AromaticContact CE1-CD2 3.95Å; Y380-F439 HydrophobicContact CE1-CD2 3.95Å; Y380-F439 AromaticContact CE1-CE1 3.92Å; Y380-F439 HydrophobicContact CE1-CE1 3.92Å; Y380-F439 AromaticContact CE1-CE2 3.69Å; Y380-F439 HydrophobicContact CE1-CE2 3.69Å; Y380-F439 HydrophobicContact CE1-CG 4.16Å; Y380-F439 AromaticContact CE1-CZ 3.67Å; Y380-F439 HydrophobicContact CE1-CZ 3.67Å; Y380-F442 HydrophobicContact CE1-CD1 4.15Å; Y380-F442 HydrophobicContact CE1-CE1 4.03Å; Y380-F442 HydrophobicContact CE2-CD1 4.35Å; Y380-F442 AromaticContact CZ-CD1 3.78Å; Y380-F442 AromaticContact CZ-CE1 3.75Å; Y380-F442 WeakPolarHBondContact OH-CE1 3.48Å
381	L	97.4	Very high	96.9	Very high	77 Å²	77	31.7 Å²	31.7	40%	0.403	16%	0.16	S	C	.	.	H	α-helix	trans	-58.4	-43.1	177.9	-67.3	169.9	0	0	0	111.6	L368 A371 S378 Q385	L368-L381 HydrophobicContact CD1-CD2 3.84Å; A371-L381 HydrophobicContact CB-CD2 3.81Å; S378-L381 PolarHBondContact O-N 3.48Å; L381-Q385 WeakPolarHBondContact O-CB 3.47Å; L381-Q385 PolarHBondContact O-N 3.28Å
382	V	97.9	Very high	96.8	Very high	20 Å²	20	32.8 Å²	32.8	12%	0.121	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-42.3	178.8	174.3	0	0	0	0	111.5	S378 G379 Y380 Q385 M386 A438 W447 Y451	S378-V382 WeakPolarHBondContact O-CG2 3.24Å; S378-V382 PolarHBondContact O-N 3.27Å; S378-V382 VanDerWaalsContact O-N 3.1Å; G379-V382 PolarHBondContact O-N 2.67Å; Y380-V382 VanDerWaalsContact C-N 3.3Å; Y380-V382 PolarHBondContact O-N 3.08Å; V382-Q385 PolarHBondContact O-N 3.42Å; V382-M386 WeakPolarHBondContact O-CG 3.47Å; V382-M386 PolarHBondContact O-N 3Å; V382-A438 HydrophobicContact CB-CB 3.85Å; V382-A438 HydrophobicContact CG1-CB 3.68Å; V382-W447 HydrophobicContact CG2-CH2 3.87Å; V382-W447 HydrophobicContact CG2-CZ2 3.72Å; V382-Y451 HydrophobicContact CG1-CE2 3.82Å
383	C	97.6	Very high	96.8	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-60.3	-50.1	177.1	-179	0	0	0	0	112	G379 Y380 Q385 M386 E387 F439	G379-C383 WeakPolarHBondContact O-CB 3.41Å; G379-C383 PolarHBondContact O-N 3.04Å; Y380-C383 PolarHBondContact O-N 3.06Å; C383-Q385 VanDerWaalsContact C-N 3.34Å; C383-Q385 PolarHBondContact O-N 3.19Å; C383-M386 WeakPolarHBondContact O-CB 3.39Å; C383-M386 PolarHBondContact O-N 3.32Å; C383-E387 PolarHBondContact O-N 2.8Å; C383-F439 HydrophobicContact CB-CB 3.85Å; C383-F439 HydrophobicContact CB-CD2 4.03Å; C383-F439 HydrophobicContact CB-CG 4.45Å
384	F	97.6	Very high	96.8	Very high	18 Å²	18	31.1 Å²	31.1	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-72.3	-27.5	-179.5	-74.6	-69.6	0	0	0	113	L367 L370 A371 H374 Y380 E387 F388 F439	L367-F384 HydrophobicContact CB-CB 4.31Å; L367-F384 HydrophobicContact CD2-CD1 3.96Å; L370-F384 HydrophobicContact CB-CD1 4.08Å; L370-F384 HydrophobicContact CB-CE1 3.72Å; L370-F384 HydrophobicContact CB-CE2 4.31Å; L370-F384 HydrophobicContact CB-CZ 3.86Å; L370-F384 HydrophobicContact CD1-CE1 4.13Å; L370-F384 HydrophobicContact CG-CE1 4.47Å; A371-F384 HydrophobicContact CB-CB 4.08Å; A371-F384 HydrophobicContact CB-CD2 3.51Å; A371-F384 HydrophobicContact CB-CE2 4.34Å; A371-F384 HydrophobicContact CB-CG 4.07Å; H374-F384 HydrophobicContact CB-CE2 4.42Å; H374-F384 AromaticContact CD2-CE2 3.38Å; H374-F384 WeakPolarHBondContact CD2-CE2 3.45Å; H374-F384 AromaticContact CD2-CZ 3.3Å; H374-F384 WeakPolarHBondContact CD2-CZ 3.34Å; H374-F384 AromaticContact NE2-CZ 3.65Å; Y380-F384 WeakPolarHBondContact O-CD2 3.42Å; Y380-F384 PolarHBondContact O-N 3.48Å; F384-E387 WeakPolarHBondContact CD1-OE2 3.49Å; F384-E387 PolarHBondContact O-N 2.8Å; F384-F388 PolarHBondContact O-N 2.86Å; F384-F439 HydrophobicContact CE2-CE2 4.15Å; F384-F439 HydrophobicContact CZ-CE2 4.46Å
385	Q	97.4	Very high	96.8	Very high	110 Å²	110	31.8 Å²	31.8	51%	0.514	16%	0.157	S	C	.	.	H	α-helix	trans	-63.1	-46.2	167.6	177.7	-172.8	83.6	0	0	111.1	L381 V382 C383 E387 F388 L389	L381-Q385 WeakPolarHBondContact O-CB 3.47Å; L381-Q385 PolarHBondContact O-N 3.28Å; V382-Q385 PolarHBondContact O-N 3.42Å; C383-Q385 VanDerWaalsContact C-N 3.34Å; C383-Q385 PolarHBondContact O-N 3.19Å; Q385-E387 VanDerWaalsContact C-N 3.34Å; Q385-F388 WeakPolarHBondContact O-CB 3.24Å; Q385-F388 PolarHBondContact O-N 3.41Å; Q385-L389 PolarHBondContact O-N 3.46Å
386	M	97.9	Very high	96.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-43	175.6	-75.2	-57.8	-58.3	0	0	111	V382 C383 F388 L389 I390 Y434 S435 H459 F462	V382-M386 WeakPolarHBondContact O-CG 3.47Å; V382-M386 PolarHBondContact O-N 3Å; C383-M386 WeakPolarHBondContact O-CB 3.39Å; C383-M386 PolarHBondContact O-N 3.32Å; M386-F388 VanDerWaalsContact C-N 3.32Å; M386-F388 PolarHBondContact O-N 3.34Å; M386-L389 PolarHBondContact O-N 3.44Å; M386-L389 HydrophobicContact SD-CD2 4.35Å; M386-I390 HydrophobicContact CB-CD1 4.36Å; M386-I390 HydrophobicContact CE-CD1 4.09Å; M386-I390 HydrophobicContact CE-CG1 4.24Å; M386-I390 VanDerWaalsContact O-CB 3.29Å; M386-I390 WeakPolarHBondContact O-CB 3.41Å; M386-I390 WeakPolarHBondContact O-CD1 3.48Å; M386-I390 WeakPolarHBondContact O-CG1 3.34Å; M386-I390 PolarHBondContact O-N 2.85Å; M386-Y434 HydrophobicContact CE-CD1 4.02Å; M386-Y434 HydrophobicContact CE-CE1 4.04Å; M386-Y434 HydrophobicContact CG-CE1 4.41Å; M386-Y434 HydrophobicContact SD-CE1 4.2Å; M386-S435 WeakPolarHBondContact CB-OG 3.44Å; M386-H459 VanDerWaalsContact SD-CE1 3.58Å; M386-H459 PolarHBondContact SD-NE2 3.33Å; M386-F462 HydrophobicContact CE-CD2 3.87Å
387	E	97.4	Very high	96.9	Very high	44 Å²	44	31 Å²	31	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-54.8	-47.7	173.5	-174.1	-175.6	156.4	0	0	111.7	I334 L367 C383 F384 Q385 L389 I390 V391	I334-E387 HydrophobicContact CD1-CG 4.07Å; I334-E387 WeakPolarHBondContact CD1-OE1 3.17Å; L367-E387 VanDerWaalsContact CD2-CD 3.48Å; L367-E387 HydrophobicContact CD2-CG 4.28Å; L367-E387 WeakPolarHBondContact CD2-OE1 3.3Å; C383-E387 PolarHBondContact O-N 2.8Å; F384-E387 WeakPolarHBondContact CD1-OE2 3.49Å; F384-E387 PolarHBondContact O-N 2.8Å; Q385-E387 VanDerWaalsContact C-N 3.34Å; E387-L389 PolarHBondContact O-N 3.48Å; E387-I390 PolarHBondContact O-N 2.88Å; E387-V391 HydrophobicContact CG-CG2 4.31Å; E387-V391 WeakPolarHBondContact O-CB 3.35Å; E387-V391 VanDerWaalsContact O-CG2 3.24Å; E387-V391 WeakPolarHBondContact O-CG2 3.28Å; E387-V391 PolarHBondContact O-N 3.01Å
388	F	97.3	Very high	96.8	Very high	57 Å²	57	30.5 Å²	30.5	25%	0.25	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-50	178.3	-174.4	-119.1	0	0	0	112	E360 Q363 L367 F384 Q385 M386 V391 I392	E360-F388 HydrophobicContact CB-CZ 4.44Å; Q363-F388 HydrophobicContact CB-CE2 4.16Å; Q363-F388 HydrophobicContact CG-CD2 4.06Å; Q363-F388 HydrophobicContact CG-CE2 4.13Å; L367-F388 HydrophobicContact CD1-CB 3.53Å; L367-F388 HydrophobicContact CD1-CD2 3.8Å; L367-F388 HydrophobicContact CD1-CG 4.12Å; F384-F388 PolarHBondContact O-N 2.86Å; Q385-F388 WeakPolarHBondContact O-CB 3.24Å; Q385-F388 PolarHBondContact O-N 3.41Å; M386-F388 VanDerWaalsContact C-N 3.32Å; M386-F388 PolarHBondContact O-N 3.34Å; F388-V391 PolarHBondContact O-N 2.83Å; F388-I392 HydrophobicContact CD1-CD1 3.89Å; F388-I392 HydrophobicContact CD2-CD1 4.23Å; F388-I392 HydrophobicContact CE1-CD1 3.5Å; F388-I392 VanDerWaalsContact CE1-CD1 3.5Å; F388-I392 HydrophobicContact CE2-CD1 3.86Å; F388-I392 HydrophobicContact CG-CD1 4.26Å; F388-I392 HydrophobicContact CZ-CD1 3.5Å; F388-I392 VanDerWaalsContact CZ-CD1 3.5Å; F388-I392 WeakPolarHBondContact O-CG1 3.39Å; F388-I392 PolarHBondContact O-N 2.95Å; F388-I392 VanDerWaalsContact O-N 3.09Å
389	L	97.8	Very high	96.7	Very high	17 Å²	17	33.9 Å²	33.9	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-48.6	-179.3	176.5	61.5	0	0	0	111.4	Q385 M386 E387 V391 I392 V393 F462 L463 L466	Q385-L389 PolarHBondContact O-N 3.46Å; M386-L389 PolarHBondContact O-N 3.44Å; M386-L389 HydrophobicContact SD-CD2 4.35Å; E387-L389 PolarHBondContact O-N 3.48Å; L389-V391 PolarHBondContact O-N 3.5Å; L389-I392 PolarHBondContact O-N 3.38Å; L389-V393 HydrophobicContact CD1-CG2 4.36Å; L389-V393 WeakPolarHBondContact O-CG2 3.44Å; L389-V393 PolarHBondContact O-N 3.05Å; L389-F462 HydrophobicContact CD1-CB 4.41Å; L389-F462 HydrophobicContact CD2-CB 3.56Å; L389-F462 HydrophobicContact CG-CB 3.7Å; L389-L463 HydrophobicContact CD1-CD2 4.18Å; L389-L463 HydrophobicContact CD2-CD2 3.99Å; L389-L463 HydrophobicContact CD2-CG 4.05Å; L389-L466 HydrophobicContact CD1-CB 4.17Å; L389-L466 HydrophobicContact CD1-CD2 3.79Å; L389-L466 HydrophobicContact CD1-CG 4.39Å
390	I	97.6	Very high	96.6	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-45.8	-179.4	-68	171.3	0	0	0	110.6	F330 M386 E387 I392 V393 E394 F431 F462	F330-I390 HydrophobicContact CB-CG2 3.87Å; F330-I390 HydrophobicContact CD1-CD1 4.36Å; F330-I390 HydrophobicContact CD1-CG2 3.58Å; F330-I390 HydrophobicContact CD2-CG2 3.33Å; F330-I390 HydrophobicContact CE1-CD1 4.08Å; F330-I390 HydrophobicContact CE1-CG2 3.92Å; F330-I390 HydrophobicContact CE2-CG2 3.69Å; F330-I390 HydrophobicContact CG-CG2 3.29Å; F330-I390 HydrophobicContact CZ-CG2 3.98Å; M386-I390 HydrophobicContact CB-CD1 4.36Å; M386-I390 HydrophobicContact CE-CD1 4.09Å; M386-I390 HydrophobicContact CE-CG1 4.24Å; M386-I390 VanDerWaalsContact O-CB 3.29Å; M386-I390 WeakPolarHBondContact O-CB 3.41Å; M386-I390 WeakPolarHBondContact O-CD1 3.48Å; M386-I390 WeakPolarHBondContact O-CG1 3.34Å; M386-I390 PolarHBondContact O-N 2.85Å; E387-I390 PolarHBondContact O-N 2.88Å; I390-I392 VanDerWaalsContact C-N 3.34Å; I390-I392 PolarHBondContact O-N 3.36Å; I390-V393 PolarHBondContact O-N 2.93Å; I390-E394 VanDerWaalsContact O-CB 3.31Å; I390-E394 WeakPolarHBondContact O-CB 3.48Å; I390-E394 PolarHBondContact O-N 3.15Å; I390-F431 HydrophobicContact CD1-CB 4.38Å; I390-F462 HydrophobicContact CB-CD1 4.45Å; I390-F462 HydrophobicContact CB-CE1 4.18Å; I390-F462 HydrophobicContact CB-CZ 4.31Å; I390-F462 HydrophobicContact CD1-CD2 4.3Å; I390-F462 HydrophobicContact CD1-CE2 3.84Å; I390-F462 HydrophobicContact CD1-CZ 4.11Å; I390-F462 HydrophobicContact CG1-CD1 3.97Å; I390-F462 HydrophobicContact CG1-CD2 3.7Å; I390-F462 HydrophobicContact CG1-CE1 3.81Å; I390-F462 HydrophobicContact CG1-CE2 3.52Å; I390-F462 HydrophobicContact CG1-CG 3.94Å; I390-F462 HydrophobicContact CG1-CZ 3.6Å; I390-F462 HydrophobicContact CG2-CE1 3.96Å; I390-F462 HydrophobicContact CG2-CZ 4.01Å
391	V	96.1	Very high	96.5	Very high	6 Å²	6	36.5 Å²	36.5	4%	0.036	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-37.7	-179.9	170	0	0	0	0	111.5	I334 E387 F388 L389 R395	I334-V391 HydrophobicContact CD1-CG2 3.66Å; E387-V391 HydrophobicContact CG-CG2 4.31Å; E387-V391 WeakPolarHBondContact O-CB 3.35Å; E387-V391 VanDerWaalsContact O-CG2 3.24Å; E387-V391 WeakPolarHBondContact O-CG2 3.28Å; E387-V391 PolarHBondContact O-N 3.01Å; F388-V391 PolarHBondContact O-N 2.83Å; L389-V391 PolarHBondContact O-N 3.5Å; V391-R395 VanDerWaalsContact CG1-NH1 3.34Å; V391-R395 VanDerWaalsContact O-CG 3.31Å; V391-R395 WeakPolarHBondContact O-CG 3.27Å; V391-R395 PolarHBondContact O-N 3.15Å; V391-R395 VanDerWaalsContact O-N 3.08Å
