A0A087XRN0_POEFO Loading...

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AlphaFold DB (A0A3B3TMC3), UniProt , Accession A0A087XRN0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 626 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	52.9	Low	58.4	Low	203 Å²	203	129.4 Å²	129.4	100%	1	65%	0.645	S	S	*	*				0	-48	0	-75.2	-167.4	-80.3	0	0	112.3	Q3 K4 E5	M1-Q3 VanDerWaalsContact C-N 3.25Å; M1-Q3 PolarHBondContact O-N 3.01Å; M1-K4 PolarHBondContact O-N 2.96Å; M1-E5 PolarHBondContact O-N 3.17Å
2	A	53.6	Low	58.1	Low	68 Å²	68	124.2 Å²	124.2	56%	0.562	62%	0.621	S	S	*	*	H	α-helix	trans	-53.4	-28.7	179.7	0	0	0	0	0	116.8	K6	A2-K6 PolarHBondContact O-N 3.45Å; A2-K6 VanDerWaalsContact O-N 3.16Å
3	Q	55	Low	57.8	Low	174 Å²	174	126.2 Å²	126.2	81%	0.813	62%	0.624	S	S	*	*	H	α-helix	trans	-79.2	-29.8	179.4	-150.5	173.7	1.1	0	0	112.9	M1 L7	M1-Q3 VanDerWaalsContact C-N 3.25Å; M1-Q3 PolarHBondContact O-N 3.01Å; Q3-L7 WeakPolarHBondContact O-CB 3.45Å; Q3-L7 PolarHBondContact O-N 3.5Å
4	K	58.4	Low	57.4	Low	174 Å²	174	126.1 Å²	126.1	76%	0.757	62%	0.621	S	S	*	*	H	α-helix	trans	-73	-37.6	172.7	-91.2	-175.3	174	-179.6	0	111.2	M1 L7 Q8	M1-K4 PolarHBondContact O-N 2.96Å; K4-L7 PolarHBondContact O-N 3.5Å; K4-Q8 WeakPolarHBondContact O-CB 3.28Å; K4-Q8 PolarHBondContact O-N 2.91Å
5	E	63.5	Low	56.8	Low	133 Å²	133	126.9 Å²	126.9	62%	0.621	62%	0.619	S	S	*	*	H	α-helix	trans	-67.3	-39.6	175.9	-72	170.4	157.3	0	0	112	M1 Q8 C9	M1-E5 PolarHBondContact O-N 3.17Å; E5-Q8 PolarHBondContact O-N 2.91Å; E5-C9 VanDerWaalsContact O-CB 3.26Å; E5-C9 WeakPolarHBondContact O-CB 3.39Å; E5-C9 PolarHBondContact O-N 3.3Å
6	K	60.1	Low	56.2	Low	155 Å²	155	125.1 Å²	125.1	67%	0.674	61%	0.613	S	S	*	*	H	α-helix	trans	-63.7	-39.7	172.3	-79.5	-174	175.4	-174.7	0	112.8	A2 L10	A2-K6 PolarHBondContact O-N 3.45Å; A2-K6 VanDerWaalsContact O-N 3.16Å; K6-L10 WeakPolarHBondContact O-CB 3.26Å; K6-L10 PolarHBondContact O-N 3.42Å
7	L	61	Low	55.7	Low	99 Å²	99	123 Å²	123	52%	0.518	61%	0.61	S	S	.	*	H	α-helix	trans	-68.9	-36	176.6	-169.6	69.7	0	0	0	111.9	Q3 K4 K11	Q3-L7 WeakPolarHBondContact O-CB 3.45Å; Q3-L7 PolarHBondContact O-N 3.5Å; K4-L7 PolarHBondContact O-N 3.5Å; L7-K11 WeakPolarHBondContact O-CB 3.44Å; L7-K11 VanDerWaalsContact O-CG 3.3Å; L7-K11 WeakPolarHBondContact O-CG 3.39Å; L7-K11 PolarHBondContact O-N 3.27Å
8	Q	62.8	Low	55.1	Low	98 Å²	98	121.3 Å²	121.3	46%	0.458	60%	0.603	S	S	.	*	H	α-helix	trans	-69.3	-44.1	175.7	-169.1	59.1	36.3	0	0	111	K4 E5 L10 K11 D12	K4-Q8 WeakPolarHBondContact O-CB 3.28Å; K4-Q8 PolarHBondContact O-N 2.91Å; E5-Q8 PolarHBondContact O-N 2.91Å; Q8-L10 VanDerWaalsContact C-N 3.34Å; Q8-L10 PolarHBondContact O-N 3.34Å; Q8-K11 WeakPolarHBondContact O-CB 3.13Å; Q8-K11 PolarHBondContact O-N 3.28Å; Q8-K11 VanDerWaalsContact O-N 3.13Å; Q8-D12 PolarHBondContact NE2-OD1 3.38Å; Q8-D12 PolarHBondContact NE2-OD2 2.96Å; Q8-D12 WeakPolarHBondContact O-CB 3.2Å; Q8-D12 VanDerWaalsContact O-CG 3.25Å; Q8-D12 PolarHBondContact O-N 3Å
9	C	61.7	Low	54.2	Low	86 Å²	86	121.5 Å²	121.5	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-61.9	-39	175.2	-167.4	0	0	0	0	112.3	E5 D12 F13	E5-C9 VanDerWaalsContact O-CB 3.26Å; E5-C9 WeakPolarHBondContact O-CB 3.39Å; E5-C9 PolarHBondContact O-N 3.3Å; C9-D12 PolarHBondContact O-N 3.39Å; C9-F13 VanDerWaalsContact O-CB 3.25Å; C9-F13 WeakPolarHBondContact O-CB 3.41Å; C9-F13 PolarHBondContact O-N 3.13Å
10	L	56.4	Low	53.4	Low	110 Å²	110	120.6 Å²	120.6	58%	0.576	60%	0.603	S	S	*	*	H	α-helix	trans	-66.3	-37.7	172.6	-92.2	158.2	0	0	0	113	K6 Q8 H14	K6-L10 WeakPolarHBondContact O-CB 3.26Å; K6-L10 PolarHBondContact O-N 3.42Å; Q8-L10 VanDerWaalsContact C-N 3.34Å; Q8-L10 PolarHBondContact O-N 3.34Å; L10-H14 WeakPolarHBondContact O-CB 3.45Å; L10-H14 PolarHBondContact O-N 2.94Å
11	K	56.7	Low	52.6	Low	123 Å²	123	118.4 Å²	118.4	54%	0.535	60%	0.6	S	S	.	*	H	α-helix	trans	-68	-40.3	174.6	-77.7	177	178.9	-175.6	0	111.7	L7 Q8 H14 K15	L7-K11 WeakPolarHBondContact O-CB 3.44Å; L7-K11 VanDerWaalsContact O-CG 3.3Å; L7-K11 WeakPolarHBondContact O-CG 3.39Å; L7-K11 PolarHBondContact O-N 3.27Å; Q8-K11 WeakPolarHBondContact O-CB 3.13Å; Q8-K11 PolarHBondContact O-N 3.28Å; Q8-K11 VanDerWaalsContact O-N 3.13Å; K11-H14 PolarHBondContact O-N 3.37Å; K11-K15 VanDerWaalsContact O-CB 3.25Å; K11-K15 WeakPolarHBondContact O-CB 3.17Å; K11-K15 PolarHBondContact O-N 3.18Å
12	D	55.3	Low	51.6	Low	67 Å²	67	115.4 Å²	115.4	36%	0.358	60%	0.595	S	S	.	*	H	α-helix	trans	-71.4	-37.5	178.5	-66.2	-28.6	0	0	0	111	Q8 C9 K15 D16	Q8-D12 PolarHBondContact NE2-OD1 3.38Å; Q8-D12 PolarHBondContact NE2-OD2 2.96Å; Q8-D12 WeakPolarHBondContact O-CB 3.2Å; Q8-D12 VanDerWaalsContact O-CG 3.25Å; Q8-D12 PolarHBondContact O-N 3Å; C9-D12 PolarHBondContact O-N 3.39Å; D12-K15 PolarHBondContact O-N 2.86Å; D12-D16 PolarHBondContact O-N 3.3Å
13	F	54.3	Low	51	Low	150 Å²	150	113.8 Å²	113.8	66%	0.658	59%	0.585	S	S	*	*	H	α-helix	trans	-63.5	-43.9	171.7	-164.4	-94	0	0	0	112.2	C9 K15 D16 T17	C9-F13 VanDerWaalsContact O-CB 3.25Å; C9-F13 WeakPolarHBondContact O-CB 3.41Å; C9-F13 PolarHBondContact O-N 3.13Å; F13-K15 VanDerWaalsContact C-N 3.3Å; F13-K15 PolarHBondContact O-N 3.07Å; F13-D16 PolarHBondContact O-N 3.26Å; F13-T17 WeakPolarHBondContact O-CB 3.4Å; F13-T17 PolarHBondContact O-N 3.41Å; F13-T17 PolarHBondContact O-OG1 3.19Å
14	H	52.4	Low	50.2	Low	126 Å²	126	111.2 Å²	111.2	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-62.3	-38.5	173	-116	109.2	0	0	0	111.8	L10 K11 L18	L10-H14 WeakPolarHBondContact O-CB 3.45Å; L10-H14 PolarHBondContact O-N 2.94Å; K11-H14 PolarHBondContact O-N 3.37Å; H14-L18 WeakPolarHBondContact O-CB 3.48Å; H14-L18 WeakPolarHBondContact O-CD1 3.38Å; H14-L18 VanDerWaalsContact O-CG 3.24Å; H14-L18 WeakPolarHBondContact O-CG 3.45Å; H14-L18 PolarHBondContact O-N 3.32Å; H14-L18 VanDerWaalsContact O-N 3.12Å
15	K	48.3	Very low	49.3	Very low	137 Å²	137	103.8 Å²	103.8	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-71.3	-32.8	-179.2	-163	176.8	-175.9	-177.8	0	112.7	K11 D12 F13 K19	K11-K15 VanDerWaalsContact O-CB 3.25Å; K11-K15 WeakPolarHBondContact O-CB 3.17Å; K11-K15 PolarHBondContact O-N 3.18Å; D12-K15 PolarHBondContact O-N 2.86Å; F13-K15 VanDerWaalsContact C-N 3.3Å; F13-K15 PolarHBondContact O-N 3.07Å; K15-K19 PolarHBondContact O-N 3.49Å
16	D	46.5	Very low	48.1	Very low	98 Å²	98	99.9 Å²	99.9	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-82.9	-27.2	175.9	-77.9	-23.8	0	0	0	113	D12 F13 L18 K19	D12-D16 PolarHBondContact O-N 3.3Å; F13-D16 PolarHBondContact O-N 3.26Å; D16-L18 VanDerWaalsContact C-N 3.32Å; D16-K19 WeakPolarHBondContact OD1-CE 3.44Å; D16-K19 IonicContact OD1-NZ 2.78Å; D16-K19 PolarHBondContact OD1-NZ 3.07Å
17	T	48.1	Very low	47.3	Very low	90 Å²	90	94.2 Å²	94.2	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-72.5	-27.5	171.3	-43.6	0	0	0	0	112	F13	F13-T17 WeakPolarHBondContact O-CB 3.4Å; F13-T17 PolarHBondContact O-N 3.41Å; F13-T17 PolarHBondContact O-OG1 3.19Å
18	L	45.3	Very low	46.3	Very low	92 Å²	92	91.1 Å²	91.1	48%	0.482	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.9	177.6	-71.6	168.3	0	0	0	114.2	H14 D16	H14-L18 WeakPolarHBondContact O-CB 3.48Å; H14-L18 WeakPolarHBondContact O-CD1 3.38Å; H14-L18 VanDerWaalsContact O-CG 3.24Å; H14-L18 WeakPolarHBondContact O-CG 3.45Å; H14-L18 PolarHBondContact O-N 3.32Å; H14-L18 VanDerWaalsContact O-N 3.12Å; D16-L18 VanDerWaalsContact C-N 3.32Å
19	K	36.8	Very low	45.4	Very low	125 Å²	125	94.1 Å²	94.1	54%	0.543	51%	0.505	S	S	.	.	S	Bend	trans	-73.6	127.6	168	-84.2	174.1	-173.4	157.5	0	108.4	K15 D16 S21	K15-K19 PolarHBondContact O-N 3.49Å; D16-K19 WeakPolarHBondContact OD1-CE 3.44Å; D16-K19 IonicContact OD1-NZ 2.78Å; D16-K19 PolarHBondContact OD1-NZ 3.07Å; K19-S21 PolarHBondContact O-N 3.26Å
20	P	38.9	Very low	44.6	Very low	103 Å²	103	93.2 Å²	93.2	67%	0.669	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-60.1	128.6	170.6	24.6	-30.1	0	0	0	108.4
21	S	36.6	Very low	44	Very low	76 Å²	76	93.1 Å²	93.1	53%	0.531	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-53.1	143.9	166.4	-62.5	0	0	0	0	109.2	K19 G23 K24	K19-S21 PolarHBondContact O-N 3.26Å; S21-G23 PolarHBondContact O-N 2.98Å; S21-K24 PolarHBondContact O-N 3.11Å
22	P	31.8	Very low	43.4	Very low	139 Å²	139	88.2 Å²	88.2	90%	0.903	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	104.5	174.4	25.5	-30.7	0	0	0	107.8
23	G	40.1	Very low	42.8	Very low	34 Å²	34	89.9 Å²	89.9	35%	0.351	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	147.6	-17.6	-171.1	0	0	0	0	0	118	S21 Y426	S21-G23 PolarHBondContact O-N 2.98Å; G23-Y426 WeakPolarHBondContact CA-OH 3.46Å; G23-Y426 WeakPolarHBondContact O-CE2 3.43Å
24	K	39.4	Very low	42.5	Very low	120 Å²	120	87 Å²	87	52%	0.522	48%	0.484	S	S	.	.			trans	-101.2	141.6	-170.3	-67	-168.8	175.8	-167	0	113.8	S21	S21-K24 PolarHBondContact O-N 3.11Å
25	S	40	Very low	42.1	Very low	19 Å²	19	86.8 Å²	86.8	13%	0.133	48%	0.483	C	S	.	.			trans	-56.9	140.6	-178.6	-153.8	0	0	0	0	111.8	G27 R423 G425	S25-G27 PolarHBondContact O-N 3.25Å; S25-G27 VanDerWaalsContact O-N 3.11Å; S25-R423 PolarHBondContact OG-O 2.85Å; S25-G425 WeakPolarHBondContact CB-O 3.49Å; S25-G425 PolarHBondContact OG-O 3.08Å
26	P	37	Very low	41.8	Very low	51 Å²	51	83.5 Å²	83.5	33%	0.331	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	107.3	176.1	-3.5	20.2	0	0	0	109
27	G	43.8	Very low	41.8	Very low	36 Å²	36	84.5 Å²	84.5	37%	0.371	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	156.2	-30.9	170.8	0	0	0	0	0	116.7	S25	S25-G27 PolarHBondContact O-N 3.25Å; S25-G27 VanDerWaalsContact O-N 3.11Å
28	T	39.3	Very low	41.9	Very low	34 Å²	34	88.3 Å²	88.3	21%	0.209	50%	0.499	C	S	.	.			trans	-93.4	122.5	-179.9	15	0	0	0	0	111.5	E33 P39	T28-E33 VanDerWaalsContact CB-OE1 3.23Å; T28-E33 WeakPolarHBondContact CB-OE1 3.45Å; T28-E33 HydrophobicContact CG2-CG 3.49Å; T28-E33 VanDerWaalsContact CG2-CG 3.49Å; T28-E33 PolarHBondContact OG1-OE1 2.75Å; T28-P39 HydrophobicContact CG2-CB 4.12Å; T28-P39 HydrophobicContact CG2-CG 4.21Å
29	R	43.9	Very low	42.4	Very low	161 Å²	161	86.4 Å²	86.4	61%	0.608	49%	0.492	S	S	*	.			trans	-67.1	142.2	159.2	-64.5	-177.9	-176.5	-179.2	3.5	107.3	E31 D32 E33	R29-E31 HydrophobicContact CB-CB 4.38Å; R29-E31 HydrophobicContact CB-CG 4.38Å; R29-E31 PolarHBondContact O-N 3.4Å; R29-D32 WeakPolarHBondContact CB-OD2 3.48Å; R29-D32 PolarHBondContact O-N 3.45Å; R29-E33 PolarHBondContact O-N 3.07Å
30	P	45.2	Very low	43.8	Very low	66 Å²	66	87.1 Å²	87.1	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-53.2	-27.3	175.8	-23.7	32.3	0	0	0	113.1	A34	P30-A34 PolarHBondContact O-N 2.64Å
31	E	44.7	Very low	45.8	Very low	108 Å²	108	83.7 Å²	83.7	51%	0.505	47%	0.471	S	S	.	.	H	α-helix	trans	-68.2	-41.1	179.3	-41.7	-180	-116.3	0	0	112.2	R29 A34 E35	R29-E31 HydrophobicContact CB-CB 4.38Å; R29-E31 HydrophobicContact CB-CG 4.38Å; R29-E31 PolarHBondContact O-N 3.4Å; E31-A34 PolarHBondContact O-N 3.05Å; E31-E35 PolarHBondContact O-N 3.03Å
32	D	43.4	Very low	48.1	Very low	20 Å²	20	81.9 Å²	81.9	11%	0.107	45%	0.454	C	S	.	.	H	α-helix	trans	-74.1	-31	-178.1	-64.5	-45.5	0	0	0	111.9	R29 G36 K37	R29-D32 WeakPolarHBondContact CB-OD2 3.48Å; R29-D32 PolarHBondContact O-N 3.45Å; D32-G36 PolarHBondContact O-N 3.16Å; D32-K37 PolarHBondContact O-N 3.49Å
33	E	44	Very low	50.9	Low	103 Å²	103	78.6 Å²	78.6	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-71.8	-35.8	173.3	-71.4	-177.5	171.6	0	0	112.1	T28 R29 E35 G36	T28-E33 VanDerWaalsContact CB-OE1 3.23Å; T28-E33 WeakPolarHBondContact CB-OE1 3.45Å; T28-E33 HydrophobicContact CG2-CG 3.49Å; T28-E33 VanDerWaalsContact CG2-CG 3.49Å; T28-E33 PolarHBondContact OG1-OE1 2.75Å; R29-E33 PolarHBondContact O-N 3.07Å; E33-E35 VanDerWaalsContact C-N 3.29Å; E33-E35 PolarHBondContact O-N 3.29Å; E33-G36 PolarHBondContact O-N 3.44Å
34	A	48	Very low	53.4	Low	89 Å²	89	77.7 Å²	77.7	74%	0.736	41%	0.412	S	S	*	.	H	α-helix	trans	-68.7	-27.7	176.7	0	0	0	0	0	112.6	P30 E31	P30-A34 PolarHBondContact O-N 2.64Å; E31-A34 PolarHBondContact O-N 3.05Å
35	E	43.3	Very low	55.8	Low	122 Å²	122	76.2 Å²	76.2	57%	0.57	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.9	178.2	-68	-175.1	167.4	0	0	114	E31 E33 K37	E31-E35 PolarHBondContact O-N 3.03Å; E33-E35 VanDerWaalsContact C-N 3.29Å; E33-E35 PolarHBondContact O-N 3.29Å; E35-K37 HydrophobicContact CB-CD 4.27Å; E35-K37 HydrophobicContact CB-CG 4.17Å; E35-K37 PolarHBondContact O-N 2.94Å; E35-K37 WeakPolarHBondContact OE2-CD 3.32Å; E35-K37 WeakPolarHBondContact OE2-CE 3.47Å; E35-K37 IonicContact OE2-NZ 3.97Å; E35-K37 PolarHBondContact OE2-NZ 3.08Å
36	G	42.6	Very low	58.2	Low	68 Å²	68	77.3 Å²	77.3	70%	0.701	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	18.7	-177.8	0	0	0	0	0	114.1	D32 E33	D32-G36 PolarHBondContact O-N 3.16Å; E33-G36 PolarHBondContact O-N 3.44Å
37	K	45.4	Very low	60.9	Low	119 Å²	119	82 Å²	82	52%	0.517	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-75	139.9	178.7	-74.7	176.2	176.2	164.4	0	109.8	D32 E35	D32-K37 PolarHBondContact O-N 3.49Å; E35-K37 HydrophobicContact CB-CD 4.27Å; E35-K37 HydrophobicContact CB-CG 4.17Å; E35-K37 PolarHBondContact O-N 2.94Å; E35-K37 WeakPolarHBondContact OE2-CD 3.32Å; E35-K37 WeakPolarHBondContact OE2-CE 3.47Å; E35-K37 IonicContact OE2-NZ 3.97Å; E35-K37 PolarHBondContact OE2-NZ 3.08Å
38	H	49.6	Very low	63.2	Low	169 Å²	169	84.5 Å²	84.5	78%	0.782	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-57.7	138	174.3	-74.7	-77.4	0	0	0	110.2	Q40	H38-Q40 PolarHBondContact O-N 3.31Å; H38-Q40 VanDerWaalsContact O-N 3.11Å
39	P	57.1	Low	65.7	Low	52 Å²	52	83.7 Å²	83.7	34%	0.338	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-53.2	120.3	179	-23.2	30.6	0	0	0	110.7	T28	T28-P39 HydrophobicContact CG2-CB 4.12Å; T28-P39 HydrophobicContact CG2-CG 4.21Å
40	Q	66.2	Low	68.1	Low	140 Å²	140	76 Å²	76	65%	0.654	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-63.8	137.3	175.8	-70.6	-171.3	2.1	0	0	109.7	H38 E42	H38-Q40 PolarHBondContact O-N 3.31Å; H38-Q40 VanDerWaalsContact O-N 3.11Å; Q40-E42 PolarHBondContact O-N 3.2Å
41	R	80.4	Confident	70.5	Confident	32 Å²	32	74.9 Å²	74.9	12%	0.121	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-59.7	135.7	177.8	-167.1	-172.5	-166.5	94.4	10.6	109.5	S106 E107 S314 Y315 D416	R41-S106 WeakPolarHBondContact CD-O 3.49Å; R41-S106 VanDerWaalsContact NH1-C 3.33Å; R41-S106 PolarHBondContact NH1-O 2.83Å; R41-E107 IonicContact NH1-OE2 3.6Å; R41-S314 WeakPolarHBondContact CD-O 3.24Å; R41-S314 VanDerWaalsContact CZ-CB 3.41Å; R41-S314 PolarHBondContact NE-O 3.39Å; R41-S314 PolarHBondContact NE-OG 3.31Å; R41-S314 PolarHBondContact NH2-OG 2.95Å; R41-Y315 HydrophobicContact CG-CD1 4.24Å; R41-Y315 HydrophobicContact CG-CE1 4.25Å; R41-D416 IonicContact CZ-OD2 3.77Å; R41-D416 IonicContact NH1-OD1 2.9Å; R41-D416 IonicContact NH1-OD2 2.67Å; R41-D416 PolarHBondContact NH1-OD2 2.89Å; R41-D416 IonicContact NH2-OD2 3.73Å; R41-D416 PolarHBondContact NH2-OD2 2.96Å
42	E	85.3	Confident	72.8	Confident	37 Å²	37	71 Å²	71	17%	0.173	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-58	155.8	171.1	-59.3	-158.8	130.6	0	0	110.8	Q40 V239 K240 Y315	Q40-E42 PolarHBondContact O-N 3.2Å; E42-V239 HydrophobicContact CB-CG2 4.34Å; E42-K240 WeakPolarHBondContact OE1-CE 3.43Å; E42-K240 IonicContact OE1-NZ 2.76Å; E42-K240 PolarHBondContact OE1-NZ 3.15Å; E42-Y315 WeakPolarHBondContact O-CD1 3.46Å
43	K	90.6	Very high	75.2	Confident	71 Å²	71	70 Å²	70	31%	0.309	38%	0.384	S	S	.	.			trans	-131.3	153.8	178.2	-62.8	-65.8	178.3	180	0	109.6	A45 S106 S314 Y315 N316	K43-A45 PolarHBondContact O-N 3.29Å; K43-S106 PolarHBondContact NZ-OG 3.21Å; K43-S106 VanDerWaalsContact NZ-OG 3.11Å; K43-S314 PolarHBondContact NZ-O 3.2Å; K43-Y315 VanDerWaalsContact CA-O 3.25Å; K43-Y315 WeakPolarHBondContact CA-O 3.26Å; K43-Y315 WeakPolarHBondContact CD-O 3.38Å; K43-N316 WeakPolarHBondContact CD-O 3.28Å; K43-N316 WeakPolarHBondContact CE-O 3.2Å; K43-N316 PolarHBondContact NZ-O 2.87Å
44	W	92	Very high	77.6	Confident	15 Å²	15	65.1 Å²	65.1	6%	0.057	36%	0.361	C	S	.	.			trans	-55.1	135.3	173.5	-65.4	110.6	0	0	0	111	D49 F50 S53 V239 L312 Y315 N316	W44-D49 HydrophobicContact CE3-CB 3.88Å; W44-D49 HydrophobicContact CZ3-CB 4.45Å; W44-F50 HydrophobicContact CD2-CB 4.14Å; W44-F50 HydrophobicContact CG-CB 3.93Å; W44-F50 AromaticContact NE1-CD2 3.47Å; W44-S53 WeakPolarHBondContact CH2-OG 3.49Å; W44-S53 WeakPolarHBondContact CZ3-OG 3.45Å; W44-V239 HydrophobicContact CD2-CB 4.4Å; W44-V239 HydrophobicContact CE3-CB 3.88Å; W44-V239 HydrophobicContact CE3-CG1 4.37Å; W44-V239 HydrophobicContact CH2-CB 3.85Å; W44-V239 HydrophobicContact CH2-CG1 3.58Å; W44-V239 HydrophobicContact CZ2-CB 4.36Å; W44-V239 HydrophobicContact CZ2-CG1 3.81Å; W44-V239 HydrophobicContact CZ3-CB 3.59Å; W44-V239 HydrophobicContact CZ3-CG1 3.89Å; W44-L312 HydrophobicContact CH2-CD2 4.01Å; W44-L312 HydrophobicContact CZ2-CB 4.38Å; W44-L312 HydrophobicContact CZ2-CD2 3.69Å; W44-L312 PolarHBondContact NE1-O 2.88Å; W44-Y315 VanDerWaalsContact CD1-C 3.4Å; W44-Y315 VanDerWaalsContact CD1-O 3.3Å; W44-Y315 HydrophobicContact CZ2-CD2 4.37Å; W44-Y315 PolarHBondContact N-O 3.28Å; W44-Y315 VanDerWaalsContact NE1-CB 3.33Å; W44-N316 PolarHBondContact NE1-OD1 3.19Å
