A0A087XZW6_POEFO Loading...

Membrane bound O-acyltransferase domain containing 2

AlphaFold DB , UniProt , Accession A0A087XZW6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 506 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	30.7	Very low	47.8	Very low	252 Å²	252	107.5 Å²	107.5	100%	1.241	66%	0.657	S	S	*	*				0	84.5	0	-76.2	-177.4	-179.6	0	0	108.2
2	A	27.4	Very low	51.4	Low	97 Å²	97	101.3 Å²	101.3	80%	0.802	62%	0.621	S	S	*	*			trans	-100.5	115.5	167.2	0	0	0	0	0	105.6	Q4	A2-Q4 PolarHBondContact O-N 3.36Å
3	T	29.1	Very low	54.6	Low	134 Å²	134	101 Å²	101	82%	0.822	62%	0.62	S	S	*	*			trans	-60	101.9	176.7	37.5	0	0	0	0	109.2	T5	T3-T5 VanDerWaalsContact C-N 3.31Å; T3-T5 PolarHBondContact O-N 3.25Å
4	Q	31.9	Very low	57.3	Low	179 Å²	179	102.8 Å²	102.8	84%	0.836	62%	0.623	S	S	*	*			trans	-62.5	98.5	157.9	-77.2	177.6	-14.8	0	0	106.5	A2 T6	A2-Q4 PolarHBondContact O-N 3.36Å; Q4-T6 PolarHBondContact O-N 3.24Å
5	T	32.6	Very low	59.8	Low	135 Å²	135	98 Å²	98	83%	0.828	59%	0.592	S	S	*	*			trans	-66.5	86.7	161.4	34.9	0	0	0	0	106.9	T3 A7	T3-T5 VanDerWaalsContact C-N 3.31Å; T3-T5 PolarHBondContact O-N 3.25Å; T5-A7 PolarHBondContact O-N 3.37Å; T5-A7 VanDerWaalsContact O-N 3.15Å
6	T	39.3	Very low	61.8	Low	117 Å²	117	96.1 Å²	96.1	72%	0.718	58%	0.575	S	S	*	*			trans	-53.8	115.9	159.3	39.6	0	0	0	0	106.3	Q4 S8	Q4-T6 PolarHBondContact O-N 3.24Å; T6-S8 PolarHBondContact O-N 3.21Å
7	A	46.8	Very low	63.7	Low	82 Å²	82	95.1 Å²	95.1	68%	0.678	57%	0.571	S	S	*	*			trans	-52.8	110	170.9	0	0	0	0	0	106.8	T5 C9	T5-A7 PolarHBondContact O-N 3.37Å; T5-A7 VanDerWaalsContact O-N 3.15Å; A7-C9 PolarHBondContact O-N 3.19Å; A7-C9 VanDerWaalsContact O-N 3.1Å
8	S	56.7	Low	65.3	Low	99 Å²	99	94.4 Å²	94.4	69%	0.692	56%	0.563	S	S	*	*			trans	-65.6	117.7	-171.6	56.4	0	0	0	0	108.3	T6 T10	T6-S8 PolarHBondContact O-N 3.21Å; S8-T10 PolarHBondContact O-N 3.38Å; S8-T10 VanDerWaalsContact O-N 3.17Å
9	C	65.5	Low	66.7	Low	32 Å²	32	90.1 Å²	90.1	22%	0.216	54%	0.538	C	S	.	.			trans	-55.3	124.7	168.3	-177.5	0	0	0	0	107.3	A7 G11 L26	A7-C9 PolarHBondContact O-N 3.19Å; A7-C9 VanDerWaalsContact O-N 3.1Å; C9-G11 PolarHBondContact O-N 3.3Å; C9-L26 HydrophobicContact CB-CB 4.41Å; C9-L26 HydrophobicContact CB-CD2 3.58Å; C9-L26 HydrophobicContact CB-CG 4.15Å
10	T	79.1	Confident	67.9	Low	42 Å²	42	92.3 Å²	92.3	26%	0.258	54%	0.542	S	S	.	.	S	Bend	trans	-74.4	-17.5	-177.8	59.4	0	0	0	0	112.4	S8 F75 G76 Y78 F124	S8-T10 PolarHBondContact O-N 3.38Å; S8-T10 VanDerWaalsContact O-N 3.17Å; T10-F75 CarbonylContact O-C 3.41Å; T10-G76 VanDerWaalsContact O-CA 3.27Å; T10-G76 WeakPolarHBondContact O-CA 3.47Å; T10-G76 PolarHBondContact O-N 2.95Å; T10-Y78 HydrophobicContact CG2-CD2 3.76Å; T10-Y78 HydrophobicContact CG2-CE2 3.43Å; T10-Y78 VanDerWaalsContact CG2-CE2 3.43Å; T10-F124 HydrophobicContact CG2-CE1 3.91Å; T10-F124 HydrophobicContact CG2-CZ 4.02Å
11	G	86.6	Confident	69.1	Low	13 Å²	13	94.6 Å²	94.6	13%	0.134	55%	0.551	C	S	.	*	S	Bend	trans	-93.3	-156.5	177.8	0	0	0	0	0	114.1	C9 F73 C74	C9-G11 PolarHBondContact O-N 3.3Å; G11-F73 WeakPolarHBondContact CA-O 3.34Å; G11-C74 WeakPolarHBondContact CA-O 3.39Å
12	S	91.1	Very high	71.8	Confident	33 Å²	33	86.4 Å²	86.4	23%	0.231	51%	0.511	C	S	.	.			trans	-66.5	139	179.8	-171.4	0	0	0	0	112.4	L14 N30 F73	S12-L14 WeakPolarHBondContact OG-CB 3.48Å; S12-L14 PolarHBondContact OG-N 3.33Å; S12-N30 PolarHBondContact O-ND2 2.97Å; S12-F73 PolarHBondContact N-O 3.23Å
13	T	92.6	Very high	74.6	Confident	98 Å²	98	87 Å²	87	60%	0.601	50%	0.501	S	S	*	.			trans	-93	4	171.4	56.3	0	0	0	0	113.1	L15 Q16 L26	T13-L15 PolarHBondContact O-N 3.34Å; T13-Q16 VanDerWaalsContact O-CB 3.22Å; T13-Q16 WeakPolarHBondContact O-CB 3.36Å; T13-Q16 PolarHBondContact O-N 3.06Å; T13-Q16 VanDerWaalsContact O-N 3.09Å; T13-L26 HydrophobicContact CG2-CD2 4.33Å
14	L	93.2	Very high	77.2	Confident	126 Å²	126	82.6 Å²	82.6	66%	0.66	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-33.8	-175.3	-174.3	69	0	0	0	112.9	S12 F73	S12-L14 WeakPolarHBondContact OG-CB 3.48Å; S12-L14 PolarHBondContact OG-N 3.33Å; L14-F73 HydrophobicContact CD2-CE2 4.27Å
15	L	93.9	Very high	79.9	Confident	31 Å²	31	77 Å²	77	16%	0.162	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	13.7	-177.7	-53.4	-176.2	0	0	0	113.4	T13 P17 I18 S19 L26 V29 A33 F73	T13-L15 PolarHBondContact O-N 3.34Å; L15-P17 VanDerWaalsContact C-CD 3.45Å; L15-P17 VanDerWaalsContact C-N 3.34Å; L15-I18 HydrophobicContact CD2-CD1 4.05Å; L15-I18 PolarHBondContact O-N 3.09Å; L15-S19 PolarHBondContact O-N 2.65Å; L15-L26 VanDerWaalsContact C-CD1 3.49Å; L15-L26 HydrophobicContact CB-CD1 4.04Å; L15-V29 HydrophobicContact CB-CG1 4.12Å; L15-V29 HydrophobicContact CD1-CG1 4.23Å; L15-A33 HydrophobicContact CD1-CB 3.43Å; L15-A33 VanDerWaalsContact CD1-CB 3.43Å; L15-F73 HydrophobicContact CD1-CE1 4.19Å; L15-F73 HydrophobicContact CD1-CZ 4.16Å; L15-F73 HydrophobicContact CG-CZ 4.16Å
16	Q	92.6	Very high	82.6	Confident	68 Å²	68	71.2 Å²	71.2	32%	0.318	42%	0.415	S	S	.	.	H	α-helix	trans	-52	-44.4	176.3	-175.3	65.2	32.8	0	0	113	T13 I18 S19 E20	T13-Q16 VanDerWaalsContact O-CB 3.22Å; T13-Q16 WeakPolarHBondContact O-CB 3.36Å; T13-Q16 PolarHBondContact O-N 3.06Å; T13-Q16 VanDerWaalsContact O-N 3.09Å; Q16-I18 VanDerWaalsContact C-N 3.26Å; Q16-I18 PolarHBondContact O-N 3.08Å; Q16-S19 WeakPolarHBondContact O-CB 3.49Å; Q16-S19 PolarHBondContact O-N 2.71Å; Q16-E20 WeakPolarHBondContact CG-OE1 3.46Å; Q16-E20 PolarHBondContact NE2-OE1 3.3Å; Q16-E20 WeakPolarHBondContact O-CG 3.49Å; Q16-E20 PolarHBondContact O-N 3.49Å
17	P	94.3	Very high	84.9	Confident	79 Å²	79	66.8 Å²	66.8	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-35.2	178.1	-23.4	34.9	0	0	0	113	L15 I21	L15-P17 VanDerWaalsContact C-CD 3.45Å; L15-P17 VanDerWaalsContact C-N 3.34Å; P17-I21 WeakPolarHBondContact O-CD1 3.32Å; P17-I21 WeakPolarHBondContact O-CG1 3.45Å; P17-I21 PolarHBondContact O-N 3.06Å; P17-I21 VanDerWaalsContact O-N 3.17Å
18	I	92.3	Very high	86.9	Confident	83 Å²	83	66.2 Å²	66.2	43%	0.426	37%	0.371	S	S	.	.	H	α-helix	trans	-70.9	-43.8	178.7	-59.6	-178.4	0	0	0	110.1	L15 Q16 E20 I21 I22 V29	L15-I18 HydrophobicContact CD2-CD1 4.05Å; L15-I18 PolarHBondContact O-N 3.09Å; Q16-I18 VanDerWaalsContact C-N 3.26Å; Q16-I18 PolarHBondContact O-N 3.08Å; I18-E20 VanDerWaalsContact C-N 3.29Å; I18-E20 PolarHBondContact O-N 3.44Å; I18-I21 PolarHBondContact O-N 3.03Å; I18-I22 HydrophobicContact CG2-CD1 4.12Å; I18-I22 WeakPolarHBondContact O-CG1 3.41Å; I18-I22 PolarHBondContact O-N 3.06Å; I18-V29 HydrophobicContact CB-CG1 4.39Å; I18-V29 HydrophobicContact CG2-CG1 4.02Å
19	S	91.1	Very high	88.6	Confident	11 Å²	11	62.1 Å²	62.1	8%	0.077	34%	0.341	C	S	.	.	H	α-helix	trans	-55.4	-43.8	176.1	170.8	0	0	0	0	112.1	L15 Q16 D23 L24 L26	L15-S19 PolarHBondContact O-N 2.65Å; Q16-S19 WeakPolarHBondContact O-CB 3.49Å; Q16-S19 PolarHBondContact O-N 2.71Å; S19-D23 PolarHBondContact O-N 3.49Å; S19-D23 VanDerWaalsContact O-N 3.1Å; S19-L24 WeakPolarHBondContact CB-O 3.32Å; S19-L24 PolarHBondContact O-N 3.13Å; S19-L24 PolarHBondContact OG-O 3.05Å; S19-L26 WeakPolarHBondContact OG-CA 3.15Å; S19-L26 PolarHBondContact OG-N 3.04Å
20	E	92	Very high	89.9	Confident	134 Å²	134	60.6 Å²	60.6	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-67.6	-38	177	-70.5	169.4	-172.7	0	0	112.8	Q16 I18	Q16-E20 WeakPolarHBondContact CG-OE1 3.46Å; Q16-E20 PolarHBondContact NE2-OE1 3.3Å; Q16-E20 WeakPolarHBondContact O-CG 3.49Å; Q16-E20 PolarHBondContact O-N 3.49Å; I18-E20 VanDerWaalsContact C-N 3.29Å; I18-E20 PolarHBondContact O-N 3.44Å
21	I	91.9	Very high	90.6	Very high	141 Å²	141	60.2 Å²	60.2	72%	0.723	33%	0.326	S	S	*	.	H	α-helix	trans	-67.3	-40.2	178.9	-71.1	164.1	0	0	0	111.9	P17 I18	P17-I21 WeakPolarHBondContact O-CD1 3.32Å; P17-I21 WeakPolarHBondContact O-CG1 3.45Å; P17-I21 PolarHBondContact O-N 3.06Å; P17-I21 VanDerWaalsContact O-N 3.17Å; I18-I21 PolarHBondContact O-N 3.03Å
22	I	87.1	Confident	90.9	Very high	81 Å²	81	61.7 Å²	61.7	42%	0.415	33%	0.332	S	S	.	.	H	α-helix	trans	-97.4	0.8	-173.2	73	-174.2	0	0	0	113.9	I18 L24 V29	I18-I22 HydrophobicContact CG2-CD1 4.12Å; I18-I22 WeakPolarHBondContact O-CG1 3.41Å; I18-I22 PolarHBondContact O-N 3.06Å; I22-L24 VanDerWaalsContact C-N 3.29Å; I22-L24 HydrophobicContact CD1-CB 4.18Å; I22-L24 HydrophobicContact CD1-CD1 3.84Å; I22-L24 HydrophobicContact CD1-CG 4.26Å; I22-L24 HydrophobicContact CG1-CB 3.89Å; I22-L24 HydrophobicContact CG1-CD1 4.1Å; I22-L24 HydrophobicContact CG1-CG 3.99Å; I22-L24 PolarHBondContact O-N 3.32Å; I22-V29 HydrophobicContact CD1-CG2 3.8Å; I22-V29 HydrophobicContact CG1-CG2 4.42Å
23	D	86.3	Confident	91.1	Very high	108 Å²	108	61.8 Å²	61.8	58%	0.578	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	44.2	-179.1	-174.8	49.5	0	0	0	112.6	S19 R258	S19-D23 PolarHBondContact O-N 3.49Å; S19-D23 VanDerWaalsContact O-N 3.1Å; D23-R258 IonicContact OD2-CZ 3.81Å; D23-R258 IonicContact OD2-NH1 3.8Å; D23-R258 PolarHBondContact OD2-NH1 2.69Å; D23-R258 IonicContact OD2-NH2 3.96Å; D23-R258 PolarHBondContact OD2-NH2 2.89Å
24	L	85.6	Confident	91.3	Very high	42 Å²	42	57.4 Å²	57.4	22%	0.22	31%	0.308	C	S	.	.			trans	-123.3	144.6	174.7	-68.6	179.6	0	0	0	111.1	S19 I22 L26 V29	S19-L24 WeakPolarHBondContact CB-O 3.32Å; S19-L24 PolarHBondContact O-N 3.13Å; S19-L24 PolarHBondContact OG-O 3.05Å; I22-L24 VanDerWaalsContact C-N 3.29Å; I22-L24 HydrophobicContact CD1-CB 4.18Å; I22-L24 HydrophobicContact CD1-CD1 3.84Å; I22-L24 HydrophobicContact CD1-CG 4.26Å; I22-L24 HydrophobicContact CG1-CB 3.89Å; I22-L24 HydrophobicContact CG1-CD1 4.1Å; I22-L24 HydrophobicContact CG1-CG 3.99Å; I22-L24 PolarHBondContact O-N 3.32Å; L24-L26 PolarHBondContact O-N 2.9Å; L24-V29 HydrophobicContact CB-CG2 4.01Å
25	P	88	Confident	91.5	Very high	63 Å²	63	51.7 Å²	51.7	41%	0.409	28%	0.278	S	S	.	.			trans	-52.6	133.1	173.7	-28.3	37.2	0	0	0	112.8	D27 Q28 V29	P25-D27 WeakPolarHBondContact CB-OD1 3.35Å; P25-D27 PolarHBondContact O-N 3.07Å; P25-Q28 HydrophobicContact CB-CG 4.19Å; P25-Q28 WeakPolarHBondContact O-CB 3.48Å; P25-Q28 PolarHBondContact O-N 3.48Å; P25-V29 WeakPolarHBondContact O-CG2 3.32Å; P25-V29 PolarHBondContact O-N 2.97Å; P25-V29 VanDerWaalsContact O-N 3.12Å
26	L	89	Confident	91.6	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-55.1	-37.6	-174.1	172.1	60.8	0	0	0	113.2	C9 T13 L15 S19 L24 V29 N30	C9-L26 HydrophobicContact CB-CB 4.41Å; C9-L26 HydrophobicContact CB-CD2 3.58Å; C9-L26 HydrophobicContact CB-CG 4.15Å; T13-L26 HydrophobicContact CG2-CD2 4.33Å; L15-L26 VanDerWaalsContact C-CD1 3.49Å; L15-L26 HydrophobicContact CB-CD1 4.04Å; S19-L26 WeakPolarHBondContact OG-CA 3.15Å; S19-L26 PolarHBondContact OG-N 3.04Å; L24-L26 PolarHBondContact O-N 2.9Å; L26-V29 WeakPolarHBondContact O-CB 3.34Å; L26-V29 PolarHBondContact O-N 3.26Å; L26-N30 WeakPolarHBondContact O-CB 3.36Å; L26-N30 VanDerWaalsContact O-CG 3.29Å; L26-N30 PolarHBondContact O-N 3.38Å
27	D	87.6	Confident	91.9	Very high	23 Å²	23	54.8 Å²	54.8	12%	0.123	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-37.1	177.8	59.5	-16.3	0	0	0	113.3	P25 F31 S130 A131	P25-D27 WeakPolarHBondContact CB-OD1 3.35Å; P25-D27 PolarHBondContact O-N 3.07Å; D27-F31 WeakPolarHBondContact O-CB 3.36Å; D27-F31 PolarHBondContact O-N 3.32Å; D27-S130 VanDerWaalsContact OD2-C 3.26Å; D27-S130 WeakPolarHBondContact OD2-CA 3.46Å; D27-S130 WeakPolarHBondContact OD2-CB 3.23Å; D27-A131 HydrophobicContact CB-CB 3.74Å; D27-A131 PolarHBondContact OD2-N 2.9Å
28	Q	89.2	Confident	92.1	Very high	71 Å²	71	51 Å²	51	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-67.6	-39.8	171.1	-62.3	-177.8	9.6	0	0	111.1	P25 F31 V32	P25-Q28 HydrophobicContact CB-CG 4.19Å; P25-Q28 WeakPolarHBondContact O-CB 3.48Å; P25-Q28 PolarHBondContact O-N 3.48Å; Q28-F31 PolarHBondContact O-N 3.21Å; Q28-V32 WeakPolarHBondContact O-CG2 3.45Å; Q28-V32 PolarHBondContact O-N 3.29Å
29	V	91.8	Very high	92.4	Very high	12 Å²	12	48.1 Å²	48.1	7%	0.073	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-47.8	175	-178.2	0	0	0	0	110.9	L15 I18 I22 L24 P25 L26 F31 V32 A33	L15-V29 HydrophobicContact CB-CG1 4.12Å; L15-V29 HydrophobicContact CD1-CG1 4.23Å; I18-V29 HydrophobicContact CB-CG1 4.39Å; I18-V29 HydrophobicContact CG2-CG1 4.02Å; I22-V29 HydrophobicContact CD1-CG2 3.8Å; I22-V29 HydrophobicContact CG1-CG2 4.42Å; L24-V29 HydrophobicContact CB-CG2 4.01Å; P25-V29 WeakPolarHBondContact O-CG2 3.32Å; P25-V29 PolarHBondContact O-N 2.97Å; P25-V29 VanDerWaalsContact O-N 3.12Å; L26-V29 WeakPolarHBondContact O-CB 3.34Å; L26-V29 PolarHBondContact O-N 3.26Å; V29-F31 VanDerWaalsContact C-N 3.33Å; V29-F31 PolarHBondContact O-N 3Å; V29-V32 PolarHBondContact O-N 3.35Å; V29-A33 VanDerWaalsContact O-CB 3.27Å; V29-A33 WeakPolarHBondContact O-CB 3.39Å; V29-A33 PolarHBondContact O-N 3Å
30	N	93.6	Very high	92.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-45.9	175.5	-75.5	-17.8	0	0	0	111.4	S12 L26 A33 C34 F73	S12-N30 PolarHBondContact O-ND2 2.97Å; L26-N30 WeakPolarHBondContact O-CB 3.36Å; L26-N30 VanDerWaalsContact O-CG 3.29Å; L26-N30 PolarHBondContact O-N 3.38Å; N30-A33 PolarHBondContact O-N 2.97Å; N30-C34 WeakPolarHBondContact O-CB 3.38Å; N30-C34 PolarHBondContact O-N 2.92Å; N30-C34 PolarHBondContact O-SG 3.35Å; N30-C34 VanDerWaalsContact O-SG 3.34Å; N30-F73 HydrophobicContact CB-CD1 4.41Å; N30-F73 HydrophobicContact CB-CE1 4.11Å
31	F	93.1	Very high	93	Very high	34 Å²	34	48.8 Å²	48.8	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-59.1	-49.5	178.5	-177.9	-87.9	0	0	0	112	D27 Q28 V29 C34 Q35 L193 A194 V297	D27-F31 WeakPolarHBondContact O-CB 3.36Å; D27-F31 PolarHBondContact O-N 3.32Å; Q28-F31 PolarHBondContact O-N 3.21Å; V29-F31 VanDerWaalsContact C-N 3.33Å; V29-F31 PolarHBondContact O-N 3Å; F31-C34 PolarHBondContact O-N 3.45Å; F31-Q35 HydrophobicContact CD1-CG 4.24Å; F31-Q35 HydrophobicContact CE1-CG 3.99Å; F31-Q35 HydrophobicContact CZ-CG 4.41Å; F31-Q35 VanDerWaalsContact O-CG 3.26Å; F31-Q35 WeakPolarHBondContact O-CG 3.32Å; F31-Q35 PolarHBondContact O-N 2.98Å; F31-L193 HydrophobicContact CD2-CB 4.46Å; F31-L193 HydrophobicContact CE2-CB 3.9Å; F31-A194 HydrophobicContact CZ-CB 3.91Å; F31-V297 HydrophobicContact CE1-CG1 3.81Å; F31-V297 HydrophobicContact CE1-CG2 3.96Å; F31-V297 HydrophobicContact CZ-CG1 3.69Å
32	V	93.7	Very high	93.3	Very high	45 Å²	45	42 Å²	42	27%	0.273	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-44.1	179.5	175.3	0	0	0	0	111.1	Q28 V29 C34 Q35 L36 F296	Q28-V32 WeakPolarHBondContact O-CG2 3.45Å; Q28-V32 PolarHBondContact O-N 3.29Å; V29-V32 PolarHBondContact O-N 3.35Å; V32-C34 VanDerWaalsContact C-N 3.33Å; V32-C34 PolarHBondContact O-N 3.41Å; V32-Q35 PolarHBondContact O-N 3.06Å; V32-L36 HydrophobicContact CG1-CD1 4.16Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.38Å; V32-L36 PolarHBondContact O-N 2.77Å; V32-F296 HydrophobicContact CG1-CZ 4.32Å; V32-F296 HydrophobicContact CG2-CE1 4.01Å; V32-F296 HydrophobicContact CG2-CZ 4.34Å
33	A	95.4	Very high	93.8	Very high	35 Å²	35	41.6 Å²	41.6	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-59.6	-42.9	177.7	0	0	0	0	0	111.9	L15 V29 N30 L36 F37	L15-A33 HydrophobicContact CD1-CB 3.43Å; L15-A33 VanDerWaalsContact CD1-CB 3.43Å; V29-A33 VanDerWaalsContact O-CB 3.27Å; V29-A33 WeakPolarHBondContact O-CB 3.39Å; V29-A33 PolarHBondContact O-N 3Å; N30-A33 PolarHBondContact O-N 2.97Å; A33-L36 PolarHBondContact O-N 3.2Å; A33-F37 WeakPolarHBondContact O-CB 3.29Å; A33-F37 PolarHBondContact O-N 2.86Å
34	C	96.5	Very high	94.4	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-36.7	176	-74.8	0	0	0	0	113.2	N30 F31 V32 F37 A38 L70 F73 C74 L193	N30-C34 WeakPolarHBondContact O-CB 3.38Å; N30-C34 PolarHBondContact O-N 2.92Å; N30-C34 PolarHBondContact O-SG 3.35Å; N30-C34 VanDerWaalsContact O-SG 3.34Å; F31-C34 PolarHBondContact O-N 3.45Å; V32-C34 VanDerWaalsContact C-N 3.33Å; V32-C34 PolarHBondContact O-N 3.41Å; C34-F37 PolarHBondContact O-N 2.84Å; C34-A38 VanDerWaalsContact O-CB 3.26Å; C34-A38 WeakPolarHBondContact O-CB 3.33Å; C34-A38 PolarHBondContact O-N 2.96Å; C34-L70 HydrophobicContact CB-CD2 3.76Å; C34-F73 WeakPolarHBondContact SG-CD1 3.45Å; C34-C74 PolarHBondContact SG-SG 2.97Å; C34-L193 HydrophobicContact CB-CD1 3.61Å
35	Q	96.6	Very high	94.9	Very high	6 Å²	6	39.2 Å²	39.2	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-66.3	-41.1	174.3	-66.9	-79.2	8.4	0	0	111.5	F31 V32 A38 L39 L193 L300 I304	F31-Q35 HydrophobicContact CD1-CG 4.24Å; F31-Q35 HydrophobicContact CE1-CG 3.99Å; F31-Q35 HydrophobicContact CZ-CG 4.41Å; F31-Q35 VanDerWaalsContact O-CG 3.26Å; F31-Q35 WeakPolarHBondContact O-CG 3.32Å; F31-Q35 PolarHBondContact O-N 2.98Å; V32-Q35 PolarHBondContact O-N 3.06Å; Q35-A38 WeakPolarHBondContact O-CB 3.1Å; Q35-A38 PolarHBondContact O-N 3.2Å; Q35-L39 PolarHBondContact O-N 3.47Å; Q35-L193 HydrophobicContact CG-CD1 4.21Å; Q35-L300 HydrophobicContact CB-CD2 3.57Å; Q35-L300 HydrophobicContact CB-CG 4.18Å; Q35-L300 HydrophobicContact CG-CD2 4.31Å; Q35-I304 HydrophobicContact CB-CD1 4.13Å; Q35-I304 VanDerWaalsContact O-CD1 3.26Å; Q35-I304 WeakPolarHBondContact O-CD1 3.49Å
36	L	96.9	Very high	95.3	Very high	92 Å²	92	38.5 Å²	38.5	48%	0.482	20%	0.195	S	C	.	.	H	α-helix	trans	-64.6	-42.2	174.5	-66.5	175.7	0	0	0	111.6	V32 A33 L39 L40	V32-L36 HydrophobicContact CG1-CD1 4.16Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.38Å; V32-L36 PolarHBondContact O-N 2.77Å; A33-L36 PolarHBondContact O-N 3.2Å; L36-L39 WeakPolarHBondContact O-CB 3.42Å; L36-L39 PolarHBondContact O-N 3.42Å; L36-L40 PolarHBondContact O-N 3.06Å; L36-L40 VanDerWaalsContact O-N 3.16Å
37	F	97.9	Very high	95.6	Very high	73 Å²	73	42.6 Å²	42.6	32%	0.32	22%	0.216	S	C	.	.	H	α-helix	trans	-61.9	-43.1	172.6	178.5	-98.7	0	0	0	111.7	A33 C34 L39 L40 M41 Y69 L70	A33-F37 WeakPolarHBondContact O-CB 3.29Å; A33-F37 PolarHBondContact O-N 2.86Å; C34-F37 PolarHBondContact O-N 2.84Å; F37-L39 VanDerWaalsContact C-N 3.28Å; F37-L39 PolarHBondContact O-N 2.94Å; F37-L40 WeakPolarHBondContact O-CB 3.47Å; F37-L40 PolarHBondContact O-N 3.13Å; F37-M41 HydrophobicContact CD1-CG 3.83Å; F37-M41 HydrophobicContact CD2-CG 4.46Å; F37-M41 HydrophobicContact CE1-CG 3.38Å; F37-M41 HydrophobicContact CE1-SD 4.19Å; F37-M41 HydrophobicContact CE2-CE 3.93Å; F37-M41 HydrophobicContact CE2-CG 4.05Å; F37-M41 HydrophobicContact CE2-SD 4.18Å; F37-M41 HydrophobicContact CG-CG 4.37Å; F37-M41 HydrophobicContact CZ-CE 4.1Å; F37-M41 HydrophobicContact CZ-CG 3.5Å; F37-M41 HydrophobicContact CZ-SD 3.72Å; F37-M41 WeakPolarHBondContact O-CG 3.21Å; F37-M41 PolarHBondContact O-N 2.78Å; F37-Y69 HydrophobicContact CE1-CE1 4.34Å; F37-L70 HydrophobicContact CD1-CD2 3.68Å; F37-L70 HydrophobicContact CE1-CD2 4.28Å
38	A	98.3	Very high	96	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-36.6	175.9	0	0	0	0	0	111.9	C34 Q35 M41 A42 L70 F189 I304	C34-A38 VanDerWaalsContact O-CB 3.26Å; C34-A38 WeakPolarHBondContact O-CB 3.33Å; C34-A38 PolarHBondContact O-N 2.96Å; Q35-A38 WeakPolarHBondContact O-CB 3.1Å; Q35-A38 PolarHBondContact O-N 3.2Å; A38-M41 CarbonylContact O-C 3.55Å; A38-M41 PolarHBondContact O-N 3.37Å; A38-A42 VanDerWaalsContact O-CB 3.24Å; A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 3.19Å; A38-L70 HydrophobicContact CB-CD1 3.86Å; A38-F189 HydrophobicContact CB-CD2 4.15Å; A38-F189 WeakPolarHBondContact O-CE2 3.27Å; A38-I304 HydrophobicContact CB-CD1 4.05Å; A38-I304 HydrophobicContact CB-CG2 4.06Å
39	L	98.4	Very high	96.3	Very high	22 Å²	22	46.1 Å²	46.1	12%	0.115	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-44.3	174.2	-176.8	65.6	0	0	0	111.9	Q35 L36 F37 A42 V43 V239 L243 I304 A307	Q35-L39 PolarHBondContact O-N 3.47Å; L36-L39 WeakPolarHBondContact O-CB 3.42Å; L36-L39 PolarHBondContact O-N 3.42Å; F37-L39 VanDerWaalsContact C-N 3.28Å; F37-L39 PolarHBondContact O-N 2.94Å; L39-A42 WeakPolarHBondContact O-CB 3.22Å; L39-A42 PolarHBondContact O-N 3.42Å; L39-V43 PolarHBondContact O-N 3.46Å; L39-V239 HydrophobicContact CD1-CG1 4.44Å; L39-L243 HydrophobicContact CD2-CD1 4.15Å; L39-L243 HydrophobicContact CD2-CD2 3.75Å; L39-I304 HydrophobicContact CB-CG1 3.84Å; L39-I304 HydrophobicContact CD1-CG1 4.04Å; L39-A307 HydrophobicContact CD1-CB 3.72Å
40	L	98.1	Very high	96.5	Very high	116 Å²	116	47.7 Å²	47.7	61%	0.607	23%	0.234	S	C	*	.	H	α-helix	trans	-62.9	-45.7	174.8	-64.2	175.2	0	0	0	111	L36 F37 A42 V43 W44	L36-L40 PolarHBondContact O-N 3.06Å; L36-L40 VanDerWaalsContact O-N 3.16Å; F37-L40 WeakPolarHBondContact O-CB 3.47Å; F37-L40 PolarHBondContact O-N 3.13Å; L40-A42 VanDerWaalsContact C-N 3.27Å; L40-A42 PolarHBondContact O-N 2.96Å; L40-V43 PolarHBondContact O-N 3.05Å; L40-W44 PolarHBondContact O-N 3.04Å
41	M	98.3	Very high	96.4	Very high	42 Å²	42	49.5 Å²	49.5	21%	0.207	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-30.6	176.7	-69.6	-55.5	99.1	0	0	112.4	F37 A38 W44 F45 L66 F189	F37-M41 HydrophobicContact CD1-CG 3.83Å; F37-M41 HydrophobicContact CD2-CG 4.46Å; F37-M41 HydrophobicContact CE1-CG 3.38Å; F37-M41 HydrophobicContact CE1-SD 4.19Å; F37-M41 HydrophobicContact CE2-CE 3.93Å; F37-M41 HydrophobicContact CE2-CG 4.05Å; F37-M41 HydrophobicContact CE2-SD 4.18Å; F37-M41 HydrophobicContact CG-CG 4.37Å; F37-M41 HydrophobicContact CZ-CE 4.1Å; F37-M41 HydrophobicContact CZ-CG 3.5Å; F37-M41 HydrophobicContact CZ-SD 3.72Å; F37-M41 WeakPolarHBondContact O-CG 3.21Å; F37-M41 PolarHBondContact O-N 2.78Å; A38-M41 CarbonylContact O-C 3.55Å; A38-M41 PolarHBondContact O-N 3.37Å; M41-W44 PolarHBondContact O-N 3.5Å; M41-F45 WeakPolarHBondContact O-CB 3.21Å; M41-F45 PolarHBondContact O-N 2.93Å; M41-L66 HydrophobicContact CB-CD1 4.36Å; M41-L66 HydrophobicContact CG-CD1 4.48Å; M41-F189 HydrophobicContact CB-CD2 4.27Å; M41-F189 HydrophobicContact CB-CE2 3.97Å
42	A	98.2	Very high	96.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-45.5	175.6	0	0	0	0	0	111.6	A38 L39 L40 W44 F45 R46 F189 I304 A307 A308	A38-A42 VanDerWaalsContact O-CB 3.24Å; A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 3.19Å; L39-A42 WeakPolarHBondContact O-CB 3.22Å; L39-A42 PolarHBondContact O-N 3.42Å; L40-A42 VanDerWaalsContact C-N 3.27Å; L40-A42 PolarHBondContact O-N 2.96Å; A42-W44 VanDerWaalsContact C-N 3.35Å; A42-F45 PolarHBondContact O-N 3.23Å; A42-R46 PolarHBondContact O-N 3.44Å; A42-F189 HydrophobicContact CB-CE2 4.04Å; A42-F189 HydrophobicContact CB-CZ 4.37Å; A42-I304 HydrophobicContact CB-CG2 4.06Å; A42-I304 WeakPolarHBondContact CB-O 3.09Å; A42-A307 HydrophobicContact CB-CB 3.89Å; A42-A308 HydrophobicContact CB-CB 3.87Å; A42-A308 WeakPolarHBondContact O-CA 3.45Å
43	V	97.7	Very high	96.2	Very high	72 Å²	72	57.4 Å²	57.4	44%	0.436	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-46.1	173.8	177.1	0	0	0	0	110.4	L39 L40 F45 R46 L47 A307	L39-V43 PolarHBondContact O-N 3.46Å; L40-V43 PolarHBondContact O-N 3.05Å; V43-F45 PolarHBondContact O-N 3.34Å; V43-R46 PolarHBondContact O-N 3.21Å; V43-L47 HydrophobicContact CG1-CD1 3.89Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.29Å; V43-L47 PolarHBondContact O-N 3.32Å; V43-A307 HydrophobicContact CG2-CB 4.07Å
44	W	97.9	Very high	96.2	Very high	100 Å²	100	56.8 Å²	56.8	38%	0.379	28%	0.281	S	S	.	.	H	α-helix	trans	-59.9	-46	176.1	176.7	89.6	0	0	0	112	L40 M41 A42 R46 L47 Y48 L49 V62	L40-W44 PolarHBondContact O-N 3.04Å; M41-W44 PolarHBondContact O-N 3.5Å; A42-W44 VanDerWaalsContact C-N 3.35Å; W44-R46 VanDerWaalsContact C-N 3.3Å; W44-R46 PolarHBondContact O-N 3.45Å; W44-L47 PolarHBondContact O-N 3.5Å; W44-Y48 AromaticContact CD1-CD2 3.23Å; W44-Y48 AromaticContact CD1-CE2 3.51Å; W44-Y48 HydrophobicContact CD2-CD2 4.34Å; W44-Y48 AromaticContact CG-CD2 3.83Å; W44-Y48 HydrophobicContact CG-CD2 3.83Å; W44-Y48 HydrophobicContact CG-CE2 4.39Å; W44-Y48 AromaticContact NE1-CD2 3.38Å; W44-Y48 AromaticContact NE1-CE2 3.86Å; W44-Y48 AromaticContact NE1-CG 3.9Å; W44-Y48 WeakPolarHBondContact O-CD2 3.42Å; W44-Y48 PolarHBondContact O-N 3.18Å; W44-L49 HydrophobicContact CH2-CD1 3.83Å; W44-L49 HydrophobicContact CH2-CG 4.11Å; W44-L49 HydrophobicContact CZ3-CD1 3.61Å; W44-L49 HydrophobicContact CZ3-CG 4.12Å; W44-V62 HydrophobicContact CH2-CG1 4.49Å; W44-V62 HydrophobicContact CZ3-CG1 4.04Å
45	F	97.7	Very high	96.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-42.3	178.7	-173.3	-89.6	0	0	0	111.1	M41 A42 V43 L49 R59 V62 A63 F189 F206 M207	M41-F45 WeakPolarHBondContact O-CB 3.21Å; M41-F45 PolarHBondContact O-N 2.93Å; A42-F45 PolarHBondContact O-N 3.23Å; V43-F45 PolarHBondContact O-N 3.34Å; F45-L49 HydrophobicContact CD2-CB 4.28Å; F45-L49 HydrophobicContact CD2-CD1 3.62Å; F45-L49 HydrophobicContact CD2-CG 4.47Å; F45-L49 HydrophobicContact CE2-CB 4.38Å; F45-L49 HydrophobicContact CE2-CD1 3.78Å; F45-L49 HydrophobicContact CG-CB 4.49Å; F45-L49 HydrophobicContact CG-CD1 4.48Å; F45-L49 CarbonylContact O-C 3.39Å; F45-L49 WeakPolarHBondContact O-CA 3.33Å; F45-L49 WeakPolarHBondContact O-CB 3.45Å; F45-L49 PolarHBondContact O-N 3.35Å; F45-R59 HydrophobicContact CE2-CB 4.49Å; F45-R59 HydrophobicContact CZ-CB 3.9Å; F45-R59 HydrophobicContact CZ-CG 4.1Å; F45-V62 HydrophobicContact CD2-CG1 4.38Å; F45-V62 HydrophobicContact CE2-CG1 4.45Å; F45-A63 HydrophobicContact CE2-CB 4.2Å; F45-A63 HydrophobicContact CZ-CB 4.42Å; F45-F189 HydrophobicContact CB-CE1 4.47Å; F45-F189 HydrophobicContact CB-CZ 4.03Å; F45-F189 AromaticContact CD2-CE1 3.96Å; F45-F189 HydrophobicContact CD2-CE1 3.96Å; F45-F189 HydrophobicContact CD2-CZ 4.36Å; F45-F189 HydrophobicContact CE2-CE1 4.4Å; F45-F189 HydrophobicContact CG-CE1 4.17Å; F45-F189 HydrophobicContact CG-CZ 4.17Å; F45-F206 HydrophobicContact CD1-CZ 4.31Å; F45-F206 HydrophobicContact CE1-CE1 4.05Å; F45-F206 AromaticContact CE1-CZ 3.85Å; F45-F206 HydrophobicContact CE1-CZ 3.85Å; F45-M207 HydrophobicContact CZ-CE 4.25Å; F45-M207 HydrophobicContact CZ-SD 4.28Å
46	R	95.4	Very high	96.2	Very high	48 Å²	48	61.5 Å²	61.5	18%	0.181	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-41.8	176.5	-171.6	173.7	-179.5	-124.1	1.6	112.8	A42 V43 W44 H50 E232 P233 A307	A42-R46 PolarHBondContact O-N 3.44Å; V43-R46 PolarHBondContact O-N 3.21Å; W44-R46 VanDerWaalsContact C-N 3.3Å; W44-R46 PolarHBondContact O-N 3.45Å; R46-H50 WeakPolarHBondContact O-CB 3.4Å; R46-E232 IonicContact CZ-OE1 3.46Å; R46-E232 IonicContact NE-OE1 3.17Å; R46-E232 PolarHBondContact NE-OE1 3.41Å; R46-E232 VanDerWaalsContact NH2-CD 3.34Å; R46-E232 IonicContact NH2-OE1 2.65Å; R46-E232 PolarHBondContact NH2-OE1 3.16Å; R46-E232 IonicContact NH2-OE2 2.72Å; R46-P233 PolarHBondContact NH2-O 3.02Å; R46-A307 WeakPolarHBondContact CD-O 3.36Å
47	L	94.5	Very high	96.2	Very high	98 Å²	98	63.4 Å²	63.4	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-75.1	-43.9	-175.1	-69.5	174.9	0	0	0	113.1	V43 W44 K53	V43-L47 HydrophobicContact CG1-CD1 3.89Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.29Å; V43-L47 PolarHBondContact O-N 3.32Å; W44-L47 PolarHBondContact O-N 3.5Å; L47-K53 PolarHBondContact O-NZ 3.44Å
48	Y	96.1	Very high	96.2	Very high	150 Å²	150	63.6 Å²	63.6	59%	0.588	32%	0.321	S	S	*	.	H	α-helix	trans	-99.7	-35.3	-171	-67.3	-79.7	0	0	0	113.2	W44 T54	W44-Y48 AromaticContact CD1-CD2 3.23Å; W44-Y48 AromaticContact CD1-CE2 3.51Å; W44-Y48 HydrophobicContact CD2-CD2 4.34Å; W44-Y48 AromaticContact CG-CD2 3.83Å; W44-Y48 HydrophobicContact CG-CD2 3.83Å; W44-Y48 HydrophobicContact CG-CE2 4.39Å; W44-Y48 AromaticContact NE1-CD2 3.38Å; W44-Y48 AromaticContact NE1-CE2 3.86Å; W44-Y48 AromaticContact NE1-CG 3.9Å; W44-Y48 WeakPolarHBondContact O-CD2 3.42Å; W44-Y48 PolarHBondContact O-N 3.18Å; Y48-T54 PolarHBondContact O-OG1 3.4Å
49	L	96.6	Very high	96.2	Very high	18 Å²	18	63.8 Å²	63.8	9%	0.094	32%	0.322	C	S	.	.	S	Bend	trans	-101.8	22.8	-179.7	-56.6	-179.3	0	0	0	112.7	W44 F45 T54 I58 R59 V62	W44-L49 HydrophobicContact CH2-CD1 3.83Å; W44-L49 HydrophobicContact CH2-CG 4.11Å; W44-L49 HydrophobicContact CZ3-CD1 3.61Å; W44-L49 HydrophobicContact CZ3-CG 4.12Å; F45-L49 HydrophobicContact CD2-CB 4.28Å; F45-L49 HydrophobicContact CD2-CD1 3.62Å; F45-L49 HydrophobicContact CD2-CG 4.47Å; F45-L49 HydrophobicContact CE2-CB 4.38Å; F45-L49 HydrophobicContact CE2-CD1 3.78Å; F45-L49 HydrophobicContact CG-CB 4.49Å; F45-L49 HydrophobicContact CG-CD1 4.48Å; F45-L49 CarbonylContact O-C 3.39Å; F45-L49 WeakPolarHBondContact O-CA 3.33Å; F45-L49 WeakPolarHBondContact O-CB 3.45Å; F45-L49 PolarHBondContact O-N 3.35Å; L49-T54 WeakPolarHBondContact CA-OG1 3.33Å; L49-T54 HydrophobicContact CB-CG2 4.48Å; L49-T54 HydrophobicContact CD2-CG2 3.95Å; L49-I58 HydrophobicContact CD2-CG2 4.36Å; L49-R59 HydrophobicContact CB-CG 4.27Å; L49-R59 VanDerWaalsContact O-CD 3.28Å; L49-R59 WeakPolarHBondContact O-CD 3.31Å; L49-R59 WeakPolarHBondContact O-CG 3.26Å; L49-R59 PolarHBondContact O-NH1 3.32Å; L49-V62 HydrophobicContact CD1-CB 3.81Å; L49-V62 HydrophobicContact CD1-CG1 3.62Å; L49-V62 HydrophobicContact CD1-CG2 3.89Å
50	H	94.8	Very high	96.2	Very high	45 Å²	45	63 Å²	63	21%	0.208	32%	0.318	C	S	.	.			trans	-49.2	139.8	178	-171.5	-96.4	0	0	0	111.8	R46 S52 K53 T54 E232	R46-H50 WeakPolarHBondContact O-CB 3.4Å; H50-S52 PolarHBondContact CE1-OG 3.09Å; H50-S52 VanDerWaalsContact ND1-CB 3.32Å; H50-S52 WeakPolarHBondContact ND1-CB 3.32Å; H50-S52 PolarHBondContact ND1-N 3.37Å; H50-S52 VanDerWaalsContact ND1-N 3.15Å; H50-S52 PolarHBondContact ND1-OG 3.06Å; H50-S52 PolarHBondContact O-N 3.49Å; H50-K53 PolarHBondContact O-N 3.24Å; H50-T54 PolarHBondContact O-N 3.31Å; H50-T54 VanDerWaalsContact O-N 3.08Å; H50-E232 IonicContact CD2-OE2 2.73Å; H50-E232 IonicContact NE2-OE2 2.74Å; H50-E232 PolarHBondContact NE2-OE2 3.42Å; H50-E232 VanDerWaalsContact NE2-OE2 3.09Å
51	P	92.3	Very high	96.2	Very high	39 Å²	39	59.6 Å²	59.6	25%	0.253	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.9	-176.8	-23.9	33.2	0	0	0	114.4	K53 R59	P51-K53 VanDerWaalsContact C-N 3.26Å; P51-K53 PolarHBondContact O-N 3.37Å; P51-R59 VanDerWaalsContact CD-NH1 3.31Å
52	S	90.1	Very high	96.2	Very high	93 Å²	93	59.1 Å²	59.1	65%	0.65	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.7	176.2	78.2	0	0	0	0	114.3	H50	H50-S52 PolarHBondContact CE1-OG 3.09Å; H50-S52 VanDerWaalsContact ND1-CB 3.32Å; H50-S52 WeakPolarHBondContact ND1-CB 3.32Å; H50-S52 PolarHBondContact ND1-N 3.37Å; H50-S52 VanDerWaalsContact ND1-N 3.15Å; H50-S52 PolarHBondContact ND1-OG 3.06Å; H50-S52 PolarHBondContact O-N 3.49Å
53	K	92.8	Very high	96.2	Very high	152 Å²	152	59.1 Å²	59.1	66%	0.661	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-18.7	-176	-61.6	-178.4	-175.4	172.5	0	112.9	L47 H50 P51	L47-K53 PolarHBondContact O-NZ 3.44Å; H50-K53 PolarHBondContact O-N 3.24Å; P51-K53 VanDerWaalsContact C-N 3.26Å; P51-K53 PolarHBondContact O-N 3.37Å
54	T	95.3	Very high	96.3	Very high	22 Å²	22	56.3 Å²	56.3	14%	0.135	28%	0.284	C	S	.	.	S	Bend	trans	-140.6	138.6	-167.6	-55.7	0	0	0	0	110.2	Y48 L49 H50 I58 R59	Y48-T54 PolarHBondContact O-OG1 3.4Å; L49-T54 WeakPolarHBondContact CA-OG1 3.33Å; L49-T54 HydrophobicContact CB-CG2 4.48Å; L49-T54 HydrophobicContact CD2-CG2 3.95Å; H50-T54 PolarHBondContact O-N 3.31Å; H50-T54 VanDerWaalsContact O-N 3.08Å; T54-I58 HydrophobicContact CG2-CB 3.63Å; T54-I58 HydrophobicContact CG2-CD1 4.21Å; T54-I58 HydrophobicContact CG2-CG2 3.62Å; T54-R59 HydrophobicContact CG2-CG 4.15Å
55	S	96.4	Very high	96.3	Very high	54 Å²	54	56.7 Å²	56.7	38%	0.378	29%	0.293	S	S	.	.			trans	-65.9	151.3	178.9	69.4	0	0	0	0	112.2	F57 I58 R59	S55-F57 PolarHBondContact O-N 3Å; S55-I58 PolarHBondContact O-N 3.2Å; S55-I58 PolarHBondContact OG-N 2.86Å; S55-R59 PolarHBondContact O-N 2.99Å
56	P	96.5	Very high	96.3	Very high	56 Å²	56	58.2 Å²	58.2	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-55.6	-35.5	174.4	-26.5	35.3	0	0	0	112.6	I58 R59 H60 E208	P56-I58 PolarHBondContact O-N 2.88Å; P56-R59 WeakPolarHBondContact O-CB 3.3Å; P56-R59 PolarHBondContact O-N 3.21Å; P56-H60 PolarHBondContact O-CD2 3.31Å; P56-H60 PolarHBondContact O-N 3.19Å; P56-E208 HydrophobicContact CG-CG 4.36Å
57	F	97.6	Very high	96.4	Very high	132 Å²	132	55.9 Å²	55.9	58%	0.579	29%	0.292	S	S	*	.	H	α-helix	trans	-55.5	-52.7	176.4	179.5	-91.8	0	0	0	112.4	S55 R59 H60 V61 L180	S55-F57 PolarHBondContact O-N 3Å; F57-R59 VanDerWaalsContact C-N 3.34Å; F57-R59 PolarHBondContact O-N 3.1Å; F57-H60 PolarHBondContact O-N 3.24Å; F57-V61 HydrophobicContact CD1-CG2 4.29Å; F57-V61 HydrophobicContact CE1-CG2 3.89Å; F57-V61 HydrophobicContact CZ-CG2 4.02Å; F57-V61 WeakPolarHBondContact O-CG2 3.48Å; F57-V61 PolarHBondContact O-N 3.33Å; F57-L180 HydrophobicContact CD2-CD2 3.43Å; F57-L180 VanDerWaalsContact CD2-CD2 3.43Å; F57-L180 HydrophobicContact CE2-CD2 3.45Å; F57-L180 VanDerWaalsContact CE2-CD2 3.45Å; F57-L180 HydrophobicContact CG-CD2 4.25Å; F57-L180 HydrophobicContact CZ-CD2 4.27Å
58	I	97.8	Very high	96.5	Very high	77 Å²	77	53.5 Å²	53.5	40%	0.395	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-42.5	-179.6	-66.3	170.3	0	0	0	110.2	L49 T54 S55 P56 H60 V61 V62	L49-I58 HydrophobicContact CD2-CG2 4.36Å; T54-I58 HydrophobicContact CG2-CB 3.63Å; T54-I58 HydrophobicContact CG2-CD1 4.21Å; T54-I58 HydrophobicContact CG2-CG2 3.62Å; S55-I58 PolarHBondContact O-N 3.2Å; S55-I58 PolarHBondContact OG-N 2.86Å; P56-I58 PolarHBondContact O-N 2.88Å; I58-H60 VanDerWaalsContact C-N 3.29Å; I58-H60 PolarHBondContact O-N 2.75Å; I58-V61 PolarHBondContact O-N 3.03Å; I58-V62 HydrophobicContact CG2-CG2 4.16Å; I58-V62 WeakPolarHBondContact O-CG2 3.48Å; I58-V62 PolarHBondContact O-N 2.94Å
59	R	98.1	Very high	96.6	Very high	3 Å²	3	52.2 Å²	52.2	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-55.2	-47.2	175.3	-73.3	170.8	60	88	-2.4	110.5	F45 L49 P51 T54 S55 P56 F57 A63 F206 M207	F45-R59 HydrophobicContact CE2-CB 4.49Å; F45-R59 HydrophobicContact CZ-CB 3.9Å; F45-R59 HydrophobicContact CZ-CG 4.1Å; L49-R59 HydrophobicContact CB-CG 4.27Å; L49-R59 VanDerWaalsContact O-CD 3.28Å; L49-R59 WeakPolarHBondContact O-CD 3.31Å; L49-R59 WeakPolarHBondContact O-CG 3.26Å; L49-R59 PolarHBondContact O-NH1 3.32Å; P51-R59 VanDerWaalsContact CD-NH1 3.31Å; T54-R59 HydrophobicContact CG2-CG 4.15Å; S55-R59 PolarHBondContact O-N 2.99Å; P56-R59 WeakPolarHBondContact O-CB 3.3Å; P56-R59 PolarHBondContact O-N 3.21Å; F57-R59 VanDerWaalsContact C-N 3.34Å; F57-R59 PolarHBondContact O-N 3.1Å; R59-A63 VanDerWaalsContact O-CB 3.24Å; R59-A63 WeakPolarHBondContact O-CB 3.41Å; R59-A63 PolarHBondContact O-N 2.91Å; R59-F206 PolarHBondContact NH2-O 3.26Å; R59-M207 HydrophobicContact CB-CE 3.6Å; R59-M207 HydrophobicContact CB-SD 4.46Å; R59-M207 WeakPolarHBondContact CD-O 3.37Å; R59-M207 PolarHBondContact NE-O 3.44Å; R59-M207 VanDerWaalsContact O-CE 3.31Å; R59-M207 WeakPolarHBondContact O-CE 3.29Å
60	H	98.4	Very high	96.6	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.028	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-47.4	178.3	-77.6	-60.8	0	0	0	112.6	P56 F57 I58 A63 T64 L180 S184 M204 M207	P56-H60 PolarHBondContact O-CD2 3.31Å; P56-H60 PolarHBondContact O-N 3.19Å; F57-H60 PolarHBondContact O-N 3.24Å; I58-H60 VanDerWaalsContact C-N 3.29Å; I58-H60 PolarHBondContact O-N 2.75Å; H60-A63 PolarHBondContact O-N 3.28Å; H60-T64 WeakPolarHBondContact O-CB 3.44Å; H60-T64 PolarHBondContact O-N 3.3Å; H60-T64 PolarHBondContact O-OG1 3.12Å; H60-L180 HydrophobicContact CB-CD1 4.13Å; H60-L180 HydrophobicContact CB-CD2 4.05Å; H60-L180 HydrophobicContact CB-CG 3.86Å; H60-S184 WeakPolarHBondContact CA-OG 3.47Å; H60-S184 VanDerWaalsContact ND1-CB 3.28Å; H60-S184 WeakPolarHBondContact ND1-CB 3.13Å; H60-S184 PolarHBondContact ND1-OG 2.91Å; H60-S184 PolarHBondContact O-OG 3.21Å; H60-M204 VanDerWaalsContact CE1-CE 3.48Å; H60-M204 WeakPolarHBondContact CE1-CE 3.22Å; H60-M207 VanDerWaalsContact CA-CE 3.43Å; H60-M207 HydrophobicContact CB-CE 4.19Å; H60-M207 VanDerWaalsContact CE1-CB 3.42Å; H60-M207 WeakPolarHBondContact CE1-CB 3.33Å; H60-M207 VanDerWaalsContact CE1-CG 3.4Å; H60-M207 WeakPolarHBondContact CE1-CG 3.23Å; H60-M207 WeakPolarHBondContact ND1-CE 3.41Å
61	V	98.5	Very high	96.7	Very high	45 Å²	45	49.3 Å²	49.3	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-58.9	-52.6	178.8	171	0	0	0	0	110.3	F57 I58 A63 T64 L65 L180	F57-V61 HydrophobicContact CD1-CG2 4.29Å; F57-V61 HydrophobicContact CE1-CG2 3.89Å; F57-V61 HydrophobicContact CZ-CG2 4.02Å; F57-V61 WeakPolarHBondContact O-CG2 3.48Å; F57-V61 PolarHBondContact O-N 3.33Å; I58-V61 PolarHBondContact O-N 3.03Å; V61-A63 PolarHBondContact O-N 3.15Å; V61-T64 PolarHBondContact O-N 3.32Å; V61-L65 HydrophobicContact CG1-CD1 3.72Å; V61-L65 HydrophobicContact CG1-CG 4.24Å; V61-L65 WeakPolarHBondContact O-CG 3.47Å; V61-L65 PolarHBondContact O-N 3.2Å; V61-L180 HydrophobicContact CG2-CD1 3.91Å; V61-L180 HydrophobicContact CG2-CD2 3.96Å
62	V	98.3	Very high	96.8	Very high	32 Å²	32	51.8 Å²	51.8	19%	0.194	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-44.9	-178.3	174.9	0	0	0	0	111.4	W44 F45 L49 I58 T64 L65 L66	W44-V62 HydrophobicContact CH2-CG1 4.49Å; W44-V62 HydrophobicContact CZ3-CG1 4.04Å; F45-V62 HydrophobicContact CD2-CG1 4.38Å; F45-V62 HydrophobicContact CE2-CG1 4.45Å; L49-V62 HydrophobicContact CD1-CB 3.81Å; L49-V62 HydrophobicContact CD1-CG1 3.62Å; L49-V62 HydrophobicContact CD1-CG2 3.89Å; I58-V62 HydrophobicContact CG2-CG2 4.16Å; I58-V62 WeakPolarHBondContact O-CG2 3.48Å; I58-V62 PolarHBondContact O-N 2.94Å; V62-T64 VanDerWaalsContact C-N 3.27Å; V62-T64 PolarHBondContact O-N 3.44Å; V62-L65 PolarHBondContact O-N 3.2Å; V62-L66 HydrophobicContact CG1-CD1 3.76Å; V62-L66 HydrophobicContact CG1-CG 4.2Å; V62-L66 WeakPolarHBondContact O-CB 3.39Å; V62-L66 WeakPolarHBondContact O-CG 3.19Å; V62-L66 PolarHBondContact O-N 3.46Å
63	A	98.3	Very high	97.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-38.6	179.4	0	0	0	0	0	112.2	F45 R59 H60 V61 G67 N188 F189 M207	F45-A63 HydrophobicContact CE2-CB 4.2Å; F45-A63 HydrophobicContact CZ-CB 4.42Å; R59-A63 VanDerWaalsContact O-CB 3.24Å; R59-A63 WeakPolarHBondContact O-CB 3.41Å; R59-A63 PolarHBondContact O-N 2.91Å; H60-A63 PolarHBondContact O-N 3.28Å; V61-A63 PolarHBondContact O-N 3.15Å; A63-G67 PolarHBondContact O-N 3.02Å; A63-N188 HydrophobicContact CB-CB 4.26Å; A63-N188 WeakPolarHBondContact O-CA 3.31Å; A63-F189 HydrophobicContact CB-CD1 4.24Å; A63-F189 HydrophobicContact CB-CE1 4.41Å; A63-F189 PolarHBondContact O-N 2.62Å; A63-F189 VanDerWaalsContact O-N 3.08Å; A63-M207 HydrophobicContact CB-CE 4.1Å
64	T	98.2	Very high	97.1	Very high	12 Å²	12	41.9 Å²	41.9	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-69.9	-50	177.9	-49	0	0	0	0	111.3	H60 V61 V62 L66 G67 L68 L183 S184 C187	H60-T64 WeakPolarHBondContact O-CB 3.44Å; H60-T64 PolarHBondContact O-N 3.3Å; H60-T64 PolarHBondContact O-OG1 3.12Å; V61-T64 PolarHBondContact O-N 3.32Å; V62-T64 VanDerWaalsContact C-N 3.27Å; V62-T64 PolarHBondContact O-N 3.44Å; T64-L66 PolarHBondContact O-N 2.97Å; T64-G67 PolarHBondContact O-N 2.9Å; T64-G67 VanDerWaalsContact O-N 3.14Å; T64-L68 HydrophobicContact CG2-CD1 4.14Å; T64-L68 HydrophobicContact CG2-CG 4.42Å; T64-L68 WeakPolarHBondContact O-CG 3.27Å; T64-L68 PolarHBondContact O-N 3.35Å; T64-L183 HydrophobicContact CG2-CB 4.18Å; T64-S184 WeakPolarHBondContact OG1-CA 3.39Å; T64-S184 VanDerWaalsContact OG1-CB 3.27Å; T64-S184 WeakPolarHBondContact OG1-CB 3.38Å; T64-C187 HydrophobicContact CG2-CB 4.39Å
65	L	98.3	Very high	96.9	Very high	109 Å²	109	40.9 Å²	40.9	57%	0.571	21%	0.211	S	C	*	.	H	α-helix	trans	-62.9	-42.8	-177.8	-69.3	178.8	0	0	0	111.9	V61 V62 G67 L68 Y69	V61-L65 HydrophobicContact CG1-CD1 3.72Å; V61-L65 HydrophobicContact CG1-CG 4.24Å; V61-L65 WeakPolarHBondContact O-CG 3.47Å; V61-L65 PolarHBondContact O-N 3.2Å; V62-L65 PolarHBondContact O-N 3.2Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.29Å; L65-L68 PolarHBondContact O-N 3.15Å; L65-Y69 WeakPolarHBondContact O-CB 3.3Å; L65-Y69 PolarHBondContact O-N 3.49Å
66	L	98.3	Very high	96.6	Very high	31 Å²	31	38.9 Å²	38.9	16%	0.162	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-39.9	174.2	-73.1	176.3	0	0	0	111.6	M41 V62 T64 Y69 L70 F189	M41-L66 HydrophobicContact CB-CD1 4.36Å; M41-L66 HydrophobicContact CG-CD1 4.48Å; V62-L66 HydrophobicContact CG1-CD1 3.76Å; V62-L66 HydrophobicContact CG1-CG 4.2Å; V62-L66 WeakPolarHBondContact O-CB 3.39Å; V62-L66 WeakPolarHBondContact O-CG 3.19Å; V62-L66 PolarHBondContact O-N 3.46Å; T64-L66 PolarHBondContact O-N 2.97Å; L66-Y69 PolarHBondContact O-N 3.03Å; L66-L70 WeakPolarHBondContact O-CG 3.37Å; L66-L70 PolarHBondContact O-N 3.4Å; L66-F189 HydrophobicContact CB-CB 3.69Å; L66-F189 HydrophobicContact CB-CD1 4.17Å; L66-F189 HydrophobicContact CB-CG 4.03Å; L66-F189 HydrophobicContact CD1-CD1 4.22Å; L66-F189 HydrophobicContact CD1-CE1 4.46Å; L66-F189 HydrophobicContact CD1-CG 4.42Å
67	G	97.8	Very high	96.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.8	-43.6	179.1	0	0	0	0	0	112.5	A63 T64 L65 Y69 L70 A71 C187 I192	A63-G67 PolarHBondContact O-N 3.02Å; T64-G67 PolarHBondContact O-N 2.9Å; T64-G67 VanDerWaalsContact O-N 3.14Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.29Å; G67-Y69 VanDerWaalsContact C-N 3.31Å; G67-Y69 PolarHBondContact O-N 2.84Å; G67-L70 PolarHBondContact O-N 2.8Å; G67-A71 WeakPolarHBondContact O-CB 3.47Å; G67-A71 PolarHBondContact O-N 3.1Å; G67-C187 WeakPolarHBondContact CA-O 3.34Å; G67-I192 WeakPolarHBondContact O-CD1 3.29Å
68	L	97.3	Very high	95.9	Very high	47 Å²	47	43.6 Å²	43.6	25%	0.246	21%	0.206	C	C	.	.	H	α-helix	trans	-62.2	-38.6	174	-66	177.8	0	0	0	112	T64 L65 A71 L72 L83 C187	T64-L68 HydrophobicContact CG2-CD1 4.14Å; T64-L68 HydrophobicContact CG2-CG 4.42Å; T64-L68 WeakPolarHBondContact O-CG 3.27Å; T64-L68 PolarHBondContact O-N 3.35Å; L65-L68 PolarHBondContact O-N 3.15Å; L68-A71 PolarHBondContact O-N 2.86Å; L68-L72 WeakPolarHBondContact O-CB 3.29Å; L68-L72 PolarHBondContact O-N 3.15Å; L68-L83 HydrophobicContact CD1-CD2 4.43Å; L68-L83 HydrophobicContact CD2-CD1 4.44Å; L68-L83 HydrophobicContact CD2-CD2 3.73Å; L68-L83 HydrophobicContact CD2-CG 4.18Å; L68-C187 HydrophobicContact CD2-CB 3.96Å; L68-C187 HydrophobicContact CG-CB 4.41Å
69	Y	97.4	Very high	95.7	Very high	123 Å²	123	40.6 Å²	40.6	48%	0.482	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-48.3	173	171.9	-99.5	0	0	0	111.9	F37 L65 L66 G67 A71 L72 F73	F37-Y69 HydrophobicContact CE1-CE1 4.34Å; L65-Y69 WeakPolarHBondContact O-CB 3.3Å; L65-Y69 PolarHBondContact O-N 3.49Å; L66-Y69 PolarHBondContact O-N 3.03Å; G67-Y69 VanDerWaalsContact C-N 3.31Å; G67-Y69 PolarHBondContact O-N 2.84Å; Y69-A71 VanDerWaalsContact C-N 3.34Å; Y69-A71 PolarHBondContact O-N 2.71Å; Y69-L72 PolarHBondContact O-N 3.5Å; Y69-F73 WeakPolarHBondContact O-CB 3.46Å; Y69-F73 PolarHBondContact O-N 2.85Å
70	L	97.3	Very high	95.4	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-41.9	177.3	-70.6	-178.5	0	0	0	112.1	C34 F37 A38 L66 G67 F73 C74 F189	C34-L70 HydrophobicContact CB-CD2 3.76Å; F37-L70 HydrophobicContact CD1-CD2 3.68Å; F37-L70 HydrophobicContact CE1-CD2 4.28Å; A38-L70 HydrophobicContact CB-CD1 3.86Å; L66-L70 WeakPolarHBondContact O-CG 3.37Å; L66-L70 PolarHBondContact O-N 3.4Å; G67-L70 PolarHBondContact O-N 2.8Å; L70-F73 PolarHBondContact O-N 2.79Å; L70-C74 PolarHBondContact O-N 2.99Å; L70-F189 HydrophobicContact CD1-CB 3.91Å
71	A	95.4	Very high	95.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-44.9	175.5	0	0	0	0	0	112.1	G67 L68 Y69 F73 C74 F75 F82 I192	G67-A71 WeakPolarHBondContact O-CB 3.47Å; G67-A71 PolarHBondContact O-N 3.1Å; L68-A71 PolarHBondContact O-N 2.86Å; Y69-A71 VanDerWaalsContact C-N 3.34Å; Y69-A71 PolarHBondContact O-N 2.71Å; A71-F73 VanDerWaalsContact C-N 3.33Å; A71-C74 PolarHBondContact O-N 3.27Å; A71-F75 WeakPolarHBondContact O-CB 3.29Å; A71-F75 WeakPolarHBondContact O-CD2 3.37Å; A71-F75 PolarHBondContact O-N 2.87Å; A71-F82 HydrophobicContact CB-CD2 3.78Å; A71-F82 HydrophobicContact CB-CE2 3.58Å; A71-I192 HydrophobicContact CB-CD1 3.81Å
72	L	95.4	Very high	95.1	Very high	91 Å²	91	43.7 Å²	43.7	48%	0.476	21%	0.208	S	C	.	.	H	α-helix	trans	-65.2	-38.4	177.9	-169	69.8	0	0	0	111.3	L68 Y69 G76 S79	L68-L72 WeakPolarHBondContact O-CB 3.29Å; L68-L72 PolarHBondContact O-N 3.15Å; Y69-L72 PolarHBondContact O-N 3.5Å; L72-G76 WeakPolarHBondContact CD1-O 3.41Å; L72-G76 WeakPolarHBondContact O-CA 3.34Å; L72-G76 PolarHBondContact O-N 3.33Å; L72-S79 WeakPolarHBondContact CD1-OG 3.07Å