392	I	96.3	Very high	96.2	Very high	25 Å²	25	39.4 Å²	39.4	13%	0.128	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-49.7	174	-71.4	168.6	0	0	0	110.4	F388 L389 I390 R395 Q396 L466	F388-I392 HydrophobicContact CD1-CD1 3.89Å; F388-I392 HydrophobicContact CD2-CD1 4.23Å; F388-I392 HydrophobicContact CE1-CD1 3.5Å; F388-I392 VanDerWaalsContact CE1-CD1 3.5Å; F388-I392 HydrophobicContact CE2-CD1 3.86Å; F388-I392 HydrophobicContact CG-CD1 4.26Å; F388-I392 HydrophobicContact CZ-CD1 3.5Å; F388-I392 VanDerWaalsContact CZ-CD1 3.5Å; F388-I392 WeakPolarHBondContact O-CG1 3.39Å; F388-I392 PolarHBondContact O-N 2.95Å; F388-I392 VanDerWaalsContact O-N 3.09Å; L389-I392 PolarHBondContact O-N 3.38Å; I390-I392 VanDerWaalsContact C-N 3.34Å; I390-I392 PolarHBondContact O-N 3.36Å; I392-R395 PolarHBondContact O-N 2.77Å; I392-Q396 WeakPolarHBondContact O-CG 3.38Å; I392-Q396 PolarHBondContact O-N 2.86Å; I392-L466 HydrophobicContact CG2-CD1 3.57Å
393	V	97.5	Very high	96	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-44.2	-179.1	170.6	0	0	0	0	111.2	L389 I390 R395 Q396 A397 F462 L465 L466 L469	L389-V393 HydrophobicContact CD1-CG2 4.36Å; L389-V393 WeakPolarHBondContact O-CG2 3.44Å; L389-V393 PolarHBondContact O-N 3.05Å; I390-V393 PolarHBondContact O-N 2.93Å; V393-R395 VanDerWaalsContact C-N 3.31Å; V393-R395 PolarHBondContact O-N 3.2Å; V393-Q396 PolarHBondContact O-N 3.44Å; V393-Q396 VanDerWaalsContact O-N 3.1Å; V393-A397 WeakPolarHBondContact O-CB 3.4Å; V393-A397 PolarHBondContact O-N 3.41Å; V393-F462 HydrophobicContact CB-CD1 3.88Å; V393-F462 HydrophobicContact CB-CE1 4.48Å; V393-F462 HydrophobicContact CG1-CD1 3.82Å; V393-F462 HydrophobicContact CG1-CE1 4.25Å; V393-F462 HydrophobicContact CG2-CB 4.46Å; V393-F462 HydrophobicContact CG2-CD1 4.13Å; V393-F462 WeakPolarHBondContact CG2-O 3.37Å; V393-L465 HydrophobicContact CG1-CB 3.67Å; V393-L465 HydrophobicContact CG1-CD1 3.79Å; V393-L465 HydrophobicContact CG1-CG 4.41Å; V393-L465 HydrophobicContact CG2-CB 4.34Å; V393-L466 HydrophobicContact CG2-CB 4.02Å; V393-L466 HydrophobicContact CG2-CD1 4.45Å; V393-L469 HydrophobicContact CG1-CD1 3.9Å
394	E	96.4	Very high	95.8	Very high	32 Å²	32	42.6 Å²	42.6	15%	0.15	21%	0.205	C	C	.	.	H	α-helix	trans	-57.9	-43.8	176.7	-175.5	177.9	88.7	0	0	110.9	R329 F330 T331 I390 Q396 A397 A398	R329-E394 WeakPolarHBondContact CA-OE2 3.35Å; R329-E394 WeakPolarHBondContact CB-OE2 3.21Å; F330-E394 WeakPolarHBondContact CD2-OE2 3.48Å; F330-E394 PolarHBondContact N-OE2 2.86Å; T331-E394 VanDerWaalsContact CB-OE1 3.25Å; T331-E394 WeakPolarHBondContact CB-OE1 3.32Å; T331-E394 WeakPolarHBondContact CG2-OE1 3.46Å; T331-E394 PolarHBondContact N-OE1 3.4Å; T331-E394 PolarHBondContact OG1-OE1 3.22Å; I390-E394 VanDerWaalsContact O-CB 3.31Å; I390-E394 WeakPolarHBondContact O-CB 3.48Å; I390-E394 PolarHBondContact O-N 3.15Å; E394-Q396 PolarHBondContact O-N 3.48Å; E394-A397 PolarHBondContact O-N 3.46Å; E394-A398 VanDerWaalsContact O-CB 3.27Å; E394-A398 WeakPolarHBondContact O-CB 3.34Å; E394-A398 PolarHBondContact O-N 3.34Å
395	R	95.3	Very high	95.5	Very high	55 Å²	55	44.9 Å²	44.9	21%	0.208	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-39.2	175.2	-73	-170.4	-59.7	-125.5	6.9	112.7	E360 V391 I392 V393 R399	E360-R395 IonicContact OE1-CZ 3.18Å; E360-R395 IonicContact OE1-NH2 2.69Å; E360-R395 PolarHBondContact OE1-NH2 3.34Å; E360-R395 IonicContact OE2-CZ 2.66Å; E360-R395 IonicContact OE2-NH2 2.8Å; E360-R395 PolarHBondContact OE2-NH2 3.43Å; V391-R395 VanDerWaalsContact CG1-NH1 3.34Å; V391-R395 VanDerWaalsContact O-CG 3.31Å; V391-R395 WeakPolarHBondContact O-CG 3.27Å; V391-R395 PolarHBondContact O-N 3.15Å; V391-R395 VanDerWaalsContact O-N 3.08Å; I392-R395 PolarHBondContact O-N 2.77Å; V393-R395 VanDerWaalsContact C-N 3.31Å; V393-R395 PolarHBondContact O-N 3.2Å; R395-R399 WeakPolarHBondContact O-CB 3.46Å; R395-R399 VanDerWaalsContact O-CG 3.31Å; R395-R399 WeakPolarHBondContact O-CG 3.48Å; R395-R399 PolarHBondContact O-N 3.47Å; R395-R399 PolarHBondContact O-NE 2.98Å
396	Q	95.8	Very high	95.2	Very high	35 Å²	35	44.3 Å²	44.3	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-46.4	176.5	-70.5	-178.2	19.7	0	0	111.4	I392 V393 E394 R399 L400 L469	I392-Q396 WeakPolarHBondContact O-CG 3.38Å; I392-Q396 PolarHBondContact O-N 2.86Å; V393-Q396 PolarHBondContact O-N 3.44Å; V393-Q396 VanDerWaalsContact O-N 3.1Å; E394-Q396 PolarHBondContact O-N 3.48Å; Q396-R399 PolarHBondContact O-N 2.92Å; Q396-L400 WeakPolarHBondContact O-CB 3.16Å; Q396-L400 PolarHBondContact O-N 3.37Å; Q396-L469 HydrophobicContact CB-CB 4.28Å; Q396-L469 HydrophobicContact CB-CD1 3.87Å
397	A	95.8	Very high	94.9	Very high	31 Å²	31	46.3 Å²	46.3	26%	0.256	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-45.3	177.8	0	0	0	0	0	111.7	V393 E394 R399 L400 I401 L469	V393-A397 WeakPolarHBondContact O-CB 3.4Å; V393-A397 PolarHBondContact O-N 3.41Å; E394-A397 PolarHBondContact O-N 3.46Å; A397-R399 PolarHBondContact O-N 3.25Å; A397-L400 WeakPolarHBondContact O-CB 3.48Å; A397-L400 PolarHBondContact O-N 2.83Å; A397-I401 WeakPolarHBondContact O-CG1 3.43Å; A397-I401 PolarHBondContact O-N 2.99Å; A397-L469 HydrophobicContact CB-CD1 4.14Å
398	A	94.3	Very high	94.7	Very high	32 Å²	32	46.6 Å²	46.6	26%	0.264	24%	0.244	S	C	.	.	H	α-helix	trans	-60.5	-44	176.5	0	0	0	0	0	111.9	E394 I401 Q402	E394-A398 VanDerWaalsContact O-CB 3.27Å; E394-A398 WeakPolarHBondContact O-CB 3.34Å; E394-A398 PolarHBondContact O-N 3.34Å; A398-I401 PolarHBondContact O-N 3.03Å; A398-Q402 WeakPolarHBondContact O-CB 3.49Å; A398-Q402 VanDerWaalsContact O-CG 3.23Å; A398-Q402 WeakPolarHBondContact O-CG 3.2Å; A398-Q402 PolarHBondContact O-N 3.24Å
399	R	94.1	Very high	94.4	Very high	109 Å²	109	49.3 Å²	49.3	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-41	175.5	-76.7	-174.4	-63.4	-129.2	2	112.3	R395 Q396 A397 Q402 Q403	R395-R399 WeakPolarHBondContact O-CB 3.46Å; R395-R399 VanDerWaalsContact O-CG 3.31Å; R395-R399 WeakPolarHBondContact O-CG 3.48Å; R395-R399 PolarHBondContact O-N 3.47Å; R395-R399 PolarHBondContact O-NE 2.98Å; Q396-R399 PolarHBondContact O-N 2.92Å; A397-R399 PolarHBondContact O-N 3.25Å; R399-Q402 PolarHBondContact O-N 3.42Å; R399-Q403 VanDerWaalsContact O-CB 3.26Å; R399-Q403 WeakPolarHBondContact O-CB 3.34Å; R399-Q403 VanDerWaalsContact O-CG 3.28Å; R399-Q403 WeakPolarHBondContact O-CG 3.27Å; R399-Q403 PolarHBondContact O-N 2.94Å
400	L	94.9	Very high	94.2	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.052	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-49.3	176.9	174.2	58.9	0	0	0	111.6	Q396 A397 Q402 Q403 S404 L407 L469 V472 H473 M476 V477	Q396-L400 WeakPolarHBondContact O-CB 3.16Å; Q396-L400 PolarHBondContact O-N 3.37Å; A397-L400 WeakPolarHBondContact O-CB 3.48Å; A397-L400 PolarHBondContact O-N 2.83Å; L400-Q402 VanDerWaalsContact C-N 3.33Å; L400-Q402 PolarHBondContact O-N 3.06Å; L400-Q403 PolarHBondContact O-N 3.49Å; L400-S404 VanDerWaalsContact O-CB 3.26Å; L400-S404 WeakPolarHBondContact O-CB 3.5Å; L400-S404 PolarHBondContact O-N 3.21Å; L400-L407 HydrophobicContact CD1-CD1 4.08Å; L400-L407 HydrophobicContact CD2-CD1 4.15Å; L400-L407 HydrophobicContact CG-CD1 3.65Å; L400-L469 HydrophobicContact CD2-CD2 3.77Å; L400-V472 HydrophobicContact CD1-CG1 4.47Å; L400-V472 HydrophobicContact CD2-CB 4.35Å; L400-V472 HydrophobicContact CD2-CG1 3.76Å; L400-H473 HydrophobicContact CD1-CB 4.09Å; L400-M476 HydrophobicContact CD1-CB 4.3Å; L400-V477 HydrophobicContact CD1-CG2 4.19Å
401	I	93.6	Very high	93.8	Very high	70 Å²	70	53.9 Å²	53.9	36%	0.359	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-43.5	178.6	-66.4	166	0	0	0	110.7	A397 A398 S408 A411	A397-I401 WeakPolarHBondContact O-CG1 3.43Å; A397-I401 PolarHBondContact O-N 2.99Å; A398-I401 PolarHBondContact O-N 3.03Å; I401-S408 WeakPolarHBondContact O-CA 3.42Å; I401-S408 WeakPolarHBondContact O-CB 3.48Å; I401-S408 PolarHBondContact O-N 3.29Å; I401-A411 HydrophobicContact CG2-CB 3.86Å
402	Q	92.5	Very high	93.7	Very high	138 Å²	138	56.9 Å²	56.9	65%	0.645	32%	0.315	S	S	*	.	H	α-helix	trans	-68.1	-36.4	-179.7	-74.4	173.5	0.5	0	0	113.5	A398 R399 L400	A398-Q402 WeakPolarHBondContact O-CB 3.49Å; A398-Q402 VanDerWaalsContact O-CG 3.23Å; A398-Q402 WeakPolarHBondContact O-CG 3.2Å; A398-Q402 PolarHBondContact O-N 3.24Å; R399-Q402 PolarHBondContact O-N 3.42Å; L400-Q402 VanDerWaalsContact C-N 3.33Å; L400-Q402 PolarHBondContact O-N 3.06Å
403	Q	93.2	Very high	93.6	Very high	98 Å²	98	59.4 Å²	59.4	46%	0.458	33%	0.328	S	S	.	.	H	α-helix	trans	-95.6	-17.1	-172	-67	-179.9	-13	0	0	114	R399 L400 P405 H473 V477	R399-Q403 VanDerWaalsContact O-CB 3.26Å; R399-Q403 WeakPolarHBondContact O-CB 3.34Å; R399-Q403 VanDerWaalsContact O-CG 3.28Å; R399-Q403 WeakPolarHBondContact O-CG 3.27Å; R399-Q403 PolarHBondContact O-N 2.94Å; L400-Q403 PolarHBondContact O-N 3.49Å; Q403-P405 WeakPolarHBondContact O-CD 3.1Å; Q403-H473 PolarHBondContact OE1-CE1 3.36Å; Q403-H473 PolarHBondContact OE1-NE2 3.09Å; Q403-V477 HydrophobicContact CB-CG1 3.99Å; Q403-V477 HydrophobicContact CB-CG2 3.96Å
404	S	93.5	Very high	93.5	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.361	C	S	.	.			trans	-88.7	118.9	174.5	179.8	0	0	0	0	110	L400 T406 L407 S408 M476	L400-S404 VanDerWaalsContact O-CB 3.26Å; L400-S404 WeakPolarHBondContact O-CB 3.5Å; L400-S404 PolarHBondContact O-N 3.21Å; S404-T406 VanDerWaalsContact C-N 3.26Å; S404-T406 PolarHBondContact O-N 2.9Å; S404-L407 PolarHBondContact O-N 3.39Å; S404-S408 VanDerWaalsContact O-CB 3.28Å; S404-S408 WeakPolarHBondContact O-CB 3.46Å; S404-S408 PolarHBondContact O-N 3.15Å; S404-M476 PolarHBondContact OG-O 3.25Å; S404-M476 VanDerWaalsContact OG-O 3.11Å
405	P	90.8	Very high	93.5	Very high	67 Å²	67	67.4 Å²	67.4	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-56	-41.3	178.1	-26	34.9	0	0	0	112.7	Q403 N409 P478	Q403-P405 WeakPolarHBondContact O-CD 3.1Å; P405-N409 VanDerWaalsContact O-CB 3.28Å; P405-N409 WeakPolarHBondContact O-CB 3.21Å; P405-N409 PolarHBondContact O-N 2.89Å; P405-N409 PolarHBondContact O-ND2 3.5Å; P405-P478 HydrophobicContact CG-CG 4.35Å
406	T	91.5	Very high	93.4	Very high	98 Å²	98	67.7 Å²	67.7	60%	0.601	39%	0.394	S	S	*	.	H	α-helix	trans	-62.1	-49.2	179.4	-49.5	0	0	0	0	112	S404 L410	S404-T406 VanDerWaalsContact C-N 3.26Å; S404-T406 PolarHBondContact O-N 2.9Å; T406-L410 WeakPolarHBondContact O-CB 3.48Å; T406-L410 PolarHBondContact O-N 3.45Å