45	A	89.4	Confident	79.8	Confident	88 Å²	88	61 Å²	61	73%	0.727	33%	0.327	S	S	*	.	S	Bend	trans	-70.8	-38.9	-179.1	0	0	0	0	0	110.8	K43 D49	K43-A45 PolarHBondContact O-N 3.29Å; A45-D49 WeakPolarHBondContact CB-OD2 3.32Å
46	S	91.8	Very high	82.1	Confident	43 Å²	43	55.3 Å²	55.3	30%	0.301	30%	0.301	S	S	.	.	S	Bend	trans	-131.9	162.4	175.1	94.6	0	0	0	0	112.4	L48 D49	S46-L48 VanDerWaalsContact C-N 3.26Å; S46-L48 PolarHBondContact OG-N 3.18Å; S46-L48 VanDerWaalsContact OG-N 3.16Å; S46-D49 PolarHBondContact N-OD2 3.11Å; S46-D49 VanDerWaalsContact N-OD2 3.07Å; S46-D49 PolarHBondContact O-N 3.13Å; S46-D49 PolarHBondContact OG-N 3.34Å; S46-D49 PolarHBondContact OG-OD1 2.81Å
47	K	92	Very high	84.3	Confident	149 Å²	149	52.1 Å²	52.1	65%	0.648	27%	0.268	S	S	*	.	H	α-helix	trans	-64.9	-34.8	171.9	-54.9	-163.3	175.8	177.1	0	111.6	D49 F50 V51 Y320	K47-D49 VanDerWaalsContact C-N 3.29Å; K47-D49 PolarHBondContact O-N 3.38Å; K47-F50 PolarHBondContact O-N 3.49Å; K47-V51 WeakPolarHBondContact O-CG2 3.32Å; K47-V51 PolarHBondContact O-N 3.01Å; K47-Y320 HydrophobicContact CB-CE2 3.91Å; K47-Y320 HydrophobicContact CD-CD2 4.5Å; K47-Y320 HydrophobicContact CD-CE2 3.82Å; K47-Y320 HydrophobicContact CG-CD2 4.44Å; K47-Y320 HydrophobicContact CG-CE2 3.69Å
48	L	92.3	Very high	86.3	Confident	88 Å²	88	46.7 Å²	46.7	46%	0.461	25%	0.245	S	C	.	.	H	α-helix	trans	-67.5	-34.1	-179.1	-159.5	103.1	0	0	0	110.9	S46 F50 V51 L52 Y247	S46-L48 VanDerWaalsContact C-N 3.26Å; S46-L48 PolarHBondContact OG-N 3.18Å; S46-L48 VanDerWaalsContact OG-N 3.16Å; L48-F50 VanDerWaalsContact C-N 3.32Å; L48-F50 PolarHBondContact O-N 3.06Å; L48-V51 PolarHBondContact O-N 3.27Å; L48-L52 HydrophobicContact CD2-CD1 3.53Å; L48-L52 HydrophobicContact CD2-CG 4.21Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.13Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CG 3.29Å; L48-L52 PolarHBondContact O-N 2.96Å; L48-Y247 HydrophobicContact CD2-CD1 4.12Å; L48-Y247 HydrophobicContact CD2-CE1 3.18Å; L48-Y247 VanDerWaalsContact CD2-CZ 3.43Å; L48-Y247 VanDerWaalsContact CD2-OH 3.28Å; L48-Y247 WeakPolarHBondContact CD2-OH 3.48Å
49	D	93.1	Very high	88.2	Confident	17 Å²	17	38.9 Å²	38.9	9%	0.091	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-44.1	176.8	-54.2	-4.3	0	0	0	110.3	W44 A45 S46 K47 S53 Y247	W44-D49 HydrophobicContact CE3-CB 3.88Å; W44-D49 HydrophobicContact CZ3-CB 4.45Å; A45-D49 WeakPolarHBondContact CB-OD2 3.32Å; S46-D49 PolarHBondContact N-OD2 3.11Å; S46-D49 VanDerWaalsContact N-OD2 3.07Å; S46-D49 PolarHBondContact O-N 3.13Å; S46-D49 PolarHBondContact OG-N 3.34Å; S46-D49 PolarHBondContact OG-OD1 2.81Å; K47-D49 VanDerWaalsContact C-N 3.29Å; K47-D49 PolarHBondContact O-N 3.38Å; D49-S53 WeakPolarHBondContact O-CB 3.1Å; D49-S53 PolarHBondContact O-N 2.86Å; D49-S53 PolarHBondContact O-OG 3.27Å; D49-Y247 WeakPolarHBondContact OD1-CE2 3.33Å; D49-Y247 PolarHBondContact OD1-OH 3.32Å
50	F	93.8	Very high	89.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-52.6	174.1	169.7	-108.5	0	0	0	111.3	W44 K47 L48 L52 S53 V54 V99 L312 N316 Y320	W44-F50 HydrophobicContact CD2-CB 4.14Å; W44-F50 HydrophobicContact CG-CB 3.93Å; W44-F50 AromaticContact NE1-CD2 3.47Å; K47-F50 PolarHBondContact O-N 3.49Å; L48-F50 VanDerWaalsContact C-N 3.32Å; L48-F50 PolarHBondContact O-N 3.06Å; F50-L52 PolarHBondContact O-N 3.4Å; F50-S53 PolarHBondContact O-N 3.45Å; F50-V54 HydrophobicContact CD2-CG2 3.84Å; F50-V54 HydrophobicContact CE1-CG2 4.36Å; F50-V54 HydrophobicContact CE2-CG2 3.41Å; F50-V54 VanDerWaalsContact CE2-CG2 3.41Å; F50-V54 HydrophobicContact CG-CG2 4.49Å; F50-V54 HydrophobicContact CZ-CG2 3.71Å; F50-V54 WeakPolarHBondContact O-CG2 3.47Å; F50-V54 PolarHBondContact O-N 3.46Å; F50-V99 HydrophobicContact CZ-CG1 3.94Å; F50-L312 HydrophobicContact CE2-CB 4.39Å; F50-N316 VanDerWaalsContact CD2-OD1 3.24Å; F50-N316 WeakPolarHBondContact CD2-OD1 3.41Å; F50-N316 WeakPolarHBondContact CE2-ND2 3.25Å; F50-N316 WeakPolarHBondContact CG-OD1 3.43Å; F50-N316 WeakPolarHBondContact CZ-ND2 3.28Å; F50-Y320 AromaticContact CD1-CE1 3.86Å; F50-Y320 HydrophobicContact CD1-CE1 3.86Å; F50-Y320 AromaticContact CD1-CZ 3.74Å; F50-Y320 WeakPolarHBondContact CD1-OH 3.49Å; F50-Y320 AromaticContact CE1-CE1 3.82Å; F50-Y320 HydrophobicContact CE1-CE1 3.82Å
51	V	94.9	Very high	90.7	Very high	42 Å²	42	30.1 Å²	30.1	26%	0.255	16%	0.164	S	C	.	.	H	α-helix	trans	-59.5	-45.6	-177.1	171.3	0	0	0	0	111.2	K47 L48 A55 L329	K47-V51 WeakPolarHBondContact O-CG2 3.32Å; K47-V51 PolarHBondContact O-N 3.01Å; L48-V51 PolarHBondContact O-N 3.27Å; V51-A55 WeakPolarHBondContact O-CA 3.23Å; V51-A55 WeakPolarHBondContact O-CB 3.36Å; V51-A55 PolarHBondContact O-N 3.14Å; V51-L329 HydrophobicContact CG1-CD2 4.02Å
52	L	94.1	Very high	91	Very high	27 Å²	27	28.9 Å²	28.9	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-70.7	-34.7	177.8	-70.2	-179.7	0	0	0	112.6	L48 F50 A55 G56 V246 Y247 T251	L48-L52 HydrophobicContact CD2-CD1 3.53Å; L48-L52 HydrophobicContact CD2-CG 4.21Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.13Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CG 3.29Å; L48-L52 PolarHBondContact O-N 2.96Å; F50-L52 PolarHBondContact O-N 3.4Å; L52-A55 PolarHBondContact O-N 3.3Å; L52-G56 PolarHBondContact O-N 3.43Å; L52-V246 HydrophobicContact CB-CB 4.2Å; L52-V246 HydrophobicContact CB-CG2 3.89Å; L52-Y247 HydrophobicContact CD1-CD1 4.02Å; L52-Y247 HydrophobicContact CD1-CD2 4.4Å; L52-Y247 HydrophobicContact CD1-CE1 4.16Å; L52-Y247 HydrophobicContact CD1-CE2 4.5Å; L52-Y247 HydrophobicContact CD1-CG 4.16Å; L52-T251 HydrophobicContact CD2-CG2 4.49Å
53	S	93.9	Very high	91.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-44.1	176.4	-59.3	0	0	0	0	111.4	W44 D49 F50 A55 G57 V405	W44-S53 WeakPolarHBondContact CH2-OG 3.49Å; W44-S53 WeakPolarHBondContact CZ3-OG 3.45Å; D49-S53 WeakPolarHBondContact O-CB 3.1Å; D49-S53 PolarHBondContact O-N 2.86Å; D49-S53 PolarHBondContact O-OG 3.27Å; F50-S53 PolarHBondContact O-N 3.45Å; S53-A55 VanDerWaalsContact C-N 3.3Å; S53-G57 PolarHBondContact O-N 2.88Å; S53-V405 WeakPolarHBondContact O-CG2 3.45Å
54	V	94.8	Very high	91.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.7	-41.7	172.4	179.6	0	0	0	0	109.8	F50 G57 F58 F95 M309 L312 L329	F50-V54 HydrophobicContact CD2-CG2 3.84Å; F50-V54 HydrophobicContact CE1-CG2 4.36Å; F50-V54 HydrophobicContact CE2-CG2 3.41Å; F50-V54 VanDerWaalsContact CE2-CG2 3.41Å; F50-V54 HydrophobicContact CG-CG2 4.49Å; F50-V54 HydrophobicContact CZ-CG2 3.71Å; F50-V54 WeakPolarHBondContact O-CG2 3.47Å; F50-V54 PolarHBondContact O-N 3.46Å; V54-G57 PolarHBondContact O-N 3.42Å; V54-F58 HydrophobicContact CG1-CE2 4.38Å; V54-F58 HydrophobicContact CG1-CZ 4.45Å; V54-F58 WeakPolarHBondContact O-CD1 3.22Å; V54-F58 WeakPolarHBondContact O-CE1 3.38Å; V54-F58 WeakPolarHBondContact O-CG 3.36Å; V54-F58 PolarHBondContact O-N 2.66Å; V54-F58 VanDerWaalsContact O-N 3.14Å; V54-F95 HydrophobicContact CG1-CE2 3.97Å; V54-F95 HydrophobicContact CG1-CZ 3.77Å; V54-M309 HydrophobicContact CG1-SD 4.03Å; V54-L312 HydrophobicContact CG2-CB 4.48Å; V54-L312 HydrophobicContact CG2-CD1 3.79Å; V54-L329 HydrophobicContact CB-CD1 3.96Å; V54-L329 HydrophobicContact CG1-CD1 3.78Å; V54-L329 HydrophobicContact CG1-CD2 4.45Å
55	A	93.9	Very high	90.6	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-46.1	-178.2	0	0	0	0	0	113.8	V51 L52 S53 F58 V59 L329 L332	V51-A55 WeakPolarHBondContact O-CA 3.23Å; V51-A55 WeakPolarHBondContact O-CB 3.36Å; V51-A55 PolarHBondContact O-N 3.14Å; L52-A55 PolarHBondContact O-N 3.3Å; S53-A55 VanDerWaalsContact C-N 3.3Å; A55-F58 HydrophobicContact CB-CE1 4.22Å; A55-F58 VanDerWaalsContact O-CD1 3.23Å; A55-F58 WeakPolarHBondContact O-CD1 3.38Å; A55-F58 WeakPolarHBondContact O-CE1 2.99Å; A55-V59 WeakPolarHBondContact O-CB 3.48Å; A55-V59 WeakPolarHBondContact O-CG2 3.34Å; A55-V59 PolarHBondContact O-N 3.18Å; A55-V59 VanDerWaalsContact O-N 3.08Å; A55-L329 HydrophobicContact CB-CD2 4Å; A55-L332 HydrophobicContact CB-CD2 3.95Å
56	G	90.8	Very high	90.6	Very high	2 Å²	2	23.8 Å²	23.8	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-69.7	-35.1	173.9	0	0	0	0	0	112.1	L52 F58 D401	L52-G56 PolarHBondContact O-N 3.43Å; G56-F58 PolarHBondContact O-N 2.99Å; G56-D401 VanDerWaalsContact C-CB 3.48Å; G56-D401 VanDerWaalsContact O-CB 3.24Å; G56-D401 WeakPolarHBondContact O-CB 3.05Å
57	G	88.9	Confident	90.7	Very high	2 Å²	2	21.8 Å²	21.8	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-47	-179.1	0	0	0	0	0	113.2	S53 V54 S402	S53-G57 PolarHBondContact O-N 2.88Å; V54-G57 PolarHBondContact O-N 3.42Å; G57-S402 WeakPolarHBondContact O-CA 3.3Å; G57-S402 WeakPolarHBondContact O-CB 3.34Å; G57-S402 PolarHBondContact O-OG 3.05Å
58	F	86.9	Confident	90.7	Very high	5 Å²	5	14.7 Å²	14.7	2%	0.022	8%	0.076	C	C	.	.	H	α-helix	trans	-98.8	-16.1	-175.7	74.5	-12.3	0	0	0	115.1	V54 A55 G56 G60 N63 F95 S301 Y302 L329 N333	V54-F58 HydrophobicContact CG1-CE2 4.38Å; V54-F58 HydrophobicContact CG1-CZ 4.45Å; V54-F58 WeakPolarHBondContact O-CD1 3.22Å; V54-F58 WeakPolarHBondContact O-CE1 3.38Å; V54-F58 WeakPolarHBondContact O-CG 3.36Å; V54-F58 PolarHBondContact O-N 2.66Å; V54-F58 VanDerWaalsContact O-N 3.14Å; A55-F58 HydrophobicContact CB-CE1 4.22Å; A55-F58 VanDerWaalsContact O-CD1 3.23Å; A55-F58 WeakPolarHBondContact O-CD1 3.38Å; A55-F58 WeakPolarHBondContact O-CE1 2.99Å; G56-F58 PolarHBondContact O-N 2.99Å; F58-G60 PolarHBondContact O-N 2.73Å; F58-N63 PolarHBondContact O-OD1 3.14Å; F58-N63 VanDerWaalsContact O-OD1 3.09Å; F58-F95 HydrophobicContact CE2-CE1 4.35Å; F58-F95 HydrophobicContact CE2-CZ 4.33Å; F58-S301 WeakPolarHBondContact CB-O 3.35Å; F58-Y302 HydrophobicContact CD2-CD1 4.15Å; F58-Y302 HydrophobicContact CE2-CD1 4.37Å; F58-Y302 HydrophobicContact CE2-CE1 4.39Å; F58-L329 HydrophobicContact CE1-CD2 4.35Å; F58-L329 HydrophobicContact CE2-CB 4Å; F58-L329 HydrophobicContact CZ-CB 3.66Å; F58-L329 HydrophobicContact CZ-CD2 3.9Å; F58-L329 HydrophobicContact CZ-CG 4.38Å; F58-L329 WeakPolarHBondContact CZ-O 3.47Å; F58-N333 HydrophobicContact CD2-CB 4Å; F58-N333 HydrophobicContact CE1-CB 4.1Å; F58-N333 HydrophobicContact CE2-CB 3.65Å; F58-N333 HydrophobicContact CG-CB 4.46Å; F58-N333 HydrophobicContact CZ-CB 3.73Å; F58-N333 PolarHBondContact O-OD1 3.41Å
59	V	89.9	Confident	90.5	Very high	4 Å²	4	12.6 Å²	12.6	2%	0.024	6%	0.063	C	C	.	.	S	Bend	trans	-92.9	84	170.8	-179.5	0	0	0	0	107.4	A55 N63 F254 T336 L398	A55-V59 WeakPolarHBondContact O-CB 3.48Å; A55-V59 WeakPolarHBondContact O-CG2 3.34Å; A55-V59 PolarHBondContact O-N 3.18Å; A55-V59 VanDerWaalsContact O-N 3.08Å; V59-N63 WeakPolarHBondContact CA-OD1 3.03Å; V59-F254 HydrophobicContact CB-CZ 4.3Å; V59-F254 HydrophobicContact CG1-CE1 4.3Å; V59-F254 HydrophobicContact CG1-CZ 4.05Å; V59-F254 HydrophobicContact CG2-CZ 4.16Å; V59-T336 HydrophobicContact CG1-CG2 3.66Å; V59-L398 HydrophobicContact CG1-CD2 4.31Å; V59-L398 WeakPolarHBondContact O-CD2 3.27Å
60	G	88.6	Confident	90.4	Very high	4 Å²	4	12.2 Å²	12.2	4%	0.041	6%	0.061	C	C	.	.	S	Bend	trans	-114.8	-159.4	-176.7	0	0	0	0	0	112.7	F58 G62 N63 S402	F58-G60 PolarHBondContact O-N 2.73Å; G60-G62 PolarHBondContact O-N 3.16Å; G60-N63 PolarHBondContact N-OD1 3.07Å; G60-N63 PolarHBondContact O-N 3.21Å; G60-N63 PolarHBondContact O-OD1 3.17Å; G60-S402 WeakPolarHBondContact CA-OG 3.46Å
61	L	87.4	Confident	90.3	Very high	5 Å²	5	12.2 Å²	12.2	3%	0.026	6%	0.061	C	C	.	.	H	α-helix	trans	-58	-37.9	177.1	-62.6	177	0	0	0	111.7	N63 V64 W65 Y138 I141 L395 L398	L61-N63 PolarHBondContact O-N 2.95Å; L61-N63 VanDerWaalsContact O-N 3.14Å; L61-V64 PolarHBondContact O-N 3.18Å; L61-W65 HydrophobicContact CB-CD2 4.34Å; L61-W65 HydrophobicContact CB-CZ2 3.85Å; L61-W65 HydrophobicContact CD1-CH2 4.19Å; L61-W65 HydrophobicContact CD1-CZ2 3.96Å; L61-W65 PolarHBondContact O-N 3.03Å; L61-W65 PolarHBondContact O-NE1 3.01Å; L61-Y138 HydrophobicContact CD1-CE2 4.33Å; L61-Y138 PolarHBondContact N-OH 3.13Å; L61-I141 HydrophobicContact CD1-CB 4.24Å; L61-I141 HydrophobicContact CD1-CD1 4.5Å; L61-I141 HydrophobicContact CD1-CG2 3.45Å; L61-I141 VanDerWaalsContact CD1-CG2 3.45Å; L61-L395 HydrophobicContact CD1-CD2 4.39Å; L61-L395 HydrophobicContact CD2-CB 4.43Å; L61-L395 HydrophobicContact CD2-CD2 3.92Å; L61-L395 HydrophobicContact CD2-CG 3.66Å; L61-L398 HydrophobicContact CD2-CB 4.17Å
62	G	87.7	Confident	90	Very high	6 Å²	6	12.3 Å²	12.3	6%	0.062	6%	0.056	C	C	.	.	I	π-helix	trans	-52.3	-36.1	178.9	0	0	0	0	0	114	G60 R66 F67	G60-G62 PolarHBondContact O-N 3.16Å; G62-R66 WeakPolarHBondContact O-CB 2.77Å; G62-R66 PolarHBondContact O-N 2.79Å; G62-F67 PolarHBondContact O-N 3.04Å
63	N	91.7	Very high	89.8	Confident	2 Å²	2	13.8 Å²	13.8	1%	0.011	6%	0.062	C	C	.	.	I	π-helix	trans	-68.9	-35.7	177.1	-58.1	73.4	0	0	0	111.9	F58 V59 G60 L61 P68 S301 N333 S337 S340	F58-N63 PolarHBondContact O-OD1 3.14Å; F58-N63 VanDerWaalsContact O-OD1 3.09Å; V59-N63 WeakPolarHBondContact CA-OD1 3.03Å; G60-N63 PolarHBondContact N-OD1 3.07Å; G60-N63 PolarHBondContact O-N 3.21Å; G60-N63 PolarHBondContact O-OD1 3.17Å; L61-N63 PolarHBondContact O-N 2.95Å; L61-N63 VanDerWaalsContact O-N 3.14Å; N63-P68 WeakPolarHBondContact O-CD 3.35Å; N63-S301 PolarHBondContact ND2-OG 3.31Å; N63-N333 PolarHBondContact ND2-O 2.95Å; N63-N333 PolarHBondContact ND2-OD1 3.41Å; N63-S337 PolarHBondContact ND2-OG 3.42Å; N63-S340 PolarHBondContact O-OG 3.28Å
64	V	87.1	Confident	89.8	Confident	10 Å²	10	13.8 Å²	13.8	6%	0.061	6%	0.062	C	C	.	.	I	π-helix	trans	-86.2	-42.9	-173.5	-178.3	0	0	0	0	112	L61 P68 L257 I344 L398	L61-V64 PolarHBondContact O-N 3.18Å; V64-P68 WeakPolarHBondContact O-CD 3.3Å; V64-P68 WeakPolarHBondContact O-CG 3.42Å; V64-L257 HydrophobicContact CG2-CD1 4.49Å; V64-L257 HydrophobicContact CG2-CD2 4.09Å; V64-I344 HydrophobicContact CG1-CD1 3.91Å; V64-I344 HydrophobicContact CG1-CG1 4.14Å; V64-I344 WeakPolarHBondContact O-CG1 3.41Å; V64-L398 HydrophobicContact CG2-CD1 3.62Å
65	W	80.4	Confident	89.7	Confident	25 Å²	25	14 Å²	14	10%	0.095	7%	0.065	C	C	.	.	I	π-helix	trans	-110.3	-22.9	-171.4	66.8	-0.4	0	0	0	115.7	L61 Y69 I141 P367 L369 A370 F371	L61-W65 HydrophobicContact CB-CD2 4.34Å; L61-W65 HydrophobicContact CB-CZ2 3.85Å; L61-W65 HydrophobicContact CD1-CH2 4.19Å; L61-W65 HydrophobicContact CD1-CZ2 3.96Å; L61-W65 PolarHBondContact O-N 3.03Å; L61-W65 PolarHBondContact O-NE1 3.01Å; W65-Y69 VanDerWaalsContact O-CB 3.32Å; W65-Y69 WeakPolarHBondContact O-CB 3.45Å; W65-I141 HydrophobicContact CH2-CB 4.47Å; W65-I141 HydrophobicContact CH2-CD1 3.95Å; W65-I141 HydrophobicContact CH2-CG1 4.37Å; W65-I141 HydrophobicContact CH2-CG2 3.37Å; W65-I141 HydrophobicContact CZ2-CD1 3.86Å; W65-I141 HydrophobicContact CZ2-CG2 4.1Å; W65-I141 HydrophobicContact CZ3-CG2 4.16Å; W65-P367 HydrophobicContact CH2-CG 4.46Å; W65-P367 HydrophobicContact CZ3-CB 4.47Å; W65-L369 HydrophobicContact CB-CD2 3.94Å; W65-L369 VanDerWaalsContact O-CD2 3.23Å; W65-L369 WeakPolarHBondContact O-CD2 3.18Å; W65-A370 HydrophobicContact CE3-CB 3.4Å; W65-A370 HydrophobicContact CZ3-CB 3.69Å; W65-F371 HydrophobicContact CH2-CE2 4.41Å; W65-F371 HydrophobicContact CZ3-CD2 4.43Å; W65-F371 AromaticContact CZ3-CE2 3.95Å; W65-F371 HydrophobicContact CZ3-CE2 3.95Å
66	R	88.8	Confident	89.7	Confident	66 Å²	66	14.1 Å²	14.1	25%	0.249	7%	0.065	C	C	.	.	I	π-helix	trans	-100.3	-49.2	-169	-173.6	-176.7	178.8	164.2	5.2	109.6	G62 Y69 L70 Q297	G62-R66 WeakPolarHBondContact O-CB 2.77Å; G62-R66 PolarHBondContact O-N 2.79Å; R66-Y69 WeakPolarHBondContact O-CB 3.49Å; R66-Y69 PolarHBondContact O-N 2.82Å; R66-L70 HydrophobicContact CG-CD1 4.01Å; R66-L70 HydrophobicContact CG-CG 4.3Å; R66-L70 WeakPolarHBondContact O-CB 3.08Å; R66-L70 WeakPolarHBondContact O-CG 3.31Å; R66-L70 PolarHBondContact O-N 3.38Å; R66-Q297 VanDerWaalsContact CD-OE1 3.23Å