73	F	95.4	Very high	95	Very high	31 Å²	31	45.7 Å²	45.7	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-65.4	-46.1	176.6	-171.9	-82.9	0	0	0	112.1	G11 S12 L14 L15 N30 C34 Y69 L70 A71	G11-F73 WeakPolarHBondContact CA-O 3.34Å; S12-F73 PolarHBondContact N-O 3.23Å; L14-F73 HydrophobicContact CD2-CE2 4.27Å; L15-F73 HydrophobicContact CD1-CE1 4.19Å; L15-F73 HydrophobicContact CD1-CZ 4.16Å; L15-F73 HydrophobicContact CG-CZ 4.16Å; N30-F73 HydrophobicContact CB-CD1 4.41Å; N30-F73 HydrophobicContact CB-CE1 4.11Å; C34-F73 WeakPolarHBondContact SG-CD1 3.45Å; Y69-F73 WeakPolarHBondContact O-CB 3.46Å; Y69-F73 PolarHBondContact O-N 2.85Å; L70-F73 PolarHBondContact O-N 2.79Å; A71-F73 VanDerWaalsContact C-N 3.33Å
74	C	92.8	Very high	95	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.034	23%	0.232	C	C	.	.	H	α-helix	trans	-73.2	-38.7	-179	-71.5	0	0	0	0	113.3	G11 C34 L70 A71 L193	G11-C74 WeakPolarHBondContact CA-O 3.39Å; C34-C74 PolarHBondContact SG-SG 2.97Å; L70-C74 PolarHBondContact O-N 2.99Å; A71-C74 PolarHBondContact O-N 3.27Å; C74-L193 HydrophobicContact CB-CD2 4.24Å
75	F	91.3	Very high	94.9	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-122.8	-4.8	-165.7	-51.4	-70.5	0	0	0	114.5	T10 A71 Y78 F82 A131 F133 P136 L193	T10-F75 CarbonylContact O-C 3.41Å; A71-F75 WeakPolarHBondContact O-CB 3.29Å; A71-F75 WeakPolarHBondContact O-CD2 3.37Å; A71-F75 PolarHBondContact O-N 2.87Å; F75-Y78 PolarHBondContact O-N 3.08Å; F75-F82 HydrophobicContact CB-CZ 4.48Å; F75-F82 AromaticContact CD2-CE2 3.8Å; F75-F82 HydrophobicContact CD2-CE2 3.8Å; F75-F82 AromaticContact CD2-CZ 3.61Å; F75-F82 HydrophobicContact CD2-CZ 3.61Å; F75-F82 HydrophobicContact CE2-CE2 4.2Å; F75-F82 HydrophobicContact CE2-CZ 4.06Å; F75-F82 HydrophobicContact CG-CZ 4.11Å; F75-A131 HydrophobicContact CE1-CB 4.38Å; F75-F133 HydrophobicContact CB-CB 4.15Å; F75-F133 HydrophobicContact CD1-CB 3.68Å; F75-F133 HydrophobicContact CE1-CB 4.31Å; F75-F133 HydrophobicContact CG-CB 3.99Å; F75-P136 HydrophobicContact CD2-CG 4.39Å; F75-P136 HydrophobicContact CE2-CG 3.48Å; F75-P136 VanDerWaalsContact CE2-CG 3.48Å; F75-P136 HydrophobicContact CZ-CG 3.56Å; F75-L193 HydrophobicContact CE2-CD2 3.69Å; F75-L193 HydrophobicContact CZ-CD2 4.33Å
76	G	91.4	Very high	94.8	Very high	12 Å²	12	42.4 Å²	42.4	12%	0.124	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	57.1	-138	-178.3	0	0	0	0	0	112	T10 L72 Y78 S79	T10-G76 VanDerWaalsContact O-CA 3.27Å; T10-G76 WeakPolarHBondContact O-CA 3.47Å; T10-G76 PolarHBondContact O-N 2.95Å; L72-G76 WeakPolarHBondContact CD1-O 3.41Å; L72-G76 WeakPolarHBondContact O-CA 3.34Å; L72-G76 PolarHBondContact O-N 3.33Å; G76-Y78 PolarHBondContact O-N 3.06Å; G76-Y78 VanDerWaalsContact O-N 3.1Å; G76-S79 VanDerWaalsContact O-CB 3.3Å; G76-S79 WeakPolarHBondContact O-CB 3.46Å; G76-S79 PolarHBondContact O-N 3.25Å; G76-S79 PolarHBondContact O-OG 3.26Å
77	W	89.1	Confident	94.8	Very high	219 Å²	219	42.9 Å²	42.9	83%	0.83	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-59.3	-22.8	-177.6	-73.5	108.4	0	0	0	114.2	S79 V80	W77-S79 PolarHBondContact O-N 3.39Å; W77-V80 HydrophobicContact CE3-CG2 4.1Å; W77-V80 VanDerWaalsContact O-CB 3.28Å; W77-V80 WeakPolarHBondContact O-CB 3.43Å; W77-V80 VanDerWaalsContact O-CG2 3.29Å; W77-V80 WeakPolarHBondContact O-CG2 3.4Å; W77-V80 PolarHBondContact O-N 3.17Å
78	Y	89.9	Confident	94.8	Very high	68 Å²	68	46.9 Å²	46.9	27%	0.267	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-65.5	-20.6	176	-66.9	-87.8	0	0	0	112.9	T10 F75 G76 V80 H81 F124 F133	T10-Y78 HydrophobicContact CG2-CD2 3.76Å; T10-Y78 HydrophobicContact CG2-CE2 3.43Å; T10-Y78 VanDerWaalsContact CG2-CE2 3.43Å; F75-Y78 PolarHBondContact O-N 3.08Å; G76-Y78 PolarHBondContact O-N 3.06Å; G76-Y78 VanDerWaalsContact O-N 3.1Å; Y78-V80 PolarHBondContact O-N 3.47Å; Y78-V80 VanDerWaalsContact O-N 3.13Å; Y78-H81 AromaticContact CD1-CD2 3.98Å; Y78-H81 WeakPolarHBondContact O-CB 3.09Å; Y78-H81 PolarHBondContact O-CD2 2.99Å; Y78-H81 PolarHBondContact O-N 2.87Å; Y78-F124 HydrophobicContact CE1-CE2 4.07Å; Y78-F124 AromaticContact CE1-CZ 3.94Å; Y78-F124 HydrophobicContact CE1-CZ 3.94Å; Y78-F124 HydrophobicContact CE2-CZ 4.08Å; Y78-F124 AromaticContact CZ-CZ 3.5Å; Y78-F124 VanDerWaalsContact CZ-CZ 3.5Å; Y78-F124 VanDerWaalsContact OH-CZ 3.25Å; Y78-F124 WeakPolarHBondContact OH-CZ 3.2Å; Y78-F133 HydrophobicContact CD1-CD1 4.01Å; Y78-F133 HydrophobicContact CD1-CD2 4.44Å; Y78-F133 AromaticContact CD1-CE1 3.78Å; Y78-F133 HydrophobicContact CD1-CE1 3.78Å; Y78-F133 HydrophobicContact CD1-CE2 4.23Å; Y78-F133 HydrophobicContact CD1-CG 4.35Å; Y78-F133 AromaticContact CD1-CZ 3.91Å; Y78-F133 HydrophobicContact CD1-CZ 3.91Å; Y78-F133 HydrophobicContact CE1-CE1 4.28Å; Y78-F133 HydrophobicContact CG-CD1 4.19Å; Y78-F133 HydrophobicContact CG-CE1 4.42Å; Y78-F133 HydrophobicContact CG-CG 4.32Å
79	S	92.4	Very high	94.8	Very high	13 Å²	13	44.7 Å²	44.7	9%	0.091	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-58.9	-21.7	171.7	64.2	0	0	0	0	113.3	L72 G76 W77 H81 F82	L72-S79 WeakPolarHBondContact CD1-OG 3.07Å; G76-S79 VanDerWaalsContact O-CB 3.3Å; G76-S79 WeakPolarHBondContact O-CB 3.46Å; G76-S79 PolarHBondContact O-N 3.25Å; G76-S79 PolarHBondContact O-OG 3.26Å; W77-S79 PolarHBondContact O-N 3.39Å; S79-H81 PolarHBondContact O-N 2.89Å; S79-F82 VanDerWaalsContact O-CB 3.25Å; S79-F82 WeakPolarHBondContact O-CB 3.23Å; S79-F82 WeakPolarHBondContact O-CG 3.35Å; S79-F82 PolarHBondContact O-N 3.48Å
80	V	93.3	Very high	94.8	Very high	64 Å²	64	40.7 Å²	40.7	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-59.3	-33.7	173.1	174.8	0	0	0	0	111.3	W77 Y78 F82 L83 V84	W77-V80 HydrophobicContact CE3-CG2 4.1Å; W77-V80 VanDerWaalsContact O-CB 3.28Å; W77-V80 WeakPolarHBondContact O-CB 3.43Å; W77-V80 VanDerWaalsContact O-CG2 3.29Å; W77-V80 WeakPolarHBondContact O-CG2 3.4Å; W77-V80 PolarHBondContact O-N 3.17Å; Y78-V80 PolarHBondContact O-N 3.47Å; Y78-V80 VanDerWaalsContact O-N 3.13Å; V80-F82 PolarHBondContact O-N 3.2Å; V80-F82 VanDerWaalsContact O-N 3.14Å; V80-L83 PolarHBondContact O-N 3.21Å; V80-L83 VanDerWaalsContact O-N 3.08Å; V80-V84 HydrophobicContact CG1-CG2 3.99Å; V80-V84 WeakPolarHBondContact O-CG2 3.08Å; V80-V84 PolarHBondContact O-N 3.42Å
81	H	94.6	Very high	94.7	Very high	56 Å²	56	41.7 Å²	41.7	26%	0.259	22%	0.218	S	C	.	.	H	α-helix	trans	-59	-27.7	176.2	-69.7	-70.5	0	0	0	112.5	Y78 S79 V84 Q85 Y112 F133 M137	Y78-H81 AromaticContact CD1-CD2 3.98Å; Y78-H81 WeakPolarHBondContact O-CB 3.09Å; Y78-H81 PolarHBondContact O-CD2 2.99Å; Y78-H81 PolarHBondContact O-N 2.87Å; S79-H81 PolarHBondContact O-N 2.89Å; H81-V84 PolarHBondContact O-N 3.02Å; H81-Q85 VanDerWaalsContact O-CB 3.26Å; H81-Q85 WeakPolarHBondContact O-CB 3.1Å; H81-Q85 PolarHBondContact O-N 3.21Å; H81-Y112 HydrophobicContact CB-CE1 4.3Å; H81-Y112 AromaticContact ND1-CZ 3.75Å; H81-Y112 PolarHBondContact ND1-OH 2.88Å; H81-F133 AromaticContact CD2-CE2 3.95Å; H81-M137 HydrophobicContact CB-CE 4.11Å; H81-M137 HydrophobicContact CB-SD 3.87Å
82	F	95.4	Very high	94.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.5	-40.7	179.8	-51.9	-5.2	0	0	0	109.9	A71 F75 S79 V80 S86 F133 P136 M137 I140 I192	A71-F82 HydrophobicContact CB-CD2 3.78Å; A71-F82 HydrophobicContact CB-CE2 3.58Å; F75-F82 HydrophobicContact CB-CZ 4.48Å; F75-F82 AromaticContact CD2-CE2 3.8Å; F75-F82 HydrophobicContact CD2-CE2 3.8Å; F75-F82 AromaticContact CD2-CZ 3.61Å; F75-F82 HydrophobicContact CD2-CZ 3.61Å; F75-F82 HydrophobicContact CE2-CE2 4.2Å; F75-F82 HydrophobicContact CE2-CZ 4.06Å; F75-F82 HydrophobicContact CG-CZ 4.11Å; S79-F82 VanDerWaalsContact O-CB 3.25Å; S79-F82 WeakPolarHBondContact O-CB 3.23Å; S79-F82 WeakPolarHBondContact O-CG 3.35Å; S79-F82 PolarHBondContact O-N 3.48Å; V80-F82 PolarHBondContact O-N 3.2Å; V80-F82 VanDerWaalsContact O-N 3.14Å; F82-S86 VanDerWaalsContact O-CB 3.26Å; F82-S86 WeakPolarHBondContact O-CB 3.27Å; F82-S86 PolarHBondContact O-N 3.42Å; F82-S86 VanDerWaalsContact O-N 3.08Å; F82-S86 PolarHBondContact O-OG 3.02Å; F82-F133 HydrophobicContact CE1-CB 4.29Å; F82-F133 HydrophobicContact CE1-CD2 4.37Å; F82-F133 WeakPolarHBondContact CE1-O 3.36Å; F82-F133 HydrophobicContact CZ-CB 4.36Å; F82-P136 HydrophobicContact CD2-CB 4.34Å; F82-P136 HydrophobicContact CE1-CB 4.14Å; F82-P136 HydrophobicContact CE2-CB 3.72Å; F82-P136 HydrophobicContact CE2-CG 4.11Å; F82-P136 HydrophobicContact CZ-CB 3.63Å; F82-P136 HydrophobicContact CZ-CG 3.84Å; F82-M137 HydrophobicContact CD1-CG 3.49Å; F82-M137 VanDerWaalsContact CD1-CG 3.49Å; F82-M137 HydrophobicContact CD1-SD 4.27Å; F82-M137 HydrophobicContact CE1-CG 3.7Å; F82-M137 HydrophobicContact CE1-SD 4.34Å; F82-I140 HydrophobicContact CB-CD1 3.78Å; F82-I140 HydrophobicContact CG-CD1 4.18Å; F82-I192 HydrophobicContact CD2-CD1 4.38Å
83	L	96.1	Very high	94.8	Very high	73 Å²	73	38.7 Å²	38.7	38%	0.382	20%	0.203	S	C	.	.	H	α-helix	trans	-72.5	-40.3	175.8	-66.6	178.3	0	0	0	111.8	L68 V80 S86 G87 L183	L68-L83 HydrophobicContact CD1-CD2 4.43Å; L68-L83 HydrophobicContact CD2-CD1 4.44Å; L68-L83 HydrophobicContact CD2-CD2 3.73Å; L68-L83 HydrophobicContact CD2-CG 4.18Å; V80-L83 PolarHBondContact O-N 3.21Å; V80-L83 VanDerWaalsContact O-N 3.08Å; L83-S86 PolarHBondContact O-N 3.45Å; L83-G87 PolarHBondContact O-N 3.48Å; L83-L183 HydrophobicContact CD2-CD2 4.37Å
84	V	97.2	Very high	94.7	Very high	53 Å²	53	41.2 Å²	41.2	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-49.8	176.7	174.6	0	0	0	0	110.4	V80 H81 S86 G87 L88 Y112	V80-V84 HydrophobicContact CG1-CG2 3.99Å; V80-V84 WeakPolarHBondContact O-CG2 3.08Å; V80-V84 PolarHBondContact O-N 3.42Å; H81-V84 PolarHBondContact O-N 3.02Å; V84-S86 VanDerWaalsContact C-N 3.32Å; V84-S86 PolarHBondContact O-N 2.95Å; V84-G87 PolarHBondContact O-N 3.31Å; V84-L88 HydrophobicContact CG1-CD1 3.82Å; V84-L88 HydrophobicContact CG1-CG 4.19Å; V84-L88 WeakPolarHBondContact O-CB 3.32Å; V84-L88 VanDerWaalsContact O-CG 3.29Å; V84-L88 WeakPolarHBondContact O-CG 3.43Å; V84-L88 PolarHBondContact O-N 3.09Å; V84-Y112 HydrophobicContact CB-CE1 4.38Å; V84-Y112 HydrophobicContact CG1-CE1 4.19Å; V84-Y112 HydrophobicContact CG1-CE2 3.9Å; V84-Y112 VanDerWaalsContact CG1-OH 3.25Å; V84-Y112 WeakPolarHBondContact CG1-OH 3.3Å
85	Q	97.2	Very high	94.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-45.1	177	-173.4	-178.7	-18.5	0	0	111.7	H81 S89 T109 Y112 M137 T141	H81-Q85 VanDerWaalsContact O-CB 3.26Å; H81-Q85 WeakPolarHBondContact O-CB 3.1Å; H81-Q85 PolarHBondContact O-N 3.21Å; Q85-S89 WeakPolarHBondContact O-CB 3.33Å; Q85-S89 PolarHBondContact O-N 2.87Å; Q85-S89 VanDerWaalsContact O-N 3.16Å; Q85-S89 PolarHBondContact O-OG 3.48Å; Q85-T109 HydrophobicContact CG-CG2 4.08Å; Q85-Y112 HydrophobicContact CB-CD1 3.63Å; Q85-Y112 HydrophobicContact CB-CE1 3.91Å; Q85-Y112 HydrophobicContact CG-CD1 3.94Å; Q85-M137 HydrophobicContact CB-CE 4.49Å; Q85-M137 PolarHBondContact NE2-O 3.36Å; Q85-T141 PolarHBondContact NE2-OG1 2.9Å
86	S	96.4	Very high	94.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-44.1	178	-61.7	0	0	0	0	111.6	F82 L83 V84 S89 Y90 Y182	F82-S86 VanDerWaalsContact O-CB 3.26Å; F82-S86 WeakPolarHBondContact O-CB 3.27Å; F82-S86 PolarHBondContact O-N 3.42Å; F82-S86 VanDerWaalsContact O-N 3.08Å; F82-S86 PolarHBondContact O-OG 3.02Å; L83-S86 PolarHBondContact O-N 3.45Å; V84-S86 VanDerWaalsContact C-N 3.32Å; V84-S86 PolarHBondContact O-N 2.95Å; S86-S89 PolarHBondContact O-N 3.18Å; S86-Y90 WeakPolarHBondContact O-CB 3.04Å; S86-Y90 PolarHBondContact O-N 3.44Å; S86-Y182 VanDerWaalsContact O-CE1 3.27Å; S86-Y182 WeakPolarHBondContact O-CE1 3.2Å; S86-Y182 PolarHBondContact O-OH 3.21Å
87	G	97.3	Very high	94.9	Very high	41 Å²	41	53.3 Å²	53.3	42%	0.423	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-47.1	-179	0	0	0	0	0	113	L83 V84 S89 Y90 G91	L83-G87 PolarHBondContact O-N 3.48Å; V84-G87 PolarHBondContact O-N 3.31Å; G87-S89 VanDerWaalsContact C-N 3.3Å; G87-S89 PolarHBondContact O-N 2.65Å; G87-Y90 PolarHBondContact O-N 2.87Å; G87-G91 PolarHBondContact O-N 3.19Å
88	L	97.4	Very high	94.9	Very high	84 Å²	84	46.1 Å²	46.1	44%	0.44	26%	0.256	S	S	.	.	H	α-helix	trans	-56.6	-46.6	174.7	-71.4	174.8	0	0	0	110.9	V84 G91 V92 V108 Y112	V84-L88 HydrophobicContact CG1-CD1 3.82Å; V84-L88 HydrophobicContact CG1-CG 4.19Å; V84-L88 WeakPolarHBondContact O-CB 3.32Å; V84-L88 VanDerWaalsContact O-CG 3.29Å; V84-L88 WeakPolarHBondContact O-CG 3.43Å; V84-L88 PolarHBondContact O-N 3.09Å; L88-G91 PolarHBondContact O-N 3.33Å; L88-V92 WeakPolarHBondContact O-CG2 3.45Å; L88-V92 PolarHBondContact O-N 3.22Å; L88-V92 VanDerWaalsContact O-N 3.09Å; L88-V108 HydrophobicContact CB-CG1 3.93Å; L88-Y112 HydrophobicContact CD1-CD2 4.06Å; L88-Y112 HydrophobicContact CD1-CE2 4.29Å
89	S	97.4	Very high	94.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.2	-37.3	-178.1	-51	0	0	0	0	112.6	Q85 S86 G87 V92 M93 T109 I144	Q85-S89 WeakPolarHBondContact O-CB 3.33Å; Q85-S89 PolarHBondContact O-N 2.87Å; Q85-S89 VanDerWaalsContact O-N 3.16Å; Q85-S89 PolarHBondContact O-OG 3.48Å; S86-S89 PolarHBondContact O-N 3.18Å; G87-S89 VanDerWaalsContact C-N 3.3Å; G87-S89 PolarHBondContact O-N 2.65Å; S89-V92 PolarHBondContact O-N 3.08Å; S89-M93 WeakPolarHBondContact O-CG 3.49Å; S89-M93 PolarHBondContact O-N 2.93Å; S89-T109 PolarHBondContact OG-OG1 3.13Å; S89-I144 VanDerWaalsContact CB-CG2 3.47Å
90	Y	97.3	Very high	94.8	Very high	40 Å²	40	50.5 Å²	50.5	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-66.7	-39.9	174.4	-170.1	-105.6	0	0	0	111.6	S86 G87 V92 M93 I94 P177 L179 Y182	S86-Y90 WeakPolarHBondContact O-CB 3.04Å; S86-Y90 PolarHBondContact O-N 3.44Å; G87-Y90 PolarHBondContact O-N 2.87Å; Y90-V92 VanDerWaalsContact C-N 3.3Å; Y90-V92 PolarHBondContact O-N 3.42Å; Y90-M93 WeakPolarHBondContact O-CB 3.26Å; Y90-M93 PolarHBondContact O-N 3.22Å; Y90-I94 HydrophobicContact CD1-CG1 4.11Å; Y90-I94 HydrophobicContact CE1-CD1 4.16Å; Y90-I94 HydrophobicContact CE1-CG1 3.79Å; Y90-I94 HydrophobicContact CE2-CD1 4.43Å; Y90-I94 WeakPolarHBondContact O-CG1 3.44Å; Y90-I94 PolarHBondContact O-N 3.14Å; Y90-P177 PolarHBondContact OH-O 3.07Å; Y90-L179 HydrophobicContact CD1-CD1 3.89Å; Y90-L179 HydrophobicContact CE1-CB 4.28Å; Y90-L179 HydrophobicContact CE1-CD1 3.88Å; Y90-L179 HydrophobicContact CG-CD1 4.4Å; Y90-L179 PolarHBondContact OH-N 2.68Å; Y90-Y182 AromaticContact CD2-CD1 3.65Å; Y90-Y182 HydrophobicContact CD2-CD1 3.65Å; Y90-Y182 AromaticContact CD2-CD2 3.79Å; Y90-Y182 HydrophobicContact CD2-CD2 3.79Å; Y90-Y182 AromaticContact CD2-CE1 3.98Å; Y90-Y182 HydrophobicContact CD2-CE1 3.98Å; Y90-Y182 HydrophobicContact CD2-CE2 4.1Å; Y90-Y182 AromaticContact CD2-CG 3.53Å; Y90-Y182 HydrophobicContact CD2-CG 3.53Å; Y90-Y182 HydrophobicContact CE2-CD1 4.36Å; Y90-Y182 HydrophobicContact CE2-CD2 4.38Å; Y90-Y182 AromaticContact CE2-CG 3.98Å; Y90-Y182 HydrophobicContact CE2-CG 3.98Å; Y90-Y182 HydrophobicContact CG-CD1 4.03Å; Y90-Y182 HydrophobicContact CG-CE1 4.08Å; Y90-Y182 HydrophobicContact CG-CG 4.37Å
91	G	96.7	Very high	94.9	Very high	22 Å²	22	47.5 Å²	47.5	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-55	-46.9	171.4	0	0	0	0	0	111.6	G87 L88 M93 I94 F95	G87-G91 PolarHBondContact O-N 3.19Å; L88-G91 PolarHBondContact O-N 3.33Å; G91-M93 VanDerWaalsContact C-N 3.33Å; G91-M93 PolarHBondContact O-N 3.24Å; G91-I94 PolarHBondContact O-N 3.34Å; G91-F95 WeakPolarHBondContact O-CD2 3.5Å; G91-F95 PolarHBondContact O-N 3.14Å
92	V	96.9	Very high	94.9	Very high	27 Å²	27	45.6 Å²	45.6	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-42.1	174.2	177.9	0	0	0	0	111.7	L88 S89 Y90 I94 F95 A96 Y104 C105 V108	L88-V92 WeakPolarHBondContact O-CG2 3.45Å; L88-V92 PolarHBondContact O-N 3.22Å; L88-V92 VanDerWaalsContact O-N 3.09Å; S89-V92 PolarHBondContact O-N 3.08Å; Y90-V92 VanDerWaalsContact C-N 3.3Å; Y90-V92 PolarHBondContact O-N 3.42Å; V92-I94 VanDerWaalsContact C-N 3.27Å; V92-I94 PolarHBondContact O-N 2.89Å; V92-F95 PolarHBondContact O-N 2.78Å; V92-A96 HydrophobicContact CG1-CB 4.09Å; V92-A96 WeakPolarHBondContact O-CB 3.28Å; V92-A96 PolarHBondContact O-N 2.71Å; V92-Y104 VanDerWaalsContact CG1-CB 3.48Å; V92-C105 VanDerWaalsContact CG1-SG 3.55Å; V92-V108 HydrophobicContact CG2-CB 4.43Å; V92-V108 HydrophobicContact CG2-CG2 4Å
93	M	94.8	Very high	94.9	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.015	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-33.4	177.8	-69.7	175.7	175.9	0	0	113.5	S89 Y90 G91 M101 C105 I144 M147 A148 M176 Y182	S89-M93 WeakPolarHBondContact O-CG 3.49Å; S89-M93 PolarHBondContact O-N 2.93Å; Y90-M93 WeakPolarHBondContact O-CB 3.26Å; Y90-M93 PolarHBondContact O-N 3.22Å; G91-M93 VanDerWaalsContact C-N 3.33Å; G91-M93 PolarHBondContact O-N 3.24Å; M93-M101 HydrophobicContact CB-SD 4.05Å; M93-M101 HydrophobicContact CG-CG 4.34Å; M93-M101 HydrophobicContact CG-SD 4.13Å; M93-C105 WeakPolarHBondContact CG-SG 3.43Å; M93-I144 HydrophobicContact CE-CG2 3.8Å; M93-I144 WeakPolarHBondContact CE-O 3.37Å; M93-M147 HydrophobicContact CE-CB 4.4Å; M93-M147 HydrophobicContact CE-CG 4.39Å; M93-M147 HydrophobicContact CE-SD 4.07Å; M93-M147 HydrophobicContact SD-SD 4.11Å; M93-A148 HydrophobicContact CE-CB 3.77Å; M93-M176 HydrophobicContact CB-CE 4.41Å; M93-M176 HydrophobicContact CB-SD 4.25Å; M93-M176 VanDerWaalsContact O-CE 3.29Å; M93-M176 WeakPolarHBondContact O-CE 3.44Å; M93-Y182 HydrophobicContact CE-CE2 4.32Å; M93-Y182 HydrophobicContact SD-CD2 4.46Å; M93-Y182 HydrophobicContact SD-CE2 3.97Å
94	I	94.5	Very high	95	Very high	83 Å²	83	52.5 Å²	52.5	43%	0.426	28%	0.275	S	S	.	.	H	α-helix	trans	-82.5	-40.1	-179.3	-63	-58.3	0	0	0	112.2	Y90 G91 V92 M176	Y90-I94 HydrophobicContact CD1-CG1 4.11Å; Y90-I94 HydrophobicContact CE1-CD1 4.16Å; Y90-I94 HydrophobicContact CE1-CG1 3.79Å; Y90-I94 HydrophobicContact CE2-CD1 4.43Å; Y90-I94 WeakPolarHBondContact O-CG1 3.44Å; Y90-I94 PolarHBondContact O-N 3.14Å; G91-I94 PolarHBondContact O-N 3.34Å; V92-I94 VanDerWaalsContact C-N 3.27Å; V92-I94 PolarHBondContact O-N 2.89Å; I94-M176 HydrophobicContact CD1-CG 4.07Å
95	F	94.8	Very high	94.9	Very high	182 Å²	182	50 Å²	50	80%	0.798	26%	0.26	S	S	*	.	H	α-helix	trans	-95.1	-25.2	-172.2	-63.7	-62.7	0	0	0	114.4	G91 V92	G91-F95 WeakPolarHBondContact O-CD2 3.5Å; G91-F95 PolarHBondContact O-N 3.14Å; V92-F95 PolarHBondContact O-N 2.78Å
96	A	93.6	Very high	94.9	Very high	25 Å²	25	52.1 Å²	52.1	21%	0.207	27%	0.269	C	S	.	.	S	Bend	trans	-77.5	148.8	179.9	0	0	0	0	0	112	V92 M101 Y104	V92-A96 HydrophobicContact CG1-CB 4.09Å; V92-A96 WeakPolarHBondContact O-CB 3.28Å; V92-A96 PolarHBondContact O-N 2.71Å; A96-M101 HydrophobicContact CB-CB 4.06Å; A96-M101 HydrophobicContact CB-CG 4.43Å; A96-Y104 HydrophobicContact CB-CD2 3.93Å
97	S	91.6	Very high	95	Very high	67 Å²	67	57.4 Å²	57.4	47%	0.469	30%	0.297	S	S	.	.			trans	-66.2	146	170.8	66.3	0	0	0	0	110.8	E99 H100 M101	S97-E99 PolarHBondContact O-N 3.23Å; S97-H100 PolarHBondContact O-N 2.81Å; S97-H100 PolarHBondContact OG-ND1 3.07Å; S97-M101 WeakPolarHBondContact O-CB 3.4Å; S97-M101 PolarHBondContact O-N 3.27Å
98	L	88.1	Confident	95	Very high	67 Å²	67	57.8 Å²	57.8	35%	0.351	29%	0.291	S	S	.	.	H	α-helix	trans	-51.2	-33.7	-178.6	-74.9	172.2	0	0	0	113.3	H100 I151 H152	L98-H100 PolarHBondContact O-N 3.3Å; L98-I151 HydrophobicContact CD2-CG2 4.13Å; L98-H152 PolarHBondContact O-CD2 3.44Å; L98-H152 VanDerWaalsContact O-CD2 3.3Å
99	E	88.4	Confident	95	Very high	116 Å²	116	53.8 Å²	53.8	54%	0.542	27%	0.27	S	S	.	.	H	α-helix	trans	-65.7	-34.5	179.8	-175.9	177.3	-173.6	0	0	113.5	S97 H102	S97-E99 PolarHBondContact O-N 3.23Å; E99-H102 PolarHBondContact O-CE1 3.02Å
100	H	92.1	Very high	95	Very high	58 Å²	58	54.4 Å²	54.4	27%	0.269	27%	0.273	S	S	.	.	H	α-helix	trans	-110.6	-16.3	-173.1	-61.6	90.2	0	0	0	113.6	S97 L98 H102 K103 Y104	S97-H100 PolarHBondContact O-N 2.81Å; S97-H100 PolarHBondContact OG-ND1 3.07Å; L98-H100 PolarHBondContact O-N 3.3Å; H100-H102 PolarHBondContact O-N 2.98Å; H100-K103 WeakPolarHBondContact O-CB 3.4Å; H100-K103 PolarHBondContact O-N 3.3Å; H100-Y104 HydrophobicContact CB-CD2 3.93Å; H100-Y104 HydrophobicContact CB-CE2 3.47Å; H100-Y104 VanDerWaalsContact CB-CE2 3.47Å; H100-Y104 PolarHBondContact O-N 3.33Å
101	M	94.6	Very high	95	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-48.5	-50.4	-175.3	179.9	-171.5	74.3	0	0	113.4	M93 A96 S97 K103 Y104 C105 A148 I151 M176	M93-M101 HydrophobicContact CB-SD 4.05Å; M93-M101 HydrophobicContact CG-CG 4.34Å; M93-M101 HydrophobicContact CG-SD 4.13Å; A96-M101 HydrophobicContact CB-CB 4.06Å; A96-M101 HydrophobicContact CB-CG 4.43Å; S97-M101 WeakPolarHBondContact O-CB 3.4Å; S97-M101 PolarHBondContact O-N 3.27Å; M101-K103 VanDerWaalsContact C-N 3.29Å; M101-K103 PolarHBondContact O-N 3Å; M101-Y104 PolarHBondContact O-N 2.92Å; M101-C105 WeakPolarHBondContact O-CB 3.29Å; M101-C105 PolarHBondContact O-N 3.5Å; M101-C105 PolarHBondContact O-SG 3.34Å; M101-C105 VanDerWaalsContact O-SG 3.33Å; M101-A148 WeakPolarHBondContact CE-O 3.17Å; M101-I151 HydrophobicContact CE-CB 3.65Å; M101-I151 HydrophobicContact CE-CD1 4.29Å; M101-I151 HydrophobicContact CE-CG2 3.61Å; M101-M176 HydrophobicContact SD-CE 4Å
102	H	94.8	Very high	95	Very high	15 Å²	15	55 Å²	55	7%	0.069	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-36.8	-179.1	64.9	-81.1	0	0	0	113	E99 H100 F106 A148 F149 H152	E99-H102 PolarHBondContact O-CE1 3.02Å; H100-H102 PolarHBondContact O-N 2.98Å; H102-F106 WeakPolarHBondContact O-CB 3.4Å; H102-F106 PolarHBondContact O-N 3.21Å; H102-A148 HydrophobicContact CB-CB 4.3Å; H102-F149 HydrophobicContact CB-CD1 4.02Å; H102-F149 HydrophobicContact CB-CD2 4.41Å; H102-F149 HydrophobicContact CB-CE1 4.32Å; H102-F149 HydrophobicContact CB-CG 4.11Å; H102-F149 AromaticContact CD2-CD1 3.7Å; H102-F149 AromaticContact CD2-CE1 3.29Å; H102-F149 WeakPolarHBondContact CD2-CE1 3.5Å; H102-F149 AromaticContact CD2-CZ 3.79Å; H102-H152 HydrophobicContact CB-CB 4.1Å; H102-H152 AromaticContact CE1-CD2 3.32Å; H102-H152 PolarHBondContact CE1-CD2 3.17Å; H102-H152 AromaticContact CE1-CE1 3.66Å; H102-H152 AromaticContact CE1-CG 3.7Å; H102-H152 AromaticContact CE1-ND1 3.94Å; H102-H152 AromaticContact CE1-NE2 3.28Å; H102-H152 PolarHBondContact CE1-NE2 3.17Å; H102-H152 VanDerWaalsContact CE1-NE2 3.28Å; H102-H152 AromaticContact CG-CG 3.97Å; H102-H152 AromaticContact ND1-CD2 3.15Å; H102-H152 PolarHBondContact ND1-CD2 2.84Å; H102-H152 AromaticContact ND1-CG 3.28Å; H102-H152 VanDerWaalsContact ND1-CG 3.28Å; H102-H152 AromaticContact ND1-ND1 3.87Å; H102-H152 AromaticContact ND1-NE2 3.65Å
103	K	95.8	Very high	95.1	Very high	103 Å²	103	53.8 Å²	53.8	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-69.8	-47.7	178.2	-56.1	178.4	-175.8	164.9	0	110.6	H100 M101 F106 I107	H100-K103 WeakPolarHBondContact O-CB 3.4Å; H100-K103 PolarHBondContact O-N 3.3Å; M101-K103 VanDerWaalsContact C-N 3.29Å; M101-K103 PolarHBondContact O-N 3Å; K103-F106 PolarHBondContact O-N 3.21Å; K103-I107 WeakPolarHBondContact O-CG1 3.33Å; K103-I107 PolarHBondContact O-N 3.41Å
104	Y	97.2	Very high	95.1	Very high	116 Å²	116	55.6 Å²	55.6	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-66.1	-43.3	179.4	-62.7	-29.9	0	0	0	111.8	V92 A96 H100 M101 F106 I107 V108	V92-Y104 VanDerWaalsContact CG1-CB 3.48Å; A96-Y104 HydrophobicContact CB-CD2 3.93Å; H100-Y104 HydrophobicContact CB-CD2 3.93Å; H100-Y104 HydrophobicContact CB-CE2 3.47Å; H100-Y104 VanDerWaalsContact CB-CE2 3.47Å; H100-Y104 PolarHBondContact O-N 3.33Å; M101-Y104 PolarHBondContact O-N 2.92Å; Y104-F106 VanDerWaalsContact C-N 3.33Å; Y104-F106 PolarHBondContact O-N 3.38Å; Y104-I107 PolarHBondContact O-N 3.06Å; Y104-V108 WeakPolarHBondContact O-CB 2.91Å; Y104-V108 WeakPolarHBondContact O-CG2 3.47Å; Y104-V108 PolarHBondContact O-N 3.01Å
105	C	96.8	Very high	95.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-48.4	172.5	-73.4	0	0	0	0	110.1	V92 M93 M101 I107 V108 T109 A148	V92-C105 VanDerWaalsContact CG1-SG 3.55Å; M93-C105 WeakPolarHBondContact CG-SG 3.43Å; M101-C105 WeakPolarHBondContact O-CB 3.29Å; M101-C105 PolarHBondContact O-N 3.5Å; M101-C105 PolarHBondContact O-SG 3.34Å; M101-C105 VanDerWaalsContact O-SG 3.33Å; C105-I107 VanDerWaalsContact C-N 3.35Å; C105-I107 PolarHBondContact O-N 2.87Å; C105-V108 PolarHBondContact O-N 3.44Å; C105-T109 WeakPolarHBondContact O-CB 3.4Å; C105-T109 PolarHBondContact O-N 2.93Å; C105-T109 PolarHBondContact O-OG1 3.38Å; C105-A148 HydrophobicContact CB-CB 3.7Å
106	F	97.1	Very high	95	Very high	44 Å²	44	47.8 Å²	47.8	19%	0.193	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-47.4	178.4	-170.3	-89.3	0	0	0	112.8	H102 K103 Y104 L110 T145 F149 V358 L374	H102-F106 WeakPolarHBondContact O-CB 3.4Å; H102-F106 PolarHBondContact O-N 3.21Å; K103-F106 PolarHBondContact O-N 3.21Å; Y104-F106 VanDerWaalsContact C-N 3.33Å; Y104-F106 PolarHBondContact O-N 3.38Å; F106-L110 HydrophobicContact CD1-CD2 4.49Å; F106-L110 HydrophobicContact CE1-CD2 3.73Å; F106-L110 HydrophobicContact CZ-CD2 3.99Å; F106-L110 WeakPolarHBondContact O-CB 3.49Å; F106-L110 PolarHBondContact O-N 2.84Å; F106-T145 HydrophobicContact CB-CG2 4.36Å; F106-T145 HydrophobicContact CD2-CG2 3.77Å; F106-T145 HydrophobicContact CG-CG2 4.39Å; F106-F149 AromaticContact CD2-CE2 3.94Å; F106-F149 HydrophobicContact CD2-CE2 3.94Å; F106-V358 HydrophobicContact CE2-CG2 4.04Å; F106-L374 HydrophobicContact CE1-CD1 4.29Å; F106-L374 HydrophobicContact CE2-CD1 4.41Å; F106-L374 HydrophobicContact CE2-CD2 4.2Å; F106-L374 HydrophobicContact CZ-CD1 3.53Å; F106-L374 HydrophobicContact CZ-CD2 3.79Å; F106-L374 HydrophobicContact CZ-CG 4.32Å
107	I	97.4	Very high	94.8	Very high	112 Å²	112	46.8 Å²	46.8	57%	0.574	24%	0.24	S	C	*	.	H	α-helix	trans	-64.2	-48.8	178.9	-67.9	165.4	0	0	0	111.3	K103 Y104 C105 G111	K103-I107 WeakPolarHBondContact O-CG1 3.33Å; K103-I107 PolarHBondContact O-N 3.41Å; Y104-I107 PolarHBondContact O-N 3.06Å; C105-I107 VanDerWaalsContact C-N 3.35Å; C105-I107 PolarHBondContact O-N 2.87Å; I107-G111 WeakPolarHBondContact O-CA 3.42Å; I107-G111 PolarHBondContact O-N 2.86Å
108	V	97.8	Very high	94.7	Very high	49 Å²	49	46.6 Å²	46.6	30%	0.297	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-47.9	-178.3	170.1	0	0	0	0	110.8	L88 V92 Y104 C105 Y112	L88-V108 HydrophobicContact CB-CG1 3.93Å; V92-V108 HydrophobicContact CG2-CB 4.43Å; V92-V108 HydrophobicContact CG2-CG2 4Å; Y104-V108 WeakPolarHBondContact O-CB 2.91Å; Y104-V108 WeakPolarHBondContact O-CG2 3.47Å; Y104-V108 PolarHBondContact O-N 3.01Å; C105-V108 PolarHBondContact O-N 3.44Å; V108-Y112 VanDerWaalsContact O-CB 3.23Å; V108-Y112 WeakPolarHBondContact O-CB 3.31Å; V108-Y112 PolarHBondContact O-N 2.96Å
109	T	97.2	Very high	94.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.7	-48.2	-176.2	-49.9	0	0	0	0	111.6	Q85 S89 C105 L113 T141 I144 T145	Q85-T109 HydrophobicContact CG-CG2 4.08Å; S89-T109 PolarHBondContact OG-OG1 3.13Å; C105-T109 WeakPolarHBondContact O-CB 3.4Å; C105-T109 PolarHBondContact O-N 2.93Å; C105-T109 PolarHBondContact O-OG1 3.38Å; T109-L113 PolarHBondContact O-N 2.82Å; T109-L113 VanDerWaalsContact O-N 3.14Å; T109-T141 HydrophobicContact CG2-CG2 3.88Å; T109-I144 HydrophobicContact CG2-CB 4.18Å; T109-I144 HydrophobicContact CG2-CD1 4.18Å; T109-I144 HydrophobicContact CG2-CG2 4.15Å; T109-I144 WeakPolarHBondContact OG1-CG2 3.3Å; T109-T145 HydrophobicContact CG2-CG2 4.38Å
110	L	97.5	Very high	94.2	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-39.7	179.2	-174	65.4	0	0	0	111.5	F106 L113 I114 T141 L374	F106-L110 HydrophobicContact CD1-CD2 4.49Å; F106-L110 HydrophobicContact CE1-CD2 3.73Å; F106-L110 HydrophobicContact CZ-CD2 3.99Å; F106-L110 WeakPolarHBondContact O-CB 3.49Å; F106-L110 PolarHBondContact O-N 2.84Å; L110-L113 HydrophobicContact CD1-CD2 4.31Å; L110-L113 WeakPolarHBondContact O-CB 3.48Å; L110-L113 PolarHBondContact O-N 2.82Å; L110-I114 HydrophobicContact CG-CD1 4.01Å; L110-I114 VanDerWaalsContact O-CG1 3.32Å; L110-I114 WeakPolarHBondContact O-CG1 3.37Å; L110-I114 PolarHBondContact O-N 3.29Å; L110-T141 HydrophobicContact CD1-CG2 4.36Å; L110-L374 HydrophobicContact CD2-CD1 3.69Å
111	G	97.5	Very high	93.6	Very high	37 Å²	37	40.1 Å²	40.1	38%	0.381	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-41.5	177.5	0	0	0	0	0	112.4	I107 I114 L115	I107-G111 WeakPolarHBondContact O-CA 3.42Å; I107-G111 PolarHBondContact O-N 2.86Å; G111-I114 PolarHBondContact O-N 3.09Å; G111-L115 PolarHBondContact O-N 3.42Å
112	Y	97.5	Very high	92.5	Very high	39 Å²	39	49.2 Å²	49.2	15%	0.153	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-40.6	174.9	-169.6	-100.4	0	0	0	112.3	H81 V84 Q85 L88 V108 L115 C116 M137	H81-Y112 HydrophobicContact CB-CE1 4.3Å; H81-Y112 AromaticContact ND1-CZ 3.75Å; H81-Y112 PolarHBondContact ND1-OH 2.88Å; V84-Y112 HydrophobicContact CB-CE1 4.38Å; V84-Y112 HydrophobicContact CG1-CE1 4.19Å; V84-Y112 HydrophobicContact CG1-CE2 3.9Å; V84-Y112 VanDerWaalsContact CG1-OH 3.25Å; V84-Y112 WeakPolarHBondContact CG1-OH 3.3Å; Q85-Y112 HydrophobicContact CB-CD1 3.63Å; Q85-Y112 HydrophobicContact CB-CE1 3.91Å; Q85-Y112 HydrophobicContact CG-CD1 3.94Å; L88-Y112 HydrophobicContact CD1-CD2 4.06Å; L88-Y112 HydrophobicContact CD1-CE2 4.29Å; V108-Y112 VanDerWaalsContact O-CB 3.23Å; V108-Y112 WeakPolarHBondContact O-CB 3.31Å; V108-Y112 PolarHBondContact O-N 2.96Å; Y112-L115 PolarHBondContact O-N 2.8Å; Y112-C116 PolarHBondContact O-N 2.87Å; Y112-M137 HydrophobicContact CD1-CE 3.72Å; Y112-M137 HydrophobicContact CE1-CE 3.73Å
113	L	97	Very high	91.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-49.2	172.5	172.4	65.7	0	0	0	111.2	T109 L110 L115 C116 Q117 M137 M138 T141	T109-L113 PolarHBondContact O-N 2.82Å; T109-L113 VanDerWaalsContact O-N 3.14Å; L110-L113 HydrophobicContact CD1-CD2 4.31Å; L110-L113 WeakPolarHBondContact O-CB 3.48Å; L110-L113 PolarHBondContact O-N 2.82Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 3.48Å; L113-C116 PolarHBondContact O-N 3.4Å; L113-Q117 HydrophobicContact CD1-CG 4.22Å; L113-Q117 HydrophobicContact CG-CG 4.46Å; L113-Q117 WeakPolarHBondContact O-CG 3.3Å; L113-Q117 PolarHBondContact O-N 3.12Å; L113-M137 HydrophobicContact CD1-CB 3.68Å; L113-M138 HydrophobicContact CD1-CG 4Å; L113-M138 HydrophobicContact CD2-CG 3.88Å; L113-T141 HydrophobicContact CD2-CG2 4.37Å
114	I	95.4	Very high	89.7	Confident	41 Å²	41	50.7 Å²	50.7	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-41.9	179	-69.9	166.6	0	0	0	110.6	L110 G111 C116 Q117 I118 M377 V381	L110-I114 HydrophobicContact CG-CD1 4.01Å; L110-I114 VanDerWaalsContact O-CG1 3.32Å; L110-I114 WeakPolarHBondContact O-CG1 3.37Å; L110-I114 PolarHBondContact O-N 3.29Å; G111-I114 PolarHBondContact O-N 3.09Å; I114-C116 PolarHBondContact O-N 2.76Å; I114-Q117 PolarHBondContact O-N 3.24Å; I114-I118 HydrophobicContact CG2-CD1 3.8Å; I114-I118 HydrophobicContact CG2-CG1 4.28Å; I114-I118 WeakPolarHBondContact O-CB 3.37Å; I114-I118 VanDerWaalsContact O-CG1 3.29Å; I114-I118 WeakPolarHBondContact O-CG1 3.23Å; I114-I118 PolarHBondContact O-N 3.5Å; I114-M377 HydrophobicContact CD1-CB 4.41Å; I114-V381 HydrophobicContact CG2-CG1 4.1Å
115	L	94.4	Very high	87.7	Confident	97 Å²	97	51.7 Å²	51.7	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-58	-47.9	175.5	178.8	63.7	0	0	0	111.3	G111 Y112 L113 Q117 I118 T119	G111-L115 PolarHBondContact O-N 3.42Å; Y112-L115 PolarHBondContact O-N 2.8Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 3.48Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.04Å; L115-I118 WeakPolarHBondContact O-CB 3.48Å; L115-I118 PolarHBondContact O-N 2.87Å; L115-T119 PolarHBondContact O-N 3.3Å; L115-T119 PolarHBondContact O-OG1 2.66Å; L115-T119 VanDerWaalsContact O-OG1 3.06Å
116	C	92.4	Very high	85.5	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.034	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-36.7	177	-73.5	0	0	0	0	112.7	Y112 L113 I114 T119 R120 F133 T134 M137	Y112-C116 PolarHBondContact O-N 2.87Å; L113-C116 PolarHBondContact O-N 3.4Å; I114-C116 PolarHBondContact O-N 2.76Å; C116-T119 PolarHBondContact O-N 3.48Å; C116-R120 WeakPolarHBondContact O-CB 3.09Å; C116-R120 PolarHBondContact O-N 3.46Å; C116-F133 HydrophobicContact CB-CE2 4.07Å; C116-F133 HydrophobicContact CB-CZ 4.36Å; C116-T134 HydrophobicContact CB-CG2 4.15Å; C116-M137 HydrophobicContact CB-CE 3.87Å; C116-M137 HydrophobicContact CB-SD 4.08Å
117	Q	90.7	Very high	83.3	Confident	3 Å²	3	56.7 Å²	56.7	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-40.1	174.1	-71.9	168.3	-22.6	0	0	111.7	L113 I114 L115 R120 V121 T134 W378 H379	L113-Q117 HydrophobicContact CD1-CG 4.22Å; L113-Q117 HydrophobicContact CG-CG 4.46Å; L113-Q117 WeakPolarHBondContact O-CG 3.3Å; L113-Q117 PolarHBondContact O-N 3.12Å; I114-Q117 PolarHBondContact O-N 3.24Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.04Å; Q117-R120 WeakPolarHBondContact O-CB 3.27Å; Q117-R120 PolarHBondContact O-N 2.99Å; Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 3.21Å; Q117-T134 HydrophobicContact CG-CG2 3.94Å; Q117-W378 PolarHBondContact NE2-O 2.92Å; Q117-H379 PolarHBondContact NE2-O 3.18Å
118	I	89.3	Confident	81	Confident	63 Å²	63	56.7 Å²	56.7	32%	0.323	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-53.4	173	-72.4	169.8	0	0	0	109.6	I114 L115 R120 V121 Y122 V381	I114-I118 HydrophobicContact CG2-CD1 3.8Å; I114-I118 HydrophobicContact CG2-CG1 4.28Å; I114-I118 WeakPolarHBondContact O-CB 3.37Å; I114-I118 VanDerWaalsContact O-CG1 3.29Å; I114-I118 WeakPolarHBondContact O-CG1 3.23Å; I114-I118 PolarHBondContact O-N 3.5Å; L115-I118 WeakPolarHBondContact O-CB 3.48Å; L115-I118 PolarHBondContact O-N 2.87Å; I118-R120 PolarHBondContact O-N 3.22Å; I118-V121 PolarHBondContact O-N 3.38Å; I118-Y122 HydrophobicContact CG2-CD2 3.65Å; I118-Y122 HydrophobicContact CG2-CE2 3.82Å; I118-Y122 VanDerWaalsContact O-CD2 3.25Å; I118-Y122 WeakPolarHBondContact O-CD2 3.43Å; I118-Y122 PolarHBondContact O-N 3.04Å; I118-V381 HydrophobicContact CD1-CG1 4.27Å; I118-V381 HydrophobicContact CG1-CB 4.39Å; I118-V381 HydrophobicContact CG1-CG1 3.64Å; I118-V381 HydrophobicContact CG1-CG2 4.11Å
119	T	84.6	Confident	78.7	Confident	62 Å²	62	61.1 Å²	61.1	38%	0.38	31%	0.307	S	S	.	.	H	α-helix	trans	-52.8	-41.6	175.9	-57.9	0	0	0	0	110.3	L115 C116 V121 Y122 V123	L115-T119 PolarHBondContact O-N 3.3Å; L115-T119 PolarHBondContact O-OG1 2.66Å; L115-T119 VanDerWaalsContact O-OG1 3.06Å; C116-T119 PolarHBondContact O-N 3.48Å; T119-V121 PolarHBondContact O-N 2.91Å; T119-Y122 PolarHBondContact O-N 3.27Å; T119-V123 HydrophobicContact CG2-CB 4.42Å; T119-V123 HydrophobicContact CG2-CG2 3.76Å; T119-V123 WeakPolarHBondContact O-CB 3.26Å; T119-V123 WeakPolarHBondContact O-CG2 3.28Å; T119-V123 PolarHBondContact O-N 3.37Å
120	R	80.5	Confident	76.6	Confident	23 Å²	23	63.7 Å²	63.7	9%	0.087	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-50.1	176.8	-172.3	178.2	67	78.4	-20.2	112.4	C116 Q117 I118 Y122 F124 D132 F133 Y382	C116-R120 WeakPolarHBondContact O-CB 3.09Å; C116-R120 PolarHBondContact O-N 3.46Å; Q117-R120 WeakPolarHBondContact O-CB 3.27Å; Q117-R120 PolarHBondContact O-N 2.99Å; I118-R120 PolarHBondContact O-N 3.22Å; R120-Y122 VanDerWaalsContact C-N 3.31Å; R120-Y122 PolarHBondContact O-N 3.27Å; R120-F124 HydrophobicContact CG-CB 4.46Å; R120-F124 HydrophobicContact CG-CD2 4.04Å; R120-F124 WeakPolarHBondContact O-CA 3.41Å; R120-F124 WeakPolarHBondContact O-CB 3.41Å; R120-F124 PolarHBondContact O-N 2.93Å; R120-F124 VanDerWaalsContact O-O 3.06Å; R120-D132 WeakPolarHBondContact CD-OD1 3.27Å; R120-D132 IonicContact CZ-OD2 2.92Å; R120-D132 IonicContact NE-OD1 2.79Å; R120-D132 PolarHBondContact NE-OD1 3.32Å; R120-D132 IonicContact NE-OD2 3.63Å; R120-D132 PolarHBondContact NE-OD2 3.3Å; R120-D132 IonicContact NH2-OD2 3.35Å; R120-D132 PolarHBondContact NH2-OD2 2.99Å; R120-F133 HydrophobicContact CB-CE1 4.45Å; R120-Y382 PolarHBondContact NH1-OH 3.34Å
121	V	79.4	Confident	74.6	Confident	20 Å²	20	64.3 Å²	64.3	12%	0.121	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-35.5	-177.3	174.7	0	0	0	0	112.8	Q117 I118 T119 Y126 V381 Y382	Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 3.21Å; I118-V121 PolarHBondContact O-N 3.38Å; T119-V121 PolarHBondContact O-N 2.91Å; V121-Y126 HydrophobicContact CG1-CD2 3.97Å; V121-Y126 HydrophobicContact CG1-CE2 4.3Å; V121-V381 HydrophobicContact CB-CG2 4.33Å; V121-V381 HydrophobicContact CG2-CG2 3.73Å; V121-Y382 HydrophobicContact CG1-CE1 4.43Å; V121-Y382 HydrophobicContact CG2-CD2 4.19Å; V121-Y382 HydrophobicContact CG2-CE1 4.12Å; V121-Y382 HydrophobicContact CG2-CE2 3.52Å
122	Y	73	Confident	73.6	Confident	192 Å²	192	64.4 Å²	64.4	75%	0.753	32%	0.324	S	S	*	.	H	α-helix	trans	-92	-23.1	-176.5	-72.1	-76	0	0	0	114	I118 T119 R120	I118-Y122 HydrophobicContact CG2-CD2 3.65Å; I118-Y122 HydrophobicContact CG2-CE2 3.82Å; I118-Y122 VanDerWaalsContact O-CD2 3.25Å; I118-Y122 WeakPolarHBondContact O-CD2 3.43Å; I118-Y122 PolarHBondContact O-N 3.04Å; T119-Y122 PolarHBondContact O-N 3.27Å; R120-Y122 VanDerWaalsContact C-N 3.31Å; R120-Y122 PolarHBondContact O-N 3.27Å
123	V	69.1	Low	73	Confident	97 Å²	97	63 Å²	63	59%	0.588	32%	0.319	S	S	*	.	H	α-helix	trans	-99.2	-32.9	-178.8	178.5	0	0	0	0	112.2	T119	T119-V123 HydrophobicContact CG2-CB 4.42Å; T119-V123 HydrophobicContact CG2-CG2 3.76Å; T119-V123 WeakPolarHBondContact O-CB 3.26Å; T119-V123 WeakPolarHBondContact O-CG2 3.28Å; T119-V123 PolarHBondContact O-N 3.37Å
124	F	62.2	Low	72.7	Confident	52 Å²	52	63 Å²	63	23%	0.228	32%	0.319	C	S	.	.	S	Bend	trans	-109.5	126.3	176.5	-59.8	-89.2	0	0	0	108.8	T10 Y78 R120 Y126 F133	T10-F124 HydrophobicContact CG2-CE1 3.91Å; T10-F124 HydrophobicContact CG2-CZ 4.02Å; Y78-F124 HydrophobicContact CE1-CE2 4.07Å; Y78-F124 AromaticContact CE1-CZ 3.94Å; Y78-F124 HydrophobicContact CE1-CZ 3.94Å; Y78-F124 HydrophobicContact CE2-CZ 4.08Å; Y78-F124 AromaticContact CZ-CZ 3.5Å; Y78-F124 VanDerWaalsContact CZ-CZ 3.5Å; Y78-F124 VanDerWaalsContact OH-CZ 3.25Å; Y78-F124 WeakPolarHBondContact OH-CZ 3.2Å; R120-F124 HydrophobicContact CG-CB 4.46Å; R120-F124 HydrophobicContact CG-CD2 4.04Å; R120-F124 WeakPolarHBondContact O-CA 3.41Å; R120-F124 WeakPolarHBondContact O-CB 3.41Å; R120-F124 PolarHBondContact O-N 2.93Å; R120-F124 VanDerWaalsContact O-O 3.06Å; F124-Y126 PolarHBondContact O-N 3.25Å; F124-F133 HydrophobicContact CE2-CE1 4.36Å
125	D	54.9	Low	72.5	Confident	137 Å²	137	62.4 Å²	62.4	73%	0.733	32%	0.322	S	S	*	.			trans	-40.3	133.3	-172.6	-73.5	-50.4	0	0	0	114.1	G127 M128	D125-G127 PolarHBondContact O-N 3.21Å; D125-G127 VanDerWaalsContact O-N 3.13Å; D125-M128 HydrophobicContact CB-CG 4.1Å; D125-M128 PolarHBondContact O-N 3.01Å
126	Y	51.5	Low	72.5	Confident	122 Å²	122	57.9 Å²	57.9	48%	0.478	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	116.5	-178.4	-168.4	-83.9	0	0	0	110.9	V121 F124 Y382 A443	V121-Y126 HydrophobicContact CG1-CD2 3.97Å; V121-Y126 HydrophobicContact CG1-CE2 4.3Å; F124-Y126 PolarHBondContact O-N 3.25Å; Y126-Y382 AromaticContact CD2-CE1 3.91Å; Y126-Y382 HydrophobicContact CD2-CE1 3.91Å; Y126-Y382 HydrophobicContact CE1-CE1 4.35Å; Y126-Y382 AromaticContact CE2-CD1 3.82Å; Y126-Y382 HydrophobicContact CE2-CD1 3.82Å; Y126-Y382 AromaticContact CE2-CE1 3.65Å; Y126-Y382 HydrophobicContact CE2-CE1 3.65Å; Y126-Y382 HydrophobicContact CG-CE1 4.38Å; Y126-Y382 AromaticContact CZ-CD1 3.83Å; Y126-Y382 AromaticContact CZ-CE1 3.89Å; Y126-A443 HydrophobicContact CE1-CB 4.08Å; Y126-A443 WeakPolarHBondContact OH-CA 3.01Å
127	G	49.6	Very low	72.6	Confident	28 Å²	28	57.6 Å²	57.6	29%	0.289	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	5	172.6	0	0	0	0	0	116	D125 Y129	D125-G127 PolarHBondContact O-N 3.21Å; D125-G127 VanDerWaalsContact O-N 3.13Å; G127-Y129 PolarHBondContact O-N 3.01Å
128	M	50.6	Low	72.9	Confident	111 Å²	111	58.5 Å²	58.5	55%	0.547	30%	0.301	S	S	.	.			trans	-73.5	120.6	172.1	-69.7	-63.4	-72	0	0	111.4	D125 S130	D125-M128 HydrophobicContact CB-CG 4.1Å; D125-M128 PolarHBondContact O-N 3.01Å; M128-S130 PolarHBondContact O-N 2.84Å
129	Y	49.1	Very low	73.2	Confident	143 Å²	143	56.1 Å²	56.1	56%	0.561	29%	0.289	S	S	*	.			trans	-79.3	55.7	176.1	-69.6	-84.1	0	0	0	111.9	G127 V440	G127-Y129 PolarHBondContact O-N 3.01Å; Y129-V440 PolarHBondContact OH-O 3.39Å
130	S	53	Low	73.8	Confident	54 Å²	54	53.1 Å²	53.1	38%	0.378	27%	0.271	S	S	.	.			trans	-80.5	160.1	172.7	59.1	0	0	0	0	111.9	D27 M128 D132	D27-S130 VanDerWaalsContact OD2-C 3.26Å; D27-S130 WeakPolarHBondContact OD2-CA 3.46Å; D27-S130 WeakPolarHBondContact OD2-CB 3.23Å; M128-S130 PolarHBondContact O-N 2.84Å; S130-D132 VanDerWaalsContact C-N 3.31Å; S130-D132 PolarHBondContact O-N 3.5Å
131	A	55.9	Low	74.6	Confident	25 Å²	25	52 Å²	52	21%	0.207	27%	0.267	C	S	.	.			trans	-62.2	95.1	170.8	0	0	0	0	0	108.7	D27 F75 F133	D27-A131 HydrophobicContact CB-CB 3.74Å; D27-A131 PolarHBondContact OD2-N 2.9Å; F75-A131 HydrophobicContact CE1-CB 4.38Å; A131-F133 PolarHBondContact O-N 3.02Å
132	D	75.1	Confident	75.5	Confident	39 Å²	39	51.2 Å²	51.2	21%	0.209	26%	0.262	C	S	.	.			trans	-68	114.4	-172.8	-172.4	-11	0	0	0	110.7	R120 S130 T134 G135 P136	R120-D132 WeakPolarHBondContact CD-OD1 3.27Å; R120-D132 IonicContact CZ-OD2 2.92Å; R120-D132 IonicContact NE-OD1 2.79Å; R120-D132 PolarHBondContact NE-OD1 3.32Å; R120-D132 IonicContact NE-OD2 3.63Å; R120-D132 PolarHBondContact NE-OD2 3.3Å; R120-D132 IonicContact NH2-OD2 3.35Å; R120-D132 PolarHBondContact NH2-OD2 2.99Å; S130-D132 VanDerWaalsContact C-N 3.31Å; S130-D132 PolarHBondContact O-N 3.5Å; D132-T134 PolarHBondContact O-N 2.99Å; D132-T134 VanDerWaalsContact O-N 3.12Å; D132-T134 WeakPolarHBondContact OD1-CA 3.37Å; D132-T134 VanDerWaalsContact OD1-CB 3.26Å; D132-T134 WeakPolarHBondContact OD1-CB 3.39Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.29Å; D132-T134 PolarHBondContact OD1-N 3.07Å; D132-T134 PolarHBondContact OD1-OG1 2.92Å; D132-T134 PolarHBondContact OD2-OG1 2.75Å; D132-G135 PolarHBondContact O-N 3.31Å; D132-P136 WeakPolarHBondContact O-CD 3.29Å
133	F	85.8	Confident	76.7	Confident	10 Å²	10	42.2 Å²	42.2	4%	0.044	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.8	175.3	74.3	-90	0	0	0	112.3	F75 Y78 H81 F82 C116 R120 F124 A131 G135 P136 M137	F75-F133 HydrophobicContact CB-CB 4.15Å; F75-F133 HydrophobicContact CD1-CB 3.68Å; F75-F133 HydrophobicContact CE1-CB 4.31Å; F75-F133 HydrophobicContact CG-CB 3.99Å; Y78-F133 HydrophobicContact CD1-CD1 4.01Å; Y78-F133 HydrophobicContact CD1-CD2 4.44Å; Y78-F133 AromaticContact CD1-CE1 3.78Å; Y78-F133 HydrophobicContact CD1-CE1 3.78Å; Y78-F133 HydrophobicContact CD1-CE2 4.23Å; Y78-F133 HydrophobicContact CD1-CG 4.35Å; Y78-F133 AromaticContact CD1-CZ 3.91Å; Y78-F133 HydrophobicContact CD1-CZ 3.91Å; Y78-F133 HydrophobicContact CE1-CE1 4.28Å; Y78-F133 HydrophobicContact CG-CD1 4.19Å; Y78-F133 HydrophobicContact CG-CE1 4.42Å; Y78-F133 HydrophobicContact CG-CG 4.32Å; H81-F133 AromaticContact CD2-CE2 3.95Å; F82-F133 HydrophobicContact CE1-CB 4.29Å; F82-F133 HydrophobicContact CE1-CD2 4.37Å; F82-F133 WeakPolarHBondContact CE1-O 3.36Å; F82-F133 HydrophobicContact CZ-CB 4.36Å; C116-F133 HydrophobicContact CB-CE2 4.07Å; C116-F133 HydrophobicContact CB-CZ 4.36Å; R120-F133 HydrophobicContact CB-CE1 4.45Å; F124-F133 HydrophobicContact CE2-CE1 4.36Å; A131-F133 PolarHBondContact O-N 3.02Å; F133-G135 PolarHBondContact O-N 3.05Å; F133-P136 WeakPolarHBondContact O-CD 3.49Å; F133-M137 HydrophobicContact CD2-SD 3.85Å; F133-M137 HydrophobicContact CE2-SD 3.87Å
134	T	90	Very high	78	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-74.1	-14.9	174.5	74	0	0	0	0	112.6	C116 Q117 D132 M137 M138	C116-T134 HydrophobicContact CB-CG2 4.15Å; Q117-T134 HydrophobicContact CG-CG2 3.94Å; D132-T134 PolarHBondContact O-N 2.99Å; D132-T134 VanDerWaalsContact O-N 3.12Å; D132-T134 WeakPolarHBondContact OD1-CA 3.37Å; D132-T134 VanDerWaalsContact OD1-CB 3.26Å; D132-T134 WeakPolarHBondContact OD1-CB 3.39Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.29Å; D132-T134 PolarHBondContact OD1-N 3.07Å; D132-T134 PolarHBondContact OD1-OG1 2.92Å; D132-T134 PolarHBondContact OD2-OG1 2.75Å; T134-M137 HydrophobicContact CG2-SD 4.39Å; T134-M137 CarbonylContact O-C 3.51Å; T134-M137 WeakPolarHBondContact O-CB 3.2Å; T134-M137 PolarHBondContact O-N 3.05Å; T134-M137 VanDerWaalsContact O-N 3.17Å; T134-M138 VanDerWaalsContact O-CG 3.28Å; T134-M138 WeakPolarHBondContact O-CG 3.35Å; T134-M138 PolarHBondContact O-N 3.24Å