407	L	91.9	Very high	93.4	Very high	42 Å²	42	69.9 Å²	69.9	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-71.9	-36.8	-179	-65	174.4	0	0	0	112	L400 S404 L410 A411 M476	L400-L407 HydrophobicContact CD1-CD1 4.08Å; L400-L407 HydrophobicContact CD2-CD1 4.15Å; L400-L407 HydrophobicContact CG-CD1 3.65Å; S404-L407 PolarHBondContact O-N 3.39Å; L407-L410 PolarHBondContact O-N 2.83Å; L407-A411 WeakPolarHBondContact O-CB 3.4Å; L407-A411 PolarHBondContact O-N 2.87Å; L407-M476 HydrophobicContact CD1-CE 3.79Å; L407-M476 HydrophobicContact CD1-SD 4.07Å; L407-M476 HydrophobicContact CD2-CE 3.91Å; L407-M476 HydrophobicContact CG-CE 3.61Å
408	S	91.7	Very high	93.4	Very high	50 Å²	50	72.8 Å²	72.8	35%	0.35	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-46.4	175.6	-172.1	0	0	0	0	111.1	I401 S404 L410 A411 A412	I401-S408 WeakPolarHBondContact O-CA 3.42Å; I401-S408 WeakPolarHBondContact O-CB 3.48Å; I401-S408 PolarHBondContact O-N 3.29Å; S404-S408 VanDerWaalsContact O-CB 3.28Å; S404-S408 WeakPolarHBondContact O-CB 3.46Å; S404-S408 PolarHBondContact O-N 3.15Å; S408-L410 PolarHBondContact O-N 2.93Å; S408-A411 PolarHBondContact O-N 3.3Å; S408-A412 WeakPolarHBondContact O-CB 3.36Å; S408-A412 PolarHBondContact O-N 3.42Å
409	N	92.3	Very high	93.5	Very high	114 Å²	114	77.1 Å²	77.1	61%	0.61	43%	0.433	S	S	*	.	H	α-helix	trans	-62.4	-43.6	176.8	-71.5	-14.6	0	0	0	111.8	P405 A412	P405-N409 VanDerWaalsContact O-CB 3.28Å; P405-N409 WeakPolarHBondContact O-CB 3.21Å; P405-N409 PolarHBondContact O-N 2.89Å; P405-N409 PolarHBondContact O-ND2 3.5Å; N409-A412 PolarHBondContact O-N 3.04Å
410	L	92.4	Very high	93.5	Very high	79 Å²	79	74.2 Å²	74.2	41%	0.414	42%	0.423	S	S	.	.	H	α-helix	trans	-62.2	-45.8	175.6	179.2	60.6	0	0	0	111.5	T406 L407 S408 A412 I413 L416 Y420	T406-L410 WeakPolarHBondContact O-CB 3.48Å; T406-L410 PolarHBondContact O-N 3.45Å; L407-L410 PolarHBondContact O-N 2.83Å; S408-L410 PolarHBondContact O-N 2.93Å; L410-A412 PolarHBondContact O-N 3.34Å; L410-I413 HydrophobicContact CD1-CD1 3.99Å; L410-I413 WeakPolarHBondContact O-CB 3.15Å; L410-I413 WeakPolarHBondContact O-CG1 3.3Å; L410-I413 PolarHBondContact O-N 3.45Å; L410-L416 HydrophobicContact CD1-CD1 3.98Å; L410-Y420 VanDerWaalsContact CD1-OH 3.27Å; L410-Y420 WeakPolarHBondContact CD1-OH 3.45Å; L410-Y420 VanDerWaalsContact CG-OH 3.28Å; L410-Y420 WeakPolarHBondContact CG-OH 3.02Å; L410-Y420 PolarHBondContact O-OH 3.46Å
411	A	91.1	Very high	93.6	Very high	36 Å²	36	78.3 Å²	78.3	30%	0.298	44%	0.438	S	S	.	.	H	α-helix	trans	-67.5	-17.9	177.9	0	0	0	0	0	113.4	I401 L407 S408 Q417	I401-A411 HydrophobicContact CG2-CB 3.86Å; L407-A411 WeakPolarHBondContact O-CB 3.4Å; L407-A411 PolarHBondContact O-N 2.87Å; S408-A411 PolarHBondContact O-N 3.3Å; A411-Q417 PolarHBondContact O-NE2 3.29Å
412	A	92.4	Very high	93.7	Very high	69 Å²	69	80.2 Å²	80.2	57%	0.57	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.8	176.3	0	0	0	0	0	113.4	S408 N409 L410 T414	S408-A412 WeakPolarHBondContact O-CB 3.36Å; S408-A412 PolarHBondContact O-N 3.42Å; N409-A412 PolarHBondContact O-N 3.04Å; L410-A412 PolarHBondContact O-N 3.34Å; A412-T414 PolarHBondContact O-N 2.91Å; A412-T414 VanDerWaalsContact O-N 3.07Å
413	I	94.6	Very high	93.9	Very high	78 Å²	78	76.4 Å²	76.4	40%	0.4	44%	0.435	S	S	.	.			trans	-64.8	112.7	179.8	-58.6	-179.4	0	0	0	109.5	L410 A415 L416 Q417	L410-I413 HydrophobicContact CD1-CD1 3.99Å; L410-I413 WeakPolarHBondContact O-CB 3.15Å; L410-I413 WeakPolarHBondContact O-CG1 3.3Å; L410-I413 PolarHBondContact O-N 3.45Å; I413-A415 VanDerWaalsContact C-N 3.34Å; I413-A415 HydrophobicContact CG2-CB 4.3Å; I413-A415 PolarHBondContact O-N 3.02Å; I413-L416 HydrophobicContact CB-CB 4.43Å; I413-L416 HydrophobicContact CB-CD1 4.13Å; I413-L416 HydrophobicContact CB-CG 4.26Å; I413-L416 HydrophobicContact CD1-CD1 4.09Å; I413-L416 HydrophobicContact CG2-CB 4.36Å; I413-L416 HydrophobicContact CG2-CD1 4.07Å; I413-L416 HydrophobicContact CG2-CG 3.87Å; I413-L416 PolarHBondContact O-N 2.86Å; I413-Q417 PolarHBondContact O-NE2 2.9Å; I413-Q417 VanDerWaalsContact O-NE2 3.16Å
414	T	94.8	Very high	94	Very high	117 Å²	117	75.4 Å²	75.4	72%	0.718	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-63	-39.1	-175.4	-47.3	0	0	0	0	112.4	A412 L416 Q417	A412-T414 PolarHBondContact O-N 2.91Å; A412-T414 VanDerWaalsContact O-N 3.07Å; T414-L416 PolarHBondContact O-N 3.43Å; T414-Q417 WeakPolarHBondContact O-CB 3.2Å; T414-Q417 WeakPolarHBondContact O-CG 3.25Å; T414-Q417 PolarHBondContact O-N 3.36Å; T414-Q417 VanDerWaalsContact O-N 3.1Å
415	A	96.3	Very high	94.1	Very high	88 Å²	88	76.6 Å²	76.6	73%	0.727	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-61.9	-24.6	179.4	0	0	0	0	0	113.4	I413	I413-A415 VanDerWaalsContact C-N 3.34Å; I413-A415 HydrophobicContact CG2-CB 4.3Å; I413-A415 PolarHBondContact O-N 3.02Å
416	L	95.1	Very high	94.4	Very high	61 Å²	61	76 Å²	76	32%	0.319	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-92.8	-7.1	179.7	-60.9	179.4	0	0	0	113.1	L410 I413 T414 F419 Y420	L410-L416 HydrophobicContact CD1-CD1 3.98Å; I413-L416 HydrophobicContact CB-CB 4.43Å; I413-L416 HydrophobicContact CB-CD1 4.13Å; I413-L416 HydrophobicContact CB-CG 4.26Å; I413-L416 HydrophobicContact CD1-CD1 4.09Å; I413-L416 HydrophobicContact CG2-CB 4.36Å; I413-L416 HydrophobicContact CG2-CD1 4.07Å; I413-L416 HydrophobicContact CG2-CG 3.87Å; I413-L416 PolarHBondContact O-N 2.86Å; T414-L416 PolarHBondContact O-N 3.43Å; L416-F419 WeakPolarHBondContact O-CB 3.33Å; L416-F419 PolarHBondContact O-N 2.88Å; L416-F419 VanDerWaalsContact O-N 3.17Å; L416-Y420 HydrophobicContact CB-CD2 4.09Å; L416-Y420 HydrophobicContact CB-CE1 4.14Å; L416-Y420 HydrophobicContact CB-CE2 3.5Å; L416-Y420 VanDerWaalsContact CB-CE2 3.5Å; L416-Y420 HydrophobicContact CD1-CE2 4.48Å; L416-Y420 WeakPolarHBondContact CD1-OH 3.37Å; L416-Y420 WeakPolarHBondContact O-CD2 3.22Å; L416-Y420 VanDerWaalsContact O-CG 3.31Å; L416-Y420 PolarHBondContact O-N 3.26Å
417	Q	94.1	Very high	94.7	Very high	81 Å²	81	74.3 Å²	74.3	38%	0.379	42%	0.417	S	S	.	.	H	α-helix	trans	-59.2	-44.4	-178.3	-62.8	-58.7	-56.5	0	0	113.8	A411 I413 T414 F419 Y420 Y421	A411-Q417 PolarHBondContact O-NE2 3.29Å; I413-Q417 PolarHBondContact O-NE2 2.9Å; I413-Q417 VanDerWaalsContact O-NE2 3.16Å; T414-Q417 WeakPolarHBondContact O-CB 3.2Å; T414-Q417 WeakPolarHBondContact O-CG 3.25Å; T414-Q417 PolarHBondContact O-N 3.36Å; T414-Q417 VanDerWaalsContact O-N 3.1Å; Q417-F419 VanDerWaalsContact C-N 3.27Å; Q417-F419 PolarHBondContact O-N 3.04Å; Q417-Y420 PolarHBondContact O-N 3.32Å; Q417-Y421 VanDerWaalsContact O-CB 3.29Å; Q417-Y421 WeakPolarHBondContact O-CB 3.49Å; Q417-Y421 PolarHBondContact O-N 3.3Å
418	P	96	Very high	94.9	Very high	91 Å²	91	72.3 Å²	72.3	59%	0.591	41%	0.407	S	S	*	.	H	α-helix	trans	-62.5	-37	177.6	-22.6	35	0	0	0	112.2	L422	P418-L422 WeakPolarHBondContact O-CB 3.21Å; P418-L422 PolarHBondContact O-N 3.45Å
419	F	96.2	Very high	95.1	Very high	123 Å²	123	70.3 Å²	70.3	54%	0.539	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-47.6	176.1	174.7	-102.2	0	0	0	111.5	L416 Q417 Y421 L422 V423	L416-F419 WeakPolarHBondContact O-CB 3.33Å; L416-F419 PolarHBondContact O-N 2.88Å; L416-F419 VanDerWaalsContact O-N 3.17Å; Q417-F419 VanDerWaalsContact C-N 3.27Å; Q417-F419 PolarHBondContact O-N 3.04Å; F419-Y421 VanDerWaalsContact C-N 3.3Å; F419-Y421 PolarHBondContact O-N 3.46Å; F419-L422 PolarHBondContact O-N 3.33Å; F419-V423 HydrophobicContact CD1-CG2 4.46Å; F419-V423 HydrophobicContact CD2-CG2 4.34Å; F419-V423 HydrophobicContact CE1-CG2 4.02Å; F419-V423 HydrophobicContact CE2-CG2 3.89Å; F419-V423 HydrophobicContact CZ-CG2 3.72Å; F419-V423 WeakPolarHBondContact O-CG2 3.45Å; F419-V423 PolarHBondContact O-N 2.98Å
420	Y	94.9	Very high	95.3	Very high	48 Å²	48	65.6 Å²	65.6	19%	0.188	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-42.2	175.5	-62.9	-30.8	0	0	0	112.1	L410 L416 Q417 V423 Q424	L410-Y420 VanDerWaalsContact CD1-OH 3.27Å; L410-Y420 WeakPolarHBondContact CD1-OH 3.45Å; L410-Y420 VanDerWaalsContact CG-OH 3.28Å; L410-Y420 WeakPolarHBondContact CG-OH 3.02Å; L410-Y420 PolarHBondContact O-OH 3.46Å; L416-Y420 HydrophobicContact CB-CD2 4.09Å; L416-Y420 HydrophobicContact CB-CE1 4.14Å; L416-Y420 HydrophobicContact CB-CE2 3.5Å; L416-Y420 VanDerWaalsContact CB-CE2 3.5Å; L416-Y420 HydrophobicContact CD1-CE2 4.48Å; L416-Y420 WeakPolarHBondContact CD1-OH 3.37Å; L416-Y420 WeakPolarHBondContact O-CD2 3.22Å; L416-Y420 VanDerWaalsContact O-CG 3.31Å; L416-Y420 PolarHBondContact O-N 3.26Å; Q417-Y420 PolarHBondContact O-N 3.32Å; Y420-V423 PolarHBondContact O-N 3.06Å; Y420-Q424 VanDerWaalsContact O-CB 3.27Å; Y420-Q424 WeakPolarHBondContact O-CB 3.3Å; Y420-Q424 WeakPolarHBondContact O-CG 3.15Å; Y420-Q424 PolarHBondContact O-N 2.83Å
421	Y	96.3	Very high	95.6	Very high	96 Å²	96	62.1 Å²	62.1	38%	0.376	35%	0.348	S	S	.	.	H	α-helix	trans	-58.3	-49.4	175.4	177.3	-95.6	0	0	0	111.3	T326 P328 Q417 F419 V423 Q424 Q425	T326-Y421 VanDerWaalsContact O-CE2 3.25Å; T326-Y421 WeakPolarHBondContact O-CE2 3.09Å; T326-Y421 PolarHBondContact O-OH 3.31Å; P328-Y421 HydrophobicContact CB-CD2 4.25Å; P328-Y421 HydrophobicContact CB-CE2 4.26Å; P328-Y421 HydrophobicContact CG-CD2 4.01Å; P328-Y421 HydrophobicContact CG-CE2 4.17Å; Q417-Y421 VanDerWaalsContact O-CB 3.29Å; Q417-Y421 WeakPolarHBondContact O-CB 3.49Å; Q417-Y421 PolarHBondContact O-N 3.3Å; F419-Y421 VanDerWaalsContact C-N 3.3Å; F419-Y421 PolarHBondContact O-N 3.46Å; Y421-V423 PolarHBondContact O-N 3.5Å; Y421-Q424 PolarHBondContact O-N 2.8Å; Y421-Q425 WeakPolarHBondContact O-CB 3.32Å; Y421-Q425 PolarHBondContact O-N 3.43Å
422	L	96.6	Very high	95.8	Very high	110 Å²	110	61.7 Å²	61.7	58%	0.576	34%	0.34	S	S	*	.	H	α-helix	trans	-60.1	-48.7	179.2	-178.6	63.5	0	0	0	111.5	P418 F419 Q424 Q425 T426	P418-L422 WeakPolarHBondContact O-CB 3.21Å; P418-L422 PolarHBondContact O-N 3.45Å; F419-L422 PolarHBondContact O-N 3.33Å; L422-Q424 PolarHBondContact O-N 3.07Å; L422-Q425 PolarHBondContact O-N 3.48Å; L422-T426 PolarHBondContact O-N 2.85Å; L422-T426 PolarHBondContact O-OG1 2.93Å; L422-T426 VanDerWaalsContact O-OG1 3.06Å
423	V	96.3	Very high	96.1	Very high	59 Å²	59	58.4 Å²	58.4	36%	0.358	31%	0.313	S	S	.	.	H	α-helix	trans	-61.1	-47.3	179.1	172	0	0	0	0	111.2	F419 Y420 Y421 Q425 T426 I427	F419-V423 HydrophobicContact CD1-CG2 4.46Å; F419-V423 HydrophobicContact CD2-CG2 4.34Å; F419-V423 HydrophobicContact CE1-CG2 4.02Å; F419-V423 HydrophobicContact CE2-CG2 3.89Å; F419-V423 HydrophobicContact CZ-CG2 3.72Å; F419-V423 WeakPolarHBondContact O-CG2 3.45Å; F419-V423 PolarHBondContact O-N 2.98Å; Y420-V423 PolarHBondContact O-N 3.06Å; Y421-V423 PolarHBondContact O-N 3.5Å; V423-Q425 VanDerWaalsContact C-N 3.35Å; V423-Q425 PolarHBondContact O-N 2.93Å; V423-T426 PolarHBondContact O-N 2.93Å; V423-I427 HydrophobicContact CG1-CD1 3.86Å; V423-I427 WeakPolarHBondContact O-CB 3.48Å; V423-I427 WeakPolarHBondContact O-CG1 3.43Å; V423-I427 PolarHBondContact O-N 2.93Å