67	F	93.4	Very high	89.9	Confident	1 Å²	1	14.8 Å²	14.8	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-57.7	-49.3	176.4	173.1	-91.1	0	0	0	112.6	G62 Y69 L70 C71 F79 L80 Y83 Y277 Q297 S337	G62-F67 PolarHBondContact O-N 3.04Å; F67-Y69 VanDerWaalsContact C-N 3.27Å; F67-Y69 PolarHBondContact O-N 3.16Å; F67-L70 PolarHBondContact O-N 2.78Å; F67-C71 WeakPolarHBondContact O-CB 3.12Å; F67-C71 PolarHBondContact O-N 3.19Å; F67-F79 HydrophobicContact CD2-CE1 4.4Å; F67-F79 HydrophobicContact CE2-CE1 4.19Å; F67-L80 HydrophobicContact CZ-CD2 3.89Å; F67-Y83 HydrophobicContact CD2-CD2 4.04Å; F67-Y83 AromaticContact CD2-CE2 3.56Å; F67-Y83 HydrophobicContact CD2-CE2 3.56Å; F67-Y83 HydrophobicContact CE2-CD1 4.28Å; F67-Y83 AromaticContact CE2-CD2 3.6Å; F67-Y83 HydrophobicContact CE2-CD2 3.6Å; F67-Y83 HydrophobicContact CE2-CE1 4.11Å; F67-Y83 AromaticContact CE2-CE2 3.38Å; F67-Y83 HydrophobicContact CE2-CE2 3.38Å; F67-Y83 HydrophobicContact CE2-CG 4.04Å; F67-Y83 AromaticContact CE2-CZ 3.67Å; F67-Y277 WeakPolarHBondContact CE1-OH 3.5Å; F67-Q297 HydrophobicContact CB-CG 4.49Å; F67-Q297 HydrophobicContact CD2-CG 4.16Å; F67-S337 VanDerWaalsContact CD1-C 3.49Å; F67-S337 WeakPolarHBondContact CD1-O 3.49Å; F67-S337 VanDerWaalsContact CE1-O 3.3Å; F67-S337 WeakPolarHBondContact CE1-O 3.42Å
68	P	91.8	Very high	90.2	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.9	-38.9	179.1	-27.4	40.5	0	0	0	112.1	N63 V64 C71 Y72 G341 F345	N63-P68 WeakPolarHBondContact O-CD 3.35Å; V64-P68 WeakPolarHBondContact O-CD 3.3Å; V64-P68 WeakPolarHBondContact O-CG 3.42Å; P68-C71 PolarHBondContact O-N 3.15Å; P68-Y72 WeakPolarHBondContact O-CD1 3.32Å; P68-Y72 PolarHBondContact O-N 2.94Å; P68-G341 VanDerWaalsContact CG-CA 3.46Å; P68-F345 HydrophobicContact CB-CD2 3.88Å; P68-F345 HydrophobicContact CB-CE2 3.49Å; P68-F345 VanDerWaalsContact CB-CE2 3.49Å; P68-F345 WeakPolarHBondContact O-CE2 3.29Å
69	Y	87.9	Confident	90.7	Very high	45 Å²	45	14.5 Å²	14.5	18%	0.176	7%	0.071	C	C	.	.	H	α-helix	trans	-60.2	-50.1	174.9	171.8	-91.9	0	0	0	112.4	W65 R66 F67 C71 Y72 K73 E364 S365	W65-Y69 VanDerWaalsContact O-CB 3.32Å; W65-Y69 WeakPolarHBondContact O-CB 3.45Å; R66-Y69 WeakPolarHBondContact O-CB 3.49Å; R66-Y69 PolarHBondContact O-N 2.82Å; F67-Y69 VanDerWaalsContact C-N 3.27Å; F67-Y69 PolarHBondContact O-N 3.16Å; Y69-C71 VanDerWaalsContact C-N 3.3Å; Y69-C71 PolarHBondContact O-N 3Å; Y69-Y72 HydrophobicContact CD2-CD1 4.44Å; Y69-Y72 AromaticContact CD2-CE1 3.35Å; Y69-Y72 HydrophobicContact CD2-CE1 3.35Å; Y69-Y72 AromaticContact CD2-CZ 3.69Å; Y69-Y72 WeakPolarHBondContact CD2-OH 3.4Å; Y69-Y72 AromaticContact CE2-CE1 3.88Å; Y69-Y72 HydrophobicContact CE2-CE1 3.88Å; Y69-Y72 AromaticContact CE2-CZ 3.71Å; Y69-Y72 WeakPolarHBondContact CE2-OH 3.5Å; Y69-Y72 AromaticContact CG-CE1 3.94Å; Y69-Y72 HydrophobicContact CG-CE1 3.94Å; Y69-Y72 WeakPolarHBondContact O-CD1 3.34Å; Y69-Y72 VanDerWaalsContact O-CE1 3.27Å; Y69-Y72 WeakPolarHBondContact O-CE1 3.06Å; Y69-Y72 PolarHBondContact O-N 2.81Å; Y69-K73 HydrophobicContact CE1-CB 4.45Å; Y69-K73 HydrophobicContact CE1-CD 3.81Å; Y69-K73 VanDerWaalsContact O-CB 3.31Å; Y69-K73 WeakPolarHBondContact O-CB 3.32Å; Y69-K73 PolarHBondContact O-N 2.05Å; Y69-E364 WeakPolarHBondContact CD2-O 3.34Å; Y69-S365 WeakPolarHBondContact OH-CB 3.33Å
70	L	91.1	Very high	91	Very high	9 Å²	9	15.8 Å²	15.8	5%	0.047	8%	0.078	C	C	.	.	H	α-helix	trans	-65.1	-36.4	179.6	-69.5	178.9	0	0	0	111.9	R66 F67 N74 F79 D293 Q297	R66-L70 HydrophobicContact CG-CD1 4.01Å; R66-L70 HydrophobicContact CG-CG 4.3Å; R66-L70 WeakPolarHBondContact O-CB 3.08Å; R66-L70 WeakPolarHBondContact O-CG 3.31Å; R66-L70 PolarHBondContact O-N 3.38Å; F67-L70 PolarHBondContact O-N 2.78Å; L70-N74 WeakPolarHBondContact O-CB 3.31Å; L70-N74 PolarHBondContact O-N 3.25Å; L70-N74 PolarHBondContact O-ND2 3.44Å; L70-F79 HydrophobicContact CB-CE1 4.17Å; L70-F79 HydrophobicContact CB-CZ 3.96Å; L70-D293 HydrophobicContact CD2-CB 4.12Å; L70-Q297 HydrophobicContact CD1-CB 3.78Å; L70-Q297 HydrophobicContact CD1-CG 4.1Å
71	C	93.2	Very high	91.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.5	-53.4	177.7	-170.5	0	0	0	0	111.1	F67 P68 Y69 N74 G76 F79 Y277	F67-C71 WeakPolarHBondContact O-CB 3.12Å; F67-C71 PolarHBondContact O-N 3.19Å; P68-C71 PolarHBondContact O-N 3.15Å; Y69-C71 VanDerWaalsContact C-N 3.3Å; Y69-C71 PolarHBondContact O-N 3Å; C71-N74 PolarHBondContact O-N 2.98Å; C71-G76 WeakPolarHBondContact O-CA 3.46Å; C71-G76 PolarHBondContact O-N 3.13Å; C71-G76 PolarHBondContact SG-O 2.69Å; C71-G76 VanDerWaalsContact SG-O 3.32Å; C71-F79 HydrophobicContact CB-CD1 4.03Å; C71-Y277 HydrophobicContact CB-CD2 4.04Å; C71-Y277 HydrophobicContact CB-CE2 3.6Å; C71-Y277 WeakPolarHBondContact SG-CE2 3.49Å
72	Y	88.4	Confident	91.8	Very high	43 Å²	43	19.3 Å²	19.3	17%	0.169	10%	0.095	C	C	.	.	H	α-helix	trans	-68.6	-44.3	180	89.7	-96.7	0	0	0	112.1	P68 Y69 N74 G75 F276 F345 A363	P68-Y72 WeakPolarHBondContact O-CD1 3.32Å; P68-Y72 PolarHBondContact O-N 2.94Å; Y69-Y72 HydrophobicContact CD2-CD1 4.44Å; Y69-Y72 AromaticContact CD2-CE1 3.35Å; Y69-Y72 HydrophobicContact CD2-CE1 3.35Å; Y69-Y72 AromaticContact CD2-CZ 3.69Å; Y69-Y72 WeakPolarHBondContact CD2-OH 3.4Å; Y69-Y72 AromaticContact CE2-CE1 3.88Å; Y69-Y72 HydrophobicContact CE2-CE1 3.88Å; Y69-Y72 AromaticContact CE2-CZ 3.71Å; Y69-Y72 WeakPolarHBondContact CE2-OH 3.5Å; Y69-Y72 AromaticContact CG-CE1 3.94Å; Y69-Y72 HydrophobicContact CG-CE1 3.94Å; Y69-Y72 WeakPolarHBondContact O-CD1 3.34Å; Y69-Y72 VanDerWaalsContact O-CE1 3.27Å; Y69-Y72 WeakPolarHBondContact O-CE1 3.06Å; Y69-Y72 PolarHBondContact O-N 2.81Å; Y72-N74 PolarHBondContact O-N 3Å; Y72-N74 VanDerWaalsContact O-N 3.11Å; Y72-G75 PolarHBondContact O-N 2.88Å; Y72-F276 HydrophobicContact CD2-CD1 4.25Å; Y72-F276 AromaticContact CD2-CE1 3.36Å; Y72-F276 HydrophobicContact CD2-CE1 3.36Å; Y72-F276 AromaticContact CD2-CZ 3.95Å; Y72-F276 HydrophobicContact CD2-CZ 3.95Å; Y72-F276 AromaticContact CE2-CE1 3.93Å; Y72-F276 HydrophobicContact CE2-CE1 3.93Å; Y72-F276 HydrophobicContact CE2-CZ 4.37Å; Y72-F276 HydrophobicContact CG-CD1 4.31Å; Y72-F276 AromaticContact CG-CE1 3.82Å; Y72-F276 HydrophobicContact CG-CE1 3.82Å; Y72-F345 AromaticContact CD1-CE1 3.94Å; Y72-F345 HydrophobicContact CD1-CE1 3.94Å; Y72-F345 HydrophobicContact CD1-CE2 4.2Å; Y72-F345 AromaticContact CD1-CZ 3.27Å; Y72-F345 HydrophobicContact CD1-CZ 3.27Å; Y72-F345 AromaticContact CE1-CZ 3.89Å; Y72-F345 HydrophobicContact CE1-CZ 3.89Å; Y72-F345 HydrophobicContact CG-CE1 4.18Å; Y72-F345 AromaticContact CG-CZ 3.91Å; Y72-F345 HydrophobicContact CG-CZ 3.91Å; Y72-A363 HydrophobicContact CE1-CB 4.07Å; Y72-A363 HydrophobicContact CE2-CB 4.33Å; Y72-A363 PolarHBondContact OH-O 3.02Å; Y72-A363 VanDerWaalsContact OH-O 3.07Å
73	K	89.7	Confident	92.3	Very high	58 Å²	58	19.2 Å²	19.2	25%	0.252	9%	0.092	S	C	.	.	H	α-helix	trans	-55.6	-34.3	-179.3	-179.3	-161.6	168	-154.2	0	111.4	Y69 R284 E289 D293	Y69-K73 HydrophobicContact CE1-CB 4.45Å; Y69-K73 HydrophobicContact CE1-CD 3.81Å; Y69-K73 VanDerWaalsContact O-CB 3.31Å; Y69-K73 WeakPolarHBondContact O-CB 3.32Å; Y69-K73 PolarHBondContact O-N 2.05Å; K73-R284 PolarHBondContact O-NE 3.05Å; K73-R284 VanDerWaalsContact O-NE 3.14Å; K73-R284 PolarHBondContact O-NH2 3.38Å; K73-E289 IonicContact NZ-OE1 2.63Å; K73-E289 PolarHBondContact NZ-OE1 2.98Å; K73-D293 IonicContact NZ-OD2 4Å; K73-D293 PolarHBondContact NZ-OD2 3.44Å
74	N	93.3	Very high	92.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	30.4	-171.6	-64.6	-35.1	0	0	0	113.8	L70 C71 Y72 F79 R284 V290 D293	L70-N74 WeakPolarHBondContact O-CB 3.31Å; L70-N74 PolarHBondContact O-N 3.25Å; L70-N74 PolarHBondContact O-ND2 3.44Å; C71-N74 PolarHBondContact O-N 2.98Å; Y72-N74 PolarHBondContact O-N 3Å; Y72-N74 VanDerWaalsContact O-N 3.11Å; N74-F79 HydrophobicContact CB-CB 4.2Å; N74-F79 HydrophobicContact CB-CD2 3.44Å; N74-F79 VanDerWaalsContact CB-CD2 3.44Å; N74-F79 HydrophobicContact CB-CE2 4.06Å; N74-F79 HydrophobicContact CB-CG 4.06Å; N74-R284 PolarHBondContact OD1-NH2 3.35Å; N74-V290 HydrophobicContact CB-CB 4.3Å; N74-V290 HydrophobicContact CB-CG1 4.01Å; N74-V290 HydrophobicContact CB-CG2 3.8Å; N74-D293 VanDerWaalsContact ND2-CB 3.31Å; N74-D293 WeakPolarHBondContact ND2-CB 3.35Å; N74-D293 PolarHBondContact ND2-OD2 3.08Å
75	G	92.5	Very high	93	Very high	6 Å²	6	26.5 Å²	26.5	6%	0.062	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	28.3	170.9	0	0	0	0	0	114.3	Y72 G77 A78 P280 D281	Y72-G75 PolarHBondContact O-N 2.88Å; G75-G77 PolarHBondContact O-N 3.23Å; G75-A78 VanDerWaalsContact O-CB 3.29Å; G75-A78 WeakPolarHBondContact O-CB 3.18Å; G75-A78 PolarHBondContact O-N 2.9Å; G75-A78 VanDerWaalsContact O-N 3.08Å; G75-P280 WeakPolarHBondContact O-CA 3.39Å; G75-D281 PolarHBondContact O-N 2.8Å
76	G	94	Very high	93.7	Very high	3 Å²	3	25.4 Å²	25.4	3%	0.031	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	56.4	-125.7	177.4	0	0	0	0	0	111.8	C71 A78 F79 Y277	C71-G76 WeakPolarHBondContact O-CA 3.46Å; C71-G76 PolarHBondContact O-N 3.13Å; C71-G76 PolarHBondContact SG-O 2.69Å; C71-G76 VanDerWaalsContact SG-O 3.32Å; G76-A78 PolarHBondContact O-N 3.32Å; G76-A78 VanDerWaalsContact O-N 3.07Å; G76-F79 VanDerWaalsContact O-CB 3.28Å; G76-F79 WeakPolarHBondContact O-CB 3.38Å; G76-F79 PolarHBondContact O-N 3.04Å; G76-Y277 VanDerWaalsContact CA-O 3.24Å; G76-Y277 WeakPolarHBondContact CA-O 3.32Å
77	G	94.6	Very high	94.1	Very high	17 Å²	17	22.7 Å²	22.7	18%	0.175	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-59.8	-21.7	-179.8	0	0	0	0	0	114.5	G75 F79 L80 L278	G75-G77 PolarHBondContact O-N 3.23Å; G77-F79 VanDerWaalsContact C-N 3.28Å; G77-F79 PolarHBondContact O-N 3.13Å; G77-L80 WeakPolarHBondContact O-CB 3.31Å; G77-L80 PolarHBondContact O-N 2.99Å; G77-L278 VanDerWaalsContact CA-O 3.31Å; G77-L278 WeakPolarHBondContact CA-O 3.42Å; G77-L278 PolarHBondContact N-O 2.79Å
78	A	96.6	Very high	94.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-64.8	-32.7	175.9	0	0	0	0	0	112.1	G75 G76 L80 I81 P82 P280 D281 L282 L285	G75-A78 VanDerWaalsContact O-CB 3.29Å; G75-A78 WeakPolarHBondContact O-CB 3.18Å; G75-A78 PolarHBondContact O-N 2.9Å; G75-A78 VanDerWaalsContact O-N 3.08Å; G76-A78 PolarHBondContact O-N 3.32Å; G76-A78 VanDerWaalsContact O-N 3.07Å; A78-L80 PolarHBondContact O-N 2.64Å; A78-L80 VanDerWaalsContact O-N 3.13Å; A78-I81 WeakPolarHBondContact O-CB 3.49Å; A78-I81 PolarHBondContact O-N 3.41Å; A78-I81 VanDerWaalsContact O-N 3.08Å; A78-P82 WeakPolarHBondContact O-CD 3.36Å; A78-P280 HydrophobicContact CB-CB 4.33Å; A78-D281 VanDerWaalsContact CB-O 3.32Å; A78-D281 WeakPolarHBondContact CB-O 3.26Å; A78-L282 HydrophobicContact CB-CD2 4.04Å; A78-L285 HydrophobicContact CB-CD1 4.42Å; A78-L285 HydrophobicContact CB-CD2 4.44Å; A78-L285 HydrophobicContact CB-CG 4.29Å
79	F	96.9	Very high	94.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-58.8	-25.2	176.9	179.1	-110	0	0	0	113.1	F67 L70 C71 N74 G76 G77 I81 P82 Y83 V290 D293 A294	F67-F79 HydrophobicContact CD2-CE1 4.4Å; F67-F79 HydrophobicContact CE2-CE1 4.19Å; L70-F79 HydrophobicContact CB-CE1 4.17Å; L70-F79 HydrophobicContact CB-CZ 3.96Å; C71-F79 HydrophobicContact CB-CD1 4.03Å; N74-F79 HydrophobicContact CB-CB 4.2Å; N74-F79 HydrophobicContact CB-CD2 3.44Å; N74-F79 VanDerWaalsContact CB-CD2 3.44Å; N74-F79 HydrophobicContact CB-CE2 4.06Å; N74-F79 HydrophobicContact CB-CG 4.06Å; G76-F79 VanDerWaalsContact O-CB 3.28Å; G76-F79 WeakPolarHBondContact O-CB 3.38Å; G76-F79 PolarHBondContact O-N 3.04Å; G77-F79 VanDerWaalsContact C-N 3.28Å; G77-F79 PolarHBondContact O-N 3.13Å; F79-I81 PolarHBondContact O-N 3.26Å; F79-P82 HydrophobicContact CD2-CG 4.44Å; F79-P82 WeakPolarHBondContact O-CD 3.41Å; F79-P82 VanDerWaalsContact O-CG 3.26Å; F79-P82 WeakPolarHBondContact O-CG 3.27Å; F79-Y83 HydrophobicContact CE1-CD2 4.17Å; F79-Y83 VanDerWaalsContact O-CB 3.32Å; F79-Y83 WeakPolarHBondContact O-CB 3.35Å; F79-Y83 PolarHBondContact O-N 2.97Å; F79-Y83 VanDerWaalsContact O-N 3.08Å; F79-V290 HydrophobicContact CD2-CG1 4.11Å; F79-D293 HydrophobicContact CE2-CB 4.35Å; F79-A294 HydrophobicContact CD2-CB 4.46Å; F79-A294 HydrophobicContact CE2-CB 3.66Å; F79-A294 HydrophobicContact CZ-CB 3.98Å
80	L	96.5	Very high	94.8	Very high	31 Å²	31	25.5 Å²	25.5	16%	0.162	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-26	178.4	-60.8	178.8	0	0	0	112.3	F67 G77 A78 Y83 F84 L278 F338	F67-L80 HydrophobicContact CZ-CD2 3.89Å; G77-L80 WeakPolarHBondContact O-CB 3.31Å; G77-L80 PolarHBondContact O-N 2.99Å; A78-L80 PolarHBondContact O-N 2.64Å; A78-L80 VanDerWaalsContact O-N 3.13Å; L80-Y83 PolarHBondContact O-N 3.08Å; L80-F84 HydrophobicContact CB-CD2 4.14Å; L80-F84 HydrophobicContact CB-CE2 4.01Å; L80-F84 WeakPolarHBondContact O-CB 3.24Å; L80-F84 WeakPolarHBondContact O-CD2 3.17Å; L80-F84 WeakPolarHBondContact O-CG 3.28Å; L80-F84 PolarHBondContact O-N 3.07Å; L80-L278 HydrophobicContact CD1-CD2 4.49Å; L80-F338 HydrophobicContact CD1-CE2 4Å
81	I	97.1	Very high	95	Very high	83 Å²	83	25.1 Å²	25.1	43%	0.426	13%	0.125	S	C	.	.	H	α-helix	trans	-62.3	-62.3	177.4	-64.3	165.8	0	0	0	111	A78 F79 Y83 F84 I85 L282 L285	A78-I81 WeakPolarHBondContact O-CB 3.49Å; A78-I81 PolarHBondContact O-N 3.41Å; A78-I81 VanDerWaalsContact O-N 3.08Å; F79-I81 PolarHBondContact O-N 3.26Å; I81-Y83 VanDerWaalsContact C-N 3.27Å; I81-Y83 PolarHBondContact O-N 3.05Å; I81-F84 PolarHBondContact O-N 3.32Å; I81-I85 HydrophobicContact CG2-CD1 4.07Å; I81-I85 WeakPolarHBondContact O-CG1 3.47Å; I81-I85 PolarHBondContact O-N 3.12Å; I81-L282 HydrophobicContact CD1-CD2 4.49Å; I81-L285 HydrophobicContact CD1-CD1 3.94Å
82	P	96.2	Very high	95.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.1	-36.3	176.4	24.4	-33.4	0	0	0	111.4	A78 F79 F84 I85 F86 L285 V290 W291 A294	A78-P82 WeakPolarHBondContact O-CD 3.36Å; F79-P82 HydrophobicContact CD2-CG 4.44Å; F79-P82 WeakPolarHBondContact O-CD 3.41Å; F79-P82 VanDerWaalsContact O-CG 3.26Å; F79-P82 WeakPolarHBondContact O-CG 3.27Å; P82-F84 PolarHBondContact O-N 2.93Å; P82-I85 PolarHBondContact O-N 3.28Å; P82-F86 VanDerWaalsContact O-CD2 3.23Å; P82-F86 WeakPolarHBondContact O-CD2 3.19Å; P82-F86 PolarHBondContact O-N 3.31Å; P82-L285 HydrophobicContact CG-CD2 4.06Å; P82-V290 HydrophobicContact CG-CG1 3.91Å; P82-W291 HydrophobicContact CB-CD2 3.91Å; P82-W291 HydrophobicContact CB-CE3 3.64Å; P82-W291 HydrophobicContact CB-CH2 4.27Å; P82-W291 HydrophobicContact CB-CZ3 3.84Å; P82-A294 HydrophobicContact CB-CB 3.79Å; P82-A294 HydrophobicContact CG-CB 4.17Å
83	Y	96.6	Very high	95.6	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-55.9	-48.4	175.7	-178.2	-92.9	0	0	0	112.6	F67 F79 L80 I81 F86 L87 Q297 I298 S334	F67-Y83 HydrophobicContact CD2-CD2 4.04Å; F67-Y83 AromaticContact CD2-CE2 3.56Å; F67-Y83 HydrophobicContact CD2-CE2 3.56Å; F67-Y83 HydrophobicContact CE2-CD1 4.28Å; F67-Y83 AromaticContact CE2-CD2 3.6Å; F67-Y83 HydrophobicContact CE2-CD2 3.6Å; F67-Y83 HydrophobicContact CE2-CE1 4.11Å; F67-Y83 AromaticContact CE2-CE2 3.38Å; F67-Y83 HydrophobicContact CE2-CE2 3.38Å; F67-Y83 HydrophobicContact CE2-CG 4.04Å; F67-Y83 AromaticContact CE2-CZ 3.67Å; F79-Y83 HydrophobicContact CE1-CD2 4.17Å; F79-Y83 VanDerWaalsContact O-CB 3.32Å; F79-Y83 WeakPolarHBondContact O-CB 3.35Å; F79-Y83 PolarHBondContact O-N 2.97Å; F79-Y83 VanDerWaalsContact O-N 3.08Å; L80-Y83 PolarHBondContact O-N 3.08Å; I81-Y83 VanDerWaalsContact C-N 3.27Å; I81-Y83 PolarHBondContact O-N 3.05Å; Y83-F86 PolarHBondContact O-N 3.42Å; Y83-L87 WeakPolarHBondContact O-CB 3.26Å; Y83-L87 PolarHBondContact O-N 3.42Å; Y83-Q297 HydrophobicContact CE2-CG 4.16Å; Y83-I298 HydrophobicContact CD1-CD1 4.26Å; Y83-I298 HydrophobicContact CD2-CD1 3.72Å; Y83-I298 HydrophobicContact CD2-CG1 3.94Å; Y83-I298 HydrophobicContact CE1-CD1 3.86Å; Y83-I298 HydrophobicContact CE2-CD1 3.26Å; Y83-I298 HydrophobicContact CE2-CG1 3.88Å; Y83-I298 HydrophobicContact CG-CD1 4.2Å; Y83-S334 WeakPolarHBondContact OH-CB 3.44Å; Y83-S334 PolarHBondContact OH-OG 3.43Å
84	F	97.1	Very high	96	Very high	96 Å²	96	20.7 Å²	20.7	42%	0.421	11%	0.107	S	C	.	.	H	α-helix	trans	-69.4	-32.9	177.7	-76.3	-57.5	0	0	0	112.8	L80 I81 P82 L87 F88	L80-F84 HydrophobicContact CB-CD2 4.14Å; L80-F84 HydrophobicContact CB-CE2 4.01Å; L80-F84 WeakPolarHBondContact O-CB 3.24Å; L80-F84 WeakPolarHBondContact O-CD2 3.17Å; L80-F84 WeakPolarHBondContact O-CG 3.28Å; L80-F84 PolarHBondContact O-N 3.07Å; I81-F84 PolarHBondContact O-N 3.32Å; P82-F84 PolarHBondContact O-N 2.93Å; F84-L87 HydrophobicContact CD1-CD2 3.73Å; F84-L87 HydrophobicContact CE1-CD2 4.01Å; F84-L87 PolarHBondContact O-N 3.45Å; F84-F88 HydrophobicContact CB-CD2 4.44Å; F84-F88 AromaticContact CD1-CE2 3.96Å; F84-F88 HydrophobicContact CD1-CE2 3.96Å; F84-F88 VanDerWaalsContact O-CD2 3.28Å; F84-F88 WeakPolarHBondContact O-CD2 3.46Å; F84-F88 PolarHBondContact O-N 2.98Å
85	I	96.8	Very high	96.2	Very high	70 Å²	70	20.7 Å²	20.7	36%	0.359	11%	0.107	S	C	.	.	H	α-helix	trans	-62	-44.9	172.9	-68.9	167.1	0	0	0	110.5	I81 P82 G89 W291 L515	I81-I85 HydrophobicContact CG2-CD1 4.07Å; I81-I85 WeakPolarHBondContact O-CG1 3.47Å; I81-I85 PolarHBondContact O-N 3.12Å; P82-I85 PolarHBondContact O-N 3.28Å; I85-G89 WeakPolarHBondContact O-CA 3.4Å; I85-G89 PolarHBondContact O-N 2.85Å; I85-W291 HydrophobicContact CD1-CH2 3.78Å; I85-W291 HydrophobicContact CD1-CZ3 3.74Å; I85-L515 HydrophobicContact CG2-CD1 4.32Å; I85-L515 HydrophobicContact CG2-CD2 4.17Å