135	G	91.2	Very high	79.7	Confident	27 Å²	27	35.1 Å²	35.1	28%	0.278	19%	0.188	S	C	.	.	H	α-helix	trans	-59.6	-54	173.5	0	0	0	0	0	113.4	D132 F133 M137 M138 V139	D132-G135 PolarHBondContact O-N 3.31Å; F133-G135 PolarHBondContact O-N 3.05Å; G135-M137 VanDerWaalsContact C-N 3.29Å; G135-M137 PolarHBondContact O-N 2.66Å; G135-M138 WeakPolarHBondContact O-CB 3.37Å; G135-M138 PolarHBondContact O-N 3.45Å; G135-V139 PolarHBondContact O-N 2.93Å
136	P	93.9	Very high	81.7	Confident	2 Å²	2	29 Å²	29	1%	0.013	16%	0.156	C	C	.	.	H	α-helix	trans	-53.5	-41.4	167.2	-31.8	36.4	0	0	0	114	F75 F82 D132 F133 M138 V139 I140 I192	F75-P136 HydrophobicContact CD2-CG 4.39Å; F75-P136 HydrophobicContact CE2-CG 3.48Å; F75-P136 VanDerWaalsContact CE2-CG 3.48Å; F75-P136 HydrophobicContact CZ-CG 3.56Å; F82-P136 HydrophobicContact CD2-CB 4.34Å; F82-P136 HydrophobicContact CE1-CB 4.14Å; F82-P136 HydrophobicContact CE2-CB 3.72Å; F82-P136 HydrophobicContact CE2-CG 4.11Å; F82-P136 HydrophobicContact CZ-CB 3.63Å; F82-P136 HydrophobicContact CZ-CG 3.84Å; D132-P136 WeakPolarHBondContact O-CD 3.29Å; F133-P136 WeakPolarHBondContact O-CD 3.49Å; P136-M138 VanDerWaalsContact C-N 3.29Å; P136-M138 PolarHBondContact O-N 2.87Å; P136-V139 WeakPolarHBondContact O-CB 3.33Å; P136-V139 PolarHBondContact O-N 3.34Å; P136-V139 VanDerWaalsContact O-N 3.16Å; P136-I140 WeakPolarHBondContact O-CG1 3.33Å; P136-I140 PolarHBondContact O-N 3.04Å; P136-I192 VanDerWaalsContact CB-O 3.25Å; P136-I192 WeakPolarHBondContact CB-O 3.46Å
137	M	95.7	Very high	83.9	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.2	-35	178.7	-64.9	178.8	67.8	0	0	112.2	H81 F82 Q85 Y112 L113 C116 F133 T134 G135 V139 I140 T141	H81-M137 HydrophobicContact CB-CE 4.11Å; H81-M137 HydrophobicContact CB-SD 3.87Å; F82-M137 HydrophobicContact CD1-CG 3.49Å; F82-M137 VanDerWaalsContact CD1-CG 3.49Å; F82-M137 HydrophobicContact CD1-SD 4.27Å; F82-M137 HydrophobicContact CE1-CG 3.7Å; F82-M137 HydrophobicContact CE1-SD 4.34Å; Q85-M137 HydrophobicContact CB-CE 4.49Å; Q85-M137 PolarHBondContact NE2-O 3.36Å; Y112-M137 HydrophobicContact CD1-CE 3.72Å; Y112-M137 HydrophobicContact CE1-CE 3.73Å; L113-M137 HydrophobicContact CD1-CB 3.68Å; C116-M137 HydrophobicContact CB-CE 3.87Å; C116-M137 HydrophobicContact CB-SD 4.08Å; F133-M137 HydrophobicContact CD2-SD 3.85Å; F133-M137 HydrophobicContact CE2-SD 3.87Å; T134-M137 HydrophobicContact CG2-SD 4.39Å; T134-M137 CarbonylContact O-C 3.51Å; T134-M137 WeakPolarHBondContact O-CB 3.2Å; T134-M137 PolarHBondContact O-N 3.05Å; T134-M137 VanDerWaalsContact O-N 3.17Å; G135-M137 VanDerWaalsContact C-N 3.29Å; G135-M137 PolarHBondContact O-N 2.66Å; M137-V139 VanDerWaalsContact C-N 3.34Å; M137-I140 PolarHBondContact O-N 3Å; M137-T141 WeakPolarHBondContact O-CB 3.27Å; M137-T141 PolarHBondContact O-N 3.44Å; M137-T141 PolarHBondContact O-OG1 2.97Å
138	M	96.2	Very high	86.1	Confident	22 Å²	22	21.9 Å²	21.9	11%	0.108	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-44.1	173.2	-75.5	170.6	70.4	0	0	110.9	L113 T134 G135 P136 T141 Q142 W378	L113-M138 HydrophobicContact CD1-CG 4Å; L113-M138 HydrophobicContact CD2-CG 3.88Å; T134-M138 VanDerWaalsContact O-CG 3.28Å; T134-M138 WeakPolarHBondContact O-CG 3.35Å; T134-M138 PolarHBondContact O-N 3.24Å; G135-M138 WeakPolarHBondContact O-CB 3.37Å; G135-M138 PolarHBondContact O-N 3.45Å; P136-M138 VanDerWaalsContact C-N 3.29Å; P136-M138 PolarHBondContact O-N 2.87Å; M138-T141 WeakPolarHBondContact O-CB 3.43Å; M138-T141 PolarHBondContact O-N 2.89Å; M138-Q142 WeakPolarHBondContact O-CG 3.34Å; M138-Q142 PolarHBondContact O-N 3.09Å; M138-W378 HydrophobicContact CB-CZ2 3.62Å; M138-W378 HydrophobicContact CE-CD2 3.46Å; M138-W378 VanDerWaalsContact CE-CD2 3.46Å; M138-W378 HydrophobicContact CE-CE3 3.37Å; M138-W378 HydrophobicContact CE-CG 4.29Å; M138-W378 HydrophobicContact CE-CH2 3.42Å; M138-W378 VanDerWaalsContact CE-CH2 3.42Å; M138-W378 HydrophobicContact CE-CZ2 3.52Å; M138-W378 HydrophobicContact CE-CZ3 3.34Å; M138-W378 WeakPolarHBondContact CE-O 3.48Å; M138-W378 HydrophobicContact CG-CZ2 4.37Å; M138-W378 PolarHBondContact O-NE1 3.44Å
139	V	96.1	Very high	88.3	Confident	12 Å²	12	17.6 Å²	17.6	7%	0.073	10%	0.098	C	C	.	.	H	α-helix	trans	-64.7	-45.2	175.7	163.8	0	0	0	0	111.8	G135 P136 M137 T141 Q142 K143 T197	G135-V139 PolarHBondContact O-N 2.93Å; P136-V139 WeakPolarHBondContact O-CB 3.33Å; P136-V139 PolarHBondContact O-N 3.34Å; P136-V139 VanDerWaalsContact O-N 3.16Å; M137-V139 VanDerWaalsContact C-N 3.34Å; V139-T141 VanDerWaalsContact C-N 3.3Å; V139-T141 PolarHBondContact O-N 3.47Å; V139-Q142 WeakPolarHBondContact O-CB 3.46Å; V139-Q142 PolarHBondContact O-N 3.42Å; V139-K143 HydrophobicContact CG1-CD 4.45Å; V139-K143 PolarHBondContact O-N 3.09Å; V139-K143 VanDerWaalsContact O-N 3.11Å; V139-T197 HydrophobicContact CG1-CG2 4.05Å
140	I	97.1	Very high	90.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-40.6	176.1	-69.2	169.1	0	0	0	110.6	F82 P136 M137 Q142 K143 I144 N186	F82-I140 HydrophobicContact CB-CD1 3.78Å; F82-I140 HydrophobicContact CG-CD1 4.18Å; P136-I140 WeakPolarHBondContact O-CG1 3.33Å; P136-I140 PolarHBondContact O-N 3.04Å; M137-I140 PolarHBondContact O-N 3Å; I140-Q142 VanDerWaalsContact C-N 3.31Å; I140-Q142 PolarHBondContact O-N 2.85Å; I140-K143 PolarHBondContact O-N 2.96Å; I140-I144 HydrophobicContact CG2-CD1 3.41Å; I140-I144 VanDerWaalsContact CG2-CD1 3.41Å; I140-I144 HydrophobicContact CG2-CG1 4.04Å; I140-I144 WeakPolarHBondContact O-CB 3.45Å; I140-I144 WeakPolarHBondContact O-CG1 3.41Å; I140-I144 PolarHBondContact O-N 2.69Å; I140-N186 HydrophobicContact CG2-CB 4.44Å
141	T	97.8	Very high	92.5	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-56.3	-46.7	176.4	-58.1	0	0	0	0	111.5	Q85 T109 L110 L113 M137 M138 V139 T145	Q85-T141 PolarHBondContact NE2-OG1 2.9Å; T109-T141 HydrophobicContact CG2-CG2 3.88Å; L110-T141 HydrophobicContact CD1-CG2 4.36Å; L113-T141 HydrophobicContact CD2-CG2 4.37Å; M137-T141 WeakPolarHBondContact O-CB 3.27Å; M137-T141 PolarHBondContact O-N 3.44Å; M137-T141 PolarHBondContact O-OG1 2.97Å; M138-T141 WeakPolarHBondContact O-CB 3.43Å; M138-T141 PolarHBondContact O-N 2.89Å; V139-T141 VanDerWaalsContact C-N 3.3Å; V139-T141 PolarHBondContact O-N 3.47Å; T141-T145 HydrophobicContact CG2-CG2 4.37Å; T141-T145 WeakPolarHBondContact O-CB 3.25Å; T141-T145 VanDerWaalsContact O-CG2 3.29Å; T141-T145 WeakPolarHBondContact O-CG2 3.4Å; T141-T145 PolarHBondContact O-N 3.46Å; T141-T145 PolarHBondContact O-OG1 3.32Å
142	Q	98	Very high	94.2	Very high	2 Å²	2	8.9 Å²	8.9	1%	0.009	5%	0.052	C	C	.	.	H	α-helix	trans	-63.2	-44.8	179.1	-65.5	176.9	-46	0	0	111.6	M138 V139 I140 T145 S146 T197 T351 W354 W378	M138-Q142 WeakPolarHBondContact O-CG 3.34Å; M138-Q142 PolarHBondContact O-N 3.09Å; V139-Q142 WeakPolarHBondContact O-CB 3.46Å; V139-Q142 PolarHBondContact O-N 3.42Å; I140-Q142 VanDerWaalsContact C-N 3.31Å; I140-Q142 PolarHBondContact O-N 2.85Å; Q142-T145 PolarHBondContact O-OG1 2.95Å; Q142-S146 VanDerWaalsContact O-CB 3.23Å; Q142-S146 WeakPolarHBondContact O-CB 3.33Å; Q142-S146 PolarHBondContact O-N 3.39Å; Q142-S146 PolarHBondContact O-OG 3.09Å; Q142-T197 HydrophobicContact CB-CG2 3.95Å; Q142-T351 VanDerWaalsContact NE2-CB 3.3Å; Q142-T351 PolarHBondContact NE2-OG1 3Å; Q142-W354 HydrophobicContact CB-CD2 4.13Å; Q142-W354 HydrophobicContact CB-CG 4.03Å; Q142-W354 HydrophobicContact CG-CD2 3.58Å; Q142-W354 HydrophobicContact CG-CE3 3.7Å; Q142-W354 HydrophobicContact CG-CG 3.97Å; Q142-W354 HydrophobicContact CG-CH2 4.36Å; Q142-W354 HydrophobicContact CG-CZ2 4.26Å; Q142-W354 HydrophobicContact CG-CZ3 4.09Å; Q142-W354 VanDerWaalsContact NE2-CE3 3.28Å; Q142-W378 VanDerWaalsContact CD-CZ2 3.41Å; Q142-W378 HydrophobicContact CG-CZ2 4.12Å
143	K	97.6	Very high	95	Very high	3 Å²	3	7.3 Å²	7.3	1%	0.013	4%	0.044	C	C	.	.	H	α-helix	trans	-61.5	-51.8	179.1	-77.7	-177.7	176.9	-178.8	0	112.2	V139 I140 M147 Y185 N186 N188 T197	V139-K143 HydrophobicContact CG1-CD 4.45Å; V139-K143 PolarHBondContact O-N 3.09Å; V139-K143 VanDerWaalsContact O-N 3.11Å; I140-K143 PolarHBondContact O-N 2.96Å; K143-M147 WeakPolarHBondContact O-CB 3.23Å; K143-M147 PolarHBondContact O-N 3.35Å; K143-Y185 HydrophobicContact CB-CD1 4.26Å; K143-Y185 HydrophobicContact CB-CE1 3.51Å; K143-Y185 HydrophobicContact CD-CE1 4.23Å; K143-Y185 HydrophobicContact CD-CE2 4.4Å; K143-Y185 WeakPolarHBondContact CD-O 3.21Å; K143-Y185 HydrophobicContact CG-CE1 3.96Å; K143-Y185 HydrophobicContact CG-CE2 4.41Å; K143-Y185 PolarHBondContact NZ-O 2.86Å; K143-N186 WeakPolarHBondContact CB-OD1 3.15Å; K143-N188 PolarHBondContact NZ-ND2 3.24Å; K143-T197 HydrophobicContact CG-CG2 4.42Å
144	I	97.8	Very high	95.1	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-63.2	-49.2	-178.9	-68.3	174.9	0	0	0	110.9	S89 M93 T109 I140 M147 A148 Y182 N186	S89-I144 VanDerWaalsContact CB-CG2 3.47Å; M93-I144 HydrophobicContact CE-CG2 3.8Å; M93-I144 WeakPolarHBondContact CE-O 3.37Å; T109-I144 HydrophobicContact CG2-CB 4.18Å; T109-I144 HydrophobicContact CG2-CD1 4.18Å; T109-I144 HydrophobicContact CG2-CG2 4.15Å; T109-I144 WeakPolarHBondContact OG1-CG2 3.3Å; I140-I144 HydrophobicContact CG2-CD1 3.41Å; I140-I144 VanDerWaalsContact CG2-CD1 3.41Å; I140-I144 HydrophobicContact CG2-CG1 4.04Å; I140-I144 WeakPolarHBondContact O-CB 3.45Å; I140-I144 WeakPolarHBondContact O-CG1 3.41Å; I140-I144 PolarHBondContact O-N 2.69Å; I144-M147 PolarHBondContact O-N 2.9Å; I144-A148 PolarHBondContact O-N 3.31Å; I144-Y182 VanDerWaalsContact CD1-OH 3.29Å; I144-Y182 WeakPolarHBondContact CD1-OH 3.24Å; I144-Y182 HydrophobicContact CG1-CE2 4.28Å; I144-Y182 WeakPolarHBondContact CG1-OH 3.15Å; I144-N186 WeakPolarHBondContact CG1-OD1 3.12Å
145	T	97.8	Very high	94.9	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-67.6	-41.3	-177.1	55.7	0	0	0	0	111.5	F106 T109 T141 Q142 M147 A148 F149 W354	F106-T145 HydrophobicContact CB-CG2 4.36Å; F106-T145 HydrophobicContact CD2-CG2 3.77Å; F106-T145 HydrophobicContact CG-CG2 4.39Å; T109-T145 HydrophobicContact CG2-CG2 4.38Å; T141-T145 HydrophobicContact CG2-CG2 4.37Å; T141-T145 WeakPolarHBondContact O-CB 3.25Å; T141-T145 VanDerWaalsContact O-CG2 3.29Å; T141-T145 WeakPolarHBondContact O-CG2 3.4Å; T141-T145 PolarHBondContact O-N 3.46Å; T141-T145 PolarHBondContact O-OG1 3.32Å; Q142-T145 PolarHBondContact O-OG1 2.95Å; T145-M147 VanDerWaalsContact C-N 3.35Å; T145-M147 PolarHBondContact O-N 3.3Å; T145-A148 PolarHBondContact O-N 2.88Å; T145-F149 VanDerWaalsContact O-CD2 3.27Å; T145-F149 WeakPolarHBondContact O-CD2 3.33Å; T145-F149 PolarHBondContact O-N 3.39Å; T145-F149 VanDerWaalsContact O-N 3.08Å; T145-W354 PolarHBondContact OG1-NE1 2.81Å
146	S	97.1	Very high	94.3	Very high	10 Å²	10	9.6 Å²	9.6	7%	0.07	5%	0.054	C	C	.	.	H	α-helix	trans	-56	-50.7	173	-57.7	0	0	0	0	110.9	Q142 A148 F149 E150 W354	Q142-S146 VanDerWaalsContact O-CB 3.23Å; Q142-S146 WeakPolarHBondContact O-CB 3.33Å; Q142-S146 PolarHBondContact O-N 3.39Å; Q142-S146 PolarHBondContact O-OG 3.09Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.31Å; S146-F149 PolarHBondContact O-N 2.71Å; S146-E150 WeakPolarHBondContact O-CB 3.39Å; S146-E150 WeakPolarHBondContact O-CG 3.43Å; S146-E150 PolarHBondContact O-N 3.48Å; S146-W354 VanDerWaalsContact OG-CD1 3.3Å
147	M	96.5	Very high	93.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-57.3	-44.6	178.3	-177.6	-166.8	-63.9	0	0	111.9	M93 K143 I144 T145 F149 E150 I151 I173 P177 Y182 Y185 Y200	M93-M147 HydrophobicContact CE-CB 4.4Å; M93-M147 HydrophobicContact CE-CG 4.39Å; M93-M147 HydrophobicContact CE-SD 4.07Å; M93-M147 HydrophobicContact SD-SD 4.11Å; K143-M147 WeakPolarHBondContact O-CB 3.23Å; K143-M147 PolarHBondContact O-N 3.35Å; I144-M147 PolarHBondContact O-N 2.9Å; T145-M147 VanDerWaalsContact C-N 3.35Å; T145-M147 PolarHBondContact O-N 3.3Å; M147-F149 VanDerWaalsContact C-N 3.34Å; M147-F149 PolarHBondContact O-N 3.47Å; M147-E150 PolarHBondContact O-N 3.49Å; M147-I151 HydrophobicContact CG-CD1 3.81Å; M147-I151 HydrophobicContact CG-CG1 4.37Å; M147-I151 VanDerWaalsContact O-CG1 3.29Å; M147-I151 WeakPolarHBondContact O-CG1 3.33Å; M147-I151 PolarHBondContact O-N 3.24Å; M147-I151 HydrophobicContact SD-CD1 4.37Å; M147-I173 HydrophobicContact CB-CD1 4.21Å; M147-I173 HydrophobicContact CG-CD1 3.59Å; M147-P177 HydrophobicContact CE-CG 4.39Å; M147-P177 HydrophobicContact SD-CG 3.79Å; M147-Y182 HydrophobicContact CE-CD2 3.98Å; M147-Y182 HydrophobicContact CE-CE2 4.44Å; M147-Y182 HydrophobicContact SD-CD2 3.83Å; M147-Y182 HydrophobicContact SD-CE2 4.16Å; M147-Y185 HydrophobicContact CE-CD1 3.2Å; M147-Y185 HydrophobicContact CE-CE1 3.42Å; M147-Y185 VanDerWaalsContact CE-CE1 3.42Å; M147-Y185 HydrophobicContact CE-CG 4.15Å; M147-Y200 HydrophobicContact CE-CD2 3.45Å; M147-Y200 VanDerWaalsContact CE-CD2 3.45Å; M147-Y200 HydrophobicContact CE-CE2 3.93Å; M147-Y200 HydrophobicContact CE-CG 4.04Å
148	A	96.8	Very high	92.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.5	-42.6	-179.7	0	0	0	0	0	112.1	M93 M101 H102 C105 I144 T145 S146 H152	M93-A148 HydrophobicContact CE-CB 3.77Å; M101-A148 WeakPolarHBondContact CE-O 3.17Å; H102-A148 HydrophobicContact CB-CB 4.3Å; C105-A148 HydrophobicContact CB-CB 3.7Å; I144-A148 PolarHBondContact O-N 3.31Å; T145-A148 PolarHBondContact O-N 2.88Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.31Å; A148-H152 WeakPolarHBondContact O-CB 3.4Å; A148-H152 PolarHBondContact O-N 3.48Å; A148-H152 VanDerWaalsContact O-N 3.12Å
149	F	95.6	Very high	90.8	Very high	20 Å²	20	26.4 Å²	26.4	9%	0.088	13%	0.128	C	C	.	.	H	α-helix	trans	-66.2	-40.5	174.1	-86.2	-76.5	0	0	0	112.3	H102 F106 T145 S146 M147 H152 D153 V358 R362	H102-F149 HydrophobicContact CB-CD1 4.02Å; H102-F149 HydrophobicContact CB-CD2 4.41Å; H102-F149 HydrophobicContact CB-CE1 4.32Å; H102-F149 HydrophobicContact CB-CG 4.11Å; H102-F149 AromaticContact CD2-CD1 3.7Å; H102-F149 AromaticContact CD2-CE1 3.29Å; H102-F149 WeakPolarHBondContact CD2-CE1 3.5Å; H102-F149 AromaticContact CD2-CZ 3.79Å; F106-F149 AromaticContact CD2-CE2 3.94Å; F106-F149 HydrophobicContact CD2-CE2 3.94Å; T145-F149 VanDerWaalsContact O-CD2 3.27Å; T145-F149 WeakPolarHBondContact O-CD2 3.33Å; T145-F149 PolarHBondContact O-N 3.39Å; T145-F149 VanDerWaalsContact O-N 3.08Å; S146-F149 PolarHBondContact O-N 2.71Å; M147-F149 VanDerWaalsContact C-N 3.34Å; M147-F149 PolarHBondContact O-N 3.47Å; F149-H152 PolarHBondContact O-N 3Å; F149-D153 WeakPolarHBondContact O-CB 3.1Å; F149-D153 PolarHBondContact O-N 3.12Å; F149-V358 HydrophobicContact CD2-CB 3.81Å; F149-V358 HydrophobicContact CD2-CG1 3.66Å; F149-V358 HydrophobicContact CE2-CB 3.71Å; F149-V358 HydrophobicContact CE2-CG1 4.08Å; F149-V358 HydrophobicContact CG-CG1 4.35Å; F149-V358 HydrophobicContact CZ-CB 4.36Å; F149-R362 HydrophobicContact CE1-CG 4.14Å
150	E	95.3	Very high	89.2	Confident	9 Å²	9	33.6 Å²	33.6	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-67.7	-35.5	-180	-73.3	169.1	-179	0	0	112.8	S146 M147 A154 L171 I173 R357	S146-E150 WeakPolarHBondContact O-CB 3.39Å; S146-E150 WeakPolarHBondContact O-CG 3.43Å; S146-E150 PolarHBondContact O-N 3.48Å; M147-E150 PolarHBondContact O-N 3.49Å; E150-A154 PolarHBondContact O-N 3.16Å; E150-L171 WeakPolarHBondContact CB-O 3.42Å; E150-L171 HydrophobicContact CG-CB 3.89Å; E150-I173 HydrophobicContact CB-CD1 3.74Å; E150-I173 HydrophobicContact CB-CG1 3.89Å; E150-I173 PolarHBondContact O-N 3.2Å; E150-R357 IonicContact OE1-NH1 2.76Å; E150-R357 PolarHBondContact OE1-NH1 3.41Å
151	I	94.8	Very high	87.1	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.046	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-43.9	171.6	-64	162.3	0	0	0	110.6	L98 M101 M147 D153 A154 G155 I173 M176	L98-I151 HydrophobicContact CD2-CG2 4.13Å; M101-I151 HydrophobicContact CE-CB 3.65Å; M101-I151 HydrophobicContact CE-CD1 4.29Å; M101-I151 HydrophobicContact CE-CG2 3.61Å; M147-I151 HydrophobicContact CG-CD1 3.81Å; M147-I151 HydrophobicContact CG-CG1 4.37Å; M147-I151 VanDerWaalsContact O-CG1 3.29Å; M147-I151 WeakPolarHBondContact O-CG1 3.33Å; M147-I151 PolarHBondContact O-N 3.24Å; M147-I151 HydrophobicContact SD-CD1 4.37Å; I151-D153 VanDerWaalsContact C-N 3.33Å; I151-D153 PolarHBondContact O-N 3.23Å; I151-A154 PolarHBondContact O-N 2.81Å; I151-G155 PolarHBondContact O-N 3.25Å; I151-I173 HydrophobicContact CG1-CB 3.69Å; I151-I173 HydrophobicContact CG1-CD1 4.15Å; I151-I173 HydrophobicContact CG1-CG2 3.71Å; I151-M176 HydrophobicContact CD1-CE 4.47Å; I151-M176 HydrophobicContact CD1-SD 3.79Å; I151-M176 HydrophobicContact CG2-CE 4.38Å
152	H	92.5	Very high	85.2	Confident	22 Å²	22	46 Å²	46	10%	0.102	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-46	176.9	162.9	-92.2	0	0	0	111.5	L98 H102 A148 F149 A154 G155 L156	L98-H152 PolarHBondContact O-CD2 3.44Å; L98-H152 VanDerWaalsContact O-CD2 3.3Å; H102-H152 HydrophobicContact CB-CB 4.1Å; H102-H152 AromaticContact CE1-CD2 3.32Å; H102-H152 PolarHBondContact CE1-CD2 3.17Å; H102-H152 AromaticContact CE1-CE1 3.66Å; H102-H152 AromaticContact CE1-CG 3.7Å; H102-H152 AromaticContact CE1-ND1 3.94Å; H102-H152 AromaticContact CE1-NE2 3.28Å; H102-H152 PolarHBondContact CE1-NE2 3.17Å; H102-H152 VanDerWaalsContact CE1-NE2 3.28Å; H102-H152 AromaticContact CG-CG 3.97Å; H102-H152 AromaticContact ND1-CD2 3.15Å; H102-H152 PolarHBondContact ND1-CD2 2.84Å; H102-H152 AromaticContact ND1-CG 3.28Å; H102-H152 VanDerWaalsContact ND1-CG 3.28Å; H102-H152 AromaticContact ND1-ND1 3.87Å; H102-H152 AromaticContact ND1-NE2 3.65Å; A148-H152 WeakPolarHBondContact O-CB 3.4Å; A148-H152 PolarHBondContact O-N 3.48Å; A148-H152 VanDerWaalsContact O-N 3.12Å; F149-H152 PolarHBondContact O-N 3Å; H152-A154 VanDerWaalsContact C-N 3.34Å; H152-A154 PolarHBondContact O-N 2.98Å; H152-G155 PolarHBondContact O-N 2.94Å; H152-G155 VanDerWaalsContact O-N 3.13Å; H152-L156 WeakPolarHBondContact CE1-CD1 3.22Å; H152-L156 PolarHBondContact O-N 3.37Å
153	D	91.3	Very high	83.7	Confident	6 Å²	6	53 Å²	53	3%	0.032	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-39.8	179.9	-68.8	-2.2	0	0	0	111.7	F149 I151 G155 L156 S157 L164 Q168 R362	F149-D153 WeakPolarHBondContact O-CB 3.1Å; F149-D153 PolarHBondContact O-N 3.12Å; I151-D153 VanDerWaalsContact C-N 3.33Å; I151-D153 PolarHBondContact O-N 3.23Å; D153-G155 VanDerWaalsContact C-N 3.31Å; D153-G155 PolarHBondContact O-N 2.99Å; D153-L156 PolarHBondContact O-N 3.22Å; D153-S157 PolarHBondContact O-N 3.12Å; D153-L164 HydrophobicContact CB-CD1 4.36Å; D153-L164 HydrophobicContact CB-CD2 3.99Å; D153-Q168 PolarHBondContact OD2-NE2 3.41Å; D153-R362 VanDerWaalsContact CG-NH2 3.31Å; D153-R362 IonicContact OD1-CZ 3.24Å; D153-R362 IonicContact OD1-NH1 3.49Å; D153-R362 PolarHBondContact OD1-NH1 3.08Å; D153-R362 IonicContact OD1-NH2 3.69Å; D153-R362 PolarHBondContact OD1-NH2 3.31Å; D153-R362 IonicContact OD2-CZ 2.75Å; D153-R362 IonicContact OD2-NH1 3.66Å; D153-R362 IonicContact OD2-NH2 2.8Å; D153-R362 PolarHBondContact OD2-NH2 2.93Å
154	A	89.1	Confident	82.8	Confident	6 Å²	6	53.8 Å²	53.8	5%	0.05	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-40.6	173.4	0	0	0	0	0	112.3	E150 I151 H152 S157 K158 A172 I173	E150-A154 PolarHBondContact O-N 3.16Å; I151-A154 PolarHBondContact O-N 2.81Å; H152-A154 VanDerWaalsContact C-N 3.34Å; H152-A154 PolarHBondContact O-N 2.98Å; A154-S157 PolarHBondContact O-N 3.06Å; A154-K158 PolarHBondContact O-N 3.18Å; A154-A172 HydrophobicContact CB-CB 3.88Å; A154-I173 WeakPolarHBondContact CB-O 3.43Å
155	G	84.9	Confident	82.1	Confident	14 Å²	14	56.5 Å²	56.5	14%	0.144	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-40.2	174.3	0	0	0	0	0	112.9	I151 H152 D153 K158 R159	I151-G155 PolarHBondContact O-N 3.25Å; H152-G155 PolarHBondContact O-N 2.94Å; H152-G155 VanDerWaalsContact O-N 3.13Å; D153-G155 VanDerWaalsContact C-N 3.31Å; D153-G155 PolarHBondContact O-N 2.99Å; G155-K158 PolarHBondContact O-N 3.33Å; G155-R159 WeakPolarHBondContact O-CG 3.36Å; G155-R159 PolarHBondContact O-N 2.96Å
156	L	78.8	Confident	81.4	Confident	65 Å²	65	61.9 Å²	61.9	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-65.2	-43.5	174.9	-73.3	-176.6	0	0	0	112.2	H152 D153 K158 R159 R160	H152-L156 WeakPolarHBondContact CE1-CD1 3.22Å; H152-L156 PolarHBondContact O-N 3.37Å; D153-L156 PolarHBondContact O-N 3.22Å; L156-K158 PolarHBondContact O-N 3.4Å; L156-R159 PolarHBondContact O-N 3.3Å; L156-R160 PolarHBondContact O-N 3.11Å
157	S	75.3	Confident	80.8	Confident	51 Å²	51	64.1 Å²	64.1	36%	0.357	33%	0.334	S	S	.	.	H	α-helix	trans	-58.6	-32.4	179.4	-168.9	0	0	0	0	113	D153 A154	D153-S157 PolarHBondContact O-N 3.12Å; A154-S157 PolarHBondContact O-N 3.06Å
158	K	70.9	Confident	80.3	Confident	157 Å²	157	65.6 Å²	65.6	68%	0.683	34%	0.341	S	S	*	.	H	α-helix	trans	-76	-24.6	176.2	-70	-179.7	179.7	177.6	0	113.1	A154 G155 L156	A154-K158 PolarHBondContact O-N 3.18Å; G155-K158 PolarHBondContact O-N 3.33Å; L156-K158 PolarHBondContact O-N 3.4Å
159	R	66.4	Low	79.8	Confident	169 Å²	169	71.4 Å²	71.4	64%	0.638	37%	0.366	S	S	*	.	H	α-helix	trans	-99.2	-26.8	-175.1	-68.5	177.7	-178.4	-172.8	-0.9	113.5	G155 L156	G155-R159 WeakPolarHBondContact O-CG 3.36Å; G155-R159 PolarHBondContact O-N 2.96Å; L156-R159 PolarHBondContact O-N 3.3Å
160	R	61.5	Low	79.3	Confident	163 Å²	163	74 Å²	74	62%	0.615	38%	0.376	S	S	*	.	S	Bend	trans	-138.9	101	-179.3	-67.5	-176.9	-178.7	-177.5	0.2	108.5	L156 G162	L156-R160 PolarHBondContact O-N 3.11Å; R160-G162 PolarHBondContact O-N 3.36Å
161	E	53.9	Low	79.1	Confident	193 Å²	193	74.5 Å²	74.5	90%	0.902	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	127.4	177.5	-66.8	-178.6	167.6	0	0	110.1
162	G	57	Low	78.9	Confident	68 Å²	68	74.9 Å²	74.9	70%	0.701	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.3	-0.9	161	0	0	0	0	0	119.7	R160	R160-G162 PolarHBondContact O-N 3.36Å
163	Q	67.5	Low	79	Confident	147 Å²	147	74 Å²	74	69%	0.687	38%	0.38	S	S	*	.			trans	-97.5	-5.3	-173.4	-69.8	-170	-11.1	0	0	117.2
164	L	78.6	Confident	78.8	Confident	20 Å²	20	78 Å²	78	11%	0.105	41%	0.408	C	S	.	.			trans	-86.5	137.8	-178.6	-65.9	-172.1	0	0	0	112.7	D153 Q168 K169	D153-L164 HydrophobicContact CB-CD1 4.36Å; D153-L164 HydrophobicContact CB-CD2 3.99Å; L164-Q168 HydrophobicContact CB-CB 4.02Å; L164-Q168 HydrophobicContact CD1-CB 4.37Å; L164-Q168 HydrophobicContact CD2-CB 4.08Å; L164-Q168 HydrophobicContact CG-CB 4.39Å; L164-K169 HydrophobicContact CB-CG 3.72Å; L164-K169 HydrophobicContact CD1-CG 4.28Å; L164-K169 WeakPolarHBondContact O-CE 3.43Å
165	T	82.3	Confident	78.9	Confident	57 Å²	57	86.2 Å²	86.2	35%	0.35	44%	0.438	S	S	.	.			trans	-64.4	156.8	168.3	68.5	0	0	0	0	110.7	S167 Q168 K169	T165-S167 PolarHBondContact O-N 3.33Å; T165-S167 PolarHBondContact OG1-OG 2.69Å; T165-S167 VanDerWaalsContact OG1-OG 3.06Å; T165-Q168 PolarHBondContact O-N 3.4Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.18Å; T165-Q168 PolarHBondContact OG1-N 2.92Å; T165-Q168 PolarHBondContact OG1-OE1 2.97Å; T165-K169 PolarHBondContact O-N 3.35Å
166	P	83.7	Confident	79.3	Confident	113 Å²	113	88.3 Å²	88.3	73%	0.734	44%	0.444	S	S	*	.	H	α-helix	trans	-53.6	-38.1	177.6	-28	35.6	0	0	0	113.5	K169 Y170	P166-K169 PolarHBondContact O-N 2.93Å; P166-Y170 PolarHBondContact O-N 3.34Å; P166-Y170 VanDerWaalsContact O-N 3.09Å
167	S	83.3	Confident	80.1	Confident	58 Å²	58	85.4 Å²	85.4	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-67.8	-38.9	176.5	52.2	0	0	0	0	112.8	T165 K169 Y170 L171	T165-S167 PolarHBondContact O-N 3.33Å; T165-S167 PolarHBondContact OG1-OG 2.69Å; T165-S167 VanDerWaalsContact OG1-OG 3.06Å; S167-K169 VanDerWaalsContact C-N 3.33Å; S167-Y170 PolarHBondContact O-N 3.34Å; S167-L171 WeakPolarHBondContact O-CB 3.01Å; S167-L171 VanDerWaalsContact O-CG 3.3Å; S167-L171 WeakPolarHBondContact O-CG 3.48Å; S167-L171 PolarHBondContact O-N 2.76Å
168	Q	86.5	Confident	81.1	Confident	31 Å²	31	85 Å²	85	15%	0.145	43%	0.427	C	S	.	.	H	α-helix	trans	-66.2	-37.6	175.6	-74.6	171.2	-42	0	0	111.6	D153 L164 T165 L171 A172	D153-Q168 PolarHBondContact OD2-NE2 3.41Å; L164-Q168 HydrophobicContact CB-CB 4.02Å; L164-Q168 HydrophobicContact CD1-CB 4.37Å; L164-Q168 HydrophobicContact CD2-CB 4.08Å; L164-Q168 HydrophobicContact CG-CB 4.39Å; T165-Q168 PolarHBondContact O-N 3.4Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.18Å; T165-Q168 PolarHBondContact OG1-N 2.92Å; T165-Q168 PolarHBondContact OG1-OE1 2.97Å; Q168-L171 PolarHBondContact O-N 2.93Å; Q168-A172 WeakPolarHBondContact O-CB 3.12Å; Q168-A172 PolarHBondContact O-N 3.41Å
169	K	86.1	Confident	82.3	Confident	122 Å²	122	82 Å²	82	53%	0.53	42%	0.417	S	S	.	.	H	α-helix	trans	-62.5	-43.3	174.3	-67.4	-178.6	-177.5	179.4	0	111.9	L164 T165 P166 S167 L171 A172	L164-K169 HydrophobicContact CB-CG 3.72Å; L164-K169 HydrophobicContact CD1-CG 4.28Å; L164-K169 WeakPolarHBondContact O-CE 3.43Å; T165-K169 PolarHBondContact O-N 3.35Å; P166-K169 PolarHBondContact O-N 2.93Å; S167-K169 VanDerWaalsContact C-N 3.33Å; K169-L171 VanDerWaalsContact C-N 3.34Å; K169-L171 PolarHBondContact O-N 3.41Å; K169-A172 WeakPolarHBondContact O-CB 3.38Å; K169-A172 PolarHBondContact O-N 3Å
170	Y	86	Confident	83.8	Confident	73 Å²	73	76 Å²	76	29%	0.286	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-41.4	176.5	176.9	-95.3	0	0	0	112.6	P166 S167 N201 D202 R215 E218	P166-Y170 PolarHBondContact O-N 3.34Å; P166-Y170 VanDerWaalsContact O-N 3.09Å; S167-Y170 PolarHBondContact O-N 3.34Å; Y170-N201 PolarHBondContact O-ND2 3.03Å; Y170-D202 PolarHBondContact OH-OD1 2.9Å; Y170-R215 VanDerWaalsContact OH-CZ 3.26Å; Y170-R215 PolarHBondContact OH-NH2 2.98Å; Y170-E218 WeakPolarHBondContact CE2-OE1 3.44Å
171	L	91.1	Very high	85.5	Confident	20 Å²	20	69.8 Å²	69.8	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-84.3	-10.7	-176.7	-65.5	171.8	0	0	0	113.7	E150 S167 Q168 K169 I173 S199 N201 R357	E150-L171 WeakPolarHBondContact CB-O 3.42Å; E150-L171 HydrophobicContact CG-CB 3.89Å; S167-L171 WeakPolarHBondContact O-CB 3.01Å; S167-L171 VanDerWaalsContact O-CG 3.3Å; S167-L171 WeakPolarHBondContact O-CG 3.48Å; S167-L171 PolarHBondContact O-N 2.76Å; Q168-L171 PolarHBondContact O-N 2.93Å; K169-L171 VanDerWaalsContact C-N 3.34Å; K169-L171 PolarHBondContact O-N 3.41Å; L171-I173 PolarHBondContact O-N 3.43Å; L171-S199 VanDerWaalsContact CD2-OG 3.31Å; L171-S199 WeakPolarHBondContact CD2-OG 3.34Å; L171-N201 PolarHBondContact O-ND2 3.21Å; L171-R357 VanDerWaalsContact CD1-CD 3.47Å
172	A	91.4	Very high	87.7	Confident	17 Å²	17	60.7 Å²	60.7	14%	0.14	33%	0.333	C	S	.	.			trans	-56.6	127.9	-176	0	0	0	0	0	111.7	A154 Q168 K169 N201	A154-A172 HydrophobicContact CB-CB 3.88Å; Q168-A172 WeakPolarHBondContact O-CB 3.12Å; Q168-A172 PolarHBondContact O-N 3.41Å; K169-A172 WeakPolarHBondContact O-CB 3.38Å; K169-A172 PolarHBondContact O-N 3Å; A172-N201 PolarHBondContact O-ND2 3.38Å; A172-N201 VanDerWaalsContact O-ND2 3.1Å
173	I	93.4	Very high	89.6	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	31%	0.311	C	S	.	.			trans	-100.6	105.7	178.8	-61.8	170.9	0	0	0	108.5	M147 E150 I151 A154 L171 R175 Y200	M147-I173 HydrophobicContact CB-CD1 4.21Å; M147-I173 HydrophobicContact CG-CD1 3.59Å; E150-I173 HydrophobicContact CB-CD1 3.74Å; E150-I173 HydrophobicContact CB-CG1 3.89Å; E150-I173 PolarHBondContact O-N 3.2Å; I151-I173 HydrophobicContact CG1-CB 3.69Å; I151-I173 HydrophobicContact CG1-CD1 4.15Å; I151-I173 HydrophobicContact CG1-CG2 3.71Å; A154-I173 WeakPolarHBondContact CB-O 3.43Å; L171-I173 PolarHBondContact O-N 3.43Å; I173-R175 WeakPolarHBondContact CG2-O 3.38Å; I173-Y200 HydrophobicContact CD1-CD1 3.63Å; I173-Y200 HydrophobicContact CD1-CG 3.91Å; I173-Y200 HydrophobicContact CG1-CD1 3.92Å; I173-Y200 HydrophobicContact CG2-CD1 4.11Å; I173-Y200 HydrophobicContact CG2-CE1 4.15Å
174	S	88.2	Confident	91	Very high	89 Å²	89	52.6 Å²	52.6	62%	0.622	28%	0.278	S	S	*	.			trans	-79.2	-18.9	-171	-70.2	0	0	0	0	114.9
175	R	90.9	Very high	92	Very high	179 Å²	179	51.7 Å²	51.7	68%	0.675	27%	0.273	S	S	*	.	S	Bend	trans	-131.5	137.8	-176.5	179.3	-169	167.9	-162.6	-3.6	109.2	I173	I173-R175 WeakPolarHBondContact CG2-O 3.38Å
176	M	93.1	Very high	92.7	Very high	58 Å²	58	49 Å²	49	29%	0.286	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-62.4	128.8	172.6	-168.1	64.4	75.2	0	0	110.4	M93 I94 M101 I151	M93-M176 HydrophobicContact CB-CE 4.41Å; M93-M176 HydrophobicContact CB-SD 4.25Å; M93-M176 VanDerWaalsContact O-CE 3.29Å; M93-M176 WeakPolarHBondContact O-CE 3.44Å; I94-M176 HydrophobicContact CD1-CG 4.07Å; M101-M176 HydrophobicContact SD-CE 4Å; I151-M176 HydrophobicContact CD1-CE 4.47Å; I151-M176 HydrophobicContact CD1-SD 3.79Å; I151-M176 HydrophobicContact CG2-CE 4.38Å
177	P	95	Very high	93.3	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.019	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-58.4	144.3	174.7	-25.3	36.1	0	0	0	111.6	Y90 M147 E181 Y200	Y90-P177 PolarHBondContact OH-O 3.07Å; M147-P177 HydrophobicContact CE-CG 4.39Å; M147-P177 HydrophobicContact SD-CG 3.79Å; P177-E181 HydrophobicContact CB-CB 4.36Å; P177-Y200 HydrophobicContact CB-CE2 4.12Å; P177-Y200 VanDerWaalsContact CB-OH 3.27Å; P177-Y200 WeakPolarHBondContact CB-OH 3.35Å; P177-Y200 HydrophobicContact CG-CE1 3.95Å; P177-Y200 HydrophobicContact CG-CE2 3.89Å; P177-Y200 VanDerWaalsContact CG-CZ 3.49Å; P177-Y200 WeakPolarHBondContact CG-OH 3.25Å
178	S	96.6	Very high	94	Very high	44 Å²	44	41 Å²	41	31%	0.308	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-66.8	161.2	162.1	65.7	0	0	0	0	110.8	L180 E181 Y182	S178-L180 PolarHBondContact O-N 3.21Å; S178-E181 WeakPolarHBondContact CB-OE2 3.4Å; S178-E181 PolarHBondContact N-OE2 3.45Å; S178-E181 PolarHBondContact O-N 3.17Å; S178-E181 VanDerWaalsContact OG-CG 3.3Å; S178-E181 WeakPolarHBondContact OG-CG 3.19Å; S178-E181 PolarHBondContact OG-N 3.11Å; S178-E181 PolarHBondContact OG-OE2 3.46Å; S178-Y182 WeakPolarHBondContact O-CB 3.31Å; S178-Y182 PolarHBondContact O-N 3.45Å
179	L	96.7	Very high	94.5	Very high	92 Å²	92	39.7 Å²	39.7	48%	0.482	20%	0.197	S	C	.	.	H	α-helix	trans	-57	-38.6	178.5	-179.1	61.8	0	0	0	112	Y90 L183	Y90-L179 HydrophobicContact CD1-CD1 3.89Å; Y90-L179 HydrophobicContact CE1-CB 4.28Å; Y90-L179 HydrophobicContact CE1-CD1 3.88Å; Y90-L179 HydrophobicContact CG-CD1 4.4Å; Y90-L179 PolarHBondContact OH-N 2.68Å; L179-L183 HydrophobicContact CD1-CD1 3.99Å; L179-L183 HydrophobicContact CD1-CG 4.03Å; L179-L183 HydrophobicContact CG-CD1 3.95Å; L179-L183 HydrophobicContact CG-CG 4.37Å; L179-L183 WeakPolarHBondContact O-CB 3.35Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.5Å; L179-L183 PolarHBondContact O-N 2.97Å
180	L	97.6	Very high	95	Very high	45 Å²	45	34 Å²	34	24%	0.236	17%	0.172	C	C	.	.	H	α-helix	trans	-67.5	-47.2	178.5	177	62.3	0	0	0	112	F57 H60 V61 S178 Y182 L183 S184	F57-L180 HydrophobicContact CD2-CD2 3.43Å; F57-L180 VanDerWaalsContact CD2-CD2 3.43Å; F57-L180 HydrophobicContact CE2-CD2 3.45Å; F57-L180 VanDerWaalsContact CE2-CD2 3.45Å; F57-L180 HydrophobicContact CG-CD2 4.25Å; F57-L180 HydrophobicContact CZ-CD2 4.27Å; H60-L180 HydrophobicContact CB-CD1 4.13Å; H60-L180 HydrophobicContact CB-CD2 4.05Å; H60-L180 HydrophobicContact CB-CG 3.86Å; V61-L180 HydrophobicContact CG2-CD1 3.91Å; V61-L180 HydrophobicContact CG2-CD2 3.96Å; S178-L180 PolarHBondContact O-N 3.21Å; L180-Y182 VanDerWaalsContact C-N 3.28Å; L180-Y182 PolarHBondContact O-N 2.98Å; L180-L183 PolarHBondContact O-N 2.91Å; L180-S184 WeakPolarHBondContact O-CB 3.41Å; L180-S184 PolarHBondContact O-N 2.94Å
181	E	97.8	Very high	95.4	Very high	32 Å²	32	30.6 Å²	30.6	15%	0.15	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-41.1	177.6	-71	158.4	156.4	0	0	110.8	P177 S178 Y185 M204	P177-E181 HydrophobicContact CB-CB 4.36Å; S178-E181 WeakPolarHBondContact CB-OE2 3.4Å; S178-E181 PolarHBondContact N-OE2 3.45Å; S178-E181 PolarHBondContact O-N 3.17Å; S178-E181 VanDerWaalsContact OG-CG 3.3Å; S178-E181 WeakPolarHBondContact OG-CG 3.19Å; S178-E181 PolarHBondContact OG-N 3.11Å; S178-E181 PolarHBondContact OG-OE2 3.46Å; E181-Y185 VanDerWaalsContact O-CB 3.3Å; E181-Y185 WeakPolarHBondContact O-CB 3.47Å; E181-Y185 PolarHBondContact O-N 2.93Å; E181-M204 HydrophobicContact CB-CE 4.13Å; E181-M204 HydrophobicContact CB-SD 3.97Å; E181-M204 HydrophobicContact CG-CE 4.49Å; E181-M204 HydrophobicContact CG-SD 3.88Å
182	Y	98	Very high	95.5	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-51	177.1	175.3	-97.3	0	0	0	112.6	S86 Y90 M93 I144 M147 S178 L180 S184 Y185 N186	S86-Y182 VanDerWaalsContact O-CE1 3.27Å; S86-Y182 WeakPolarHBondContact O-CE1 3.2Å; S86-Y182 PolarHBondContact O-OH 3.21Å; Y90-Y182 AromaticContact CD2-CD1 3.65Å; Y90-Y182 HydrophobicContact CD2-CD1 3.65Å; Y90-Y182 AromaticContact CD2-CD2 3.79Å; Y90-Y182 HydrophobicContact CD2-CD2 3.79Å; Y90-Y182 AromaticContact CD2-CE1 3.98Å; Y90-Y182 HydrophobicContact CD2-CE1 3.98Å; Y90-Y182 HydrophobicContact CD2-CE2 4.1Å; Y90-Y182 AromaticContact CD2-CG 3.53Å; Y90-Y182 HydrophobicContact CD2-CG 3.53Å; Y90-Y182 HydrophobicContact CE2-CD1 4.36Å; Y90-Y182 HydrophobicContact CE2-CD2 4.38Å; Y90-Y182 AromaticContact CE2-CG 3.98Å; Y90-Y182 HydrophobicContact CE2-CG 3.98Å; Y90-Y182 HydrophobicContact CG-CD1 4.03Å; Y90-Y182 HydrophobicContact CG-CE1 4.08Å; Y90-Y182 HydrophobicContact CG-CG 4.37Å; M93-Y182 HydrophobicContact CE-CE2 4.32Å; M93-Y182 HydrophobicContact SD-CD2 4.46Å; M93-Y182 HydrophobicContact SD-CE2 3.97Å; I144-Y182 VanDerWaalsContact CD1-OH 3.29Å; I144-Y182 WeakPolarHBondContact CD1-OH 3.24Å; I144-Y182 HydrophobicContact CG1-CE2 4.28Å; I144-Y182 WeakPolarHBondContact CG1-OH 3.15Å; M147-Y182 HydrophobicContact CE-CD2 3.98Å; M147-Y182 HydrophobicContact CE-CE2 4.44Å; M147-Y182 HydrophobicContact SD-CD2 3.83Å; M147-Y182 HydrophobicContact SD-CE2 4.16Å; S178-Y182 WeakPolarHBondContact O-CB 3.31Å; S178-Y182 PolarHBondContact O-N 3.45Å; L180-Y182 VanDerWaalsContact C-N 3.28Å; L180-Y182 PolarHBondContact O-N 2.98Å; Y182-S184 VanDerWaalsContact C-N 3.31Å; Y182-S184 PolarHBondContact O-N 3.38Å; Y182-Y185 PolarHBondContact O-N 3.44Å; Y182-N186 VanDerWaalsContact CE2-ND2 3.25Å; Y182-N186 WeakPolarHBondContact CE2-ND2 3.4Å; Y182-N186 VanDerWaalsContact CZ-ND2 3.33Å; Y182-N186 PolarHBondContact O-N 3.33Å; Y182-N186 VanDerWaalsContact O-N 3.09Å; Y182-N186 PolarHBondContact O-ND2 3.45Å
183	L	97.8	Very high	95.6	Very high	45 Å²	45	29.1 Å²	29.1	24%	0.236	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-39.5	177.7	-73	175.9	0	0	0	111.1	T64 L83 L179 L180 Y185 N186 C187	T64-L183 HydrophobicContact CG2-CB 4.18Å; L83-L183 HydrophobicContact CD2-CD2 4.37Å; L179-L183 HydrophobicContact CD1-CD1 3.99Å; L179-L183 HydrophobicContact CD1-CG 4.03Å; L179-L183 HydrophobicContact CG-CD1 3.95Å; L179-L183 HydrophobicContact CG-CG 4.37Å; L179-L183 WeakPolarHBondContact O-CB 3.35Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.5Å; L179-L183 PolarHBondContact O-N 2.97Å; L180-L183 PolarHBondContact O-N 2.91Å; L183-Y185 PolarHBondContact O-N 3.19Å; L183-N186 PolarHBondContact O-N 3.08Å; L183-C187 WeakPolarHBondContact O-CA 3.39Å; L183-C187 VanDerWaalsContact O-CB 3.29Å; L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.47Å
184	S	98	Very high	95.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-43.2	176	-170.5	0	0	0	0	112.1	H60 T64 L180 Y182 N186 N188 Y203	H60-S184 WeakPolarHBondContact CA-OG 3.47Å; H60-S184 VanDerWaalsContact ND1-CB 3.28Å; H60-S184 WeakPolarHBondContact ND1-CB 3.13Å; H60-S184 PolarHBondContact ND1-OG 2.91Å; H60-S184 PolarHBondContact O-OG 3.21Å; T64-S184 WeakPolarHBondContact OG1-CA 3.39Å; T64-S184 VanDerWaalsContact OG1-CB 3.27Å; T64-S184 WeakPolarHBondContact OG1-CB 3.38Å; L180-S184 WeakPolarHBondContact O-CB 3.41Å; L180-S184 PolarHBondContact O-N 2.94Å; Y182-S184 VanDerWaalsContact C-N 3.31Å; Y182-S184 PolarHBondContact O-N 3.38Å; S184-N186 PolarHBondContact O-N 2.91Å; S184-N188 WeakPolarHBondContact O-CB 3.44Å; S184-N188 PolarHBondContact O-N 2.64Å; S184-N188 VanDerWaalsContact O-N 3.08Å; S184-N188 PolarHBondContact O-ND2 3.01Å; S184-Y203 PolarHBondContact O-OH 2.78Å; S184-Y203 VanDerWaalsContact O-OH 3.11Å; S184-Y203 PolarHBondContact OG-OH 2.69Å
185	Y	98	Very high	95.5	Very high	1 Å²	1	25.2 Å²	25.2	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-41.4	177.2	172.8	-114	0	0	0	112.9	K143 M147 E181 Y182 L183 N188 C198 Y200 Y203	K143-Y185 HydrophobicContact CB-CD1 4.26Å; K143-Y185 HydrophobicContact CB-CE1 3.51Å; K143-Y185 HydrophobicContact CD-CE1 4.23Å; K143-Y185 HydrophobicContact CD-CE2 4.4Å; K143-Y185 WeakPolarHBondContact CD-O 3.21Å; K143-Y185 HydrophobicContact CG-CE1 3.96Å; K143-Y185 HydrophobicContact CG-CE2 4.41Å; K143-Y185 PolarHBondContact NZ-O 2.86Å; M147-Y185 HydrophobicContact CE-CD1 3.2Å; M147-Y185 HydrophobicContact CE-CE1 3.42Å; M147-Y185 VanDerWaalsContact CE-CE1 3.42Å; M147-Y185 HydrophobicContact CE-CG 4.15Å; E181-Y185 VanDerWaalsContact O-CB 3.3Å; E181-Y185 WeakPolarHBondContact O-CB 3.47Å; E181-Y185 PolarHBondContact O-N 2.93Å; Y182-Y185 PolarHBondContact O-N 3.44Å; L183-Y185 PolarHBondContact O-N 3.19Å; Y185-N188 PolarHBondContact O-ND2 2.9Å; Y185-C198 PolarHBondContact OH-O 2.9Å; Y185-Y200 HydrophobicContact CD1-CD2 4.03Å; Y185-Y200 HydrophobicContact CD2-CD2 4.11Å; Y185-Y200 HydrophobicContact CE1-CD2 4.39Å; Y185-Y200 AromaticContact CG-CD2 3.82Å; Y185-Y200 HydrophobicContact CG-CD2 3.82Å; Y185-Y203 AromaticContact CD2-CD1 3.61Å; Y185-Y203 HydrophobicContact CD2-CD1 3.61Å; Y185-Y203 HydrophobicContact CD2-CE1 4.44Å; Y185-Y203 AromaticContact CD2-CG 3.75Å; Y185-Y203 HydrophobicContact CD2-CG 3.75Å; Y185-Y203 HydrophobicContact CG-CD1 4.13Å
186	N	97.2	Very high	95.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-78.4	-41.8	-179.2	-70.6	-59	0	0	0	112.8	I140 K143 I144 Y182 L183 S184	I140-N186 HydrophobicContact CG2-CB 4.44Å; K143-N186 WeakPolarHBondContact CB-OD1 3.15Å; I144-N186 WeakPolarHBondContact CG1-OD1 3.12Å; Y182-N186 VanDerWaalsContact CE2-ND2 3.25Å; Y182-N186 WeakPolarHBondContact CE2-ND2 3.4Å; Y182-N186 VanDerWaalsContact CZ-ND2 3.33Å; Y182-N186 PolarHBondContact O-N 3.33Å; Y182-N186 VanDerWaalsContact O-N 3.09Å; Y182-N186 PolarHBondContact O-ND2 3.45Å; L183-N186 PolarHBondContact O-N 3.08Å; S184-N186 PolarHBondContact O-N 2.91Å
187	C	96.9	Very high	95.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-112.4	26.4	-168.8	-57.3	0	0	0	0	113.9	T64 G67 L68 L183 I192	T64-C187 HydrophobicContact CG2-CB 4.39Å; G67-C187 WeakPolarHBondContact CA-O 3.34Å; L68-C187 HydrophobicContact CD2-CB 3.96Å; L68-C187 HydrophobicContact CG-CB 4.41Å; L183-C187 WeakPolarHBondContact O-CA 3.39Å; L183-C187 VanDerWaalsContact O-CB 3.29Å; L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.47Å; C187-I192 HydrophobicContact CB-CD1 4Å
188	N	97.4	Very high	95.4	Very high	4 Å²	4	15 Å²	15	2%	0.021	9%	0.085	C	C	.	.			trans	-70.7	142.1	174.6	61.4	87.4	0	0	0	112.6	A63 K143 S184 Y185 M190 G191 I192 Y203	A63-N188 HydrophobicContact CB-CB 4.26Å; A63-N188 WeakPolarHBondContact O-CA 3.31Å; K143-N188 PolarHBondContact NZ-ND2 3.24Å; S184-N188 WeakPolarHBondContact O-CB 3.44Å; S184-N188 PolarHBondContact O-N 2.64Å; S184-N188 VanDerWaalsContact O-N 3.08Å; S184-N188 PolarHBondContact O-ND2 3.01Å; Y185-N188 PolarHBondContact O-ND2 2.9Å; N188-M190 HydrophobicContact CB-CE 4.16Å; N188-M190 PolarHBondContact O-N 3.01Å; N188-M190 VanDerWaalsContact O-N 3.13Å; N188-M190 PolarHBondContact OD1-N 3.06Å; N188-G191 PolarHBondContact O-N 3.16Å; N188-G191 PolarHBondContact OD1-N 3.15Å; N188-G191 VanDerWaalsContact OD1-N 3.17Å; N188-I192 VanDerWaalsContact O-CB 3.29Å; N188-I192 WeakPolarHBondContact O-CB 3.5Å; N188-I192 PolarHBondContact O-N 3.38Å; N188-Y203 HydrophobicContact CB-CE2 4.26Å
189	F	97.9	Very high	95.3	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.018	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.4	-180	80	-82.6	0	0	0	114.8	A38 M41 A42 F45 A63 L66 L70 G191	A38-F189 HydrophobicContact CB-CD2 4.15Å; A38-F189 WeakPolarHBondContact O-CE2 3.27Å; M41-F189 HydrophobicContact CB-CD2 4.27Å; M41-F189 HydrophobicContact CB-CE2 3.97Å; A42-F189 HydrophobicContact CB-CE2 4.04Å; A42-F189 HydrophobicContact CB-CZ 4.37Å; F45-F189 HydrophobicContact CB-CE1 4.47Å; F45-F189 HydrophobicContact CB-CZ 4.03Å; F45-F189 AromaticContact CD2-CE1 3.96Å; F45-F189 HydrophobicContact CD2-CE1 3.96Å; F45-F189 HydrophobicContact CD2-CZ 4.36Å; F45-F189 HydrophobicContact CE2-CE1 4.4Å; F45-F189 HydrophobicContact CG-CE1 4.17Å; F45-F189 HydrophobicContact CG-CZ 4.17Å; A63-F189 HydrophobicContact CB-CD1 4.24Å; A63-F189 HydrophobicContact CB-CE1 4.41Å; A63-F189 PolarHBondContact O-N 2.62Å; A63-F189 VanDerWaalsContact O-N 3.08Å; L66-F189 HydrophobicContact CB-CB 3.69Å; L66-F189 HydrophobicContact CB-CD1 4.17Å; L66-F189 HydrophobicContact CB-CG 4.03Å; L66-F189 HydrophobicContact CD1-CD1 4.22Å; L66-F189 HydrophobicContact CD1-CE1 4.46Å; L66-F189 HydrophobicContact CD1-CG 4.42Å; L70-F189 HydrophobicContact CD1-CB 3.91Å; F189-G191 VanDerWaalsContact C-N 3.29Å; F189-G191 PolarHBondContact O-N 3.32Å
190	M	96.8	Very high	95.3	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-25.9	-175.8	-58.2	169.9	-73.4	0	0	112.8	N188 Y203 F206 I304 N305 A308	N188-M190 HydrophobicContact CB-CE 4.16Å; N188-M190 PolarHBondContact O-N 3.01Å; N188-M190 VanDerWaalsContact O-N 3.13Å; N188-M190 PolarHBondContact OD1-N 3.06Å; M190-Y203 HydrophobicContact CE-CE2 3.85Å; M190-F206 HydrophobicContact CE-CD1 4.34Å; M190-F206 HydrophobicContact CE-CE1 3.67Å; M190-F206 HydrophobicContact CE-CZ 4.47Å; M190-F206 HydrophobicContact SD-CE1 3.88Å; M190-F206 HydrophobicContact SD-CZ 4.09Å; M190-I304 HydrophobicContact CB-CG2 4.31Å; M190-N305 WeakPolarHBondContact CB-OD1 3.49Å; M190-N305 PolarHBondContact O-ND2 3.37Å; M190-A308 HydrophobicContact CG-CB 4.22Å; M190-A308 HydrophobicContact SD-CB 3.51Å; M190-A308 VanDerWaalsContact SD-CB 3.51Å
191	G	92.9	Very high	95.2	Very high	2 Å²	2	8.8 Å²	8.8	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138.6	2	-174.7	0	0	0	0	0	116.1	N188 F189 L193 G195	N188-G191 PolarHBondContact O-N 3.16Å; N188-G191 PolarHBondContact OD1-N 3.15Å; N188-G191 VanDerWaalsContact OD1-N 3.17Å; F189-G191 VanDerWaalsContact C-N 3.29Å; F189-G191 PolarHBondContact O-N 3.32Å; G191-L193 VanDerWaalsContact C-N 3.31Å; G191-L193 PolarHBondContact O-N 2.9Å; G191-G195 VanDerWaalsContact CA-O 3.28Å; G191-G195 WeakPolarHBondContact CA-O 3.33Å; G191-G195 VanDerWaalsContact O-CA 3.3Å; G191-G195 WeakPolarHBondContact O-CA 3.36Å; G191-G195 PolarHBondContact O-N 2.69Å
192	I	94.9	Very high	95	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.5	-176.7	-166.8	168.3	0	0	0	113.2	G67 A71 F82 P136 C187 N188	G67-I192 WeakPolarHBondContact O-CD1 3.29Å; A71-I192 HydrophobicContact CB-CD1 3.81Å; F82-I192 HydrophobicContact CD2-CD1 4.38Å; P136-I192 VanDerWaalsContact CB-O 3.25Å; P136-I192 WeakPolarHBondContact CB-O 3.46Å; C187-I192 HydrophobicContact CB-CD1 4Å; N188-I192 VanDerWaalsContact O-CB 3.29Å; N188-I192 WeakPolarHBondContact O-CB 3.5Å; N188-I192 PolarHBondContact O-N 3.38Å
193	L	93	Very high	95	Very high	7 Å²	7	8 Å²	8	4%	0.037	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-37.5	-174.4	-63.3	-178.6	0	0	0	113.5	F31 C34 Q35 C74 F75 G191	F31-L193 HydrophobicContact CD2-CB 4.46Å; F31-L193 HydrophobicContact CE2-CB 3.9Å; C34-L193 HydrophobicContact CB-CD1 3.61Å; Q35-L193 HydrophobicContact CG-CD1 4.21Å; C74-L193 HydrophobicContact CB-CD2 4.24Å; F75-L193 HydrophobicContact CE2-CD2 3.69Å; F75-L193 HydrophobicContact CZ-CD2 4.33Å; G191-L193 VanDerWaalsContact C-N 3.31Å; G191-L193 PolarHBondContact O-N 2.9Å
194	A	89.6	Confident	94.9	Very high	11 Å²	11	6.6 Å²	6.6	9%	0.091	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.6	5.9	-168.5	0	0	0	0	0	115.2	F31 V297 A301	F31-A194 HydrophobicContact CZ-CB 3.91Å; A194-V297 HydrophobicContact CB-CG1 3.67Å; A194-A301 HydrophobicContact CB-CB 4.16Å
195	G	89.4	Confident	94.7	Very high	1 Å²	1	6.6 Å²	6.6	1%	0.01	4%	0.038	C	C	.	.			trans	75.6	-150.3	-166.5	0	0	0	0	0	111.7	G191 A301	G191-G195 VanDerWaalsContact CA-O 3.28Å; G191-G195 WeakPolarHBondContact CA-O 3.33Å; G191-G195 VanDerWaalsContact O-CA 3.3Å; G191-G195 WeakPolarHBondContact O-CA 3.36Å; G191-G195 PolarHBondContact O-N 2.69Å; G195-A301 VanDerWaalsContact O-CB 3.28Å; G195-A301 WeakPolarHBondContact O-CB 3.48Å