424	Q	96.2	Very high	96.2	Very high	77 Å²	77	54.8 Å²	54.8	36%	0.36	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-41.3	178.5	-71	173.8	-13.3	0	0	111.3	P328 Y420 Y421 L422 I427 H428	P328-Q424 HydrophobicContact CB-CB 3.66Å; P328-Q424 HydrophobicContact CG-CB 4.25Å; Y420-Q424 VanDerWaalsContact O-CB 3.27Å; Y420-Q424 WeakPolarHBondContact O-CB 3.3Å; Y420-Q424 WeakPolarHBondContact O-CG 3.15Å; Y420-Q424 PolarHBondContact O-N 2.83Å; Y421-Q424 PolarHBondContact O-N 2.8Å; L422-Q424 PolarHBondContact O-N 3.07Å; Q424-I427 PolarHBondContact O-N 3.2Å; Q424-H428 WeakPolarHBondContact O-CB 3.25Å; Q424-H428 PolarHBondContact O-N 3.06Å
425	Q	95.7	Very high	96.3	Very high	25 Å²	25	49.5 Å²	49.5	12%	0.117	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-39.5	178.6	-168.9	69.2	-10.8	0	0	111.9	E325 N327 P328 Y421 L422 V423 H428 W429	E325-Q425 PolarHBondContact O-NE2 3.05Å; E325-Q425 VanDerWaalsContact O-NE2 3.12Å; N327-Q425 PolarHBondContact O-OE1 3.4Å; P328-Q425 HydrophobicContact CB-CB 4.3Å; Y421-Q425 WeakPolarHBondContact O-CB 3.32Å; Y421-Q425 PolarHBondContact O-N 3.43Å; L422-Q425 PolarHBondContact O-N 3.48Å; V423-Q425 VanDerWaalsContact C-N 3.35Å; V423-Q425 PolarHBondContact O-N 2.93Å; Q425-H428 PolarHBondContact O-N 3.13Å; Q425-W429 PolarHBondContact O-N 3.46Å
426	T	96.3	Very high	96.3	Very high	55 Å²	55	46 Å²	46	34%	0.337	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-47.7	174.3	-61.2	0	0	0	0	111.4	L274 L422 V423 H428 L430	L274-T426 HydrophobicContact CD1-CG2 3.96Å; L274-T426 WeakPolarHBondContact CD1-O 3.22Å; L422-T426 PolarHBondContact O-N 2.85Å; L422-T426 PolarHBondContact O-OG1 2.93Å; L422-T426 VanDerWaalsContact O-OG1 3.06Å; V423-T426 PolarHBondContact O-N 2.93Å; T426-H428 VanDerWaalsContact C-N 3.33Å; T426-H428 PolarHBondContact O-N 2.83Å; T426-L430 WeakPolarHBondContact O-CB 3.43Å; T426-L430 PolarHBondContact O-N 3.31Å
427	I	96.6	Very high	96.4	Very high	62 Å²	62	43.1 Å²	43.1	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-59.1	-47	176	-73.2	171.1	0	0	0	110.4	V423 Q424 F431	V423-I427 HydrophobicContact CG1-CD1 3.86Å; V423-I427 WeakPolarHBondContact O-CB 3.48Å; V423-I427 WeakPolarHBondContact O-CG1 3.43Å; V423-I427 PolarHBondContact O-N 2.93Å; Q424-I427 PolarHBondContact O-N 3.2Å; I427-F431 HydrophobicContact CG2-CD2 3.79Å; I427-F431 HydrophobicContact CG2-CE2 3.89Å; I427-F431 WeakPolarHBondContact O-CD2 3.41Å; I427-F431 PolarHBondContact O-N 3.37Å; I427-F431 VanDerWaalsContact O-N 3.11Å
428	H	96.5	Very high	96.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.5	-58.6	-179.9	173.8	-146.7	0	0	0	111.1	N327 F330 T333 Q424 Q425 T426 L430 F431 M432	N327-H428 PolarHBondContact O-CE1 3.43Å; N327-H428 PolarHBondContact O-ND1 3.43Å; F330-H428 AromaticContact CD1-CD2 3.75Å; F330-H428 AromaticContact CE1-CD2 3.82Å; F330-H428 WeakPolarHBondContact CE1-O 3.36Å; F330-H428 HydrophobicContact CZ-CB 4.5Å; T333-H428 PolarHBondContact OG1-CE1 3.06Å; T333-H428 PolarHBondContact OG1-NE2 3.44Å; Q424-H428 WeakPolarHBondContact O-CB 3.25Å; Q424-H428 PolarHBondContact O-N 3.06Å; Q425-H428 PolarHBondContact O-N 3.13Å; T426-H428 VanDerWaalsContact C-N 3.33Å; T426-H428 PolarHBondContact O-N 2.83Å; H428-L430 PolarHBondContact O-N 3.2Å; H428-F431 PolarHBondContact O-N 3.34Å; H428-M432 VanDerWaalsContact CD2-CG 3.45Å; H428-M432 WeakPolarHBondContact CD2-CG 3.26Å; H428-M432 WeakPolarHBondContact NE2-CG 3.45Å; H428-M432 WeakPolarHBondContact O-CB 3.33Å; H428-M432 VanDerWaalsContact O-CG 3.25Å; H428-M432 WeakPolarHBondContact O-CG 3.43Å; H428-M432 PolarHBondContact O-N 3.43Å
429	W	96.3	Very high	96.6	Very high	7 Å²	7	35.9 Å²	35.9	3%	0.027	17%	0.174	C	C	.	.	H	α-helix	trans	-70.2	-31.8	-177.1	-74.2	113.7	0	0	0	113.7	L274 K278 L281 F324 Q425 F431 M432 G433	L274-W429 HydrophobicContact CD1-CB 4.28Å; L274-W429 HydrophobicContact CD2-CB 3.8Å; L274-W429 HydrophobicContact CG-CB 3.62Å; K278-W429 HydrophobicContact CB-CD2 3.98Å; K278-W429 HydrophobicContact CB-CE3 3.57Å; K278-W429 HydrophobicContact CB-CH2 4.39Å; K278-W429 HydrophobicContact CB-CZ3 3.82Å; K278-W429 HydrophobicContact CD-CD2 3.95Å; K278-W429 HydrophobicContact CD-CE3 4.3Å; K278-W429 HydrophobicContact CD-CG 4.48Å; K278-W429 HydrophobicContact CD-CH2 4.31Å; K278-W429 HydrophobicContact CD-CZ2 3.93Å; K278-W429 HydrophobicContact CD-CZ3 4.48Å; K278-W429 HydrophobicContact CG-CD2 4.05Å; K278-W429 HydrophobicContact CG-CE3 3.88Å; K278-W429 HydrophobicContact CG-CH2 3.84Å; K278-W429 HydrophobicContact CG-CZ2 3.98Å; K278-W429 HydrophobicContact CG-CZ3 3.78Å; L281-W429 HydrophobicContact CD1-CZ3 4.37Å; F324-W429 HydrophobicContact CD1-CH2 4.42Å; F324-W429 HydrophobicContact CD2-CH2 4.45Å; F324-W429 AromaticContact CE1-CH2 3.79Å; F324-W429 HydrophobicContact CE1-CH2 3.79Å; F324-W429 HydrophobicContact CE1-CZ2 4.44Å; F324-W429 AromaticContact CE2-CH2 3.85Å; F324-W429 HydrophobicContact CE2-CH2 3.85Å; F324-W429 AromaticContact CZ-CH2 3.5Å; F324-W429 HydrophobicContact CZ-CH2 3.5Å; F324-W429 VanDerWaalsContact CZ-CH2 3.5Å; F324-W429 HydrophobicContact CZ-CZ2 4.5Å; F324-W429 HydrophobicContact CZ-CZ3 4.18Å; Q425-W429 PolarHBondContact O-N 3.46Å; W429-F431 VanDerWaalsContact C-N 3.35Å; W429-F431 PolarHBondContact O-N 3.09Å; W429-M432 HydrophobicContact CE3-CB 4.01Å; W429-M432 HydrophobicContact CE3-CG 4.4Å; W429-M432 HydrophobicContact CZ3-CB 4.35Å; W429-G433 PolarHBondContact O-N 3.08Å
430	L	97.6	Very high	96.5	Very high	15 Å²	15	30.4 Å²	30.4	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-49	174.5	177.4	59.1	0	0	0	110.7	C270 L274 T426 H428 G433 Y434 L457	C270-L430 HydrophobicContact CB-CD1 3.86Å; C270-L430 VanDerWaalsContact O-CD1 3.24Å; C270-L430 WeakPolarHBondContact O-CD1 3.25Å; L274-L430 HydrophobicContact CB-CB 4.48Å; L274-L430 HydrophobicContact CB-CD1 4.42Å; L274-L430 HydrophobicContact CD1-CB 4.14Å; T426-L430 WeakPolarHBondContact O-CB 3.43Å; T426-L430 PolarHBondContact O-N 3.31Å; H428-L430 PolarHBondContact O-N 3.2Å; L430-G433 PolarHBondContact O-N 2.54Å; L430-Y434 WeakPolarHBondContact O-CB 3.43Å; L430-Y434 PolarHBondContact O-N 2.69Å; L430-L457 HydrophobicContact CD2-CD2 4.05Å
431	F	97.8	Very high	96.6	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-86.4	-19	-176.3	-60.2	-62.7	0	0	0	114.1	F330 I390 I427 H428 W429 S435 L457 F461 F462	F330-F431 HydrophobicContact CE1-CB 3.98Å; F330-F431 HydrophobicContact CZ-CB 3.76Å; F330-F431 HydrophobicContact CZ-CD2 4.44Å; I390-F431 HydrophobicContact CD1-CB 4.38Å; I427-F431 HydrophobicContact CG2-CD2 3.79Å; I427-F431 HydrophobicContact CG2-CE2 3.89Å; I427-F431 WeakPolarHBondContact O-CD2 3.41Å; I427-F431 PolarHBondContact O-N 3.37Å; I427-F431 VanDerWaalsContact O-N 3.11Å; H428-F431 PolarHBondContact O-N 3.34Å; W429-F431 VanDerWaalsContact C-N 3.35Å; W429-F431 PolarHBondContact O-N 3.09Å; F431-S435 WeakPolarHBondContact O-CB 3.44Å; F431-S435 PolarHBondContact O-N 2.73Å; F431-S435 PolarHBondContact O-OG 2.88Å; F431-L457 HydrophobicContact CE1-CD2 4.46Å; F431-L457 HydrophobicContact CE1-CG 4.17Å; F431-F461 HydrophobicContact CD2-CD1 4.38Å; F431-F461 HydrophobicContact CD2-CE1 4.41Å; F431-F461 HydrophobicContact CE1-CB 4.22Å; F431-F461 HydrophobicContact CE1-CD1 4.3Å; F431-F461 HydrophobicContact CE1-CG 4.38Å; F431-F461 AromaticContact CE2-CD1 3.49Å; F431-F461 HydrophobicContact CE2-CD1 3.49Å; F431-F461 VanDerWaalsContact CE2-CD1 3.49Å; F431-F461 AromaticContact CE2-CE1 3.55Å; F431-F461 HydrophobicContact CE2-CE1 3.55Å; F431-F461 HydrophobicContact CE2-CG 4.06Å; F431-F461 HydrophobicContact CE2-CZ 4.17Å; F431-F461 HydrophobicContact CZ-CB 3.86Å; F431-F461 AromaticContact CZ-CD1 3.44Å; F431-F461 HydrophobicContact CZ-CD1 3.44Å; F431-F461 VanDerWaalsContact CZ-CD1 3.44Å; F431-F461 HydrophobicContact CZ-CD2 4.19Å; F431-F461 AromaticContact CZ-CE1 3.95Å; F431-F461 HydrophobicContact CZ-CE1 3.95Å; F431-F461 AromaticContact CZ-CG 3.57Å; F431-F461 HydrophobicContact CZ-CG 3.57Å; F431-F462 HydrophobicContact CB-CE2 3.66Å; F431-F462 HydrophobicContact CB-CZ 4.08Å; F431-F462 HydrophobicContact CD1-CD2 4.45Å; F431-F462 AromaticContact CD1-CE2 3.72Å; F431-F462 HydrophobicContact CD1-CE2 3.72Å; F431-F462 AromaticContact CD2-CE2 3.5Å; F431-F462 HydrophobicContact CD2-CE2 3.5Å; F431-F462 AromaticContact CD2-CZ 3.6Å; F431-F462 HydrophobicContact CD2-CZ 3.6Å; F431-F462 HydrophobicContact CE1-CE2 4.19Å; F431-F462 AromaticContact CE2-CE2 3.99Å; F431-F462 HydrophobicContact CE2-CE2 3.99Å; F431-F462 HydrophobicContact CE2-CZ 4.14Å; F431-F462 HydrophobicContact CG-CD2 4.46Å; F431-F462 AromaticContact CG-CE2 3.36Å; F431-F462 HydrophobicContact CG-CE2 3.36Å; F431-F462 AromaticContact CG-CZ 3.88Å; F431-F462 HydrophobicContact CG-CZ 3.88Å; F431-F462 HydrophobicContact CZ-CE2 4.31Å
432	M	96.3	Very high	96.4	Very high	28 Å²	28	24.4 Å²	24.4	14%	0.138	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-49.3	160.9	-75.2	-58.7	-56.4	0	0	109.8	F330 T333 H428 W429 Y434 S435 M436	F330-M432 HydrophobicContact CD1-CG 3.98Å; F330-M432 HydrophobicContact CD1-SD 3.58Å; F330-M432 VanDerWaalsContact CD1-SD 3.58Å; F330-M432 HydrophobicContact CE1-CG 3.85Å; F330-M432 HydrophobicContact CE1-SD 3.97Å; T333-M432 HydrophobicContact CG2-CE 3.69Å; T333-M432 HydrophobicContact CG2-SD 4.26Å; H428-M432 VanDerWaalsContact CD2-CG 3.45Å; H428-M432 WeakPolarHBondContact CD2-CG 3.26Å; H428-M432 WeakPolarHBondContact NE2-CG 3.45Å; H428-M432 WeakPolarHBondContact O-CB 3.33Å; H428-M432 VanDerWaalsContact O-CG 3.25Å; H428-M432 WeakPolarHBondContact O-CG 3.43Å; H428-M432 PolarHBondContact O-N 3.43Å; W429-M432 HydrophobicContact CE3-CB 4.01Å; W429-M432 HydrophobicContact CE3-CG 4.4Å; W429-M432 HydrophobicContact CZ3-CB 4.35Å; M432-Y434 VanDerWaalsContact C-N 3.33Å; M432-Y434 PolarHBondContact O-N 2.84Å; M432-S435 PolarHBondContact O-N 2.61Å; M432-M436 WeakPolarHBondContact O-CB 3.18Å; M432-M436 VanDerWaalsContact O-CG 3.27Å; M432-M436 WeakPolarHBondContact O-CG 3.36Å; M432-M436 PolarHBondContact O-N 2.6Å
433	G	96.9	Very high	96.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.4	-39.4	175.1	0	0	0	0	0	113.5	W429 L430 S435 M436 T437	W429-G433 PolarHBondContact O-N 3.08Å; L430-G433 PolarHBondContact O-N 2.54Å; G433-S435 PolarHBondContact O-N 2.96Å; G433-M436 PolarHBondContact O-N 3.25Å; G433-T437 PolarHBondContact O-N 3.15Å; G433-T437 PolarHBondContact O-OG1 3.39Å