86	F	95.9	Very high	96.4	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-70.8	-35.7	175.2	-79.9	-79.1	0	0	0	112.6	P82 Y83 G90 G91 W291 A294 G295 I298 F299 L515 C519	P82-F86 VanDerWaalsContact O-CD2 3.23Å; P82-F86 WeakPolarHBondContact O-CD2 3.19Å; P82-F86 PolarHBondContact O-N 3.31Å; Y83-F86 PolarHBondContact O-N 3.42Å; F86-G90 CarbonylContact O-C 3.48Å; F86-G90 WeakPolarHBondContact O-CA 3.38Å; F86-G90 PolarHBondContact O-N 3.16Å; F86-G91 PolarHBondContact O-N 3.44Å; F86-W291 HydrophobicContact CE2-CE3 4.09Å; F86-W291 VanDerWaalsContact CE2-O 3.3Å; F86-W291 WeakPolarHBondContact CE2-O 3.37Å; F86-A294 HydrophobicContact CD2-CB 3.93Å; F86-A294 HydrophobicContact CE2-CB 4.37Å; F86-G295 VanDerWaalsContact CD1-CA 3.44Å; F86-G295 VanDerWaalsContact CG-CA 3.42Å; F86-I298 HydrophobicContact CB-CB 4.13Å; F86-I298 HydrophobicContact CB-CG1 3.83Å; F86-I298 HydrophobicContact CB-CG2 4.42Å; F86-F299 HydrophobicContact CD1-CE2 4.36Å; F86-L515 HydrophobicContact CD1-CB 4.42Å; F86-L515 HydrophobicContact CD1-CD1 4.29Å; F86-L515 HydrophobicContact CE1-CB 3.84Å; F86-L515 HydrophobicContact CE1-CD1 4.37Å; F86-L515 HydrophobicContact CE1-CD2 4.25Å; F86-L515 HydrophobicContact CE1-CG 4.38Å; F86-L515 HydrophobicContact CZ-CD2 4.19Å; F86-C519 WeakPolarHBondContact CZ-SG 3.3Å
87	L	96.6	Very high	96.6	Very high	8 Å²	8	20.3 Å²	20.3	4%	0.042	10%	0.103	C	C	.	.	I	π-helix	trans	-57.2	-54.6	176.6	175.6	60.6	0	0	0	111.2	Y83 F84 G91 L92 I298 Y302	Y83-L87 WeakPolarHBondContact O-CB 3.26Å; Y83-L87 PolarHBondContact O-N 3.42Å; F84-L87 HydrophobicContact CD1-CD2 3.73Å; F84-L87 HydrophobicContact CE1-CD2 4.01Å; F84-L87 PolarHBondContact O-N 3.45Å; L87-G91 PolarHBondContact O-N 3.25Å; L87-L92 HydrophobicContact CD1-CD1 4.08Å; L87-L92 HydrophobicContact CD1-CG 3.86Å; L87-L92 HydrophobicContact CG-CD1 4.16Å; L87-L92 HydrophobicContact CG-CG 4.42Å; L87-L92 WeakPolarHBondContact O-CB 3.19Å; L87-L92 PolarHBondContact O-N 3.42Å; L87-I298 HydrophobicContact CB-CD1 3.89Å; L87-I298 HydrophobicContact CD1-CD1 4.21Å; L87-Y302 HydrophobicContact CD1-CE2 3.83Å; L87-Y302 WeakPolarHBondContact CD1-OH 3.4Å
88	F	96.9	Very high	96.8	Very high	100 Å²	100	19.5 Å²	19.5	44%	0.439	10%	0.095	S	C	.	.	I	π-helix	trans	-85.6	-27.1	-177.5	-65.5	-69.4	0	0	0	112.8	F84 L92 P93 W503	F84-F88 HydrophobicContact CB-CD2 4.44Å; F84-F88 AromaticContact CD1-CE2 3.96Å; F84-F88 HydrophobicContact CD1-CE2 3.96Å; F84-F88 VanDerWaalsContact O-CD2 3.28Å; F84-F88 WeakPolarHBondContact O-CD2 3.46Å; F84-F88 PolarHBondContact O-N 2.98Å; F88-L92 HydrophobicContact CD1-CD1 3.81Å; F88-L92 HydrophobicContact CE1-CD1 3.85Å; F88-P93 WeakPolarHBondContact O-CG 3.34Å; F88-W503 HydrophobicContact CB-CZ2 3.76Å; F88-W503 AromaticContact CD1-CH2 3.99Å; F88-W503 HydrophobicContact CD1-CH2 3.99Å; F88-W503 AromaticContact CD1-CZ2 3.81Å; F88-W503 HydrophobicContact CD1-CZ2 3.81Å; F88-W503 HydrophobicContact CG-CZ2 4.29Å; F88-W503 VanDerWaalsContact O-CE2 3.28Å; F88-W503 WeakPolarHBondContact O-CZ2 3.02Å; F88-W503 PolarHBondContact O-NE1 3.18Å; F88-W503 VanDerWaalsContact O-NE1 3.15Å
89	G	95.8	Very high	96.8	Very high	6 Å²	6	19.4 Å²	19.4	6%	0.062	9%	0.094	C	C	.	.	I	π-helix	trans	-81.6	-26.8	-179.4	0	0	0	0	0	113.9	I85 T512	I85-G89 WeakPolarHBondContact O-CA 3.4Å; I85-G89 PolarHBondContact O-N 2.85Å; G89-T512 PolarHBondContact O-N 2.93Å; G89-T512 PolarHBondContact O-OG1 3.05Å
90	G	94.7	Very high	96.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.094	C	C	.	.	I	π-helix	trans	-140.4	-56.8	-172.7	0	0	0	0	0	114.7	F86 P93 V94	F86-G90 CarbonylContact O-C 3.48Å; F86-G90 WeakPolarHBondContact O-CA 3.38Å; F86-G90 PolarHBondContact O-N 3.16Å; G90-P93 WeakPolarHBondContact O-CD 2.95Å; G90-V94 WeakPolarHBondContact O-CB 3Å; G90-V94 VanDerWaalsContact O-CG2 3.26Å; G90-V94 WeakPolarHBondContact O-CG2 3.38Å; G90-V94 PolarHBondContact O-N 3.46Å
91	G	95.6	Very high	96.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	I	π-helix	trans	-56.9	-61.5	-172	0	0	0	0	0	114.3	F86 L87 V94 F95 I298	F86-G91 PolarHBondContact O-N 3.44Å; L87-G91 PolarHBondContact O-N 3.25Å; G91-V94 PolarHBondContact O-N 3.48Å; G91-F95 WeakPolarHBondContact O-CB 3.31Å; G91-F95 PolarHBondContact O-N 2.89Å; G91-I298 VanDerWaalsContact CA-CG2 3.47Å
92	L	96.8	Very high	96.8	Very high	9 Å²	9	14 Å²	14	5%	0.047	7%	0.066	C	C	.	.	H	α-helix	trans	-59.4	-46.9	177.9	-85.3	172.6	0	0	0	112.8	L87 F88 F96 Y302 L327 W503	L87-L92 HydrophobicContact CD1-CD1 4.08Å; L87-L92 HydrophobicContact CD1-CG 3.86Å; L87-L92 HydrophobicContact CG-CD1 4.16Å; L87-L92 HydrophobicContact CG-CG 4.42Å; L87-L92 WeakPolarHBondContact O-CB 3.19Å; L87-L92 PolarHBondContact O-N 3.42Å; F88-L92 HydrophobicContact CD1-CD1 3.81Å; F88-L92 HydrophobicContact CE1-CD1 3.85Å; L92-F96 WeakPolarHBondContact O-CB 3.31Å; L92-F96 PolarHBondContact O-N 3.21Å; L92-Y302 HydrophobicContact CD2-CE1 4.23Å; L92-L327 HydrophobicContact CD2-CD2 4.44Å; L92-W503 HydrophobicContact CB-CH2 4.05Å; L92-W503 HydrophobicContact CD1-CH2 4.17Å
93	P	97.4	Very high	96.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-56.5	-50.5	174.7	-27.5	33.5	0	0	0	113.9	F88 G90 F96 L97 W503 M504 W508	F88-P93 WeakPolarHBondContact O-CG 3.34Å; G90-P93 WeakPolarHBondContact O-CD 2.95Å; P93-F96 PolarHBondContact O-N 2.99Å; P93-L97 WeakPolarHBondContact O-CB 3.27Å; P93-L97 PolarHBondContact O-N 3.42Å; P93-W503 HydrophobicContact CG-CZ2 4.15Å; P93-M504 HydrophobicContact CB-SD 4.16Å; P93-M504 HydrophobicContact CG-SD 4.16Å; P93-W508 PolarHBondContact O-NE1 2.86Å
94	V	97.6	Very high	96.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-69.3	-39.9	-177.2	176.1	0	0	0	0	110.9	G90 G91 F96 L97 E98 F299 I304 T512	G90-V94 WeakPolarHBondContact O-CB 3Å; G90-V94 VanDerWaalsContact O-CG2 3.26Å; G90-V94 WeakPolarHBondContact O-CG2 3.38Å; G90-V94 PolarHBondContact O-N 3.46Å; G91-V94 PolarHBondContact O-N 3.48Å; V94-F96 VanDerWaalsContact C-N 3.34Å; V94-F96 PolarHBondContact O-N 3.5Å; V94-L97 WeakPolarHBondContact O-CB 3.48Å; V94-L97 PolarHBondContact O-N 2.85Å; V94-L97 VanDerWaalsContact O-N 3.12Å; V94-E98 PolarHBondContact O-N 3.38Å; V94-F299 HydrophobicContact CG2-CE1 4.49Å; V94-I304 HydrophobicContact CB-CD1 3.77Å; V94-I304 HydrophobicContact CG1-CB 4.1Å; V94-I304 HydrophobicContact CG1-CD1 3.76Å; V94-I304 HydrophobicContact CG1-CG1 4.46Å; V94-T512 HydrophobicContact CG2-CG2 3.62Å
95	F	97.7	Very high	96.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-56.3	-48.2	173.2	171.7	-134.3	0	0	0	111.9	V54 F58 G91 L97 E98 V99 Y302 I304 M309 C326 L329	V54-F95 HydrophobicContact CG1-CE2 3.97Å; V54-F95 HydrophobicContact CG1-CZ 3.77Å; F58-F95 HydrophobicContact CE2-CE1 4.35Å; F58-F95 HydrophobicContact CE2-CZ 4.33Å; G91-F95 WeakPolarHBondContact O-CB 3.31Å; G91-F95 PolarHBondContact O-N 2.89Å; F95-L97 VanDerWaalsContact C-N 3.33Å; F95-L97 PolarHBondContact O-N 3.14Å; F95-E98 PolarHBondContact O-N 2.96Å; F95-V99 HydrophobicContact CD2-CG2 3.94Å; F95-V99 HydrophobicContact CE2-CG2 3.56Å; F95-V99 HydrophobicContact CZ-CG2 4.28Å; F95-V99 WeakPolarHBondContact O-CG2 3.48Å; F95-V99 PolarHBondContact O-N 3.05Å; F95-V99 VanDerWaalsContact O-N 3.16Å; F95-Y302 HydrophobicContact CB-CD1 3.9Å; F95-Y302 AromaticContact CD1-CD1 3.9Å; F95-Y302 HydrophobicContact CD1-CD1 3.9Å; F95-Y302 HydrophobicContact CD1-CE1 4.01Å; F95-Y302 AromaticContact CG-CD1 3.91Å; F95-Y302 HydrophobicContact CG-CD1 3.91Å; F95-Y302 HydrophobicContact CG-CE1 4.46Å; F95-I304 HydrophobicContact CB-CG2 3.78Å; F95-I304 HydrophobicContact CD2-CG2 4.37Å; F95-M309 HydrophobicContact CD2-CB 4.45Å; F95-M309 HydrophobicContact CD2-CG 4.01Å; F95-M309 HydrophobicContact CD2-SD 4.18Å; F95-M309 HydrophobicContact CE2-CG 4.14Å; F95-M309 HydrophobicContact CE2-SD 3.71Å; F95-C326 HydrophobicContact CD1-CB 4Å; F95-C326 HydrophobicContact CE1-CB 3.71Å; F95-C326 WeakPolarHBondContact CE1-O 3.27Å; F95-C326 HydrophobicContact CZ-CB 4.34Å; F95-L329 HydrophobicContact CE1-CB 4.02Å; F95-L329 HydrophobicContact CZ-CB 4.2Å; F95-L329 HydrophobicContact CZ-CD1 4.25Å
96	F	97.9	Very high	96.3	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-64.1	-39.1	176.2	175.1	-128.3	0	0	0	112.1	L92 P93 V94 A100 Y323 C326 I492 P500 M504 W508	L92-F96 WeakPolarHBondContact O-CB 3.31Å; L92-F96 PolarHBondContact O-N 3.21Å; P93-F96 PolarHBondContact O-N 2.99Å; V94-F96 VanDerWaalsContact C-N 3.34Å; V94-F96 PolarHBondContact O-N 3.5Å; F96-A100 HydrophobicContact CD2-CB 4.39Å; F96-A100 HydrophobicContact CE2-CB 4.02Å; F96-A100 HydrophobicContact CZ-CB 4.35Å; F96-A100 WeakPolarHBondContact O-CB 3.34Å; F96-A100 PolarHBondContact O-N 3.35Å; F96-Y323 HydrophobicContact CD1-CD2 4.01Å; F96-Y323 HydrophobicContact CD2-CD2 4.28Å; F96-Y323 AromaticContact CE1-CD2 3.7Å; F96-Y323 HydrophobicContact CE1-CD2 3.7Å; F96-Y323 HydrophobicContact CE1-CE2 4.4Å; F96-Y323 VanDerWaalsContact CE2-CA 3.46Å; F96-Y323 AromaticContact CE2-CD2 3.99Å; F96-Y323 HydrophobicContact CE2-CD2 3.99Å; F96-Y323 HydrophobicContact CE2-CG 4.33Å; F96-Y323 HydrophobicContact CG-CD2 4.31Å; F96-Y323 AromaticContact CZ-CD2 3.7Å; F96-Y323 HydrophobicContact CZ-CD2 3.7Å; F96-Y323 HydrophobicContact CZ-CG 4.18Å; F96-C326 HydrophobicContact CB-CB 4.26Å; F96-C326 HydrophobicContact CD2-CB 4.24Å; F96-I492 HydrophobicContact CE1-CD1 3.98Å; F96-I492 HydrophobicContact CZ-CD1 3.94Å; F96-I492 HydrophobicContact CZ-CG1 4.48Å; F96-I492 HydrophobicContact CZ-CG2 4.07Å; F96-P500 HydrophobicContact CE1-CB 4.23Å; F96-P500 HydrophobicContact CE1-CG 3.92Å; F96-P500 HydrophobicContact CZ-CG 3.93Å; F96-M504 HydrophobicContact CB-CE 4.11Å; F96-M504 HydrophobicContact CD1-CB 4.49Å; F96-M504 HydrophobicContact CD1-CE 4.01Å; F96-M504 HydrophobicContact CD1-CG 4.01Å; F96-M504 HydrophobicContact CD1-SD 4.13Å; F96-M504 HydrophobicContact CE1-CG 4.37Å; F96-M504 HydrophobicContact CG-CE 4.28Å; F96-W508 AromaticContact CD1-CH2 3.76Å; F96-W508 HydrophobicContact CD1-CH2 3.76Å; F96-W508 AromaticContact CD1-CZ2 3.49Å; F96-W508 HydrophobicContact CD1-CZ2 3.49Å; F96-W508 VanDerWaalsContact CD1-CZ2 3.49Å; F96-W508 AromaticContact CE1-CH2 3.68Å; F96-W508 HydrophobicContact CE1-CH2 3.68Å; F96-W508 AromaticContact CE1-CZ2 3.93Å; F96-W508 HydrophobicContact CE1-CZ2 3.93Å; F96-W508 HydrophobicContact CG-CZ2 4.41Å
97	L	97.6	Very high	96.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58	-51.7	176.7	-178.6	160	0	0	0	111.3	P93 V94 F95 A100 L101 V479 F488 W508	P93-L97 WeakPolarHBondContact O-CB 3.27Å; P93-L97 PolarHBondContact O-N 3.42Å; V94-L97 WeakPolarHBondContact O-CB 3.48Å; V94-L97 PolarHBondContact O-N 2.85Å; V94-L97 VanDerWaalsContact O-N 3.12Å; F95-L97 VanDerWaalsContact C-N 3.33Å; F95-L97 PolarHBondContact O-N 3.14Å; L97-A100 PolarHBondContact O-N 3.46Å; L97-L101 WeakPolarHBondContact O-CB 3.2Å; L97-L101 PolarHBondContact O-N 2.87Å; L97-V479 HydrophobicContact CD1-CB 4.11Å; L97-V479 HydrophobicContact CD1-CG1 4.25Å; L97-V479 HydrophobicContact CD1-CG2 4.06Å; L97-V479 HydrophobicContact CD2-CG2 4.14Å; L97-V479 HydrophobicContact CG-CG2 4.3Å; L97-F488 HydrophobicContact CG-CE1 4.27Å; L97-W508 HydrophobicContact CB-CZ2 3.99Å; L97-W508 HydrophobicContact CD1-CD2 4.32Å; L97-W508 HydrophobicContact CD1-CG 4.1Å
98	E	97.5	Very high	95.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.4	-47.4	-178.9	-75.2	-167.7	128.1	0	0	111.8	V94 F95 A100 L101 G102 I304 C305 M309 T310	V94-E98 PolarHBondContact O-N 3.38Å; F95-E98 PolarHBondContact O-N 2.96Å; E98-A100 PolarHBondContact O-N 3.2Å; E98-L101 PolarHBondContact O-N 3.11Å; E98-G102 PolarHBondContact O-N 3.26Å; E98-I304 VanDerWaalsContact OE2-CA 3.29Å; E98-I304 WeakPolarHBondContact OE2-CA 3.45Å; E98-I304 WeakPolarHBondContact OE2-CG2 3.4Å; E98-C305 VanDerWaalsContact CD-N 3.31Å; E98-C305 VanDerWaalsContact OE1-CA 3.24Å; E98-C305 WeakPolarHBondContact OE1-CA 3.25Å; E98-C305 PolarHBondContact OE1-N 3.35Å; E98-C305 PolarHBondContact OE2-N 2.93Å; E98-M309 HydrophobicContact CB-CB 3.98Å; E98-M309 WeakPolarHBondContact OE2-CB 3.46Å; E98-T310 WeakPolarHBondContact CB-OG1 3.43Å; E98-T310 WeakPolarHBondContact O-CA 3.38Å; E98-T310 PolarHBondContact O-OG1 3.3Å
99	V	97.4	Very high	95.5	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-63	-43.8	179	175.5	0	0	0	0	111.2	F50 F95 Q103 M309 C322	F50-V99 HydrophobicContact CZ-CG1 3.94Å; F95-V99 HydrophobicContact CD2-CG2 3.94Å; F95-V99 HydrophobicContact CE2-CG2 3.56Å; F95-V99 HydrophobicContact CZ-CG2 4.28Å; F95-V99 WeakPolarHBondContact O-CG2 3.48Å; F95-V99 PolarHBondContact O-N 3.05Å; F95-V99 VanDerWaalsContact O-N 3.16Å; V99-Q103 WeakPolarHBondContact O-CB 3.42Å; V99-Q103 PolarHBondContact O-N 3Å; V99-M309 HydrophobicContact CG2-CB 4.13Å; V99-C322 HydrophobicContact CG1-CB 3.89Å
100	A	97.5	Very high	95.4	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-65.6	-41.9	177.9	0	0	0	0	0	111.7	F96 L97 E98 Q103 F104 F488 I492 M495	F96-A100 HydrophobicContact CD2-CB 4.39Å; F96-A100 HydrophobicContact CE2-CB 4.02Å; F96-A100 HydrophobicContact CZ-CB 4.35Å; F96-A100 WeakPolarHBondContact O-CB 3.34Å; F96-A100 PolarHBondContact O-N 3.35Å; L97-A100 PolarHBondContact O-N 3.46Å; E98-A100 PolarHBondContact O-N 3.2Å; A100-Q103 PolarHBondContact O-N 3.25Å; A100-F104 WeakPolarHBondContact O-CB 3.11Å; A100-F104 PolarHBondContact O-N 2.88Å; A100-F488 HydrophobicContact CB-CZ 4.01Å; A100-I492 HydrophobicContact CB-CD1 4.48Å; A100-I492 HydrophobicContact CB-CG1 4.32Å; A100-M495 HydrophobicContact CB-CE 4.24Å
101	L	96.6	Very high	95.4	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-61.8	-46.3	177.2	177.5	59.2	0	0	0	111.4	L97 E98 F104 T105 C112 W113 L116 F488	L97-L101 WeakPolarHBondContact O-CB 3.2Å; L97-L101 PolarHBondContact O-N 2.87Å; E98-L101 PolarHBondContact O-N 3.11Å; L101-F104 PolarHBondContact O-N 3.16Å; L101-T105 HydrophobicContact CD1-CG2 3.94Å; L101-T105 WeakPolarHBondContact O-CB 3.32Å; L101-T105 WeakPolarHBondContact O-CG2 3.47Å; L101-T105 PolarHBondContact O-N 2.87Å; L101-T105 PolarHBondContact O-OG1 3.36Å; L101-C112 HydrophobicContact CG-CB 4.27Å; L101-W113 HydrophobicContact CD2-CD2 4.31Å; L101-W113 HydrophobicContact CD2-CE3 4.48Å; L101-W113 HydrophobicContact CD2-CH2 3.87Å; L101-W113 HydrophobicContact CD2-CZ2 3.65Å; L101-W113 HydrophobicContact CD2-CZ3 4.28Å; L101-L116 HydrophobicContact CD1-CB 4.31Å; L101-L116 HydrophobicContact CD1-CD1 4.14Å; L101-L116 HydrophobicContact CD1-CD2 3.74Å; L101-L116 HydrophobicContact CD1-CG 4.28Å; L101-F488 HydrophobicContact CB-CE2 4.49Å; L101-F488 HydrophobicContact CB-CZ 4.32Å; L101-F488 HydrophobicContact CD1-CE2 4.46Å
102	G	96.1	Very high	95.3	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-58.5	-51.1	174.5	0	0	0	0	0	111.7	E98 F104 T105 S106 T310 S314	E98-G102 PolarHBondContact O-N 3.26Å; G102-F104 PolarHBondContact O-N 3.41Å; G102-T105 PolarHBondContact O-N 2.95Å; G102-T105 PolarHBondContact O-OG1 3.02Å; G102-S106 WeakPolarHBondContact O-CA 3.3Å; G102-S106 PolarHBondContact O-N 3.41Å; G102-T310 VanDerWaalsContact CA-O 3.28Å; G102-T310 WeakPolarHBondContact CA-O 3.35Å; G102-S314 WeakPolarHBondContact O-CA 3.47Å
103	Q	96.3	Very high	95.2	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-61	-42.9	180	-176.8	174.5	-54.6	0	0	112.5	V99 A100 G313 N316 Y318 Y320 M495	V99-Q103 WeakPolarHBondContact O-CB 3.42Å; V99-Q103 PolarHBondContact O-N 3Å; A100-Q103 PolarHBondContact O-N 3.25Å; Q103-G313 VanDerWaalsContact CA-O 3.27Å; Q103-G313 WeakPolarHBondContact CA-O 2.9Å; Q103-G313 PolarHBondContact N-O 3.04Å; Q103-N316 HydrophobicContact CB-CB 4.38Å; Q103-N316 HydrophobicContact CG-CB 3.91Å; Q103-N316 PolarHBondContact OE1-ND2 3.13Å; Q103-Y318 PolarHBondContact NE2-O 2.97Å; Q103-Y320 PolarHBondContact NE2-O 3.04Å; Q103-M495 HydrophobicContact CB-SD 4.11Å; Q103-M495 HydrophobicContact CG-SD 3.86Å
104	F	94.9	Very high	94.9	Very high	13 Å²	13	8.7 Å²	8.7	6%	0.057	5%	0.046	C	C	.	.	H	α-helix	trans	-65	-48.6	-179	180	-120.6	0	0	0	111.9	A100 L101 G102 Y318 A491 M495 A587	A100-F104 WeakPolarHBondContact O-CB 3.11Å; A100-F104 PolarHBondContact O-N 2.88Å; L101-F104 PolarHBondContact O-N 3.16Å; G102-F104 PolarHBondContact O-N 3.41Å; F104-Y318 HydrophobicContact CD2-CE2 4.06Å; F104-A491 HydrophobicContact CD1-CB 4.38Å; F104-A491 HydrophobicContact CD2-CB 3.95Å; F104-A491 HydrophobicContact CE1-CB 4.06Å; F104-A491 HydrophobicContact CE2-CB 3.61Å; F104-A491 HydrophobicContact CG-CB 4.33Å; F104-A491 HydrophobicContact CZ-CB 3.67Å; F104-M495 WeakPolarHBondContact CA-SD 3.45Å; F104-M495 HydrophobicContact CB-CE 3.81Å; F104-M495 HydrophobicContact CB-SD 3.58Å; F104-M495 VanDerWaalsContact CB-SD 3.58Å; F104-M495 HydrophobicContact CD2-CE 4.48Å; F104-M495 HydrophobicContact CD2-CG 4.2Å; F104-M495 HydrophobicContact CD2-SD 4.14Å; F104-M495 HydrophobicContact CG-CE 4.49Å; F104-M495 HydrophobicContact CG-SD 4.35Å; F104-M495 PolarHBondContact N-SD 3.13Å; F104-M495 VanDerWaalsContact N-SD 3.43Å; F104-A587 WeakPolarHBondContact CZ-O 3.42Å