196	P	90.4	Very high	94.6	Very high	4 Å²	4	6.9 Å²	6.9	3%	0.026	4%	0.039	C	C	.	.			cis	-62	163.6	-4.8	27.6	-35.5	0	0	0	112.8	I326 N328 Q350	P196-I326 HydrophobicContact CB-CB 4.39Å; P196-I326 WeakPolarHBondContact CB-O 3.38Å; P196-I326 HydrophobicContact CG-CB 3.99Å; P196-I326 HydrophobicContact CG-CD1 3.75Å; P196-I326 HydrophobicContact CG-CG1 3.72Å; P196-I326 WeakPolarHBondContact CG-O 3.36Å; P196-N328 HydrophobicContact CB-CB 4.48Å; P196-Q350 HydrophobicContact CB-CG 4.21Å
197	T	92.9	Very high	94.6	Very high	9 Å²	9	6.9 Å²	6.9	6%	0.055	4%	0.039	C	C	.	.			trans	-80.5	159.4	168.1	64.3	0	0	0	0	110.2	V139 Q142 K143 Q350	V139-T197 HydrophobicContact CG1-CG2 4.05Å; Q142-T197 HydrophobicContact CB-CG2 3.95Å; K143-T197 HydrophobicContact CG-CG2 4.42Å; T197-Q350 WeakPolarHBondContact O-CG 3.29Å; T197-Q350 WeakPolarHBondContact OG1-CB 3.44Å
198	C	94.3	Very high	94.4	Very high	11 Å²	11	11.4 Å²	11.4	7%	0.074	6%	0.06	C	C	.	.			trans	-146.9	168.1	-179	61.5	0	0	0	0	110	Y185 F310 I326	Y185-C198 PolarHBondContact OH-O 2.9Å; C198-F310 HydrophobicContact CB-CE1 3.94Å; C198-F310 HydrophobicContact CB-CZ 3.84Å; C198-I326 HydrophobicContact CB-CG2 3.66Å
199	S	94.6	Very high	94.1	Very high	5 Å²	5	12.4 Å²	12.4	4%	0.035	7%	0.072	C	C	.	.			trans	-70	144.4	169.2	176.1	0	0	0	0	110.4	L171 N201 D202 Y203	L171-S199 VanDerWaalsContact CD2-OG 3.31Å; L171-S199 WeakPolarHBondContact CD2-OG 3.34Å; S199-N201 VanDerWaalsContact C-N 3.27Å; S199-N201 PolarHBondContact O-N 3.2Å; S199-N201 PolarHBondContact OG-N 3.36Å; S199-D202 WeakPolarHBondContact CB-OD2 3.29Å; S199-D202 PolarHBondContact O-N 2.79Å; S199-Y203 PolarHBondContact O-N 3.11Å
200	Y	96.4	Very high	93.6	Very high	13 Å²	13	14.4 Å²	14.4	5%	0.051	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-41	171.6	176.8	-101.4	0	0	0	111.9	M147 I173 P177 Y185 D202 Y203 M204	M147-Y200 HydrophobicContact CE-CD2 3.45Å; M147-Y200 VanDerWaalsContact CE-CD2 3.45Å; M147-Y200 HydrophobicContact CE-CE2 3.93Å; M147-Y200 HydrophobicContact CE-CG 4.04Å; I173-Y200 HydrophobicContact CD1-CD1 3.63Å; I173-Y200 HydrophobicContact CD1-CG 3.91Å; I173-Y200 HydrophobicContact CG1-CD1 3.92Å; I173-Y200 HydrophobicContact CG2-CD1 4.11Å; I173-Y200 HydrophobicContact CG2-CE1 4.15Å; P177-Y200 HydrophobicContact CB-CE2 4.12Å; P177-Y200 VanDerWaalsContact CB-OH 3.27Å; P177-Y200 WeakPolarHBondContact CB-OH 3.35Å; P177-Y200 HydrophobicContact CG-CE1 3.95Å; P177-Y200 HydrophobicContact CG-CE2 3.89Å; P177-Y200 VanDerWaalsContact CG-CZ 3.49Å; P177-Y200 WeakPolarHBondContact CG-OH 3.25Å; Y185-Y200 HydrophobicContact CD1-CD2 4.03Å; Y185-Y200 HydrophobicContact CD2-CD2 4.11Å; Y185-Y200 HydrophobicContact CE1-CD2 4.39Å; Y185-Y200 AromaticContact CG-CD2 3.82Å; Y185-Y200 HydrophobicContact CG-CD2 3.82Å; Y200-D202 VanDerWaalsContact C-N 3.31Å; Y200-D202 PolarHBondContact O-N 3.12Å; Y200-Y203 PolarHBondContact O-N 3.49Å; Y200-M204 HydrophobicContact CD1-CG 4.02Å; Y200-M204 HydrophobicContact CD2-CE 4.17Å; Y200-M204 HydrophobicContact CD2-CG 4.3Å; Y200-M204 HydrophobicContact CE1-CG 3.53Å; Y200-M204 HydrophobicContact CE1-SD 4.29Å; Y200-M204 HydrophobicContact CE2-CE 3.53Å; Y200-M204 HydrophobicContact CE2-CG 3.84Å; Y200-M204 HydrophobicContact CE2-SD 3.85Å; Y200-M204 HydrophobicContact CG-CG 4.39Å; Y200-M204 VanDerWaalsContact CZ-CG 3.41Å; Y200-M204 VanDerWaalsContact CZ-SD 3.57Å; Y200-M204 WeakPolarHBondContact O-CG 3.45Å; Y200-M204 PolarHBondContact O-N 2.73Å; Y200-M204 PolarHBondContact OH-SD 3.27Å
201	N	94.4	Very high	92.8	Very high	34 Å²	34	15.4 Å²	15.4	18%	0.182	9%	0.091	C	C	.	.	H	α-helix	trans	-64.8	-33.3	179.4	-73.4	-14.6	0	0	0	112.9	Y170 L171 A172 S199 A205 R214	Y170-N201 PolarHBondContact O-ND2 3.03Å; L171-N201 PolarHBondContact O-ND2 3.21Å; A172-N201 PolarHBondContact O-ND2 3.38Å; A172-N201 VanDerWaalsContact O-ND2 3.1Å; S199-N201 VanDerWaalsContact C-N 3.27Å; S199-N201 PolarHBondContact O-N 3.2Å; S199-N201 PolarHBondContact OG-N 3.36Å; N201-A205 WeakPolarHBondContact O-CB 3.35Å; N201-A205 PolarHBondContact O-N 2.93Å; N201-R214 PolarHBondContact O-NH1 3.23Å
202	D	94.8	Very high	91.9	Very high	16 Å²	16	17.3 Å²	17.3	9%	0.086	10%	0.098	C	C	.	.	H	α-helix	trans	-72.5	-41.2	174.5	-71.4	-38.2	0	0	0	110.8	Y170 S199 Y200 A205 F206 R215 F310 L325	Y170-D202 PolarHBondContact OH-OD1 2.9Å; S199-D202 WeakPolarHBondContact CB-OD2 3.29Å; S199-D202 PolarHBondContact O-N 2.79Å; Y200-D202 VanDerWaalsContact C-N 3.31Å; Y200-D202 PolarHBondContact O-N 3.12Å; D202-A205 PolarHBondContact O-N 3.08Å; D202-F206 PolarHBondContact O-N 3.39Å; D202-R215 IonicContact OD1-CZ 3.99Å; D202-R215 IonicContact OD1-NH2 3.42Å; D202-R215 PolarHBondContact OD1-NH2 3.23Å; D202-R215 VanDerWaalsContact OD1-NH2 3.1Å; D202-R215 IonicContact OD2-NH2 3.24Å; D202-F310 HydrophobicContact CB-CE2 4.17Å; D202-F310 HydrophobicContact CB-CZ 4.25Å; D202-L325 HydrophobicContact CB-CD2 4.46Å
203	Y	96.8	Very high	90.5	Very high	1 Å²	1	23 Å²	23	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-45.4	176.7	-178.7	-107.9	0	0	0	112.1	S184 Y185 N188 M190 S199 Y200 A205 F206 M207	S184-Y203 PolarHBondContact O-OH 2.78Å; S184-Y203 VanDerWaalsContact O-OH 3.11Å; S184-Y203 PolarHBondContact OG-OH 2.69Å; Y185-Y203 AromaticContact CD2-CD1 3.61Å; Y185-Y203 HydrophobicContact CD2-CD1 3.61Å; Y185-Y203 HydrophobicContact CD2-CE1 4.44Å; Y185-Y203 AromaticContact CD2-CG 3.75Å; Y185-Y203 HydrophobicContact CD2-CG 3.75Å; Y185-Y203 HydrophobicContact CG-CD1 4.13Å; N188-Y203 HydrophobicContact CB-CE2 4.26Å; M190-Y203 HydrophobicContact CE-CE2 3.85Å; S199-Y203 PolarHBondContact O-N 3.11Å; Y200-Y203 PolarHBondContact O-N 3.49Å; Y203-A205 PolarHBondContact O-N 3.39Å; Y203-F206 WeakPolarHBondContact O-CB 3.26Å; Y203-F206 PolarHBondContact O-N 3.16Å; Y203-M207 HydrophobicContact CD1-CG 4.36Å; Y203-M207 HydrophobicContact CD2-CG 4.47Å; Y203-M207 HydrophobicContact CE1-CG 3.92Å; Y203-M207 HydrophobicContact CE2-CG 4.08Å; Y203-M207 HydrophobicContact CE2-SD 4.17Å; Y203-M207 VanDerWaalsContact O-CG 3.29Å; Y203-M207 WeakPolarHBondContact O-CG 3.35Å; Y203-M207 PolarHBondContact O-N 2.75Å
204	M	96.3	Very high	89.2	Confident	14 Å²	14	26.3 Å²	26.3	7%	0.069	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-45.9	174.9	-69.4	-60.1	101.8	0	0	111.4	H60 E181 Y200 F206 M207 E208	H60-M204 VanDerWaalsContact CE1-CE 3.48Å; H60-M204 WeakPolarHBondContact CE1-CE 3.22Å; E181-M204 HydrophobicContact CB-CE 4.13Å; E181-M204 HydrophobicContact CB-SD 3.97Å; E181-M204 HydrophobicContact CG-CE 4.49Å; E181-M204 HydrophobicContact CG-SD 3.88Å; Y200-M204 HydrophobicContact CD1-CG 4.02Å; Y200-M204 HydrophobicContact CD2-CE 4.17Å; Y200-M204 HydrophobicContact CD2-CG 4.3Å; Y200-M204 HydrophobicContact CE1-CG 3.53Å; Y200-M204 HydrophobicContact CE1-SD 4.29Å; Y200-M204 HydrophobicContact CE2-CE 3.53Å; Y200-M204 HydrophobicContact CE2-CG 3.84Å; Y200-M204 HydrophobicContact CE2-SD 3.85Å; Y200-M204 HydrophobicContact CG-CG 4.39Å; Y200-M204 VanDerWaalsContact CZ-CG 3.41Å; Y200-M204 VanDerWaalsContact CZ-SD 3.57Å; Y200-M204 WeakPolarHBondContact O-CG 3.45Å; Y200-M204 PolarHBondContact O-N 2.73Å; Y200-M204 PolarHBondContact OH-SD 3.27Å; M204-F206 VanDerWaalsContact C-N 3.25Å; M204-F206 PolarHBondContact O-N 2.76Å; M204-M207 PolarHBondContact O-N 3.48Å; M204-E208 WeakPolarHBondContact O-CB 3.43Å; M204-E208 WeakPolarHBondContact O-CG 3.29Å; M204-E208 PolarHBondContact O-N 3.34Å
205	A	94.5	Very high	88.3	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-34.8	178	0	0	0	0	0	113	N201 D202 Y203 G209 T210 S211	N201-A205 WeakPolarHBondContact O-CB 3.35Å; N201-A205 PolarHBondContact O-N 2.93Å; D202-A205 PolarHBondContact O-N 3.08Å; Y203-A205 PolarHBondContact O-N 3.39Å; A205-G209 CarbonylContact O-C 3.29Å; A205-G209 PolarHBondContact O-N 2.82Å; A205-T210 WeakPolarHBondContact CA-OG1 3.46Å; A205-T210 PolarHBondContact O-N 2.83Å; A205-T210 PolarHBondContact O-OG1 2.95Å; A205-S211 PolarHBondContact O-N 2.87Å; A205-S211 VanDerWaalsContact O-N 3.15Å
206	F	95.5	Very high	86.9	Confident	7 Å²	7	30.6 Å²	30.6	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-66.3	-43.2	172	165.6	-106.6	0	0	0	112.1	F45 R59 M190 D202 Y203 M204 E208 G209 A308 F310	F45-F206 HydrophobicContact CD1-CZ 4.31Å; F45-F206 HydrophobicContact CE1-CE1 4.05Å; F45-F206 AromaticContact CE1-CZ 3.85Å; F45-F206 HydrophobicContact CE1-CZ 3.85Å; R59-F206 PolarHBondContact NH2-O 3.26Å; M190-F206 HydrophobicContact CE-CD1 4.34Å; M190-F206 HydrophobicContact CE-CE1 3.67Å; M190-F206 HydrophobicContact CE-CZ 4.47Å; M190-F206 HydrophobicContact SD-CE1 3.88Å; M190-F206 HydrophobicContact SD-CZ 4.09Å; D202-F206 PolarHBondContact O-N 3.39Å; Y203-F206 WeakPolarHBondContact O-CB 3.26Å; Y203-F206 PolarHBondContact O-N 3.16Å; M204-F206 VanDerWaalsContact C-N 3.25Å; M204-F206 PolarHBondContact O-N 2.76Å; F206-E208 VanDerWaalsContact C-N 3.32Å; F206-E208 PolarHBondContact O-N 2.98Å; F206-G209 PolarHBondContact O-N 3.36Å; F206-A308 WeakPolarHBondContact CE2-O 3.41Å; F206-A308 HydrophobicContact CZ-CB 4.15Å; F206-F310 HydrophobicContact CB-CD2 3.52Å; F206-F310 HydrophobicContact CB-CE2 3.92Å; F206-F310 HydrophobicContact CB-CG 4.22Å; F206-F310 HydrophobicContact CD1-CB 4.22Å; F206-F310 HydrophobicContact CD1-CD2 4.4Å; F206-F310 HydrophobicContact CD1-CG 4.27Å; F206-F310 HydrophobicContact CD2-CB 3.65Å; F206-F310 HydrophobicContact CD2-CD2 4.04Å; F206-F310 HydrophobicContact CD2-CG 4.16Å; F206-F310 HydrophobicContact CE1-CB 4.32Å; F206-F310 HydrophobicContact CE2-CB 3.75Å; F206-F310 HydrophobicContact CG-CB 3.89Å; F206-F310 AromaticContact CG-CD2 3.72Å; F206-F310 HydrophobicContact CG-CD2 3.72Å; F206-F310 AromaticContact CG-CG 3.93Å; F206-F310 HydrophobicContact CG-CG 3.93Å; F206-F310 HydrophobicContact CZ-CB 4.08Å
207	M	96.3	Very high	85.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.8	-33.3	-179.1	-64.4	-59.6	-79.7	0	0	112.3	F45 R59 H60 A63 Y203 M204	F45-M207 HydrophobicContact CZ-CE 4.25Å; F45-M207 HydrophobicContact CZ-SD 4.28Å; R59-M207 HydrophobicContact CB-CE 3.6Å; R59-M207 HydrophobicContact CB-SD 4.46Å; R59-M207 WeakPolarHBondContact CD-O 3.37Å; R59-M207 PolarHBondContact NE-O 3.44Å; R59-M207 VanDerWaalsContact O-CE 3.31Å; R59-M207 WeakPolarHBondContact O-CE 3.29Å; H60-M207 VanDerWaalsContact CA-CE 3.43Å; H60-M207 HydrophobicContact CB-CE 4.19Å; H60-M207 VanDerWaalsContact CE1-CB 3.42Å; H60-M207 WeakPolarHBondContact CE1-CB 3.33Å; H60-M207 VanDerWaalsContact CE1-CG 3.4Å; H60-M207 WeakPolarHBondContact CE1-CG 3.23Å; H60-M207 WeakPolarHBondContact ND1-CE 3.41Å; A63-M207 HydrophobicContact CB-CE 4.1Å; Y203-M207 HydrophobicContact CD1-CG 4.36Å; Y203-M207 HydrophobicContact CD2-CG 4.47Å; Y203-M207 HydrophobicContact CE1-CG 3.92Å; Y203-M207 HydrophobicContact CE2-CG 4.08Å; Y203-M207 HydrophobicContact CE2-SD 4.17Å; Y203-M207 VanDerWaalsContact O-CG 3.29Å; Y203-M207 WeakPolarHBondContact O-CG 3.35Å; Y203-M207 PolarHBondContact O-N 2.75Å; M204-M207 PolarHBondContact O-N 3.48Å
208	E	94.4	Very high	83.9	Confident	94 Å²	94	40.6 Å²	40.6	44%	0.439	20%	0.199	S	C	.	.	H	α-helix	trans	-82.9	-17.8	175.5	-66.1	172	172.6	0	0	114	P56 M204 F206 T210	P56-E208 HydrophobicContact CG-CG 4.36Å; M204-E208 WeakPolarHBondContact O-CB 3.43Å; M204-E208 WeakPolarHBondContact O-CG 3.29Å; M204-E208 PolarHBondContact O-N 3.34Å; F206-E208 VanDerWaalsContact C-N 3.32Å; F206-E208 PolarHBondContact O-N 2.98Å; E208-T210 HydrophobicContact CB-CG2 4.22Å
209	G	90.4	Very high	82.1	Confident	26 Å²	26	44.1 Å²	44.1	27%	0.268	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	17.7	-176.2	0	0	0	0	0	115.2	A205 F206	A205-G209 CarbonylContact O-C 3.29Å; A205-G209 PolarHBondContact O-N 2.82Å; F206-G209 PolarHBondContact O-N 3.36Å
210	T	87.4	Confident	80.3	Confident	46 Å²	46	45.2 Å²	45.2	28%	0.282	23%	0.227	S	C	.	.			trans	-95.2	-5.7	179.5	59.5	0	0	0	0	113.3	A205 E208 Y212 Q213 R214	A205-T210 WeakPolarHBondContact CA-OG1 3.46Å; A205-T210 PolarHBondContact O-N 2.83Å; A205-T210 PolarHBondContact O-OG1 2.95Å; E208-T210 HydrophobicContact CB-CG2 4.22Å; T210-Y212 PolarHBondContact O-N 2.76Å; T210-Q213 PolarHBondContact O-N 3.29Å; T210-R214 PolarHBondContact O-N 3.31Å; T210-R214 VanDerWaalsContact O-N 3.16Å
211	S	79.8	Confident	77.9	Confident	21 Å²	21	51.5 Å²	51.5	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-54.1	-47	-177	51.4	0	0	0	0	113.6	A205 R215	A205-S211 PolarHBondContact O-N 2.87Å; A205-S211 VanDerWaalsContact O-N 3.15Å; S211-R215 WeakPolarHBondContact O-CG 3.29Å; S211-R215 PolarHBondContact O-N 2.95Å
212	Y	73.9	Confident	75.7	Confident	42 Å²	42	53.8 Å²	53.8	17%	0.165	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-40.1	-177.5	-60.8	-71.6	0	0	0	112.9	T210 R215 H216 E232 P233 G309 F312 W323	T210-Y212 PolarHBondContact O-N 2.76Å; Y212-R215 PolarHBondContact O-N 3.35Å; Y212-H216 WeakPolarHBondContact O-CB 3.31Å; Y212-H216 PolarHBondContact O-N 2.98Å; Y212-E232 HydrophobicContact CD2-CG 4.04Å; Y212-E232 HydrophobicContact CE1-CG 4.15Å; Y212-E232 HydrophobicContact CE2-CG 3.48Å; Y212-E232 VanDerWaalsContact CE2-CG 3.48Å; Y212-E232 PolarHBondContact OH-OE1 3.27Å; Y212-P233 HydrophobicContact CD1-CG 3.84Å; Y212-P233 HydrophobicContact CE1-CG 3.59Å; Y212-G309 PolarHBondContact OH-O 3.31Å; Y212-G309 VanDerWaalsContact OH-O 3.12Å; Y212-F312 HydrophobicContact CD1-CB 4.15Å; Y212-F312 AromaticContact CD1-CD1 3.59Å; Y212-F312 HydrophobicContact CD1-CD1 3.59Å; Y212-F312 HydrophobicContact CD1-CE1 4.16Å; Y212-F312 AromaticContact CD1-CG 3.92Å; Y212-F312 HydrophobicContact CD1-CG 3.92Å; Y212-F312 HydrophobicContact CE1-CB 3.73Å; Y212-F312 HydrophobicContact CE1-CD1 4.04Å; Y212-F312 AromaticContact CE1-CG 3.86Å; Y212-F312 HydrophobicContact CE1-CG 3.86Å; Y212-W323 HydrophobicContact CE1-CH2 4.2Å; Y212-W323 WeakPolarHBondContact OH-CH2 3.32Å
213	Q	65.2	Low	73.1	Confident	120 Å²	120	62 Å²	62	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-64.4	-45.1	179	-79	174.8	-31.1	0	0	111.4	T210 R215 H216 Q217	T210-Q213 PolarHBondContact O-N 3.29Å; Q213-R215 PolarHBondContact O-N 3.08Å; Q213-H216 PolarHBondContact O-N 2.99Å; Q213-Q217 VanDerWaalsContact O-CG 3.32Å; Q213-Q217 WeakPolarHBondContact O-CG 3.44Å; Q213-Q217 PolarHBondContact O-N 2.95Å
214	R	67	Low	70.5	Confident	77 Å²	77	67.8 Å²	67.8	29%	0.291	35%	0.354	S	S	.	.	H	α-helix	trans	-57.6	-48.9	177.1	-171.3	-174.4	-63.9	159.8	0.9	111.2	N201 T210 H216 Q217 E218	N201-R214 PolarHBondContact O-NH1 3.23Å; T210-R214 PolarHBondContact O-N 3.31Å; T210-R214 VanDerWaalsContact O-N 3.16Å; R214-H216 PolarHBondContact O-N 3.27Å; R214-Q217 PolarHBondContact O-N 3.47Å; R214-E218 WeakPolarHBondContact O-CG 3.39Å; R214-E218 PolarHBondContact O-N 3.37Å
215	R	69.1	Low	67.7	Low	30 Å²	30	74.8 Å²	74.8	11%	0.113	39%	0.392	C	S	.	.	H	α-helix	trans	-71.4	-30	-178.4	-65	-57.5	-171.9	178.7	1.6	113.8	Y170 D202 S211 Y212 Q213 E218 N219 F312 L325	Y170-R215 VanDerWaalsContact OH-CZ 3.26Å; Y170-R215 PolarHBondContact OH-NH2 2.98Å; D202-R215 IonicContact OD1-CZ 3.99Å; D202-R215 IonicContact OD1-NH2 3.42Å; D202-R215 PolarHBondContact OD1-NH2 3.23Å; D202-R215 VanDerWaalsContact OD1-NH2 3.1Å; D202-R215 IonicContact OD2-NH2 3.24Å; S211-R215 WeakPolarHBondContact O-CG 3.29Å; S211-R215 PolarHBondContact O-N 2.95Å; Y212-R215 PolarHBondContact O-N 3.35Å; Q213-R215 PolarHBondContact O-N 3.08Å; R215-E218 VanDerWaalsContact CD-OE2 3.26Å; R215-E218 WeakPolarHBondContact CD-OE2 3.49Å; R215-E218 IonicContact CZ-OE2 3.12Å; R215-E218 IonicContact NE-OE2 2.69Å; R215-E218 IonicContact NH1-OE2 2.84Å; R215-E218 PolarHBondContact NH1-OE2 2.85Å; R215-N219 PolarHBondContact O-N 3.48Å; R215-N219 PolarHBondContact O-ND2 2.91Å; R215-F312 HydrophobicContact CB-CD1 4.26Å; R215-F312 HydrophobicContact CB-CE1 4.18Å; R215-L325 VanDerWaalsContact NH2-CD1 3.25Å
216	H	60.3	Low	65.2	Low	72 Å²	72	78.8 Å²	78.8	33%	0.333	43%	0.434	S	S	.	.	H	α-helix	trans	-67.4	-43.7	172.7	-171.2	-71.2	0	0	0	111.2	Y212 Q213 R214 N219 A220 E224	Y212-H216 WeakPolarHBondContact O-CB 3.31Å; Y212-H216 PolarHBondContact O-N 2.98Å; Q213-H216 PolarHBondContact O-N 2.99Å; R214-H216 PolarHBondContact O-N 3.27Å; H216-N219 PolarHBondContact O-N 3.05Å; H216-A220 WeakPolarHBondContact O-CB 3.19Å; H216-A220 PolarHBondContact O-N 3.4Å; H216-E224 IonicContact CE1-OE2 3.76Å
217	Q	58.8	Low	62.4	Low	142 Å²	142	86.8 Å²	86.8	66%	0.664	47%	0.468	S	S	*	.	H	α-helix	trans	-65.1	-39.2	178.5	-71.7	171.9	-8.8	0	0	112.2	Q213 R214	Q213-Q217 VanDerWaalsContact O-CG 3.32Å; Q213-Q217 WeakPolarHBondContact O-CG 3.44Å; Q213-Q217 PolarHBondContact O-N 2.95Å; R214-Q217 PolarHBondContact O-N 3.47Å
218	E	61.4	Low	59.7	Low	80 Å²	80	90.8 Å²	90.8	37%	0.374	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-41.8	176.7	-75.1	171.4	-173.8	0	0	113	Y170 R214 R215	Y170-E218 WeakPolarHBondContact CE2-OE1 3.44Å; R214-E218 WeakPolarHBondContact O-CG 3.39Å; R214-E218 PolarHBondContact O-N 3.37Å; R215-E218 VanDerWaalsContact CD-OE2 3.26Å; R215-E218 WeakPolarHBondContact CD-OE2 3.49Å; R215-E218 IonicContact CZ-OE2 3.12Å; R215-E218 IonicContact NE-OE2 2.69Å; R215-E218 IonicContact NH1-OE2 2.84Å; R215-E218 PolarHBondContact NH1-OE2 2.85Å
219	N	57.5	Low	57.5	Low	86 Å²	86	95.9 Å²	95.9	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-80.3	-17.7	-177.4	-71.6	-53.6	0	0	0	113.8	R215 H216 N221 G314	R215-N219 PolarHBondContact O-N 3.48Å; R215-N219 PolarHBondContact O-ND2 2.91Å; H216-N219 PolarHBondContact O-N 3.05Å; N219-N221 VanDerWaalsContact C-N 3.35Å; N219-N221 PolarHBondContact O-N 3Å; N219-G314 VanDerWaalsContact ND2-CA 3.33Å; N219-G314 WeakPolarHBondContact ND2-CA 3.5Å
220	A	56	Low	55.8	Low	28 Å²	28	101 Å²	101	23%	0.231	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	1.5	-175.6	0	0	0	0	0	114.9	H216 G222 K223	H216-A220 WeakPolarHBondContact O-CB 3.19Å; H216-A220 PolarHBondContact O-N 3.4Å; A220-G222 PolarHBondContact O-N 3.28Å; A220-K223 PolarHBondContact O-N 2.58Å
221	N	46.3	Very low	54.8	Low	144 Å²	144	103.6 Å²	103.6	77%	0.77	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	43.8	35.6	179.2	-86.4	-10.7	0	0	0	114.2	N219 K223	N219-N221 VanDerWaalsContact C-N 3.35Å; N219-N221 PolarHBondContact O-N 3Å; N221-K223 PolarHBondContact O-N 2.8Å
222	G	47.2	Very low	54.8	Low	82 Å²	82	105.8 Å²	105.8	85%	0.845	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.5	16	-180	0	0	0	0	0	116.1	A220	A220-G222 PolarHBondContact O-N 3.28Å
223	K	40.3	Very low	55.5	Low	189 Å²	189	104.3 Å²	104.3	82%	0.822	56%	0.561	S	S	*	*			trans	-115.2	28.1	-173.1	-80.6	-168.2	179.1	-176.8	0	115.3	A220 N221	A220-K223 PolarHBondContact O-N 2.58Å; N221-K223 PolarHBondContact O-N 2.8Å
224	E	42.5	Very low	56.7	Low	122 Å²	122	101.5 Å²	101.5	57%	0.57	55%	0.554	S	S	*	*			trans	-119.5	106.4	165.8	-80.9	-161.4	138.6	0	0	112.7	H216 G226	H216-E224 IonicContact CE1-OE2 3.76Å; E224-G226 PolarHBondContact O-N 2.74Å
225	N	38.3	Very low	58	Low	162 Å²	162	98 Å²	98	87%	0.866	54%	0.542	S	S	*	.			trans	-62.9	109.6	159.6	-79.8	-19.8	0	0	0	109.5	K227	N225-K227 VanDerWaalsContact C-N 3.34Å; N225-K227 PolarHBondContact O-N 2.72Å
226	G	41.4	Very low	59.2	Low	85 Å²	85	104 Å²	104	88%	0.876	57%	0.568	S	S	*	*	S	Bend	trans	59.7	23	142.9	0	0	0	0	0	119.1	E224	E224-G226 PolarHBondContact O-N 2.74Å
227	K	36.8	Very low	60.8	Low	174 Å²	174	109.1 Å²	109.1	76%	0.757	59%	0.585	S	S	*	*			trans	-90.5	132.7	173.8	-74.4	-175.3	179	177.5	0	111.6	N225	N225-K227 VanDerWaalsContact C-N 3.34Å; N225-K227 PolarHBondContact O-N 2.72Å
228	A	40.8	Very low	62.5	Low	85 Å²	85	103.3 Å²	103.3	70%	0.702	56%	0.561	S	S	*	*			trans	-31.8	143.7	-171.3	0	0	0	0	0	116.7	Q230	A228-Q230 PolarHBondContact O-N 2.84Å
229	K	46.8	Very low	64.2	Low	200 Å²	200	100.4 Å²	100.4	87%	0.87	55%	0.549	S	S	*	.			trans	-40	97.7	165.8	-77.1	176.1	175.5	176.1	0	110
230	Q	56	Low	66.2	Low	133 Å²	133	100.5 Å²	100.5	62%	0.621	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-56.9	134.4	171.2	-76.4	-84	-2.9	0	0	107.7	A228	A228-Q230 PolarHBondContact O-N 2.84Å
231	P	66.6	Low	68.1	Low	101 Å²	101	102.6 Å²	102.6	66%	0.656	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-60.4	149	179.4	24.7	-32.3	0	0	0	110.4
232	E	79.2	Confident	70.6	Confident	68 Å²	68	97 Å²	97	32%	0.318	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-52	126.8	177.7	-170.2	-165.2	154.5	0	0	110	R46 H50 Y212	R46-E232 IonicContact CZ-OE1 3.46Å; R46-E232 IonicContact NE-OE1 3.17Å; R46-E232 PolarHBondContact NE-OE1 3.41Å; R46-E232 VanDerWaalsContact NH2-CD 3.34Å; R46-E232 IonicContact NH2-OE1 2.65Å; R46-E232 PolarHBondContact NH2-OE1 3.16Å; R46-E232 IonicContact NH2-OE2 2.72Å; H50-E232 IonicContact CD2-OE2 2.73Å; H50-E232 IonicContact NE2-OE2 2.74Å; H50-E232 PolarHBondContact NE2-OE2 3.42Å; H50-E232 VanDerWaalsContact NE2-OE2 3.09Å; Y212-E232 HydrophobicContact CD2-CG 4.04Å; Y212-E232 HydrophobicContact CE1-CG 4.15Å; Y212-E232 HydrophobicContact CE2-CG 3.48Å; Y212-E232 VanDerWaalsContact CE2-CG 3.48Å; Y212-E232 PolarHBondContact OH-OE1 3.27Å
233	P	87.2	Confident	73	Confident	11 Å²	11	96 Å²	96	7%	0.071	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-62	143.3	-177.7	25.1	-33.5	0	0	0	110.6	R46 Y212 P235 F312 P321 W323	R46-P233 PolarHBondContact NH2-O 3.02Å; Y212-P233 HydrophobicContact CD1-CG 3.84Å; Y212-P233 HydrophobicContact CE1-CG 3.59Å; P233-P235 WeakPolarHBondContact O-CD 3.45Å; P233-F312 HydrophobicContact CB-CD2 4.33Å; P233-F312 HydrophobicContact CB-CE2 4.1Å; P233-F312 HydrophobicContact CG-CD2 3.68Å; P233-F312 HydrophobicContact CG-CE2 3.65Å; P233-F312 HydrophobicContact CG-CG 4.15Å; P233-F312 HydrophobicContact CG-CZ 4.09Å; P233-P321 HydrophobicContact CB-CB 3.69Å; P233-P321 HydrophobicContact CB-CG 4.22Å; P233-W323 HydrophobicContact CB-CZ2 4.15Å; P233-W323 HydrophobicContact CG-CZ2 4.06Å; P233-W323 WeakPolarHBondContact O-CZ2 3.31Å
234	S	90.5	Very high	75.7	Confident	61 Å²	61	90.3 Å²	90.3	43%	0.427	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-83.8	125.3	177.7	-178.5	0	0	0	0	110.8	K236 W323	S234-K236 VanDerWaalsContact C-N 3.26Å; S234-K236 PolarHBondContact O-N 3.47Å; S234-K236 WeakPolarHBondContact OG-CG 3.37Å; S234-K236 PolarHBondContact OG-N 3.12Å; S234-W323 PolarHBondContact O-NE1 3.29Å
235	P	94.1	Very high	78.4	Confident	4 Å²	4	86.6 Å²	86.6	3%	0.026	48%	0.478	C	S	.	.			trans	-78.9	-6.7	175	31.5	-34	0	0	0	113	P233 R237 A238 V239 N306 W323	P233-P235 WeakPolarHBondContact O-CD 3.45Å; P235-R237 PolarHBondContact O-N 3.01Å; P235-A238 PolarHBondContact O-N 3.49Å; P235-V239 HydrophobicContact CB-CG2 4.14Å; P235-V239 WeakPolarHBondContact O-CG2 3.44Å; P235-V239 PolarHBondContact O-N 3.38Å; P235-N306 WeakPolarHBondContact CB-O 3.36Å; P235-N306 WeakPolarHBondContact CG-O 3.37Å; P235-W323 HydrophobicContact CB-CD2 4.06Å; P235-W323 HydrophobicContact CB-CE3 4.16Å; P235-W323 HydrophobicContact CB-CH2 3.76Å; P235-W323 HydrophobicContact CB-CZ2 3.63Å; P235-W323 HydrophobicContact CB-CZ3 4.02Å; P235-W323 HydrophobicContact CG-CH2 4.21Å; P235-W323 HydrophobicContact CG-CZ2 4.25Å
236	K	94.3	Very high	81.2	Confident	155 Å²	155	79.1 Å²	79.1	67%	0.674	44%	0.438	S	S	*	.	H	α-helix	trans	-51.6	-49.9	-169.9	-70.4	-178.7	-178.4	-177.5	0	113.1	S234 A238 V239 V240	S234-K236 VanDerWaalsContact C-N 3.26Å; S234-K236 PolarHBondContact O-N 3.47Å; S234-K236 WeakPolarHBondContact OG-CG 3.37Å; S234-K236 PolarHBondContact OG-N 3.12Å; K236-A238 PolarHBondContact O-N 3.31Å; K236-V239 PolarHBondContact O-N 2.84Å; K236-V240 WeakPolarHBondContact O-CB 3.43Å; K236-V240 VanDerWaalsContact O-CG2 3.31Å; K236-V240 WeakPolarHBondContact O-CG2 3.39Å; K236-V240 PolarHBondContact O-N 2.88Å
237	R	94.5	Very high	83.9	Confident	179 Å²	179	77.6 Å²	77.6	68%	0.675	42%	0.418	S	S	*	.	H	α-helix	trans	-61.2	-44.7	179.6	176.3	179.5	146.1	-160.3	-9	111.6	P235 S241 S320	P235-R237 PolarHBondContact O-N 3.01Å; R237-S241 VanDerWaalsContact O-CB 3.32Å; R237-S241 WeakPolarHBondContact O-CB 3.34Å; R237-S241 PolarHBondContact O-N 3.43Å; R237-S320 PolarHBondContact NH1-OG 3.44Å
238	A	95.3	Very high	86.7	Confident	21 Å²	21	74.8 Å²	74.8	17%	0.174	41%	0.41	C	S	.	.	H	α-helix	trans	-65.8	-42.9	178.8	0	0	0	0	0	111.9	P235 K236 S241 K242 W323	P235-A238 PolarHBondContact O-N 3.49Å; K236-A238 PolarHBondContact O-N 3.31Å; A238-S241 PolarHBondContact O-N 3.19Å; A238-K242 WeakPolarHBondContact O-CB 3.36Å; A238-K242 VanDerWaalsContact O-CG 3.31Å; A238-K242 WeakPolarHBondContact O-CG 3.32Å; A238-K242 PolarHBondContact O-N 3.33Å; A238-W323 HydrophobicContact CB-CB 3.68Å; A238-W323 HydrophobicContact CB-CG 3.74Å
239	V	97.6	Very high	89.4	Confident	18 Å²	18	71.1 Å²	71.1	11%	0.109	38%	0.379	C	S	.	.	H	α-helix	trans	-63.6	-49.3	177.3	174.5	0	0	0	0	110.7	L39 P235 K236 S241 K242 L243 N306 A307	L39-V239 HydrophobicContact CD1-CG1 4.44Å; P235-V239 HydrophobicContact CB-CG2 4.14Å; P235-V239 WeakPolarHBondContact O-CG2 3.44Å; P235-V239 PolarHBondContact O-N 3.38Å; K236-V239 PolarHBondContact O-N 2.84Å; V239-S241 VanDerWaalsContact C-N 3.34Å; V239-S241 PolarHBondContact O-N 3.37Å; V239-K242 PolarHBondContact O-N 3.11Å; V239-L243 HydrophobicContact CG1-CD1 3.98Å; V239-L243 HydrophobicContact CG1-CG 4.29Å; V239-L243 VanDerWaalsContact O-CG 3.29Å; V239-L243 WeakPolarHBondContact O-CG 3.3Å; V239-L243 PolarHBondContact O-N 2.99Å; V239-N306 HydrophobicContact CG2-CB 3.83Å; V239-A307 HydrophobicContact CG1-CB 4.49Å; V239-A307 HydrophobicContact CG2-CB 4.1Å
240	V	97.8	Very high	91.7	Very high	89 Å²	89	64.2 Å²	64.2	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-46.2	177.7	171	0	0	0	0	111	K236 K242 L243 C244	K236-V240 WeakPolarHBondContact O-CB 3.43Å; K236-V240 VanDerWaalsContact O-CG2 3.31Å; K236-V240 WeakPolarHBondContact O-CG2 3.39Å; K236-V240 PolarHBondContact O-N 2.88Å; V240-K242 PolarHBondContact O-N 3.19Å; V240-L243 PolarHBondContact O-N 2.79Å; V240-C244 PolarHBondContact O-N 2.99Å; V240-C244 PolarHBondContact O-SG 2.95Å; V240-C244 VanDerWaalsContact O-SG 3.32Å
241	S	97.1	Very high	93.5	Very high	71 Å²	71	62.1 Å²	62.1	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-59	-44.9	176.7	175.9	0	0	0	0	112.2	R237 A238 V239 C244 T245	R237-S241 VanDerWaalsContact O-CB 3.32Å; R237-S241 WeakPolarHBondContact O-CB 3.34Å; R237-S241 PolarHBondContact O-N 3.43Å; A238-S241 PolarHBondContact O-N 3.19Å; V239-S241 VanDerWaalsContact C-N 3.34Å; V239-S241 PolarHBondContact O-N 3.37Å; S241-C244 WeakPolarHBondContact O-CB 3.5Å; S241-C244 PolarHBondContact O-N 2.75Å; S241-T245 PolarHBondContact O-N 3.16Å; S241-T245 PolarHBondContact O-OG1 3.4Å
242	K	97.6	Very high	94.8	Very high	26 Å²	26	59.8 Å²	59.8	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-38.6	176.6	-72.6	-177.9	-171.3	-171.4	0	112.1	A238 V239 V240 T245 C246 T299 D302 A303 N306 W323	A238-K242 WeakPolarHBondContact O-CB 3.36Å; A238-K242 VanDerWaalsContact O-CG 3.31Å; A238-K242 WeakPolarHBondContact O-CG 3.32Å; A238-K242 PolarHBondContact O-N 3.33Å; V239-K242 PolarHBondContact O-N 3.11Å; V240-K242 PolarHBondContact O-N 3.19Å; K242-T245 WeakPolarHBondContact O-CB 3.31Å; K242-T245 PolarHBondContact O-N 2.92Å; K242-C246 PolarHBondContact O-N 3.03Å; K242-C246 PolarHBondContact O-SG 3.42Å; K242-T299 HydrophobicContact CB-CG2 3.72Å; K242-T299 HydrophobicContact CG-CG2 3.94Å; K242-D302 HydrophobicContact CD-CB 4.39Å; K242-D302 IonicContact NZ-OD1 2.82Å; K242-D302 PolarHBondContact NZ-OD1 3.37Å; K242-D302 IonicContact NZ-OD2 3.49Å; K242-D302 PolarHBondContact NZ-OD2 3.22Å; K242-A303 HydrophobicContact CB-CB 3.83Å; K242-A303 HydrophobicContact CD-CB 4.35Å; K242-N306 WeakPolarHBondContact CE-ND2 3.36Å; K242-N306 PolarHBondContact NZ-ND2 3.38Å; K242-W323 PolarHBondContact NZ-O 3.36Å
243	L	98.1	Very high	95.4	Very high	62 Å²	62	58.4 Å²	58.4	33%	0.325	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-37.8	174.9	-67.4	176.2	0	0	0	112.5	L39 V239 V240 C246 A247 L300 A303	L39-L243 HydrophobicContact CD2-CD1 4.15Å; L39-L243 HydrophobicContact CD2-CD2 3.75Å; V239-L243 HydrophobicContact CG1-CD1 3.98Å; V239-L243 HydrophobicContact CG1-CG 4.29Å; V239-L243 VanDerWaalsContact O-CG 3.29Å; V239-L243 WeakPolarHBondContact O-CG 3.3Å; V239-L243 PolarHBondContact O-N 2.99Å; V240-L243 PolarHBondContact O-N 2.79Å; L243-C246 WeakPolarHBondContact O-CB 3.37Å; L243-C246 PolarHBondContact O-N 3.48Å; L243-A247 PolarHBondContact O-N 3.15Å; L243-L300 HydrophobicContact CD2-CD1 4.02Å; L243-A303 HydrophobicContact CD2-CB 4.47Å
244	C	98.1	Very high	95.6	Very high	70 Å²	70	61.4 Å²	61.4	47%	0.473	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-45.4	171.1	-67.2	0	0	0	0	111.3	V240 S241 C246 A247 I248	V240-C244 PolarHBondContact O-N 2.99Å; V240-C244 PolarHBondContact O-SG 2.95Å; V240-C244 VanDerWaalsContact O-SG 3.32Å; S241-C244 WeakPolarHBondContact O-CB 3.5Å; S241-C244 PolarHBondContact O-N 2.75Å; C244-C246 VanDerWaalsContact C-N 3.3Å; C244-C246 PolarHBondContact O-N 3.28Å; C244-A247 PolarHBondContact O-N 3.08Å; C244-I248 WeakPolarHBondContact O-CG1 3.2Å; C244-I248 PolarHBondContact O-N 3.46Å
245	T	97.6	Very high	95.6	Very high	43 Å²	43	62 Å²	62	26%	0.264	34%	0.342	S	S	.	.	H	α-helix	trans	-59.4	-40.5	174.3	-60.2	0	0	0	0	111.9	S241 K242 S249 T299 I331	S241-T245 PolarHBondContact O-N 3.16Å; S241-T245 PolarHBondContact O-OG1 3.4Å; K242-T245 WeakPolarHBondContact O-CB 3.31Å; K242-T245 PolarHBondContact O-N 2.92Å; T245-S249 VanDerWaalsContact O-CB 3.27Å; T245-S249 WeakPolarHBondContact O-CB 3.49Å; T245-S249 PolarHBondContact O-N 3.08Å; T245-S249 PolarHBondContact O-OG 2.96Å; T245-T299 HydrophobicContact CG2-CG2 4.1Å; T245-I331 HydrophobicContact CG2-CD1 3.5Å; T245-I331 VanDerWaalsContact CG2-CD1 3.5Å
246	C	97.7	Very high	95.5	Very high	6 Å²	6	64.8 Å²	64.8	4%	0.041	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-46.8	174.8	-70.9	0	0	0	0	112	K242 L243 C244 S249 L250 F296 L300	K242-C246 PolarHBondContact O-N 3.03Å; K242-C246 PolarHBondContact O-SG 3.42Å; L243-C246 WeakPolarHBondContact O-CB 3.37Å; L243-C246 PolarHBondContact O-N 3.48Å; C244-C246 VanDerWaalsContact C-N 3.3Å; C244-C246 PolarHBondContact O-N 3.28Å; C246-S249 PolarHBondContact O-N 3.23Å; C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.47Å; C246-L250 PolarHBondContact O-N 2.74Å; C246-F296 HydrophobicContact CB-CD2 3.75Å; C246-F296 HydrophobicContact CB-CE2 4.08Å; C246-L300 VanDerWaalsContact SG-CA 3.6Å; C246-L300 PolarHBondContact SG-N 2.8Å
247	A	97.3	Very high	95	Very high	53 Å²	53	60.4 Å²	60.4	44%	0.438	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-49.9	178.1	0	0	0	0	0	111.2	L243 C244 S249 L250 T251	L243-A247 PolarHBondContact O-N 3.15Å; C244-A247 PolarHBondContact O-N 3.08Å; A247-S249 VanDerWaalsContact C-N 3.35Å; A247-S249 PolarHBondContact O-N 3.39Å; A247-L250 PolarHBondContact O-N 2.76Å; A247-T251 WeakPolarHBondContact O-CB 3.21Å; A247-T251 PolarHBondContact O-N 3.07Å; A247-T251 PolarHBondContact O-OG1 2.93Å
248	I	97	Very high	94.6	Very high	115 Å²	115	58.8 Å²	58.8	59%	0.59	33%	0.33	S	S	*	.	H	α-helix	trans	-59.2	-46.3	177.8	-65.7	165.9	0	0	0	110.9	C244 T252	C244-I248 WeakPolarHBondContact O-CG1 3.2Å; C244-I248 PolarHBondContact O-N 3.46Å; I248-T252 VanDerWaalsContact O-CB 3.27Å; I248-T252 WeakPolarHBondContact O-CB 3.39Å; I248-T252 PolarHBondContact O-N 3.34Å; I248-T252 PolarHBondContact O-OG1 2.87Å
249	S	96.8	Very high	94.4	Very high	8 Å²	8	63.5 Å²	63.5	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-43.3	-177.9	-58.1	0	0	0	0	112.1	T245 C246 A247 Y253 P292	T245-S249 VanDerWaalsContact O-CB 3.27Å; T245-S249 WeakPolarHBondContact O-CB 3.49Å; T245-S249 PolarHBondContact O-N 3.08Å; T245-S249 PolarHBondContact O-OG 2.96Å; C246-S249 PolarHBondContact O-N 3.23Å; A247-S249 VanDerWaalsContact C-N 3.35Å; A247-S249 PolarHBondContact O-N 3.39Å; S249-Y253 WeakPolarHBondContact O-CB 3.24Å; S249-Y253 PolarHBondContact O-N 3.32Å; S249-P292 VanDerWaalsContact O-CB 3.27Å; S249-P292 WeakPolarHBondContact O-CB 3.28Å
250	L	94.4	Very high	94.2	Very high	54 Å²	54	64.5 Å²	64.5	28%	0.283	36%	0.357	S	S	.	.	H	α-helix	trans	-67.2	-46.5	179.2	-178.1	61.6	0	0	0	111.2	C246 A247 T252 Y253 L254 F296	C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.47Å; C246-L250 PolarHBondContact O-N 2.74Å; A247-L250 PolarHBondContact O-N 2.76Å; L250-T252 PolarHBondContact O-N 3.28Å; L250-Y253 PolarHBondContact O-N 2.88Å; L250-L254 HydrophobicContact CD1-CD1 3.95Å; L250-L254 HydrophobicContact CD1-CG 4.05Å; L250-L254 HydrophobicContact CG-CD1 3.94Å; L250-L254 HydrophobicContact CG-CG 4.39Å; L250-L254 WeakPolarHBondContact O-CB 3.47Å; L250-L254 WeakPolarHBondContact O-CG 3.5Å; L250-L254 PolarHBondContact O-N 2.95Å; L250-F296 HydrophobicContact CB-CD2 3.85Å; L250-F296 HydrophobicContact CB-CE2 4.24Å; L250-F296 HydrophobicContact CB-CG 4.12Å; L250-F296 HydrophobicContact CD1-CD1 4.15Å; L250-F296 HydrophobicContact CD1-CE1 4.25Å; L250-F296 HydrophobicContact CD1-CG 4.35Å; L250-F296 HydrophobicContact CD2-CD2 4.43Å; L250-F296 HydrophobicContact CD2-CE2 3.99Å; L250-F296 HydrophobicContact CD2-CZ 4.05Å
251	T	94	Very high	94	Very high	89 Å²	89	62.4 Å²	62.4	55%	0.546	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-47.1	175.9	-60.1	0	0	0	0	110.8	A247 Y253 L254 S255	A247-T251 WeakPolarHBondContact O-CB 3.21Å; A247-T251 PolarHBondContact O-N 3.07Å; A247-T251 PolarHBondContact O-OG1 2.93Å; T251-Y253 VanDerWaalsContact C-N 3.34Å; T251-Y253 PolarHBondContact O-N 3.25Å; T251-L254 PolarHBondContact O-N 3Å; T251-S255 WeakPolarHBondContact O-CB 3.18Å; T251-S255 PolarHBondContact O-N 3.07Å; T251-S255 PolarHBondContact O-OG 3.27Å
252	T	93.7	Very high	93.7	Very high	53 Å²	53	59.4 Å²	59.4	33%	0.325	32%	0.324	S	S	.	.	H	α-helix	trans	-58.9	-45.8	178	-57.2	0	0	0	0	111.5	I248 L250 L256 P292	I248-T252 VanDerWaalsContact O-CB 3.27Å; I248-T252 WeakPolarHBondContact O-CB 3.39Å; I248-T252 PolarHBondContact O-N 3.34Å; I248-T252 PolarHBondContact O-OG1 2.87Å; L250-T252 PolarHBondContact O-N 3.28Å; T252-L256 HydrophobicContact CG2-CD1 3.76Å; T252-L256 HydrophobicContact CG2-CG 4.49Å; T252-L256 WeakPolarHBondContact O-CB 3.35Å; T252-L256 WeakPolarHBondContact O-CG 3.2Å; T252-L256 PolarHBondContact O-N 3.11Å; T252-L256 VanDerWaalsContact O-N 3.07Å; T252-P292 HydrophobicContact CG2-CG 4.1Å
253	Y	93.1	Very high	93.4	Very high	39 Å²	39	63 Å²	63	15%	0.153	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-57.3	176.9	178.3	-113.6	0	0	0	110.7	S249 L250 T251 S255 L256 Y257 L290 K293	S249-Y253 WeakPolarHBondContact O-CB 3.24Å; S249-Y253 PolarHBondContact O-N 3.32Å; L250-Y253 PolarHBondContact O-N 2.88Å; T251-Y253 VanDerWaalsContact C-N 3.34Å; T251-Y253 PolarHBondContact O-N 3.25Å; Y253-S255 PolarHBondContact O-N 3.46Å; Y253-L256 PolarHBondContact O-N 3.02Å; Y253-Y257 HydrophobicContact CD2-CG 4.47Å; Y253-Y257 HydrophobicContact CE1-CD1 4.37Å; Y253-Y257 HydrophobicContact CE1-CG 4.33Å; Y253-Y257 HydrophobicContact CE2-CD2 4.5Å; Y253-Y257 HydrophobicContact CE2-CG 4.02Å; Y253-Y257 AromaticContact CZ-CG 3.95Å; Y253-Y257 VanDerWaalsContact O-CB 3.3Å; Y253-Y257 WeakPolarHBondContact O-CB 3.3Å; Y253-Y257 WeakPolarHBondContact O-CD1 3.28Å; Y253-Y257 PolarHBondContact O-N 3.48Å; Y253-L290 HydrophobicContact CE2-CD1 4.34Å; Y253-K293 HydrophobicContact CD1-CB 4.11Å; Y253-K293 HydrophobicContact CD2-CB 3.78Å; Y253-K293 HydrophobicContact CE1-CB 4.1Å; Y253-K293 HydrophobicContact CE2-CB 3.77Å; Y253-K293 HydrophobicContact CE2-CD 3.75Å; Y253-K293 HydrophobicContact CE2-CG 4.21Å; Y253-K293 HydrophobicContact CG-CB 3.94Å
254	L	90.3	Very high	93.2	Very high	74 Å²	74	63.2 Å²	63.2	39%	0.387	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-32.8	-175.7	-68	177	0	0	0	112.8	L250 T251 Y257	L250-L254 HydrophobicContact CD1-CD1 3.95Å; L250-L254 HydrophobicContact CD1-CG 4.05Å; L250-L254 HydrophobicContact CG-CD1 3.94Å; L250-L254 HydrophobicContact CG-CG 4.39Å; L250-L254 WeakPolarHBondContact O-CB 3.47Å; L250-L254 WeakPolarHBondContact O-CG 3.5Å; L250-L254 PolarHBondContact O-N 2.95Å; T251-L254 PolarHBondContact O-N 3Å; L254-Y257 HydrophobicContact CD2-CE1 4.31Å
255	S	91.9	Very high	93	Very high	72 Å²	72	60.1 Å²	60.1	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-76.5	-36.8	177.2	-62.3	0	0	0	0	113.8	T251 Y253 L259	T251-S255 WeakPolarHBondContact O-CB 3.18Å; T251-S255 PolarHBondContact O-N 3.07Å; T251-S255 PolarHBondContact O-OG 3.27Å; Y253-S255 PolarHBondContact O-N 3.46Å; S255-L259 WeakPolarHBondContact O-CD1 3.48Å
256	L	92.1	Very high	92.8	Very high	63 Å²	63	59.2 Å²	59.2	33%	0.33	32%	0.316	S	S	.	.	H	α-helix	trans	-102.9	-25.9	-169.3	-61	-179.2	0	0	0	114.3	T252 Y253 R258 L259 L260 A289	T252-L256 HydrophobicContact CG2-CD1 3.76Å; T252-L256 HydrophobicContact CG2-CG 4.49Å; T252-L256 WeakPolarHBondContact O-CB 3.35Å; T252-L256 WeakPolarHBondContact O-CG 3.2Å; T252-L256 PolarHBondContact O-N 3.11Å; T252-L256 VanDerWaalsContact O-N 3.07Å; Y253-L256 PolarHBondContact O-N 3.02Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 3.04Å; L256-L259 HydrophobicContact CD2-CD1 4.43Å; L256-L259 PolarHBondContact O-N 3.27Å; L256-L260 PolarHBondContact O-N 3.41Å; L256-A289 HydrophobicContact CB-CB 3.68Å
257	Y	82.7	Confident	92.6	Very high	64 Å²	64	62 Å²	62	25%	0.251	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-33.8	-170.3	88.9	-79.5	0	0	0	113.6	Y253 L254 L259	Y253-Y257 HydrophobicContact CD2-CG 4.47Å; Y253-Y257 HydrophobicContact CE1-CD1 4.37Å; Y253-Y257 HydrophobicContact CE1-CG 4.33Å; Y253-Y257 HydrophobicContact CE2-CD2 4.5Å; Y253-Y257 HydrophobicContact CE2-CG 4.02Å; Y253-Y257 AromaticContact CZ-CG 3.95Å; Y253-Y257 VanDerWaalsContact O-CB 3.3Å; Y253-Y257 WeakPolarHBondContact O-CB 3.3Å; Y253-Y257 WeakPolarHBondContact O-CD1 3.28Å; Y253-Y257 PolarHBondContact O-N 3.48Å; L254-Y257 HydrophobicContact CD2-CE1 4.31Å; Y257-L259 VanDerWaalsContact C-N 3.33Å
258	R	87.1	Confident	92.4	Very high	144 Å²	144	65.8 Å²	65.8	54%	0.543	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-24	175.4	-61.5	-171.6	-177	-168.3	-4.5	112.4	D23 L256	D23-R258 IonicContact OD2-CZ 3.81Å; D23-R258 IonicContact OD2-NH1 3.8Å; D23-R258 PolarHBondContact OD2-NH1 2.69Å; D23-R258 IonicContact OD2-NH2 3.96Å; D23-R258 PolarHBondContact OD2-NH2 2.89Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 3.04Å
259	L	90.8	Very high	92.3	Very high	121 Å²	121	66.7 Å²	66.7	63%	0.634	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-29.8	-177.1	-59.7	178.6	0	0	0	112.5	S255 L256 Y257 P261	S255-L259 WeakPolarHBondContact O-CD1 3.48Å; L256-L259 HydrophobicContact CD2-CD1 4.43Å; L256-L259 PolarHBondContact O-N 3.27Å; Y257-L259 VanDerWaalsContact C-N 3.33Å; L259-P261 WeakPolarHBondContact O-CD 3.28Å
260	L	93.6	Very high	92.2	Very high	39 Å²	39	67.2 Å²	67.2	20%	0.204	34%	0.342	C	S	.	.	S	Bend	trans	-126.2	63.1	-175	-61	168.9	0	0	0	111.5	L256 Y282 L285 A286 A289	L256-L260 PolarHBondContact O-N 3.41Å; L260-Y282 HydrophobicContact CD2-CD2 4.31Å; L260-Y282 HydrophobicContact CD2-CE2 3.81Å; L260-L285 HydrophobicContact CD1-CB 4.03Å; L260-A286 HydrophobicContact CB-CB 4.26Å; L260-A286 WeakPolarHBondContact O-CB 3.16Å; L260-A289 HydrophobicContact CB-CB 4.14Å; L260-A289 HydrophobicContact CD1-CB 4.06Å
261	P	92.6	Very high	92.2	Very high	44 Å²	44	66.5 Å²	66.5	29%	0.286	34%	0.339	S	S	.	.			trans	-66.5	130.6	179.3	26.4	-33.3	0	0	0	112.1	L259 D263 H264 Y282	L259-P261 WeakPolarHBondContact O-CD 3.28Å; P261-D263 VanDerWaalsContact C-N 3.26Å; P261-D263 VanDerWaalsContact CB-OD1 3.28Å; P261-D263 WeakPolarHBondContact CB-OD1 3.3Å; P261-D263 PolarHBondContact O-N 3.13Å; P261-H264 HydrophobicContact CG-CB 4.25Å; P261-H264 WeakPolarHBondContact O-CB 3.22Å; P261-H264 PolarHBondContact O-N 3.08Å; P261-H264 VanDerWaalsContact O-N 3.14Å; P261-Y282 WeakPolarHBondContact CD-OH 3.42Å; P261-Y282 PolarHBondContact O-OH 2.96Å
262	V	92.1	Very high	92.1	Very high	9 Å²	9	66.8 Å²	66.8	6%	0.055	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-64.6	-31.2	-176.6	176	0	0	0	0	112.1	H264 S265 A286 M287 L290 V440	V262-H264 PolarHBondContact O-N 2.91Å; V262-S265 VanDerWaalsContact O-CB 3.27Å; V262-S265 WeakPolarHBondContact O-CB 3.43Å; V262-S265 PolarHBondContact O-N 3Å; V262-S265 PolarHBondContact O-OG 2.9Å; V262-A286 HydrophobicContact CG2-CB 4.19Å; V262-M287 HydrophobicContact CG1-SD 4.18Å; V262-M287 HydrophobicContact CG2-SD 3.88Å; V262-L290 HydrophobicContact CG2-CD2 3.98Å; V262-V440 HydrophobicContact CB-CG1 4.06Å; V262-V440 HydrophobicContact CG1-CB 4.3Å; V262-V440 HydrophobicContact CG1-CG1 4.06Å; V262-V440 HydrophobicContact CG2-CG1 4.3Å
263	D	91.6	Very high	92.2	Very high	101 Å²	101	68.1 Å²	68.1	54%	0.54	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-63.8	-20.2	176.5	52.2	-64.1	0	0	0	113.6	P261 S265 I266	P261-D263 VanDerWaalsContact C-N 3.26Å; P261-D263 VanDerWaalsContact CB-OD1 3.28Å; P261-D263 WeakPolarHBondContact CB-OD1 3.3Å; P261-D263 PolarHBondContact O-N 3.13Å; D263-S265 PolarHBondContact O-N 3.27Å; D263-I266 WeakPolarHBondContact O-CG1 3.36Å; D263-I266 PolarHBondContact O-N 2.99Å; D263-I266 VanDerWaalsContact O-N 3.16Å
264	H	93.4	Very high	92.3	Very high	66 Å²	66	67.7 Å²	67.7	31%	0.306	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-64.7	-23.1	171.1	-166.1	61.7	0	0	0	112.5	P261 V262 I266 D267 F270 Y282	P261-H264 HydrophobicContact CG-CB 4.25Å; P261-H264 WeakPolarHBondContact O-CB 3.22Å; P261-H264 PolarHBondContact O-N 3.08Å; P261-H264 VanDerWaalsContact O-N 3.14Å; V262-H264 PolarHBondContact O-N 2.91Å; H264-I266 PolarHBondContact O-N 3.2Å; H264-I266 VanDerWaalsContact O-N 3.11Å; H264-D267 WeakPolarHBondContact O-CB 3.37Å; H264-D267 PolarHBondContact O-N 2.91Å; H264-D267 VanDerWaalsContact O-N 3.12Å; H264-F270 AromaticContact CD2-CD2 3.62Å; H264-F270 AromaticContact CD2-CG 3.71Å; H264-F270 AromaticContact NE2-CD2 3.19Å; H264-F270 WeakPolarHBondContact NE2-CD2 3.45Å; H264-F270 AromaticContact NE2-CE2 3.91Å; H264-F270 AromaticContact NE2-CG 3.48Å; H264-F270 WeakPolarHBondContact NE2-CG 3.29Å; H264-F270 VanDerWaalsContact O-CD1 3.31Å; H264-F270 WeakPolarHBondContact O-CD1 3.35Å; H264-Y282 HydrophobicContact CB-CE1 3.92Å; H264-Y282 WeakPolarHBondContact CB-OH 3.33Å; H264-Y282 AromaticContact CD2-CE1 3.98Å; H264-Y282 AromaticContact CD2-CE2 3.9Å; H264-Y282 AromaticContact CD2-CZ 3.58Å
265	S	92.6	Very high	92.6	Very high	5 Å²	5	67 Å²	67	4%	0.035	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-65.3	-12.6	176.1	69.5	0	0	0	0	114.2	V262 D263	V262-S265 VanDerWaalsContact O-CB 3.27Å; V262-S265 WeakPolarHBondContact O-CB 3.43Å; V262-S265 PolarHBondContact O-N 3Å; V262-S265 PolarHBondContact O-OG 2.9Å; D263-S265 PolarHBondContact O-N 3.27Å
266	I	93.3	Very high	92.7	Very high	24 Å²	24	67.9 Å²	67.9	12%	0.123	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-117	6.6	176.7	61.4	168.5	0	0	0	113.2	D263 H264 L441 P446 K449 F450	D263-I266 WeakPolarHBondContact O-CG1 3.36Å; D263-I266 PolarHBondContact O-N 2.99Å; D263-I266 VanDerWaalsContact O-N 3.16Å; H264-I266 PolarHBondContact O-N 3.2Å; H264-I266 VanDerWaalsContact O-N 3.11Å; I266-L441 HydrophobicContact CD1-CD1 4.13Å; I266-L441 HydrophobicContact CD1-CD2 4.02Å; I266-L441 HydrophobicContact CG2-CD1 4.06Å; I266-P446 HydrophobicContact CD1-CB 3.65Å; I266-K449 HydrophobicContact CB-CD 4.39Å; I266-K449 VanDerWaalsContact O-CE 3.22Å; I266-K449 WeakPolarHBondContact O-CE 3.49Å; I266-K449 PolarHBondContact O-NZ 3.28Å; I266-F450 HydrophobicContact CG2-CB 3.54Å; I266-F450 HydrophobicContact CG2-CD2 4.24Å; I266-F450 HydrophobicContact CG2-CG 4.36Å
267	D	94.4	Very high	92.8	Very high	64 Å²	64	72.2 Å²	72.2	34%	0.342	36%	0.363	S	S	.	.			trans	-67.7	132.3	173.3	177	-103	0	0	0	110.4	H264 H269 F270 V271	H264-D267 WeakPolarHBondContact O-CB 3.37Å; H264-D267 PolarHBondContact O-N 2.91Å; H264-D267 VanDerWaalsContact O-N 3.12Å; D267-H269 PolarHBondContact O-N 3.49Å; D267-H269 WeakPolarHBondContact OD1-CB 3.44Å; D267-H269 PolarHBondContact OD1-N 2.71Å; D267-H269 VanDerWaalsContact OD1-N 3.15Å; D267-F270 HydrophobicContact CB-CB 4Å; D267-F270 PolarHBondContact O-N 3.08Å; D267-F270 PolarHBondContact OD1-N 3Å; D267-V271 WeakPolarHBondContact O-CB 3.38Å; D267-V271 VanDerWaalsContact O-CG2 3.23Å; D267-V271 WeakPolarHBondContact O-CG2 3.38Å; D267-V271 PolarHBondContact O-N 2.89Å