434	Y	98	Very high	96.1	Very high	2 Å²	2	25 Å²	25	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-55.7	-52.6	171.1	-172.5	-93.5	0	0	0	111.6	M273 M386 L430 M432 M436 T437 Y451 I454 H459	M273-Y434 VanDerWaalsContact SD-CA 3.51Å; M273-Y434 HydrophobicContact SD-CD2 3.95Å; M273-Y434 HydrophobicContact SD-CG 4.46Å; M386-Y434 HydrophobicContact CE-CD1 4.02Å; M386-Y434 HydrophobicContact CE-CE1 4.04Å; M386-Y434 HydrophobicContact CG-CE1 4.41Å; M386-Y434 HydrophobicContact SD-CE1 4.2Å; L430-Y434 WeakPolarHBondContact O-CB 3.43Å; L430-Y434 PolarHBondContact O-N 2.69Å; M432-Y434 VanDerWaalsContact C-N 3.33Å; M432-Y434 PolarHBondContact O-N 2.84Å; Y434-M436 VanDerWaalsContact C-N 3.35Å; Y434-M436 PolarHBondContact O-N 3.46Å; Y434-T437 VanDerWaalsContact O-CB 3.26Å; Y434-T437 WeakPolarHBondContact O-CB 3.24Å; Y434-T437 PolarHBondContact O-N 3.21Å; Y434-T437 PolarHBondContact O-OG1 2.98Å; Y434-Y451 HydrophobicContact CD1-CE1 4.2Å; Y434-Y451 HydrophobicContact CD2-CD1 4.3Å; Y434-Y451 AromaticContact CD2-CE1 3.97Å; Y434-Y451 HydrophobicContact CD2-CE1 3.97Å; Y434-Y451 AromaticContact CE1-CE1 3.89Å; Y434-Y451 HydrophobicContact CE1-CE1 3.89Å; Y434-Y451 AromaticContact CE1-CE2 3.93Å; Y434-Y451 HydrophobicContact CE1-CE2 3.93Å; Y434-Y451 AromaticContact CE1-CZ 3.55Å; Y434-Y451 AromaticContact CE2-CD1 3.64Å; Y434-Y451 HydrophobicContact CE2-CD1 3.64Å; Y434-Y451 AromaticContact CE2-CE1 3.61Å; Y434-Y451 HydrophobicContact CE2-CE1 3.61Å; Y434-Y451 HydrophobicContact CE2-CG 4.13Å; Y434-Y451 HydrophobicContact CG-CE1 4.23Å; Y434-Y451 AromaticContact CZ-CD1 3.76Å; Y434-Y451 AromaticContact CZ-CD2 3.93Å; Y434-Y451 AromaticContact CZ-CE1 3.55Å; Y434-Y451 AromaticContact CZ-CE2 3.77Å; Y434-Y451 AromaticContact CZ-CG 3.93Å; Y434-Y451 AromaticContact CZ-CZ 3.57Å; Y434-Y451 WeakPolarHBondContact O-CE1 3.1Å; Y434-Y451 PolarHBondContact O-OH 3.16Å; Y434-Y451 VanDerWaalsContact OH-CD2 3.28Å; Y434-Y451 WeakPolarHBondContact OH-CD2 3.24Å; Y434-Y451 WeakPolarHBondContact OH-CE2 3.18Å; Y434-I454 HydrophobicContact CD2-CD1 3.46Å; Y434-I454 VanDerWaalsContact CD2-CD1 3.46Å; Y434-I454 HydrophobicContact CE2-CD1 3.52Å; Y434-I454 HydrophobicContact CE2-CG1 4.31Å; Y434-H459 AromaticContact CE1-CE1 3.7Å; Y434-H459 AromaticContact CE1-ND1 3.41Å; Y434-H459 WeakPolarHBondContact CE1-ND1 3.24Å; Y434-H459 AromaticContact CZ-ND1 3.5Å; Y434-H459 PolarHBondContact OH-CE1 3.11Å; Y434-H459 PolarHBondContact OH-ND1 3.42Å
435	S	97.2	Very high	96.1	Very high	6 Å²	6	26.2 Å²	26.2	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-64.7	-39.8	-178.9	-53	0	0	0	0	112	M386 F431 M432 G433 T437 A438	M386-S435 WeakPolarHBondContact CB-OG 3.44Å; F431-S435 WeakPolarHBondContact O-CB 3.44Å; F431-S435 PolarHBondContact O-N 2.73Å; F431-S435 PolarHBondContact O-OG 2.88Å; M432-S435 PolarHBondContact O-N 2.61Å; G433-S435 PolarHBondContact O-N 2.96Å; S435-T437 VanDerWaalsContact C-N 3.3Å; S435-T437 PolarHBondContact O-N 3.03Å; S435-A438 PolarHBondContact O-N 3.27Å
436	M	96.4	Very high	96.1	Very high	15 Å²	15	27.1 Å²	27.1	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-68.4	-26	178.3	-71	-52.8	-54.5	0	0	113.2	W276 L281 M432 G433 Y434 A438 F439 C440	W276-M436 HydrophobicContact CH2-CB 4.27Å; W276-M436 HydrophobicContact CZ3-CB 4.21Å; L281-M436 HydrophobicContact CD2-CE 3.67Å; L281-M436 HydrophobicContact CD2-CG 4.44Å; L281-M436 HydrophobicContact CD2-SD 3.98Å; M432-M436 WeakPolarHBondContact O-CB 3.18Å; M432-M436 VanDerWaalsContact O-CG 3.27Å; M432-M436 WeakPolarHBondContact O-CG 3.36Å; M432-M436 PolarHBondContact O-N 2.6Å; G433-M436 PolarHBondContact O-N 3.25Å; Y434-M436 VanDerWaalsContact C-N 3.35Å; Y434-M436 PolarHBondContact O-N 3.46Å; M436-A438 VanDerWaalsContact C-N 3.33Å; M436-A438 PolarHBondContact O-N 2.97Å; M436-F439 HydrophobicContact CE-CB 3.96Å; M436-F439 HydrophobicContact CE-CD1 3.55Å; M436-F439 HydrophobicContact CE-CE1 4.26Å; M436-F439 HydrophobicContact CE-CG 3.87Å; M436-F439 WeakPolarHBondContact O-CB 3.4Å; M436-F439 PolarHBondContact O-N 3.04Å; M436-F439 VanDerWaalsContact O-N 3.15Å; M436-F439 HydrophobicContact SD-CB 4.33Å; M436-F439 HydrophobicContact SD-CG 4.45Å; M436-C440 VanDerWaalsContact CE-SG 3.59Å; M436-C440 WeakPolarHBondContact O-CB 3.26Å; M436-C440 PolarHBondContact O-N 3.46Å
437	T	97.3	Very high	96.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-53	-51.4	175	-60.6	0	0	0	0	110.9	G433 Y434 S435 L441 W447 V450 Y451	G433-T437 PolarHBondContact O-N 3.15Å; G433-T437 PolarHBondContact O-OG1 3.39Å; Y434-T437 VanDerWaalsContact O-CB 3.26Å; Y434-T437 WeakPolarHBondContact O-CB 3.24Å; Y434-T437 PolarHBondContact O-N 3.21Å; Y434-T437 PolarHBondContact O-OG1 2.98Å; S435-T437 VanDerWaalsContact C-N 3.3Å; S435-T437 PolarHBondContact O-N 3.03Å; T437-L441 HydrophobicContact CG2-CD1 3.76Å; T437-L441 VanDerWaalsContact O-CB 3.27Å; T437-L441 WeakPolarHBondContact O-CB 3.07Å; T437-L441 VanDerWaalsContact O-CG 3.29Å; T437-L441 WeakPolarHBondContact O-CG 3Å; T437-L441 PolarHBondContact O-N 2.77Å; T437-L441 VanDerWaalsContact O-N 3.09Å; T437-W447 HydrophobicContact CG2-CB 4.49Å; T437-V450 HydrophobicContact CG2-CB 3.8Å; T437-V450 HydrophobicContact CG2-CG1 3.74Å; T437-V450 HydrophobicContact CG2-CG2 4.22Å; T437-Y451 HydrophobicContact CG2-CD1 4.25Å; T437-Y451 HydrophobicContact CG2-CE1 3.97Å
438	A	96.8	Very high	96.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-44	177.5	0	0	0	0	0	111.6	G379 V382 S435 M436 C440 F442 W447 Y451	G379-A438 CarbonylContact C-O 3.56Å; G379-A438 WeakPolarHBondContact CA-O 3.42Å; G379-A438 CarbonylContact O-C 3.59Å; V382-A438 HydrophobicContact CB-CB 3.85Å; V382-A438 HydrophobicContact CG1-CB 3.68Å; S435-A438 PolarHBondContact O-N 3.27Å; M436-A438 VanDerWaalsContact C-N 3.33Å; M436-A438 PolarHBondContact O-N 2.97Å; A438-C440 PolarHBondContact O-N 3.48Å; A438-F442 PolarHBondContact O-N 3.47Å; A438-W447 HydrophobicContact CB-CB 4.18Å; A438-W447 HydrophobicContact CB-CD2 4.36Å; A438-W447 HydrophobicContact CB-CG 4.06Å; A438-Y451 WeakPolarHBondContact CB-OH 3.27Å
439	F	96.1	Very high	96.2	Very high	20 Å²	20	26.5 Å²	26.5	9%	0.088	12%	0.122	C	C	.	.	H	α-helix	trans	-58.5	-45.3	-179.7	-170.7	-82	0	0	0	113	H374 Y380 C383 F384 M436 F442	H374-F439 HydrophobicContact CB-CE2 4.46Å; H374-F439 AromaticContact CE1-CZ 3.7Å; H374-F439 AromaticContact CG-CE2 3.93Å; H374-F439 AromaticContact ND1-CE2 3.88Å; H374-F439 AromaticContact ND1-CZ 3.56Å; Y380-F439 HydrophobicContact CD1-CD1 4.49Å; Y380-F439 AromaticContact CD1-CD2 3.52Å; Y380-F439 HydrophobicContact CD1-CD2 3.52Å; Y380-F439 HydrophobicContact CD1-CE1 4.47Å; Y380-F439 AromaticContact CD1-CE2 3.49Å; Y380-F439 HydrophobicContact CD1-CE2 3.49Å; Y380-F439 VanDerWaalsContact CD1-CE2 3.49Å; Y380-F439 HydrophobicContact CD1-CG 4.04Å; Y380-F439 AromaticContact CD1-CZ 3.99Å; Y380-F439 HydrophobicContact CD1-CZ 3.99Å; Y380-F439 HydrophobicContact CE1-CD1 4.15Å; Y380-F439 AromaticContact CE1-CD2 3.95Å; Y380-F439 HydrophobicContact CE1-CD2 3.95Å; Y380-F439 AromaticContact CE1-CE1 3.92Å; Y380-F439 HydrophobicContact CE1-CE1 3.92Å; Y380-F439 AromaticContact CE1-CE2 3.69Å; Y380-F439 HydrophobicContact CE1-CE2 3.69Å; Y380-F439 HydrophobicContact CE1-CG 4.16Å; Y380-F439 AromaticContact CE1-CZ 3.67Å; Y380-F439 HydrophobicContact CE1-CZ 3.67Å; C383-F439 HydrophobicContact CB-CB 3.85Å; C383-F439 HydrophobicContact CB-CD2 4.03Å; C383-F439 HydrophobicContact CB-CG 4.45Å; F384-F439 HydrophobicContact CE2-CE2 4.15Å; F384-F439 HydrophobicContact CZ-CE2 4.46Å; M436-F439 HydrophobicContact CE-CB 3.96Å; M436-F439 HydrophobicContact CE-CD1 3.55Å; M436-F439 HydrophobicContact CE-CE1 4.26Å; M436-F439 HydrophobicContact CE-CG 3.87Å; M436-F439 WeakPolarHBondContact O-CB 3.4Å; M436-F439 PolarHBondContact O-N 3.04Å; M436-F439 VanDerWaalsContact O-N 3.15Å; M436-F439 HydrophobicContact SD-CB 4.33Å; M436-F439 HydrophobicContact SD-CG 4.45Å; F439-F442 WeakPolarHBondContact O-CD1 3.46Å; F439-F442 VanDerWaalsContact O-CE1 3.27Å; F439-F442 WeakPolarHBondContact O-CE1 3.43Å
440	C	95.4	Very high	96.2	Very high	8 Å²	8	26.2 Å²	26.2	5%	0.054	12%	0.121	C	C	.	.	H	α-helix	trans	-85.4	-25.7	-173.9	-67	0	0	0	0	113.8	W276 M436 A438 F442	W276-C440 HydrophobicContact CH2-CB 3.89Å; W276-C440 HydrophobicContact CZ2-CB 3.8Å; M436-C440 VanDerWaalsContact CE-SG 3.59Å; M436-C440 WeakPolarHBondContact O-CB 3.26Å; M436-C440 PolarHBondContact O-N 3.46Å; A438-C440 PolarHBondContact O-N 3.48Å; C440-F442 WeakPolarHBondContact O-CD2 3.27Å; C440-F442 WeakPolarHBondContact O-CE2 3.33Å
441	L	95.4	Very high	96.2	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-88.6	-10	178.8	-66.1	178.9	0	0	0	113.5	E253 L257 T437 T443 K446 W447 V450	E253-L441 HydrophobicContact CB-CD2 4.16Å; L257-L441 HydrophobicContact CD1-CD2 4.07Å; L257-L441 HydrophobicContact CD2-CD1 4.05Å; L257-L441 HydrophobicContact CD2-CD2 4.37Å; L257-L441 HydrophobicContact CG-CD2 4.23Å; T437-L441 HydrophobicContact CG2-CD1 3.76Å; T437-L441 VanDerWaalsContact O-CB 3.27Å; T437-L441 WeakPolarHBondContact O-CB 3.07Å; T437-L441 VanDerWaalsContact O-CG 3.29Å; T437-L441 WeakPolarHBondContact O-CG 3Å; T437-L441 PolarHBondContact O-N 2.77Å; T437-L441 VanDerWaalsContact O-N 3.09Å; L441-T443 PolarHBondContact O-N 3.1Å; L441-K446 HydrophobicContact CB-CB 3.91Å; L441-K446 HydrophobicContact CD1-CB 4.45Å; L441-K446 WeakPolarHBondContact O-CD 3.48Å; L441-W447 HydrophobicContact CB-CB 4.14Å; L441-W447 HydrophobicContact CD1-CB 4.29Å; L441-V450 HydrophobicContact CD1-CG2 3.63Å
442	F	92.4	Very high	96.2	Very high	12 Å²	12	31 Å²	31	5%	0.053	14%	0.141	C	C	.	.			trans	61.9	-63.8	174.8	-50.8	-61.2	0	0	0	115.7	Y137 H377 G379 Y380 A438 F439 C440	Y137-F442 AromaticContact CD2-CZ 3.96Å; Y137-F442 HydrophobicContact CD2-CZ 3.96Å; Y137-F442 HydrophobicContact CG-CZ 4.43Å; H377-F442 HydrophobicContact CB-CB 3.93Å; H377-F442 WeakPolarHBondContact CB-O 3.38Å; G379-F442 WeakPolarHBondContact CA-O 3.37Å; G379-F442 PolarHBondContact N-O 3.45Å; Y380-F442 HydrophobicContact CE1-CD1 4.15Å; Y380-F442 HydrophobicContact CE1-CE1 4.03Å; Y380-F442 HydrophobicContact CE2-CD1 4.35Å; Y380-F442 AromaticContact CZ-CD1 3.78Å; Y380-F442 AromaticContact CZ-CE1 3.75Å; Y380-F442 WeakPolarHBondContact OH-CE1 3.48Å; A438-F442 PolarHBondContact O-N 3.47Å; F439-F442 WeakPolarHBondContact O-CD1 3.46Å; F439-F442 VanDerWaalsContact O-CE1 3.27Å; F439-F442 WeakPolarHBondContact O-CE1 3.43Å; C440-F442 WeakPolarHBondContact O-CD2 3.27Å; C440-F442 WeakPolarHBondContact O-CE2 3.33Å
443	T	92.9	Very high	96.2	Very high	27 Å²	27	30.3 Å²	30.3	17%	0.166	14%	0.139	C	C	.	.	S	Bend	trans	-91.2	146.8	-167.7	65.1	0	0	0	0	112.6	L441 D445 K446 W447	L441-T443 PolarHBondContact O-N 3.1Å; T443-D445 VanDerWaalsContact C-N 3.3Å; T443-D445 WeakPolarHBondContact CB-OD1 3.3Å; T443-D445 PolarHBondContact O-N 3.18Å; T443-D445 PolarHBondContact OG1-OD1 3.18Å; T443-K446 PolarHBondContact O-N 3.3Å; T443-K446 VanDerWaalsContact O-N 3.16Å; T443-K446 WeakPolarHBondContact OG1-CG 3.28Å; T443-W447 VanDerWaalsContact C-CD1 3.43Å; T443-W447 PolarHBondContact O-N 2.69Å; T443-W447 PolarHBondContact O-NE1 3.18Å