105	T	92.9	Very high	94.5	Very high	8 Å²	8	11.9 Å²	11.9	5%	0.049	6%	0.059	C	C	.	.	H	α-helix	trans	-80.2	-23.1	-177	58.4	0	0	0	0	112.8	L101 G102 E107 C112	L101-T105 HydrophobicContact CD1-CG2 3.94Å; L101-T105 WeakPolarHBondContact O-CB 3.32Å; L101-T105 WeakPolarHBondContact O-CG2 3.47Å; L101-T105 PolarHBondContact O-N 2.87Å; L101-T105 PolarHBondContact O-OG1 3.36Å; G102-T105 PolarHBondContact O-N 2.95Å; G102-T105 PolarHBondContact O-OG1 3.02Å; T105-E107 PolarHBondContact O-N 3.42Å; T105-E107 PolarHBondContact OG1-N 3.23Å; T105-C112 HydrophobicContact CG2-CB 4.21Å; T105-C112 WeakPolarHBondContact OG1-CB 3.4Å
106	S	92.5	Very high	94.2	Very high	33 Å²	33	12 Å²	12	23%	0.231	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	39.2	-167.6	-71.2	0	0	0	0	111.9	R41 K43 G102	R41-S106 WeakPolarHBondContact CD-O 3.49Å; R41-S106 VanDerWaalsContact NH1-C 3.33Å; R41-S106 PolarHBondContact NH1-O 2.83Å; K43-S106 PolarHBondContact NZ-OG 3.21Å; K43-S106 VanDerWaalsContact NZ-OG 3.11Å; G102-S106 WeakPolarHBondContact O-CA 3.3Å; G102-S106 PolarHBondContact O-N 3.41Å
107	E	91.1	Very high	93.9	Very high	34 Å²	34	12 Å²	12	16%	0.159	6%	0.06	C	C	.	.			trans	-129.8	155.8	-178.5	-72.7	-54.3	160.1	0	0	111.3	R41 T105 T111 C112 K115 S314	R41-E107 IonicContact NH1-OE2 3.6Å; T105-E107 PolarHBondContact O-N 3.42Å; T105-E107 PolarHBondContact OG1-N 3.23Å; E107-T111 WeakPolarHBondContact CB-OG1 3.46Å; E107-T111 PolarHBondContact OE2-OG1 3.43Å; E107-T111 VanDerWaalsContact OE2-OG1 3.13Å; E107-C112 HydrophobicContact CB-CB 4.19Å; E107-K115 VanDerWaalsContact CD-NZ 3.31Å; E107-K115 HydrophobicContact CG-CD 3.87Å; E107-K115 WeakPolarHBondContact OE1-CE 3.38Å; E107-K115 IonicContact OE1-NZ 3.25Å; E107-K115 PolarHBondContact OE1-NZ 3.15Å; E107-S314 VanDerWaalsContact O-CB 3.27Å; E107-S314 WeakPolarHBondContact O-CB 3.49Å
108	G	90.9	Very high	93.6	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.			trans	-72.3	-179.8	174	0	0	0	0	0	113.3	I110 T111 C112 D416	G108-I110 VanDerWaalsContact C-N 3.26Å; G108-I110 PolarHBondContact O-N 3.27Å; G108-I110 VanDerWaalsContact O-N 3.09Å; G108-T111 PolarHBondContact N-OG1 2.96Å; G108-T111 PolarHBondContact O-N 3.14Å; G108-C112 VanDerWaalsContact O-CB 3.31Å; G108-C112 WeakPolarHBondContact O-CB 3.48Å; G108-C112 PolarHBondContact O-N 3Å; G108-C112 PolarHBondContact O-SG 3.11Å; G108-D416 WeakPolarHBondContact CA-OD2 3.27Å; G108-D416 PolarHBondContact N-OD2 2.88Å
109	G	90.1	Very high	93.4	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.01	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.2	-168.8	0	0	0	0	0	116.8	G124 S413	G109-G124 WeakPolarHBondContact O-CA 3Å; G109-S413 WeakPolarHBondContact CA-OG 3.28Å; G109-S413 PolarHBondContact N-OG 2.91Å
110	I	94.6	Very high	93.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-52.3	174.3	-58.7	171.2	0	0	0	110.9	G108 C112 W113 E114 T121 Y125 I128 L417	G108-I110 VanDerWaalsContact C-N 3.26Å; G108-I110 PolarHBondContact O-N 3.27Å; G108-I110 VanDerWaalsContact O-N 3.09Å; I110-C112 VanDerWaalsContact C-N 3.26Å; I110-C112 PolarHBondContact O-N 3.48Å; I110-W113 PolarHBondContact O-N 2.8Å; I110-E114 PolarHBondContact O-N 3.48Å; I110-T121 HydrophobicContact CG2-CG2 3.86Å; I110-Y125 HydrophobicContact CD1-CD1 3.91Å; I110-Y125 HydrophobicContact CD1-CE1 3.93Å; I110-Y125 HydrophobicContact CG2-CD2 4.42Å; I110-Y125 HydrophobicContact CG2-CE1 4.18Å; I110-Y125 HydrophobicContact CG2-CE2 4.05Å; I110-I128 HydrophobicContact CD1-CB 4.44Å; I110-I128 HydrophobicContact CD1-CG1 3.86Å; I110-I128 HydrophobicContact CG1-CG1 3.9Å; I110-L417 HydrophobicContact CB-CD2 4.36Å; I110-L417 HydrophobicContact CD1-CD1 3.77Å; I110-L417 HydrophobicContact CD1-CG 4.45Å; I110-L417 HydrophobicContact CG2-CD2 3.91Å
111	T	93.3	Very high	93.2	Very high	11 Å²	11	14.5 Å²	14.5	7%	0.067	7%	0.073	C	C	.	.	H	α-helix	trans	-67.9	-24.5	-174.6	45.7	0	0	0	0	112.8	E107 G108 E114 K115 D416 L417	E107-T111 WeakPolarHBondContact CB-OG1 3.46Å; E107-T111 PolarHBondContact OE2-OG1 3.43Å; E107-T111 VanDerWaalsContact OE2-OG1 3.13Å; G108-T111 PolarHBondContact N-OG1 2.96Å; G108-T111 PolarHBondContact O-N 3.14Å; T111-E114 PolarHBondContact O-N 3.08Å; T111-K115 PolarHBondContact O-N 3.29Å; T111-K115 VanDerWaalsContact O-N 3.15Å; T111-D416 HydrophobicContact CG2-CB 4.24Å; T111-L417 HydrophobicContact CG2-CD2 3.92Å; T111-L417 HydrophobicContact CG2-CG 4.48Å
112	C	94.1	Very high	93.2	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.8	-44	172.6	69.6	0	0	0	0	111.9	L101 T105 E107 G108 I110 K115 L116 T310	L101-C112 HydrophobicContact CG-CB 4.27Å; T105-C112 HydrophobicContact CG2-CB 4.21Å; T105-C112 WeakPolarHBondContact OG1-CB 3.4Å; E107-C112 HydrophobicContact CB-CB 4.19Å; G108-C112 VanDerWaalsContact O-CB 3.31Å; G108-C112 WeakPolarHBondContact O-CB 3.48Å; G108-C112 PolarHBondContact O-N 3Å; G108-C112 PolarHBondContact O-SG 3.11Å; I110-C112 VanDerWaalsContact C-N 3.26Å; I110-C112 PolarHBondContact O-N 3.48Å; C112-K115 PolarHBondContact O-N 3.2Å; C112-L116 WeakPolarHBondContact O-CB 3.28Å; C112-L116 PolarHBondContact O-N 3.01Å; C112-T310 HydrophobicContact CB-CG2 4.19Å
113	W	95.1	Very high	93.3	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.008	7%	0.073	C	C	.	.	H	α-helix	trans	-71	-35.7	178.8	-67.9	111.1	0	0	0	111.8	L101 I110 K115 L116 C117 I123 E475 A478 V479	L101-W113 HydrophobicContact CD2-CD2 4.31Å; L101-W113 HydrophobicContact CD2-CE3 4.48Å; L101-W113 HydrophobicContact CD2-CH2 3.87Å; L101-W113 HydrophobicContact CD2-CZ2 3.65Å; L101-W113 HydrophobicContact CD2-CZ3 4.28Å; I110-W113 PolarHBondContact O-N 2.8Å; W113-K115 VanDerWaalsContact C-N 3.26Å; W113-K115 PolarHBondContact O-N 2.87Å; W113-L116 HydrophobicContact CE3-CD2 4.36Å; W113-L116 HydrophobicContact CZ3-CD2 4.11Å; W113-L116 PolarHBondContact O-N 2.79Å; W113-C117 CarbonylContact O-C 3.31Å; W113-C117 WeakPolarHBondContact O-CA 3.37Å; W113-C117 PolarHBondContact O-N 2.74Å; W113-I123 HydrophobicContact CD2-CB 4.27Å; W113-I123 HydrophobicContact CD2-CD1 4.34Å; W113-I123 HydrophobicContact CD2-CG2 4.3Å; W113-I123 HydrophobicContact CE3-CD1 4.19Å; W113-I123 HydrophobicContact CG-CB 4.39Å; W113-I123 HydrophobicContact CH2-CD1 4.17Å; W113-I123 HydrophobicContact CZ2-CD1 4.32Å; W113-I123 HydrophobicContact CZ2-CG2 3.81Å; W113-I123 HydrophobicContact CZ3-CD1 4.1Å; W113-E475 HydrophobicContact CH2-CB 4.01Å; W113-E475 HydrophobicContact CH2-CG 3.96Å; W113-E475 HydrophobicContact CZ2-CB 4.18Å; W113-E475 HydrophobicContact CZ2-CG 3.63Å; W113-A478 HydrophobicContact CE3-CB 4.29Å; W113-A478 HydrophobicContact CH2-CB 4.39Å; W113-A478 HydrophobicContact CZ3-CB 3.63Å; W113-V479 HydrophobicContact CH2-CG2 3.8Å; W113-V479 HydrophobicContact CZ3-CG2 3.85Å
114	E	91.6	Very high	93.3	Very high	80 Å²	80	14.5 Å²	14.5	37%	0.374	7%	0.073	S	C	.	.	H	α-helix	trans	-60.6	-35.8	173.3	-175.4	163.3	-140.7	0	0	112.4	I110 T111 P118 T121 K564 V583	I110-E114 PolarHBondContact O-N 3.48Å; T111-E114 PolarHBondContact O-N 3.08Å; E114-P118 WeakPolarHBondContact O-CG 3.27Å; E114-T121 WeakPolarHBondContact CA-OG1 3.41Å; E114-T121 HydrophobicContact CB-CG2 4.17Å; E114-K564 IonicContact OE1-NZ 3.24Å; E114-V583 VanDerWaalsContact O-CG2 3.31Å; E114-V583 WeakPolarHBondContact O-CG2 3.31Å
115	K	89.6	Confident	93.4	Very high	66 Å²	66	18.5 Å²	18.5	29%	0.287	9%	0.089	S	C	.	.	H	α-helix	trans	-77.3	-42.1	175.9	-69.6	-173.8	-175.3	178.2	0	113.1	E107 T111 C112 W113 V583	E107-K115 VanDerWaalsContact CD-NZ 3.31Å; E107-K115 HydrophobicContact CG-CD 3.87Å; E107-K115 WeakPolarHBondContact OE1-CE 3.38Å; E107-K115 IonicContact OE1-NZ 3.25Å; E107-K115 PolarHBondContact OE1-NZ 3.15Å; T111-K115 PolarHBondContact O-N 3.29Å; T111-K115 VanDerWaalsContact O-N 3.15Å; C112-K115 PolarHBondContact O-N 3.2Å; W113-K115 VanDerWaalsContact C-N 3.26Å; W113-K115 PolarHBondContact O-N 2.87Å; K115-V583 PolarHBondContact O-N 3.04Å
116	L	90.5	Very high	93.6	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-78.1	-51.9	-174.5	-168.3	83.4	0	0	0	112.2	L101 C112 W113 V479 Y483 P582	L101-L116 HydrophobicContact CD1-CB 4.31Å; L101-L116 HydrophobicContact CD1-CD1 4.14Å; L101-L116 HydrophobicContact CD1-CD2 3.74Å; L101-L116 HydrophobicContact CD1-CG 4.28Å; C112-L116 WeakPolarHBondContact O-CB 3.28Å; C112-L116 PolarHBondContact O-N 3.01Å; W113-L116 HydrophobicContact CE3-CD2 4.36Å; W113-L116 HydrophobicContact CZ3-CD2 4.11Å; W113-L116 PolarHBondContact O-N 2.79Å; L116-V479 HydrophobicContact CD2-CG2 3.94Å; L116-Y483 HydrophobicContact CD1-CD1 3.95Å; L116-Y483 HydrophobicContact CD1-CD2 3.72Å; L116-Y483 HydrophobicContact CD1-CE1 3.81Å; L116-Y483 HydrophobicContact CD1-CE2 3.59Å; L116-Y483 HydrophobicContact CD1-CG 3.9Å; L116-Y483 HydrophobicContact CD2-CG 4.33Å; L116-Y483 HydrophobicContact CG-CD1 4.39Å; L116-Y483 HydrophobicContact CG-CD2 3.81Å; L116-Y483 HydrophobicContact CG-CE2 4.17Å; L116-Y483 HydrophobicContact CG-CG 3.93Å; L116-P582 WeakPolarHBondContact O-CB 3.34Å
117	C	91.4	Very high	93.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.076	C	C	.	.			trans	-150.3	85.7	-173.8	-163.6	0	0	0	0	110.6	W113 I119 F120 V482	W113-C117 CarbonylContact O-C 3.31Å; W113-C117 WeakPolarHBondContact O-CA 3.37Å; W113-C117 PolarHBondContact O-N 2.74Å; C117-I119 PolarHBondContact O-N 3.29Å; C117-I119 VanDerWaalsContact O-N 3.1Å; C117-F120 PolarHBondContact O-N 2.65Å; C117-V482 WeakPolarHBondContact SG-CG1 3.46Å
118	P	91.3	Very high	94	Very high	15 Å²	15	15.6 Å²	15.6	10%	0.097	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-57.8	-28.4	-171.2	-20.5	25.6	0	0	0	115.4	E114 F120 T121 V579 A581 V583	E114-P118 WeakPolarHBondContact O-CG 3.27Å; P118-F120 PolarHBondContact O-N 3.25Å; P118-T121 PolarHBondContact O-N 3.2Å; P118-T121 PolarHBondContact O-OG1 3.01Å; P118-V579 CarbonylContact C-O 3.31Å; P118-V579 WeakPolarHBondContact CB-O 3.48Å; P118-V579 WeakPolarHBondContact CD-O 3.48Å; P118-A581 VanDerWaalsContact CD-O 3.25Å; P118-A581 WeakPolarHBondContact CD-O 3.49Å; P118-V583 HydrophobicContact CG-CG2 3.95Å
119	I	93.3	Very high	94.3	Very high	13 Å²	13	17.3 Å²	17.3	7%	0.067	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-64.6	-29.5	175.7	-165.9	176.3	0	0	0	112	C117 V561 I576 V579 A580	C117-I119 PolarHBondContact O-N 3.29Å; C117-I119 VanDerWaalsContact O-N 3.1Å; I119-V561 HydrophobicContact CD1-CG1 4.25Å; I119-V561 HydrophobicContact CG1-CB 4.49Å; I119-V561 HydrophobicContact CG1-CG1 4.13Å; I119-V561 HydrophobicContact CG1-CG2 4.24Å; I119-V561 WeakPolarHBondContact O-CG2 3.41Å; I119-I576 HydrophobicContact CD1-CG2 4.43Å; I119-V579 HydrophobicContact CB-CB 4.22Å; I119-V579 HydrophobicContact CB-CG2 3.82Å; I119-V579 WeakPolarHBondContact CB-O 3.44Å; I119-V579 HydrophobicContact CD1-CG2 3.81Å; I119-V579 HydrophobicContact CG1-CG2 3.78Å; I119-V579 PolarHBondContact N-O 3.02Å; I119-A580 HydrophobicContact CG2-CB 4.16Å
120	F	95.6	Very high	94.5	Very high	23 Å²	23	17.3 Å²	17.3	10%	0.101	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-103	17.8	-178.1	-76.9	-64.6	0	0	0	113.9	C117 P118 G122 I123 F474 I477 A478 V482 I557 V561	C117-F120 PolarHBondContact O-N 2.65Å; P118-F120 PolarHBondContact O-N 3.25Å; F120-G122 PolarHBondContact O-N 2.87Å; F120-I123 HydrophobicContact CB-CD1 3.81Å; F120-I123 HydrophobicContact CB-CG1 4.25Å; F120-I123 HydrophobicContact CD1-CD1 4.28Å; F120-I123 HydrophobicContact CG-CD1 4.26Å; F120-I123 WeakPolarHBondContact O-CB 3.24Å; F120-I123 WeakPolarHBondContact O-CG1 3.19Å; F120-I123 PolarHBondContact O-N 3.39Å; F120-F474 HydrophobicContact CD1-CD1 4.4Å; F120-F474 AromaticContact CE1-CD1 3.72Å; F120-F474 HydrophobicContact CE1-CD1 3.72Å; F120-F474 HydrophobicContact CE1-CE1 4.29Å; F120-F474 HydrophobicContact CZ-CD1 4.49Å; F120-I477 HydrophobicContact CZ-CG2 4.32Å; F120-A478 HydrophobicContact CB-CB 3.91Å; F120-A478 HydrophobicContact CD2-CB 3.59Å; F120-A478 HydrophobicContact CE2-CB 4.27Å; F120-A478 HydrophobicContact CG-CB 3.8Å; F120-V482 HydrophobicContact CD2-CG2 4.48Å; F120-V482 HydrophobicContact CE2-CB 4.3Å; F120-V482 HydrophobicContact CE2-CG2 3.69Å; F120-I557 HydrophobicContact CD1-CG2 4.24Å; F120-I557 HydrophobicContact CE1-CG2 4.5Å; F120-V561 HydrophobicContact CD1-CG2 4.39Å; F120-V561 HydrophobicContact CE1-CG2 4.35Å
121	T	95.8	Very high	94.6	Very high	3 Å²	3	17.2 Å²	17.2	2%	0.018	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.2	172.6	-49.7	0	0	0	0	113	I110 E114 P118 I123 G124 Y125	I110-T121 HydrophobicContact CG2-CG2 3.86Å; E114-T121 WeakPolarHBondContact CA-OG1 3.41Å; E114-T121 HydrophobicContact CB-CG2 4.17Å; P118-T121 PolarHBondContact O-N 3.2Å; P118-T121 PolarHBondContact O-OG1 3.01Å; T121-I123 PolarHBondContact O-N 2.92Å; T121-G124 PolarHBondContact O-N 3.45Å; T121-G124 VanDerWaalsContact O-N 3.15Å; T121-Y125 HydrophobicContact CG2-CD2 4.33Å; T121-Y125 HydrophobicContact CG2-CE2 3.89Å; T121-Y125 WeakPolarHBondContact O-CD2 3.36Å; T121-Y125 PolarHBondContact O-N 3.35Å
122	G	96.8	Very high	94.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.1	-23.8	172	0	0	0	0	0	114.8	F120 Y125 A126	F120-G122 PolarHBondContact O-N 2.87Å; G122-Y125 PolarHBondContact O-N 3.49Å; G122-A126 WeakPolarHBondContact O-CB 3.47Å; G122-A126 PolarHBondContact O-N 3.45Å
123	I	97.6	Very high	94.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60	-51.6	172.9	-64.5	175.9	0	0	0	109.8	W113 F120 T121 Y125 A126 S127 V471 F474 E475 A478 I557	W113-I123 HydrophobicContact CD2-CB 4.27Å; W113-I123 HydrophobicContact CD2-CD1 4.34Å; W113-I123 HydrophobicContact CD2-CG2 4.3Å; W113-I123 HydrophobicContact CE3-CD1 4.19Å; W113-I123 HydrophobicContact CG-CB 4.39Å; W113-I123 HydrophobicContact CH2-CD1 4.17Å; W113-I123 HydrophobicContact CZ2-CD1 4.32Å; W113-I123 HydrophobicContact CZ2-CG2 3.81Å; W113-I123 HydrophobicContact CZ3-CD1 4.1Å; F120-I123 HydrophobicContact CB-CD1 3.81Å; F120-I123 HydrophobicContact CB-CG1 4.25Å; F120-I123 HydrophobicContact CD1-CD1 4.28Å; F120-I123 HydrophobicContact CG-CD1 4.26Å; F120-I123 WeakPolarHBondContact O-CB 3.24Å; F120-I123 WeakPolarHBondContact O-CG1 3.19Å; F120-I123 PolarHBondContact O-N 3.39Å; T121-I123 PolarHBondContact O-N 2.92Å; I123-Y125 VanDerWaalsContact C-N 3.32Å; I123-Y125 PolarHBondContact O-N 2.86Å; I123-A126 WeakPolarHBondContact O-CB 3.43Å; I123-A126 PolarHBondContact O-N 2.95Å; I123-A126 VanDerWaalsContact O-N 3.12Å; I123-S127 PolarHBondContact O-N 3.12Å; I123-S127 PolarHBondContact O-OG 3.46Å; I123-V471 HydrophobicContact CG2-CG1 3.96Å; I123-F474 HydrophobicContact CD1-CB 4Å; I123-F474 WeakPolarHBondContact CD1-O 3.32Å; I123-F474 HydrophobicContact CG1-CB 4.11Å; I123-E475 HydrophobicContact CD1-CG 4.35Å; I123-E475 HydrophobicContact CG2-CG 3.56Å; I123-A478 HydrophobicContact CD1-CB 3.88Å; I123-I557 HydrophobicContact CG1-CD1 4.2Å; I123-I557 HydrophobicContact CG1-CG1 4.36Å
124	G	96.8	Very high	94.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.7	-40.2	179	0	0	0	0	0	113	G109 T121 S127 I128	G109-G124 WeakPolarHBondContact O-CA 3Å; T121-G124 PolarHBondContact O-N 3.45Å; T121-G124 VanDerWaalsContact O-N 3.15Å; G124-S127 PolarHBondContact O-N 3.21Å; G124-I128 VanDerWaalsContact O-CG1 3.29Å; G124-I128 WeakPolarHBondContact O-CG1 3.21Å; G124-I128 PolarHBondContact O-N 2.97Å
125	Y	97.1	Very high	95	Very high	97 Å²	97	15.7 Å²	15.7	38%	0.38	8%	0.077	S	C	.	.	H	α-helix	trans	-64.7	-41.7	174.3	-71	-68.5	0	0	0	112.2	I110 T121 G122 I123 I128 V129 V560	I110-Y125 HydrophobicContact CD1-CD1 3.91Å; I110-Y125 HydrophobicContact CD1-CE1 3.93Å; I110-Y125 HydrophobicContact CG2-CD2 4.42Å; I110-Y125 HydrophobicContact CG2-CE1 4.18Å; I110-Y125 HydrophobicContact CG2-CE2 4.05Å; T121-Y125 HydrophobicContact CG2-CD2 4.33Å; T121-Y125 HydrophobicContact CG2-CE2 3.89Å; T121-Y125 WeakPolarHBondContact O-CD2 3.36Å; T121-Y125 PolarHBondContact O-N 3.35Å; G122-Y125 PolarHBondContact O-N 3.49Å; I123-Y125 VanDerWaalsContact C-N 3.32Å; I123-Y125 PolarHBondContact O-N 2.86Å; Y125-I128 PolarHBondContact O-N 2.82Å; Y125-V129 WeakPolarHBondContact O-CG2 3.17Å; Y125-V129 PolarHBondContact O-N 3.14Å; Y125-V560 HydrophobicContact CD2-CG2 4.05Å; Y125-V560 HydrophobicContact CE2-CG2 4.5Å