268	E	93	Very high	93.4	Very high	133 Å²	133	72.8 Å²	72.8	62%	0.621	37%	0.37	S	S	*	.	H	α-helix	trans	-69.9	-36.4	-172.4	-63.2	-175.2	179.3	0	0	112.1	S272 K449	E268-S272 VanDerWaalsContact O-CB 3.28Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 3.47Å; E268-S272 PolarHBondContact O-OG 2.83Å; E268-K449 IonicContact OE1-NZ 3.09Å; E268-K449 PolarHBondContact OE1-NZ 3.28Å
269	H	94.2	Very high	93.8	Very high	134 Å²	134	66.5 Å²	66.5	62%	0.62	35%	0.346	S	S	*	.	H	α-helix	trans	-68.2	-46.5	178.5	-175.5	69.9	0	0	0	110.2	D267 S272 T273	D267-H269 PolarHBondContact O-N 3.49Å; D267-H269 WeakPolarHBondContact OD1-CB 3.44Å; D267-H269 PolarHBondContact OD1-N 2.71Å; D267-H269 VanDerWaalsContact OD1-N 3.15Å; H269-S272 PolarHBondContact O-N 3.14Å; H269-S272 PolarHBondContact O-OG 3.18Å; H269-T273 WeakPolarHBondContact O-CB 3.41Å; H269-T273 WeakPolarHBondContact O-CG2 3.45Å; H269-T273 PolarHBondContact O-N 3.45Å; H269-T273 VanDerWaalsContact O-N 3.08Å; H269-T273 PolarHBondContact O-OG1 2.93Å
270	F	94.7	Very high	94	Very high	20 Å²	20	62.3 Å²	62.3	9%	0.088	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-51.3	175.5	178.6	-107.5	0	0	0	112.2	H264 D267 S272 T273 T274 Q279 Y282	H264-F270 AromaticContact CD2-CD2 3.62Å; H264-F270 AromaticContact CD2-CG 3.71Å; H264-F270 AromaticContact NE2-CD2 3.19Å; H264-F270 WeakPolarHBondContact NE2-CD2 3.45Å; H264-F270 AromaticContact NE2-CE2 3.91Å; H264-F270 AromaticContact NE2-CG 3.48Å; H264-F270 WeakPolarHBondContact NE2-CG 3.29Å; H264-F270 VanDerWaalsContact O-CD1 3.31Å; H264-F270 WeakPolarHBondContact O-CD1 3.35Å; D267-F270 HydrophobicContact CB-CB 4Å; D267-F270 PolarHBondContact O-N 3.08Å; D267-F270 PolarHBondContact OD1-N 3Å; F270-S272 VanDerWaalsContact C-N 3.33Å; F270-S272 PolarHBondContact O-N 3.35Å; F270-T273 PolarHBondContact O-N 3.46Å; F270-T274 WeakPolarHBondContact CD2-OG1 3.44Å; F270-T274 HydrophobicContact CE2-CG2 3.83Å; F270-T274 WeakPolarHBondContact CE2-OG1 3.49Å; F270-T274 HydrophobicContact CZ-CG2 4.03Å; F270-T274 WeakPolarHBondContact O-CB 3.35Å; F270-T274 PolarHBondContact O-N 3.43Å; F270-T274 PolarHBondContact O-OG1 3.04Å; F270-Q279 HydrophobicContact CE1-CB 4.28Å; F270-Q279 HydrophobicContact CE1-CG 3.95Å; F270-Q279 HydrophobicContact CZ-CG 4.2Å; F270-Y282 HydrophobicContact CE1-CD1 4.11Å; F270-Y282 HydrophobicContact CE1-CG 4.32Å; F270-Y282 HydrophobicContact CE2-CG 4.37Å; F270-Y282 AromaticContact CZ-CD1 3.97Å; F270-Y282 HydrophobicContact CZ-CD1 3.97Å; F270-Y282 HydrophobicContact CZ-CD2 4.29Å; F270-Y282 AromaticContact CZ-CG 3.71Å; F270-Y282 HydrophobicContact CZ-CG 3.71Å
271	V	94.3	Very high	94.2	Very high	39 Å²	39	64 Å²	64	24%	0.236	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-36.8	-177.1	169.3	0	0	0	0	112.3	D267 Q279	D267-V271 WeakPolarHBondContact O-CB 3.38Å; D267-V271 VanDerWaalsContact O-CG2 3.23Å; D267-V271 WeakPolarHBondContact O-CG2 3.38Å; D267-V271 PolarHBondContact O-N 2.89Å; V271-Q279 PolarHBondContact O-NE2 3.04Å
272	S	93.7	Very high	94.4	Very high	94 Å²	94	63.5 Å²	63.5	66%	0.657	33%	0.33	S	S	*	.	H	α-helix	trans	-80	-29	-177.9	57.6	0	0	0	0	113.9	E268 H269 F270	E268-S272 VanDerWaalsContact O-CB 3.28Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 3.47Å; E268-S272 PolarHBondContact O-OG 2.83Å; H269-S272 PolarHBondContact O-N 3.14Å; H269-S272 PolarHBondContact O-OG 3.18Å; F270-S272 VanDerWaalsContact C-N 3.33Å; F270-S272 PolarHBondContact O-N 3.35Å
273	T	95.2	Very high	94.5	Very high	82 Å²	82	63.2 Å²	63.2	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-99.3	-23.8	-174.9	59.2	0	0	0	0	113.7	H269 F270	H269-T273 WeakPolarHBondContact O-CB 3.41Å; H269-T273 WeakPolarHBondContact O-CG2 3.45Å; H269-T273 PolarHBondContact O-N 3.45Å; H269-T273 VanDerWaalsContact O-N 3.08Å; H269-T273 PolarHBondContact O-OG1 2.93Å; F270-T273 PolarHBondContact O-N 3.46Å
274	T	95.4	Very high	94.8	Very high	29 Å²	29	61 Å²	61	18%	0.178	31%	0.313	C	S	.	.	S	Bend	trans	-95.1	128.1	-172.5	-57.4	0	0	0	0	111.2	F270 L278 Q279	F270-T274 WeakPolarHBondContact CD2-OG1 3.44Å; F270-T274 HydrophobicContact CE2-CG2 3.83Å; F270-T274 WeakPolarHBondContact CE2-OG1 3.49Å; F270-T274 HydrophobicContact CZ-CG2 4.03Å; F270-T274 WeakPolarHBondContact O-CB 3.35Å; F270-T274 PolarHBondContact O-N 3.43Å; F270-T274 PolarHBondContact O-OG1 3.04Å; T274-L278 HydrophobicContact CG2-CB 3.52Å; T274-L278 HydrophobicContact CG2-CD1 4.38Å; T274-Q279 HydrophobicContact CG2-CG 3.96Å; T274-Q279 PolarHBondContact O-NE2 3.43Å
275	P	95.7	Very high	94.9	Very high	59 Å²	59	61.3 Å²	61.3	38%	0.383	32%	0.316	S	S	.	.			trans	-54.8	143.3	172.8	-26.3	33.1	0	0	0	113.4	Y277 L278 Q279	P275-Y277 VanDerWaalsContact C-N 3.3Å; P275-Y277 HydrophobicContact CB-CD1 3.73Å; P275-Y277 HydrophobicContact CB-CE1 3.3Å; P275-Y277 HydrophobicContact CG-CE1 4.08Å; P275-Y277 PolarHBondContact O-N 3.25Å; P275-Y277 VanDerWaalsContact O-N 3.14Å; P275-L278 HydrophobicContact CG-CD1 4.45Å; P275-L278 WeakPolarHBondContact O-CB 3.38Å; P275-L278 PolarHBondContact O-N 2.94Å; P275-Q279 PolarHBondContact O-N 3.28Å; P275-Q279 VanDerWaalsContact O-N 3.14Å
276	F	93.9	Very high	95	Very high	92 Å²	92	61.1 Å²	61.1	40%	0.404	32%	0.315	S	S	.	.	H	α-helix	trans	-53.6	-40.5	-174.1	-176.6	-104.8	0	0	0	114.2	L278 Q279 V280 W454	F276-L278 VanDerWaalsContact C-N 3.3Å; F276-L278 PolarHBondContact O-N 3.45Å; F276-Q279 WeakPolarHBondContact O-CB 3.44Å; F276-Q279 PolarHBondContact O-N 3.46Å; F276-Q279 VanDerWaalsContact O-N 3.11Å; F276-V280 HydrophobicContact CD1-CG2 4.16Å; F276-V280 HydrophobicContact CE1-CG2 3.79Å; F276-V280 HydrophobicContact CZ-CG2 4.04Å; F276-V280 WeakPolarHBondContact O-CG2 3.34Å; F276-V280 PolarHBondContact O-N 3.37Å; F276-W454 AromaticContact CE2-CD2 3.88Å; F276-W454 HydrophobicContact CE2-CD2 3.88Å; F276-W454 AromaticContact CE2-CE3 3.93Å; F276-W454 HydrophobicContact CE2-CE3 3.93Å; F276-W454 HydrophobicContact CE2-CG 4.23Å; F276-W454 HydrophobicContact CE2-CZ3 4.43Å; F276-W454 HydrophobicContact CZ-CD2 4.15Å; F276-W454 AromaticContact CZ-CE3 3.69Å; F276-W454 HydrophobicContact CZ-CE3 3.69Å; F276-W454 AromaticContact CZ-CZ3 3.97Å; F276-W454 HydrophobicContact CZ-CZ3 3.97Å
277	Y	94.1	Very high	95.1	Very high	154 Å²	154	60.3 Å²	60.3	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-64.1	-33.7	178.6	68.4	-89.1	0	0	0	112.8	P275 V280 V281	P275-Y277 VanDerWaalsContact C-N 3.3Å; P275-Y277 HydrophobicContact CB-CD1 3.73Å; P275-Y277 HydrophobicContact CB-CE1 3.3Å; P275-Y277 HydrophobicContact CG-CE1 4.08Å; P275-Y277 PolarHBondContact O-N 3.25Å; P275-Y277 VanDerWaalsContact O-N 3.14Å; Y277-V280 PolarHBondContact O-N 2.82Å; Y277-V281 WeakPolarHBondContact O-CG2 3.38Å; Y277-V281 PolarHBondContact O-N 3.32Å; Y277-V281 VanDerWaalsContact O-N 3.08Å
278	L	95.7	Very high	95	Very high	76 Å²	76	60 Å²	60	40%	0.398	31%	0.309	S	S	.	.	H	α-helix	trans	-73	-32.8	173.7	-68.6	-176.5	0	0	0	111.5	T274 P275 F276 V280 V281 Y282	T274-L278 HydrophobicContact CG2-CB 3.52Å; T274-L278 HydrophobicContact CG2-CD1 4.38Å; P275-L278 HydrophobicContact CG-CD1 4.45Å; P275-L278 WeakPolarHBondContact O-CB 3.38Å; P275-L278 PolarHBondContact O-N 2.94Å; F276-L278 VanDerWaalsContact C-N 3.3Å; F276-L278 PolarHBondContact O-N 3.45Å; L278-V280 VanDerWaalsContact C-N 3.31Å; L278-V280 PolarHBondContact O-N 3.38Å; L278-V281 PolarHBondContact O-N 2.68Å; L278-Y282 WeakPolarHBondContact O-CB 3.35Å; L278-Y282 PolarHBondContact O-N 2.95Å
279	Q	95.7	Very high	95.1	Very high	12 Å²	12	53.7 Å²	53.7	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-39	171.3	-57.3	-175.3	25.1	0	0	111.5	F270 V271 T274 P275 F276 Y282 L283	F270-Q279 HydrophobicContact CE1-CB 4.28Å; F270-Q279 HydrophobicContact CE1-CG 3.95Å; F270-Q279 HydrophobicContact CZ-CG 4.2Å; V271-Q279 PolarHBondContact O-NE2 3.04Å; T274-Q279 HydrophobicContact CG2-CG 3.96Å; T274-Q279 PolarHBondContact O-NE2 3.43Å; P275-Q279 PolarHBondContact O-N 3.28Å; P275-Q279 VanDerWaalsContact O-N 3.14Å; F276-Q279 WeakPolarHBondContact O-CB 3.44Å; F276-Q279 PolarHBondContact O-N 3.46Å; F276-Q279 VanDerWaalsContact O-N 3.11Å; Q279-Y282 PolarHBondContact O-N 3.5Å; Q279-L283 WeakPolarHBondContact O-CB 3.14Å; Q279-L283 PolarHBondContact O-N 3Å
280	V	95.9	Very high	95	Very high	32 Å²	32	48.5 Å²	48.5	19%	0.194	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-46.6	174.5	177.1	0	0	0	0	111.2	F276 Y277 L278 L283 Y284 V430 W454	F276-V280 HydrophobicContact CD1-CG2 4.16Å; F276-V280 HydrophobicContact CE1-CG2 3.79Å; F276-V280 HydrophobicContact CZ-CG2 4.04Å; F276-V280 WeakPolarHBondContact O-CG2 3.34Å; F276-V280 PolarHBondContact O-N 3.37Å; Y277-V280 PolarHBondContact O-N 2.82Å; L278-V280 VanDerWaalsContact C-N 3.31Å; L278-V280 PolarHBondContact O-N 3.38Å; V280-L283 PolarHBondContact O-N 2.94Å; V280-Y284 PolarHBondContact O-N 3.16Å; V280-V430 HydrophobicContact CG1-CG1 4.16Å; V280-V430 HydrophobicContact CG1-CG2 3.8Å; V280-W454 HydrophobicContact CB-CH2 3.99Å; V280-W454 HydrophobicContact CG1-CH2 4.27Å; V280-W454 HydrophobicContact CG2-CH2 3.46Å; V280-W454 VanDerWaalsContact CG2-CH2 3.46Å; V280-W454 HydrophobicContact CG2-CZ2 4.18Å; V280-W454 HydrophobicContact CG2-CZ3 3.84Å
281	V	96.5	Very high	95	Very high	75 Å²	75	48.1 Å²	48.1	46%	0.455	25%	0.254	S	S	.	.	H	α-helix	trans	-62.5	-45.6	177.1	172	0	0	0	0	110.7	Y277 L278 L283 Y284 L285	Y277-V281 WeakPolarHBondContact O-CG2 3.38Å; Y277-V281 PolarHBondContact O-N 3.32Å; Y277-V281 VanDerWaalsContact O-N 3.08Å; L278-V281 PolarHBondContact O-N 2.68Å; V281-L283 PolarHBondContact O-N 2.94Å; V281-Y284 PolarHBondContact O-N 3.37Å; V281-L285 HydrophobicContact CG1-CD1 3.92Å; V281-L285 HydrophobicContact CG1-CG 4.33Å; V281-L285 WeakPolarHBondContact O-CG 3.46Å; V281-L285 PolarHBondContact O-N 3.03Å
282	Y	96.3	Very high	95.1	Very high	33 Å²	33	46.7 Å²	46.7	13%	0.129	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-48.8	176.4	-178.4	-92.5	0	0	0	111.4	L260 P261 H264 F270 L278 Q279 Y284 L285 A286	L260-Y282 HydrophobicContact CD2-CD2 4.31Å; L260-Y282 HydrophobicContact CD2-CE2 3.81Å; P261-Y282 WeakPolarHBondContact CD-OH 3.42Å; P261-Y282 PolarHBondContact O-OH 2.96Å; H264-Y282 HydrophobicContact CB-CE1 3.92Å; H264-Y282 WeakPolarHBondContact CB-OH 3.33Å; H264-Y282 AromaticContact CD2-CE1 3.98Å; H264-Y282 AromaticContact CD2-CE2 3.9Å; H264-Y282 AromaticContact CD2-CZ 3.58Å; F270-Y282 HydrophobicContact CE1-CD1 4.11Å; F270-Y282 HydrophobicContact CE1-CG 4.32Å; F270-Y282 HydrophobicContact CE2-CG 4.37Å; F270-Y282 AromaticContact CZ-CD1 3.97Å; F270-Y282 HydrophobicContact CZ-CD1 3.97Å; F270-Y282 HydrophobicContact CZ-CD2 4.29Å; F270-Y282 AromaticContact CZ-CG 3.71Å; F270-Y282 HydrophobicContact CZ-CG 3.71Å; L278-Y282 WeakPolarHBondContact O-CB 3.35Å; L278-Y282 PolarHBondContact O-N 2.95Å; Q279-Y282 PolarHBondContact O-N 3.5Å; Y282-Y284 VanDerWaalsContact C-N 3.31Å; Y282-Y284 PolarHBondContact O-N 2.79Å; Y282-L285 PolarHBondContact O-N 3.14Å; Y282-L285 VanDerWaalsContact O-N 3.17Å; Y282-A286 HydrophobicContact CD1-CB 4.45Å; Y282-A286 HydrophobicContact CE1-CB 4.05Å; Y282-A286 WeakPolarHBondContact O-CB 3.38Å; Y282-A286 PolarHBondContact O-N 3.4Å
283	L	96.1	Very high	95.1	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-45.2	178.9	176.4	63.6	0	0	0	111.4	Q279 V280 V281 A286 M287 C433 V437 F450 W454	Q279-L283 WeakPolarHBondContact O-CB 3.14Å; Q279-L283 PolarHBondContact O-N 3Å; V280-L283 PolarHBondContact O-N 2.94Å; V281-L283 PolarHBondContact O-N 2.94Å; L283-A286 PolarHBondContact O-N 3.48Å; L283-M287 HydrophobicContact CD1-CG 3.98Å; L283-M287 WeakPolarHBondContact O-CB 3.26Å; L283-M287 VanDerWaalsContact O-CG 3.27Å; L283-M287 WeakPolarHBondContact O-CG 3.25Å; L283-M287 PolarHBondContact O-N 2.91Å; L283-C433 HydrophobicContact CD2-CB 4.1Å; L283-C433 HydrophobicContact CG-CB 3.96Å; L283-V437 HydrophobicContact CD1-CG2 3.39Å; L283-V437 HydrophobicContact CD2-CG2 4.44Å; L283-F450 HydrophobicContact CD1-CE2 4.36Å; L283-F450 HydrophobicContact CD1-CZ 4.49Å; L283-F450 HydrophobicContact CD2-CE2 4.06Å; L283-F450 HydrophobicContact CD2-CZ 3.72Å; L283-W454 HydrophobicContact CB-CZ2 4.09Å; L283-W454 HydrophobicContact CD2-CH2 3.58Å; L283-W454 HydrophobicContact CD2-CZ2 3.44Å; L283-W454 VanDerWaalsContact CD2-CZ2 3.44Å; L283-W454 HydrophobicContact CD2-CZ3 4.48Å; L283-W454 HydrophobicContact CG-CZ2 4.39Å
284	Y	95.9	Very high	95	Very high	55 Å²	55	43.6 Å²	43.6	22%	0.216	21%	0.212	C	C	.	.	H	α-helix	trans	-60.1	-47.1	176.2	174	-107.9	0	0	0	111.7	V280 V281 Y282 M287 L288 Q429	V280-Y284 PolarHBondContact O-N 3.16Å; V281-Y284 PolarHBondContact O-N 3.37Å; Y282-Y284 VanDerWaalsContact C-N 3.31Å; Y282-Y284 PolarHBondContact O-N 2.79Å; Y284-M287 PolarHBondContact O-N 3.14Å; Y284-L288 HydrophobicContact CE1-CD2 4.22Å; Y284-L288 VanDerWaalsContact O-CB 3.22Å; Y284-L288 WeakPolarHBondContact O-CB 3.42Å; Y284-L288 PolarHBondContact O-N 2.92Å; Y284-Q429 HydrophobicContact CD2-CB 3.97Å; Y284-Q429 HydrophobicContact CE2-CB 3.71Å; Y284-Q429 HydrophobicContact CE2-CG 4Å
285	L	95.8	Very high	95.1	Very high	72 Å²	72	42.7 Å²	42.7	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-65.4	-41.7	179.6	-67.7	177	0	0	0	112.5	L260 V281 Y282 L288 A289	L260-L285 HydrophobicContact CD1-CB 4.03Å; V281-L285 HydrophobicContact CG1-CD1 3.92Å; V281-L285 HydrophobicContact CG1-CG 4.33Å; V281-L285 WeakPolarHBondContact O-CG 3.46Å; V281-L285 PolarHBondContact O-N 3.03Å; Y282-L285 PolarHBondContact O-N 3.14Å; Y282-L285 VanDerWaalsContact O-N 3.17Å; L285-L288 PolarHBondContact O-N 3.31Å; L285-A289 WeakPolarHBondContact O-CB 3.43Å; L285-A289 PolarHBondContact O-N 2.91Å
286	A	95.5	Very high	95.2	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-44.4	177	0	0	0	0	0	111.8	L260 V262 Y282 L283 A289 L290	L260-A286 HydrophobicContact CB-CB 4.26Å; L260-A286 WeakPolarHBondContact O-CB 3.16Å; V262-A286 HydrophobicContact CG2-CB 4.19Å; Y282-A286 HydrophobicContact CD1-CB 4.45Å; Y282-A286 HydrophobicContact CE1-CB 4.05Å; Y282-A286 WeakPolarHBondContact O-CB 3.38Å; Y282-A286 PolarHBondContact O-N 3.4Å; L283-A286 PolarHBondContact O-N 3.48Å; A286-A289 PolarHBondContact O-N 3.08Å; A286-L290 WeakPolarHBondContact O-CB 3.48Å; A286-L290 PolarHBondContact O-N 3.04Å
287	M	94.6	Very high	95.2	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.039	18%	0.182	C	C	.	.	H	α-helix	trans	-69.1	-35.8	176.1	-67.8	-55.8	-62.1	0	0	112.5	V262 L283 Y284 A289 L290 R291 C433 V436 V440	V262-M287 HydrophobicContact CG1-SD 4.18Å; V262-M287 HydrophobicContact CG2-SD 3.88Å; L283-M287 HydrophobicContact CD1-CG 3.98Å; L283-M287 WeakPolarHBondContact O-CB 3.26Å; L283-M287 VanDerWaalsContact O-CG 3.27Å; L283-M287 WeakPolarHBondContact O-CG 3.25Å; L283-M287 PolarHBondContact O-N 2.91Å; Y284-M287 PolarHBondContact O-N 3.14Å; M287-A289 VanDerWaalsContact C-N 3.34Å; M287-L290 HydrophobicContact CE-CD2 4.47Å; M287-L290 PolarHBondContact O-N 2.93Å; M287-L290 HydrophobicContact SD-CD2 4.45Å; M287-R291 WeakPolarHBondContact O-CG 3.44Å; M287-R291 PolarHBondContact O-N 3.38Å; M287-R291 VanDerWaalsContact O-N 3.08Å; M287-C433 HydrophobicContact CB-CB 4.23Å; M287-C433 VanDerWaalsContact CB-SG 3.56Å; M287-C433 HydrophobicContact CG-CB 3.86Å; M287-V436 HydrophobicContact CE-CB 3.83Å; M287-V436 HydrophobicContact CE-CG1 3.45Å; M287-V436 VanDerWaalsContact CE-CG1 3.45Å; M287-V440 HydrophobicContact CE-CG2 4.13Å; M287-V440 HydrophobicContact SD-CG2 4.34Å
288	L	93.9	Very high	95.4	Very high	57 Å²	57	32.5 Å²	32.5	30%	0.298	16%	0.16	S	C	.	.	H	α-helix	trans	-64.8	-37.1	172.1	-179.8	65.7	0	0	0	111.9	Y284 L285 L290 P292	Y284-L288 HydrophobicContact CE1-CD2 4.22Å; Y284-L288 VanDerWaalsContact O-CB 3.22Å; Y284-L288 WeakPolarHBondContact O-CB 3.42Å; Y284-L288 PolarHBondContact O-N 2.92Å; L285-L288 PolarHBondContact O-N 3.31Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-P292 WeakPolarHBondContact O-CD 3.31Å
289	A	94.1	Very high	95.5	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-70.1	-30.2	174.6	0	0	0	0	0	112.8	L256 L260 L285 A286 M287 P292	L256-A289 HydrophobicContact CB-CB 3.68Å; L260-A289 HydrophobicContact CB-CB 4.14Å; L260-A289 HydrophobicContact CD1-CB 4.06Å; L285-A289 WeakPolarHBondContact O-CB 3.43Å; L285-A289 PolarHBondContact O-N 2.91Å; A286-A289 PolarHBondContact O-N 3.08Å; M287-A289 VanDerWaalsContact C-N 3.34Å; A289-P292 WeakPolarHBondContact O-CD 3.48Å
290	L	93.1	Very high	95.6	Very high	24 Å²	24	29.1 Å²	29.1	13%	0.126	14%	0.143	C	C	.	.	H	α-helix	trans	-79.1	-39.3	-179.4	-174.1	65.6	0	0	0	113.6	Y253 V262 A286 M287 L288 P292 K293 V440	Y253-L290 HydrophobicContact CE2-CD1 4.34Å; V262-L290 HydrophobicContact CG2-CD2 3.98Å; A286-L290 WeakPolarHBondContact O-CB 3.48Å; A286-L290 PolarHBondContact O-N 3.04Å; M287-L290 HydrophobicContact CE-CD2 4.47Å; M287-L290 PolarHBondContact O-N 2.93Å; M287-L290 HydrophobicContact SD-CD2 4.45Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L290-P292 VanDerWaalsContact C-CD 3.42Å; L290-K293 HydrophobicContact CD1-CD 4.13Å; L290-K293 WeakPolarHBondContact O-CG 3.32Å; L290-V440 HydrophobicContact CD2-CB 4.32Å; L290-V440 HydrophobicContact CD2-CG1 3.78Å; L290-V440 HydrophobicContact CD2-CG2 3.49Å; L290-V440 VanDerWaalsContact CD2-CG2 3.49Å
291	R	93.9	Very high	95.6	Very high	12 Å²	12	27.6 Å²	27.6	5%	0.045	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.4	-174.7	-81	-178.1	-67.1	167.6	3.2	115.6	M287 K293 Y294 Y295 E335 W347	M287-R291 WeakPolarHBondContact O-CG 3.44Å; M287-R291 PolarHBondContact O-N 3.38Å; M287-R291 VanDerWaalsContact O-N 3.08Å; R291-K293 PolarHBondContact O-N 3.42Å; R291-Y294 WeakPolarHBondContact O-CB 3.25Å; R291-Y294 PolarHBondContact O-N 3.23Å; R291-Y295 HydrophobicContact CB-CE2 4.29Å; R291-Y295 PolarHBondContact O-N 2.93Å; R291-E335 IonicContact CZ-OE1 3.1Å; R291-E335 VanDerWaalsContact CZ-OE1 3.25Å; R291-E335 IonicContact CZ-OE2 3.11Å; R291-E335 IonicContact NE-OE1 3.21Å; R291-E335 IonicContact NH1-OE1 2.8Å; R291-E335 PolarHBondContact NH1-OE1 2.92Å; R291-E335 VanDerWaalsContact NH1-OE1 3.11Å; R291-E335 IonicContact NH1-OE2 3.83Å; R291-E335 PolarHBondContact NH1-OE2 3.25Å; R291-E335 IonicContact NH2-OE1 2.82Å; R291-E335 PolarHBondContact NH2-OE1 3.01Å; R291-E335 IonicContact NH2-OE2 3.25Å; R291-E335 PolarHBondContact NH2-OE2 2.84Å; R291-W347 HydrophobicContact CG-CH2 4.2Å; R291-W347 HydrophobicContact CG-CZ3 4.08Å
292	P	96	Very high	95.6	Very high	9 Å²	9	24.4 Å²	24.4	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-22.8	-174.7	-28.9	34.8	0	0	0	115.4	S249 T252 L288 A289 L290 Y294 Y295 F296	S249-P292 VanDerWaalsContact O-CB 3.27Å; S249-P292 WeakPolarHBondContact O-CB 3.28Å; T252-P292 HydrophobicContact CG2-CG 4.1Å; L288-P292 WeakPolarHBondContact O-CD 3.31Å; A289-P292 WeakPolarHBondContact O-CD 3.48Å; L290-P292 VanDerWaalsContact C-CD 3.42Å; P292-Y294 VanDerWaalsContact C-N 3.29Å; P292-Y294 PolarHBondContact O-N 3.34Å; P292-Y295 WeakPolarHBondContact O-CB 3.46Å; P292-Y295 PolarHBondContact O-N 2.81Å; P292-F296 PolarHBondContact O-N 3.24Å
293	K	93.1	Very high	95.7	Very high	44 Å²	44	22.8 Å²	22.8	19%	0.191	11%	0.108	C	C	.	.	H	α-helix	trans	-59.6	-38.7	171.9	76.2	-171.2	179.2	175.2	0	112.7	Y253 L290 R291 V297	Y253-K293 HydrophobicContact CD1-CB 4.11Å; Y253-K293 HydrophobicContact CD2-CB 3.78Å; Y253-K293 HydrophobicContact CE1-CB 4.1Å; Y253-K293 HydrophobicContact CE2-CB 3.77Å; Y253-K293 HydrophobicContact CE2-CD 3.75Å; Y253-K293 HydrophobicContact CE2-CG 4.21Å; Y253-K293 HydrophobicContact CG-CB 3.94Å; L290-K293 HydrophobicContact CD1-CD 4.13Å; L290-K293 WeakPolarHBondContact O-CG 3.32Å; R291-K293 PolarHBondContact O-N 3.42Å; K293-V297 WeakPolarHBondContact O-CG2 3.47Å; K293-V297 PolarHBondContact O-N 3.46Å; K293-V297 VanDerWaalsContact O-N 3.15Å
294	Y	94.4	Very high	95.8	Very high	68 Å²	68	22.7 Å²	22.7	27%	0.267	11%	0.107	S	C	.	.	H	α-helix	trans	-73.1	-37.1	176.4	-60.3	-79	0	0	0	110.9	R291 P292 F296 V297 W298 W347	R291-Y294 WeakPolarHBondContact O-CB 3.25Å; R291-Y294 PolarHBondContact O-N 3.23Å; P292-Y294 VanDerWaalsContact C-N 3.29Å; P292-Y294 PolarHBondContact O-N 3.34Å; Y294-F296 VanDerWaalsContact C-N 3.34Å; Y294-F296 PolarHBondContact O-N 3.03Å; Y294-V297 PolarHBondContact O-N 3.29Å; Y294-W298 HydrophobicContact CD1-CH2 4.3Å; Y294-W298 HydrophobicContact CD1-CZ2 4.33Å; Y294-W298 WeakPolarHBondContact O-CB 3.37Å; Y294-W298 PolarHBondContact O-N 3.45Å; Y294-W347 HydrophobicContact CD1-CZ2 4.44Å; Y294-W347 AromaticContact CD2-CH2 3.66Å; Y294-W347 HydrophobicContact CD2-CH2 3.66Å; Y294-W347 HydrophobicContact CD2-CZ2 4.04Å; Y294-W347 HydrophobicContact CE2-CH2 4.45Å; Y294-W347 AromaticContact CG-CH2 3.79Å; Y294-W347 HydrophobicContact CG-CH2 3.79Å; Y294-W347 AromaticContact CG-CZ2 3.96Å; Y294-W347 HydrophobicContact CG-CZ2 3.96Å
295	Y	97.3	Very high	95.9	Very high	9 Å²	9	20.2 Å²	20.2	4%	0.035	10%	0.098	C	C	.	.	H	α-helix	trans	-60.1	-45.3	174.9	-60.4	-15.6	0	0	0	111.6	R291 P292 T299 L329 I331 I334 E335 W347	R291-Y295 HydrophobicContact CB-CE2 4.29Å; R291-Y295 PolarHBondContact O-N 2.93Å; P292-Y295 WeakPolarHBondContact O-CB 3.46Å; P292-Y295 PolarHBondContact O-N 2.81Å; Y295-T299 WeakPolarHBondContact O-CB 3.43Å; Y295-T299 PolarHBondContact O-N 3.5Å; Y295-T299 PolarHBondContact O-OG1 3.2Å; Y295-L329 HydrophobicContact CD1-CD1 3.65Å; Y295-L329 HydrophobicContact CD1-CD2 4.03Å; Y295-L329 HydrophobicContact CD1-CG 4.46Å; Y295-L329 HydrophobicContact CE1-CD1 4.49Å; Y295-L329 HydrophobicContact CE1-CD2 4.07Å; Y295-L329 HydrophobicContact CG-CD1 4.42Å; Y295-I331 HydrophobicContact CD1-CD1 4.48Å; Y295-I331 HydrophobicContact CD1-CG1 4.13Å; Y295-I331 HydrophobicContact CD2-CD1 4.09Å; Y295-I331 HydrophobicContact CD2-CG1 4.19Å; Y295-I331 HydrophobicContact CD2-CG2 4.04Å; Y295-I331 HydrophobicContact CE1-CG1 4.41Å; Y295-I331 HydrophobicContact CE2-CG1 4.49Å; Y295-I331 HydrophobicContact CE2-CG2 3.8Å; Y295-I331 HydrophobicContact CG-CD1 3.92Å; Y295-I331 HydrophobicContact CG-CG1 4.02Å; Y295-I334 HydrophobicContact CE1-CD1 4.09Å; Y295-I334 WeakPolarHBondContact OH-CG2 3.44Å; Y295-E335 WeakPolarHBondContact CE2-OE1 3.28Å; Y295-E335 PolarHBondContact OH-OE1 3.12Å; Y295-W347 HydrophobicContact CD1-CZ3 4.38Å; Y295-W347 HydrophobicContact CE1-CE3 4.11Å; Y295-W347 AromaticContact CE1-CZ3 3.57Å; Y295-W347 HydrophobicContact CE1-CZ3 3.57Å
296	F	96.9	Very high	96	Very high	20 Å²	20	16.8 Å²	16.8	9%	0.088	8%	0.08	C	C	.	.	H	α-helix	trans	-58.6	-58.3	174.5	169.1	-112.5	0	0	0	111.9	V32 C246 L250 P292 Y294 W298 T299 L300	V32-F296 HydrophobicContact CG1-CZ 4.32Å; V32-F296 HydrophobicContact CG2-CE1 4.01Å; V32-F296 HydrophobicContact CG2-CZ 4.34Å; C246-F296 HydrophobicContact CB-CD2 3.75Å; C246-F296 HydrophobicContact CB-CE2 4.08Å; L250-F296 HydrophobicContact CB-CD2 3.85Å; L250-F296 HydrophobicContact CB-CE2 4.24Å; L250-F296 HydrophobicContact CB-CG 4.12Å; L250-F296 HydrophobicContact CD1-CD1 4.15Å; L250-F296 HydrophobicContact CD1-CE1 4.25Å; L250-F296 HydrophobicContact CD1-CG 4.35Å; L250-F296 HydrophobicContact CD2-CD2 4.43Å; L250-F296 HydrophobicContact CD2-CE2 3.99Å; L250-F296 HydrophobicContact CD2-CZ 4.05Å; P292-F296 PolarHBondContact O-N 3.24Å; Y294-F296 VanDerWaalsContact C-N 3.34Å; Y294-F296 PolarHBondContact O-N 3.03Å; F296-W298 PolarHBondContact O-N 2.96Å; F296-T299 PolarHBondContact O-N 3.2Å; F296-L300 HydrophobicContact CE2-CD2 4.03Å; F296-L300 HydrophobicContact CZ-CD2 3.82Å; F296-L300 VanDerWaalsContact O-CB 3.26Å; F296-L300 WeakPolarHBondContact O-CB 3.32Å; F296-L300 PolarHBondContact O-N 3.03Å
297	V	95.2	Very high	96.1	Very high	35 Å²	35	17 Å²	17	21%	0.212	8%	0.082	C	C	.	.	H	α-helix	trans	-62.4	-48	-172.5	171.7	0	0	0	0	112.1	F31 A194 K293 Y294 A301	F31-V297 HydrophobicContact CE1-CG1 3.81Å; F31-V297 HydrophobicContact CE1-CG2 3.96Å; F31-V297 HydrophobicContact CZ-CG1 3.69Å; A194-V297 HydrophobicContact CB-CG1 3.67Å; K293-V297 WeakPolarHBondContact O-CG2 3.47Å; K293-V297 PolarHBondContact O-N 3.46Å; K293-V297 VanDerWaalsContact O-N 3.15Å; Y294-V297 PolarHBondContact O-N 3.29Å; V297-A301 WeakPolarHBondContact O-CB 3.3Å; V297-A301 PolarHBondContact O-N 3.4Å; V297-A301 VanDerWaalsContact O-N 3.08Å
298	W	96.8	Very high	96.2	Very high	37 Å²	37	16.8 Å²	16.8	14%	0.14	8%	0.081	C	C	.	.	H	α-helix	trans	-75.2	-31.7	-177.3	-68.2	-24.2	0	0	0	113.1	Y294 F296 D302 N328 L329 W347 N348	Y294-W298 HydrophobicContact CD1-CH2 4.3Å; Y294-W298 HydrophobicContact CD1-CZ2 4.33Å; Y294-W298 WeakPolarHBondContact O-CB 3.37Å; Y294-W298 PolarHBondContact O-N 3.45Å; F296-W298 PolarHBondContact O-N 2.96Å; W298-D302 VanDerWaalsContact O-CB 3.31Å; W298-D302 WeakPolarHBondContact O-CB 3.48Å; W298-D302 PolarHBondContact O-N 3.31Å; W298-D302 VanDerWaalsContact O-N 3.08Å; W298-N328 HydrophobicContact CB-CB 4.18Å; W298-N328 HydrophobicContact CG-CB 4.35Å; W298-L329 HydrophobicContact CB-CD1 3.76Å; W298-L329 HydrophobicContact CB-CG 4.26Å; W298-L329 HydrophobicContact CE3-CD1 3.82Å; W298-L329 HydrophobicContact CE3-CD2 3.66Å; W298-L329 HydrophobicContact CE3-CG 3.68Å; W298-L329 HydrophobicContact CZ3-CD2 3.95Å; W298-L329 HydrophobicContact CZ3-CG 4.46Å; W298-W347 AromaticContact CH2-CE2 3.91Å; W298-W347 AromaticContact CH2-CZ2 3.98Å; W298-W347 HydrophobicContact CH2-CZ2 3.98Å; W298-W347 AromaticContact CH2-NE1 3.81Å; W298-W347 HydrophobicContact CZ3-CD2 4.19Å; W298-W347 AromaticContact CZ3-CE2 3.74Å; W298-W347 HydrophobicContact CZ3-CH2 4.45Å; W298-W347 AromaticContact CZ3-CZ2 3.88Å; W298-W347 HydrophobicContact CZ3-CZ2 3.88Å; W298-W347 AromaticContact CZ3-NE1 3.96Å; W298-N348 HydrophobicContact CH2-CB 3.57Å; W298-N348 HydrophobicContact CZ2-CB 4.22Å; W298-N348 HydrophobicContact CZ3-CB 3.74Å
299	T	97.7	Very high	96.3	Very high	13 Å²	13	14.2 Å²	14.2	8%	0.08	7%	0.068	C	C	.	.	H	α-helix	trans	-71.8	-36	174.8	-55	0	0	0	0	111.4	K242 T245 Y295 F296 D302 A303	K242-T299 HydrophobicContact CB-CG2 3.72Å; K242-T299 HydrophobicContact CG-CG2 3.94Å; T245-T299 HydrophobicContact CG2-CG2 4.1Å; Y295-T299 WeakPolarHBondContact O-CB 3.43Å; Y295-T299 PolarHBondContact O-N 3.5Å; Y295-T299 PolarHBondContact O-OG1 3.2Å; F296-T299 PolarHBondContact O-N 3.2Å; T299-D302 PolarHBondContact O-N 3.43Å; T299-A303 WeakPolarHBondContact O-CB 3.43Å; T299-A303 PolarHBondContact O-N 2.87Å
300	L	97.8	Very high	96.3	Very high	4 Å²	4	14.4 Å²	14.4	2%	0.021	7%	0.069	C	C	.	.	H	α-helix	trans	-65.7	-45.2	175.6	-178.5	57.5	0	0	0	111	Q35 L243 C246 F296 D302 A303 I304	Q35-L300 HydrophobicContact CB-CD2 3.57Å; Q35-L300 HydrophobicContact CB-CG 4.18Å; Q35-L300 HydrophobicContact CG-CD2 4.31Å; L243-L300 HydrophobicContact CD2-CD1 4.02Å; C246-L300 VanDerWaalsContact SG-CA 3.6Å; C246-L300 PolarHBondContact SG-N 2.8Å; F296-L300 HydrophobicContact CE2-CD2 4.03Å; F296-L300 HydrophobicContact CZ-CD2 3.82Å; F296-L300 VanDerWaalsContact O-CB 3.26Å; F296-L300 WeakPolarHBondContact O-CB 3.32Å; F296-L300 PolarHBondContact O-N 3.03Å; L300-D302 VanDerWaalsContact C-N 3.3Å; L300-D302 PolarHBondContact O-N 3.41Å; L300-A303 WeakPolarHBondContact O-CB 3.31Å; L300-A303 PolarHBondContact O-N 2.93Å; L300-A303 VanDerWaalsContact O-N 3.12Å; L300-I304 HydrophobicContact CG-CD1 4.24Å; L300-I304 WeakPolarHBondContact O-CG1 3.49Å; L300-I304 PolarHBondContact O-N 2.85Å
301	A	96.9	Very high	96.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.3	-41.3	176.5	0	0	0	0	0	112.1	A194 G195 V297 I304 N305	A194-A301 HydrophobicContact CB-CB 4.16Å; G195-A301 VanDerWaalsContact O-CB 3.28Å; G195-A301 WeakPolarHBondContact O-CB 3.48Å; V297-A301 WeakPolarHBondContact O-CB 3.3Å; V297-A301 PolarHBondContact O-N 3.4Å; V297-A301 VanDerWaalsContact O-N 3.08Å; A301-I304 PolarHBondContact O-N 3.41Å; A301-N305 PolarHBondContact O-N 2.84Å; A301-N305 PolarHBondContact O-ND2 3.43Å
302	D	97.2	Very high	96.3	Very high	7 Å²	7	13.3 Å²	13.3	4%	0.037	6%	0.063	C	C	.	.	H	α-helix	trans	-64.6	-40.5	173.5	-170.4	0.2	0	0	0	112.1	K242 W298 T299 L300 I304 N305 N306 S327	K242-D302 HydrophobicContact CD-CB 4.39Å; K242-D302 IonicContact NZ-OD1 2.82Å; K242-D302 PolarHBondContact NZ-OD1 3.37Å; K242-D302 IonicContact NZ-OD2 3.49Å; K242-D302 PolarHBondContact NZ-OD2 3.22Å; W298-D302 VanDerWaalsContact O-CB 3.31Å; W298-D302 WeakPolarHBondContact O-CB 3.48Å; W298-D302 PolarHBondContact O-N 3.31Å; W298-D302 VanDerWaalsContact O-N 3.08Å; T299-D302 PolarHBondContact O-N 3.43Å; L300-D302 VanDerWaalsContact C-N 3.3Å; L300-D302 PolarHBondContact O-N 3.41Å; D302-I304 VanDerWaalsContact C-N 3.32Å; D302-I304 PolarHBondContact O-N 2.68Å; D302-N305 PolarHBondContact O-N 3.43Å; D302-N306 PolarHBondContact O-N 3.22Å; D302-S327 WeakPolarHBondContact OD2-CA 3.29Å; D302-S327 WeakPolarHBondContact OD2-CB 3.33Å; D302-S327 PolarHBondContact OD2-OG 3.49Å
303	A	98.1	Very high	96.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.3	-37.3	174.1	0	0	0	0	0	113	K242 L243 T299 L300 N306 A307	K242-A303 HydrophobicContact CB-CB 3.83Å; K242-A303 HydrophobicContact CD-CB 4.35Å; L243-A303 HydrophobicContact CD2-CB 4.47Å; T299-A303 WeakPolarHBondContact O-CB 3.43Å; T299-A303 PolarHBondContact O-N 2.87Å; L300-A303 WeakPolarHBondContact O-CB 3.31Å; L300-A303 PolarHBondContact O-N 2.93Å; L300-A303 VanDerWaalsContact O-N 3.12Å; A303-N306 PolarHBondContact O-N 3.26Å; A303-A307 WeakPolarHBondContact O-CB 3.39Å; A303-A307 PolarHBondContact O-N 2.92Å
304	I	98.4	Very high	95.8	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.7	-47	177.1	-69.3	160.1	0	0	0	110.8	Q35 A38 L39 A42 M190 L300 A301 D302 N306 A307 A308	Q35-I304 HydrophobicContact CB-CD1 4.13Å; Q35-I304 VanDerWaalsContact O-CD1 3.26Å; Q35-I304 WeakPolarHBondContact O-CD1 3.49Å; A38-I304 HydrophobicContact CB-CD1 4.05Å; A38-I304 HydrophobicContact CB-CG2 4.06Å; L39-I304 HydrophobicContact CB-CG1 3.84Å; L39-I304 HydrophobicContact CD1-CG1 4.04Å; A42-I304 HydrophobicContact CB-CG2 4.06Å; A42-I304 WeakPolarHBondContact CB-O 3.09Å; M190-I304 HydrophobicContact CB-CG2 4.31Å; L300-I304 HydrophobicContact CG-CD1 4.24Å; L300-I304 WeakPolarHBondContact O-CG1 3.49Å; L300-I304 PolarHBondContact O-N 2.85Å; A301-I304 PolarHBondContact O-N 3.41Å; D302-I304 VanDerWaalsContact C-N 3.32Å; D302-I304 PolarHBondContact O-N 2.68Å; I304-N306 VanDerWaalsContact C-N 3.35Å; I304-N306 PolarHBondContact O-N 3.34Å; I304-A307 PolarHBondContact O-N 3.14Å; I304-A308 PolarHBondContact O-N 3.16Å; I304-A308 VanDerWaalsContact O-N 3.11Å
305	N	97.9	Very high	95.5	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.021	6%	0.064	C	C	.	.	H	α-helix	trans	-61.4	-45.5	176.8	-75.2	-92.5	0	0	0	111	M190 A301 D302 A307 A308 G309 F310 I326	M190-N305 WeakPolarHBondContact CB-OD1 3.49Å; M190-N305 PolarHBondContact O-ND2 3.37Å; A301-N305 PolarHBondContact O-N 2.84Å; A301-N305 PolarHBondContact O-ND2 3.43Å; D302-N305 PolarHBondContact O-N 3.43Å; N305-A307 VanDerWaalsContact C-N 3.34Å; N305-A307 PolarHBondContact O-N 3.29Å; N305-A308 WeakPolarHBondContact O-CB 3.49Å; N305-A308 PolarHBondContact O-N 3.03Å; N305-A308 VanDerWaalsContact O-N 3.12Å; N305-G309 PolarHBondContact O-N 3.46Å; N305-F310 CarbonylContact C-O 3.58Å; N305-F310 HydrophobicContact CB-CB 4.45Å; N305-F310 HydrophobicContact CB-CD1 4.27Å; N305-F310 PolarHBondContact O-N 2.65Å; N305-F310 VanDerWaalsContact O-O 3.06Å; N305-F310 WeakPolarHBondContact OD1-CD1 3.44Å; N305-I326 HydrophobicContact CB-CD1 3.6Å
306	N	97.5	Very high	94.8	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-40.2	176	-75.5	-2.6	0	0	0	113	P235 V239 K242 D302 A303 I304 A308 G309 F310 W323	P235-N306 WeakPolarHBondContact CB-O 3.36Å; P235-N306 WeakPolarHBondContact CG-O 3.37Å; V239-N306 HydrophobicContact CG2-CB 3.83Å; K242-N306 WeakPolarHBondContact CE-ND2 3.36Å; K242-N306 PolarHBondContact NZ-ND2 3.38Å; D302-N306 PolarHBondContact O-N 3.22Å; A303-N306 PolarHBondContact O-N 3.26Å; I304-N306 VanDerWaalsContact C-N 3.35Å; I304-N306 PolarHBondContact O-N 3.34Å; N306-A308 PolarHBondContact O-N 3.36Å; N306-G309 PolarHBondContact O-N 2.96Å; N306-F310 WeakPolarHBondContact CA-O 3.34Å; N306-F310 PolarHBondContact N-O 3.42Å; N306-F310 PolarHBondContact OD1-O 3.22Å; N306-W323 HydrophobicContact CB-CE3 4.26Å; N306-W323 VanDerWaalsContact ND2-CB 3.34Å; N306-W323 WeakPolarHBondContact ND2-CB 3.49Å; N306-W323 PolarHBondContact ND2-O 3.38Å; N306-W323 VanDerWaalsContact ND2-O 3.16Å
307	A	97.8	Very high	94.3	Very high	6 Å²	6	22.6 Å²	22.6	5%	0.05	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-32.8	176.5	0	0	0	0	0	112.1	L39 A42 V43 R46 V239 A303 I304 N305 G309	L39-A307 HydrophobicContact CD1-CB 3.72Å; A42-A307 HydrophobicContact CB-CB 3.89Å; V43-A307 HydrophobicContact CG2-CB 4.07Å; R46-A307 WeakPolarHBondContact CD-O 3.36Å; V239-A307 HydrophobicContact CG1-CB 4.49Å; V239-A307 HydrophobicContact CG2-CB 4.1Å; A303-A307 WeakPolarHBondContact O-CB 3.39Å; A303-A307 PolarHBondContact O-N 2.92Å; I304-A307 PolarHBondContact O-N 3.14Å; N305-A307 VanDerWaalsContact C-N 3.34Å; N305-A307 PolarHBondContact O-N 3.29Å; A307-G309 PolarHBondContact O-N 3.11Å
308	A	96.8	Very high	93.8	Very high	3 Å²	3	26 Å²	26	3%	0.025	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-10.3	173.7	0	0	0	0	0	113.5	A42 M190 F206 I304 N305 N306	A42-A308 HydrophobicContact CB-CB 3.87Å; A42-A308 WeakPolarHBondContact O-CA 3.45Å; M190-A308 HydrophobicContact CG-CB 4.22Å; M190-A308 HydrophobicContact SD-CB 3.51Å; M190-A308 VanDerWaalsContact SD-CB 3.51Å; F206-A308 WeakPolarHBondContact CE2-O 3.41Å; F206-A308 HydrophobicContact CZ-CB 4.15Å; I304-A308 PolarHBondContact O-N 3.16Å; I304-A308 VanDerWaalsContact O-N 3.11Å; N305-A308 WeakPolarHBondContact O-CB 3.49Å; N305-A308 PolarHBondContact O-N 3.03Å; N305-A308 VanDerWaalsContact O-N 3.12Å; N306-A308 PolarHBondContact O-N 3.36Å
309	G	94.6	Very high	93.2	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	15.6	-175	0	0	0	0	0	113.7	Y212 N305 N306 A307	Y212-G309 PolarHBondContact OH-O 3.31Å; Y212-G309 VanDerWaalsContact OH-O 3.12Å; N305-G309 PolarHBondContact O-N 3.46Å; N306-G309 PolarHBondContact O-N 2.96Å; A307-G309 PolarHBondContact O-N 3.11Å
310	F	95.7	Very high	92.6	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.022	16%	0.157	C	C	.	.			trans	-101.4	148	173.1	-172.9	-138.6	0	0	0	110.5	C198 D202 F206 N305 N306 I326	C198-F310 HydrophobicContact CB-CE1 3.94Å; C198-F310 HydrophobicContact CB-CZ 3.84Å; D202-F310 HydrophobicContact CB-CE2 4.17Å; D202-F310 HydrophobicContact CB-CZ 4.25Å; F206-F310 HydrophobicContact CB-CD2 3.52Å; F206-F310 HydrophobicContact CB-CE2 3.92Å; F206-F310 HydrophobicContact CB-CG 4.22Å; F206-F310 HydrophobicContact CD1-CB 4.22Å; F206-F310 HydrophobicContact CD1-CD2 4.4Å; F206-F310 HydrophobicContact CD1-CG 4.27Å; F206-F310 HydrophobicContact CD2-CB 3.65Å; F206-F310 HydrophobicContact CD2-CD2 4.04Å; F206-F310 HydrophobicContact CD2-CG 4.16Å; F206-F310 HydrophobicContact CE1-CB 4.32Å; F206-F310 HydrophobicContact CE2-CB 3.75Å; F206-F310 HydrophobicContact CG-CB 3.89Å; F206-F310 AromaticContact CG-CD2 3.72Å; F206-F310 HydrophobicContact CG-CD2 3.72Å; F206-F310 AromaticContact CG-CG 3.93Å; F206-F310 HydrophobicContact CG-CG 3.93Å; F206-F310 HydrophobicContact CZ-CB 4.08Å; N305-F310 CarbonylContact C-O 3.58Å; N305-F310 HydrophobicContact CB-CB 4.45Å; N305-F310 HydrophobicContact CB-CD1 4.27Å; N305-F310 PolarHBondContact O-N 2.65Å; N305-F310 VanDerWaalsContact O-O 3.06Å; N305-F310 WeakPolarHBondContact OD1-CD1 3.44Å; N306-F310 WeakPolarHBondContact CA-O 3.34Å; N306-F310 PolarHBondContact N-O 3.42Å; N306-F310 PolarHBondContact OD1-O 3.22Å; F310-I326 HydrophobicContact CD1-CD1 3.6Å; F310-I326 HydrophobicContact CE1-CD1 3.58Å; F310-I326 HydrophobicContact CE1-CG2 4.21Å; F310-I326 HydrophobicContact CG-CD1 4.45Å; F310-I326 HydrophobicContact CZ-CD1 4.43Å; F310-I326 HydrophobicContact CZ-CG2 4.15Å
311	G	93.9	Very high	92.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.01	17%	0.17	C	C	.	.			trans	107.5	3.8	177.7	0	0	0	0	0	116.2	W323 D324 L325	G311-W323 CarbonylContact O-C 3.57Å; G311-W323 VanDerWaalsContact O-C 3.29Å; G311-W323 WeakPolarHBondContact O-CA 3.38Å; G311-D324 PolarHBondContact O-N 2.8Å; G311-L325 VanDerWaalsContact O-CB 3.23Å; G311-L325 WeakPolarHBondContact O-CB 3.03Å; G311-L325 PolarHBondContact O-N 3.16Å; G311-L325 VanDerWaalsContact O-N 3.08Å
312	F	93.3	Very high	92	Very high	12 Å²	12	31.7 Å²	31.7	5%	0.053	18%	0.182	C	C	.	.			trans	-68	134.1	175.9	178	-107.4	0	0	0	112.5	Y212 R215 P233 G314 Y315 P321 R322 W323	Y212-F312 HydrophobicContact CD1-CB 4.15Å; Y212-F312 AromaticContact CD1-CD1 3.59Å; Y212-F312 HydrophobicContact CD1-CD1 3.59Å; Y212-F312 HydrophobicContact CD1-CE1 4.16Å; Y212-F312 AromaticContact CD1-CG 3.92Å; Y212-F312 HydrophobicContact CD1-CG 3.92Å; Y212-F312 HydrophobicContact CE1-CB 3.73Å; Y212-F312 HydrophobicContact CE1-CD1 4.04Å; Y212-F312 AromaticContact CE1-CG 3.86Å; Y212-F312 HydrophobicContact CE1-CG 3.86Å; R215-F312 HydrophobicContact CB-CD1 4.26Å; R215-F312 HydrophobicContact CB-CE1 4.18Å; P233-F312 HydrophobicContact CB-CD2 4.33Å; P233-F312 HydrophobicContact CB-CE2 4.1Å; P233-F312 HydrophobicContact CG-CD2 3.68Å; P233-F312 HydrophobicContact CG-CE2 3.65Å; P233-F312 HydrophobicContact CG-CG 4.15Å; P233-F312 HydrophobicContact CG-CZ 4.09Å; F312-G314 WeakPolarHBondContact CE2-O 3.44Å; F312-G314 VanDerWaalsContact CZ-C 3.49Å; F312-G314 WeakPolarHBondContact CZ-O 3.09Å; F312-Y315 HydrophobicContact CE2-CE1 4.42Å; F312-Y315 HydrophobicContact CE2-CE2 4.45Å; F312-Y315 HydrophobicContact CZ-CD2 4.03Å; F312-Y315 HydrophobicContact CZ-CE1 4.42Å; F312-Y315 AromaticContact CZ-CE2 3.69Å; F312-Y315 HydrophobicContact CZ-CE2 3.69Å; F312-Y315 AromaticContact CZ-CZ 3.9Å; F312-P321 HydrophobicContact CD2-CB 4.28Å; F312-P321 HydrophobicContact CE2-CB 3.77Å; F312-R322 WeakPolarHBondContact CA-O 3.33Å; F312-R322 VanDerWaalsContact CD2-O 3.32Å; F312-R322 WeakPolarHBondContact CD2-O 3.26Å; F312-W323 HydrophobicContact CB-CE3 4.16Å; F312-W323 HydrophobicContact CB-CH2 4.22Å; F312-W323 HydrophobicContact CB-CZ3 3.99Å; F312-W323 HydrophobicContact CD2-CZ2 4.45Å
313	N	90.6	Very high	91.9	Very high	41 Å²	41	32 Å²	32	22%	0.219	18%	0.182	C	C	.	.			trans	-132.2	36.7	-173.1	-164	24	0	0	0	113.2	R322 D324 L325	N313-R322 HydrophobicContact CB-CB 4.21Å; N313-R322 PolarHBondContact N-O 3.46Å; N313-R322 PolarHBondContact O-NE 3.02Å; N313-R322 PolarHBondContact O-NH2 3.26Å; N313-D324 VanDerWaalsContact CB-OD1 3.26Å; N313-D324 WeakPolarHBondContact CB-OD1 3.39Å; N313-D324 PolarHBondContact ND2-OD1 2.87Å; N313-L325 HydrophobicContact CB-CB 3.96Å
314	G	87.9	Confident	91.7	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.01	19%	0.192	C	C	.	.			trans	83.1	-160.2	-178	0	0	0	0	0	113.5	N219 F312 R322	N219-G314 VanDerWaalsContact ND2-CA 3.33Å; N219-G314 WeakPolarHBondContact ND2-CA 3.5Å; F312-G314 WeakPolarHBondContact CE2-O 3.44Å; F312-G314 VanDerWaalsContact CZ-C 3.49Å; F312-G314 WeakPolarHBondContact CZ-O 3.09Å; G314-R322 PolarHBondContact O-N 3.05Å
315	Y	86.6	Confident	91.5	Very high	76 Å²	76	35.3 Å²	35.3	30%	0.298	20%	0.2	S	C	.	.	B	Isolated β-bridge	trans	-114.9	151	-178.2	-63.8	-85.1	0	0	0	111	F312 G319 S320 P321 R322	F312-Y315 HydrophobicContact CE2-CE1 4.42Å; F312-Y315 HydrophobicContact CE2-CE2 4.45Å; F312-Y315 HydrophobicContact CZ-CD2 4.03Å; F312-Y315 HydrophobicContact CZ-CE1 4.42Å; F312-Y315 AromaticContact CZ-CE2 3.69Å; F312-Y315 HydrophobicContact CZ-CE2 3.69Å; F312-Y315 AromaticContact CZ-CZ 3.9Å; Y315-G319 VanDerWaalsContact CD1-O 3.3Å; Y315-G319 WeakPolarHBondContact CD1-O 3.42Å; Y315-S320 CarbonylContact C-O 3.2Å; Y315-S320 WeakPolarHBondContact CA-O 3.26Å; Y315-P321 HydrophobicContact CD1-CB 4.07Å; Y315-P321 HydrophobicContact CE1-CB 3.86Å; Y315-R322 PolarHBondContact O-NH1 3.08Å; Y315-R322 VanDerWaalsContact O-NH1 3.13Å
316	D	83.6	Confident	91.4	Very high	70 Å²	70	35.2 Å²	35.2	37%	0.374	20%	0.199	S	C	.	.			trans	-77.9	171.4	169	-81.8	-34.5	0	0	0	111.4	D318 G319 S320 R322	D316-D318 WeakPolarHBondContact CB-OD1 3.5Å; D316-D318 PolarHBondContact O-N 2.63Å; D316-G319 PolarHBondContact O-N 3.38Å; D316-S320 PolarHBondContact N-O 3.29Å; D316-R322 HydrophobicContact CB-CG 4.46Å; D316-R322 WeakPolarHBondContact OD1-CD 3.49Å; D316-R322 VanDerWaalsContact OD1-CG 3.27Å; D316-R322 WeakPolarHBondContact OD1-CG 3.42Å; D316-R322 IonicContact OD1-CZ 3.83Å; D316-R322 IonicContact OD1-NE 3.1Å; D316-R322 IonicContact OD1-NH1 3.97Å; D316-R322 PolarHBondContact OD1-NH1 2.92Å; D316-R322 VanDerWaalsContact OD2-CG 3.25Å; D316-R322 WeakPolarHBondContact OD2-CG 3.14Å
317	T	85.4	Confident	91.3	Very high	158 Å²	158	35.8 Å²	35.8	97%	0.969	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.4	179.1	49.9	0	0	0	0	113	G319	T317-G319 VanDerWaalsContact C-N 3.32Å
318	D	85.6	Confident	91.1	Very high	105 Å²	105	35.8 Å²	35.8	56%	0.561	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.1	174.2	72.3	-21.1	0	0	0	113.1	D316 S320	D316-D318 WeakPolarHBondContact CB-OD1 3.5Å; D316-D318 PolarHBondContact O-N 2.63Å; D318-S320 VanDerWaalsContact C-N 3.33Å; D318-S320 VanDerWaalsContact OD1-CB 3.23Å; D318-S320 WeakPolarHBondContact OD1-CB 3.34Å; D318-S320 PolarHBondContact OD1-N 3.24Å; D318-S320 PolarHBondContact OD1-OG 2.89Å; D318-S320 WeakPolarHBondContact OD2-CB 3.48Å; D318-S320 PolarHBondContact OD2-OG 3.21Å
319	G	83.1	Confident	91.1	Very high	48 Å²	48	36.6 Å²	36.6	50%	0.495	21%	0.206	S	C	.	.	S	Bend	trans	80.8	4.2	-175.6	0	0	0	0	0	114.8	Y315 D316 T317	Y315-G319 VanDerWaalsContact CD1-O 3.3Å; Y315-G319 WeakPolarHBondContact CD1-O 3.42Å; D316-G319 PolarHBondContact O-N 3.38Å; T317-G319 VanDerWaalsContact C-N 3.32Å
320	S	86.4	Confident	91.2	Very high	16 Å²	16	41.9 Å²	41.9	11%	0.112	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-70.5	138.2	174.3	-69.9	0	0	0	0	110.7	R237 Y315 D316 D318 R322	R237-S320 PolarHBondContact NH1-OG 3.44Å; Y315-S320 CarbonylContact C-O 3.2Å; Y315-S320 WeakPolarHBondContact CA-O 3.26Å; D316-S320 PolarHBondContact N-O 3.29Å; D318-S320 VanDerWaalsContact C-N 3.33Å; D318-S320 VanDerWaalsContact OD1-CB 3.23Å; D318-S320 WeakPolarHBondContact OD1-CB 3.34Å; D318-S320 PolarHBondContact OD1-N 3.24Å; D318-S320 PolarHBondContact OD1-OG 2.89Å; D318-S320 WeakPolarHBondContact OD2-CB 3.48Å; D318-S320 PolarHBondContact OD2-OG 3.21Å; S320-R322 PolarHBondContact O-N 2.92Å
321	P	89.9	Confident	91.2	Very high	45 Å²	45	43.7 Å²	43.7	29%	0.292	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-71.3	128.4	176.9	28.2	-33.7	0	0	0	111.2	P233 F312 Y315	P233-P321 HydrophobicContact CB-CB 3.69Å; P233-P321 HydrophobicContact CB-CG 4.22Å; F312-P321 HydrophobicContact CD2-CB 4.28Å; F312-P321 HydrophobicContact CE2-CB 3.77Å; Y315-P321 HydrophobicContact CD1-CB 4.07Å; Y315-P321 HydrophobicContact CE1-CB 3.86Å
322	R	92.1	Very high	91.3	Very high	66 Å²	66	49.7 Å²	49.7	25%	0.249	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-83.9	132.4	172.8	-75.6	-155.7	-62.4	-90.7	-6.5	111.3	F312 N313 G314 Y315 D316 S320 D324	F312-R322 WeakPolarHBondContact CA-O 3.33Å; F312-R322 VanDerWaalsContact CD2-O 3.32Å; F312-R322 WeakPolarHBondContact CD2-O 3.26Å; N313-R322 HydrophobicContact CB-CB 4.21Å; N313-R322 PolarHBondContact N-O 3.46Å; N313-R322 PolarHBondContact O-NE 3.02Å; N313-R322 PolarHBondContact O-NH2 3.26Å; G314-R322 PolarHBondContact O-N 3.05Å; Y315-R322 PolarHBondContact O-NH1 3.08Å; Y315-R322 VanDerWaalsContact O-NH1 3.13Å; D316-R322 HydrophobicContact CB-CG 4.46Å; D316-R322 WeakPolarHBondContact OD1-CD 3.49Å; D316-R322 VanDerWaalsContact OD1-CG 3.27Å; D316-R322 WeakPolarHBondContact OD1-CG 3.42Å; D316-R322 IonicContact OD1-CZ 3.83Å; D316-R322 IonicContact OD1-NE 3.1Å; D316-R322 IonicContact OD1-NH1 3.97Å; D316-R322 PolarHBondContact OD1-NH1 2.92Å; D316-R322 VanDerWaalsContact OD2-CG 3.25Å; D316-R322 WeakPolarHBondContact OD2-CG 3.14Å; S320-R322 PolarHBondContact O-N 2.92Å; R322-D324 IonicContact NE-OD1 3.65Å