444	W	94.3	Very high	96.3	Very high	153 Å²	153	30.3 Å²	30.3	58%	0.58	14%	0.139	S	C	*	.	H	α-helix	trans	-53.2	-44.9	-177.1	154.4	-86.3	0	0	0	112.9	S378 K446 W447 L448	S378-W444 PolarHBondContact OG-N 3.37Å; W444-K446 VanDerWaalsContact C-N 3.3Å; W444-K446 PolarHBondContact O-N 2.94Å; W444-W447 VanDerWaalsContact CA-NE1 3.35Å; W444-W447 HydrophobicContact CB-CZ2 4.18Å; W444-W447 HydrophobicContact CD2-CH2 4.31Å; W444-W447 HydrophobicContact CD2-CZ2 4.25Å; W444-W447 AromaticContact CE3-CH2 3.25Å; W444-W447 HydrophobicContact CE3-CH2 3.25Å; W444-W447 AromaticContact CE3-CZ2 3.42Å; W444-W447 HydrophobicContact CE3-CZ2 3.42Å; W444-W447 VanDerWaalsContact CE3-CZ2 3.42Å; W444-W447 HydrophobicContact CE3-CZ3 4.16Å; W444-W447 AromaticContact CZ3-CH2 3.55Å; W444-W447 HydrophobicContact CZ3-CH2 3.55Å; W444-W447 HydrophobicContact CZ3-CZ2 4.19Å; W444-W447 HydrophobicContact CZ3-CZ3 4.29Å; W444-L448 HydrophobicContact CD2-CB 4.42Å; W444-L448 HydrophobicContact CD2-CD2 4.18Å; W444-L448 VanDerWaalsContact CE2-CD2 3.45Å; W444-L448 HydrophobicContact CE3-CD1 4.19Å; W444-L448 HydrophobicContact CH2-CD1 3.53Å; W444-L448 HydrophobicContact CH2-CD2 3.72Å; W444-L448 HydrophobicContact CH2-CG 4.21Å; W444-L448 HydrophobicContact CZ2-CD1 3.97Å; W444-L448 HydrophobicContact CZ2-CD2 3.21Å; W444-L448 HydrophobicContact CZ2-CG 4.13Å; W444-L448 HydrophobicContact CZ3-CD1 3.66Å; W444-L448 HydrophobicContact CZ3-CD2 4.4Å; W444-L448 WeakPolarHBondContact O-CB 3.41Å; W444-L448 PolarHBondContact O-N 3Å
445	D	95.1	Very high	96.2	Very high	103 Å²	103	38 Å²	38	55%	0.551	17%	0.169	S	C	*	.	H	α-helix	trans	-58.1	-41.5	-179.5	57.3	-63.9	0	0	0	112.4	T443 K449	T443-D445 VanDerWaalsContact C-N 3.3Å; T443-D445 WeakPolarHBondContact CB-OD1 3.3Å; T443-D445 PolarHBondContact O-N 3.18Å; T443-D445 PolarHBondContact OG1-OD1 3.18Å; D445-K449 PolarHBondContact O-N 3.16Å
446	K	96	Very high	96.3	Very high	44 Å²	44	40.8 Å²	40.8	19%	0.191	18%	0.181	C	C	.	.	H	α-helix	trans	-72.4	-59.7	-178.4	-68.2	-179.6	177.4	-172.6	0	112	G135 N136 L257 L441 T443 W444 L448 K449 V450	G135-K446 PolarHBondContact O-NZ 2.95Å; N136-K446 PolarHBondContact OD1-NZ 2.97Å; L257-K446 HydrophobicContact CD1-CB 4.47Å; L257-K446 HydrophobicContact CD1-CD 4.13Å; L257-K446 HydrophobicContact CD1-CG 4.17Å; L257-K446 HydrophobicContact CD2-CB 3.98Å; L257-K446 HydrophobicContact CD2-CG 4.38Å; L441-K446 HydrophobicContact CB-CB 3.91Å; L441-K446 HydrophobicContact CD1-CB 4.45Å; L441-K446 WeakPolarHBondContact O-CD 3.48Å; T443-K446 PolarHBondContact O-N 3.3Å; T443-K446 VanDerWaalsContact O-N 3.16Å; T443-K446 WeakPolarHBondContact OG1-CG 3.28Å; W444-K446 VanDerWaalsContact C-N 3.3Å; W444-K446 PolarHBondContact O-N 2.94Å; K446-L448 VanDerWaalsContact C-N 3.29Å; K446-L448 PolarHBondContact O-N 3.42Å; K446-K449 WeakPolarHBondContact O-CB 3.12Å; K446-K449 PolarHBondContact O-N 3.1Å; K446-V450 PolarHBondContact O-N 2.85Å
447	W	97.1	Very high	96.3	Very high	14 Å²	14	42 Å²	42	5%	0.053	19%	0.187	C	C	.	.	H	α-helix	trans	-69.9	-28.3	-174.7	62	-108.8	0	0	0	112.8	S378 V382 T437 A438 L441 T443 W444 K449 V450 Y451	S378-W447 PolarHBondContact OG-NE1 3.26Å; S378-W447 VanDerWaalsContact OG-NE1 3.1Å; V382-W447 HydrophobicContact CG2-CH2 3.87Å; V382-W447 HydrophobicContact CG2-CZ2 3.72Å; T437-W447 HydrophobicContact CG2-CB 4.49Å; A438-W447 HydrophobicContact CB-CB 4.18Å; A438-W447 HydrophobicContact CB-CD2 4.36Å; A438-W447 HydrophobicContact CB-CG 4.06Å; L441-W447 HydrophobicContact CB-CB 4.14Å; L441-W447 HydrophobicContact CD1-CB 4.29Å; T443-W447 VanDerWaalsContact C-CD1 3.43Å; T443-W447 PolarHBondContact O-N 2.69Å; T443-W447 PolarHBondContact O-NE1 3.18Å; W444-W447 VanDerWaalsContact CA-NE1 3.35Å; W444-W447 HydrophobicContact CB-CZ2 4.18Å; W444-W447 HydrophobicContact CD2-CH2 4.31Å; W444-W447 HydrophobicContact CD2-CZ2 4.25Å; W444-W447 AromaticContact CE3-CH2 3.25Å; W444-W447 HydrophobicContact CE3-CH2 3.25Å; W444-W447 AromaticContact CE3-CZ2 3.42Å; W444-W447 HydrophobicContact CE3-CZ2 3.42Å; W444-W447 VanDerWaalsContact CE3-CZ2 3.42Å; W444-W447 HydrophobicContact CE3-CZ3 4.16Å; W444-W447 AromaticContact CZ3-CH2 3.55Å; W444-W447 HydrophobicContact CZ3-CH2 3.55Å; W444-W447 HydrophobicContact CZ3-CZ2 4.19Å; W444-W447 HydrophobicContact CZ3-CZ3 4.29Å; W447-K449 VanDerWaalsContact C-N 3.35Å; W447-V450 PolarHBondContact O-N 3.42Å; W447-Y451 AromaticContact CE3-CD2 3.66Å; W447-Y451 HydrophobicContact CE3-CD2 3.66Å; W447-Y451 AromaticContact CE3-CE2 3.87Å; W447-Y451 HydrophobicContact CE3-CE2 3.87Å; W447-Y451 HydrophobicContact CE3-CG 4.26Å; W447-Y451 AromaticContact CZ3-CD2 3.85Å; W447-Y451 HydrophobicContact CZ3-CD2 3.85Å; W447-Y451 HydrophobicContact CZ3-CE2 4.14Å; W447-Y451 PolarHBondContact O-N 3.02Å
448	L	97.4	Very high	96.3	Very high	14 Å²	14	42 Å²	42	7%	0.073	19%	0.187	C	C	.	.	H	α-helix	trans	-67.7	-37.3	176.7	-170.3	80.2	0	0	0	111.6	W444 K446 V450 Y451 K452 F456	W444-L448 HydrophobicContact CD2-CB 4.42Å; W444-L448 HydrophobicContact CD2-CD2 4.18Å; W444-L448 VanDerWaalsContact CE2-CD2 3.45Å; W444-L448 HydrophobicContact CE3-CD1 4.19Å; W444-L448 HydrophobicContact CH2-CD1 3.53Å; W444-L448 HydrophobicContact CH2-CD2 3.72Å; W444-L448 HydrophobicContact CH2-CG 4.21Å; W444-L448 HydrophobicContact CZ2-CD1 3.97Å; W444-L448 HydrophobicContact CZ2-CD2 3.21Å; W444-L448 HydrophobicContact CZ2-CG 4.13Å; W444-L448 HydrophobicContact CZ3-CD1 3.66Å; W444-L448 HydrophobicContact CZ3-CD2 4.4Å; W444-L448 WeakPolarHBondContact O-CB 3.41Å; W444-L448 PolarHBondContact O-N 3Å; K446-L448 VanDerWaalsContact C-N 3.29Å; K446-L448 PolarHBondContact O-N 3.42Å; L448-V450 VanDerWaalsContact C-N 3.31Å; L448-V450 PolarHBondContact O-N 3.19Å; L448-Y451 PolarHBondContact O-N 3.07Å; L448-K452 HydrophobicContact CD2-CD 4.37Å; L448-K452 HydrophobicContact CG-CD 4.22Å; L448-K452 HydrophobicContact CG-CG 4.39Å; L448-K452 WeakPolarHBondContact O-CB 3.18Å; L448-K452 VanDerWaalsContact O-CG 3.29Å; L448-K452 WeakPolarHBondContact O-CG 3.15Å; L448-K452 PolarHBondContact O-N 3.33Å; L448-F456 HydrophobicContact CD1-CE1 3.98Å; L448-F456 HydrophobicContact CD1-CZ 3.6Å
449	K	96.9	Very high	96.4	Very high	77 Å²	77	43.6 Å²	43.6	34%	0.335	20%	0.195	S	C	.	.	H	α-helix	trans	-54.9	-51.1	173.9	-178.8	-177.7	173.1	-180	0	110.1	L257 D262 D445 K446 W447 Y451 K452 S453	L257-K449 PolarHBondContact O-NZ 3.43Å; D262-K449 WeakPolarHBondContact OD2-CE 3.45Å; D262-K449 IonicContact OD2-NZ 3.35Å; D262-K449 PolarHBondContact OD2-NZ 3.26Å; D445-K449 PolarHBondContact O-N 3.16Å; K446-K449 WeakPolarHBondContact O-CB 3.12Å; K446-K449 PolarHBondContact O-N 3.1Å; W447-K449 VanDerWaalsContact C-N 3.35Å; K449-Y451 PolarHBondContact O-N 3.04Å; K449-K452 PolarHBondContact O-N 2.91Å; K449-S453 PolarHBondContact O-N 2.76Å; K449-S453 VanDerWaalsContact O-N 3.1Å
450	V	97.4	Very high	96.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-43.5	179.6	-170.2	0	0	0	0	111.5	L256 L257 Y261 M273 T437 L441 K446 W447 L448 K452 S453 I454	L256-V450 HydrophobicContact CB-CG1 4.35Å; L256-V450 HydrophobicContact CB-CG2 3.93Å; L256-V450 HydrophobicContact CD2-CG1 4.48Å; L256-V450 WeakPolarHBondContact O-CG2 3.47Å; L257-V450 HydrophobicContact CD2-CG2 4.02Å; Y261-V450 HydrophobicContact CE1-CG1 4.2Å; M273-V450 HydrophobicContact CE-CG1 3.5Å; T437-V450 HydrophobicContact CG2-CB 3.8Å; T437-V450 HydrophobicContact CG2-CG1 3.74Å; T437-V450 HydrophobicContact CG2-CG2 4.22Å; L441-V450 HydrophobicContact CD1-CG2 3.63Å; K446-V450 PolarHBondContact O-N 2.85Å; W447-V450 PolarHBondContact O-N 3.42Å; L448-V450 VanDerWaalsContact C-N 3.31Å; L448-V450 PolarHBondContact O-N 3.19Å; V450-K452 VanDerWaalsContact C-N 3.34Å; V450-K452 PolarHBondContact O-N 3.25Å; V450-S453 PolarHBondContact O-N 2.72Å; V450-S453 PolarHBondContact O-OG 3.38Å; V450-I454 WeakPolarHBondContact O-CG1 3.16Å; V450-I454 PolarHBondContact O-N 3.12Å
451	Y	98	Very high	96.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-37.6	178.2	-79.7	8.2	0	0	0	113.2	V382 Y434 T437 A438 W447 L448 K449 S453 I454 Y455 F456 H459	V382-Y451 HydrophobicContact CG1-CE2 3.82Å; Y434-Y451 HydrophobicContact CD1-CE1 4.2Å; Y434-Y451 HydrophobicContact CD2-CD1 4.3Å; Y434-Y451 AromaticContact CD2-CE1 3.97Å; Y434-Y451 HydrophobicContact CD2-CE1 3.97Å; Y434-Y451 AromaticContact CE1-CE1 3.89Å; Y434-Y451 HydrophobicContact CE1-CE1 3.89Å; Y434-Y451 AromaticContact CE1-CE2 3.93Å; Y434-Y451 HydrophobicContact CE1-CE2 3.93Å; Y434-Y451 AromaticContact CE1-CZ 3.55Å; Y434-Y451 AromaticContact CE2-CD1 3.64Å; Y434-Y451 HydrophobicContact CE2-CD1 3.64Å; Y434-Y451 AromaticContact CE2-CE1 3.61Å; Y434-Y451 HydrophobicContact CE2-CE1 3.61Å; Y434-Y451 HydrophobicContact CE2-CG 4.13Å; Y434-Y451 HydrophobicContact CG-CE1 4.23Å; Y434-Y451 AromaticContact CZ-CD1 3.76Å; Y434-Y451 AromaticContact CZ-CD2 3.93Å; Y434-Y451 AromaticContact CZ-CE1 3.55Å; Y434-Y451 AromaticContact CZ-CE2 3.77Å; Y434-Y451 AromaticContact CZ-CG 3.93Å; Y434-Y451 AromaticContact CZ-CZ 3.57Å; Y434-Y451 WeakPolarHBondContact O-CE1 3.1Å; Y434-Y451 PolarHBondContact O-OH 3.16Å; Y434-Y451 VanDerWaalsContact OH-CD2 3.28Å; Y434-Y451 WeakPolarHBondContact OH-CD2 3.24Å; Y434-Y451 WeakPolarHBondContact OH-CE2 3.18Å; T437-Y451 HydrophobicContact CG2-CD1 4.25Å; T437-Y451 HydrophobicContact CG2-CE1 3.97Å; A438-Y451 WeakPolarHBondContact CB-OH 3.27Å; W447-Y451 AromaticContact CE3-CD2 3.66Å; W447-Y451 HydrophobicContact CE3-CD2 3.66Å; W447-Y451 AromaticContact CE3-CE2 3.87Å; W447-Y451 HydrophobicContact CE3-CE2 3.87Å; W447-Y451 HydrophobicContact CE3-CG 4.26Å; W447-Y451 AromaticContact CZ3-CD2 3.85Å; W447-Y451 HydrophobicContact CZ3-CD2 3.85Å; W447-Y451 HydrophobicContact CZ3-CE2 4.14Å; W447-Y451 PolarHBondContact O-N 3.02Å; L448-Y451 PolarHBondContact O-N 3.07Å; K449-Y451 PolarHBondContact O-N 3.04Å; Y451-S453 VanDerWaalsContact C-N 3.33Å; Y451-I454 CarbonylContact O-C 3.47Å; Y451-I454 PolarHBondContact O-N 3.05Å; Y451-Y455 PolarHBondContact O-N 3.28Å; Y451-Y455 VanDerWaalsContact O-N 3.12Å; Y451-F456 AromaticContact CD2-CD1 3.99Å; Y451-F456 HydrophobicContact CD2-CD1 3.99Å; Y451-F456 AromaticContact CD2-CE1 3.97Å; Y451-F456 HydrophobicContact CD2-CE1 3.97Å; Y451-F456 HydrophobicContact CG-CD1 4.37Å; Y451-F456 HydrophobicContact CG-CE1 4.39Å; Y451-F456 PolarHBondContact O-N 3.3Å; Y451-H459 AromaticContact CE2-CE1 3.59Å
452	K	97.3	Very high	96.7	Very high	123 Å²	123	49.7 Å²	49.7	54%	0.535	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-40.5	174.3	-77.2	173.9	175.9	179.3	0	111.5	L448 K449 V450 I454 Y455 F456	L448-K452 HydrophobicContact CD2-CD 4.37Å; L448-K452 HydrophobicContact CG-CD 4.22Å; L448-K452 HydrophobicContact CG-CG 4.39Å; L448-K452 WeakPolarHBondContact O-CB 3.18Å; L448-K452 VanDerWaalsContact O-CG 3.29Å; L448-K452 WeakPolarHBondContact O-CG 3.15Å; L448-K452 PolarHBondContact O-N 3.33Å; K449-K452 PolarHBondContact O-N 2.91Å; V450-K452 VanDerWaalsContact C-N 3.34Å; V450-K452 PolarHBondContact O-N 3.25Å; K452-I454 PolarHBondContact O-N 3.03Å; K452-Y455 PolarHBondContact O-N 3.36Å; K452-F456 HydrophobicContact CG-CE2 3.8Å; K452-F456 HydrophobicContact CG-CZ 4.15Å
453	S	96.8	Very high	97	Very high	12 Å²	12	52.6 Å²	52.6	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-28.1	-177.9	82.9	0	0	0	0	112.5	D262 R269 K449 V450 Y451	D262-S453 VanDerWaalsContact OD1-CB 3.28Å; D262-S453 WeakPolarHBondContact OD1-CB 3.34Å; R269-S453 PolarHBondContact NH1-O 3.22Å; R269-S453 VanDerWaalsContact NH1-O 3.08Å; R269-S453 PolarHBondContact NH2-O 2.83Å; K449-S453 PolarHBondContact O-N 2.76Å; K449-S453 VanDerWaalsContact O-N 3.1Å; V450-S453 PolarHBondContact O-N 2.72Å; V450-S453 PolarHBondContact O-OG 3.38Å; Y451-S453 VanDerWaalsContact C-N 3.33Å