126	A	97.2	Very high	95.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.1	-49.8	175.6	0	0	0	0	0	111	G122 I123 I128 V129 I130 V471 S553 C556 I557	G122-A126 WeakPolarHBondContact O-CB 3.47Å; G122-A126 PolarHBondContact O-N 3.45Å; I123-A126 WeakPolarHBondContact O-CB 3.43Å; I123-A126 PolarHBondContact O-N 2.95Å; I123-A126 VanDerWaalsContact O-N 3.12Å; A126-I128 VanDerWaalsContact C-N 3.28Å; A126-I128 PolarHBondContact O-N 2.86Å; A126-V129 PolarHBondContact O-N 2.93Å; A126-I130 WeakPolarHBondContact O-CG1 3.48Å; A126-I130 PolarHBondContact O-N 2.88Å; A126-V471 HydrophobicContact CB-CG2 3.99Å; A126-S553 VanDerWaalsContact CB-O 3.27Å; A126-S553 WeakPolarHBondContact CB-O 3.35Å; A126-C556 HydrophobicContact CB-CB 4Å; A126-I557 HydrophobicContact CB-CD1 4.38Å; A126-I557 HydrophobicContact CB-CG1 4.02Å
127	S	95.9	Very high	95.5	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.007	7%	0.067	C	C	.	.	H	α-helix	trans	-56	-41.7	176.6	-61.8	0	0	0	0	112.5	I123 G124 I130 V131 C305	I123-S127 PolarHBondContact O-N 3.12Å; I123-S127 PolarHBondContact O-OG 3.46Å; G124-S127 PolarHBondContact O-N 3.21Å; S127-I130 PolarHBondContact O-N 3.46Å; S127-V131 PolarHBondContact O-N 3.3Å; S127-C305 VanDerWaalsContact CB-O 3.27Å; S127-C305 WeakPolarHBondContact CB-O 3.44Å; S127-C305 PolarHBondContact OG-O 3.42Å
128	I	95.7	Very high	95.7	Very high	13 Å²	13	13.8 Å²	13.8	7%	0.067	7%	0.069	C	C	.	.	H	α-helix	trans	-70.2	-35.3	179.5	-67.6	-65.4	0	0	0	112.8	I110 G124 Y125 A126 V131 S132 Q410 S413 L414	I110-I128 HydrophobicContact CD1-CB 4.44Å; I110-I128 HydrophobicContact CD1-CG1 3.86Å; I110-I128 HydrophobicContact CG1-CG1 3.9Å; G124-I128 VanDerWaalsContact O-CG1 3.29Å; G124-I128 WeakPolarHBondContact O-CG1 3.21Å; G124-I128 PolarHBondContact O-N 2.97Å; Y125-I128 PolarHBondContact O-N 2.82Å; A126-I128 VanDerWaalsContact C-N 3.28Å; A126-I128 PolarHBondContact O-N 2.86Å; I128-V131 HydrophobicContact CD1-CG1 4.19Å; I128-V131 WeakPolarHBondContact O-CG1 3.18Å; I128-S132 VanDerWaalsContact O-CB 3.28Å; I128-S132 WeakPolarHBondContact O-CB 3.47Å; I128-S132 PolarHBondContact O-N 2.89Å; I128-S132 PolarHBondContact O-OG 2.95Å; I128-Q410 HydrophobicContact CD1-CB 4.44Å; I128-Q410 HydrophobicContact CD1-CG 4.32Å; I128-Q410 HydrophobicContact CG2-CG 4.41Å; I128-S413 VanDerWaalsContact CD1-CB 3.43Å; I128-L414 HydrophobicContact CG2-CD2 4.24Å
129	V	96.4	Very high	95.9	Very high	36 Å²	36	13 Å²	13	22%	0.218	7%	0.065	C	C	.	.	H	α-helix	trans	-63.9	-47.4	171.6	170.8	0	0	0	0	110.2	Y125 A126 S132 L133 T552	Y125-V129 WeakPolarHBondContact O-CG2 3.17Å; Y125-V129 PolarHBondContact O-N 3.14Å; A126-V129 PolarHBondContact O-N 2.93Å; V129-S132 PolarHBondContact O-N 3.02Å; V129-L133 HydrophobicContact CG1-CD1 4.11Å; V129-L133 WeakPolarHBondContact O-CG 3.36Å; V129-L133 PolarHBondContact O-N 3.31Å; V129-L133 VanDerWaalsContact O-N 3.08Å; V129-T552 HydrophobicContact CG1-CG2 3.86Å
130	I	95.9	Very high	96.1	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.1	-52.3	-179.4	-62.5	167.8	0	0	0	110.2	A126 S127 S132 L133 L134 L306 A463 C467 L468 V471 S553	A126-I130 WeakPolarHBondContact O-CG1 3.48Å; A126-I130 PolarHBondContact O-N 2.88Å; S127-I130 PolarHBondContact O-N 3.46Å; I130-S132 VanDerWaalsContact C-N 3.27Å; I130-S132 PolarHBondContact O-N 3Å; I130-L133 PolarHBondContact O-N 3.09Å; I130-L134 WeakPolarHBondContact O-CB 3.03Å; I130-L134 PolarHBondContact O-N 3.13Å; I130-L306 HydrophobicContact CB-CD2 4.1Å; I130-L306 HydrophobicContact CG2-CD2 3.41Å; I130-L306 VanDerWaalsContact CG2-CD2 3.41Å; I130-A463 HydrophobicContact CG2-CB 4.26Å; I130-C467 HydrophobicContact CD1-CB 4.02Å; I130-C467 HydrophobicContact CG1-CB 4.47Å; I130-L468 HydrophobicContact CD1-CD2 4.42Å; I130-L468 HydrophobicContact CG2-CD2 4.12Å; I130-V471 HydrophobicContact CD1-CG2 3.77Å; I130-S553 VanDerWaalsContact CG1-CB 3.43Å
131	V	95.8	Very high	96.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-64.4	-32.4	-178.5	78.6	0	0	0	0	112	S127 I128 L134 N135 L306 E406 Q410	S127-V131 PolarHBondContact O-N 3.3Å; I128-V131 HydrophobicContact CD1-CG1 4.19Å; I128-V131 WeakPolarHBondContact O-CG1 3.18Å; V131-L134 PolarHBondContact O-N 3.43Å; V131-N135 VanDerWaalsContact O-CB 3.28Å; V131-N135 WeakPolarHBondContact O-CB 3.42Å; V131-N135 PolarHBondContact O-N 3.24Å; V131-N135 PolarHBondContact O-ND2 3.07Å; V131-L306 HydrophobicContact CB-CB 4.32Å; V131-L306 HydrophobicContact CB-CD2 4.38Å; V131-L306 HydrophobicContact CG2-CB 4.34Å; V131-E406 HydrophobicContact CG2-CB 3.73Å; V131-E406 HydrophobicContact CG2-CG 4.24Å; V131-Q410 HydrophobicContact CG1-CB 3.87Å; V131-Q410 HydrophobicContact CG1-CG 4.04Å
132	S	95.9	Very high	96.2	Very high	31 Å²	31	11.5 Å²	11.5	22%	0.217	6%	0.057	C	C	.	.	H	α-helix	trans	-64.1	-45.3	175.1	-60.4	0	0	0	0	111.6	I128 V129 I130 I136 Q410	I128-S132 VanDerWaalsContact O-CB 3.28Å; I128-S132 WeakPolarHBondContact O-CB 3.47Å; I128-S132 PolarHBondContact O-N 2.89Å; I128-S132 PolarHBondContact O-OG 2.95Å; V129-S132 PolarHBondContact O-N 3.02Å; I130-S132 VanDerWaalsContact C-N 3.27Å; I130-S132 PolarHBondContact O-N 3Å; S132-I136 WeakPolarHBondContact O-CD1 3.41Å; S132-I136 VanDerWaalsContact O-CG1 3.3Å; S132-I136 WeakPolarHBondContact O-CG1 3.49Å; S132-I136 PolarHBondContact O-N 3.38Å; S132-Q410 PolarHBondContact OG-NE2 3.48Å
133	L	95.7	Very high	96.3	Very high	28 Å²	28	11.5 Å²	11.5	15%	0.147	6%	0.057	C	C	.	.	H	α-helix	trans	-67.9	-38.7	177.2	-64.2	171.6	0	0	0	111.1	V129 I130 I136 Y137 F458 A462 L549	V129-L133 HydrophobicContact CG1-CD1 4.11Å; V129-L133 WeakPolarHBondContact O-CG 3.36Å; V129-L133 PolarHBondContact O-N 3.31Å; V129-L133 VanDerWaalsContact O-N 3.08Å; I130-L133 PolarHBondContact O-N 3.09Å; L133-I136 PolarHBondContact O-N 2.69Å; L133-Y137 WeakPolarHBondContact O-CD1 3.3Å; L133-Y137 PolarHBondContact O-N 3.12Å; L133-F458 HydrophobicContact CB-CD1 4.48Å; L133-F458 HydrophobicContact CD2-CE1 3.84Å; L133-A462 HydrophobicContact CB-CB 3.9Å; L133-A462 HydrophobicContact CD1-CB 3.87Å; L133-A462 HydrophobicContact CG-CB 4.42Å; L133-L549 HydrophobicContact CD1-CD2 4.46Å; L133-L549 HydrophobicContact CD2-CD2 4.29Å
134	L	95	Very high	96.3	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.01	6%	0.058	C	C	.	.	H	α-helix	trans	-61	-51.6	176.9	-168.3	165	0	0	0	111.4	I130 V131 I136 Y137 Y138 F300 L306 E406 A463	I130-L134 WeakPolarHBondContact O-CB 3.03Å; I130-L134 PolarHBondContact O-N 3.13Å; V131-L134 PolarHBondContact O-N 3.43Å; L134-I136 PolarHBondContact O-N 3.24Å; L134-I136 VanDerWaalsContact O-N 3.12Å; L134-Y137 HydrophobicContact CB-CE1 4.15Å; L134-Y137 HydrophobicContact CG-CE1 3.95Å; L134-Y137 WeakPolarHBondContact O-CD1 3.36Å; L134-Y137 PolarHBondContact O-N 2.87Å; L134-Y137 VanDerWaalsContact O-N 3.14Å; L134-Y138 HydrophobicContact CD2-CG 4.32Å; L134-Y138 WeakPolarHBondContact O-CB 3.23Å; L134-Y138 PolarHBondContact O-N 2.95Å; L134-F300 HydrophobicContact CD1-CE2 4.05Å; L134-L306 HydrophobicContact CD1-CD1 3.84Å; L134-L306 HydrophobicContact CD1-CD2 4.12Å; L134-E406 WeakPolarHBondContact CD2-OE2 3.48Å; L134-A463 HydrophobicContact CB-CB 3.93Å; L134-A463 HydrophobicContact CD1-CB 3.97Å; L134-A463 HydrophobicContact CG-CB 4.02Å
135	N	96.2	Very high	96.3	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-56.2	-31.2	179.4	-77.8	-26.3	0	0	0	113.1	V131 I139 Q403 E406 V407 Q410	V131-N135 VanDerWaalsContact O-CB 3.28Å; V131-N135 WeakPolarHBondContact O-CB 3.42Å; V131-N135 PolarHBondContact O-N 3.24Å; V131-N135 PolarHBondContact O-ND2 3.07Å; N135-I139 WeakPolarHBondContact O-CG2 3.38Å; N135-Q403 PolarHBondContact O-NE2 3.5Å; N135-E406 VanDerWaalsContact OD1-CB 3.29Å; N135-E406 WeakPolarHBondContact OD1-CB 3.19Å; N135-V407 HydrophobicContact CB-CG2 4.3Å; N135-Q410 PolarHBondContact ND2-OE1 3.31Å
136	I	96.1	Very high	96.3	Very high	14 Å²	14	7.5 Å²	7.5	7%	0.072	4%	0.042	C	C	.	.	H	α-helix	trans	-70.3	-45.4	179.4	-68.6	165.2	0	0	0	111.3	S132 L133 L134 F442 M446	S132-I136 WeakPolarHBondContact O-CD1 3.41Å; S132-I136 VanDerWaalsContact O-CG1 3.3Å; S132-I136 WeakPolarHBondContact O-CG1 3.49Å; S132-I136 PolarHBondContact O-N 3.38Å; L133-I136 PolarHBondContact O-N 2.69Å; L134-I136 PolarHBondContact O-N 3.24Å; L134-I136 VanDerWaalsContact O-N 3.12Å; I136-F442 HydrophobicContact CD1-CB 4.02Å; I136-F442 HydrophobicContact CD1-CD2 4.4Å; I136-F442 HydrophobicContact CD1-CG 4.33Å; I136-F442 HydrophobicContact CG1-CB 4.38Å; I136-F442 HydrophobicContact CG2-CB 3.81Å; I136-M446 HydrophobicContact CG2-CE 3.71Å
137	Y	94.6	Very high	96.3	Very high	1 Å²	1	8.1 Å²	8.1	0%	0.004	5%	0.045	C	C	.	.	H	α-helix	trans	-88.4	-38.1	-174.7	87.7	-95.5	0	0	0	112.6	L133 L134 I139 V140 M446 F455 F458 D459 A463	L133-Y137 WeakPolarHBondContact O-CD1 3.3Å; L133-Y137 PolarHBondContact O-N 3.12Å; L134-Y137 HydrophobicContact CB-CE1 4.15Å; L134-Y137 HydrophobicContact CG-CE1 3.95Å; L134-Y137 WeakPolarHBondContact O-CD1 3.36Å; L134-Y137 PolarHBondContact O-N 2.87Å; L134-Y137 VanDerWaalsContact O-N 3.14Å; Y137-I139 VanDerWaalsContact C-N 3.27Å; Y137-I139 PolarHBondContact O-N 3.5Å; Y137-V140 VanDerWaalsContact O-CB 3.24Å; Y137-V140 WeakPolarHBondContact O-CB 3.42Å; Y137-V140 WeakPolarHBondContact O-CG2 3.44Å; Y137-V140 PolarHBondContact O-N 3.03Å; Y137-M446 VanDerWaalsContact CA-SD 3.6Å; Y137-M446 VanDerWaalsContact CB-SD 3.51Å; Y137-F455 HydrophobicContact CD2-CD2 4.16Å; Y137-F455 AromaticContact CD2-CE2 3.64Å; Y137-F455 HydrophobicContact CD2-CE2 3.64Å; Y137-F455 AromaticContact CD2-CZ 3.98Å; Y137-F455 HydrophobicContact CD2-CZ 3.98Å; Y137-F455 HydrophobicContact CE2-CE2 4.46Å; Y137-F455 HydrophobicContact CE2-CZ 4.39Å; Y137-F455 WeakPolarHBondContact O-CE2 3.34Å; Y137-F458 HydrophobicContact CD1-CB 4.07Å; Y137-F458 HydrophobicContact CG-CB 4.05Å; Y137-D459 HydrophobicContact CD2-CB 4.15Å; Y137-D459 HydrophobicContact CE2-CB 3.72Å; Y137-D459 WeakPolarHBondContact CE2-OD1 3.39Å; Y137-D459 PolarHBondContact OH-OD1 2.68Å; Y137-A463 HydrophobicContact CE1-CB 3.82Å
138	Y	94.9	Very high	96.4	Very high	12 Å²	12	8.1 Å²	8.1	5%	0.047	5%	0.045	C	C	.	.	H	α-helix	trans	-61.1	-38.9	-175.2	-173.7	-96.1	0	0	0	111.6	L61 L134 V140 I141 L142 G399 Q403	L61-Y138 HydrophobicContact CD1-CE2 4.33Å; L61-Y138 PolarHBondContact N-OH 3.13Å; L134-Y138 HydrophobicContact CD2-CG 4.32Å; L134-Y138 WeakPolarHBondContact O-CB 3.23Å; L134-Y138 PolarHBondContact O-N 2.95Å; Y138-V140 PolarHBondContact O-N 3.28Å; Y138-I141 HydrophobicContact CD2-CD1 4.08Å; Y138-I141 HydrophobicContact CE2-CD1 4.44Å; Y138-I141 VanDerWaalsContact O-CB 3.23Å; Y138-I141 WeakPolarHBondContact O-CB 3.37Å; Y138-I141 WeakPolarHBondContact O-CG1 3.49Å; Y138-I141 PolarHBondContact O-N 3.35Å; Y138-L142 HydrophobicContact CD1-CD1 3.92Å; Y138-L142 HydrophobicContact CE1-CD1 3.93Å; Y138-G399 WeakPolarHBondContact CE1-O 3.32Å; Y138-Q403 HydrophobicContact CD1-CB 4.38Å
139	I	96.8	Very high	96.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.4	-20.7	178.9	-152.8	174.6	0	0	0	114.2	N135 Y137 I141 L142 A143 L224 V227 W228 Q403	N135-I139 WeakPolarHBondContact O-CG2 3.38Å; Y137-I139 VanDerWaalsContact C-N 3.27Å; Y137-I139 PolarHBondContact O-N 3.5Å; I139-I141 PolarHBondContact O-N 2.84Å; I139-L142 HydrophobicContact CG1-CD1 4.49Å; I139-L142 WeakPolarHBondContact O-CB 3.46Å; I139-L142 PolarHBondContact O-N 3.22Å; I139-A143 PolarHBondContact O-N 3.38Å; I139-A143 VanDerWaalsContact O-N 3.09Å; I139-L224 HydrophobicContact CG2-CD1 3.73Å; I139-V227 HydrophobicContact CD1-CB 4.48Å; I139-V227 HydrophobicContact CD1-CG1 3.81Å; I139-V227 HydrophobicContact CG1-CB 4.32Å; I139-V227 HydrophobicContact CG1-CG1 3.5Å; I139-W228 HydrophobicContact CB-CZ2 4.38Å; I139-W228 HydrophobicContact CD1-CB 4.46Å; I139-W228 HydrophobicContact CD1-CD2 3.36Å; I139-W228 HydrophobicContact CD1-CE3 3.74Å; I139-W228 HydrophobicContact CD1-CG 3.7Å; I139-W228 HydrophobicContact CD1-CH2 4.13Å; I139-W228 HydrophobicContact CD1-CZ2 3.76Å; I139-W228 HydrophobicContact CD1-CZ3 4.12Å; I139-W228 HydrophobicContact CG2-CZ2 3.73Å; I139-Q403 HydrophobicContact CB-CG 4.39Å; I139-Q403 HydrophobicContact CD1-CG 4.04Å; I139-Q403 HydrophobicContact CG1-CG 4.1Å
140	V	97.2	Very high	96.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.9	-32.6	174.2	-178	0	0	0	0	110.6	Y137 Y138 L142 A143 W144 L224 M446 V447 F455	Y137-V140 VanDerWaalsContact O-CB 3.24Å; Y137-V140 WeakPolarHBondContact O-CB 3.42Å; Y137-V140 WeakPolarHBondContact O-CG2 3.44Å; Y137-V140 PolarHBondContact O-N 3.03Å; Y138-V140 PolarHBondContact O-N 3.28Å; V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 3.08Å; V140-A143 VanDerWaalsContact O-CB 3.32Å; V140-A143 WeakPolarHBondContact O-CB 3.46Å; V140-A143 PolarHBondContact O-N 3.41Å; V140-A143 VanDerWaalsContact O-N 3.11Å; V140-W144 HydrophobicContact CG1-CD2 4.37Å; V140-W144 HydrophobicContact CG1-CH2 4.29Å; V140-W144 HydrophobicContact CG1-CZ2 3.66Å; V140-W144 PolarHBondContact O-N 3.5Å; V140-L224 HydrophobicContact CG2-CD1 4.34Å; V140-M446 HydrophobicContact CG1-CB 4.38Å; V140-M446 HydrophobicContact CG2-CB 3.96Å; V140-M446 HydrophobicContact CG2-SD 4.05Å; V140-V447 HydrophobicContact CG1-CG2 4.08Å; V140-F455 HydrophobicContact CB-CD2 4.22Å; V140-F455 HydrophobicContact CB-CE2 4.41Å; V140-F455 HydrophobicContact CG1-CD2 4.39Å
141	I	95.7	Very high	96.5	Very high	5 Å²	5	13.5 Å²	13.5	3%	0.026	7%	0.066	C	C	.	.	H	α-helix	trans	-63.6	-41.2	175.8	-54.6	172.6	0	0	0	111	L61 W65 Y138 I139 A143 W144 G145 F371 F455	L61-I141 HydrophobicContact CD1-CB 4.24Å; L61-I141 HydrophobicContact CD1-CD1 4.5Å; L61-I141 HydrophobicContact CD1-CG2 3.45Å; L61-I141 VanDerWaalsContact CD1-CG2 3.45Å; W65-I141 HydrophobicContact CH2-CB 4.47Å; W65-I141 HydrophobicContact CH2-CD1 3.95Å; W65-I141 HydrophobicContact CH2-CG1 4.37Å; W65-I141 HydrophobicContact CH2-CG2 3.37Å; W65-I141 HydrophobicContact CZ2-CD1 3.86Å; W65-I141 HydrophobicContact CZ2-CG2 4.1Å; W65-I141 HydrophobicContact CZ3-CG2 4.16Å; Y138-I141 HydrophobicContact CD2-CD1 4.08Å; Y138-I141 HydrophobicContact CE2-CD1 4.44Å; Y138-I141 VanDerWaalsContact O-CB 3.23Å; Y138-I141 WeakPolarHBondContact O-CB 3.37Å; Y138-I141 WeakPolarHBondContact O-CG1 3.49Å; Y138-I141 PolarHBondContact O-N 3.35Å; I139-I141 PolarHBondContact O-N 2.84Å; I141-A143 VanDerWaalsContact C-N 3.3Å; I141-A143 PolarHBondContact O-N 3.4Å; I141-W144 HydrophobicContact CB-CE3 4.33Å; I141-W144 HydrophobicContact CG1-CE3 4.28Å; I141-W144 HydrophobicContact CG1-CZ3 4.05Å; I141-W144 HydrophobicContact CG2-CE3 4.48Å; I141-W144 PolarHBondContact O-N 2.88Å; I141-G145 PolarHBondContact O-N 2.88Å; I141-F371 HydrophobicContact CG2-CE2 4.08Å; I141-F371 HydrophobicContact CG2-CZ 4.2Å; I141-F455 HydrophobicContact CD1-CE2 4.15Å; I141-F455 HydrophobicContact CD1-CZ 3.84Å; I141-F455 HydrophobicContact CG1-CE2 3.66Å; I141-F455 HydrophobicContact CG1-CZ 3.68Å
142	L	97.1	Very high	96.5	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-66	-35.8	174.7	-72.2	90.8	0	0	0	111.1	Y138 I139 V140 W144 G145 L146 V227 L396 L400	Y138-L142 HydrophobicContact CD1-CD1 3.92Å; Y138-L142 HydrophobicContact CE1-CD1 3.93Å; I139-L142 HydrophobicContact CG1-CD1 4.49Å; I139-L142 WeakPolarHBondContact O-CB 3.46Å; I139-L142 PolarHBondContact O-N 3.22Å; V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 3.08Å; L142-W144 VanDerWaalsContact C-N 3.33Å; L142-W144 PolarHBondContact O-N 3.06Å; L142-G145 PolarHBondContact O-N 3.27Å; L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 PolarHBondContact O-N 2.92Å; L142-V227 HydrophobicContact CB-CB 4.46Å; L142-V227 HydrophobicContact CB-CG1 3.64Å; L142-V227 HydrophobicContact CB-CG2 4.07Å; L142-V227 HydrophobicContact CD2-CG1 3.74Å; L142-V227 HydrophobicContact CG-CG1 4.32Å; L142-L396 HydrophobicContact CB-CD2 4.21Å; L142-L396 VanDerWaalsContact O-CD2 3.24Å; L142-L396 WeakPolarHBondContact O-CD2 3.28Å; L142-L400 HydrophobicContact CD2-CB 4Å; L142-L400 HydrophobicContact CD2-CD1 4.25Å
143	A	98	Very high	96.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.7	-41.9	174.5	0	0	0	0	0	111.5	I139 V140 I141 L146 Y147 C223 L224	I139-A143 PolarHBondContact O-N 3.38Å; I139-A143 VanDerWaalsContact O-N 3.09Å; V140-A143 VanDerWaalsContact O-CB 3.32Å; V140-A143 WeakPolarHBondContact O-CB 3.46Å; V140-A143 PolarHBondContact O-N 3.41Å; V140-A143 VanDerWaalsContact O-N 3.11Å; I141-A143 VanDerWaalsContact C-N 3.3Å; I141-A143 PolarHBondContact O-N 3.4Å; A143-L146 PolarHBondContact O-N 2.91Å; A143-Y147 WeakPolarHBondContact O-CB 3.48Å; A143-Y147 PolarHBondContact O-N 3.18Å; A143-C223 HydrophobicContact CB-CB 4.2Å; A143-L224 HydrophobicContact CB-CB 3.96Å; A143-L224 HydrophobicContact CB-CD1 4.21Å