323	W	94.7	Very high	91.5	Very high	12 Å²	12	52.4 Å²	52.4	5%	0.045	28%	0.282	C	S	.	.			trans	-124.8	51	179.2	-68.2	90.8	0	0	0	111.1	Y212 P233 S234 P235 A238 K242 N306 G311 F312	Y212-W323 HydrophobicContact CE1-CH2 4.2Å; Y212-W323 WeakPolarHBondContact OH-CH2 3.32Å; P233-W323 HydrophobicContact CB-CZ2 4.15Å; P233-W323 HydrophobicContact CG-CZ2 4.06Å; P233-W323 WeakPolarHBondContact O-CZ2 3.31Å; S234-W323 PolarHBondContact O-NE1 3.29Å; P235-W323 HydrophobicContact CB-CD2 4.06Å; P235-W323 HydrophobicContact CB-CE3 4.16Å; P235-W323 HydrophobicContact CB-CH2 3.76Å; P235-W323 HydrophobicContact CB-CZ2 3.63Å; P235-W323 HydrophobicContact CB-CZ3 4.02Å; P235-W323 HydrophobicContact CG-CH2 4.21Å; P235-W323 HydrophobicContact CG-CZ2 4.25Å; A238-W323 HydrophobicContact CB-CB 3.68Å; A238-W323 HydrophobicContact CB-CG 3.74Å; K242-W323 PolarHBondContact NZ-O 3.36Å; N306-W323 HydrophobicContact CB-CE3 4.26Å; N306-W323 VanDerWaalsContact ND2-CB 3.34Å; N306-W323 WeakPolarHBondContact ND2-CB 3.49Å; N306-W323 PolarHBondContact ND2-O 3.38Å; N306-W323 VanDerWaalsContact ND2-O 3.16Å; G311-W323 CarbonylContact O-C 3.57Å; G311-W323 VanDerWaalsContact O-C 3.29Å; G311-W323 WeakPolarHBondContact O-CA 3.38Å; F312-W323 HydrophobicContact CB-CE3 4.16Å; F312-W323 HydrophobicContact CB-CH2 4.22Å; F312-W323 HydrophobicContact CB-CZ3 3.99Å; F312-W323 HydrophobicContact CD2-CZ2 4.45Å
324	D	94.5	Very high	91.8	Very high	40 Å²	40	50.5 Å²	50.5	21%	0.214	27%	0.271	C	S	.	.			trans	-123.9	12.9	-174.2	76.1	-29.3	0	0	0	114.2	G311 N313 R322 I326 S327 R330	G311-D324 PolarHBondContact O-N 2.8Å; N313-D324 VanDerWaalsContact CB-OD1 3.26Å; N313-D324 WeakPolarHBondContact CB-OD1 3.39Å; N313-D324 PolarHBondContact ND2-OD1 2.87Å; R322-D324 IonicContact NE-OD1 3.65Å; D324-I326 VanDerWaalsContact C-N 3.26Å; D324-I326 PolarHBondContact O-N 2.85Å; D324-S327 WeakPolarHBondContact CA-OG 3.25Å; D324-S327 PolarHBondContact O-N 3.17Å; D324-R330 IonicContact OD2-NH2 3.61Å; D324-R330 PolarHBondContact OD2-NH2 3.42Å; D324-R330 VanDerWaalsContact OD2-NH2 3.12Å
325	L	94.2	Very high	92.2	Very high	30 Å²	30	51.7 Å²	51.7	16%	0.157	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-43.3	-175	176.8	63.8	0	0	0	112.4	D202 R215 G311 N313 Q350	D202-L325 HydrophobicContact CB-CD2 4.46Å; R215-L325 VanDerWaalsContact NH2-CD1 3.25Å; G311-L325 VanDerWaalsContact O-CB 3.23Å; G311-L325 WeakPolarHBondContact O-CB 3.03Å; G311-L325 PolarHBondContact O-N 3.16Å; G311-L325 VanDerWaalsContact O-N 3.08Å; N313-L325 HydrophobicContact CB-CB 3.96Å; L325-Q350 PolarHBondContact O-NE2 3.31Å
326	I	94.6	Very high	92.7	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.01	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	15.2	-175.9	65	179.2	0	0	0	111.7	P196 C198 N305 F310 D324 N328	P196-I326 HydrophobicContact CB-CB 4.39Å; P196-I326 WeakPolarHBondContact CB-O 3.38Å; P196-I326 HydrophobicContact CG-CB 3.99Å; P196-I326 HydrophobicContact CG-CD1 3.75Å; P196-I326 HydrophobicContact CG-CG1 3.72Å; P196-I326 WeakPolarHBondContact CG-O 3.36Å; C198-I326 HydrophobicContact CB-CG2 3.66Å; N305-I326 HydrophobicContact CB-CD1 3.6Å; F310-I326 HydrophobicContact CD1-CD1 3.6Å; F310-I326 HydrophobicContact CE1-CD1 3.58Å; F310-I326 HydrophobicContact CE1-CG2 4.21Å; F310-I326 HydrophobicContact CG-CD1 4.45Å; F310-I326 HydrophobicContact CZ-CD1 4.43Å; F310-I326 HydrophobicContact CZ-CG2 4.15Å; D324-I326 VanDerWaalsContact C-N 3.26Å; D324-I326 PolarHBondContact O-N 2.85Å; I326-N328 PolarHBondContact O-N 3.49Å
327	S	95.4	Very high	93.3	Very high	13 Å²	13	51.4 Å²	51.4	9%	0.091	27%	0.274	C	S	.	.			trans	-61	132.6	179.8	-73.7	0	0	0	0	110.9	D302 D324 Q350	D302-S327 WeakPolarHBondContact OD2-CA 3.29Å; D302-S327 WeakPolarHBondContact OD2-CB 3.33Å; D302-S327 PolarHBondContact OD2-OG 3.49Å; D324-S327 WeakPolarHBondContact CA-OG 3.25Å; D324-S327 PolarHBondContact O-N 3.17Å; S327-Q350 PolarHBondContact O-NE2 3.29Å
328	N	94.9	Very high	93.8	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	24%	0.236	C	C	.	.			trans	-92.2	-13.3	179.3	-103.4	-17.2	0	0	0	113.2	P196 W298 I326 N348 I349 Q350	P196-N328 HydrophobicContact CB-CB 4.48Å; W298-N328 HydrophobicContact CB-CB 4.18Å; W298-N328 HydrophobicContact CG-CB 4.35Å; I326-N328 PolarHBondContact O-N 3.49Å; N328-N348 CarbonylContact O-C 3.41Å; N328-N348 WeakPolarHBondContact O-CA 3.26Å; N328-N348 PolarHBondContact O-N 3.43Å; N328-N348 PolarHBondContact OD1-OD1 3.38Å; N328-I349 PolarHBondContact O-N 2.98Å; N328-Q350 WeakPolarHBondContact OD1-CB 3.29Å; N328-Q350 WeakPolarHBondContact OD1-CG 3.49Å; N328-Q350 PolarHBondContact OD1-N 3.42Å
329	L	95.5	Very high	94.2	Very high	19 Å²	19	40.6 Å²	40.6	10%	0.099	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-139.3	141.8	-172.6	-72.2	170.6	0	0	0	111.8	Y295 W298 I334 W347	Y295-L329 HydrophobicContact CD1-CD1 3.65Å; Y295-L329 HydrophobicContact CD1-CD2 4.03Å; Y295-L329 HydrophobicContact CD1-CG 4.46Å; Y295-L329 HydrophobicContact CE1-CD1 4.49Å; Y295-L329 HydrophobicContact CE1-CD2 4.07Å; Y295-L329 HydrophobicContact CG-CD1 4.42Å; W298-L329 HydrophobicContact CB-CD1 3.76Å; W298-L329 HydrophobicContact CB-CG 4.26Å; W298-L329 HydrophobicContact CE3-CD1 3.82Å; W298-L329 HydrophobicContact CE3-CD2 3.66Å; W298-L329 HydrophobicContact CE3-CG 3.68Å; W298-L329 HydrophobicContact CZ3-CD2 3.95Å; W298-L329 HydrophobicContact CZ3-CG 4.46Å; L329-I334 HydrophobicContact CD2-CD1 3.63Å; L329-W347 HydrophobicContact CD2-CE3 4.26Å
330	R	96.6	Very high	94.8	Very high	114 Å²	114	38.7 Å²	38.7	43%	0.43	19%	0.19	S	C	.	.			trans	-125.9	88.7	160.9	-67.8	-178.2	175.9	-165.7	-4.5	108.7	D324 L332 D333 I334 N346 I349	D324-R330 IonicContact OD2-NH2 3.61Å; D324-R330 PolarHBondContact OD2-NH2 3.42Å; D324-R330 VanDerWaalsContact OD2-NH2 3.12Å; R330-L332 VanDerWaalsContact C-N 3.34Å; R330-L332 PolarHBondContact O-N 2.89Å; R330-D333 HydrophobicContact CB-CB 3.97Å; R330-D333 WeakPolarHBondContact CB-OD2 3.32Å; R330-D333 VanDerWaalsContact CD-OD2 3.31Å; R330-D333 WeakPolarHBondContact CD-OD2 3.46Å; R330-D333 PolarHBondContact O-N 3.45Å; R330-D333 VanDerWaalsContact O-N 3.11Å; R330-I334 WeakPolarHBondContact O-CG1 3.35Å; R330-I334 PolarHBondContact O-N 2.94Å; R330-N346 HydrophobicContact CB-CB 4.19Å; R330-N346 WeakPolarHBondContact CD-OD1 3.3Å; R330-N346 PolarHBondContact N-O 3.3Å; R330-I349 HydrophobicContact CG-CD1 3.97Å
331	I	96.8	Very high	95.1	Very high	43 Å²	43	43.7 Å²	43.7	22%	0.221	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-45.4	-167.5	-61.6	173.2	0	0	0	111.8	T245 Y295 D333 I334 E335	T245-I331 HydrophobicContact CG2-CD1 3.5Å; T245-I331 VanDerWaalsContact CG2-CD1 3.5Å; Y295-I331 HydrophobicContact CD1-CD1 4.48Å; Y295-I331 HydrophobicContact CD1-CG1 4.13Å; Y295-I331 HydrophobicContact CD2-CD1 4.09Å; Y295-I331 HydrophobicContact CD2-CG1 4.19Å; Y295-I331 HydrophobicContact CD2-CG2 4.04Å; Y295-I331 HydrophobicContact CE1-CG1 4.41Å; Y295-I331 HydrophobicContact CE2-CG1 4.49Å; Y295-I331 HydrophobicContact CE2-CG2 3.8Å; Y295-I331 HydrophobicContact CG-CD1 3.92Å; Y295-I331 HydrophobicContact CG-CG1 4.02Å; I331-D333 PolarHBondContact O-N 3.35Å; I331-I334 WeakPolarHBondContact O-CB 3.4Å; I331-I334 PolarHBondContact O-N 3.46Å; I331-I334 VanDerWaalsContact O-N 3.16Å; I331-E335 HydrophobicContact CG2-CG 4.23Å; I331-E335 WeakPolarHBondContact O-CG 3.38Å; I331-E335 PolarHBondContact O-N 3.13Å
332	L	96.5	Very high	95.3	Very high	126 Å²	126	44.5 Å²	44.5	66%	0.66	21%	0.211	S	C	*	.	H	α-helix	trans	-63.9	-41.9	179.2	-61.7	179.1	0	0	0	111.9	R330 I334 E335 F336	R330-L332 VanDerWaalsContact C-N 3.34Å; R330-L332 PolarHBondContact O-N 2.89Å; L332-I334 PolarHBondContact O-N 3.31Å; L332-E335 PolarHBondContact O-N 3.38Å; L332-F336 HydrophobicContact CD2-CE2 4.2Å; L332-F336 WeakPolarHBondContact O-CB 3.28Å; L332-F336 VanDerWaalsContact O-CD2 3.32Å; L332-F336 WeakPolarHBondContact O-CD2 3.38Å; L332-F336 PolarHBondContact O-N 3.26Å
333	D	96.9	Very high	95.6	Very high	70 Å²	70	41.8 Å²	41.8	37%	0.374	20%	0.201	S	C	.	.	H	α-helix	trans	-66.7	-24.8	177.6	-63.8	-38.1	0	0	0	112.4	R330 I331 A337 N346	R330-D333 HydrophobicContact CB-CB 3.97Å; R330-D333 WeakPolarHBondContact CB-OD2 3.32Å; R330-D333 VanDerWaalsContact CD-OD2 3.31Å; R330-D333 WeakPolarHBondContact CD-OD2 3.46Å; R330-D333 PolarHBondContact O-N 3.45Å; R330-D333 VanDerWaalsContact O-N 3.11Å; I331-D333 PolarHBondContact O-N 3.35Å; D333-A337 WeakPolarHBondContact O-CA 3.27Å; D333-A337 WeakPolarHBondContact O-CB 3.45Å; D333-A337 PolarHBondContact O-N 2.9Å; D333-N346 HydrophobicContact CB-CB 4.03Å; D333-N346 VanDerWaalsContact CB-CG 3.46Å
334	I	97.1	Very high	95.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-75.6	-54	173.2	-66.6	161.4	0	0	0	110.6	Y295 L329 R330 I331 L332 F336 A337 F343 N346 W347 Q429	Y295-I334 HydrophobicContact CE1-CD1 4.09Å; Y295-I334 WeakPolarHBondContact OH-CG2 3.44Å; L329-I334 HydrophobicContact CD2-CD1 3.63Å; R330-I334 WeakPolarHBondContact O-CG1 3.35Å; R330-I334 PolarHBondContact O-N 2.94Å; I331-I334 WeakPolarHBondContact O-CB 3.4Å; I331-I334 PolarHBondContact O-N 3.46Å; I331-I334 VanDerWaalsContact O-N 3.16Å; L332-I334 PolarHBondContact O-N 3.31Å; I334-F336 VanDerWaalsContact C-N 3.28Å; I334-F336 PolarHBondContact O-N 3.44Å; I334-A337 WeakPolarHBondContact O-CB 3.25Å; I334-A337 PolarHBondContact O-N 3.39Å; I334-F343 HydrophobicContact CG2-CD2 3.79Å; I334-F343 HydrophobicContact CG2-CE1 4.12Å; I334-F343 HydrophobicContact CG2-CE2 3.3Å; I334-F343 HydrophobicContact CG2-CG 4.39Å; I334-F343 HydrophobicContact CG2-CZ 3.47Å; I334-F343 VanDerWaalsContact CG2-CZ 3.47Å; I334-F343 WeakPolarHBondContact O-CD2 3.5Å; I334-N346 WeakPolarHBondContact CD1-O 3.23Å; I334-N346 HydrophobicContact CG1-CB 3.79Å; I334-W347 HydrophobicContact CD1-CB 4.45Å; I334-W347 HydrophobicContact CD1-CE3 4.11Å; I334-W347 HydrophobicContact CG2-CE3 4.5Å; I334-Q429 PolarHBondContact O-NE2 2.99Å; I334-Q429 VanDerWaalsContact O-NE2 3.14Å
335	E	96	Very high	95.6	Very high	27 Å²	27	45.4 Å²	45.4	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-28.3	-174.6	-62.9	-52.4	152.5	0	0	112.5	R291 Y295 I331 L332 W425 Q429	R291-E335 IonicContact CZ-OE1 3.1Å; R291-E335 VanDerWaalsContact CZ-OE1 3.25Å; R291-E335 IonicContact CZ-OE2 3.11Å; R291-E335 IonicContact NE-OE1 3.21Å; R291-E335 IonicContact NH1-OE1 2.8Å; R291-E335 PolarHBondContact NH1-OE1 2.92Å; R291-E335 VanDerWaalsContact NH1-OE1 3.11Å; R291-E335 IonicContact NH1-OE2 3.83Å; R291-E335 PolarHBondContact NH1-OE2 3.25Å; R291-E335 IonicContact NH2-OE1 2.82Å; R291-E335 PolarHBondContact NH2-OE1 3.01Å; R291-E335 IonicContact NH2-OE2 3.25Å; R291-E335 PolarHBondContact NH2-OE2 2.84Å; Y295-E335 WeakPolarHBondContact CE2-OE1 3.28Å; Y295-E335 PolarHBondContact OH-OE1 3.12Å; I331-E335 HydrophobicContact CG2-CG 4.23Å; I331-E335 WeakPolarHBondContact O-CG 3.38Å; I331-E335 PolarHBondContact O-N 3.13Å; L332-E335 PolarHBondContact O-N 3.38Å; E335-W425 PolarHBondContact O-NE1 3.23Å; E335-Q429 PolarHBondContact O-NE2 3.4Å
336	F	96.5	Very high	95.8	Very high	139 Å²	139	44.6 Å²	44.6	61%	0.61	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	16.6	177.1	-62.7	-73.3	0	0	0	113.6	L332 I334 T338	L332-F336 HydrophobicContact CD2-CE2 4.2Å; L332-F336 WeakPolarHBondContact O-CB 3.28Å; L332-F336 VanDerWaalsContact O-CD2 3.32Å; L332-F336 WeakPolarHBondContact O-CD2 3.38Å; L332-F336 PolarHBondContact O-N 3.26Å; I334-F336 VanDerWaalsContact C-N 3.28Å; I334-F336 PolarHBondContact O-N 3.44Å; F336-T338 PolarHBondContact O-N 3.45Å
337	A	96.8	Very high	95.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.			trans	-61.1	121.8	-179.4	0	0	0	0	0	112.6	D333 I334 S339 L342 F343 T428	D333-A337 WeakPolarHBondContact O-CA 3.27Å; D333-A337 WeakPolarHBondContact O-CB 3.45Å; D333-A337 PolarHBondContact O-N 2.9Å; I334-A337 WeakPolarHBondContact O-CB 3.25Å; I334-A337 PolarHBondContact O-N 3.39Å; A337-S339 VanDerWaalsContact C-N 3.33Å; A337-L342 HydrophobicContact CB-CB 4.4Å; A337-L342 HydrophobicContact CB-CD2 4.45Å; A337-L342 HydrophobicContact CB-CG 4.32Å; A337-F343 HydrophobicContact CB-CB 3.82Å; A337-F343 HydrophobicContact CB-CD2 4.19Å; A337-F343 HydrophobicContact CB-CG 4.49Å; A337-T428 HydrophobicContact CB-CG2 4.27Å; A337-T428 WeakPolarHBondContact O-CB 3.03Å; A337-T428 WeakPolarHBondContact O-CG2 3.42Å
338	T	95.6	Very high	95.9	Very high	28 Å²	28	47.3 Å²	47.3	17%	0.172	23%	0.226	C	C	.	.	S	Bend	trans	-90.4	8.5	174.7	63.8	0	0	0	0	113.7	F336 R403 D421 T424 W425	F336-T338 PolarHBondContact O-N 3.45Å; T338-R403 VanDerWaalsContact C-NH2 3.31Å; T338-R403 PolarHBondContact O-NH2 2.64Å; T338-R403 VanDerWaalsContact O-NH2 3.16Å; T338-R403 PolarHBondContact OG1-NH2 3.24Å; T338-D421 HydrophobicContact CG2-CB 4.13Å; T338-T424 WeakPolarHBondContact O-CB 3.26Å; T338-T424 PolarHBondContact O-OG1 3.12Å; T338-W425 HydrophobicContact CG2-CB 4.32Å
339	S	95	Very high	96.1	Very high	8 Å²	8	48 Å²	48	6%	0.056	23%	0.23	C	C	.	.	S	Bend	trans	-158.4	155.3	167.1	57.9	0	0	0	0	112.6	A337 K341 L342 F343 R403 T428	A337-S339 VanDerWaalsContact C-N 3.33Å; S339-K341 VanDerWaalsContact C-N 3.27Å; S339-K341 PolarHBondContact O-N 3.44Å; S339-L342 WeakPolarHBondContact O-CB 3.38Å; S339-L342 PolarHBondContact O-N 3.1Å; S339-L342 WeakPolarHBondContact OG-CB 3.28Å; S339-L342 PolarHBondContact OG-N 2.97Å; S339-F343 PolarHBondContact O-N 3.5Å; S339-R403 VanDerWaalsContact OG-CZ 3.29Å; S339-R403 PolarHBondContact OG-NE 2.8Å; S339-R403 VanDerWaalsContact OG-NE 3.11Å; S339-R403 PolarHBondContact OG-NH2 3.21Å; S339-T428 WeakPolarHBondContact CA-OG1 3.25Å; S339-T428 PolarHBondContact N-OG1 3.39Å
340	F	94.6	Very high	96.1	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.035	23%	0.227	C	C	.	.	H	α-helix	trans	-46.9	-46.7	170.4	-154.5	-97.2	0	0	0	113.4	F343 L344 M395 T396 A399 A431 I432 T435	F340-F343 PolarHBondContact O-N 2.91Å; F340-L344 HydrophobicContact CD1-CD1 3.75Å; F340-L344 HydrophobicContact CD1-CG 4.24Å; F340-L344 HydrophobicContact CE1-CD1 3.61Å; F340-L344 HydrophobicContact CE1-CG 4.2Å; F340-L344 WeakPolarHBondContact O-CG 3.16Å; F340-L344 PolarHBondContact O-N 2.88Å; F340-M395 HydrophobicContact CD1-CB 4.3Å; F340-M395 HydrophobicContact CD2-CB 4Å; F340-M395 HydrophobicContact CE1-CB 4.05Å; F340-M395 HydrophobicContact CE2-CB 3.74Å; F340-M395 HydrophobicContact CE2-CG 4.24Å; F340-M395 HydrophobicContact CG-CB 4.27Å; F340-M395 HydrophobicContact CZ-CB 3.79Å; F340-M395 HydrophobicContact CZ-CG 4.43Å; F340-T396 WeakPolarHBondContact CD1-OG1 3.32Å; F340-T396 WeakPolarHBondContact CE1-OG1 3.42Å; F340-A399 HydrophobicContact CB-CB 3.9Å; F340-A431 HydrophobicContact CD2-CB 4.46Å; F340-I432 HydrophobicContact CD2-CD1 3.52Å; F340-I432 HydrophobicContact CD2-CG1 3.85Å; F340-I432 HydrophobicContact CE2-CD1 3.3Å; F340-I432 HydrophobicContact CE2-CG1 3.88Å; F340-I432 HydrophobicContact CG-CD1 4.24Å; F340-I432 HydrophobicContact CZ-CD1 3.85Å; F340-T435 HydrophobicContact CZ-CG2 4.16Å
341	K	92.6	Very high	96.1	Very high	121 Å²	121	42.6 Å²	42.6	53%	0.526	21%	0.209	S	C	.	.	H	α-helix	trans	-62.7	-45.4	177.5	175.6	167.1	173	49.6	0	112.8	S339 F343 L344 D345	S339-K341 VanDerWaalsContact C-N 3.27Å; S339-K341 PolarHBondContact O-N 3.44Å; K341-F343 VanDerWaalsContact C-N 3.28Å; K341-F343 PolarHBondContact O-N 3.38Å; K341-L344 PolarHBondContact O-N 3.27Å; K341-D345 VanDerWaalsContact CE-OD2 3.22Å; K341-D345 WeakPolarHBondContact CE-OD2 3.34Å; K341-D345 WeakPolarHBondContact CG-OD2 3.3Å; K341-D345 IonicContact NZ-OD1 3.7Å; K341-D345 PolarHBondContact NZ-OD1 3.2Å; K341-D345 IonicContact NZ-OD2 3Å; K341-D345 PolarHBondContact NZ-OD2 3.22Å; K341-D345 WeakPolarHBondContact O-CB 3.36Å; K341-D345 PolarHBondContact O-N 3.39Å
342	L	94.9	Very high	96.1	Very high	62 Å²	62	42.1 Å²	42.1	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-38.5	179.8	-178.4	62.5	0	0	0	111.2	A337 S339 N346	A337-L342 HydrophobicContact CB-CB 4.4Å; A337-L342 HydrophobicContact CB-CD2 4.45Å; A337-L342 HydrophobicContact CB-CG 4.32Å; S339-L342 WeakPolarHBondContact O-CB 3.38Å; S339-L342 PolarHBondContact O-N 3.1Å; S339-L342 WeakPolarHBondContact OG-CB 3.28Å; S339-L342 PolarHBondContact OG-N 2.97Å; L342-N346 WeakPolarHBondContact CD1-ND2 3.38Å; L342-N346 PolarHBondContact O-N 3.46Å; L342-N346 PolarHBondContact O-ND2 3.17Å
343	F	97.1	Very high	96.1	Very high	9 Å²	9	39.8 Å²	39.8	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-53.1	173.2	-170.8	-72.9	0	0	0	111	I334 A337 S339 F340 K341 D345 N346 W347 I432	I334-F343 HydrophobicContact CG2-CD2 3.79Å; I334-F343 HydrophobicContact CG2-CE1 4.12Å; I334-F343 HydrophobicContact CG2-CE2 3.3Å; I334-F343 HydrophobicContact CG2-CG 4.39Å; I334-F343 HydrophobicContact CG2-CZ 3.47Å; I334-F343 VanDerWaalsContact CG2-CZ 3.47Å; I334-F343 WeakPolarHBondContact O-CD2 3.5Å; A337-F343 HydrophobicContact CB-CB 3.82Å; A337-F343 HydrophobicContact CB-CD2 4.19Å; A337-F343 HydrophobicContact CB-CG 4.49Å; S339-F343 PolarHBondContact O-N 3.5Å; F340-F343 PolarHBondContact O-N 2.91Å; K341-F343 VanDerWaalsContact C-N 3.28Å; K341-F343 PolarHBondContact O-N 3.38Å; F343-D345 VanDerWaalsContact C-N 3.33Å; F343-D345 PolarHBondContact O-N 2.95Å; F343-N346 PolarHBondContact O-N 2.75Å; F343-N346 VanDerWaalsContact O-N 3.15Å; F343-W347 HydrophobicContact CD1-CB 4.28Å; F343-W347 HydrophobicContact CE1-CB 4.13Å; F343-W347 HydrophobicContact CE1-CD2 4.33Å; F343-W347 HydrophobicContact CE1-CE3 4.21Å; F343-W347 HydrophobicContact CE1-CG 4.31Å; F343-W347 HydrophobicContact CZ-CE3 4.39Å; F343-W347 WeakPolarHBondContact O-CB 3.46Å; F343-W347 PolarHBondContact O-N 3.38Å; F343-W347 VanDerWaalsContact O-N 3.08Å; F343-I432 HydrophobicContact CB-CD1 4.07Å; F343-I432 HydrophobicContact CB-CG1 4.27Å; F343-I432 HydrophobicContact CD1-CD1 3.59Å; F343-I432 HydrophobicContact CD1-CG1 4.15Å; F343-I432 HydrophobicContact CD1-CG2 4.38Å; F343-I432 HydrophobicContact CD2-CD1 4.29Å; F343-I432 HydrophobicContact CD2-CG1 3.94Å; F343-I432 HydrophobicContact CD2-CG2 4.37Å; F343-I432 HydrophobicContact CE1-CD1 4.08Å; F343-I432 HydrophobicContact CE1-CG2 3.91Å; F343-I432 HydrophobicContact CE2-CB 4.43Å; F343-I432 HydrophobicContact CE2-CG1 4.27Å; F343-I432 HydrophobicContact CE2-CG2 3.85Å; F343-I432 HydrophobicContact CG-CD1 3.73Å; F343-I432 HydrophobicContact CG-CG1 3.87Å; F343-I432 HydrophobicContact CZ-CG2 3.62Å
344	L	95.3	Very high	96.1	Very high	55 Å²	55	36.6 Å²	36.6	29%	0.288	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-36.1	-178	-67.5	-178.7	0	0	0	113.3	F340 K341 N346 W347 F372	F340-L344 HydrophobicContact CD1-CD1 3.75Å; F340-L344 HydrophobicContact CD1-CG 4.24Å; F340-L344 HydrophobicContact CE1-CD1 3.61Å; F340-L344 HydrophobicContact CE1-CG 4.2Å; F340-L344 WeakPolarHBondContact O-CG 3.16Å; F340-L344 PolarHBondContact O-N 2.88Å; K341-L344 PolarHBondContact O-N 3.27Å; L344-N346 PolarHBondContact O-N 3.11Å; L344-W347 PolarHBondContact O-N 2.98Å; L344-F372 HydrophobicContact CD1-CE1 4.38Å; L344-F372 HydrophobicContact CD1-CZ 3.76Å
345	D	95.4	Very high	96.1	Very high	73 Å²	73	37.2 Å²	37.2	39%	0.39	18%	0.184	S	C	.	.	H	α-helix	trans	-67.8	-18.8	179.4	-71.8	-18	0	0	0	112.5	K341 F343	K341-D345 VanDerWaalsContact CE-OD2 3.22Å; K341-D345 WeakPolarHBondContact CE-OD2 3.34Å; K341-D345 WeakPolarHBondContact CG-OD2 3.3Å; K341-D345 IonicContact NZ-OD1 3.7Å; K341-D345 PolarHBondContact NZ-OD1 3.2Å; K341-D345 IonicContact NZ-OD2 3Å; K341-D345 PolarHBondContact NZ-OD2 3.22Å; K341-D345 WeakPolarHBondContact O-CB 3.36Å; K341-D345 PolarHBondContact O-N 3.39Å; F343-D345 VanDerWaalsContact C-N 3.33Å; F343-D345 PolarHBondContact O-N 2.95Å
346	N	97.5	Very high	96.1	Very high	14 Å²	14	41.2 Å²	41.2	8%	0.075	20%	0.201	C	C	.	.	H	α-helix	trans	-109	-9	-178.9	-70.2	-67.8	0	0	0	113.9	R330 D333 I334 L342 F343 L344	R330-N346 HydrophobicContact CB-CB 4.19Å; R330-N346 WeakPolarHBondContact CD-OD1 3.3Å; R330-N346 PolarHBondContact N-O 3.3Å; D333-N346 HydrophobicContact CB-CB 4.03Å; D333-N346 VanDerWaalsContact CB-CG 3.46Å; I334-N346 WeakPolarHBondContact CD1-O 3.23Å; I334-N346 HydrophobicContact CG1-CB 3.79Å; L342-N346 WeakPolarHBondContact CD1-ND2 3.38Å; L342-N346 PolarHBondContact O-N 3.46Å; L342-N346 PolarHBondContact O-ND2 3.17Å; F343-N346 PolarHBondContact O-N 2.75Å; F343-N346 VanDerWaalsContact O-N 3.15Å; L344-N346 PolarHBondContact O-N 3.11Å
347	W	96.9	Very high	95.9	Very high	58 Å²	58	36.6 Å²	36.6	22%	0.22	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-98.6	121	176.2	177.8	-85.1	0	0	0	110.9	R291 Y294 Y295 W298 L329 I334 F343 L344 I349	R291-W347 HydrophobicContact CG-CH2 4.2Å; R291-W347 HydrophobicContact CG-CZ3 4.08Å; Y294-W347 HydrophobicContact CD1-CZ2 4.44Å; Y294-W347 AromaticContact CD2-CH2 3.66Å; Y294-W347 HydrophobicContact CD2-CH2 3.66Å; Y294-W347 HydrophobicContact CD2-CZ2 4.04Å; Y294-W347 HydrophobicContact CE2-CH2 4.45Å; Y294-W347 AromaticContact CG-CH2 3.79Å; Y294-W347 HydrophobicContact CG-CH2 3.79Å; Y294-W347 AromaticContact CG-CZ2 3.96Å; Y294-W347 HydrophobicContact CG-CZ2 3.96Å; Y295-W347 HydrophobicContact CD1-CZ3 4.38Å; Y295-W347 HydrophobicContact CE1-CE3 4.11Å; Y295-W347 AromaticContact CE1-CZ3 3.57Å; Y295-W347 HydrophobicContact CE1-CZ3 3.57Å; W298-W347 AromaticContact CH2-CE2 3.91Å; W298-W347 AromaticContact CH2-CZ2 3.98Å; W298-W347 HydrophobicContact CH2-CZ2 3.98Å; W298-W347 AromaticContact CH2-NE1 3.81Å; W298-W347 HydrophobicContact CZ3-CD2 4.19Å; W298-W347 AromaticContact CZ3-CE2 3.74Å; W298-W347 HydrophobicContact CZ3-CH2 4.45Å; W298-W347 AromaticContact CZ3-CZ2 3.88Å; W298-W347 HydrophobicContact CZ3-CZ2 3.88Å; W298-W347 AromaticContact CZ3-NE1 3.96Å; L329-W347 HydrophobicContact CD2-CE3 4.26Å; I334-W347 HydrophobicContact CD1-CB 4.45Å; I334-W347 HydrophobicContact CD1-CE3 4.11Å; I334-W347 HydrophobicContact CG2-CE3 4.5Å; F343-W347 HydrophobicContact CD1-CB 4.28Å; F343-W347 HydrophobicContact CE1-CB 4.13Å; F343-W347 HydrophobicContact CE1-CD2 4.33Å; F343-W347 HydrophobicContact CE1-CE3 4.21Å; F343-W347 HydrophobicContact CE1-CG 4.31Å; F343-W347 HydrophobicContact CZ-CE3 4.39Å; F343-W347 WeakPolarHBondContact O-CB 3.46Å; F343-W347 PolarHBondContact O-N 3.38Å; F343-W347 VanDerWaalsContact O-N 3.08Å; L344-W347 PolarHBondContact O-N 2.98Å; W347-I349 PolarHBondContact O-N 2.92Å
348	N	96.3	Very high	95.8	Very high	14 Å²	14	36.9 Å²	36.9	8%	0.075	18%	0.181	C	C	.	.	S	Bend	trans	51.8	54.1	-178.8	-161.3	-8.8	0	0	0	112.1	W298 N328 Q350 T351 A352	W298-N348 HydrophobicContact CH2-CB 3.57Å; W298-N348 HydrophobicContact CZ2-CB 4.22Å; W298-N348 HydrophobicContact CZ3-CB 3.74Å; N328-N348 CarbonylContact O-C 3.41Å; N328-N348 WeakPolarHBondContact O-CA 3.26Å; N328-N348 PolarHBondContact O-N 3.43Å; N328-N348 PolarHBondContact OD1-OD1 3.38Å; N348-Q350 VanDerWaalsContact C-N 3.3Å; N348-Q350 PolarHBondContact O-N 3.03Å; N348-T351 PolarHBondContact ND2-OG1 3.13Å; N348-T351 VanDerWaalsContact ND2-OG1 3.08Å; N348-T351 WeakPolarHBondContact O-CB 3.31Å; N348-T351 PolarHBondContact O-N 3.21Å; N348-T351 WeakPolarHBondContact OD1-CB 3.35Å; N348-T351 PolarHBondContact OD1-OG1 3.17Å; N348-A352 PolarHBondContact O-N 2.81Å
349	I	97.5	Very high	95.9	Very high	20 Å²	20	36.4 Å²	36.4	10%	0.103	18%	0.179	C	C	.	.	H	α-helix	trans	-52.5	-45.3	-168.3	-62.5	171.4	0	0	0	112	N328 R330 W347 T351 A352 Q353	N328-I349 PolarHBondContact O-N 2.98Å; R330-I349 HydrophobicContact CG-CD1 3.97Å; W347-I349 PolarHBondContact O-N 2.92Å; I349-T351 VanDerWaalsContact C-N 3.32Å; I349-T351 PolarHBondContact O-N 3.43Å; I349-A352 WeakPolarHBondContact O-CB 3.33Å; I349-A352 PolarHBondContact O-N 2.89Å; I349-Q353 HydrophobicContact CG2-CG 4.48Å; I349-Q353 WeakPolarHBondContact O-CG 3.41Å; I349-Q353 PolarHBondContact O-N 3.06Å
350	Q	96.4	Very high	95.8	Very high	9 Å²	9	40 Å²	40	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-69.6	-33.3	-176.1	-54.6	-63.9	-36	0	0	111.7	P196 T197 L325 S327 N328 N348 Q353 W354	P196-Q350 HydrophobicContact CB-CG 4.21Å; T197-Q350 WeakPolarHBondContact O-CG 3.29Å; T197-Q350 WeakPolarHBondContact OG1-CB 3.44Å; L325-Q350 PolarHBondContact O-NE2 3.31Å; S327-Q350 PolarHBondContact O-NE2 3.29Å; N328-Q350 WeakPolarHBondContact OD1-CB 3.29Å; N328-Q350 WeakPolarHBondContact OD1-CG 3.49Å; N328-Q350 PolarHBondContact OD1-N 3.42Å; N348-Q350 VanDerWaalsContact C-N 3.3Å; N348-Q350 PolarHBondContact O-N 3.03Å; Q350-Q353 PolarHBondContact O-N 2.67Å; Q350-W354 PolarHBondContact O-N 3.34Å
351	T	97.1	Very high	95.6	Very high	10 Å²	10	43 Å²	43	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-44	170.7	-64.1	0	0	0	0	111.6	Q142 N348 I349 Q353 W354 L355 W378	Q142-T351 VanDerWaalsContact NE2-CB 3.3Å; Q142-T351 PolarHBondContact NE2-OG1 3Å; N348-T351 PolarHBondContact ND2-OG1 3.13Å; N348-T351 VanDerWaalsContact ND2-OG1 3.08Å; N348-T351 WeakPolarHBondContact O-CB 3.31Å; N348-T351 PolarHBondContact O-N 3.21Å; N348-T351 WeakPolarHBondContact OD1-CB 3.35Å; N348-T351 PolarHBondContact OD1-OG1 3.17Å; I349-T351 VanDerWaalsContact C-N 3.32Å; I349-T351 PolarHBondContact O-N 3.43Å; T351-Q353 VanDerWaalsContact C-N 3.28Å; T351-Q353 PolarHBondContact O-N 3.21Å; T351-W354 HydrophobicContact CG2-CE3 4.17Å; T351-W354 WeakPolarHBondContact O-CB 3.42Å; T351-W354 PolarHBondContact O-N 3.43Å; T351-L355 HydrophobicContact CG2-CD1 4.21Å; T351-L355 HydrophobicContact CG2-CG 4.48Å; T351-L355 WeakPolarHBondContact O-CG 3.37Å; T351-L355 PolarHBondContact O-N 3.22Å; T351-W378 HydrophobicContact CG2-CE3 4.36Å; T351-W378 HydrophobicContact CG2-CH2 3.87Å; T351-W378 HydrophobicContact CG2-CZ2 4.47Å; T351-W378 HydrophobicContact CG2-CZ3 3.81Å
352	A	96.6	Very high	95.5	Very high	34 Å²	34	40.7 Å²	40.7	28%	0.281	19%	0.194	S	C	.	.	H	α-helix	trans	-61.3	-39.8	176.8	0	0	0	0	0	111.5	N348 I349 K356	N348-A352 PolarHBondContact O-N 2.81Å; I349-A352 WeakPolarHBondContact O-CB 3.33Å; I349-A352 PolarHBondContact O-N 2.89Å; A352-K356 WeakPolarHBondContact O-CB 3.46Å; A352-K356 PolarHBondContact O-N 3.46Å
353	Q	95.8	Very high	95.3	Very high	77 Å²	77	39 Å²	39	36%	0.36	19%	0.187	S	C	.	.	H	α-helix	trans	-67.4	-39.4	174.5	-67.8	-178.8	9.6	0	0	112.8	I349 Q350 T351 K356 R357	I349-Q353 HydrophobicContact CG2-CG 4.48Å; I349-Q353 WeakPolarHBondContact O-CG 3.41Å; I349-Q353 PolarHBondContact O-N 3.06Å; Q350-Q353 PolarHBondContact O-N 2.67Å; T351-Q353 VanDerWaalsContact C-N 3.28Å; T351-Q353 PolarHBondContact O-N 3.21Å; Q353-K356 PolarHBondContact O-N 3.01Å; Q353-R357 WeakPolarHBondContact O-CB 3.37Å; Q353-R357 VanDerWaalsContact O-CG 3.23Å; Q353-R357 WeakPolarHBondContact O-CG 3.27Å; Q353-R357 PolarHBondContact O-N 2.84Å; Q353-R357 PolarHBondContact O-NE 3.25Å
354	W	97.1	Very high	94.9	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-54.6	173	161.3	69.1	0	0	0	110.8	Q142 T145 S146 Q350 T351 K356 R357 V358 L374 W378	Q142-W354 HydrophobicContact CB-CD2 4.13Å; Q142-W354 HydrophobicContact CB-CG 4.03Å; Q142-W354 HydrophobicContact CG-CD2 3.58Å; Q142-W354 HydrophobicContact CG-CE3 3.7Å; Q142-W354 HydrophobicContact CG-CG 3.97Å; Q142-W354 HydrophobicContact CG-CH2 4.36Å; Q142-W354 HydrophobicContact CG-CZ2 4.26Å; Q142-W354 HydrophobicContact CG-CZ3 4.09Å; Q142-W354 VanDerWaalsContact NE2-CE3 3.28Å; T145-W354 PolarHBondContact OG1-NE1 2.81Å; S146-W354 VanDerWaalsContact OG-CD1 3.3Å; Q350-W354 PolarHBondContact O-N 3.34Å; T351-W354 HydrophobicContact CG2-CE3 4.17Å; T351-W354 WeakPolarHBondContact O-CB 3.42Å; T351-W354 PolarHBondContact O-N 3.43Å; W354-K356 PolarHBondContact O-N 3.2Å; W354-R357 PolarHBondContact O-N 3.32Å; W354-V358 HydrophobicContact CD2-CG2 4.32Å; W354-V358 HydrophobicContact CG-CG2 4.4Å; W354-V358 HydrophobicContact CZ2-CG2 4.28Å; W354-V358 WeakPolarHBondContact O-CG2 3.3Å; W354-V358 PolarHBondContact O-N 3.31Å; W354-L374 HydrophobicContact CH2-CD2 4.43Å; W354-L374 HydrophobicContact CH2-CG 4.32Å; W354-W378 HydrophobicContact CH2-CB 3.95Å; W354-W378 AromaticContact CH2-CD1 3.56Å; W354-W378 HydrophobicContact CH2-CD2 4.3Å; W354-W378 AromaticContact CH2-CG 3.66Å; W354-W378 HydrophobicContact CH2-CG 3.66Å; W354-W378 HydrophobicContact CZ3-CB 4.25Å; W354-W378 AromaticContact CZ3-CD1 3.95Å; W354-W378 AromaticContact CZ3-CD2 3.95Å; W354-W378 HydrophobicContact CZ3-CD2 3.95Å; W354-W378 AromaticContact CZ3-CG 3.78Å; W354-W378 HydrophobicContact CZ3-CG 3.78Å
355	L	97.4	Very high	94.6	Very high	14 Å²	14	46 Å²	46	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-53.5	-41.7	177.5	-74.7	172.9	0	0	0	111.7	T351 C359 Y360 T371 L374	T351-L355 HydrophobicContact CG2-CD1 4.21Å; T351-L355 HydrophobicContact CG2-CG 4.48Å; T351-L355 WeakPolarHBondContact O-CG 3.37Å; T351-L355 PolarHBondContact O-N 3.22Å; L355-C359 WeakPolarHBondContact O-CA 3.21Å; L355-C359 VanDerWaalsContact O-CB 3.27Å; L355-C359 WeakPolarHBondContact O-CB 3.42Å; L355-C359 PolarHBondContact O-N 2.99Å; L355-Y360 PolarHBondContact O-N 3.41Å; L355-T371 HydrophobicContact CB-CG2 3.8Å; L355-T371 HydrophobicContact CD1-CG2 4.36Å; L355-T371 HydrophobicContact CG-CG2 4.47Å; L355-L374 HydrophobicContact CD2-CB 4.24Å; L355-L374 HydrophobicContact CD2-CD2 3.84Å; L355-L374 HydrophobicContact CD2-CG 3.82Å
356	K	94.9	Very high	94.2	Very high	110 Å²	110	47.8 Å²	47.8	48%	0.478	24%	0.244	S	C	.	.	I	π-helix	trans	-60.3	-50.3	175.8	-179.6	179.2	166.5	-171.8	0	111.8	A352 Q353 W354 Y360 E361	A352-K356 WeakPolarHBondContact O-CB 3.46Å; A352-K356 PolarHBondContact O-N 3.46Å; Q353-K356 PolarHBondContact O-N 3.01Å; W354-K356 PolarHBondContact O-N 3.2Å; K356-Y360 PolarHBondContact O-N 3.02Å; K356-E361 WeakPolarHBondContact CE-OE1 3.46Å; K356-E361 HydrophobicContact CG-CG 4.05Å; K356-E361 IonicContact NZ-OE1 3.48Å; K356-E361 WeakPolarHBondContact O-CG 3.47Å; K356-E361 PolarHBondContact O-N 2.89Å
357	R	93.4	Very high	94	Very high	42 Å²	42	47.9 Å²	47.9	16%	0.158	25%	0.245	C	C	.	.	I	π-helix	trans	-71	-40.3	-173.3	-73.4	-179.8	-102.9	170.5	-11.5	113.8	E150 L171 Q353 W354 R362	E150-R357 IonicContact OE1-NH1 2.76Å; E150-R357 PolarHBondContact OE1-NH1 3.41Å; L171-R357 VanDerWaalsContact CD1-CD 3.47Å; Q353-R357 WeakPolarHBondContact O-CB 3.37Å; Q353-R357 VanDerWaalsContact O-CG 3.23Å; Q353-R357 WeakPolarHBondContact O-CG 3.27Å; Q353-R357 PolarHBondContact O-N 2.84Å; Q353-R357 PolarHBondContact O-NE 3.25Å; W354-R357 PolarHBondContact O-N 3.32Å; R357-R362 WeakPolarHBondContact O-CG 3.49Å; R357-R362 PolarHBondContact O-NE 2.89Å; R357-R362 VanDerWaalsContact O-NE 3.09Å
358	V	95.3	Very high	93.8	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.042	24%	0.242	C	C	.	.	I	π-helix	trans	-93.2	-20.1	-175.1	-51.2	0	0	0	0	113.3	F106 F149 W354 R362 L374	F106-V358 HydrophobicContact CE2-CG2 4.04Å; F149-V358 HydrophobicContact CD2-CB 3.81Å; F149-V358 HydrophobicContact CD2-CG1 3.66Å; F149-V358 HydrophobicContact CE2-CB 3.71Å; F149-V358 HydrophobicContact CE2-CG1 4.08Å; F149-V358 HydrophobicContact CG-CG1 4.35Å; F149-V358 HydrophobicContact CZ-CB 4.36Å; W354-V358 HydrophobicContact CD2-CG2 4.32Å; W354-V358 HydrophobicContact CG-CG2 4.4Å; W354-V358 HydrophobicContact CZ2-CG2 4.28Å; W354-V358 WeakPolarHBondContact O-CG2 3.3Å; W354-V358 PolarHBondContact O-N 3.31Å; V358-R362 WeakPolarHBondContact O-CG 3.49Å; V358-L374 HydrophobicContact CG2-CD2 4.08Å
359	C	95.9	Very high	93.7	Very high	18 Å²	18	47.9 Å²	47.9	12%	0.122	25%	0.252	C	S	.	.	I	π-helix	trans	-126.8	-63.8	-175.7	-172.4	0	0	0	0	112.8	L355 E361 R362 C363 A370 L374	L355-C359 WeakPolarHBondContact O-CA 3.21Å; L355-C359 VanDerWaalsContact O-CB 3.27Å; L355-C359 WeakPolarHBondContact O-CB 3.42Å; L355-C359 PolarHBondContact O-N 2.99Å; C359-E361 PolarHBondContact O-N 2.93Å; C359-R362 CarbonylContact O-C 3.54Å; C359-R362 PolarHBondContact O-N 3.27Å; C359-C363 WeakPolarHBondContact O-CB 3.48Å; C359-C363 PolarHBondContact O-N 3.23Å; C359-A370 VanDerWaalsContact SG-C 3.58Å; C359-L374 HydrophobicContact CB-CD2 3.54Å
360	Y	94.4	Very high	93.7	Very high	84 Å²	84	48.2 Å²	48.2	33%	0.329	26%	0.258	S	S	.	.	I	π-helix	trans	-56.8	-48.7	-170.7	-173	-90.2	0	0	0	113.1	L355 K356 R362 P367 T371	L355-Y360 PolarHBondContact O-N 3.41Å; K356-Y360 PolarHBondContact O-N 3.02Å; Y360-R362 VanDerWaalsContact C-N 3.3Å; Y360-P367 HydrophobicContact CD1-CB 4.49Å; Y360-P367 HydrophobicContact CD2-CB 3.69Å; Y360-P367 HydrophobicContact CD2-CG 4.34Å; Y360-P367 HydrophobicContact CE2-CB 3.79Å; Y360-P367 HydrophobicContact CE2-CG 3.92Å; Y360-P367 HydrophobicContact CG-CB 4.05Å; Y360-P367 VanDerWaalsContact O-CB 3.26Å; Y360-P367 WeakPolarHBondContact O-CB 3.39Å; Y360-T371 WeakPolarHBondContact CB-OG1 3.34Å
361	E	90.8	Very high	93.7	Very high	69 Å²	69	48.7 Å²	48.7	32%	0.322	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-23.8	-179.3	-68.7	179.1	157.3	0	0	112.5	K356 C359	K356-E361 WeakPolarHBondContact CE-OE1 3.46Å; K356-E361 HydrophobicContact CG-CG 4.05Å; K356-E361 IonicContact NZ-OE1 3.48Å; K356-E361 WeakPolarHBondContact O-CG 3.47Å; K356-E361 PolarHBondContact O-N 2.89Å; C359-E361 PolarHBondContact O-N 2.93Å
362	R	89.4	Confident	93.7	Very high	73 Å²	73	49.5 Å²	49.5	28%	0.275	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-19.1	-179.8	-52.7	-62.8	179.8	136.3	0.4	113.1	F149 D153 R357 V358 C359 Y360 P364	F149-R362 HydrophobicContact CE1-CG 4.14Å; D153-R362 VanDerWaalsContact CG-NH2 3.31Å; D153-R362 IonicContact OD1-CZ 3.24Å; D153-R362 IonicContact OD1-NH1 3.49Å; D153-R362 PolarHBondContact OD1-NH1 3.08Å; D153-R362 IonicContact OD1-NH2 3.69Å; D153-R362 PolarHBondContact OD1-NH2 3.31Å; D153-R362 IonicContact OD2-CZ 2.75Å; D153-R362 IonicContact OD2-NH1 3.66Å; D153-R362 IonicContact OD2-NH2 2.8Å; D153-R362 PolarHBondContact OD2-NH2 2.93Å; R357-R362 WeakPolarHBondContact O-CG 3.49Å; R357-R362 PolarHBondContact O-NE 2.89Å; R357-R362 VanDerWaalsContact O-NE 3.09Å; V358-R362 WeakPolarHBondContact O-CG 3.49Å; C359-R362 CarbonylContact O-C 3.54Å; C359-R362 PolarHBondContact O-N 3.27Å; Y360-R362 VanDerWaalsContact C-N 3.3Å; R362-P364 WeakPolarHBondContact O-CD 3.39Å
363	C	91.9	Very high	93.7	Very high	26 Å²	26	51 Å²	51	18%	0.176	27%	0.268	C	S	.	.			trans	-89.5	117.8	-171.4	-169.9	0	0	0	0	112.1	C359 V365 P367 A370 R475	C359-C363 WeakPolarHBondContact O-CB 3.48Å; C359-C363 PolarHBondContact O-N 3.23Å; C363-V365 PolarHBondContact SG-O 3.43Å; C363-P367 HydrophobicContact CB-CB 4.14Å; C363-A370 HydrophobicContact CB-CB 4.3Å; C363-R475 PolarHBondContact O-NH1 3.36Å; C363-R475 PolarHBondContact O-NH2 3.06Å
364	P	86.8	Confident	93.8	Very high	107 Å²	107	47.6 Å²	47.6	70%	0.695	25%	0.252	S	S	*	.	S	Bend	trans	-76.4	-28.6	-179.8	28.9	-33.4	0	0	0	113	R362 R475	R362-P364 WeakPolarHBondContact O-CD 3.39Å; P364-R475 VanDerWaalsContact C-NH1 3.29Å; P364-R475 PolarHBondContact O-NH1 3.47Å
365	V	89.1	Confident	93.8	Very high	104 Å²	104	48 Å²	48	63%	0.63	26%	0.255	S	S	*	.	S	Bend	trans	-119.4	120	-173.8	-177.3	0	0	0	0	110.1	C363	C363-V365 PolarHBondContact SG-O 3.43Å
366	N	88.6	Confident	93.8	Very high	112 Å²	112	47.3 Å²	47.3	60%	0.599	25%	0.251	S	S	*	.			trans	48.3	61.3	178.3	-66.2	-34.7	0	0	0	114.5	T368 T369 A370	N366-T368 PolarHBondContact O-N 3.33Å; N366-T368 VanDerWaalsContact O-N 3.15Å; N366-T369 PolarHBondContact O-N 3.19Å; N366-A370 PolarHBondContact O-N 3Å; N366-A370 VanDerWaalsContact O-N 3.12Å
367	P	92.8	Very high	93.8	Very high	16 Å²	16	45.3 Å²	45.3	10%	0.104	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-32.5	-174.9	26.5	-37.3	0	0	0	113	Y360 C363 T371	Y360-P367 HydrophobicContact CD1-CB 4.49Å; Y360-P367 HydrophobicContact CD2-CB 3.69Å; Y360-P367 HydrophobicContact CD2-CG 4.34Å; Y360-P367 HydrophobicContact CE2-CB 3.79Å; Y360-P367 HydrophobicContact CE2-CG 3.92Å; Y360-P367 HydrophobicContact CG-CB 4.05Å; Y360-P367 VanDerWaalsContact O-CB 3.26Å; Y360-P367 WeakPolarHBondContact O-CB 3.39Å; C363-P367 HydrophobicContact CB-CB 4.14Å; P367-T371 VanDerWaalsContact O-CB 3.31Å; P367-T371 WeakPolarHBondContact O-CB 3.38Å; P367-T371 PolarHBondContact O-N 3.01Å; P367-T371 PolarHBondContact O-OG1 3.08Å
368	T	92.3	Very high	94	Very high	23 Å²	23	43.8 Å²	43.8	14%	0.141	24%	0.238	C	C	.	.	H	α-helix	trans	-59	-54.7	173.9	-49.5	0	0	0	0	110.8	N366 A370 T371 F372 T396	N366-T368 PolarHBondContact O-N 3.33Å; N366-T368 VanDerWaalsContact O-N 3.15Å; T368-A370 PolarHBondContact O-N 2.96Å; T368-T371 WeakPolarHBondContact O-CB 3.49Å; T368-T371 PolarHBondContact O-N 2.52Å; T368-T371 VanDerWaalsContact O-N 3.16Å; T368-F372 HydrophobicContact CG2-CD2 3.87Å; T368-F372 HydrophobicContact CG2-CE2 3.87Å; T368-F372 WeakPolarHBondContact O-CD2 3.26Å; T368-F372 PolarHBondContact O-N 2.8Å; T368-T396 HydrophobicContact CG2-CG2 4.28Å
369	T	94.6	Very high	94	Very high	48 Å²	48	45 Å²	45	29%	0.294	24%	0.244	S	C	.	.	H	α-helix	trans	-58.6	-48.1	-179	-58.7	0	0	0	0	111.4	N366 T371 F372 L373 I393	N366-T369 PolarHBondContact O-N 3.19Å; T369-T371 VanDerWaalsContact C-N 3.28Å; T369-T371 PolarHBondContact O-N 2.74Å; T369-F372 PolarHBondContact O-N 2.91Å; T369-L373 HydrophobicContact CG2-CD1 3.9Å; T369-L373 HydrophobicContact CG2-CG 4.36Å; T369-L373 WeakPolarHBondContact O-CG 3.43Å; T369-L373 PolarHBondContact O-N 2.73Å; T369-I393 HydrophobicContact CG2-CD1 3.91Å
370	A	96.1	Very high	93.8	Very high	27 Å²	27	44.2 Å²	44.2	22%	0.223	24%	0.238	C	C	.	.	H	α-helix	trans	-58.4	-40.6	177.9	0	0	0	0	0	112.3	C359 C363 N366 T368 L373 L374	C359-A370 VanDerWaalsContact SG-C 3.58Å; C363-A370 HydrophobicContact CB-CB 4.3Å; N366-A370 PolarHBondContact O-N 3Å; N366-A370 VanDerWaalsContact O-N 3.12Å; T368-A370 PolarHBondContact O-N 2.96Å; A370-L373 PolarHBondContact O-N 3.49Å; A370-L374 WeakPolarHBondContact O-CB 3.28Å; A370-L374 PolarHBondContact O-N 3.11Å
371	T	96.8	Very high	93.7	Very high	20 Å²	20	42.2 Å²	42.2	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-45.8	179.1	-57.3	0	0	0	0	111.8	L355 Y360 P367 T368 T369 L374 S375	L355-T371 HydrophobicContact CB-CG2 3.8Å; L355-T371 HydrophobicContact CD1-CG2 4.36Å; L355-T371 HydrophobicContact CG-CG2 4.47Å; Y360-T371 WeakPolarHBondContact CB-OG1 3.34Å; P367-T371 VanDerWaalsContact O-CB 3.31Å; P367-T371 WeakPolarHBondContact O-CB 3.38Å; P367-T371 PolarHBondContact O-N 3.01Å; P367-T371 PolarHBondContact O-OG1 3.08Å; T368-T371 WeakPolarHBondContact O-CB 3.49Å; T368-T371 PolarHBondContact O-N 2.52Å; T368-T371 VanDerWaalsContact O-N 3.16Å; T369-T371 VanDerWaalsContact C-N 3.28Å; T369-T371 PolarHBondContact O-N 2.74Å; T371-L374 PolarHBondContact O-N 3.31Å; T371-S375 WeakPolarHBondContact O-CB 3.47Å; T371-S375 PolarHBondContact O-N 3.35Å
372	F	97.1	Very high	93.7	Very high	27 Å²	27	39.1 Å²	39.1	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-40.3	178.4	-87	-91.5	0	0	0	111.8	L344 T368 T369 S375 A376 F389 I393 T396	L344-F372 HydrophobicContact CD1-CE1 4.38Å; L344-F372 HydrophobicContact CD1-CZ 3.76Å; T368-F372 HydrophobicContact CG2-CD2 3.87Å; T368-F372 HydrophobicContact CG2-CE2 3.87Å; T368-F372 WeakPolarHBondContact O-CD2 3.26Å; T368-F372 PolarHBondContact O-N 2.8Å; T369-F372 PolarHBondContact O-N 2.91Å; F372-S375 WeakPolarHBondContact O-CB 3.3Å; F372-S375 PolarHBondContact O-N 3.1Å; F372-A376 PolarHBondContact O-N 3.1Å; F372-F389 HydrophobicContact CB-CB 4.25Å; F372-F389 HydrophobicContact CD1-CB 4.12Å; F372-F389 AromaticContact CD1-CD1 3.78Å; F372-F389 HydrophobicContact CD1-CD1 3.78Å; F372-F389 HydrophobicContact CD1-CG 4.46Å; F372-F389 VanDerWaalsContact CD1-O 3.28Å; F372-F389 WeakPolarHBondContact CD1-O 3.43Å; F372-F389 HydrophobicContact CE1-CD1 4.43Å; F372-F389 WeakPolarHBondContact O-CB 3.33Å; F372-I393 HydrophobicContact CB-CD1 3.97Å; F372-I393 HydrophobicContact CB-CG1 3.58Å; F372-I393 HydrophobicContact CD1-CG1 4.39Å; F372-I393 HydrophobicContact CD2-CG1 4Å; F372-I393 HydrophobicContact CG-CG1 3.75Å; F372-T396 WeakPolarHBondContact CZ-OG1 3.41Å
373	L	96.9	Very high	93.9	Very high	66 Å²	66	37.9 Å²	37.9	35%	0.346	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-41	175.6	-68.3	177	0	0	0	112.2	T369 A370 S375 A376 M377 V390	T369-L373 HydrophobicContact CG2-CD1 3.9Å; T369-L373 HydrophobicContact CG2-CG 4.36Å; T369-L373 WeakPolarHBondContact O-CG 3.43Å; T369-L373 PolarHBondContact O-N 2.73Å; A370-L373 PolarHBondContact O-N 3.49Å; L373-S375 VanDerWaalsContact C-N 3.28Å; L373-S375 PolarHBondContact O-N 2.96Å; L373-A376 WeakPolarHBondContact O-CB 3.24Å; L373-A376 PolarHBondContact O-N 2.9Å; L373-M377 WeakPolarHBondContact O-CG 3.36Å; L373-M377 PolarHBondContact O-N 3.5Å; L373-V390 HydrophobicContact CD2-CG2 4.4Å
374	L	97.5	Very high	94	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-41.3	172.4	176.2	57.5	0	0	0	111.3	F106 L110 W354 L355 V358 C359 A370 T371 A376 M377 W378	F106-L374 HydrophobicContact CE1-CD1 4.29Å; F106-L374 HydrophobicContact CE2-CD1 4.41Å; F106-L374 HydrophobicContact CE2-CD2 4.2Å; F106-L374 HydrophobicContact CZ-CD1 3.53Å; F106-L374 HydrophobicContact CZ-CD2 3.79Å; F106-L374 HydrophobicContact CZ-CG 4.32Å; L110-L374 HydrophobicContact CD2-CD1 3.69Å; W354-L374 HydrophobicContact CH2-CD2 4.43Å; W354-L374 HydrophobicContact CH2-CG 4.32Å; L355-L374 HydrophobicContact CD2-CB 4.24Å; L355-L374 HydrophobicContact CD2-CD2 3.84Å; L355-L374 HydrophobicContact CD2-CG 3.82Å; V358-L374 HydrophobicContact CG2-CD2 4.08Å; C359-L374 HydrophobicContact CB-CD2 3.54Å; A370-L374 WeakPolarHBondContact O-CB 3.28Å; A370-L374 PolarHBondContact O-N 3.11Å; T371-L374 PolarHBondContact O-N 3.31Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 3.32Å; L374-M377 HydrophobicContact CB-CE 4.46Å; L374-M377 HydrophobicContact CD1-CE 4.19Å; L374-M377 PolarHBondContact O-N 3.41Å; L374-W378 WeakPolarHBondContact O-CB 3.47Å; L374-W378 PolarHBondContact O-N 2.95Å
375	S	97.6	Very high	94.4	Very high	10 Å²	10	32.8 Å²	32.8	7%	0.07	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-41.1	175.7	-162.6	0	0	0	0	111.8	T371 F372 L373 W378 H379 F389	T371-S375 WeakPolarHBondContact O-CB 3.47Å; T371-S375 PolarHBondContact O-N 3.35Å; F372-S375 WeakPolarHBondContact O-CB 3.3Å; F372-S375 PolarHBondContact O-N 3.1Å; L373-S375 VanDerWaalsContact C-N 3.28Å; L373-S375 PolarHBondContact O-N 2.96Å; S375-W378 PolarHBondContact O-N 3.42Å; S375-H379 PolarHBondContact O-N 3.49Å; S375-H379 VanDerWaalsContact O-N 3.11Å; S375-H379 PolarHBondContact O-ND1 3.45Å; S375-F389 WeakPolarHBondContact OG-CE1 3.4Å; S375-F389 WeakPolarHBondContact OG-CZ 3.35Å
376	A	96.9	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.8	-52.4	173.9	0	0	0	0	0	112.2	F372 L373 L374 W378 H379 G380 Y386 F389	F372-A376 PolarHBondContact O-N 3.1Å; L373-A376 WeakPolarHBondContact O-CB 3.24Å; L373-A376 PolarHBondContact O-N 2.9Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 3.32Å; A376-W378 VanDerWaalsContact C-N 3.26Å; A376-W378 PolarHBondContact O-N 3.02Å; A376-H379 PolarHBondContact O-N 2.88Å; A376-H379 VanDerWaalsContact O-N 3.17Å; A376-G380 PolarHBondContact O-N 3.15Å; A376-Y386 HydrophobicContact CB-CD1 3.88Å; A376-Y386 HydrophobicContact CB-CE1 4.02Å; A376-Y386 HydrophobicContact CB-CG 4.24Å; A376-F389 HydrophobicContact CB-CB 4.03Å; A376-F389 HydrophobicContact CB-CD2 3.46Å; A376-F389 VanDerWaalsContact CB-CD2 3.46Å; A376-F389 HydrophobicContact CB-CE2 4.3Å; A376-F389 HydrophobicContact CB-CG 4Å
377	M	96.4	Very high	95.3	Very high	67 Å²	67	28.4 Å²	28.4	33%	0.33	15%	0.152	S	C	.	.	H	α-helix	trans	-60.2	-36.8	179.6	-69	-174.8	-65.2	0	0	112.5	I114 L373 L374 G380 Y386	I114-M377 HydrophobicContact CD1-CB 4.41Å; L373-M377 WeakPolarHBondContact O-CG 3.36Å; L373-M377 PolarHBondContact O-N 3.5Å; L374-M377 HydrophobicContact CB-CE 4.46Å; L374-M377 HydrophobicContact CD1-CE 4.19Å; L374-M377 PolarHBondContact O-N 3.41Å; M377-G380 PolarHBondContact O-N 2.87Å; M377-Y386 HydrophobicContact CG-CE1 4.3Å
378	W	97.2	Very high	95.5	Very high	10 Å²	10	28 Å²	28	4%	0.038	15%	0.15	C	C	.	.	H	α-helix	trans	-67.7	-38.2	177.5	175.4	74.9	0	0	0	112.7	Q117 M138 Q142 T351 W354 L374 S375 A376	Q117-W378 PolarHBondContact NE2-O 2.92Å; M138-W378 HydrophobicContact CB-CZ2 3.62Å; M138-W378 HydrophobicContact CE-CD2 3.46Å; M138-W378 VanDerWaalsContact CE-CD2 3.46Å; M138-W378 HydrophobicContact CE-CE3 3.37Å; M138-W378 HydrophobicContact CE-CG 4.29Å; M138-W378 HydrophobicContact CE-CH2 3.42Å; M138-W378 VanDerWaalsContact CE-CH2 3.42Å; M138-W378 HydrophobicContact CE-CZ2 3.52Å; M138-W378 HydrophobicContact CE-CZ3 3.34Å; M138-W378 WeakPolarHBondContact CE-O 3.48Å; M138-W378 HydrophobicContact CG-CZ2 4.37Å; M138-W378 PolarHBondContact O-NE1 3.44Å; Q142-W378 VanDerWaalsContact CD-CZ2 3.41Å; Q142-W378 HydrophobicContact CG-CZ2 4.12Å; T351-W378 HydrophobicContact CG2-CE3 4.36Å; T351-W378 HydrophobicContact CG2-CH2 3.87Å; T351-W378 HydrophobicContact CG2-CZ2 4.47Å; T351-W378 HydrophobicContact CG2-CZ3 3.81Å; W354-W378 HydrophobicContact CH2-CB 3.95Å; W354-W378 AromaticContact CH2-CD1 3.56Å; W354-W378 HydrophobicContact CH2-CD2 4.3Å; W354-W378 AromaticContact CH2-CG 3.66Å; W354-W378 HydrophobicContact CH2-CG 3.66Å; W354-W378 HydrophobicContact CZ3-CB 4.25Å; W354-W378 AromaticContact CZ3-CD1 3.95Å; W354-W378 AromaticContact CZ3-CD2 3.95Å; W354-W378 HydrophobicContact CZ3-CD2 3.95Å; W354-W378 AromaticContact CZ3-CG 3.78Å; W354-W378 HydrophobicContact CZ3-CG 3.78Å; L374-W378 WeakPolarHBondContact O-CB 3.47Å; L374-W378 PolarHBondContact O-N 2.95Å; S375-W378 PolarHBondContact O-N 3.42Å; A376-W378 VanDerWaalsContact C-N 3.26Å; A376-W378 PolarHBondContact O-N 3.02Å