454	I	97.1	Very high	97.3	Very high	1 Å²	1	54 Å²	54	1%	0.005	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	24.7	172.2	61	161.7	0	0	0	113.8	F266 R269 M273 Y434 V450 Y451 K452 F456 L457	F266-I454 HydrophobicContact CE2-CB 4.1Å; R269-I454 HydrophobicContact CB-CG2 3.85Å; M273-I454 HydrophobicContact CE-CD1 3.44Å; M273-I454 VanDerWaalsContact CE-CD1 3.44Å; M273-I454 HydrophobicContact CE-CG1 4.29Å; M273-I454 HydrophobicContact SD-CD1 3.62Å; Y434-I454 HydrophobicContact CD2-CD1 3.46Å; Y434-I454 VanDerWaalsContact CD2-CD1 3.46Å; Y434-I454 HydrophobicContact CE2-CD1 3.52Å; Y434-I454 HydrophobicContact CE2-CG1 4.31Å; V450-I454 WeakPolarHBondContact O-CG1 3.16Å; V450-I454 PolarHBondContact O-N 3.12Å; Y451-I454 CarbonylContact O-C 3.47Å; Y451-I454 PolarHBondContact O-N 3.05Å; K452-I454 PolarHBondContact O-N 3.03Å; I454-F456 PolarHBondContact O-N 3.09Å; I454-F456 VanDerWaalsContact O-N 3.09Å; I454-L457 WeakPolarHBondContact O-CB 3.41Å; I454-L457 PolarHBondContact O-N 3.43Å
455	Y	97.3	Very high	97.4	Very high	162 Å²	162	49 Å²	49	64%	0.635	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.4	172.4	-50.9	-78	0	0	0	115.1	F266 Y451 K452 L457	F266-Y455 AromaticContact CD2-CD2 3.87Å; F266-Y455 HydrophobicContact CD2-CD2 3.87Å; F266-Y455 HydrophobicContact CD2-CE2 4.04Å; F266-Y455 AromaticContact CE2-CD2 3.91Å; F266-Y455 HydrophobicContact CE2-CD2 3.91Å; Y451-Y455 PolarHBondContact O-N 3.28Å; Y451-Y455 VanDerWaalsContact O-N 3.12Å; K452-Y455 PolarHBondContact O-N 3.36Å; Y455-L457 PolarHBondContact O-N 2.84Å
456	F	97.9	Very high	97.5	Very high	66 Å²	66	46 Å²	46	29%	0.289	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.4	-177.5	-65.3	-96.9	0	0	0	113.8	L448 Y451 K452 I454 G458 H459 V460	L448-F456 HydrophobicContact CD1-CE1 3.98Å; L448-F456 HydrophobicContact CD1-CZ 3.6Å; Y451-F456 AromaticContact CD2-CD1 3.99Å; Y451-F456 HydrophobicContact CD2-CD1 3.99Å; Y451-F456 AromaticContact CD2-CE1 3.97Å; Y451-F456 HydrophobicContact CD2-CE1 3.97Å; Y451-F456 HydrophobicContact CG-CD1 4.37Å; Y451-F456 HydrophobicContact CG-CE1 4.39Å; Y451-F456 PolarHBondContact O-N 3.3Å; K452-F456 HydrophobicContact CG-CE2 3.8Å; K452-F456 HydrophobicContact CG-CZ 4.15Å; I454-F456 PolarHBondContact O-N 3.09Å; I454-F456 VanDerWaalsContact O-N 3.09Å; F456-G458 PolarHBondContact O-N 2.92Å; F456-H459 HydrophobicContact CB-CB 4.42Å; F456-H459 PolarHBondContact O-N 3.5Å; F456-V460 HydrophobicContact CB-CG2 4.42Å; F456-V460 PolarHBondContact O-N 3.42Å
457	L	97.8	Very high	97.5	Very high	41 Å²	41	50.4 Å²	50.4	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-42.7	-47.3	-174.9	178.8	65.6	0	0	0	113.6	F266 L430 F431 I454 Y455 F461	F266-L457 HydrophobicContact CZ-CD1 4.24Å; F266-L457 HydrophobicContact CZ-CD2 3.99Å; F266-L457 HydrophobicContact CZ-CG 4.48Å; L430-L457 HydrophobicContact CD2-CD2 4.05Å; F431-L457 HydrophobicContact CE1-CD2 4.46Å; F431-L457 HydrophobicContact CE1-CG 4.17Å; I454-L457 WeakPolarHBondContact O-CB 3.41Å; I454-L457 PolarHBondContact O-N 3.43Å; Y455-L457 PolarHBondContact O-N 2.84Å; L457-F461 WeakPolarHBondContact O-CB 3.4Å; L457-F461 PolarHBondContact O-N 3.22Å
458	G	97.4	Very high	97.5	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-50.2	178.9	0	0	0	0	0	113.7	F456 F461 F462	F456-G458 PolarHBondContact O-N 2.92Å; G458-F461 PolarHBondContact O-N 3.36Å; G458-F462 VanDerWaalsContact O-CD2 3.27Å; G458-F462 WeakPolarHBondContact O-CD2 3.14Å; G458-F462 PolarHBondContact O-N 3Å
459	H	98.1	Very high	97.4	Very high	32 Å²	32	54.2 Å²	54.2	15%	0.148	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-47.4	178.9	-70.1	81.4	0	0	0	111	M386 Y434 Y451 F456 F461 L463	M386-H459 VanDerWaalsContact SD-CE1 3.58Å; M386-H459 PolarHBondContact SD-NE2 3.33Å; Y434-H459 AromaticContact CE1-CE1 3.7Å; Y434-H459 AromaticContact CE1-ND1 3.41Å; Y434-H459 WeakPolarHBondContact CE1-ND1 3.24Å; Y434-H459 AromaticContact CZ-ND1 3.5Å; Y434-H459 PolarHBondContact OH-CE1 3.11Å; Y434-H459 PolarHBondContact OH-ND1 3.42Å; Y451-H459 AromaticContact CE2-CE1 3.59Å; F456-H459 HydrophobicContact CB-CB 4.42Å; F456-H459 PolarHBondContact O-N 3.5Å; H459-F461 PolarHBondContact O-N 3.35Å; H459-L463 HydrophobicContact CB-CD1 4.35Å; H459-L463 WeakPolarHBondContact O-CB 3.46Å; H459-L463 WeakPolarHBondContact O-CG 3.49Å; H459-L463 PolarHBondContact O-N 3.21Å
460	V	98.3	Very high	97.3	Very high	83 Å²	83	53.6 Å²	53.6	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-50.5	179.1	176.1	0	0	0	0	110.1	F456 S464	F456-V460 HydrophobicContact CB-CG2 4.42Å; F456-V460 PolarHBondContact O-N 3.42Å; V460-S464 VanDerWaalsContact O-CB 3.27Å; V460-S464 WeakPolarHBondContact O-CB 3.47Å; V460-S464 PolarHBondContact O-N 3.27Å; V460-S464 PolarHBondContact O-OG 3.3Å
461	F	98	Very high	97.2	Very high	72 Å²	72	62.1 Å²	62.1	32%	0.316	30%	0.299	S	S	.	.	H	α-helix	trans	-58.2	-54.1	-178.9	-177.8	-98.8	0	0	0	112.5	F431 L457 G458 H459 L465	F431-F461 HydrophobicContact CD2-CD1 4.38Å; F431-F461 HydrophobicContact CD2-CE1 4.41Å; F431-F461 HydrophobicContact CE1-CB 4.22Å; F431-F461 HydrophobicContact CE1-CD1 4.3Å; F431-F461 HydrophobicContact CE1-CG 4.38Å; F431-F461 AromaticContact CE2-CD1 3.49Å; F431-F461 HydrophobicContact CE2-CD1 3.49Å; F431-F461 VanDerWaalsContact CE2-CD1 3.49Å; F431-F461 AromaticContact CE2-CE1 3.55Å; F431-F461 HydrophobicContact CE2-CE1 3.55Å; F431-F461 HydrophobicContact CE2-CG 4.06Å; F431-F461 HydrophobicContact CE2-CZ 4.17Å; F431-F461 HydrophobicContact CZ-CB 3.86Å; F431-F461 AromaticContact CZ-CD1 3.44Å; F431-F461 HydrophobicContact CZ-CD1 3.44Å; F431-F461 VanDerWaalsContact CZ-CD1 3.44Å; F431-F461 HydrophobicContact CZ-CD2 4.19Å; F431-F461 AromaticContact CZ-CE1 3.95Å; F431-F461 HydrophobicContact CZ-CE1 3.95Å; F431-F461 AromaticContact CZ-CG 3.57Å; F431-F461 HydrophobicContact CZ-CG 3.57Å; L457-F461 WeakPolarHBondContact O-CB 3.4Å; L457-F461 PolarHBondContact O-N 3.22Å; G458-F461 PolarHBondContact O-N 3.36Å; H459-F461 PolarHBondContact O-N 3.35Å; F461-L465 HydrophobicContact CD1-CD1 3.9Å; F461-L465 HydrophobicContact CE1-CD1 3.38Å; F461-L465 HydrophobicContact CE1-CG 4.49Å; F461-L465 HydrophobicContact CE2-CD1 4.26Å; F461-L465 HydrophobicContact CZ-CD1 3.59Å; F461-L465 WeakPolarHBondContact O-CG 3.27Å; F461-L465 PolarHBondContact O-N 3.4Å
462	F	98.3	Very high	96.9	Very high	7 Å²	7	64.3 Å²	64.3	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-76.2	-32.1	-175.1	-73.5	-75.2	0	0	0	113.8	F330 M386 L389 I390 V393 F431 G458 L465 L466	F330-F462 HydrophobicContact CE2-CZ 4.26Å; F330-F462 HydrophobicContact CZ-CZ 4.18Å; M386-F462 HydrophobicContact CE-CD2 3.87Å; L389-F462 HydrophobicContact CD1-CB 4.41Å; L389-F462 HydrophobicContact CD2-CB 3.56Å; L389-F462 HydrophobicContact CG-CB 3.7Å; I390-F462 HydrophobicContact CB-CD1 4.45Å; I390-F462 HydrophobicContact CB-CE1 4.18Å; I390-F462 HydrophobicContact CB-CZ 4.31Å; I390-F462 HydrophobicContact CD1-CD2 4.3Å; I390-F462 HydrophobicContact CD1-CE2 3.84Å; I390-F462 HydrophobicContact CD1-CZ 4.11Å; I390-F462 HydrophobicContact CG1-CD1 3.97Å; I390-F462 HydrophobicContact CG1-CD2 3.7Å; I390-F462 HydrophobicContact CG1-CE1 3.81Å; I390-F462 HydrophobicContact CG1-CE2 3.52Å; I390-F462 HydrophobicContact CG1-CG 3.94Å; I390-F462 HydrophobicContact CG1-CZ 3.6Å; I390-F462 HydrophobicContact CG2-CE1 3.96Å; I390-F462 HydrophobicContact CG2-CZ 4.01Å; V393-F462 HydrophobicContact CB-CD1 3.88Å; V393-F462 HydrophobicContact CB-CE1 4.48Å; V393-F462 HydrophobicContact CG1-CD1 3.82Å; V393-F462 HydrophobicContact CG1-CE1 4.25Å; V393-F462 HydrophobicContact CG2-CB 4.46Å; V393-F462 HydrophobicContact CG2-CD1 4.13Å; V393-F462 WeakPolarHBondContact CG2-O 3.37Å; F431-F462 HydrophobicContact CB-CE2 3.66Å; F431-F462 HydrophobicContact CB-CZ 4.08Å; F431-F462 HydrophobicContact CD1-CD2 4.45Å; F431-F462 AromaticContact CD1-CE2 3.72Å; F431-F462 HydrophobicContact CD1-CE2 3.72Å; F431-F462 AromaticContact CD2-CE2 3.5Å; F431-F462 HydrophobicContact CD2-CE2 3.5Å; F431-F462 AromaticContact CD2-CZ 3.6Å; F431-F462 HydrophobicContact CD2-CZ 3.6Å; F431-F462 HydrophobicContact CE1-CE2 4.19Å; F431-F462 AromaticContact CE2-CE2 3.99Å; F431-F462 HydrophobicContact CE2-CE2 3.99Å; F431-F462 HydrophobicContact CE2-CZ 4.14Å; F431-F462 HydrophobicContact CG-CD2 4.46Å; F431-F462 AromaticContact CG-CE2 3.36Å; F431-F462 HydrophobicContact CG-CE2 3.36Å; F431-F462 AromaticContact CG-CZ 3.88Å; F431-F462 HydrophobicContact CG-CZ 3.88Å; F431-F462 HydrophobicContact CZ-CE2 4.31Å; G458-F462 VanDerWaalsContact O-CD2 3.27Å; G458-F462 WeakPolarHBondContact O-CD2 3.14Å; G458-F462 PolarHBondContact O-N 3Å; F462-L465 PolarHBondContact O-N 2.73Å; F462-L466 WeakPolarHBondContact O-CB 3.3Å; F462-L466 PolarHBondContact O-N 3.31Å
463	L	98.1	Very high	96.7	Very high	74 Å²	74	61 Å²	61	39%	0.387	30%	0.299	S	S	.	.	H	α-helix	trans	-67	-42.9	173.2	-70.1	171.8	0	0	0	110.8	L389 H459 L465 L466 F467	L389-L463 HydrophobicContact CD1-CD2 4.18Å; L389-L463 HydrophobicContact CD2-CD2 3.99Å; L389-L463 HydrophobicContact CD2-CG 4.05Å; H459-L463 HydrophobicContact CB-CD1 4.35Å; H459-L463 WeakPolarHBondContact O-CB 3.46Å; H459-L463 WeakPolarHBondContact O-CG 3.49Å; H459-L463 PolarHBondContact O-N 3.21Å; L463-L465 VanDerWaalsContact C-N 3.34Å; L463-L465 PolarHBondContact O-N 2.87Å; L463-L466 WeakPolarHBondContact O-CB 3.39Å; L463-L466 PolarHBondContact O-N 3.18Å; L463-F467 WeakPolarHBondContact O-CD2 3.47Å; L463-F467 PolarHBondContact O-N 3.1Å
464	S	97.9	Very high	96.4	Very high	57 Å²	57	67.3 Å²	67.3	40%	0.399	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-47.5	173.2	-66.1	0	0	0	0	111.2	V460 L466 F467 I468	V460-S464 VanDerWaalsContact O-CB 3.27Å; V460-S464 WeakPolarHBondContact O-CB 3.47Å; V460-S464 PolarHBondContact O-N 3.27Å; V460-S464 PolarHBondContact O-OG 3.3Å; S464-L466 PolarHBondContact O-N 3.49Å; S464-F467 PolarHBondContact O-N 2.66Å; S464-I468 VanDerWaalsContact O-CB 3.3Å; S464-I468 WeakPolarHBondContact O-CB 3.47Å; S464-I468 WeakPolarHBondContact O-CD1 3.04Å; S464-I468 WeakPolarHBondContact O-CG1 3.29Å; S464-I468 PolarHBondContact O-N 3.16Å