144	W	97.8	Very high	96.2	Very high	1 Å²	1	21.8 Å²	21.8	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-62.7	-46.1	171.6	-58.9	-33.5	0	0	0	111.8	V140 I141 L142 L146 Y147 Y148 W199 L204 P367 F371 M452 F455	V140-W144 HydrophobicContact CG1-CD2 4.37Å; V140-W144 HydrophobicContact CG1-CH2 4.29Å; V140-W144 HydrophobicContact CG1-CZ2 3.66Å; V140-W144 PolarHBondContact O-N 3.5Å; I141-W144 HydrophobicContact CB-CE3 4.33Å; I141-W144 HydrophobicContact CG1-CE3 4.28Å; I141-W144 HydrophobicContact CG1-CZ3 4.05Å; I141-W144 HydrophobicContact CG2-CE3 4.48Å; I141-W144 PolarHBondContact O-N 2.88Å; L142-W144 VanDerWaalsContact C-N 3.33Å; L142-W144 PolarHBondContact O-N 3.06Å; W144-L146 VanDerWaalsContact C-N 3.28Å; W144-L146 PolarHBondContact O-N 3.02Å; W144-Y147 WeakPolarHBondContact O-CB 3.38Å; W144-Y147 PolarHBondContact O-N 3.45Å; W144-Y148 WeakPolarHBondContact O-CD2 3.23Å; W144-Y148 PolarHBondContact O-N 2.8Å; W144-W199 HydrophobicContact CB-CH2 4.43Å; W144-W199 HydrophobicContact CB-CZ3 4.24Å; W144-W199 AromaticContact CD2-CH2 3.64Å; W144-W199 HydrophobicContact CD2-CH2 3.64Å; W144-W199 HydrophobicContact CD2-CZ3 4.26Å; W144-W199 AromaticContact CE3-CH2 3.69Å; W144-W199 HydrophobicContact CE3-CH2 3.69Å; W144-W199 AromaticContact CG-CH2 3.98Å; W144-W199 HydrophobicContact CG-CH2 3.98Å; W144-W199 HydrophobicContact CG-CZ3 4.12Å; W144-W199 HydrophobicContact CZ2-CH2 4.49Å; W144-W199 HydrophobicContact CZ3-CH2 4.17Å; W144-L204 HydrophobicContact CZ2-CD2 4.15Å; W144-P367 HydrophobicContact CZ3-CB 4.09Å; W144-P367 HydrophobicContact CZ3-CG 4.03Å; W144-F371 HydrophobicContact CB-CD1 4.46Å; W144-F371 HydrophobicContact CB-CE1 3.81Å; W144-F371 HydrophobicContact CB-CE2 4.11Å; W144-F371 HydrophobicContact CB-CZ 3.61Å; W144-F371 HydrophobicContact CE3-CD2 4.33Å; W144-F371 AromaticContact CE3-CE2 3.8Å; W144-F371 HydrophobicContact CE3-CE2 3.8Å; W144-F371 HydrophobicContact CE3-CZ 4.39Å; W144-M452 HydrophobicContact CH2-SD 3.72Å; W144-M452 HydrophobicContact CZ2-SD 4.09Å; W144-F455 AromaticContact CH2-CD1 3.9Å; W144-F455 HydrophobicContact CH2-CD1 3.9Å; W144-F455 AromaticContact CH2-CD2 3.72Å; W144-F455 HydrophobicContact CH2-CD2 3.72Å; W144-F455 AromaticContact CH2-CE1 3.98Å; W144-F455 HydrophobicContact CH2-CE1 3.98Å; W144-F455 AromaticContact CH2-CE2 3.76Å; W144-F455 HydrophobicContact CH2-CE2 3.76Å; W144-F455 AromaticContact CH2-CG 3.8Å; W144-F455 HydrophobicContact CH2-CG 3.8Å; W144-F455 AromaticContact CH2-CZ 3.9Å; W144-F455 HydrophobicContact CH2-CZ 3.9Å; W144-F455 HydrophobicContact CZ2-CD2 4.39Å; W144-F455 HydrophobicContact CZ2-CG 4.49Å; W144-F455 HydrophobicContact CZ3-CD2 4.41Å; W144-F455 HydrophobicContact CZ3-CE1 4.22Å; W144-F455 AromaticContact CZ3-CE2 3.98Å; W144-F455 HydrophobicContact CZ3-CE2 3.98Å; W144-F455 AromaticContact CZ3-CZ 3.89Å; W144-F455 HydrophobicContact CZ3-CZ 3.89Å
145	G	96.6	Very high	95.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.7	-41.3	175.5	0	0	0	0	0	113.1	I141 L142 Y148 L149	I141-G145 PolarHBondContact O-N 2.88Å; L142-G145 PolarHBondContact O-N 3.27Å; G145-Y148 PolarHBondContact O-N 2.87Å; G145-L149 WeakPolarHBondContact O-CB 3.41Å; G145-L149 PolarHBondContact O-N 3.46Å
146	L	97.9	Very high	95.6	Very high	12 Å²	12	32.6 Å²	32.6	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-69.6	-40.4	178.7	-174.1	58.6	0	0	0	111.7	L142 A143 W144 L149 F150 C223 L226 V227 L396	L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 PolarHBondContact O-N 2.92Å; A143-L146 PolarHBondContact O-N 2.91Å; W144-L146 VanDerWaalsContact C-N 3.28Å; W144-L146 PolarHBondContact O-N 3.02Å; L146-L149 HydrophobicContact CD1-CD2 4.46Å; L146-L149 PolarHBondContact O-N 2.85Å; L146-F150 HydrophobicContact CD1-CE1 4.09Å; L146-F150 HydrophobicContact CD1-CE2 3.97Å; L146-F150 HydrophobicContact CD1-CZ 3.68Å; L146-F150 HydrophobicContact CD2-CE2 4.16Å; L146-F150 HydrophobicContact CD2-CZ 4.3Å; L146-F150 HydrophobicContact CG-CD2 4.26Å; L146-F150 HydrophobicContact CG-CE2 3.65Å; L146-F150 HydrophobicContact CG-CZ 3.88Å; L146-F150 WeakPolarHBondContact O-CD2 3.42Å; L146-F150 WeakPolarHBondContact O-CG 3.24Å; L146-F150 PolarHBondContact O-N 2.96Å; L146-C223 HydrophobicContact CB-CB 4.47Å; L146-C223 HydrophobicContact CD2-CB 4.33Å; L146-L226 HydrophobicContact CD2-CB 4.04Å; L146-L226 HydrophobicContact CD2-CD2 3.81Å; L146-L226 HydrophobicContact CD2-CG 3.9Å; L146-V227 HydrophobicContact CB-CG2 4.26Å; L146-V227 HydrophobicContact CD2-CG2 3.68Å; L146-L396 HydrophobicContact CB-CD1 4.39Å; L146-L396 HydrophobicContact CB-CD2 4Å; L146-L396 HydrophobicContact CD1-CD1 4Å
147	Y	97.8	Very high	95.5	Very high	13 Å²	13	32.2 Å²	32.2	5%	0.051	16%	0.159	C	C	.	.	H	α-helix	trans	-58.1	-51.5	173.1	-175.4	-88.7	0	0	0	111	A143 W144 L149 F150 Q151 F198 N202 V203 D219 L220	A143-Y147 WeakPolarHBondContact O-CB 3.48Å; A143-Y147 PolarHBondContact O-N 3.18Å; W144-Y147 WeakPolarHBondContact O-CB 3.38Å; W144-Y147 PolarHBondContact O-N 3.45Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.34Å; Y147-F150 PolarHBondContact O-N 3.25Å; Y147-Q151 HydrophobicContact CD1-CG 3.93Å; Y147-Q151 HydrophobicContact CE1-CG 3.66Å; Y147-Q151 VanDerWaalsContact O-CG 3.24Å; Y147-Q151 WeakPolarHBondContact O-CG 3.48Å; Y147-Q151 PolarHBondContact O-N 3.21Å; Y147-Q151 PolarHBondContact OH-NE2 3.38Å; Y147-F198 HydrophobicContact CE1-CZ 4.1Å; Y147-N202 PolarHBondContact OH-ND2 3.09Å; Y147-V203 HydrophobicContact CD1-CG1 4.28Å; Y147-V203 HydrophobicContact CD1-CG2 3.99Å; Y147-V203 HydrophobicContact CE1-CB 4.46Å; Y147-V203 HydrophobicContact CE1-CG2 3.73Å; Y147-D219 HydrophobicContact CE2-CB 4.02Å; Y147-D219 VanDerWaalsContact CE2-OD2 3.26Å; Y147-D219 WeakPolarHBondContact CE2-OD2 3.31Å; Y147-D219 PolarHBondContact OH-OD2 3.42Å; Y147-L220 HydrophobicContact CD2-CD2 3.78Å; Y147-L220 HydrophobicContact CG-CD2 3.79Å
148	Y	97.5	Very high	95.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-39	176.8	-91.4	-92.8	0	0	0	112.7	W144 G145 F150 Q151 C152 W159 F198 W199 V203 F371 P375 F392	W144-Y148 WeakPolarHBondContact O-CD2 3.23Å; W144-Y148 PolarHBondContact O-N 2.8Å; G145-Y148 PolarHBondContact O-N 2.87Å; Y148-F150 PolarHBondContact O-N 2.89Å; Y148-Q151 PolarHBondContact O-N 3.24Å; Y148-C152 PolarHBondContact O-N 2.93Å; Y148-C152 VanDerWaalsContact O-N 3.08Å; Y148-C152 PolarHBondContact O-SG 2.95Å; Y148-W159 HydrophobicContact CD1-CD2 4.47Å; Y148-W159 AromaticContact CD1-CE3 3.88Å; Y148-W159 HydrophobicContact CD1-CE3 3.88Å; Y148-W159 AromaticContact CD1-CH2 3.66Å; Y148-W159 HydrophobicContact CD1-CH2 3.66Å; Y148-W159 HydrophobicContact CD1-CZ2 4.27Å; Y148-W159 AromaticContact CD1-CZ3 3.44Å; Y148-W159 HydrophobicContact CD1-CZ3 3.44Å; Y148-W159 VanDerWaalsContact CD1-CZ3 3.44Å; Y148-W159 HydrophobicContact CE1-CD2 4.19Å; Y148-W159 AromaticContact CE1-CE3 3.79Å; Y148-W159 HydrophobicContact CE1-CE3 3.79Å; Y148-W159 HydrophobicContact CE1-CH2 4.33Å; Y148-W159 AromaticContact CE1-CZ3 3.86Å; Y148-W159 HydrophobicContact CE1-CZ3 3.86Å; Y148-W159 HydrophobicContact CG-CZ3 4.44Å; Y148-F198 HydrophobicContact CD1-CE1 4.11Å; Y148-F198 AromaticContact CE1-CD1 3.83Å; Y148-F198 HydrophobicContact CE1-CD1 3.83Å; Y148-F198 AromaticContact CE1-CE1 3.5Å; Y148-F198 HydrophobicContact CE1-CE1 3.5Å; Y148-F198 HydrophobicContact CE2-CE1 4.25Å; Y148-F198 AromaticContact CZ-CD1 3.77Å; Y148-F198 AromaticContact CZ-CE1 3.6Å; Y148-F198 WeakPolarHBondContact OH-CD1 3.16Å; Y148-W199 AromaticContact CE2-CE3 3.8Å; Y148-W199 HydrophobicContact CE2-CE3 3.8Å; Y148-W199 AromaticContact CE2-CZ3 3.95Å; Y148-W199 HydrophobicContact CE2-CZ3 3.95Å; Y148-V203 HydrophobicContact CE2-CG1 4.29Å; Y148-V203 HydrophobicContact CE2-CG2 3.79Å; Y148-F371 AromaticContact CD2-CD1 3.52Å; Y148-F371 HydrophobicContact CD2-CD1 3.52Å; Y148-F371 AromaticContact CD2-CE1 3.95Å; Y148-F371 HydrophobicContact CD2-CE1 3.95Å; Y148-F371 HydrophobicContact CE2-CB 4.09Å; Y148-F371 AromaticContact CE2-CD1 3.48Å; Y148-F371 HydrophobicContact CE2-CD1 3.48Å; Y148-F371 VanDerWaalsContact CE2-CD1 3.48Å; Y148-F371 HydrophobicContact CE2-CE1 4.31Å; Y148-F371 HydrophobicContact CE2-CG 4.13Å; Y148-F371 HydrophobicContact CG-CD1 4.22Å; Y148-F371 PolarHBondContact OH-O 3.27Å; Y148-P375 HydrophobicContact CE1-CG 4.33Å; Y148-F392 VanDerWaalsContact CB-CE1 3.41Å; Y148-F392 VanDerWaalsContact CB-CZ 3.43Å; Y148-F392 AromaticContact CD1-CE1 3.92Å; Y148-F392 HydrophobicContact CD1-CE1 3.92Å; Y148-F392 AromaticContact CD1-CE2 3.67Å; Y148-F392 HydrophobicContact CD1-CE2 3.67Å; Y148-F392 AromaticContact CD1-CZ 3.21Å; Y148-F392 HydrophobicContact CD1-CZ 3.21Å; Y148-F392 HydrophobicContact CD2-CE1 4.33Å; Y148-F392 HydrophobicContact CD2-CZ 4.41Å; Y148-F392 HydrophobicContact CE1-CZ 4.03Å; Y148-F392 HydrophobicContact CG-CD1 4.36Å; Y148-F392 AromaticContact CG-CE1 3.65Å; Y148-F392 HydrophobicContact CG-CE1 3.65Å; Y148-F392 HydrophobicContact CG-CE2 4.03Å; Y148-F392 AromaticContact CG-CZ 3.44Å; Y148-F392 HydrophobicContact CG-CZ 3.44Å; Y148-F392 VanDerWaalsContact CG-CZ 3.44Å
149	L	97.3	Very high	95.4	Very high	20 Å²	20	32.1 Å²	32.1	11%	0.105	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-45.2	175.3	179.2	59.7	0	0	0	111.4	G145 L146 Y147 Q151 C152 F153 I389 F392 I393 L396	G145-L149 WeakPolarHBondContact O-CB 3.41Å; G145-L149 PolarHBondContact O-N 3.46Å; L146-L149 HydrophobicContact CD1-CD2 4.46Å; L146-L149 PolarHBondContact O-N 2.85Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.34Å; L149-Q151 VanDerWaalsContact C-N 3.28Å; L149-Q151 PolarHBondContact O-N 2.97Å; L149-C152 WeakPolarHBondContact O-CB 3.23Å; L149-C152 PolarHBondContact O-N 3.47Å; L149-C152 VanDerWaalsContact O-N 3.15Å; L149-F153 HydrophobicContact CD1-CE2 4.07Å; L149-F153 HydrophobicContact CD1-CZ 4.37Å; L149-F153 HydrophobicContact CG-CE2 4.15Å; L149-F153 WeakPolarHBondContact O-CD2 3.33Å; L149-F153 VanDerWaalsContact O-CE2 3.28Å; L149-F153 WeakPolarHBondContact O-CE2 3.49Å; L149-I389 HydrophobicContact CD1-CG2 4.21Å; L149-F392 HydrophobicContact CB-CB 4.09Å; L149-F392 HydrophobicContact CD1-CB 4.43Å; L149-I393 HydrophobicContact CD1-CG1 3.94Å; L149-I393 HydrophobicContact CD2-CG1 4.07Å; L149-L396 HydrophobicContact CB-CD1 4.29Å; L149-L396 HydrophobicContact CD2-CD1 3.56Å
150	F	97.2	Very high	95.1	Very high	99 Å²	99	33.5 Å²	33.5	43%	0.434	17%	0.172	S	C	.	.	H	α-helix	trans	-62.2	-37.4	175.6	-67.2	-36.3	0	0	0	112.5	L146 Y147 Y148 C152 F153 L226	L146-F150 HydrophobicContact CD1-CE1 4.09Å; L146-F150 HydrophobicContact CD1-CE2 3.97Å; L146-F150 HydrophobicContact CD1-CZ 3.68Å; L146-F150 HydrophobicContact CD2-CE2 4.16Å; L146-F150 HydrophobicContact CD2-CZ 4.3Å; L146-F150 HydrophobicContact CG-CD2 4.26Å; L146-F150 HydrophobicContact CG-CE2 3.65Å; L146-F150 HydrophobicContact CG-CZ 3.88Å; L146-F150 WeakPolarHBondContact O-CD2 3.42Å; L146-F150 WeakPolarHBondContact O-CG 3.24Å; L146-F150 PolarHBondContact O-N 2.96Å; Y147-F150 PolarHBondContact O-N 3.25Å; Y148-F150 PolarHBondContact O-N 2.89Å; F150-C152 PolarHBondContact O-N 3.02Å; F150-F153 PolarHBondContact O-N 2.67Å; F150-L226 HydrophobicContact CE2-CD2 4.34Å; F150-L226 HydrophobicContact CZ-CD2 3.85Å
151	Q	96.1	Very high	94.7	Very high	43 Å²	43	37.6 Å²	37.6	20%	0.201	19%	0.189	C	C	.	.	H	α-helix	trans	-70.2	-16.2	177.6	-64.9	-65.4	-11.4	0	0	113.5	Y147 Y148 L149 F153 Q154 P158 W159 F198	Y147-Q151 HydrophobicContact CD1-CG 3.93Å; Y147-Q151 HydrophobicContact CE1-CG 3.66Å; Y147-Q151 VanDerWaalsContact O-CG 3.24Å; Y147-Q151 WeakPolarHBondContact O-CG 3.48Å; Y147-Q151 PolarHBondContact O-N 3.21Å; Y147-Q151 PolarHBondContact OH-NE2 3.38Å; Y148-Q151 PolarHBondContact O-N 3.24Å; L149-Q151 VanDerWaalsContact C-N 3.28Å; L149-Q151 PolarHBondContact O-N 2.97Å; Q151-F153 VanDerWaalsContact C-N 3.3Å; Q151-F153 PolarHBondContact O-N 3.18Å; Q151-Q154 WeakPolarHBondContact O-CG 3.32Å; Q151-P158 HydrophobicContact CB-CG 3.91Å; Q151-P158 WeakPolarHBondContact O-CD 3.5Å; Q151-W159 HydrophobicContact CB-CZ3 3.86Å; Q151-F198 HydrophobicContact CB-CZ 4.41Å; Q151-F198 HydrophobicContact CG-CZ 4.13Å
152	C	96.3	Very high	94.2	Very high	1 Å²	1	38 Å²	38	1%	0.007	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.3	174.2	-65.4	0	0	0	0	113.4	Y148 L149 F150 Q154 L157 T385 I389	Y148-C152 PolarHBondContact O-N 2.93Å; Y148-C152 VanDerWaalsContact O-N 3.08Å; Y148-C152 PolarHBondContact O-SG 2.95Å; L149-C152 WeakPolarHBondContact O-CB 3.23Å; L149-C152 PolarHBondContact O-N 3.47Å; L149-C152 VanDerWaalsContact O-N 3.15Å; F150-C152 PolarHBondContact O-N 3.02Å; C152-Q154 PolarHBondContact O-N 3.34Å; C152-L157 HydrophobicContact CB-CD2 4.45Å; C152-T385 VanDerWaalsContact O-CG2 3.32Å; C152-T385 WeakPolarHBondContact O-CG2 3.36Å; C152-I389 HydrophobicContact CB-CD1 4.36Å; C152-I389 HydrophobicContact CB-CG1 3.54Å
153	F	94.4	Very high	93.9	Very high	133 Å²	133	45.2 Å²	45.2	58%	0.583	23%	0.231	S	C	*	.	S	Bend	trans	-84.5	40.9	-178.3	-62.1	-78	0	0	0	112.7	L149 F150 Q151 I389	L149-F153 HydrophobicContact CD1-CE2 4.07Å; L149-F153 HydrophobicContact CD1-CZ 4.37Å; L149-F153 HydrophobicContact CG-CE2 4.15Å; L149-F153 WeakPolarHBondContact O-CD2 3.33Å; L149-F153 VanDerWaalsContact O-CE2 3.28Å; L149-F153 WeakPolarHBondContact O-CE2 3.49Å; F150-F153 PolarHBondContact O-N 2.67Å; Q151-F153 VanDerWaalsContact C-N 3.3Å; Q151-F153 PolarHBondContact O-N 3.18Å; F153-I389 HydrophobicContact CD1-CD1 4.46Å; F153-I389 HydrophobicContact CE1-CD1 4.09Å
154	Q	90.6	Very high	93.6	Very high	100 Å²	100	48.6 Å²	48.6	47%	0.467	25%	0.247	S	C	.	.	S	Bend	trans	-115	156.4	175.6	-63.3	-62.7	-26.2	0	0	109.6	Q151 C152 E156	Q151-Q154 WeakPolarHBondContact O-CG 3.32Å; C152-Q154 PolarHBondContact O-N 3.34Å; Q154-E156 WeakPolarHBondContact CB-O 3.5Å; Q154-E156 PolarHBondContact O-N 3.45Å
155	P	87.1	Confident	93.4	Very high	132 Å²	132	54.4 Å²	54.4	86%	0.857	28%	0.284	S	S	*	.	S	Bend	trans	-57.6	-33.8	177.9	-24.9	34.4	0	0	0	113.3
156	E	90.3	Very high	93.2	Very high	96 Å²	96	56.8 Å²	56.8	45%	0.449	29%	0.293	S	S	.	.	S	Bend	trans	-133.7	144	175.3	-176.5	163.3	-147.5	0	0	108.7	Q154 K161	Q154-E156 WeakPolarHBondContact CB-O 3.5Å; Q154-E156 PolarHBondContact O-N 3.45Å; E156-K161 WeakPolarHBondContact OE1-CD 3.4Å; E156-K161 WeakPolarHBondContact OE1-CE 3.43Å; E156-K161 IonicContact OE1-NZ 3.01Å; E156-K161 PolarHBondContact OE1-NZ 3.47Å; E156-K161 IonicContact OE2-NZ 2.73Å; E156-K161 PolarHBondContact OE2-NZ 3.16Å
157	L	93.5	Very high	93.1	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.031	30%	0.298	C	S	.	.			trans	-65.4	130.4	-179.6	-65.7	177.8	0	0	0	110	C152 W159 A160 V378 T379 P384 A388	C152-L157 HydrophobicContact CB-CD2 4.45Å; L157-W159 HydrophobicContact CB-CD2 4.42Å; L157-W159 HydrophobicContact CB-CZ2 4.26Å; L157-W159 HydrophobicContact CD1-CZ2 4.03Å; L157-W159 HydrophobicContact CD2-CH2 4.11Å; L157-W159 HydrophobicContact CD2-CZ2 3.8Å; L157-W159 HydrophobicContact CG-CZ2 4.26Å; L157-W159 PolarHBondContact O-N 3.4Å; L157-W159 VanDerWaalsContact O-N 3.16Å; L157-A160 HydrophobicContact CB-CB 4.23Å; L157-A160 VanDerWaalsContact O-CB 3.24Å; L157-A160 WeakPolarHBondContact O-CB 3.33Å; L157-A160 PolarHBondContact O-N 2.88Å; L157-V378 HydrophobicContact CD1-CG1 4.42Å; L157-T379 HydrophobicContact CD1-CG2 4.02Å; L157-P384 HydrophobicContact CD1-CB 3.88Å; L157-A388 HydrophobicContact CD1-CB 4.12Å; L157-A388 HydrophobicContact CD2-CB 4.14Å
158	P	93.5	Very high	92.8	Very high	11 Å²	11	59.6 Å²	59.6	7%	0.071	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.7	-170.9	22.4	-29.6	0	0	0	114	Q151 W166 F198	Q151-P158 HydrophobicContact CB-CG 3.91Å; Q151-P158 WeakPolarHBondContact O-CD 3.5Å; P158-W166 HydrophobicContact CB-CH2 4.14Å; P158-W166 HydrophobicContact CB-CZ2 4.06Å; P158-F198 HydrophobicContact CB-CD2 4.36Å; P158-F198 HydrophobicContact CB-CE2 3.85Å; P158-F198 HydrophobicContact CB-CZ 4.5Å; P158-F198 HydrophobicContact CG-CE2 3.85Å; P158-F198 HydrophobicContact CG-CZ 4Å
159	W	93.9	Very high	92.3	Very high	1 Å²	1	67.7 Å²	67.7	0%	0.004	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.2	175.2	55.2	84.1	0	0	0	113.9	Y148 Q151 L157 V195 F198 P375 A388 F392	Y148-W159 HydrophobicContact CD1-CD2 4.47Å; Y148-W159 AromaticContact CD1-CE3 3.88Å; Y148-W159 HydrophobicContact CD1-CE3 3.88Å; Y148-W159 AromaticContact CD1-CH2 3.66Å; Y148-W159 HydrophobicContact CD1-CH2 3.66Å; Y148-W159 HydrophobicContact CD1-CZ2 4.27Å; Y148-W159 AromaticContact CD1-CZ3 3.44Å; Y148-W159 HydrophobicContact CD1-CZ3 3.44Å; Y148-W159 VanDerWaalsContact CD1-CZ3 3.44Å; Y148-W159 HydrophobicContact CE1-CD2 4.19Å; Y148-W159 AromaticContact CE1-CE3 3.79Å; Y148-W159 HydrophobicContact CE1-CE3 3.79Å; Y148-W159 HydrophobicContact CE1-CH2 4.33Å; Y148-W159 AromaticContact CE1-CZ3 3.86Å; Y148-W159 HydrophobicContact CE1-CZ3 3.86Å; Y148-W159 HydrophobicContact CG-CZ3 4.44Å; Q151-W159 HydrophobicContact CB-CZ3 3.86Å; L157-W159 HydrophobicContact CB-CD2 4.42Å; L157-W159 HydrophobicContact CB-CZ2 4.26Å; L157-W159 HydrophobicContact CD1-CZ2 4.03Å; L157-W159 HydrophobicContact CD2-CH2 4.11Å; L157-W159 HydrophobicContact CD2-CZ2 3.8Å; L157-W159 HydrophobicContact CG-CZ2 4.26Å; L157-W159 PolarHBondContact O-N 3.4Å; L157-W159 VanDerWaalsContact O-N 3.16Å; W159-V195 HydrophobicContact CB-CB 4.4Å; W159-V195 HydrophobicContact CB-CG1 4.3Å; W159-V195 HydrophobicContact CB-CG2 4.15Å; W159-V195 HydrophobicContact CG-CG1 4.5Å; W159-V195 HydrophobicContact CG-CG2 4.47Å; W159-V195 WeakPolarHBondContact O-CG2 3.4Å; W159-F198 HydrophobicContact CB-CB 3.84Å; W159-F198 HydrophobicContact CB-CD1 3.95Å; W159-F198 HydrophobicContact CB-CD2 4.47Å; W159-F198 HydrophobicContact CB-CG 3.83Å; W159-F198 HydrophobicContact CD2-CD1 4.48Å; W159-F198 HydrophobicContact CD2-CE1 4.46Å; W159-F198 AromaticContact CE3-CD1 3.86Å; W159-F198 HydrophobicContact CE3-CD1 3.86Å; W159-F198 AromaticContact CE3-CE1 3.47Å; W159-F198 HydrophobicContact CE3-CE1 3.47Å; W159-F198 VanDerWaalsContact CE3-CE1 3.47Å; W159-F198 HydrophobicContact CE3-CE2 4.42Å; W159-F198 HydrophobicContact CE3-CG 4.5Å; W159-F198 AromaticContact CE3-CZ 3.78Å; W159-F198 HydrophobicContact CE3-CZ 3.78Å; W159-F198 AromaticContact CZ3-CE1 4Å; W159-F198 HydrophobicContact CZ3-CE1 4Å; W159-F198 HydrophobicContact CZ3-CZ 4.16Å; W159-P375 HydrophobicContact CZ2-CB 4.5Å; W159-A388 HydrophobicContact CZ2-CB 4.21Å; W159-F392 HydrophobicContact CH2-CE2 4.04Å; W159-F392 HydrophobicContact CZ2-CE2 4.06Å