379	H	94.5	Very high	95.8	Very high	33 Å²	33	28.1 Å²	28.1	15%	0.153	15%	0.148	C	C	.	.	H	α-helix	trans	-70.4	-33.2	174.9	-73.4	92.8	0	0	0	112.7	Q117 S375 A376 Y385 F389 F439	Q117-H379 PolarHBondContact NE2-O 3.18Å; S375-H379 PolarHBondContact O-N 3.49Å; S375-H379 VanDerWaalsContact O-N 3.11Å; S375-H379 PolarHBondContact O-ND1 3.45Å; A376-H379 PolarHBondContact O-N 2.88Å; A376-H379 VanDerWaalsContact O-N 3.17Å; H379-Y385 VanDerWaalsContact C-CE2 3.49Å; H379-Y385 HydrophobicContact CB-CD1 4.33Å; H379-Y385 HydrophobicContact CB-CD2 3.74Å; H379-Y385 HydrophobicContact CB-CE2 3.95Å; H379-Y385 HydrophobicContact CB-CG 3.94Å; H379-Y385 WeakPolarHBondContact O-CE2 3.39Å; H379-F389 HydrophobicContact CB-CE2 4.45Å; H379-F389 AromaticContact CE1-CZ 3.38Å; H379-F389 WeakPolarHBondContact CE1-CZ 3.16Å; H379-F389 AromaticContact ND1-CE2 3.51Å; H379-F389 AromaticContact ND1-CZ 3.27Å; H379-F389 VanDerWaalsContact ND1-CZ 3.27Å; H379-F389 WeakPolarHBondContact ND1-CZ 3.39Å; H379-F439 HydrophobicContact CB-CE2 4.32Å; H379-F439 AromaticContact CD2-CE2 3.52Å; H379-F439 AromaticContact CD2-CZ 3.39Å; H379-F439 WeakPolarHBondContact CD2-CZ 3.5Å; H379-F439 AromaticContact CG-CE2 3.81Å; H379-F439 AromaticContact NE2-CE2 3.83Å; H379-F439 AromaticContact NE2-CZ 3.79Å
380	G	92.3	Very high	95.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.01	16%	0.157	C	C	.	.			trans	136.6	-155.6	164.4	0	0	0	0	0	114.8	A376 M377 Y386	A376-G380 PolarHBondContact O-N 3.15Å; M377-G380 PolarHBondContact O-N 2.87Å; G380-Y386 VanDerWaalsContact O-CE2 3.23Å; G380-Y386 WeakPolarHBondContact O-CE2 3.47Å; G380-Y386 PolarHBondContact O-OH 3.44Å
381	V	91.7	Very high	95.9	Very high	42 Å²	42	28.8 Å²	28.8	26%	0.255	15%	0.149	S	C	.	.	S	Bend	trans	-96.8	-0.4	-168.3	-58.9	0	0	0	0	114.6	I114 I118 V121 P383	I114-V381 HydrophobicContact CG2-CG1 4.1Å; I118-V381 HydrophobicContact CD1-CG1 4.27Å; I118-V381 HydrophobicContact CG1-CB 4.39Å; I118-V381 HydrophobicContact CG1-CG1 3.64Å; I118-V381 HydrophobicContact CG1-CG2 4.11Å; V121-V381 HydrophobicContact CB-CG2 4.33Å; V121-V381 HydrophobicContact CG2-CG2 3.73Å; V381-P383 WeakPolarHBondContact O-CD 3.36Å
382	Y	90.8	Very high	95.9	Very high	5 Å²	5	27.9 Å²	27.9	2%	0.02	14%	0.144	C	C	.	.			trans	-65.2	128.1	175.1	-72.3	-81.5	0	0	0	110.7	R120 V121 Y126 G384 Y385 Y386 L442	R120-Y382 PolarHBondContact NH1-OH 3.34Å; V121-Y382 HydrophobicContact CG1-CE1 4.43Å; V121-Y382 HydrophobicContact CG2-CD2 4.19Å; V121-Y382 HydrophobicContact CG2-CE1 4.12Å; V121-Y382 HydrophobicContact CG2-CE2 3.52Å; Y126-Y382 AromaticContact CD2-CE1 3.91Å; Y126-Y382 HydrophobicContact CD2-CE1 3.91Å; Y126-Y382 HydrophobicContact CE1-CE1 4.35Å; Y126-Y382 AromaticContact CE2-CD1 3.82Å; Y126-Y382 HydrophobicContact CE2-CD1 3.82Å; Y126-Y382 AromaticContact CE2-CE1 3.65Å; Y126-Y382 HydrophobicContact CE2-CE1 3.65Å; Y126-Y382 HydrophobicContact CG-CE1 4.38Å; Y126-Y382 AromaticContact CZ-CD1 3.83Å; Y126-Y382 AromaticContact CZ-CE1 3.89Å; Y382-G384 PolarHBondContact O-N 2.96Å; Y382-G384 VanDerWaalsContact O-N 3.15Å; Y382-Y385 AromaticContact CD2-CE2 3.78Å; Y382-Y385 HydrophobicContact CD2-CE2 3.78Å; Y382-Y385 HydrophobicContact CG-CE2 4.31Å; Y382-Y385 WeakPolarHBondContact O-CB 3.32Å; Y382-Y385 PolarHBondContact O-N 3.19Å; Y382-Y385 VanDerWaalsContact O-N 3.08Å; Y382-Y386 WeakPolarHBondContact O-CD2 3.37Å; Y382-L442 HydrophobicContact CD1-CB 3.82Å; Y382-L442 HydrophobicContact CD1-CD1 4.43Å; Y382-L442 HydrophobicContact CD1-CG 4.49Å; Y382-L442 HydrophobicContact CD2-CD2 4.35Å; Y382-L442 HydrophobicContact CE1-CB 4.44Å; Y382-L442 HydrophobicContact CE1-CD1 4.38Å; Y382-L442 HydrophobicContact CG-CB 4.15Å; Y382-L442 HydrophobicContact CG-CD2 4.08Å
383	P	93.7	Very high	95.8	Very high	46 Å²	46	27.5 Å²	27.5	30%	0.299	14%	0.143	S	C	.	.	H	α-helix	trans	-58.1	-30.7	-178.1	-28.3	36.2	0	0	0	114.5	V381 Y385 Y386 L387 V444	V381-P383 WeakPolarHBondContact O-CD 3.36Å; P383-Y385 PolarHBondContact O-N 3.41Å; P383-Y386 PolarHBondContact O-N 3.42Å; P383-Y386 VanDerWaalsContact O-N 3.1Å; P383-L387 PolarHBondContact O-N 2.98Å; P383-V444 HydrophobicContact CB-CG2 3.21Å; P383-V444 HydrophobicContact CG-CG2 3.72Å
384	G	95.1	Very high	95.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58	-32.7	176.7	0	0	0	0	0	113.8	Y382 T388 P438 L442	Y382-G384 PolarHBondContact O-N 2.96Å; Y382-G384 VanDerWaalsContact O-N 3.15Å; G384-T388 WeakPolarHBondContact O-CB 3.25Å; G384-T388 PolarHBondContact O-N 3.14Å; G384-T388 PolarHBondContact O-OG1 3.01Å; G384-P438 CarbonylContact C-O 3.51Å; G384-P438 WeakPolarHBondContact CA-O 3.3Å; G384-P438 CarbonylContact O-C 3.58Å; G384-P438 WeakPolarHBondContact O-CB 3.1Å; G384-L442 PolarHBondContact N-O 3.08Å
385	Y	95.6	Very high	95.7	Very high	26 Å²	26	25.9 Å²	25.9	10%	0.102	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-50.4	173	-59.3	-30.3	0	0	0	110.7	H379 Y382 P383 L387 T388 F389 F439 L442	H379-Y385 VanDerWaalsContact C-CE2 3.49Å; H379-Y385 HydrophobicContact CB-CD1 4.33Å; H379-Y385 HydrophobicContact CB-CD2 3.74Å; H379-Y385 HydrophobicContact CB-CE2 3.95Å; H379-Y385 HydrophobicContact CB-CG 3.94Å; H379-Y385 WeakPolarHBondContact O-CE2 3.39Å; Y382-Y385 AromaticContact CD2-CE2 3.78Å; Y382-Y385 HydrophobicContact CD2-CE2 3.78Å; Y382-Y385 HydrophobicContact CG-CE2 4.31Å; Y382-Y385 WeakPolarHBondContact O-CB 3.32Å; Y382-Y385 PolarHBondContact O-N 3.19Å; Y382-Y385 VanDerWaalsContact O-N 3.08Å; P383-Y385 PolarHBondContact O-N 3.41Å; Y385-L387 VanDerWaalsContact C-N 3.35Å; Y385-L387 PolarHBondContact O-N 3.26Å; Y385-T388 WeakPolarHBondContact O-CB 3.41Å; Y385-T388 PolarHBondContact O-N 3.42Å; Y385-T388 VanDerWaalsContact O-N 3.14Å; Y385-F389 WeakPolarHBondContact O-CD2 3.44Å; Y385-F389 PolarHBondContact O-N 3.34Å; Y385-F439 HydrophobicContact CD1-CD1 4.42Å; Y385-F439 AromaticContact CD1-CD2 3.43Å; Y385-F439 HydrophobicContact CD1-CD2 3.43Å; Y385-F439 VanDerWaalsContact CD1-CD2 3.43Å; Y385-F439 HydrophobicContact CD1-CE1 4.48Å; Y385-F439 AromaticContact CD1-CE2 3.5Å; Y385-F439 HydrophobicContact CD1-CE2 3.5Å; Y385-F439 VanDerWaalsContact CD1-CE2 3.5Å; Y385-F439 AromaticContact CD1-CG 3.92Å; Y385-F439 HydrophobicContact CD1-CG 3.92Å; Y385-F439 HydrophobicContact CD1-CZ 4.05Å; Y385-F439 HydrophobicContact CE1-CD1 4.11Å; Y385-F439 AromaticContact CE1-CD2 3.88Å; Y385-F439 HydrophobicContact CE1-CD2 3.88Å; Y385-F439 AromaticContact CE1-CE1 3.94Å; Y385-F439 HydrophobicContact CE1-CE1 3.94Å; Y385-F439 AromaticContact CE1-CE2 3.7Å; Y385-F439 HydrophobicContact CE1-CE2 3.7Å; Y385-F439 HydrophobicContact CE1-CG 4.07Å; Y385-F439 AromaticContact CE1-CZ 3.73Å; Y385-F439 HydrophobicContact CE1-CZ 3.73Å; Y385-F439 HydrophobicContact CG-CD2 4.46Å; Y385-F439 HydrophobicContact CG-CE2 4.41Å; Y385-L442 HydrophobicContact CD1-CD2 4.38Å; Y385-L442 HydrophobicContact CE1-CD2 3.55Å
386	Y	97.4	Very high	95.5	Very high	80 Å²	80	26.2 Å²	26.2	31%	0.314	14%	0.143	S	C	.	.	H	α-helix	trans	-60.6	-43.3	179.8	-64.1	-94.2	0	0	0	112	A376 M377 G380 Y382 P383 T388 F389 V390	A376-Y386 HydrophobicContact CB-CD1 3.88Å; A376-Y386 HydrophobicContact CB-CE1 4.02Å; A376-Y386 HydrophobicContact CB-CG 4.24Å; M377-Y386 HydrophobicContact CG-CE1 4.3Å; G380-Y386 VanDerWaalsContact O-CE2 3.23Å; G380-Y386 WeakPolarHBondContact O-CE2 3.47Å; G380-Y386 PolarHBondContact O-OH 3.44Å; Y382-Y386 WeakPolarHBondContact O-CD2 3.37Å; P383-Y386 PolarHBondContact O-N 3.42Å; P383-Y386 VanDerWaalsContact O-N 3.1Å; Y386-T388 VanDerWaalsContact C-N 3.31Å; Y386-T388 PolarHBondContact O-N 2.68Å; Y386-F389 PolarHBondContact O-N 3.41Å; Y386-V390 VanDerWaalsContact O-CB 3.31Å; Y386-V390 WeakPolarHBondContact O-CB 3.15Å; Y386-V390 VanDerWaalsContact O-CG2 3.23Å; Y386-V390 WeakPolarHBondContact O-CG2 3.41Å; Y386-V390 PolarHBondContact O-N 3.43Å
387	L	97.6	Very high	95.3	Very high	45 Å²	45	30.3 Å²	30.3	24%	0.236	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-41.7	175.5	-68.6	176.9	0	0	0	112.3	P383 Y385 T391 P438 S447	P383-L387 PolarHBondContact O-N 2.98Å; Y385-L387 VanDerWaalsContact C-N 3.35Å; Y385-L387 PolarHBondContact O-N 3.26Å; L387-T391 VanDerWaalsContact O-CB 3.25Å; L387-T391 WeakPolarHBondContact O-CB 3.26Å; L387-T391 PolarHBondContact O-N 3.43Å; L387-T391 PolarHBondContact O-OG1 3.28Å; L387-P438 HydrophobicContact CB-CB 3.81Å; L387-P438 HydrophobicContact CB-CG 4.16Å; L387-P438 HydrophobicContact CD1-CB 4.41Å; L387-S447 VanDerWaalsContact CD1-CB 3.46Å
388	T	97.7	Very high	95.2	Very high	8 Å²	8	27.5 Å²	27.5	5%	0.049	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-54.4	176.5	-61.9	0	0	0	0	111.2	G384 Y385 Y386 V390 T391 G392 T435 F439	G384-T388 WeakPolarHBondContact O-CB 3.25Å; G384-T388 PolarHBondContact O-N 3.14Å; G384-T388 PolarHBondContact O-OG1 3.01Å; Y385-T388 WeakPolarHBondContact O-CB 3.41Å; Y385-T388 PolarHBondContact O-N 3.42Å; Y385-T388 VanDerWaalsContact O-N 3.14Å; Y386-T388 VanDerWaalsContact C-N 3.31Å; Y386-T388 PolarHBondContact O-N 2.68Å; T388-V390 PolarHBondContact O-N 2.91Å; T388-T391 PolarHBondContact O-N 2.89Å; T388-G392 PolarHBondContact O-N 3.49Å; T388-T435 WeakPolarHBondContact CA-O 3.32Å; T388-T435 HydrophobicContact CG2-CG2 4.17Å; T388-T435 WeakPolarHBondContact CG2-O 3.46Å; T388-T435 WeakPolarHBondContact O-CG2 3.35Å; T388-T435 PolarHBondContact OG1-O 2.86Å; T388-F439 HydrophobicContact CG2-CB 4.02Å; T388-F439 HydrophobicContact CG2-CD2 4.18Å; T388-F439 WeakPolarHBondContact OG1-CA 3.33Å; T388-F439 WeakPolarHBondContact OG1-CB 3.35Å; T388-F439 PolarHBondContact OG1-N 3.06Å
389	F	97.4	Very high	95.1	Very high	25 Å²	25	28.3 Å²	28.3	11%	0.11	16%	0.159	C	C	.	.	H	α-helix	trans	-70.8	-35.5	-174.1	-70	-72.2	0	0	0	112.2	F372 S375 A376 H379 Y385 Y386 G392 I393 F439	F372-F389 HydrophobicContact CB-CB 4.25Å; F372-F389 HydrophobicContact CD1-CB 4.12Å; F372-F389 AromaticContact CD1-CD1 3.78Å; F372-F389 HydrophobicContact CD1-CD1 3.78Å; F372-F389 HydrophobicContact CD1-CG 4.46Å; F372-F389 VanDerWaalsContact CD1-O 3.28Å; F372-F389 WeakPolarHBondContact CD1-O 3.43Å; F372-F389 HydrophobicContact CE1-CD1 4.43Å; F372-F389 WeakPolarHBondContact O-CB 3.33Å; S375-F389 WeakPolarHBondContact OG-CE1 3.4Å; S375-F389 WeakPolarHBondContact OG-CZ 3.35Å; A376-F389 HydrophobicContact CB-CB 4.03Å; A376-F389 HydrophobicContact CB-CD2 3.46Å; A376-F389 VanDerWaalsContact CB-CD2 3.46Å; A376-F389 HydrophobicContact CB-CE2 4.3Å; A376-F389 HydrophobicContact CB-CG 4Å; H379-F389 HydrophobicContact CB-CE2 4.45Å; H379-F389 AromaticContact CE1-CZ 3.38Å; H379-F389 WeakPolarHBondContact CE1-CZ 3.16Å; H379-F389 AromaticContact ND1-CE2 3.51Å; H379-F389 AromaticContact ND1-CZ 3.27Å; H379-F389 VanDerWaalsContact ND1-CZ 3.27Å; H379-F389 WeakPolarHBondContact ND1-CZ 3.39Å; Y385-F389 WeakPolarHBondContact O-CD2 3.44Å; Y385-F389 PolarHBondContact O-N 3.34Å; Y386-F389 PolarHBondContact O-N 3.41Å; F389-G392 PolarHBondContact O-N 3.4Å; F389-I393 WeakPolarHBondContact O-CG1 3.45Å; F389-I393 PolarHBondContact O-N 3.46Å; F389-I393 VanDerWaalsContact O-N 3.1Å; F389-F439 HydrophobicContact CE2-CD2 4.2Å; F389-F439 HydrophobicContact CE2-CE2 4.04Å; F389-F439 HydrophobicContact CZ-CD2 4.41Å; F389-F439 HydrophobicContact CZ-CE2 4.09Å
390	V	97	Very high	95	Very high	79 Å²	79	31.8 Å²	31.8	48%	0.479	17%	0.171	S	C	.	.	H	α-helix	trans	-63.4	-43.7	172.6	171	0	0	0	0	111	L373 Y386 T388 G392 I393	L373-V390 HydrophobicContact CD2-CG2 4.4Å; Y386-V390 VanDerWaalsContact O-CB 3.31Å; Y386-V390 WeakPolarHBondContact O-CB 3.15Å; Y386-V390 VanDerWaalsContact O-CG2 3.23Å; Y386-V390 WeakPolarHBondContact O-CG2 3.41Å; Y386-V390 PolarHBondContact O-N 3.43Å; T388-V390 PolarHBondContact O-N 2.91Å; V390-G392 VanDerWaalsContact C-N 3.3Å; V390-G392 PolarHBondContact O-N 2.97Å; V390-I393 WeakPolarHBondContact O-CB 3.33Å; V390-I393 PolarHBondContact O-N 3.36Å
391	T	97.4	Very high	95.1	Very high	9 Å²	9	31.8 Å²	31.8	6%	0.055	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-41.5	174.1	-59.8	0	0	0	0	111	L387 T388 I393 G394 M395 Y434 T435 Y451 H459	L387-T391 VanDerWaalsContact O-CB 3.25Å; L387-T391 WeakPolarHBondContact O-CB 3.26Å; L387-T391 PolarHBondContact O-N 3.43Å; L387-T391 PolarHBondContact O-OG1 3.28Å; T388-T391 PolarHBondContact O-N 2.89Å; T391-I393 VanDerWaalsContact C-N 3.26Å; T391-I393 PolarHBondContact O-N 3.5Å; T391-G394 PolarHBondContact O-N 2.94Å; T391-G394 VanDerWaalsContact O-N 3.12Å; T391-M395 HydrophobicContact CG2-CE 3.89Å; T391-M395 HydrophobicContact CG2-CG 4.21Å; T391-M395 WeakPolarHBondContact O-CG 3.16Å; T391-M395 PolarHBondContact O-N 2.95Å; T391-Y434 HydrophobicContact CG2-CD1 4.43Å; T391-Y434 HydrophobicContact CG2-CE1 4.42Å; T391-T435 HydrophobicContact CG2-CG2 4.11Å; T391-Y451 PolarHBondContact OG1-OH 3.06Å; T391-H459 WeakPolarHBondContact CG2-NE2 3.47Å; T391-H459 PolarHBondContact OG1-NE2 3.09Å
392	G	96.6	Very high	95.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-30.7	175.7	0	0	0	0	0	114.3	T388 F389 V390 T396	T388-G392 PolarHBondContact O-N 3.49Å; F389-G392 PolarHBondContact O-N 3.4Å; V390-G392 VanDerWaalsContact C-N 3.3Å; V390-G392 PolarHBondContact O-N 2.97Å; G392-T396 VanDerWaalsContact O-CB 3.22Å; G392-T396 WeakPolarHBondContact O-CB 3.44Å; G392-T396 PolarHBondContact O-N 3.04Å; G392-T396 PolarHBondContact O-OG1 3.4Å
393	I	95.3	Very high	95.2	Very high	20 Å²	20	34.6 Å²	34.6	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-52.7	173	-63.9	165.2	0	0	0	109.9	T369 F372 F389 V390 T391 M395 T396 M397	T369-I393 HydrophobicContact CG2-CD1 3.91Å; F372-I393 HydrophobicContact CB-CD1 3.97Å; F372-I393 HydrophobicContact CB-CG1 3.58Å; F372-I393 HydrophobicContact CD1-CG1 4.39Å; F372-I393 HydrophobicContact CD2-CG1 4Å; F372-I393 HydrophobicContact CG-CG1 3.75Å; F389-I393 WeakPolarHBondContact O-CG1 3.45Å; F389-I393 PolarHBondContact O-N 3.46Å; F389-I393 VanDerWaalsContact O-N 3.1Å; V390-I393 WeakPolarHBondContact O-CB 3.33Å; V390-I393 PolarHBondContact O-N 3.36Å; T391-I393 VanDerWaalsContact C-N 3.26Å; T391-I393 PolarHBondContact O-N 3.5Å; I393-M395 PolarHBondContact O-N 2.85Å; I393-T396 PolarHBondContact O-N 3Å; I393-M397 HydrophobicContact CG2-SD 4.02Å; I393-M397 WeakPolarHBondContact O-CG 3.28Å; I393-M397 PolarHBondContact O-N 3.14Å
394	G	94.8	Very high	95.1	Very high	27 Å²	27	37 Å²	37	28%	0.278	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-48.3	179.3	0	0	0	0	0	111.9	T391 T396 M397 A398	T391-G394 PolarHBondContact O-N 2.94Å; T391-G394 VanDerWaalsContact O-N 3.12Å; G394-T396 VanDerWaalsContact C-N 3.34Å; G394-T396 PolarHBondContact O-N 3.01Å; G394-M397 PolarHBondContact O-N 3.04Å; G394-A398 WeakPolarHBondContact O-CB 3.49Å; G394-A398 PolarHBondContact O-N 2.8Å
395	M	96.1	Very high	95	Very high	10 Å²	10	39.3 Å²	39.3	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-42.4	177.5	-63.8	-71.6	175.6	0	0	112.2	F340 T391 I393 M397 A398 A399 A431 Y434 T435 L458 C462	F340-M395 HydrophobicContact CD1-CB 4.3Å; F340-M395 HydrophobicContact CD2-CB 4Å; F340-M395 HydrophobicContact CE1-CB 4.05Å; F340-M395 HydrophobicContact CE2-CB 3.74Å; F340-M395 HydrophobicContact CE2-CG 4.24Å; F340-M395 HydrophobicContact CG-CB 4.27Å; F340-M395 HydrophobicContact CZ-CB 3.79Å; F340-M395 HydrophobicContact CZ-CG 4.43Å; T391-M395 HydrophobicContact CG2-CE 3.89Å; T391-M395 HydrophobicContact CG2-CG 4.21Å; T391-M395 WeakPolarHBondContact O-CG 3.16Å; T391-M395 PolarHBondContact O-N 2.95Å; I393-M395 PolarHBondContact O-N 2.85Å; M395-M397 PolarHBondContact O-N 2.72Å; M395-A398 PolarHBondContact O-N 3.29Å; M395-A399 WeakPolarHBondContact O-CB 3.25Å; M395-A399 PolarHBondContact O-N 2.9Å; M395-A431 HydrophobicContact SD-CB 4.06Å; M395-Y434 HydrophobicContact CE-CD1 3.71Å; M395-Y434 HydrophobicContact CE-CE1 4.09Å; M395-T435 WeakPolarHBondContact CG-OG1 3.23Å; M395-L458 HydrophobicContact CE-CB 3.46Å; M395-L458 VanDerWaalsContact CE-CB 3.46Å; M395-L458 HydrophobicContact CE-CD1 4.18Å; M395-L458 HydrophobicContact CE-CG 4.46Å; M395-C462 PolarHBondContact SD-SG 3.06Å
396	T	94.3	Very high	94.8	Very high	17 Å²	17	40.9 Å²	40.9	10%	0.104	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-40.2	177.9	-62.4	0	0	0	0	111.8	F340 T368 F372 G392 I393 G394 R400	F340-T396 WeakPolarHBondContact CD1-OG1 3.32Å; F340-T396 WeakPolarHBondContact CE1-OG1 3.42Å; T368-T396 HydrophobicContact CG2-CG2 4.28Å; F372-T396 WeakPolarHBondContact CZ-OG1 3.41Å; G392-T396 VanDerWaalsContact O-CB 3.22Å; G392-T396 WeakPolarHBondContact O-CB 3.44Å; G392-T396 PolarHBondContact O-N 3.04Å; G392-T396 PolarHBondContact O-OG1 3.4Å; I393-T396 PolarHBondContact O-N 3Å; G394-T396 VanDerWaalsContact C-N 3.34Å; G394-T396 PolarHBondContact O-N 3.01Å; T396-R400 VanDerWaalsContact O-CB 3.31Å; T396-R400 WeakPolarHBondContact O-CB 3.49Å; T396-R400 PolarHBondContact O-N 3.38Å; T396-R400 VanDerWaalsContact O-N 3.11Å
397	M	92.8	Very high	94.6	Very high	85 Å²	85	41.6 Å²	41.6	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-47.1	177.6	-71	178.7	63.5	0	0	111.4	I393 G394 M395 R400 A401 V466	I393-M397 HydrophobicContact CG2-SD 4.02Å; I393-M397 WeakPolarHBondContact O-CG 3.28Å; I393-M397 PolarHBondContact O-N 3.14Å; G394-M397 PolarHBondContact O-N 3.04Å; M395-M397 PolarHBondContact O-N 2.72Å; M397-R400 WeakPolarHBondContact O-CB 3.35Å; M397-R400 PolarHBondContact O-N 3.28Å; M397-A401 PolarHBondContact O-N 3.41Å; M397-V466 HydrophobicContact CB-CG2 3.94Å; M397-V466 HydrophobicContact CE-CG1 4.26Å
398	A	94.8	Very high	94.4	Very high	8 Å²	8	42.8 Å²	42.8	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-47.6	177.8	0	0	0	0	0	112	G394 M395 R400 A401 V402 C462 V465 V466	G394-A398 WeakPolarHBondContact O-CB 3.49Å; G394-A398 PolarHBondContact O-N 2.8Å; M395-A398 PolarHBondContact O-N 3.29Å; A398-R400 PolarHBondContact O-N 3.08Å; A398-A401 WeakPolarHBondContact O-CB 3.27Å; A398-A401 PolarHBondContact O-N 2.83Å; A398-V402 WeakPolarHBondContact O-CG2 3.27Å; A398-V402 PolarHBondContact O-N 3.12Å; A398-C462 HydrophobicContact CB-CB 3.83Å; A398-V465 HydrophobicContact CB-CB 4.19Å; A398-V465 HydrophobicContact CB-CG1 3.87Å; A398-V466 HydrophobicContact CB-CG2 4.31Å
399	A	94.2	Very high	94.1	Very high	28 Å²	28	50.8 Å²	50.8	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-36.1	177.2	0	0	0	0	0	112.2	F340 M395 R403	F340-A399 HydrophobicContact CB-CB 3.9Å; M395-A399 WeakPolarHBondContact O-CB 3.25Å; M395-A399 PolarHBondContact O-N 2.9Å; A399-R403 WeakPolarHBondContact O-CB 3.4Å; A399-R403 PolarHBondContact O-N 2.91Å
400	R	93.1	Very high	93.9	Very high	106 Å²	106	52.4 Å²	52.4	40%	0.4	26%	0.26	S	S	.	.	H	α-helix	trans	-65.8	-43.8	173.9	-175.4	-173.2	-56.7	-169.9	2.5	111.7	T396 M397 A398 R403 H404	T396-R400 VanDerWaalsContact O-CB 3.31Å; T396-R400 WeakPolarHBondContact O-CB 3.49Å; T396-R400 PolarHBondContact O-N 3.38Å; T396-R400 VanDerWaalsContact O-N 3.11Å; M397-R400 WeakPolarHBondContact O-CB 3.35Å; M397-R400 PolarHBondContact O-N 3.28Å; A398-R400 PolarHBondContact O-N 3.08Å; R400-R403 PolarHBondContact O-N 2.82Å; R400-H404 WeakPolarHBondContact O-CB 3.28Å; R400-H404 PolarHBondContact O-N 2.84Å
401	A	93.4	Very high	93.7	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-45.2	179	0	0	0	0	0	112.2	M397 A398 H404 N405 V465 L469 V471	M397-A401 PolarHBondContact O-N 3.41Å; A398-A401 WeakPolarHBondContact O-CB 3.27Å; A398-A401 PolarHBondContact O-N 2.83Å; A401-H404 PolarHBondContact O-N 3.25Å; A401-N405 WeakPolarHBondContact O-CB 3.4Å; A401-N405 PolarHBondContact O-N 2.84Å; A401-N405 PolarHBondContact O-ND2 2.9Å; A401-V465 HydrophobicContact CB-CG1 4.02Å; A401-L469 HydrophobicContact CB-CB 4.04Å; A401-L469 WeakPolarHBondContact CB-O 3.27Å; A401-V471 VanDerWaalsContact CA-CG2 3.42Å; A401-V471 HydrophobicContact CB-CG2 3.65Å
402	V	93.8	Very high	93.3	Very high	37 Å²	37	58 Å²	58	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-48.4	173.5	170.5	0	0	0	0	111	A398 H404 I406 R407 V465 L469	A398-V402 WeakPolarHBondContact O-CG2 3.27Å; A398-V402 PolarHBondContact O-N 3.12Å; V402-H404 VanDerWaalsContact C-N 3.29Å; V402-H404 PolarHBondContact O-N 3.4Å; V402-I406 HydrophobicContact CG1-CB 4.29Å; V402-I406 HydrophobicContact CG1-CD1 4.15Å; V402-I406 HydrophobicContact CG2-CD1 4.35Å; V402-I406 WeakPolarHBondContact O-CA 3.22Å; V402-I406 VanDerWaalsContact O-CB 3.3Å; V402-I406 WeakPolarHBondContact O-CB 3.02Å; V402-I406 PolarHBondContact O-N 3.05Å; V402-R407 PolarHBondContact O-N 3.1Å; V402-V465 HydrophobicContact CG2-CG1 3.76Å; V402-L469 HydrophobicContact CG2-CD1 4.42Å
403	R	92.1	Very high	93.2	Very high	69 Å²	69	60 Å²	60	26%	0.26	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-34.8	179	-83.9	-152.1	-173.8	-71.8	16.2	113	T338 S339 A399 R400 R407	T338-R403 VanDerWaalsContact C-NH2 3.31Å; T338-R403 PolarHBondContact O-NH2 2.64Å; T338-R403 VanDerWaalsContact O-NH2 3.16Å; T338-R403 PolarHBondContact OG1-NH2 3.24Å; S339-R403 VanDerWaalsContact OG-CZ 3.29Å; S339-R403 PolarHBondContact OG-NE 2.8Å; S339-R403 VanDerWaalsContact OG-NE 3.11Å; S339-R403 PolarHBondContact OG-NH2 3.21Å; A399-R403 WeakPolarHBondContact O-CB 3.4Å; A399-R403 PolarHBondContact O-N 2.91Å; R400-R403 PolarHBondContact O-N 2.82Å; R403-R407 WeakPolarHBondContact O-CB 3.47Å
404	H	91.4	Very high	93.1	Very high	97 Å²	97	64.9 Å²	64.9	45%	0.449	33%	0.331	S	S	.	.	H	α-helix	trans	-74.2	-46.1	-179.6	-175	59.9	0	0	0	112	R400 A401 V402 V471	R400-H404 WeakPolarHBondContact O-CB 3.28Å; R400-H404 PolarHBondContact O-N 2.84Å; A401-H404 PolarHBondContact O-N 3.25Å; V402-H404 VanDerWaalsContact C-N 3.29Å; V402-H404 PolarHBondContact O-N 3.4Å; H404-V471 HydrophobicContact CB-CG2 4.5Å
405	N	92.2	Very high	93	Very high	47 Å²	47	66.4 Å²	66.4	25%	0.251	34%	0.337	S	S	.	.	H	α-helix	trans	-93.8	-33.5	-170	-67.9	-74.4	0	0	0	113.4	A401 Y409 L469 P470	A401-N405 WeakPolarHBondContact O-CB 3.4Å; A401-N405 PolarHBondContact O-N 2.84Å; A401-N405 PolarHBondContact O-ND2 2.9Å; N405-Y409 WeakPolarHBondContact O-CD2 3.37Å; N405-Y409 WeakPolarHBondContact O-CE2 3.27Å; N405-L469 HydrophobicContact CB-CB 4.38Å; N405-L469 HydrophobicContact CB-CD1 4.37Å; N405-L469 HydrophobicContact CB-CD2 4.11Å; N405-P470 PolarHBondContact ND2-O 3.43Å
406	I	92.3	Very high	92.9	Very high	60 Å²	60	70.7 Å²	70.7	31%	0.308	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-41.9	-171.2	-61.1	179.1	0	0	0	112	V402 P408 Y409 F410 Y420 L469	V402-I406 HydrophobicContact CG1-CB 4.29Å; V402-I406 HydrophobicContact CG1-CD1 4.15Å; V402-I406 HydrophobicContact CG2-CD1 4.35Å; V402-I406 WeakPolarHBondContact O-CA 3.22Å; V402-I406 VanDerWaalsContact O-CB 3.3Å; V402-I406 WeakPolarHBondContact O-CB 3.02Å; V402-I406 PolarHBondContact O-N 3.05Å; I406-P408 VanDerWaalsContact C-N 3.34Å; I406-Y409 WeakPolarHBondContact O-CD2 3.44Å; I406-Y409 PolarHBondContact O-N 3.15Å; I406-F410 HydrophobicContact CG2-CD2 3.99Å; I406-F410 HydrophobicContact CG2-CE2 3.58Å; I406-F410 WeakPolarHBondContact O-CD2 3.35Å; I406-Y420 HydrophobicContact CG2-CE2 4.38Å; I406-L469 HydrophobicContact CD1-CD1 3.79Å; I406-L469 HydrophobicContact CG1-CD1 4.09Å
407	R	92.9	Very high	92.9	Very high	94 Å²	94	73.8 Å²	73.8	36%	0.355	37%	0.369	S	S	.	.	H	α-helix	trans	-51.2	-42.8	-175.4	-170.3	175.5	178.8	-113.8	2.4	114.2	V402 R403 Y409 F410 L411 Y420	V402-R407 PolarHBondContact O-N 3.1Å; R403-R407 WeakPolarHBondContact O-CB 3.47Å; R407-Y409 PolarHBondContact O-N 3.28Å; R407-F410 PolarHBondContact O-N 3.1Å; R407-L411 HydrophobicContact CG-CD1 4.22Å; R407-L411 HydrophobicContact CG-CD2 4.44Å; R407-L411 HydrophobicContact CG-CG 4.22Å; R407-L411 PolarHBondContact O-N 3.03Å; R407-Y420 HydrophobicContact CB-CE1 4.28Å; R407-Y420 HydrophobicContact CB-CE2 4.24Å; R407-Y420 HydrophobicContact CG-CD1 4.46Å; R407-Y420 HydrophobicContact CG-CE1 3.76Å; R407-Y420 HydrophobicContact CG-CE2 4.49Å
408	P	93.3	Very high	93	Very high	71 Å²	71	77.8 Å²	77.8	46%	0.461	38%	0.379	S	S	.	.	H	α-helix	trans	-54.6	-36.2	-177.6	-27.7	37	0	0	0	114	I406 F410 L411	I406-P408 VanDerWaalsContact C-N 3.34Å; P408-F410 PolarHBondContact O-N 3.33Å; P408-L411 PolarHBondContact O-N 3.18Å
409	Y	91.9	Very high	93	Very high	175 Å²	175	81 Å²	81	69%	0.686	40%	0.398	S	S	*	.	H	α-helix	trans	-67.1	-21.9	179.3	-59.5	-68.3	0	0	0	113.7	N405 I406 R407 V412	N405-Y409 WeakPolarHBondContact O-CD2 3.37Å; N405-Y409 WeakPolarHBondContact O-CE2 3.27Å; I406-Y409 WeakPolarHBondContact O-CD2 3.44Å; I406-Y409 PolarHBondContact O-N 3.15Å; R407-Y409 PolarHBondContact O-N 3.28Å; Y409-V412 WeakPolarHBondContact O-CG2 3.41Å
410	F	92.3	Very high	93	Very high	60 Å²	60	80.2 Å²	80.2	26%	0.263	39%	0.389	S	S	.	.	H	α-helix	trans	-97	-6.1	179.5	-69.3	-92.4	0	0	0	113.2	I406 R407 P408 V412 H416 K417 Y420	I406-F410 HydrophobicContact CG2-CD2 3.99Å; I406-F410 HydrophobicContact CG2-CE2 3.58Å; I406-F410 WeakPolarHBondContact O-CD2 3.35Å; R407-F410 PolarHBondContact O-N 3.1Å; P408-F410 PolarHBondContact O-N 3.33Å; F410-V412 VanDerWaalsContact C-N 3.27Å; F410-V412 PolarHBondContact O-N 3.25Å; F410-H416 HydrophobicContact CD1-CB 4.39Å; F410-H416 CarbonylContact O-C 3.58Å; F410-K417 VanDerWaalsContact O-CA 3.29Å; F410-K417 WeakPolarHBondContact O-CA 3.41Å; F410-K417 PolarHBondContact O-N 3.05Å; F410-Y420 HydrophobicContact CB-CD2 3.93Å; F410-Y420 HydrophobicContact CB-CG 3.86Å; F410-Y420 HydrophobicContact CD1-CD2 4.34Å; F410-Y420 AromaticContact CD2-CD2 3.65Å; F410-Y420 HydrophobicContact CD2-CD2 3.65Å; F410-Y420 HydrophobicContact CD2-CE2 4.34Å; F410-Y420 HydrophobicContact CD2-CG 4.41Å; F410-Y420 HydrophobicContact CE2-CD2 4.24Å; F410-Y420 AromaticContact CG-CD2 3.71Å; F410-Y420 HydrophobicContact CG-CD2 3.71Å; F410-Y420 HydrophobicContact CG-CG 4.02Å
411	L	91.9	Very high	93.1	Very high	83 Å²	83	77.2 Å²	77.2	44%	0.435	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	4	177.3	-63.2	179.7	0	0	0	113.4	R407 P408 S413 K417	R407-L411 HydrophobicContact CG-CD1 4.22Å; R407-L411 HydrophobicContact CG-CD2 4.44Å; R407-L411 HydrophobicContact CG-CG 4.22Å; R407-L411 PolarHBondContact O-N 3.03Å; P408-L411 PolarHBondContact O-N 3.18Å; L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 3.01Å; L411-K417 HydrophobicContact CD2-CD 4.3Å; L411-K417 HydrophobicContact CD2-CG 4.19Å
412	V	90.8	Very high	93.3	Very high	122 Å²	122	81.6 Å²	81.6	74%	0.739	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-27.4	-177.7	-176	0	0	0	0	112.2	Y409 F410	Y409-V412 WeakPolarHBondContact O-CG2 3.41Å; F410-V412 VanDerWaalsContact C-N 3.27Å; F410-V412 PolarHBondContact O-N 3.25Å
413	S	93.9	Very high	93.4	Very high	42 Å²	42	84.4 Å²	84.4	29%	0.294	42%	0.42	S	S	.	.	S	Bend	trans	-153.2	159.2	175.4	63	0	0	0	0	112.1	L411 S415 H416 K417	L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 3.01Å; S413-S415 VanDerWaalsContact C-N 3.27Å; S413-S415 PolarHBondContact O-N 3.45Å; S413-S415 PolarHBondContact OG-OG 2.86Å; S413-H416 PolarHBondContact O-N 3.41Å; S413-H416 PolarHBondContact OG-ND1 2.94Å; S413-K417 WeakPolarHBondContact O-CB 3.43Å; S413-K417 PolarHBondContact O-N 3.26Å
414	D	92.8	Very high	93.6	Very high	124 Å²	124	81.9 Å²	81.9	66%	0.663	41%	0.412	S	S	*	.	H	α-helix	trans	-64.3	-28.6	-179.4	-71.4	-34.5	0	0	0	113.6	R418	D414-R418 WeakPolarHBondContact O-CB 3.27Å; D414-R418 VanDerWaalsContact O-CG 3.29Å; D414-R418 WeakPolarHBondContact O-CG 3.25Å; D414-R418 PolarHBondContact O-N 3.49Å; D414-R418 VanDerWaalsContact O-N 3.08Å; D414-R418 PolarHBondContact O-NE 2.87Å
415	S	94	Very high	93.8	Very high	58 Å²	58	81 Å²	81	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-68.9	-49.2	174.5	55	0	0	0	0	111.4	S413 K417 R418 V419	S413-S415 VanDerWaalsContact C-N 3.27Å; S413-S415 PolarHBondContact O-N 3.45Å; S413-S415 PolarHBondContact OG-OG 2.86Å; S415-K417 VanDerWaalsContact C-N 3.3Å; S415-K417 PolarHBondContact O-N 3.06Å; S415-R418 PolarHBondContact O-N 2.69Å; S415-V419 WeakPolarHBondContact O-CG2 3.44Å; S415-V419 PolarHBondContact O-N 2.93Å
416	H	92.4	Very high	94	Very high	100 Å²	100	80.8 Å²	80.8	46%	0.463	41%	0.409	S	S	.	.	H	α-helix	trans	-62.5	-40.1	178.1	-72.4	70.7	0	0	0	111.3	F410 S413 V419 Y420	F410-H416 HydrophobicContact CD1-CB 4.39Å; F410-H416 CarbonylContact O-C 3.58Å; S413-H416 PolarHBondContact O-N 3.41Å; S413-H416 PolarHBondContact OG-ND1 2.94Å; H416-V419 PolarHBondContact O-N 3.36Å; H416-Y420 WeakPolarHBondContact O-CB 3.28Å; H416-Y420 PolarHBondContact O-N 2.93Å
417	K	94.4	Very high	94.2	Very high	83 Å²	83	81.2 Å²	81.2	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-61	-46.5	175.6	-179.6	-174.6	167.7	-163.3	0	111.3	F410 L411 S413 S415 V419 Y420 D421	F410-K417 VanDerWaalsContact O-CA 3.29Å; F410-K417 WeakPolarHBondContact O-CA 3.41Å; F410-K417 PolarHBondContact O-N 3.05Å; L411-K417 HydrophobicContact CD2-CD 4.3Å; L411-K417 HydrophobicContact CD2-CG 4.19Å; S413-K417 WeakPolarHBondContact O-CB 3.43Å; S413-K417 PolarHBondContact O-N 3.26Å; S415-K417 VanDerWaalsContact C-N 3.3Å; S415-K417 PolarHBondContact O-N 3.06Å; K417-V419 VanDerWaalsContact C-N 3.35Å; K417-V419 PolarHBondContact O-N 2.87Å; K417-Y420 WeakPolarHBondContact O-CB 3.33Å; K417-Y420 PolarHBondContact O-N 3.35Å; K417-D421 WeakPolarHBondContact O-CB 3.42Å; K417-D421 VanDerWaalsContact O-CG 3.28Å; K417-D421 PolarHBondContact O-N 3.46Å
418	R	94.5	Very high	94.4	Very high	168 Å²	168	77.3 Å²	77.3	63%	0.634	40%	0.404	S	S	*	.	H	α-helix	trans	-60.6	-43	177.3	-78.5	-175.7	-68.6	162	-3.6	112.2	D414 S415 D421 V422	D414-R418 WeakPolarHBondContact O-CB 3.27Å; D414-R418 VanDerWaalsContact O-CG 3.29Å; D414-R418 WeakPolarHBondContact O-CG 3.25Å; D414-R418 PolarHBondContact O-N 3.49Å; D414-R418 VanDerWaalsContact O-N 3.08Å; D414-R418 PolarHBondContact O-NE 2.87Å; S415-R418 PolarHBondContact O-N 2.69Å; R418-D421 PolarHBondContact O-N 3Å; R418-V422 WeakPolarHBondContact O-CG2 3.44Å; R418-V422 PolarHBondContact O-N 3.4Å
419	V	95.1	Very high	94.6	Very high	77 Å²	77	74 Å²	74	47%	0.467	38%	0.383	S	S	.	.	H	α-helix	trans	-60.2	-47.3	175.5	172.4	0	0	0	0	110.6	S415 H416 K417 D421 V422 I423	S415-V419 WeakPolarHBondContact O-CG2 3.44Å; S415-V419 PolarHBondContact O-N 2.93Å; H416-V419 PolarHBondContact O-N 3.36Å; K417-V419 VanDerWaalsContact C-N 3.35Å; K417-V419 PolarHBondContact O-N 2.87Å; V419-D421 PolarHBondContact O-N 3.37Å; V419-V422 PolarHBondContact O-N 3.02Å; V419-I423 HydrophobicContact CG1-CD1 3.7Å; V419-I423 VanDerWaalsContact O-CG1 3.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.41Å; V419-I423 PolarHBondContact O-N 2.87Å
420	Y	95.3	Very high	94.8	Very high	10 Å²	10	67.5 Å²	67.5	4%	0.039	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-44.9	175.5	177.4	-90.6	0	0	0	112.3	I406 R407 F410 H416 K417 V422 I423 T424	I406-Y420 HydrophobicContact CG2-CE2 4.38Å; R407-Y420 HydrophobicContact CB-CE1 4.28Å; R407-Y420 HydrophobicContact CB-CE2 4.24Å; R407-Y420 HydrophobicContact CG-CD1 4.46Å; R407-Y420 HydrophobicContact CG-CE1 3.76Å; R407-Y420 HydrophobicContact CG-CE2 4.49Å; F410-Y420 HydrophobicContact CB-CD2 3.93Å; F410-Y420 HydrophobicContact CB-CG 3.86Å; F410-Y420 HydrophobicContact CD1-CD2 4.34Å; F410-Y420 AromaticContact CD2-CD2 3.65Å; F410-Y420 HydrophobicContact CD2-CD2 3.65Å; F410-Y420 HydrophobicContact CD2-CE2 4.34Å; F410-Y420 HydrophobicContact CD2-CG 4.41Å; F410-Y420 HydrophobicContact CE2-CD2 4.24Å; F410-Y420 AromaticContact CG-CD2 3.71Å; F410-Y420 HydrophobicContact CG-CD2 3.71Å; F410-Y420 HydrophobicContact CG-CG 4.02Å; H416-Y420 WeakPolarHBondContact O-CB 3.28Å; H416-Y420 PolarHBondContact O-N 2.93Å; K417-Y420 WeakPolarHBondContact O-CB 3.33Å; K417-Y420 PolarHBondContact O-N 3.35Å; Y420-V422 PolarHBondContact O-N 2.9Å; Y420-I423 PolarHBondContact O-N 3.08Å; Y420-T424 HydrophobicContact CD1-CG2 4.13Å; Y420-T424 HydrophobicContact CD2-CG2 4.04Å; Y420-T424 HydrophobicContact CE1-CG2 3.75Å; Y420-T424 HydrophobicContact CE2-CG2 3.66Å; Y420-T424 HydrophobicContact CG-CG2 4.26Å; Y420-T424 VanDerWaalsContact O-CB 3.31Å; Y420-T424 WeakPolarHBondContact O-CB 3.36Å; Y420-T424 WeakPolarHBondContact O-CG2 3.38Å; Y420-T424 PolarHBondContact O-N 3Å; Y420-T424 PolarHBondContact O-OG1 3.33Å
421	D	95.3	Very high	95.1	Very high	43 Å²	43	65.3 Å²	65.3	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-40.9	-178.9	-72.8	-22.3	0	0	0	111.2	T338 K417 R418 V419 T424 W425	T338-D421 HydrophobicContact CG2-CB 4.13Å; K417-D421 WeakPolarHBondContact O-CB 3.42Å; K417-D421 VanDerWaalsContact O-CG 3.28Å; K417-D421 PolarHBondContact O-N 3.46Å; R418-D421 PolarHBondContact O-N 3Å; V419-D421 PolarHBondContact O-N 3.37Å; D421-T424 PolarHBondContact O-OG1 3.23Å; D421-W425 WeakPolarHBondContact O-CB 3.46Å; D421-W425 PolarHBondContact O-N 3.35Å
422	V	96.6	Very high	95.3	Very high	93 Å²	93	61.9 Å²	61.9	56%	0.564	34%	0.336	S	S	*	.	H	α-helix	trans	-65	-47.7	175.3	172	0	0	0	0	111.6	R418 V419 Y420 W425 A426	R418-V422 WeakPolarHBondContact O-CG2 3.44Å; R418-V422 PolarHBondContact O-N 3.4Å; V419-V422 PolarHBondContact O-N 3.02Å; Y420-V422 PolarHBondContact O-N 2.9Å; V422-W425 PolarHBondContact O-N 2.87Å; V422-A426 PolarHBondContact O-N 2.98Å
423	I	95.9	Very high	95.6	Very high	96 Å²	96	56.2 Å²	56.2	49%	0.492	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-45.7	-179.6	-68.1	169.8	0	0	0	110.7	V419 Y420 A426 S427	V419-I423 HydrophobicContact CG1-CD1 3.7Å; V419-I423 VanDerWaalsContact O-CG1 3.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.41Å; V419-I423 PolarHBondContact O-N 2.87Å; Y420-I423 PolarHBondContact O-N 3.08Å; I423-A426 PolarHBondContact O-N 3.18Å; I423-S427 VanDerWaalsContact O-CB 3.3Å; I423-S427 WeakPolarHBondContact O-CB 3.21Å; I423-S427 PolarHBondContact O-N 3.17Å; I423-S427 PolarHBondContact O-OG 3.33Å
424	T	95.7	Very high	95.8	Very high	16 Å²	16	54.2 Å²	54.2	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-73.4	-29.6	-178.9	55.6	0	0	0	0	112.8	T338 Y420 D421 T428	T338-T424 WeakPolarHBondContact O-CB 3.26Å; T338-T424 PolarHBondContact O-OG1 3.12Å; Y420-T424 HydrophobicContact CD1-CG2 4.13Å; Y420-T424 HydrophobicContact CD2-CG2 4.04Å; Y420-T424 HydrophobicContact CE1-CG2 3.75Å; Y420-T424 HydrophobicContact CE2-CG2 3.66Å; Y420-T424 HydrophobicContact CG-CG2 4.26Å; Y420-T424 VanDerWaalsContact O-CB 3.31Å; Y420-T424 WeakPolarHBondContact O-CB 3.36Å; Y420-T424 WeakPolarHBondContact O-CG2 3.38Å; Y420-T424 PolarHBondContact O-N 3Å; Y420-T424 PolarHBondContact O-OG1 3.33Å; D421-T424 PolarHBondContact O-OG1 3.23Å; T424-T428 WeakPolarHBondContact O-CB 3.38Å; T424-T428 PolarHBondContact O-N 3.33Å; T424-T428 PolarHBondContact O-OG1 2.95Å
425	W	97.2	Very high	96	Very high	80 Å²	80	48.5 Å²	48.5	30%	0.303	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-56.7	167.2	167.4	75.6	0	0	0	111	E335 T338 D421 V422 S427 T428 Q429	E335-W425 PolarHBondContact O-NE1 3.23Å; T338-W425 HydrophobicContact CG2-CB 4.32Å; D421-W425 WeakPolarHBondContact O-CB 3.46Å; D421-W425 PolarHBondContact O-N 3.35Å; V422-W425 PolarHBondContact O-N 2.87Å; W425-S427 VanDerWaalsContact C-N 3.32Å; W425-S427 PolarHBondContact O-N 2.81Å; W425-T428 WeakPolarHBondContact O-CB 3.16Å; W425-T428 PolarHBondContact O-N 3.43Å; W425-T428 VanDerWaalsContact O-N 3.08Å; W425-Q429 WeakPolarHBondContact O-CG 3.34Å; W425-Q429 PolarHBondContact O-N 3.2Å
426	A	96.5	Very high	96.1	Very high	41 Å²	41	47.7 Å²	47.7	34%	0.339	25%	0.25	S	S	.	.	H	α-helix	trans	-58.3	-45.9	-179	0	0	0	0	0	111.5	V422 I423 T428 Q429 V430	V422-A426 PolarHBondContact O-N 2.98Å; I423-A426 PolarHBondContact O-N 3.18Å; A426-T428 VanDerWaalsContact C-N 3.33Å; A426-T428 PolarHBondContact O-N 2.99Å; A426-Q429 PolarHBondContact O-N 3.05Å; A426-V430 WeakPolarHBondContact O-CG2 3.02Å; A426-V430 PolarHBondContact O-N 2.95Å; A426-V430 VanDerWaalsContact O-N 3.1Å
427	S	96	Very high	96.3	Very high	70 Å²	70	42.9 Å²	42.9	49%	0.49	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-37.2	177.6	-62	0	0	0	0	112.4	I423 W425 A431	I423-S427 VanDerWaalsContact O-CB 3.3Å; I423-S427 WeakPolarHBondContact O-CB 3.21Å; I423-S427 PolarHBondContact O-N 3.17Å; I423-S427 PolarHBondContact O-OG 3.33Å; W425-S427 VanDerWaalsContact C-N 3.32Å; W425-S427 PolarHBondContact O-N 2.81Å; S427-A431 WeakPolarHBondContact O-CB 2.93Å; S427-A431 PolarHBondContact O-N 3.26Å
428	T	96.8	Very high	96.4	Very high	11 Å²	11	39 Å²	39	7%	0.067	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-46.1	176.8	-66.4	0	0	0	0	111.5	A337 S339 T424 W425 A426 V430 A431 I432	A337-T428 HydrophobicContact CB-CG2 4.27Å; A337-T428 WeakPolarHBondContact O-CB 3.03Å; A337-T428 WeakPolarHBondContact O-CG2 3.42Å; S339-T428 WeakPolarHBondContact CA-OG1 3.25Å; S339-T428 PolarHBondContact N-OG1 3.39Å; T424-T428 WeakPolarHBondContact O-CB 3.38Å; T424-T428 PolarHBondContact O-N 3.33Å; T424-T428 PolarHBondContact O-OG1 2.95Å; W425-T428 WeakPolarHBondContact O-CB 3.16Å; W425-T428 PolarHBondContact O-N 3.43Å; W425-T428 VanDerWaalsContact O-N 3.08Å; A426-T428 VanDerWaalsContact C-N 3.33Å; A426-T428 PolarHBondContact O-N 2.99Å; T428-V430 PolarHBondContact O-N 2.79Å; T428-A431 PolarHBondContact O-N 3.04Å; T428-I432 HydrophobicContact CG2-CG1 4.35Å; T428-I432 WeakPolarHBondContact O-CB 3.5Å; T428-I432 WeakPolarHBondContact O-CG1 3.37Å; T428-I432 PolarHBondContact O-N 3.26Å
429	Q	97.1	Very high	96.4	Very high	3 Å²	3	32.7 Å²	32.7	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-45.2	-179.9	-65.4	-56.5	-36.2	0	0	110.9	Y284 I334 E335 W425 A426 I432 C433	Y284-Q429 HydrophobicContact CD2-CB 3.97Å; Y284-Q429 HydrophobicContact CE2-CB 3.71Å; Y284-Q429 HydrophobicContact CE2-CG 4Å; I334-Q429 PolarHBondContact O-NE2 2.99Å; I334-Q429 VanDerWaalsContact O-NE2 3.14Å; E335-Q429 PolarHBondContact O-NE2 3.4Å; W425-Q429 WeakPolarHBondContact O-CG 3.34Å; W425-Q429 PolarHBondContact O-N 3.2Å; A426-Q429 PolarHBondContact O-N 3.05Å; Q429-I432 PolarHBondContact O-N 3.23Å; Q429-C433 WeakPolarHBondContact O-CB 3.12Å; Q429-C433 PolarHBondContact O-N 2.9Å; Q429-C433 PolarHBondContact O-SG 3.02Å
430	V	97	Very high	96.3	Very high	37 Å²	37	29.9 Å²	29.9	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-45.6	175.8	176	0	0	0	0	111.3	V280 A426 T428 I432 C433 Y434 W454 L458	V280-V430 HydrophobicContact CG1-CG1 4.16Å; V280-V430 HydrophobicContact CG1-CG2 3.8Å; A426-V430 WeakPolarHBondContact O-CG2 3.02Å; A426-V430 PolarHBondContact O-N 2.95Å; A426-V430 VanDerWaalsContact O-N 3.1Å; T428-V430 PolarHBondContact O-N 2.79Å; V430-I432 VanDerWaalsContact C-N 3.35Å; V430-I432 PolarHBondContact O-N 3.39Å; V430-C433 PolarHBondContact O-N 2.87Å; V430-Y434 WeakPolarHBondContact O-CB 3.47Å; V430-Y434 PolarHBondContact O-N 3.23Å; V430-W454 HydrophobicContact CG1-CZ3 4.37Å; V430-L458 HydrophobicContact CG1-CD1 4.33Å
431	A	97.3	Very high	96.2	Very high	15 Å²	15	30.7 Å²	30.7	12%	0.124	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-40.1	179.5	0	0	0	0	0	112.8	F340 M395 S427 T428 T435	F340-A431 HydrophobicContact CD2-CB 4.46Å; M395-A431 HydrophobicContact SD-CB 4.06Å; S427-A431 WeakPolarHBondContact O-CB 2.93Å; S427-A431 PolarHBondContact O-N 3.26Å; T428-A431 PolarHBondContact O-N 3.04Å; A431-T435 WeakPolarHBondContact O-CB 3.21Å; A431-T435 PolarHBondContact O-N 2.64Å; A431-T435 PolarHBondContact O-OG1 2.91Å
432	I	97.1	Very high	95.9	Very high	10 Å²	10	29.5 Å²	29.5	5%	0.051	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-49.2	174.4	-72.7	-77	0	0	0	110.4	F340 F343 T428 Q429 V430 Y434 T435 V436	F340-I432 HydrophobicContact CD2-CD1 3.52Å; F340-I432 HydrophobicContact CD2-CG1 3.85Å; F340-I432 HydrophobicContact CE2-CD1 3.3Å; F340-I432 HydrophobicContact CE2-CG1 3.88Å; F340-I432 HydrophobicContact CG-CD1 4.24Å; F340-I432 HydrophobicContact CZ-CD1 3.85Å; F343-I432 HydrophobicContact CB-CD1 4.07Å; F343-I432 HydrophobicContact CB-CG1 4.27Å; F343-I432 HydrophobicContact CD1-CD1 3.59Å; F343-I432 HydrophobicContact CD1-CG1 4.15Å; F343-I432 HydrophobicContact CD1-CG2 4.38Å; F343-I432 HydrophobicContact CD2-CD1 4.29Å; F343-I432 HydrophobicContact CD2-CG1 3.94Å; F343-I432 HydrophobicContact CD2-CG2 4.37Å; F343-I432 HydrophobicContact CE1-CD1 4.08Å; F343-I432 HydrophobicContact CE1-CG2 3.91Å; F343-I432 HydrophobicContact CE2-CB 4.43Å; F343-I432 HydrophobicContact CE2-CG1 4.27Å; F343-I432 HydrophobicContact CE2-CG2 3.85Å; F343-I432 HydrophobicContact CG-CD1 3.73Å; F343-I432 HydrophobicContact CG-CG1 3.87Å; F343-I432 HydrophobicContact CZ-CG2 3.62Å; T428-I432 HydrophobicContact CG2-CG1 4.35Å; T428-I432 WeakPolarHBondContact O-CB 3.5Å; T428-I432 WeakPolarHBondContact O-CG1 3.37Å; T428-I432 PolarHBondContact O-N 3.26Å; Q429-I432 PolarHBondContact O-N 3.23Å; V430-I432 VanDerWaalsContact C-N 3.35Å; V430-I432 PolarHBondContact O-N 3.39Å; I432-Y434 VanDerWaalsContact C-N 3.35Å; I432-Y434 PolarHBondContact O-N 2.69Å; I432-T435 PolarHBondContact O-N 3.4Å; I432-T435 VanDerWaalsContact O-N 3.14Å; I432-V436 HydrophobicContact CG2-CG2 4.27Å; I432-V436 WeakPolarHBondContact O-CB 3.39Å; I432-V436 VanDerWaalsContact O-CG2 3.28Å; I432-V436 WeakPolarHBondContact O-CG2 3.33Å; I432-V436 PolarHBondContact O-N 3.17Å
433	C	97.1	Very high	95.6	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.02	15%	0.15	C	C	.	.	H	α-helix	trans	-57.3	-50.4	-180	-66.2	0	0	0	0	110.8	L283 M287 Q429 V430 T435 V436 V437	L283-C433 HydrophobicContact CD2-CB 4.1Å; L283-C433 HydrophobicContact CG-CB 3.96Å; M287-C433 HydrophobicContact CB-CB 4.23Å; M287-C433 VanDerWaalsContact CB-SG 3.56Å; M287-C433 HydrophobicContact CG-CB 3.86Å; Q429-C433 WeakPolarHBondContact O-CB 3.12Å; Q429-C433 PolarHBondContact O-N 2.9Å; Q429-C433 PolarHBondContact O-SG 3.02Å; V430-C433 PolarHBondContact O-N 2.87Å; C433-T435 VanDerWaalsContact C-N 3.3Å; C433-T435 PolarHBondContact O-N 3.01Å; C433-V436 PolarHBondContact O-N 3.4Å; C433-V437 WeakPolarHBondContact O-CG2 3.41Å; C433-V437 PolarHBondContact O-N 3.43Å
434	Y	97.5	Very high	95.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-42	176.1	-177.1	-92.1	0	0	0	113.1	T391 M395 V430 I432 V436 F450 Y451 W454 L458 H459	T391-Y434 HydrophobicContact CG2-CD1 4.43Å; T391-Y434 HydrophobicContact CG2-CE1 4.42Å; M395-Y434 HydrophobicContact CE-CD1 3.71Å; M395-Y434 HydrophobicContact CE-CE1 4.09Å; V430-Y434 WeakPolarHBondContact O-CB 3.47Å; V430-Y434 PolarHBondContact O-N 3.23Å; I432-Y434 VanDerWaalsContact C-N 3.35Å; I432-Y434 PolarHBondContact O-N 2.69Å; Y434-V436 VanDerWaalsContact C-N 3.34Å; Y434-V436 PolarHBondContact O-N 2.94Å; Y434-F450 AromaticContact CD2-CE1 3.6Å; Y434-F450 HydrophobicContact CD2-CE1 3.6Å; Y434-F450 AromaticContact CD2-CZ 3.75Å; Y434-F450 HydrophobicContact CD2-CZ 3.75Å; Y434-F450 AromaticContact CE2-CE1 3.8Å; Y434-F450 HydrophobicContact CE2-CE1 3.8Å; Y434-F450 HydrophobicContact CE2-CZ 4.21Å; Y434-F450 HydrophobicContact CG-CE1 4.19Å; Y434-F450 HydrophobicContact CG-CZ 4.5Å; Y434-Y451 HydrophobicContact CD1-CE1 4.18Å; Y434-Y451 AromaticContact CE1-CD1 3.91Å; Y434-Y451 HydrophobicContact CE1-CD1 3.91Å; Y434-Y451 AromaticContact CE1-CE1 3.63Å; Y434-Y451 HydrophobicContact CE1-CE1 3.63Å; Y434-Y451 AromaticContact CE2-CD1 3.95Å; Y434-Y451 HydrophobicContact CE2-CD1 3.95Å; Y434-Y451 HydrophobicContact CE2-CE1 4.29Å; Y434-Y451 AromaticContact CZ-CD1 3.45Å; Y434-Y451 VanDerWaalsContact CZ-CD1 3.45Å; Y434-Y451 AromaticContact CZ-CE1 3.68Å; Y434-Y451 VanDerWaalsContact OH-CD1 3.28Å; Y434-Y451 WeakPolarHBondContact OH-CD1 3.37Å; Y434-W454 HydrophobicContact CD2-CD2 4.03Å; Y434-W454 AromaticContact CD2-CE3 3.71Å; Y434-W454 HydrophobicContact CD2-CE3 3.71Å; Y434-W454 HydrophobicContact CD2-CG 4.38Å; Y434-W454 HydrophobicContact CD2-CZ3 4.23Å; Y434-W454 HydrophobicContact CE2-CB 3.72Å; Y434-W454 HydrophobicContact CE2-CD2 4.11Å; Y434-W454 AromaticContact CE2-CE3 3.99Å; Y434-W454 HydrophobicContact CE2-CE3 3.99Å; Y434-W454 HydrophobicContact CE2-CG 4.02Å; Y434-L458 HydrophobicContact CD1-CB 3.99Å; Y434-L458 HydrophobicContact CD1-CD1 3.92Å; Y434-L458 HydrophobicContact CD1-CG 4.47Å; Y434-L458 HydrophobicContact CD2-CD1 4.07Å; Y434-L458 HydrophobicContact CE1-CB 3.94Å; Y434-L458 HydrophobicContact CG-CB 4.39Å; Y434-L458 HydrophobicContact CG-CD1 3.6Å; Y434-L458 HydrophobicContact CG-CG 4.38Å; Y434-H459 AromaticContact CE1-CE1 3.42Å; Y434-H459 VanDerWaalsContact CE1-CE1 3.42Å; Y434-H459 WeakPolarHBondContact CE1-CE1 3.39Å; Y434-H459 AromaticContact CE1-ND1 3.64Å; Y434-H459 AromaticContact CZ-CE1 3.76Å; Y434-H459 AromaticContact CZ-ND1 3.75Å; Y434-H459 PolarHBondContact OH-CE1 2.91Å; Y434-H459 VanDerWaalsContact OH-CE1 3.26Å; Y434-H459 PolarHBondContact OH-ND1 3.49Å