465	L	97.8	Very high	96.1	Very high	46 Å²	46	71.3 Å²	71.3	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-39.6	178.1	-72.3	-179.9	0	0	0	113.3	V393 F461 F462 L463 F467 I468 L469	V393-L465 HydrophobicContact CG1-CB 3.67Å; V393-L465 HydrophobicContact CG1-CD1 3.79Å; V393-L465 HydrophobicContact CG1-CG 4.41Å; V393-L465 HydrophobicContact CG2-CB 4.34Å; F461-L465 HydrophobicContact CD1-CD1 3.9Å; F461-L465 HydrophobicContact CE1-CD1 3.38Å; F461-L465 HydrophobicContact CE1-CG 4.49Å; F461-L465 HydrophobicContact CE2-CD1 4.26Å; F461-L465 HydrophobicContact CZ-CD1 3.59Å; F461-L465 WeakPolarHBondContact O-CG 3.27Å; F461-L465 PolarHBondContact O-N 3.4Å; F462-L465 PolarHBondContact O-N 2.73Å; L463-L465 VanDerWaalsContact C-N 3.34Å; L463-L465 PolarHBondContact O-N 2.87Å; L465-F467 PolarHBondContact O-N 3.3Å; L465-I468 PolarHBondContact O-N 3.26Å; L465-L469 HydrophobicContact CB-CD1 4.2Å; L465-L469 HydrophobicContact CB-CG 4.43Å; L465-L469 HydrophobicContact CD2-CG 4.46Å; L465-L469 VanDerWaalsContact O-CB 3.29Å; L465-L469 WeakPolarHBondContact O-CB 3.43Å; L465-L469 VanDerWaalsContact O-CG 3.24Å; L465-L469 WeakPolarHBondContact O-CG 3.48Å; L465-L469 PolarHBondContact O-N 3.21Å
466	L	97.2	Very high	95.7	Very high	41 Å²	41	67 Å²	67	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-55.8	-41.4	178.1	178.6	68.3	0	0	0	111.9	L389 I392 V393 F462 L463 S464 P470	L389-L466 HydrophobicContact CD1-CB 4.17Å; L389-L466 HydrophobicContact CD1-CD2 3.79Å; L389-L466 HydrophobicContact CD1-CG 4.39Å; I392-L466 HydrophobicContact CG2-CD1 3.57Å; V393-L466 HydrophobicContact CG2-CB 4.02Å; V393-L466 HydrophobicContact CG2-CD1 4.45Å; F462-L466 WeakPolarHBondContact O-CB 3.3Å; F462-L466 PolarHBondContact O-N 3.31Å; L463-L466 WeakPolarHBondContact O-CB 3.39Å; L463-L466 PolarHBondContact O-N 3.18Å; S464-L466 PolarHBondContact O-N 3.49Å; L466-P470 VanDerWaalsContact O-CD 3.27Å; L466-P470 WeakPolarHBondContact O-CD 3.19Å
467	F	96.4	Very high	95.2	Very high	136 Å²	136	65 Å²	65	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-85.3	-33.3	179.9	-64.9	-64.5	0	0	0	112.9	L463 S464 L465 Y471	L463-F467 WeakPolarHBondContact O-CD2 3.47Å; L463-F467 PolarHBondContact O-N 3.1Å; S464-F467 PolarHBondContact O-N 2.66Å; L465-F467 PolarHBondContact O-N 3.3Å; F467-Y471 WeakPolarHBondContact O-CD2 3.45Å; F467-Y471 WeakPolarHBondContact O-CE2 3.43Å
468	I	96.9	Very high	94.2	Very high	90 Å²	90	65.6 Å²	65.6	46%	0.462	34%	0.344	S	S	.	.	H	α-helix	trans	-77.6	-44.2	-176.3	-68.7	168	0	0	0	112.2	S464 L465 P470 Y471 V472	S464-I468 VanDerWaalsContact O-CB 3.3Å; S464-I468 WeakPolarHBondContact O-CB 3.47Å; S464-I468 WeakPolarHBondContact O-CD1 3.04Å; S464-I468 WeakPolarHBondContact O-CG1 3.29Å; S464-I468 PolarHBondContact O-N 3.16Å; L465-I468 PolarHBondContact O-N 3.26Å; I468-P470 VanDerWaalsContact C-CD 3.49Å; I468-Y471 PolarHBondContact O-N 3.39Å; I468-V472 HydrophobicContact CG2-CG2 3.67Å; I468-V472 PolarHBondContact O-N 3.28Å; I468-V472 VanDerWaalsContact O-N 3.11Å
469	L	95.7	Very high	93.1	Very high	19 Å²	19	73.3 Å²	73.3	10%	0.099	37%	0.373	C	S	.	.	H	α-helix	trans	-56.5	-38.9	-172.1	-74.8	173.8	0	0	0	114.4	V393 Q396 A397 L400 L465 Y471 V472 H473	V393-L469 HydrophobicContact CG1-CD1 3.9Å; Q396-L469 HydrophobicContact CB-CB 4.28Å; Q396-L469 HydrophobicContact CB-CD1 3.87Å; A397-L469 HydrophobicContact CB-CD1 4.14Å; L400-L469 HydrophobicContact CD2-CD2 3.77Å; L465-L469 HydrophobicContact CB-CD1 4.2Å; L465-L469 HydrophobicContact CB-CG 4.43Å; L465-L469 HydrophobicContact CD2-CG 4.46Å; L465-L469 VanDerWaalsContact O-CB 3.29Å; L465-L469 WeakPolarHBondContact O-CB 3.43Å; L465-L469 VanDerWaalsContact O-CG 3.24Å; L465-L469 WeakPolarHBondContact O-CG 3.48Å; L465-L469 PolarHBondContact O-N 3.21Å; L469-Y471 VanDerWaalsContact C-N 3.33Å; L469-Y471 PolarHBondContact O-N 3.36Å; L469-V472 PolarHBondContact O-N 3.48Å; L469-H473 VanDerWaalsContact O-CB 3.25Å; L469-H473 WeakPolarHBondContact O-CB 3.28Å; L469-H473 PolarHBondContact O-N 2.92Å
470	P	94.3	Very high	91.2	Very high	64 Å²	64	80.7 Å²	80.7	42%	0.416	41%	0.405	S	S	.	.	H	α-helix	trans	-60.3	-37.6	174.9	-26.3	36.1	0	0	0	114	L466 I468 K474	L466-P470 VanDerWaalsContact O-CD 3.27Å; L466-P470 WeakPolarHBondContact O-CD 3.19Å; I468-P470 VanDerWaalsContact C-CD 3.49Å; P470-K474 PolarHBondContact O-N 3.36Å; P470-K474 VanDerWaalsContact O-N 3.11Å
471	Y	94.3	Very high	89.1	Confident	179 Å²	179	84 Å²	84	70%	0.702	42%	0.415	S	S	*	.	H	α-helix	trans	-72.6	-42.5	177.5	-61.3	-78	0	0	0	111.5	F467 I468 L469 H473 K474 A475	F467-Y471 WeakPolarHBondContact O-CD2 3.45Å; F467-Y471 WeakPolarHBondContact O-CE2 3.43Å; I468-Y471 PolarHBondContact O-N 3.39Å; L469-Y471 VanDerWaalsContact C-N 3.33Å; L469-Y471 PolarHBondContact O-N 3.36Å; Y471-H473 VanDerWaalsContact C-N 3.29Å; Y471-H473 PolarHBondContact O-N 3.24Å; Y471-K474 PolarHBondContact O-N 3.18Å; Y471-A475 PolarHBondContact O-N 2.75Å
472	V	93.2	Very high	86.8	Confident	46 Å²	46	87.5 Å²	87.5	28%	0.279	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-41.8	174.9	178.6	0	0	0	0	110.5	L400 I468 L469 K474 A475 M476	L400-V472 HydrophobicContact CD1-CG1 4.47Å; L400-V472 HydrophobicContact CD2-CB 4.35Å; L400-V472 HydrophobicContact CD2-CG1 3.76Å; I468-V472 HydrophobicContact CG2-CG2 3.67Å; I468-V472 PolarHBondContact O-N 3.28Å; I468-V472 VanDerWaalsContact O-N 3.11Å; L469-V472 PolarHBondContact O-N 3.48Å; V472-K474 PolarHBondContact O-N 3.31Å; V472-A475 PolarHBondContact O-N 3.42Å; V472-A475 VanDerWaalsContact O-N 3.13Å; V472-M476 HydrophobicContact CG1-CG 4Å; V472-M476 HydrophobicContact CG1-SD 3.46Å; V472-M476 WeakPolarHBondContact CG1-SD 3.29Å; V472-M476 WeakPolarHBondContact O-CB 2.89Å; V472-M476 WeakPolarHBondContact O-CG 3.48Å; V472-M476 PolarHBondContact O-N 2.94Å
473	H	91.9	Very high	84.5	Confident	54 Å²	54	91.7 Å²	91.7	25%	0.25	45%	0.452	C	S	.	.	H	α-helix	trans	-58.3	-48.5	174.9	-176.2	-76.7	0	0	0	112.2	L400 Q403 L469 Y471 A475 M476 V477	L400-H473 HydrophobicContact CD1-CB 4.09Å; Q403-H473 PolarHBondContact OE1-CE1 3.36Å; Q403-H473 PolarHBondContact OE1-NE2 3.09Å; L469-H473 VanDerWaalsContact O-CB 3.25Å; L469-H473 WeakPolarHBondContact O-CB 3.28Å; L469-H473 PolarHBondContact O-N 2.92Å; Y471-H473 VanDerWaalsContact C-N 3.29Å; Y471-H473 PolarHBondContact O-N 3.24Å; H473-A475 PolarHBondContact O-N 3.14Å; H473-M476 PolarHBondContact O-N 2.93Å; H473-V477 VanDerWaalsContact O-CB 3.25Å; H473-V477 WeakPolarHBondContact O-CB 3.39Å; H473-V477 WeakPolarHBondContact O-CG2 2.93Å; H473-V477 PolarHBondContact O-N 3.08Å
474	K	90.5	Very high	82.1	Confident	143 Å²	143	96.3 Å²	96.3	62%	0.622	47%	0.469	S	S	*	.	H	α-helix	trans	-60.6	-30.8	176.1	-171.6	179.5	178.4	-176.1	0	113.3	P470 Y471 V472	P470-K474 PolarHBondContact O-N 3.36Å; P470-K474 VanDerWaalsContact O-N 3.11Å; Y471-K474 PolarHBondContact O-N 3.18Å; V472-K474 PolarHBondContact O-N 3.31Å
475	A	90.6	Very high	79.7	Confident	86 Å²	86	102.4 Å²	102.4	71%	0.711	49%	0.488	S	S	*	.	H	α-helix	trans	-81.8	-39.6	179.6	0	0	0	0	0	113.2	Y471 V472 H473	Y471-A475 PolarHBondContact O-N 2.75Å; V472-A475 PolarHBondContact O-N 3.42Å; V472-A475 VanDerWaalsContact O-N 3.13Å; H473-A475 PolarHBondContact O-N 3.14Å
476	M	88.6	Confident	77.4	Confident	70 Å²	70	108 Å²	108	35%	0.345	52%	0.515	S	S	.	.	H	α-helix	trans	-97.6	-13.2	-171.1	-64.1	-171.5	73.6	0	0	114.7	L400 S404 L407 V472 H473	L400-M476 HydrophobicContact CD1-CB 4.3Å; S404-M476 PolarHBondContact OG-O 3.25Å; S404-M476 VanDerWaalsContact OG-O 3.11Å; L407-M476 HydrophobicContact CD1-CE 3.79Å; L407-M476 HydrophobicContact CD1-SD 4.07Å; L407-M476 HydrophobicContact CD2-CE 3.91Å; L407-M476 HydrophobicContact CG-CE 3.61Å; V472-M476 HydrophobicContact CG1-CG 4Å; V472-M476 HydrophobicContact CG1-SD 3.46Å; V472-M476 WeakPolarHBondContact CG1-SD 3.29Å; V472-M476 WeakPolarHBondContact O-CB 2.89Å; V472-M476 WeakPolarHBondContact O-CG 3.48Å; V472-M476 PolarHBondContact O-N 2.94Å; H473-M476 PolarHBondContact O-N 2.93Å
477	V	87.8	Confident	74.8	Confident	26 Å²	26	116.5 Å²	116.5	16%	0.158	55%	0.554	C	S	.	*	S	Bend	trans	-103.4	119.4	178.9	-178.5	0	0	0	0	109.5	L400 Q403 H473 R479	L400-V477 HydrophobicContact CD1-CG2 4.19Å; Q403-V477 HydrophobicContact CB-CG1 3.99Å; Q403-V477 HydrophobicContact CB-CG2 3.96Å; H473-V477 VanDerWaalsContact O-CB 3.25Å; H473-V477 WeakPolarHBondContact O-CB 3.39Å; H473-V477 WeakPolarHBondContact O-CG2 2.93Å; H473-V477 PolarHBondContact O-N 3.08Å; V477-R479 PolarHBondContact O-N 3.35Å
478	P	77.2	Confident	73.7	Confident	53 Å²	53	115.6 Å²	115.6	34%	0.344	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-58.2	134.4	178.4	-21.2	30.7	0	0	0	111.6	P405 L483	P405-P478 HydrophobicContact CG-CG 4.35Å; P478-L483 HydrophobicContact CB-CD1 4.3Å; P478-L483 HydrophobicContact CB-CG 4.36Å
479	R	74.1	Confident	72.5	Confident	161 Å²	161	116.9 Å²	116.9	61%	0.608	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-63.6	138.6	169.4	-72.2	-174.9	-179.7	179.1	1	109.3	V477 E481 K482	V477-R479 PolarHBondContact O-N 3.35Å; R479-E481 PolarHBondContact O-N 3.1Å; R479-K482 PolarHBondContact O-N 3.33Å
480	K	59	Low	71.2	Confident	188 Å²	188	122.3 Å²	122.3	82%	0.817	58%	0.582	S	S	*	*	H	α-helix	trans	-49.1	-30.4	179.2	-79.5	-175.4	173	-176.6	0	114.2
481	E	52.9	Low	69.8	Low	153 Å²	153	125.8 Å²	125.8	72%	0.715	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-26.8	176.4	-69.4	176.8	157.7	0	0	114.4	R479	R479-E481 PolarHBondContact O-N 3.1Å
482	K	50.4	Low	68.3	Low	144 Å²	144	122.4 Å²	122.4	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-78.6	-31.4	176.3	-78.1	-171.2	173.5	-173.3	0	112.3	R479 K484 K485 M486	R479-K482 PolarHBondContact O-N 3.33Å; K482-K484 VanDerWaalsContact C-N 3.35Å; K482-K485 PolarHBondContact O-N 3.42Å; K482-K485 VanDerWaalsContact O-N 3.15Å; K482-M486 WeakPolarHBondContact O-CG 3.46Å; K482-M486 PolarHBondContact O-N 3.35Å
483	L	50.5	Low	66.6	Low	96 Å²	96	127.5 Å²	127.5	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-64	-39.8	174.6	-80	153.4	0	0	0	111.4	P478 K485 M486 E487	P478-L483 HydrophobicContact CB-CD1 4.3Å; P478-L483 HydrophobicContact CB-CG 4.36Å; L483-K485 PolarHBondContact O-N 2.88Å; L483-M486 PolarHBondContact O-N 3.46Å; L483-M486 VanDerWaalsContact O-N 3.14Å; L483-E487 PolarHBondContact O-N 3.14Å
484	K	46.7	Very low	64.8	Low	171 Å²	171	132.8 Å²	132.8	74%	0.743	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-11.9	172.6	-85.3	-169.4	173.4	-171.1	0	115.7	K482	K482-K484 VanDerWaalsContact C-N 3.35Å
485	K	48.2	Very low	62.9	Low	185 Å²	185	132 Å²	132	80%	0.804	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-5.4	174.7	-78.7	-172.1	174.3	-174.3	0	112.6	K482 L483	K482-K485 PolarHBondContact O-N 3.42Å; K482-K485 VanDerWaalsContact O-N 3.15Å; L483-K485 PolarHBondContact O-N 2.88Å
486	M	49.4	Very low	60.6	Low	163 Å²	163	135.8 Å²	135.8	80%	0.803	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-14.1	-179.7	-69.2	178.3	71.2	0	0	112.5	K482 L483	K482-M486 WeakPolarHBondContact O-CG 3.46Å; K482-M486 PolarHBondContact O-N 3.35Å; L483-M486 PolarHBondContact O-N 3.46Å; L483-M486 VanDerWaalsContact O-N 3.14Å
487	E	41.9	Very low	58	Low	220 Å²	220	141.8 Å²	141.8	100%	1.028	65%	0.65	S	S	*	*			trans	-81.9	0	152.8	-69.8	176.4	165.4	0	0	109.2	L483	L483-E487 PolarHBondContact O-N 3.14Å

Retrieved 487 of 487 residues in 424.7 ms (Link to these results)

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