435	T	97.6	Very high	95.4	Very high	5 Å²	5	26 Å²	26	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-36.5	180	-59.3	0	0	0	0	112.1	F340 T388 T391 M395 A431 I432 C433 P438	F340-T435 HydrophobicContact CZ-CG2 4.16Å; T388-T435 WeakPolarHBondContact CA-O 3.32Å; T388-T435 HydrophobicContact CG2-CG2 4.17Å; T388-T435 WeakPolarHBondContact CG2-O 3.46Å; T388-T435 WeakPolarHBondContact O-CG2 3.35Å; T388-T435 PolarHBondContact OG1-O 2.86Å; T391-T435 HydrophobicContact CG2-CG2 4.11Å; M395-T435 WeakPolarHBondContact CG-OG1 3.23Å; A431-T435 WeakPolarHBondContact O-CB 3.21Å; A431-T435 PolarHBondContact O-N 2.64Å; A431-T435 PolarHBondContact O-OG1 2.91Å; I432-T435 PolarHBondContact O-N 3.4Å; I432-T435 VanDerWaalsContact O-N 3.14Å; C433-T435 VanDerWaalsContact C-N 3.3Å; C433-T435 PolarHBondContact O-N 3.01Å; T435-P438 WeakPolarHBondContact O-CD 3.39Å
436	V	96.4	Very high	95.3	Very high	40 Å²	40	24.5 Å²	24.5	24%	0.242	17%	0.165	C	C	.	.	H	α-helix	trans	-88.9	-15.5	-170.7	177.5	0	0	0	0	112.8	M287 I432 C433 Y434 F439 V440	M287-V436 HydrophobicContact CE-CB 3.83Å; M287-V436 HydrophobicContact CE-CG1 3.45Å; M287-V436 VanDerWaalsContact CE-CG1 3.45Å; I432-V436 HydrophobicContact CG2-CG2 4.27Å; I432-V436 WeakPolarHBondContact O-CB 3.39Å; I432-V436 VanDerWaalsContact O-CG2 3.28Å; I432-V436 WeakPolarHBondContact O-CG2 3.33Å; I432-V436 PolarHBondContact O-N 3.17Å; C433-V436 PolarHBondContact O-N 3.4Å; Y434-V436 VanDerWaalsContact C-N 3.34Å; Y434-V436 PolarHBondContact O-N 2.94Å; V436-F439 HydrophobicContact CG1-CB 4.06Å; V436-F439 WeakPolarHBondContact O-CA 3.47Å; V436-F439 WeakPolarHBondContact O-CB 3.5Å; V436-F439 PolarHBondContact O-N 3.23Å; V436-V440 HydrophobicContact CG1-CG2 4.27Å; V436-V440 PolarHBondContact O-N 3.48Å
437	V	96	Very high	95.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-50.2	-48.7	178.6	168	0	0	0	0	113.3	L283 C433 F439 V440 L441 F450	L283-V437 HydrophobicContact CD1-CG2 3.39Å; L283-V437 HydrophobicContact CD2-CG2 4.44Å; C433-V437 WeakPolarHBondContact O-CG2 3.41Å; C433-V437 PolarHBondContact O-N 3.43Å; V437-F439 PolarHBondContact O-N 3.41Å; V437-V440 PolarHBondContact O-N 3.03Å; V437-L441 HydrophobicContact CG1-CD1 3.5Å; V437-L441 VanDerWaalsContact CG1-CD1 3.5Å; V437-L441 HydrophobicContact CG1-CG 3.99Å; V437-L441 WeakPolarHBondContact O-CG 3.37Å; V437-L441 PolarHBondContact O-N 3.31Å; V437-F450 HydrophobicContact CB-CD1 3.82Å; V437-F450 HydrophobicContact CB-CE1 3.71Å; V437-F450 HydrophobicContact CB-CE2 4.43Å; V437-F450 HydrophobicContact CB-CG 4.25Å; V437-F450 HydrophobicContact CB-CZ 4.05Å; V437-F450 HydrophobicContact CG1-CB 4.07Å; V437-F450 HydrophobicContact CG1-CD1 3.57Å; V437-F450 HydrophobicContact CG1-CD2 3.87Å; V437-F450 HydrophobicContact CG1-CE1 3.95Å; V437-F450 HydrophobicContact CG1-CE2 4.21Å; V437-F450 HydrophobicContact CG1-CG 3.54Å; V437-F450 HydrophobicContact CG1-CZ 4.27Å; V437-F450 HydrophobicContact CG2-CD1 4.34Å; V437-F450 HydrophobicContact CG2-CD2 4.43Å; V437-F450 HydrophobicContact CG2-CE1 3.86Å; V437-F450 HydrophobicContact CG2-CE2 3.95Å; V437-F450 HydrophobicContact CG2-CZ 3.66Å
438	P	96.4	Very high	95.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-31.1	176.6	-22.5	32.8	0	0	0	113.9	G384 L387 T435 V440 L441 L442 S447 Y451	G384-P438 CarbonylContact C-O 3.51Å; G384-P438 WeakPolarHBondContact CA-O 3.3Å; G384-P438 CarbonylContact O-C 3.58Å; G384-P438 WeakPolarHBondContact O-CB 3.1Å; L387-P438 HydrophobicContact CB-CB 3.81Å; L387-P438 HydrophobicContact CB-CG 4.16Å; L387-P438 HydrophobicContact CD1-CB 4.41Å; T435-P438 WeakPolarHBondContact O-CD 3.39Å; P438-V440 PolarHBondContact O-N 3.36Å; P438-L441 PolarHBondContact O-N 3.07Å; P438-L442 PolarHBondContact O-N 3.35Å; P438-S447 WeakPolarHBondContact CA-OG 3.48Å; P438-S447 WeakPolarHBondContact CB-OG 3.19Å; P438-Y451 HydrophobicContact CG-CE1 4.06Å; P438-Y451 HydrophobicContact CG-CE2 4.02Å; P438-Y451 VanDerWaalsContact CG-CZ 3.48Å; P438-Y451 WeakPolarHBondContact CG-OH 3.49Å
439	F	95.1	Very high	95.2	Very high	36 Å²	36	26.2 Å²	26.2	16%	0.158	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-36.8	176.4	-167.3	-82.5	0	0	0	110.9	H379 Y385 T388 F389 V436 V437 L442	H379-F439 HydrophobicContact CB-CE2 4.32Å; H379-F439 AromaticContact CD2-CE2 3.52Å; H379-F439 AromaticContact CD2-CZ 3.39Å; H379-F439 WeakPolarHBondContact CD2-CZ 3.5Å; H379-F439 AromaticContact CG-CE2 3.81Å; H379-F439 AromaticContact NE2-CE2 3.83Å; H379-F439 AromaticContact NE2-CZ 3.79Å; Y385-F439 HydrophobicContact CD1-CD1 4.42Å; Y385-F439 AromaticContact CD1-CD2 3.43Å; Y385-F439 HydrophobicContact CD1-CD2 3.43Å; Y385-F439 VanDerWaalsContact CD1-CD2 3.43Å; Y385-F439 HydrophobicContact CD1-CE1 4.48Å; Y385-F439 AromaticContact CD1-CE2 3.5Å; Y385-F439 HydrophobicContact CD1-CE2 3.5Å; Y385-F439 VanDerWaalsContact CD1-CE2 3.5Å; Y385-F439 AromaticContact CD1-CG 3.92Å; Y385-F439 HydrophobicContact CD1-CG 3.92Å; Y385-F439 HydrophobicContact CD1-CZ 4.05Å; Y385-F439 HydrophobicContact CE1-CD1 4.11Å; Y385-F439 AromaticContact CE1-CD2 3.88Å; Y385-F439 HydrophobicContact CE1-CD2 3.88Å; Y385-F439 AromaticContact CE1-CE1 3.94Å; Y385-F439 HydrophobicContact CE1-CE1 3.94Å; Y385-F439 AromaticContact CE1-CE2 3.7Å; Y385-F439 HydrophobicContact CE1-CE2 3.7Å; Y385-F439 HydrophobicContact CE1-CG 4.07Å; Y385-F439 AromaticContact CE1-CZ 3.73Å; Y385-F439 HydrophobicContact CE1-CZ 3.73Å; Y385-F439 HydrophobicContact CG-CD2 4.46Å; Y385-F439 HydrophobicContact CG-CE2 4.41Å; T388-F439 HydrophobicContact CG2-CB 4.02Å; T388-F439 HydrophobicContact CG2-CD2 4.18Å; T388-F439 WeakPolarHBondContact OG1-CA 3.33Å; T388-F439 WeakPolarHBondContact OG1-CB 3.35Å; T388-F439 PolarHBondContact OG1-N 3.06Å; F389-F439 HydrophobicContact CE2-CD2 4.2Å; F389-F439 HydrophobicContact CE2-CE2 4.04Å; F389-F439 HydrophobicContact CZ-CD2 4.41Å; F389-F439 HydrophobicContact CZ-CE2 4.09Å; V436-F439 HydrophobicContact CG1-CB 4.06Å; V436-F439 WeakPolarHBondContact O-CA 3.47Å; V436-F439 WeakPolarHBondContact O-CB 3.5Å; V436-F439 PolarHBondContact O-N 3.23Å; V437-F439 PolarHBondContact O-N 3.41Å; F439-L442 WeakPolarHBondContact O-CD2 3.46Å
440	V	92.9	Very high	95.2	Very high	18 Å²	18	26 Å²	26	11%	0.109	16%	0.158	C	C	.	.	H	α-helix	trans	-79.6	-40.5	178.4	-176.2	0	0	0	0	110.9	Y129 V262 M287 L290 V436 V437 P438	Y129-V440 PolarHBondContact OH-O 3.39Å; V262-V440 HydrophobicContact CB-CG1 4.06Å; V262-V440 HydrophobicContact CG1-CB 4.3Å; V262-V440 HydrophobicContact CG1-CG1 4.06Å; V262-V440 HydrophobicContact CG2-CG1 4.3Å; M287-V440 HydrophobicContact CE-CG2 4.13Å; M287-V440 HydrophobicContact SD-CG2 4.34Å; L290-V440 HydrophobicContact CD2-CB 4.32Å; L290-V440 HydrophobicContact CD2-CG1 3.78Å; L290-V440 HydrophobicContact CD2-CG2 3.49Å; L290-V440 VanDerWaalsContact CD2-CG2 3.49Å; V436-V440 HydrophobicContact CG1-CG2 4.27Å; V436-V440 PolarHBondContact O-N 3.48Å; V437-V440 PolarHBondContact O-N 3.03Å; P438-V440 PolarHBondContact O-N 3.36Å
441	L	91.9	Very high	95.2	Very high	28 Å²	28	24.5 Å²	24.5	15%	0.147	15%	0.148	C	C	.	.	H	α-helix	trans	-76.1	-20.7	-177.7	-64.8	178.8	0	0	0	114	I266 V437 P438 A443 P446	I266-L441 HydrophobicContact CD1-CD1 4.13Å; I266-L441 HydrophobicContact CD1-CD2 4.02Å; I266-L441 HydrophobicContact CG2-CD1 4.06Å; V437-L441 HydrophobicContact CG1-CD1 3.5Å; V437-L441 VanDerWaalsContact CG1-CD1 3.5Å; V437-L441 HydrophobicContact CG1-CG 3.99Å; V437-L441 WeakPolarHBondContact O-CG 3.37Å; V437-L441 PolarHBondContact O-N 3.31Å; P438-L441 PolarHBondContact O-N 3.07Å; L441-A443 PolarHBondContact O-N 2.91Å; L441-P446 HydrophobicContact CB-CB 4.17Å; L441-P446 HydrophobicContact CD1-CB 3.96Å; L441-P446 HydrophobicContact CG-CB 4.47Å
442	L	90.7	Very high	95.1	Very high	18 Å²	18	27.1 Å²	27.1	9%	0.094	17%	0.165	C	C	.	.			trans	63.1	-30.2	178.1	-57.8	173.9	0	0	0	116.5	Y382 G384 Y385 P438 F439	Y382-L442 HydrophobicContact CD1-CB 3.82Å; Y382-L442 HydrophobicContact CD1-CD1 4.43Å; Y382-L442 HydrophobicContact CD1-CG 4.49Å; Y382-L442 HydrophobicContact CD2-CD2 4.35Å; Y382-L442 HydrophobicContact CE1-CB 4.44Å; Y382-L442 HydrophobicContact CE1-CD1 4.38Å; Y382-L442 HydrophobicContact CG-CB 4.15Å; Y382-L442 HydrophobicContact CG-CD2 4.08Å; G384-L442 PolarHBondContact N-O 3.08Å; Y385-L442 HydrophobicContact CD1-CD2 4.38Å; Y385-L442 HydrophobicContact CE1-CD2 3.55Å; P438-L442 PolarHBondContact O-N 3.35Å; F439-L442 WeakPolarHBondContact O-CD2 3.46Å
443	A	89.9	Confident	94.9	Very high	17 Å²	17	27.6 Å²	27.6	14%	0.14	17%	0.17	C	C	.	.	S	Bend	trans	-104.5	149.9	-171.8	0	0	0	0	0	113.6	Y126 L441 P446 S447	Y126-A443 HydrophobicContact CE1-CB 4.08Å; Y126-A443 WeakPolarHBondContact OH-CA 3.01Å; L441-A443 PolarHBondContact O-N 2.91Å; A443-P446 HydrophobicContact CB-CG 4.05Å; A443-S447 VanDerWaalsContact O-CB 3.26Å; A443-S447 WeakPolarHBondContact O-CB 3.22Å; A443-S447 PolarHBondContact O-N 3.39Å; A443-S447 PolarHBondContact O-OG 2.99Å
444	V	92.4	Very high	94.8	Very high	66 Å²	66	27.8 Å²	27.8	40%	0.4	17%	0.17	S	C	.	.	H	α-helix	trans	-63.1	-50.4	-179.6	-179.1	0	0	0	0	112	P383 S447 L448	P383-V444 HydrophobicContact CB-CG2 3.21Å; P383-V444 HydrophobicContact CG-CG2 3.72Å; V444-S447 PolarHBondContact O-N 3.49Å; V444-L448 HydrophobicContact CG1-CD1 3.57Å; V444-L448 HydrophobicContact CG1-CG 3.92Å; V444-L448 WeakPolarHBondContact O-CG 3.27Å; V444-L448 PolarHBondContact O-N 3.17Å
445	G	94.6	Very high	94.7	Very high	49 Å²	49	36.3 Å²	36.3	51%	0.505	20%	0.203	S	C	.	.	H	α-helix	trans	-56.2	-58.8	-174.9	0	0	0	0	0	112.9	S447 L448 K449	G445-S447 VanDerWaalsContact C-N 3.29Å; G445-S447 PolarHBondContact O-N 3.4Å; G445-L448 PolarHBondContact O-N 2.95Å; G445-K449 WeakPolarHBondContact O-CB 3.48Å; G445-K449 PolarHBondContact O-N 3.37Å
446	P	94.2	Very high	94.6	Very high	47 Å²	47	40 Å²	40	31%	0.305	22%	0.219	S	C	.	.	H	α-helix	trans	-54.3	-41	173.9	-30.5	38.7	0	0	0	113.7	I266 L441 A443 K449 F450	I266-P446 HydrophobicContact CD1-CB 3.65Å; L441-P446 HydrophobicContact CB-CB 4.17Å; L441-P446 HydrophobicContact CD1-CB 3.96Å; L441-P446 HydrophobicContact CG-CB 4.47Å; A443-P446 HydrophobicContact CB-CG 4.05Å; P446-K449 WeakPolarHBondContact O-CB 3.44Å; P446-K449 PolarHBondContact O-N 3.02Å; P446-F450 PolarHBondContact O-N 3.47Å
447	S	96.1	Very high	94.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-42.1	179.9	-58.8	0	0	0	0	112.9	L387 P438 A443 V444 G445 F450 Y451	L387-S447 VanDerWaalsContact CD1-CB 3.46Å; P438-S447 WeakPolarHBondContact CA-OG 3.48Å; P438-S447 WeakPolarHBondContact CB-OG 3.19Å; A443-S447 VanDerWaalsContact O-CB 3.26Å; A443-S447 WeakPolarHBondContact O-CB 3.22Å; A443-S447 PolarHBondContact O-N 3.39Å; A443-S447 PolarHBondContact O-OG 2.99Å; V444-S447 PolarHBondContact O-N 3.49Å; G445-S447 VanDerWaalsContact C-N 3.29Å; G445-S447 PolarHBondContact O-N 3.4Å; S447-F450 WeakPolarHBondContact O-CB 3.41Å; S447-F450 PolarHBondContact O-N 2.9Å; S447-Y451 PolarHBondContact O-N 3.48Å
448	L	96.1	Very high	94.6	Very high	78 Å²	78	41.5 Å²	41.5	41%	0.408	23%	0.228	S	C	.	.	H	α-helix	trans	-71	-33.9	176.2	-68.6	-177.6	0	0	0	111.6	V444 G445 F450 Y451 S452	V444-L448 HydrophobicContact CG1-CD1 3.57Å; V444-L448 HydrophobicContact CG1-CG 3.92Å; V444-L448 WeakPolarHBondContact O-CG 3.27Å; V444-L448 PolarHBondContact O-N 3.17Å; G445-L448 PolarHBondContact O-N 2.95Å; L448-F450 VanDerWaalsContact C-N 3.35Å; L448-Y451 HydrophobicContact CD2-CD2 4.45Å; L448-Y451 PolarHBondContact O-N 2.84Å; L448-S452 VanDerWaalsContact O-CB 3.27Å; L448-S452 WeakPolarHBondContact O-CB 3.36Å; L448-S452 PolarHBondContact O-N 2.9Å
449	K	95.8	Very high	94.6	Very high	80 Å²	80	44.1 Å²	44.1	35%	0.348	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-46.7	171.9	-172.8	178.6	-173.5	180	0	111	I266 E268 G445 P446 S452 S453	I266-K449 HydrophobicContact CB-CD 4.39Å; I266-K449 VanDerWaalsContact O-CE 3.22Å; I266-K449 WeakPolarHBondContact O-CE 3.49Å; I266-K449 PolarHBondContact O-NZ 3.28Å; E268-K449 IonicContact OE1-NZ 3.09Å; E268-K449 PolarHBondContact OE1-NZ 3.28Å; G445-K449 WeakPolarHBondContact O-CB 3.48Å; G445-K449 PolarHBondContact O-N 3.37Å; P446-K449 WeakPolarHBondContact O-CB 3.44Å; P446-K449 PolarHBondContact O-N 3.02Å; K449-S452 PolarHBondContact O-N 3.05Å; K449-S453 PolarHBondContact O-N 3.03Å; K449-S453 PolarHBondContact O-OG 2.91Å
450	F	96.7	Very high	94.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.3	-49.5	173.7	174.1	-106.1	0	0	0	112.5	I266 L283 Y434 V437 P446 S447 L448 S452 S453 W454	I266-F450 HydrophobicContact CG2-CB 3.54Å; I266-F450 HydrophobicContact CG2-CD2 4.24Å; I266-F450 HydrophobicContact CG2-CG 4.36Å; L283-F450 HydrophobicContact CD1-CE2 4.36Å; L283-F450 HydrophobicContact CD1-CZ 4.49Å; L283-F450 HydrophobicContact CD2-CE2 4.06Å; L283-F450 HydrophobicContact CD2-CZ 3.72Å; Y434-F450 AromaticContact CD2-CE1 3.6Å; Y434-F450 HydrophobicContact CD2-CE1 3.6Å; Y434-F450 AromaticContact CD2-CZ 3.75Å; Y434-F450 HydrophobicContact CD2-CZ 3.75Å; Y434-F450 AromaticContact CE2-CE1 3.8Å; Y434-F450 HydrophobicContact CE2-CE1 3.8Å; Y434-F450 HydrophobicContact CE2-CZ 4.21Å; Y434-F450 HydrophobicContact CG-CE1 4.19Å; Y434-F450 HydrophobicContact CG-CZ 4.5Å; V437-F450 HydrophobicContact CB-CD1 3.82Å; V437-F450 HydrophobicContact CB-CE1 3.71Å; V437-F450 HydrophobicContact CB-CE2 4.43Å; V437-F450 HydrophobicContact CB-CG 4.25Å; V437-F450 HydrophobicContact CB-CZ 4.05Å; V437-F450 HydrophobicContact CG1-CB 4.07Å; V437-F450 HydrophobicContact CG1-CD1 3.57Å; V437-F450 HydrophobicContact CG1-CD2 3.87Å; V437-F450 HydrophobicContact CG1-CE1 3.95Å; V437-F450 HydrophobicContact CG1-CE2 4.21Å; V437-F450 HydrophobicContact CG1-CG 3.54Å; V437-F450 HydrophobicContact CG1-CZ 4.27Å; V437-F450 HydrophobicContact CG2-CD1 4.34Å; V437-F450 HydrophobicContact CG2-CD2 4.43Å; V437-F450 HydrophobicContact CG2-CE1 3.86Å; V437-F450 HydrophobicContact CG2-CE2 3.95Å; V437-F450 HydrophobicContact CG2-CZ 3.66Å; P446-F450 PolarHBondContact O-N 3.47Å; S447-F450 WeakPolarHBondContact O-CB 3.41Å; S447-F450 PolarHBondContact O-N 2.9Å; L448-F450 VanDerWaalsContact C-N 3.35Å; F450-S452 VanDerWaalsContact C-N 3.3Å; F450-S452 PolarHBondContact O-N 2.8Å; F450-S453 PolarHBondContact O-N 3Å; F450-S453 PolarHBondContact O-OG 3.29Å; F450-W454 AromaticContact CD2-CD1 3.95Å; F450-W454 AromaticContact CD2-NE1 3.97Å; F450-W454 AromaticContact CE2-CD1 3.59Å; F450-W454 HydrophobicContact CE2-CD2 4.41Å; F450-W454 AromaticContact CE2-CE2 3.82Å; F450-W454 HydrophobicContact CE2-CG 4.3Å; F450-W454 HydrophobicContact CE2-CZ2 4.41Å; F450-W454 AromaticContact CE2-NE1 3.29Å; F450-W454 VanDerWaalsContact CE2-NE1 3.29Å; F450-W454 AromaticContact CZ-CD1 3.99Å; F450-W454 HydrophobicContact CZ-CD2 4.21Å; F450-W454 AromaticContact CZ-CE2 3.96Å; F450-W454 HydrophobicContact CZ-CG 4.26Å; F450-W454 HydrophobicContact CZ-CZ2 4.48Å; F450-W454 AromaticContact CZ-NE1 3.84Å; F450-W454 PolarHBondContact O-N 3.16Å
451	Y	96.8	Very high	94.8	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-36.2	-179.9	-68.2	-29	0	0	0	113	T391 Y434 P438 S447 L448 W454 Y455 F456 H459	T391-Y451 PolarHBondContact OG1-OH 3.06Å; Y434-Y451 HydrophobicContact CD1-CE1 4.18Å; Y434-Y451 AromaticContact CE1-CD1 3.91Å; Y434-Y451 HydrophobicContact CE1-CD1 3.91Å; Y434-Y451 AromaticContact CE1-CE1 3.63Å; Y434-Y451 HydrophobicContact CE1-CE1 3.63Å; Y434-Y451 AromaticContact CE2-CD1 3.95Å; Y434-Y451 HydrophobicContact CE2-CD1 3.95Å; Y434-Y451 HydrophobicContact CE2-CE1 4.29Å; Y434-Y451 AromaticContact CZ-CD1 3.45Å; Y434-Y451 VanDerWaalsContact CZ-CD1 3.45Å; Y434-Y451 AromaticContact CZ-CE1 3.68Å; Y434-Y451 VanDerWaalsContact OH-CD1 3.28Å; Y434-Y451 WeakPolarHBondContact OH-CD1 3.37Å; P438-Y451 HydrophobicContact CG-CE1 4.06Å; P438-Y451 HydrophobicContact CG-CE2 4.02Å; P438-Y451 VanDerWaalsContact CG-CZ 3.48Å; P438-Y451 WeakPolarHBondContact CG-OH 3.49Å; S447-Y451 PolarHBondContact O-N 3.48Å; L448-Y451 HydrophobicContact CD2-CD2 4.45Å; L448-Y451 PolarHBondContact O-N 2.84Å; Y451-W454 CarbonylContact O-C 3.45Å; Y451-W454 PolarHBondContact O-N 3.06Å; Y451-Y455 PolarHBondContact O-N 3.25Å; Y451-Y455 VanDerWaalsContact O-N 3.16Å; Y451-F456 VanDerWaalsContact CB-CE1 3.44Å; Y451-F456 HydrophobicContact CD2-CE1 4.28Å; Y451-F456 HydrophobicContact CG-CD1 4.49Å; Y451-F456 HydrophobicContact CG-CE1 4.26Å; Y451-F456 PolarHBondContact O-N 3.32Å; Y451-H459 AromaticContact CD1-CE1 3.85Å; Y451-H459 AromaticContact CD2-CE1 3.96Å; Y451-H459 AromaticContact CE1-CE1 3.71Å; Y451-H459 AromaticContact CE2-CE1 3.81Å; Y451-H459 AromaticContact CG-CE1 3.96Å; Y451-H459 AromaticContact CZ-CE1 3.65Å
452	S	95.2	Very high	95	Very high	71 Å²	71	50.2 Å²	50.2	50%	0.497	27%	0.274	S	S	.	.	H	α-helix	trans	-66	-43.1	175.6	-169.8	0	0	0	0	112.2	L448 K449 F450 W454 Y455	L448-S452 VanDerWaalsContact O-CB 3.27Å; L448-S452 WeakPolarHBondContact O-CB 3.36Å; L448-S452 PolarHBondContact O-N 2.9Å; K449-S452 PolarHBondContact O-N 3.05Å; F450-S452 VanDerWaalsContact C-N 3.3Å; F450-S452 PolarHBondContact O-N 2.8Å; S452-W454 PolarHBondContact O-N 3.18Å; S452-Y455 WeakPolarHBondContact O-CA 3.32Å; S452-Y455 PolarHBondContact O-N 2.9Å
453	S	93.9	Very high	95.1	Very high	20 Å²	20	54.2 Å²	54.2	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-24.6	176.4	64	0	0	0	0	113	K449 F450	K449-S453 PolarHBondContact O-N 3.03Å; K449-S453 PolarHBondContact O-OG 2.91Å; F450-S453 PolarHBondContact O-N 3Å; F450-S453 PolarHBondContact O-OG 3.29Å
454	W	95.1	Very high	95.4	Very high	6 Å²	6	58.3 Å²	58.3	2%	0.023	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	9.4	172.1	-76.9	62.4	0	0	0	113.7	F276 V280 L283 V430 Y434 F450 Y451 S452 F456 C457	F276-W454 AromaticContact CE2-CD2 3.88Å; F276-W454 HydrophobicContact CE2-CD2 3.88Å; F276-W454 AromaticContact CE2-CE3 3.93Å; F276-W454 HydrophobicContact CE2-CE3 3.93Å; F276-W454 HydrophobicContact CE2-CG 4.23Å; F276-W454 HydrophobicContact CE2-CZ3 4.43Å; F276-W454 HydrophobicContact CZ-CD2 4.15Å; F276-W454 AromaticContact CZ-CE3 3.69Å; F276-W454 HydrophobicContact CZ-CE3 3.69Å; F276-W454 AromaticContact CZ-CZ3 3.97Å; F276-W454 HydrophobicContact CZ-CZ3 3.97Å; V280-W454 HydrophobicContact CB-CH2 3.99Å; V280-W454 HydrophobicContact CG1-CH2 4.27Å; V280-W454 HydrophobicContact CG2-CH2 3.46Å; V280-W454 VanDerWaalsContact CG2-CH2 3.46Å; V280-W454 HydrophobicContact CG2-CZ2 4.18Å; V280-W454 HydrophobicContact CG2-CZ3 3.84Å; L283-W454 HydrophobicContact CB-CZ2 4.09Å; L283-W454 HydrophobicContact CD2-CH2 3.58Å; L283-W454 HydrophobicContact CD2-CZ2 3.44Å; L283-W454 VanDerWaalsContact CD2-CZ2 3.44Å; L283-W454 HydrophobicContact CD2-CZ3 4.48Å; L283-W454 HydrophobicContact CG-CZ2 4.39Å; V430-W454 HydrophobicContact CG1-CZ3 4.37Å; Y434-W454 HydrophobicContact CD2-CD2 4.03Å; Y434-W454 AromaticContact CD2-CE3 3.71Å; Y434-W454 HydrophobicContact CD2-CE3 3.71Å; Y434-W454 HydrophobicContact CD2-CG 4.38Å; Y434-W454 HydrophobicContact CD2-CZ3 4.23Å; Y434-W454 HydrophobicContact CE2-CB 3.72Å; Y434-W454 HydrophobicContact CE2-CD2 4.11Å; Y434-W454 AromaticContact CE2-CE3 3.99Å; Y434-W454 HydrophobicContact CE2-CE3 3.99Å; Y434-W454 HydrophobicContact CE2-CG 4.02Å; F450-W454 AromaticContact CD2-CD1 3.95Å; F450-W454 AromaticContact CD2-NE1 3.97Å; F450-W454 AromaticContact CE2-CD1 3.59Å; F450-W454 HydrophobicContact CE2-CD2 4.41Å; F450-W454 AromaticContact CE2-CE2 3.82Å; F450-W454 HydrophobicContact CE2-CG 4.3Å; F450-W454 HydrophobicContact CE2-CZ2 4.41Å; F450-W454 AromaticContact CE2-NE1 3.29Å; F450-W454 VanDerWaalsContact CE2-NE1 3.29Å; F450-W454 AromaticContact CZ-CD1 3.99Å; F450-W454 HydrophobicContact CZ-CD2 4.21Å; F450-W454 AromaticContact CZ-CE2 3.96Å; F450-W454 HydrophobicContact CZ-CG 4.26Å; F450-W454 HydrophobicContact CZ-CZ2 4.48Å; F450-W454 AromaticContact CZ-NE1 3.84Å; F450-W454 PolarHBondContact O-N 3.16Å; Y451-W454 CarbonylContact O-C 3.45Å; Y451-W454 PolarHBondContact O-N 3.06Å; S452-W454 PolarHBondContact O-N 3.18Å; W454-F456 PolarHBondContact O-N 3.34Å; W454-C457 VanDerWaalsContact O-CB 3.25Å; W454-C457 WeakPolarHBondContact O-CB 3.48Å; W454-C457 PolarHBondContact O-N 3.38Å; W454-C457 PolarHBondContact O-SG 3.01Å
455	Y	94.8	Very high	95.5	Very high	179 Å²	179	56.3 Å²	56.3	70%	0.702	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	27.2	179.9	-50.6	-81.1	0	0	0	114.2	Y451 S452 C457	Y451-Y455 PolarHBondContact O-N 3.25Å; Y451-Y455 VanDerWaalsContact O-N 3.16Å; S452-Y455 WeakPolarHBondContact O-CA 3.32Å; S452-Y455 PolarHBondContact O-N 2.9Å; Y455-C457 PolarHBondContact O-N 2.61Å
456	F	96.4	Very high	95.3	Very high	83 Å²	83	56.6 Å²	56.6	36%	0.364	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	26.3	-173.2	-61.2	-93.6	0	0	0	113.6	Y451 W454 L458 H459 L460	Y451-F456 VanDerWaalsContact CB-CE1 3.44Å; Y451-F456 HydrophobicContact CD2-CE1 4.28Å; Y451-F456 HydrophobicContact CG-CD1 4.49Å; Y451-F456 HydrophobicContact CG-CE1 4.26Å; Y451-F456 PolarHBondContact O-N 3.32Å; W454-F456 PolarHBondContact O-N 3.34Å; F456-L458 VanDerWaalsContact C-N 3.33Å; F456-L458 PolarHBondContact O-N 3.18Å; F456-H459 AromaticContact CD1-ND1 3.92Å; F456-H459 PolarHBondContact O-N 3.25Å; F456-L460 WeakPolarHBondContact O-CG 3.39Å; F456-L460 PolarHBondContact O-N 3.19Å
457	C	95.4	Very high	95.2	Very high	43 Å²	43	60.4 Å²	60.4	29%	0.291	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-40.8	-164.9	64.1	0	0	0	0	113.3	W454 Y455 L461	W454-C457 VanDerWaalsContact O-CB 3.25Å; W454-C457 WeakPolarHBondContact O-CB 3.48Å; W454-C457 PolarHBondContact O-N 3.38Å; W454-C457 PolarHBondContact O-SG 3.01Å; Y455-C457 PolarHBondContact O-N 2.61Å; C457-L461 VanDerWaalsContact O-CB 3.3Å; C457-L461 WeakPolarHBondContact O-CB 3.33Å; C457-L461 PolarHBondContact O-N 2.87Å
458	L	96.2	Very high	95	Very high	28 Å²	28	64.9 Å²	64.9	15%	0.147	34%	0.338	C	S	.	.	H	α-helix	trans	-77.8	-28.3	179.8	-66.4	-176.1	0	0	0	113.3	M395 V430 Y434 F456 L461 C462	M395-L458 HydrophobicContact CE-CB 3.46Å; M395-L458 VanDerWaalsContact CE-CB 3.46Å; M395-L458 HydrophobicContact CE-CD1 4.18Å; M395-L458 HydrophobicContact CE-CG 4.46Å; V430-L458 HydrophobicContact CG1-CD1 4.33Å; Y434-L458 HydrophobicContact CD1-CB 3.99Å; Y434-L458 HydrophobicContact CD1-CD1 3.92Å; Y434-L458 HydrophobicContact CD1-CG 4.47Å; Y434-L458 HydrophobicContact CD2-CD1 4.07Å; Y434-L458 HydrophobicContact CE1-CB 3.94Å; Y434-L458 HydrophobicContact CG-CB 4.39Å; Y434-L458 HydrophobicContact CG-CD1 3.6Å; Y434-L458 HydrophobicContact CG-CG 4.38Å; F456-L458 VanDerWaalsContact C-N 3.33Å; F456-L458 PolarHBondContact O-N 3.18Å; L458-L461 HydrophobicContact CD2-CD2 3.94Å; L458-C462 WeakPolarHBondContact O-CB 3.19Å; L458-C462 PolarHBondContact O-N 3.37Å; L458-C462 PolarHBondContact O-SG 3.43Å
459	H	97.1	Very high	94.8	Very high	55 Å²	55	62.9 Å²	62.9	26%	0.255	33%	0.328	S	S	.	.	H	α-helix	trans	-65.3	-46.7	169.9	-62.7	100.2	0	0	0	110.6	T391 Y434 Y451 F456 C462 L463	T391-H459 WeakPolarHBondContact CG2-NE2 3.47Å; T391-H459 PolarHBondContact OG1-NE2 3.09Å; Y434-H459 AromaticContact CE1-CE1 3.42Å; Y434-H459 VanDerWaalsContact CE1-CE1 3.42Å; Y434-H459 WeakPolarHBondContact CE1-CE1 3.39Å; Y434-H459 AromaticContact CE1-ND1 3.64Å; Y434-H459 AromaticContact CZ-CE1 3.76Å; Y434-H459 AromaticContact CZ-ND1 3.75Å; Y434-H459 PolarHBondContact OH-CE1 2.91Å; Y434-H459 VanDerWaalsContact OH-CE1 3.26Å; Y434-H459 PolarHBondContact OH-ND1 3.49Å; Y451-H459 AromaticContact CD1-CE1 3.85Å; Y451-H459 AromaticContact CD2-CE1 3.96Å; Y451-H459 AromaticContact CE1-CE1 3.71Å; Y451-H459 AromaticContact CE2-CE1 3.81Å; Y451-H459 AromaticContact CG-CE1 3.96Å; Y451-H459 AromaticContact CZ-CE1 3.65Å; F456-H459 AromaticContact CD1-ND1 3.92Å; F456-H459 PolarHBondContact O-N 3.25Å; H459-C462 PolarHBondContact O-N 3.34Å; H459-L463 PolarHBondContact O-N 3.01Å
460	L	96.8	Very high	94.2	Very high	106 Å²	106	63.7 Å²	63.7	56%	0.555	34%	0.341	S	S	*	.	H	α-helix	trans	-61.9	-43.6	177	-65.9	174.8	0	0	0	111.4	F456 C462 L463 L464	F456-L460 WeakPolarHBondContact O-CG 3.39Å; F456-L460 PolarHBondContact O-N 3.19Å; L460-C462 PolarHBondContact O-N 2.88Å; L460-L463 PolarHBondContact O-N 3.32Å; L460-L464 WeakPolarHBondContact O-CB 3.38Å; L460-L464 PolarHBondContact O-N 3.24Å
461	L	95.4	Very high	93.4	Very high	90 Å²	90	66.4 Å²	66.4	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-44.7	175.3	-179.3	62.8	0	0	0	111.7	C457 L458 L463 L464 V465	C457-L461 VanDerWaalsContact O-CB 3.3Å; C457-L461 WeakPolarHBondContact O-CB 3.33Å; C457-L461 PolarHBondContact O-N 2.87Å; L458-L461 HydrophobicContact CD2-CD2 3.94Å; L461-L463 VanDerWaalsContact C-N 3.33Å; L461-L463 PolarHBondContact O-N 3.2Å; L461-L464 PolarHBondContact O-N 3.39Å; L461-V465 HydrophobicContact CD1-CG2 4.17Å; L461-V465 HydrophobicContact CG-CG2 4.39Å; L461-V465 WeakPolarHBondContact O-CB 3.31Å; L461-V465 VanDerWaalsContact O-CG2 3.25Å; L461-V465 WeakPolarHBondContact O-CG2 3.22Å; L461-V465 PolarHBondContact O-N 3.4Å
462	C	94.9	Very high	92	Very high	14 Å²	14	74 Å²	74	10%	0.095	39%	0.39	C	S	.	.	H	α-helix	trans	-61	-43.6	177.3	-73.6	0	0	0	0	111.9	M395 A398 L458 H459 L460 V465 V466	M395-C462 PolarHBondContact SD-SG 3.06Å; A398-C462 HydrophobicContact CB-CB 3.83Å; L458-C462 WeakPolarHBondContact O-CB 3.19Å; L458-C462 PolarHBondContact O-N 3.37Å; L458-C462 PolarHBondContact O-SG 3.43Å; H459-C462 PolarHBondContact O-N 3.34Å; L460-C462 PolarHBondContact O-N 2.88Å; C462-V465 PolarHBondContact O-N 2.98Å; C462-V466 WeakPolarHBondContact O-CB 3.5Å; C462-V466 VanDerWaalsContact O-CG2 3.3Å; C462-V466 WeakPolarHBondContact O-CG2 3.35Å; C462-V466 PolarHBondContact O-N 2.92Å
463	L	94.2	Very high	90.4	Very high	103 Å²	103	73.4 Å²	73.4	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-60.4	-49.3	177	-178.5	64.7	0	0	0	110.8	H459 L460 L461 V465 V466 L467	H459-L463 PolarHBondContact O-N 3.01Å; L460-L463 PolarHBondContact O-N 3.32Å; L461-L463 VanDerWaalsContact C-N 3.33Å; L461-L463 PolarHBondContact O-N 3.2Å; L463-V465 PolarHBondContact O-N 3.1Å; L463-V466 PolarHBondContact O-N 3.28Å; L463-L467 HydrophobicContact CD1-CD1 4.16Å; L463-L467 HydrophobicContact CD1-CG 4.39Å; L463-L467 HydrophobicContact CG-CD1 4Å; L463-L467 VanDerWaalsContact O-CG 3.28Å; L463-L467 WeakPolarHBondContact O-CG 3.28Å; L463-L467 PolarHBondContact O-N 2.84Å
464	L	94.9	Very high	88.8	Confident	103 Å²	103	82.4 Å²	82.4	54%	0.539	42%	0.418	S	S	.	.	H	α-helix	trans	-57.9	-48.3	177.5	-179.5	67	0	0	0	111.6	L460 L461 V466 L467 V468	L460-L464 WeakPolarHBondContact O-CB 3.38Å; L460-L464 PolarHBondContact O-N 3.24Å; L461-L464 PolarHBondContact O-N 3.39Å; L464-V466 VanDerWaalsContact C-N 3.35Å; L464-V466 PolarHBondContact O-N 2.76Å; L464-L467 PolarHBondContact O-N 3.32Å; L464-V468 HydrophobicContact CD1-CG2 3.84Å; L464-V468 HydrophobicContact CG-CG2 4.32Å; L464-V468 WeakPolarHBondContact O-CB 3.48Å; L464-V468 VanDerWaalsContact O-CG2 3.3Å; L464-V468 WeakPolarHBondContact O-CG2 3.32Å; L464-V468 PolarHBondContact O-N 3.13Å
465	V	94.2	Very high	86.9	Confident	24 Å²	24	87.6 Å²	87.6	15%	0.145	44%	0.437	C	S	.	.	H	α-helix	trans	-59.5	-44.8	179.4	164.5	0	0	0	0	111.3	A398 A401 V402 L461 C462 L463 L467 L469	A398-V465 HydrophobicContact CB-CB 4.19Å; A398-V465 HydrophobicContact CB-CG1 3.87Å; A401-V465 HydrophobicContact CB-CG1 4.02Å; V402-V465 HydrophobicContact CG2-CG1 3.76Å; L461-V465 HydrophobicContact CD1-CG2 4.17Å; L461-V465 HydrophobicContact CG-CG2 4.39Å; L461-V465 WeakPolarHBondContact O-CB 3.31Å; L461-V465 VanDerWaalsContact O-CG2 3.25Å; L461-V465 WeakPolarHBondContact O-CG2 3.22Å; L461-V465 PolarHBondContact O-N 3.4Å; C462-V465 PolarHBondContact O-N 2.98Å; L463-V465 PolarHBondContact O-N 3.1Å; V465-L467 VanDerWaalsContact C-N 3.35Å; V465-L469 HydrophobicContact CG1-CD1 4.28Å; V465-L469 VanDerWaalsContact O-CB 3.28Å; V465-L469 WeakPolarHBondContact O-CB 3.23Å; V465-L469 PolarHBondContact O-N 2.88Å
466	V	91.4	Very high	84.9	Confident	54 Å²	54	84.7 Å²	84.7	33%	0.327	43%	0.433	S	S	.	.	H	α-helix	trans	-67.9	-35.4	-179.6	170.4	0	0	0	0	111.8	M397 A398 C462 L463 L464	M397-V466 HydrophobicContact CB-CG2 3.94Å; M397-V466 HydrophobicContact CE-CG1 4.26Å; A398-V466 HydrophobicContact CB-CG2 4.31Å; C462-V466 WeakPolarHBondContact O-CB 3.5Å; C462-V466 VanDerWaalsContact O-CG2 3.3Å; C462-V466 WeakPolarHBondContact O-CG2 3.35Å; C462-V466 PolarHBondContact O-N 2.92Å; L463-V466 PolarHBondContact O-N 3.28Å; L464-V466 VanDerWaalsContact C-N 3.35Å; L464-V466 PolarHBondContact O-N 2.76Å
467	L	90.9	Very high	82.9	Confident	127 Å²	127	84.4 Å²	84.4	67%	0.665	43%	0.433	S	S	*	.	H	α-helix	trans	-71.7	-41.8	177.3	-70	172.8	0	0	0	112.5	L463 L464 V465	L463-L467 HydrophobicContact CD1-CD1 4.16Å; L463-L467 HydrophobicContact CD1-CG 4.39Å; L463-L467 HydrophobicContact CG-CD1 4Å; L463-L467 VanDerWaalsContact O-CG 3.28Å; L463-L467 WeakPolarHBondContact O-CG 3.28Å; L463-L467 PolarHBondContact O-N 2.84Å; L464-L467 PolarHBondContact O-N 3.32Å; V465-L467 VanDerWaalsContact C-N 3.35Å
468	V	93.4	Very high	81.1	Confident	94 Å²	94	84.7 Å²	84.7	57%	0.57	44%	0.438	S	S	*	.	H	α-helix	trans	-83.1	-32.3	-175	175.4	0	0	0	0	112.5	L464 P470	L464-V468 HydrophobicContact CD1-CG2 3.84Å; L464-V468 HydrophobicContact CG-CG2 4.32Å; L464-V468 WeakPolarHBondContact O-CB 3.48Å; L464-V468 VanDerWaalsContact O-CG2 3.3Å; L464-V468 WeakPolarHBondContact O-CG2 3.32Å; L464-V468 PolarHBondContact O-N 3.13Å; V468-P470 WeakPolarHBondContact O-CD 3.27Å
469	L	91.6	Very high	79.1	Confident	37 Å²	37	91.2 Å²	91.2	19%	0.194	46%	0.461	C	S	.	.	S	Bend	trans	-112.4	79.5	-176.2	-58.6	-178.8	0	0	0	110.8	A401 V402 N405 I406 V465 V471	A401-L469 HydrophobicContact CB-CB 4.04Å; A401-L469 WeakPolarHBondContact CB-O 3.27Å; V402-L469 HydrophobicContact CG2-CD1 4.42Å; N405-L469 HydrophobicContact CB-CB 4.38Å; N405-L469 HydrophobicContact CB-CD1 4.37Å; N405-L469 HydrophobicContact CB-CD2 4.11Å; I406-L469 HydrophobicContact CD1-CD1 3.79Å; I406-L469 HydrophobicContact CG1-CD1 4.09Å; V465-L469 HydrophobicContact CG1-CD1 4.28Å; V465-L469 VanDerWaalsContact O-CB 3.28Å; V465-L469 WeakPolarHBondContact O-CB 3.23Å; V465-L469 PolarHBondContact O-N 2.88Å; L469-V471 PolarHBondContact O-N 3.18Å
470	P	82.1	Confident	77.1	Confident	96 Å²	96	91.2 Å²	91.2	62%	0.623	47%	0.47	S	S	*	.			trans	-61	139.6	-178.8	25.6	-34	0	0	0	110.9	N405 V468	N405-P470 PolarHBondContact ND2-O 3.43Å; V468-P470 WeakPolarHBondContact O-CD 3.27Å
471	V	81	Confident	75.3	Confident	58 Å²	58	93.8 Å²	93.8	35%	0.352	48%	0.477	S	S	.	.			trans	-116.4	116.1	173.3	-177	0	0	0	0	107.8	A401 H404 L469 S473	A401-V471 VanDerWaalsContact CA-CG2 3.42Å; A401-V471 HydrophobicContact CB-CG2 3.65Å; H404-V471 HydrophobicContact CB-CG2 4.5Å; L469-V471 PolarHBondContact O-N 3.18Å; V471-S473 PolarHBondContact O-N 3.14Å
472	K	67.1	Low	73.6	Confident	162 Å²	162	95.4 Å²	95.4	70%	0.704	48%	0.482	S	S	*	.			trans	-61.5	131.5	172.2	-71.1	-174.9	179.8	-177.8	0	109.2	R474 Q477	K472-R474 PolarHBondContact O-N 3.11Å; K472-Q477 HydrophobicContact CB-CG 4.4Å
473	S	62	Low	72.1	Confident	60 Å²	60	98.6 Å²	98.6	42%	0.42	50%	0.499	S	S	.	.			trans	-60.4	125.6	179.7	176.9	0	0	0	0	110.5	V471 R475 L476 Q477	V471-S473 PolarHBondContact O-N 3.14Å; S473-R475 PolarHBondContact O-N 2.82Å; S473-R475 PolarHBondContact OG-N 2.94Å; S473-L476 WeakPolarHBondContact O-CB 3.35Å; S473-L476 PolarHBondContact O-N 3.14Å; S473-Q477 PolarHBondContact O-N 3.02Å
474	R	59.6	Low	70.7	Confident	209 Å²	209	96.2 Å²	96.2	79%	0.789	49%	0.493	S	S	*	.	H	α-helix	trans	-57.2	-29.4	175.3	-80.4	-174.4	-179.4	-177.8	-1.7	112.9	K472 Q477 A478	K472-R474 PolarHBondContact O-N 3.11Å; R474-Q477 PolarHBondContact O-N 3.3Å; R474-A478 WeakPolarHBondContact O-CB 3Å; R474-A478 PolarHBondContact O-N 3.35Å
475	R	54.6	Low	69.2	Low	114 Å²	114	93.6 Å²	93.6	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-72.5	-38	174.9	-76.9	-174.5	-179.4	170.2	0.2	111.9	C363 P364 S473 Q477 A478 R479	C363-R475 PolarHBondContact O-NH1 3.36Å; C363-R475 PolarHBondContact O-NH2 3.06Å; P364-R475 VanDerWaalsContact C-NH1 3.29Å; P364-R475 PolarHBondContact O-NH1 3.47Å; S473-R475 PolarHBondContact O-N 2.82Å; S473-R475 PolarHBondContact OG-N 2.94Å; R475-Q477 VanDerWaalsContact C-N 3.29Å; R475-A478 PolarHBondContact O-N 3.06Å; R475-R479 VanDerWaalsContact O-CB 3.22Å; R475-R479 WeakPolarHBondContact O-CB 3.48Å; R475-R479 PolarHBondContact O-N 2.8Å
476	L	53.8	Low	67.8	Low	119 Å²	119	97.7 Å²	97.7	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-66.6	-34.8	172.3	-69.6	172.1	0	0	0	111.1	S473 A480	S473-L476 WeakPolarHBondContact O-CB 3.35Å; S473-L476 PolarHBondContact O-N 3.14Å; L476-A480 WeakPolarHBondContact O-CB 3.39Å; L476-A480 PolarHBondContact O-N 2.98Å
477	Q	54.2	Low	66.6	Low	76 Å²	76	99.6 Å²	99.6	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-70.4	-40.6	173.9	-70	176.5	-21.6	0	0	113	K472 S473 R474 R475 K481	K472-Q477 HydrophobicContact CB-CG 4.4Å; S473-Q477 PolarHBondContact O-N 3.02Å; R474-Q477 PolarHBondContact O-N 3.3Å; R475-Q477 VanDerWaalsContact C-N 3.29Å; Q477-K481 WeakPolarHBondContact O-CB 3.22Å; Q477-K481 VanDerWaalsContact O-CG 3.29Å; Q477-K481 WeakPolarHBondContact O-CG 3.46Å; Q477-K481 PolarHBondContact O-N 2.88Å
478	A	57.3	Low	65.3	Low	49 Å²	49	100.2 Å²	100.2	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-45	175.7	0	0	0	0	0	111	R474 R475 K481 E482	R474-A478 WeakPolarHBondContact O-CB 3Å; R474-A478 PolarHBondContact O-N 3.35Å; R475-A478 PolarHBondContact O-N 3.06Å; A478-K481 PolarHBondContact O-N 3.14Å; A478-E482 WeakPolarHBondContact O-CG 3.34Å; A478-E482 PolarHBondContact O-N 2.92Å
479	R	55.5	Low	63.6	Low	165 Å²	165	102.6 Å²	102.6	62%	0.623	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-44.2	176	-160.8	173.9	-172.9	175	2.3	112	R475 K481 E482 D483	R475-R479 VanDerWaalsContact O-CB 3.22Å; R475-R479 WeakPolarHBondContact O-CB 3.48Å; R475-R479 PolarHBondContact O-N 2.8Å; R479-K481 VanDerWaalsContact C-N 3.26Å; R479-K481 PolarHBondContact O-N 3.29Å; R479-E482 PolarHBondContact O-N 3.41Å; R479-D483 VanDerWaalsContact O-CB 3.32Å; R479-D483 WeakPolarHBondContact O-CB 3.43Å; R479-D483 PolarHBondContact O-N 2.59Å
480	A	53.4	Low	62	Low	55 Å²	55	108.8 Å²	108.8	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-29.9	174.1	0	0	0	0	0	113.3	L476 A484	L476-A480 WeakPolarHBondContact O-CB 3.39Å; L476-A480 PolarHBondContact O-N 2.98Å; A480-A484 WeakPolarHBondContact O-CB 3.09Å; A480-A484 PolarHBondContact O-N 3.29Å
481	K	59.6	Low	60.7	Low	161 Å²	161	109.2 Å²	109.2	70%	0.7	54%	0.535	S	S	*	.	H	α-helix	trans	-75.4	-38.7	173.2	-79.7	-177.4	176.1	-164.8	0	112.5	Q477 A478 R479 A485	Q477-K481 WeakPolarHBondContact O-CB 3.22Å; Q477-K481 VanDerWaalsContact O-CG 3.29Å; Q477-K481 WeakPolarHBondContact O-CG 3.46Å; Q477-K481 PolarHBondContact O-N 2.88Å; A478-K481 PolarHBondContact O-N 3.14Å; R479-K481 VanDerWaalsContact C-N 3.26Å; R479-K481 PolarHBondContact O-N 3.29Å; K481-A485 VanDerWaalsContact O-CB 3.32Å; K481-A485 WeakPolarHBondContact O-CB 3.19Å; K481-A485 PolarHBondContact O-N 3.1Å
482	E	60.5	Low	59.4	Low	124 Å²	124	112.8 Å²	112.8	58%	0.579	55%	0.548	S	S	*	.	H	α-helix	trans	-65.7	-43.9	173.1	-76.7	174	173.4	0	0	111	A478 R479 A485 Q486	A478-E482 WeakPolarHBondContact O-CG 3.34Å; A478-E482 PolarHBondContact O-N 2.92Å; R479-E482 PolarHBondContact O-N 3.41Å; E482-A485 PolarHBondContact O-N 3.18Å; E482-Q486 WeakPolarHBondContact O-CG 3.44Å; E482-Q486 PolarHBondContact O-N 3.17Å
483	D	63.4	Low	58.8	Low	81 Å²	81	108.1 Å²	108.1	43%	0.433	54%	0.536	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.4	-64.2	-24.9	0	0	0	110.6	R479 Q486 D487	R479-D483 VanDerWaalsContact O-CB 3.32Å; R479-D483 WeakPolarHBondContact O-CB 3.43Å; R479-D483 PolarHBondContact O-N 2.59Å; D483-Q486 PolarHBondContact O-N 3.4Å; D483-D487 PolarHBondContact O-N 3.04Å
484	A	63.9	Low	58.4	Low	52 Å²	52	108 Å²	108	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-65.1	-38.8	175.3	0	0	0	0	0	113.1	A480 Q486 D487 E488	A480-A484 WeakPolarHBondContact O-CB 3.09Å; A480-A484 PolarHBondContact O-N 3.29Å; A484-Q486 VanDerWaalsContact C-N 3.32Å; A484-D487 PolarHBondContact O-N 3.2Å; A484-E488 PolarHBondContact O-N 3.26Å
485	A	64.4	Low	58	Low	49 Å²	49	102.3 Å²	102.3	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-32	175.7	0	0	0	0	0	112.4	K481 E482 Q489	K481-A485 VanDerWaalsContact O-CB 3.32Å; K481-A485 WeakPolarHBondContact O-CB 3.19Å; K481-A485 PolarHBondContact O-N 3.1Å; E482-A485 PolarHBondContact O-N 3.18Å; A485-Q489 PolarHBondContact O-N 3.44Å
486	Q	64.4	Low	57.8	Low	110 Å²	110	101.8 Å²	101.8	51%	0.514	53%	0.529	S	S	.	.	H	α-helix	trans	-72.5	-35.5	173.9	-75.1	-179.8	9.2	0	0	112.5	E482 D483 A484 Q489 R490	E482-Q486 WeakPolarHBondContact O-CG 3.44Å; E482-Q486 PolarHBondContact O-N 3.17Å; D483-Q486 PolarHBondContact O-N 3.4Å; A484-Q486 VanDerWaalsContact C-N 3.32Å; Q486-Q489 PolarHBondContact O-N 3.11Å; Q486-R490 WeakPolarHBondContact O-CG 3.48Å; Q486-R490 PolarHBondContact O-N 3.23Å
487	D	66.1	Low	57.5	Low	94 Å²	94	101.5 Å²	101.5	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-68.3	-42.4	173.2	-102.4	-2.5	0	0	0	111.8	D483 A484 Q489 R490 D491	D483-D487 PolarHBondContact O-N 3.04Å; A484-D487 PolarHBondContact O-N 3.2Å; D487-Q489 VanDerWaalsContact C-N 3.28Å; D487-Q489 PolarHBondContact O-N 3.16Å; D487-R490 WeakPolarHBondContact O-CB 3.39Å; D487-R490 PolarHBondContact O-N 3.03Å; D487-D491 PolarHBondContact O-N 3.12Å
488	E	64.1	Low	57.2	Low	139 Å²	139	103.1 Å²	103.1	65%	0.65	54%	0.539	S	S	*	.	H	α-helix	trans	-60.2	-36.2	173.9	-78.8	-177.2	169.5	0	0	112.4	A484 H492	A484-E488 PolarHBondContact O-N 3.26Å; E488-H492 PolarHBondContact O-N 2.83Å
489	Q	56.6	Low	56.6	Low	145 Å²	145	105 Å²	105	68%	0.678	55%	0.548	S	S	*	.	H	α-helix	trans	-70.3	-32	173.2	-89.9	178.2	-33.9	0	0	113.4	A485 Q486 D487 S493	A485-Q489 PolarHBondContact O-N 3.44Å; Q486-Q489 PolarHBondContact O-N 3.11Å; D487-Q489 VanDerWaalsContact C-N 3.28Å; D487-Q489 PolarHBondContact O-N 3.16Å; Q489-S493 WeakPolarHBondContact O-CB 3.28Å; Q489-S493 PolarHBondContact O-N 2.96Å; Q489-S493 VanDerWaalsContact O-N 3.13Å; Q489-S493 PolarHBondContact O-OG 2.97Å; Q489-S493 VanDerWaalsContact O-OG 3.06Å
490	R	58.3	Low	56.2	Low	166 Å²	166	102.7 Å²	102.7	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-71.6	-38.8	174.3	-79.5	177	174.9	179	0	112	Q486 D487 S493 S494	Q486-R490 WeakPolarHBondContact O-CG 3.48Å; Q486-R490 PolarHBondContact O-N 3.23Å; D487-R490 WeakPolarHBondContact O-CB 3.39Å; D487-R490 PolarHBondContact O-N 3.03Å; R490-S493 PolarHBondContact O-N 3.2Å; R490-S493 PolarHBondContact O-OG 2.97Å; R490-S494 WeakPolarHBondContact O-CB 3.36Å; R490-S494 PolarHBondContact O-N 3.45Å; R490-S494 PolarHBondContact O-OG 3.35Å
491	D	55.8	Low	55.8	Low	106 Å²	106	106.9 Å²	106.9	57%	0.567	56%	0.558	S	S	*	*	H	α-helix	trans	-68.8	-38.9	175.9	-79.4	-11.5	0	0	0	111.8	D487 S494 T495	D487-D491 PolarHBondContact O-N 3.12Å; D491-S494 WeakPolarHBondContact CA-OG 3.35Å; D491-S494 PolarHBondContact O-N 3.26Å; D491-S494 PolarHBondContact O-OG 3.04Å; D491-S494 VanDerWaalsContact O-OG 3.08Å; D491-T495 WeakPolarHBondContact O-CB 3.4Å; D491-T495 PolarHBondContact O-OG1 2.71Å; D491-T495 PolarHBondContact O-N 3.45Å
492	H	53.9	Low	55.2	Low	133 Å²	133	107 Å²	107	62%	0.616	56%	0.559	S	S	*	*	H	α-helix	trans	-64.5	-44	173.6	-95.7	-60.1	0	0	0	113	E488 S494 T495 D496	E488-H492 PolarHBondContact O-N 2.83Å; H492-S494 VanDerWaalsContact C-N 3.34Å; H492-S494 PolarHBondContact O-N 3.39Å; H492-T495 PolarHBondContact O-N 2.97Å; H492-D496 PolarHBondContact O-N 2.84Å; H492-D496 VanDerWaalsContact O-N 3.09Å
493	S	53.7	Low	54.5	Low	64 Å²	64	108 Å²	108	45%	0.448	57%	0.568	S	S	.	*	H	α-helix	trans	-69.6	-27.8	179.4	60.6	0	0	0	0	114.2	Q489 R490 N497	Q489-S493 WeakPolarHBondContact O-CB 3.28Å; Q489-S493 PolarHBondContact O-N 2.96Å; Q489-S493 VanDerWaalsContact O-N 3.13Å; Q489-S493 PolarHBondContact O-OG 2.97Å; Q489-S493 VanDerWaalsContact O-OG 3.06Å; R490-S493 PolarHBondContact O-N 3.2Å; R490-S493 PolarHBondContact O-OG 2.97Å; S493-N497 PolarHBondContact O-N 3.47Å; S493-N497 PolarHBondContact O-ND2 3.15Å
494	S	53.1	Low	53.7	Low	57 Å²	57	113.3 Å²	113.3	40%	0.399	59%	0.588	S	S	.	*	H	α-helix	trans	-79.1	-28.9	174	46.1	0	0	0	0	112.7	R490 D491 H492 N498	R490-S494 WeakPolarHBondContact O-CB 3.36Å; R490-S494 PolarHBondContact O-N 3.45Å; R490-S494 PolarHBondContact O-OG 3.35Å; D491-S494 WeakPolarHBondContact CA-OG 3.35Å; D491-S494 PolarHBondContact O-N 3.26Å; D491-S494 PolarHBondContact O-OG 3.04Å; D491-S494 VanDerWaalsContact O-OG 3.08Å; H492-S494 VanDerWaalsContact C-N 3.34Å; H492-S494 PolarHBondContact O-N 3.39Å; S494-N498 PolarHBondContact O-N 3.15Å
495	T	52.3	Low	52.9	Low	89 Å²	89	115 Å²	115	55%	0.546	60%	0.596	S	S	.	*	H	α-helix	trans	-71.6	-40	173.4	-45.2	0	0	0	0	111.9	D491 H492 N498 C499	D491-T495 WeakPolarHBondContact O-CB 3.4Å; D491-T495 PolarHBondContact O-OG1 2.71Å; D491-T495 PolarHBondContact O-N 3.45Å; H492-T495 PolarHBondContact O-N 2.97Å; T495-N498 PolarHBondContact O-N 3.48Å; T495-C499 PolarHBondContact O-N 2.79Å
496	D	49	Very low	51.5	Low	104 Å²	104	122.8 Å²	122.8	56%	0.556	64%	0.639	S	S	*	*	H	α-helix	trans	-67.8	-34.6	176.8	-75.7	-21.1	0	0	0	112.9	H492 N498 C499 N500	H492-D496 PolarHBondContact O-N 2.84Å; H492-D496 VanDerWaalsContact O-N 3.09Å; D496-N498 VanDerWaalsContact C-N 3.35Å; D496-C499 PolarHBondContact O-N 3.01Å; D496-N500 PolarHBondContact O-N 3.08Å
497	N	47.8	Very low	50.9	Low	112 Å²	112	123.5 Å²	123.5	60%	0.599	65%	0.645	S	S	*	*	H	α-helix	trans	-67.7	-33.4	174.5	-82.9	-25.9	0	0	0	112.8	S493 Q501	S493-N497 PolarHBondContact O-N 3.47Å; S493-N497 PolarHBondContact O-ND2 3.15Å; N497-Q501 PolarHBondContact O-N 3.14Å
498	N	47.8	Very low	50.1	Low	111 Å²	111	125 Å²	125	59%	0.594	65%	0.653	S	S	*	*	H	α-helix	trans	-73.9	-28.6	175.7	-100.4	-14.8	0	0	0	113	S494 T495 D496	S494-N498 PolarHBondContact O-N 3.15Å; T495-N498 PolarHBondContact O-N 3.48Å; D496-N498 VanDerWaalsContact C-N 3.35Å
499	C	45.7	Very low	49.3	Very low	88 Å²	88	124.2 Å²	124.2	60%	0.595	65%	0.653	S	S	*	*	H	α-helix	trans	-71.9	-42.5	175.3	-134.5	0	0	0	0	111.2	T495 D496 Q501 K502	T495-C499 PolarHBondContact O-N 2.79Å; D496-C499 PolarHBondContact O-N 3.01Å; C499-Q501 PolarHBondContact O-N 2.88Å; C499-K502 PolarHBondContact O-N 2.66Å
500	N	45.5	Very low	48.9	Very low	116 Å²	116	123 Å²	123	62%	0.62	65%	0.652	S	S	*	*	H	α-helix	trans	-68.6	-16.4	176.9	-81.2	-29.6	0	0	0	114.6	D496	D496-N500 PolarHBondContact O-N 3.08Å
501	Q	46.5	Very low	48.3	Very low	143 Å²	143	120.3 Å²	120.3	67%	0.668	65%	0.653	S	S	*	*	H	α-helix	trans	-86.1	-20.9	175.8	-114.3	176.4	-4.5	0	0	113.6	N497 C499	N497-Q501 PolarHBondContact O-N 3.14Å; C499-Q501 PolarHBondContact O-N 2.88Å
502	K	45.8	Very low	47.8	Very low	163 Å²	163	121.3 Å²	121.3	71%	0.709	66%	0.659	S	S	*	*	H	α-helix	trans	-82.2	-23.9	177.4	-92.8	-175.9	179.4	-179.1	0	114.2	C499 K504	C499-K502 PolarHBondContact O-N 2.66Å; K502-K504 VanDerWaalsContact C-N 3.27Å; K502-K504 PolarHBondContact O-N 3Å
503	D	46.3	Very low	47.4	Very low	145 Å²	145	120.4 Å²	120.4	78%	0.775	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	6.8	177.4	-78.9	-13.3	0	0	0	114.4
504	K	47.3	Very low	46.9	Very low	194 Å²	194	124.8 Å²	124.8	84%	0.843	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	8.1	173.9	-81.1	-173.3	177.5	178.3	0	114.3	K502	K502-K504 VanDerWaalsContact C-N 3.27Å; K502-K504 PolarHBondContact O-N 3Å
505	S	45.9	Very low	46.4	Very low	87 Å²	87	130.4 Å²	130.4	61%	0.608	70%	0.702	S	S	*	*			trans	-138.3	61.3	177.5	66.4	0	0	0	0	112.1
506	T	36.7	Very low	45.8	Very low	213 Å²	213	134.2 Å²	134.2	100%	1.307	72%	0.716	S	S	*	*			trans	-166.9	0	142.5	14.1	0	0	0	0	110.5

Retrieved 506 of 506 residues in 1293.1 ms (Link to these results)

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