160	A	90.7	Very high	91.7	Very high	29 Å²	29	71.7 Å²	71.7	24%	0.24	37%	0.373	C	S	.	.	S	Bend	trans	-79.5	-25.2	-175.6	0	0	0	0	0	114.4	L157 T379	L157-A160 HydrophobicContact CB-CB 4.23Å; L157-A160 VanDerWaalsContact O-CB 3.24Å; L157-A160 WeakPolarHBondContact O-CB 3.33Å; L157-A160 PolarHBondContact O-N 2.88Å; A160-T379 HydrophobicContact CB-CG2 3.81Å
161	K	89.1	Confident	91.2	Very high	85 Å²	85	67.8 Å²	67.8	37%	0.37	36%	0.358	S	S	.	.	S	Bend	trans	-134.7	157.4	-171.5	-72.6	-179.3	175	157.1	0	112.2	E156 E173 P194	E156-K161 WeakPolarHBondContact OE1-CD 3.4Å; E156-K161 WeakPolarHBondContact OE1-CE 3.43Å; E156-K161 IonicContact OE1-NZ 3.01Å; E156-K161 PolarHBondContact OE1-NZ 3.47Å; E156-K161 IonicContact OE2-NZ 2.73Å; E156-K161 PolarHBondContact OE2-NZ 3.16Å; K161-E173 WeakPolarHBondContact CB-OE1 3.19Å; K161-P194 WeakPolarHBondContact O-CB 3.16Å
162	C	86.3	Confident	90.6	Very high	13 Å²	13	67.5 Å²	67.5	9%	0.088	36%	0.357	C	S	.	.	S	Bend	trans	-83.2	168.3	164.9	-64	0	0	0	0	109.7	C171 I172 E173	C162-C171 HydrophobicContact CB-CB 3.83Å; C162-C171 WeakPolarHBondContact CB-SG 3.46Å; C162-C171 WeakPolarHBondContact SG-CB 3.49Å; C162-C171 PolarHBondContact SG-O 3.16Å; C162-C171 CovalentContact SG-SG 2.05Å; C162-C171 PolarHBondContact SG-SG 3.06Å; C162-I172 VanDerWaalsContact SG-C 3.59Å; C162-E173 HydrophobicContact CB-CG 4.02Å; C162-E173 PolarHBondContact N-OE1 3.49Å; C162-E173 VanDerWaalsContact N-OE1 3.15Å
163	N	89.1	Confident	89.9	Confident	154 Å²	154	69.6 Å²	69.6	82%	0.824	37%	0.367	S	S	*	.			trans	84.7	29	-173	-50	-50.2	0	0	0	116.3	N167	N163-N167 PolarHBondContact N-OD1 3.13Å
164	Q	92.3	Very high	88.7	Confident	72 Å²	72	64.4 Å²	64.4	34%	0.336	35%	0.345	S	S	.	.	S	Bend	trans	-92.3	160.9	165.9	-59.2	-68	-10.7	0	0	110.9	W166 N167	Q164-W166 HydrophobicContact CB-CD2 3.69Å; Q164-W166 HydrophobicContact CB-CE3 4.12Å; Q164-W166 HydrophobicContact CB-CG 4.28Å; Q164-W166 HydrophobicContact CB-CH2 3.82Å; Q164-W166 HydrophobicContact CB-CZ2 3.34Å; Q164-W166 HydrophobicContact CB-CZ3 4.18Å; Q164-W166 HydrophobicContact CG-CH2 3.98Å; Q164-W166 HydrophobicContact CG-CZ2 3.42Å; Q164-W166 VanDerWaalsContact CG-CZ2 3.42Å; Q164-W166 PolarHBondContact O-N 3.22Å; Q164-N167 VanDerWaalsContact CB-OD1 3.28Å; Q164-N167 WeakPolarHBondContact CB-OD1 3.32Å; Q164-N167 PolarHBondContact N-OD1 3.2Å; Q164-N167 WeakPolarHBondContact O-CB 3.45Å; Q164-N167 PolarHBondContact O-N 2.99Å
165	P	93.8	Very high	87.6	Confident	122 Å²	122	64 Å²	64	79%	0.792	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.6	-178	-25.9	34.8	0	0	0	115.6
166	W	93.6	Very high	86.6	Confident	50 Å²	50	63.4 Å²	63.4	19%	0.189	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.4	178.3	53.4	81.4	0	0	0	113.6	P158 Q164 F198 H201 N202	P158-W166 HydrophobicContact CB-CH2 4.14Å; P158-W166 HydrophobicContact CB-CZ2 4.06Å; Q164-W166 HydrophobicContact CB-CD2 3.69Å; Q164-W166 HydrophobicContact CB-CE3 4.12Å; Q164-W166 HydrophobicContact CB-CG 4.28Å; Q164-W166 HydrophobicContact CB-CH2 3.82Å; Q164-W166 HydrophobicContact CB-CZ2 3.34Å; Q164-W166 HydrophobicContact CB-CZ3 4.18Å; Q164-W166 HydrophobicContact CG-CH2 3.98Å; Q164-W166 HydrophobicContact CG-CZ2 3.42Å; Q164-W166 VanDerWaalsContact CG-CZ2 3.42Å; Q164-W166 PolarHBondContact O-N 3.22Å; W166-F198 AromaticContact CE2-CD2 3.7Å; W166-F198 HydrophobicContact CH2-CD2 4.39Å; W166-F198 HydrophobicContact CH2-CE2 4.3Å; W166-F198 AromaticContact CZ2-CD2 3.56Å; W166-F198 HydrophobicContact CZ2-CD2 3.56Å; W166-F198 AromaticContact CZ2-CE2 3.89Å; W166-F198 HydrophobicContact CZ2-CE2 3.89Å; W166-F198 AromaticContact NE1-CD2 3.8Å; W166-H201 HydrophobicContact CB-CB 4.16Å; W166-H201 PolarHBondContact O-ND1 3.23Å; W166-N202 HydrophobicContact CB-CB 3.89Å; W166-N202 HydrophobicContact CD2-CB 3.64Å; W166-N202 HydrophobicContact CE3-CB 3.99Å; W166-N202 HydrophobicContact CG-CB 3.6Å
167	N	94.6	Very high	85.3	Confident	28 Å²	28	62.5 Å²	62.5	15%	0.15	32%	0.324	C	S	.	.			trans	-79.3	147.2	-178.1	-68.9	134.3	0	0	0	112.1	N163 Q164 C171 E197	N163-N167 PolarHBondContact N-OD1 3.13Å; Q164-N167 VanDerWaalsContact CB-OD1 3.28Å; Q164-N167 WeakPolarHBondContact CB-OD1 3.32Å; Q164-N167 PolarHBondContact N-OD1 3.2Å; Q164-N167 WeakPolarHBondContact O-CB 3.45Å; Q164-N167 PolarHBondContact O-N 2.99Å; N167-C171 HydrophobicContact CB-CB 4.13Å; N167-E197 WeakPolarHBondContact CA-OE2 3.33Å; N167-E197 WeakPolarHBondContact CB-OE2 3.43Å; N167-E197 PolarHBondContact ND2-OE2 3.26Å
168	T	91.3	Very high	83.8	Confident	56 Å²	56	68 Å²	68	34%	0.344	35%	0.348	S	S	.	.			trans	-96.4	168.3	171.8	74.6	0	0	0	0	111	Q170 C171 E197	T168-Q170 PolarHBondContact O-N 3.1Å; T168-Q170 WeakPolarHBondContact OG1-CB 3.3Å; T168-Q170 PolarHBondContact OG1-N 2.93Å; T168-Q170 VanDerWaalsContact OG1-N 3.16Å; T168-C171 VanDerWaalsContact O-CB 3.31Å; T168-C171 WeakPolarHBondContact O-CB 3.22Å; T168-C171 PolarHBondContact O-N 2.95Å; T168-E197 PolarHBondContact N-OE2 3.03Å; T168-E197 PolarHBondContact OG1-OE1 3.25Å
169	D	86.6	Confident	82.6	Confident	170 Å²	170	72 Å²	72	91%	0.909	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-11.2	171.8	-61	-33.9	0	0	0	112.8
170	Q	85.1	Confident	81.2	Confident	105 Å²	105	80 Å²	80	49%	0.491	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	2.4	176.3	-56.7	179.5	-14.5	0	0	113	T168 I172 F191 T192	T168-Q170 PolarHBondContact O-N 3.1Å; T168-Q170 WeakPolarHBondContact OG1-CB 3.3Å; T168-Q170 PolarHBondContact OG1-N 2.93Å; T168-Q170 VanDerWaalsContact OG1-N 3.16Å; Q170-I172 PolarHBondContact O-N 2.88Å; Q170-F191 HydrophobicContact CB-CD1 4.45Å; Q170-F191 WeakPolarHBondContact O-CD1 3.17Å; Q170-T192 PolarHBondContact O-N 2.93Å; Q170-T192 VanDerWaalsContact O-N 3.08Å; Q170-T192 PolarHBondContact O-OG1 2.79Å
171	C	87.8	Confident	79.9	Confident	16 Å²	16	84.4 Å²	84.4	11%	0.108	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-72.3	122	173.5	-170.7	0	0	0	0	110.3	C162 N167 T168 E197	C162-C171 HydrophobicContact CB-CB 3.83Å; C162-C171 WeakPolarHBondContact CB-SG 3.46Å; C162-C171 WeakPolarHBondContact SG-CB 3.49Å; C162-C171 PolarHBondContact SG-O 3.16Å; C162-C171 CovalentContact SG-SG 2.05Å; C162-C171 PolarHBondContact SG-SG 3.06Å; N167-C171 HydrophobicContact CB-CB 4.13Å; T168-C171 VanDerWaalsContact O-CB 3.31Å; T168-C171 WeakPolarHBondContact O-CB 3.22Å; T168-C171 PolarHBondContact O-N 2.95Å; C171-E197 WeakPolarHBondContact CB-OE2 3.17Å
172	I	83.7	Confident	78.6	Confident	38 Å²	38	84.2 Å²	84.2	20%	0.195	43%	0.429	C	S	.	.			trans	-121	129.8	169.6	-75.1	-178.1	0	0	0	110.3	C162 Q170 Y176 A186 F191 T192 P194	C162-I172 VanDerWaalsContact SG-C 3.59Å; Q170-I172 PolarHBondContact O-N 2.88Å; I172-Y176 HydrophobicContact CG2-CD2 4.44Å; I172-Y176 HydrophobicContact CG2-CG 4.36Å; I172-A186 HydrophobicContact CD1-CB 4.4Å; I172-F191 HydrophobicContact CB-CB 4.32Å; I172-F191 HydrophobicContact CB-CD1 4.28Å; I172-F191 HydrophobicContact CD1-CB 3.99Å; I172-F191 HydrophobicContact CD1-CD1 3.1Å; I172-F191 HydrophobicContact CD1-CD2 3.88Å; I172-F191 HydrophobicContact CD1-CE1 3.36Å; I172-F191 HydrophobicContact CD1-CE2 4.1Å; I172-F191 HydrophobicContact CD1-CG 3.36Å; I172-F191 HydrophobicContact CD1-CZ 3.84Å; I172-F191 HydrophobicContact CG1-CB 4.24Å; I172-F191 HydrophobicContact CG1-CD1 3.34Å; I172-F191 HydrophobicContact CG1-CE1 3.83Å; I172-F191 HydrophobicContact CG1-CG 3.91Å; I172-T192 PolarHBondContact N-O 3.38Å; I172-P194 WeakPolarHBondContact O-CD 3.43Å
173	E	81.3	Confident	77.5	Confident	45 Å²	45	88.4 Å²	88.4	21%	0.21	44%	0.443	C	S	.	.			trans	-68.4	138.9	170.9	-59.2	-178.3	177.9	0	0	110.7	K161 C162 T175 Y176	K161-E173 WeakPolarHBondContact CB-OE1 3.19Å; C162-E173 HydrophobicContact CB-CG 4.02Å; C162-E173 PolarHBondContact N-OE1 3.49Å; C162-E173 VanDerWaalsContact N-OE1 3.15Å; E173-T175 WeakPolarHBondContact CB-OG1 3.46Å; E173-T175 PolarHBondContact O-N 3.38Å; E173-Y176 HydrophobicContact CB-CD2 4.1Å; E173-Y176 HydrophobicContact CB-CE2 4.47Å; E173-Y176 WeakPolarHBondContact O-CB 3.38Å; E173-Y176 PolarHBondContact O-N 3.04Å
174	D	69.6	Low	76.2	Confident	24 Å²	24	86.2 Å²	86.2	13%	0.128	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.8	-176.2	-61.3	-64.8	0	0	0	113.7	Y176 R177 K376 M380	D174-Y176 PolarHBondContact O-N 2.94Å; D174-R177 WeakPolarHBondContact O-CB 3.12Å; D174-R177 PolarHBondContact O-N 3.22Å; D174-K376 WeakPolarHBondContact OD1-CE 3.32Å; D174-K376 IonicContact OD1-NZ 3.81Å; D174-K376 PolarHBondContact OD1-NZ 3.12Å; D174-K376 WeakPolarHBondContact OD2-CE 3.32Å; D174-K376 IonicContact OD2-NZ 3.71Å; D174-M380 HydrophobicContact CB-CE 3.78Å
175	T	67.5	Low	74.6	Confident	92 Å²	92	86.9 Å²	86.9	56%	0.564	45%	0.453	S	S	*	.	H	α-helix	trans	-57.4	-30.7	171.5	39	0	0	0	0	112.4	E173 R177 K178	E173-T175 WeakPolarHBondContact CB-OG1 3.46Å; E173-T175 PolarHBondContact O-N 3.38Å; T175-R177 VanDerWaalsContact C-N 3.34Å; T175-R177 PolarHBondContact O-N 3.4Å; T175-K178 PolarHBondContact O-N 2.88Å
176	Y	65.2	Low	73	Confident	119 Å²	119	82.7 Å²	82.7	47%	0.467	43%	0.429	S	S	.	.	H	α-helix	trans	-70.3	-26.6	176.1	-76.4	-90.8	0	0	0	113.1	I172 E173 D174 K178 N179 I182	I172-Y176 HydrophobicContact CG2-CD2 4.44Å; I172-Y176 HydrophobicContact CG2-CG 4.36Å; E173-Y176 HydrophobicContact CB-CD2 4.1Å; E173-Y176 HydrophobicContact CB-CE2 4.47Å; E173-Y176 WeakPolarHBondContact O-CB 3.38Å; E173-Y176 PolarHBondContact O-N 3.04Å; D174-Y176 PolarHBondContact O-N 2.94Å; Y176-K178 PolarHBondContact O-N 3.23Å; Y176-N179 PolarHBondContact O-N 2.99Å; Y176-I182 HydrophobicContact CD1-CG2 3.86Å; Y176-I182 HydrophobicContact CE1-CG2 4.43Å
177	R	62.6	Low	71.3	Confident	76 Å²	76	86.6 Å²	86.6	29%	0.287	45%	0.454	S	S	.	.	H	α-helix	trans	-62.3	-30.3	175.4	-92.5	179.1	178.8	-157	-4.9	112.7	D174 T175 N179 W183 V357	D174-R177 WeakPolarHBondContact O-CB 3.12Å; D174-R177 PolarHBondContact O-N 3.22Å; T175-R177 VanDerWaalsContact C-N 3.34Å; T175-R177 PolarHBondContact O-N 3.4Å; R177-N179 VanDerWaalsContact C-N 3.26Å; R177-N179 PolarHBondContact O-N 3.34Å; R177-W183 HydrophobicContact CG-CG 4.4Å; R177-V357 VanDerWaalsContact NH1-CG1 3.34Å
178	K	62.4	Low	69.5	Low	123 Å²	123	86.2 Å²	86.2	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-29.8	177.6	-70.2	-173.3	174.5	-178	0	112.4	T175 Y176 K180 E354	T175-K178 PolarHBondContact O-N 2.88Å; Y176-K178 PolarHBondContact O-N 3.23Å; K178-K180 PolarHBondContact O-N 3.1Å; K178-E354 WeakPolarHBondContact CE-O 3.4Å; K178-E354 IonicContact NZ-OE2 3.96Å; K178-E354 PolarHBondContact NZ-OE2 3.08Å
179	N	68.6	Low	67.9	Low	94 Å²	94	88.4 Å²	88.4	50%	0.503	47%	0.472	S	S	.	.			trans	-90.6	83.3	175.9	-79.6	-33.7	0	0	0	110.6	Y176 R177 T181 I182 W183	Y176-N179 PolarHBondContact O-N 2.99Å; R177-N179 VanDerWaalsContact C-N 3.26Å; R177-N179 PolarHBondContact O-N 3.34Å; N179-T181 PolarHBondContact O-N 3.33Å; N179-I182 HydrophobicContact CB-CB 4.29Å; N179-I182 HydrophobicContact CB-CD1 4.04Å; N179-I182 HydrophobicContact CB-CG1 4.25Å; N179-I182 PolarHBondContact O-N 3.16Å; N179-W183 PolarHBondContact O-N 3.12Å
180	K	63.2	Low	66.9	Low	168 Å²	168	86 Å²	86	73%	0.73	46%	0.459	S	S	*	.	H	α-helix	trans	-47.8	-35.4	-179	-70.3	-172.8	177.4	-176.1	0	113.8	K178 W183 V184	K178-K180 PolarHBondContact O-N 3.1Å; K180-W183 PolarHBondContact O-N 2.89Å; K180-V184 WeakPolarHBondContact O-CB 3.39Å; K180-V184 VanDerWaalsContact O-CG2 3.28Å; K180-V184 WeakPolarHBondContact O-CG2 3.01Å; K180-V184 PolarHBondContact O-N 3.16Å
181	T	63.9	Low	66.4	Low	122 Å²	122	84.6 Å²	84.6	75%	0.748	45%	0.451	S	S	*	.	H	α-helix	trans	-65.1	-40.3	178.7	-25.3	0	0	0	0	112.7	N179 A185	N179-T181 PolarHBondContact O-N 3.33Å; T181-A185 VanDerWaalsContact O-CB 3.26Å; T181-A185 WeakPolarHBondContact O-CB 3.44Å; T181-A185 PolarHBondContact O-N 3.46Å; T181-A185 VanDerWaalsContact O-N 3.17Å
182	I	62.6	Low	66.2	Low	82 Å²	82	85.8 Å²	85.8	42%	0.421	46%	0.458	S	S	.	.	H	α-helix	trans	-77.4	-37.9	177.8	-60	174	0	0	0	109.9	Y176 N179 V184 A185 A186	Y176-I182 HydrophobicContact CD1-CG2 3.86Å; Y176-I182 HydrophobicContact CE1-CG2 4.43Å; N179-I182 HydrophobicContact CB-CB 4.29Å; N179-I182 HydrophobicContact CB-CD1 4.04Å; N179-I182 HydrophobicContact CB-CG1 4.25Å; N179-I182 PolarHBondContact O-N 3.16Å; I182-V184 PolarHBondContact O-N 3.12Å; I182-A185 PolarHBondContact O-N 3.47Å; I182-A186 WeakPolarHBondContact O-CB 3.5Å; I182-A186 PolarHBondContact O-N 2.84Å
183	W	63	Low	66.4	Low	100 Å²	100	84.6 Å²	84.6	38%	0.379	45%	0.453	S	S	.	.	H	α-helix	trans	-62.8	-42.4	178	-164.7	75.9	0	0	0	112.8	R177 N179 K180 A186 A188	R177-W183 HydrophobicContact CG-CG 4.4Å; N179-W183 PolarHBondContact O-N 3.12Å; K180-W183 PolarHBondContact O-N 2.89Å; W183-A186 PolarHBondContact O-N 2.92Å; W183-A188 HydrophobicContact CD2-CB 4.01Å; W183-A188 HydrophobicContact CG-CB 4.24Å; W183-A188 HydrophobicContact CZ2-CB 4.03Å; W183-A188 WeakPolarHBondContact O-CB 3.38Å
184	V	61.4	Low	66.8	Low	109 Å²	109	82.6 Å²	82.6	66%	0.661	44%	0.444	S	S	*	.	H	α-helix	trans	-70.2	-39.2	174.2	173.9	0	0	0	0	111.3	K180 I182 A186 N187	K180-V184 WeakPolarHBondContact O-CB 3.39Å; K180-V184 VanDerWaalsContact O-CG2 3.28Å; K180-V184 WeakPolarHBondContact O-CG2 3.01Å; K180-V184 PolarHBondContact O-N 3.16Å; I182-V184 PolarHBondContact O-N 3.12Å; V184-A186 PolarHBondContact O-N 3.19Å; V184-N187 PolarHBondContact O-N 3.26Å
185	A	59.8	Low	67.9	Low	86 Å²	86	81.5 Å²	81.5	71%	0.711	44%	0.438	S	S	*	.	H	α-helix	trans	-64.9	-27.5	177.4	0	0	0	0	0	113.3	T181 I182 N187	T181-A185 VanDerWaalsContact O-CB 3.26Å; T181-A185 WeakPolarHBondContact O-CB 3.44Å; T181-A185 PolarHBondContact O-N 3.46Å; T181-A185 VanDerWaalsContact O-N 3.17Å; I182-A185 PolarHBondContact O-N 3.47Å; A185-N187 VanDerWaalsContact C-N 3.29Å; A185-N187 PolarHBondContact O-N 3.12Å
186	A	60	Low	69	Low	34 Å²	34	78.6 Å²	78.6	28%	0.281	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-6	179.1	0	0	0	0	0	114.3	I172 I182 W183 V184 F191	I172-A186 HydrophobicContact CD1-CB 4.4Å; I182-A186 WeakPolarHBondContact O-CB 3.5Å; I182-A186 PolarHBondContact O-N 2.84Å; W183-A186 PolarHBondContact O-N 2.92Å; V184-A186 PolarHBondContact O-N 3.19Å; A186-F191 HydrophobicContact CB-CE2 4.25Å; A186-F191 HydrophobicContact CB-CZ 4.27Å; A186-F191 WeakPolarHBondContact O-CE2 3.26Å; A186-F191 WeakPolarHBondContact O-CZ 3.24Å
187	N	57.4	Low	70.4	Confident	132 Å²	132	73 Å²	73	71%	0.706	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	55.2	-173.8	-158.5	22.9	0	0	0	112.1	V184 A185 S189	V184-N187 PolarHBondContact O-N 3.26Å; A185-N187 VanDerWaalsContact C-N 3.29Å; A185-N187 PolarHBondContact O-N 3.12Å; N187-S189 PolarHBondContact O-N 3.39Å
188	A	55.6	Low	71.9	Confident	20 Å²	20	69.4 Å²	69.4	17%	0.165	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-74.8	20	-153.2	0	0	0	0	0	118.2	W183 N190 F191	W183-A188 HydrophobicContact CD2-CB 4.01Å; W183-A188 HydrophobicContact CG-CB 4.24Å; W183-A188 HydrophobicContact CZ2-CB 4.03Å; W183-A188 WeakPolarHBondContact O-CB 3.38Å; A188-N190 VanDerWaalsContact C-N 3.31Å; A188-N190 PolarHBondContact O-N 3.26Å; A188-F191 VanDerWaalsContact CA-CD2 3.45Å; A188-F191 HydrophobicContact CB-CD2 4.04Å; A188-F191 HydrophobicContact CB-CE2 4.38Å
189	S	59	Low	73.5	Confident	101 Å²	101	63.8 Å²	63.8	71%	0.706	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-74.1	-16.4	-176.9	56.7	0	0	0	0	114.7	N187	N187-S189 PolarHBondContact O-N 3.39Å
190	N	64.5	Low	74.7	Confident	120 Å²	120	61.1 Å²	61.1	64%	0.642	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-118.2	19.8	-174.1	-70.9	-5.1	0	0	0	114.5	A188	A188-N190 VanDerWaalsContact C-N 3.31Å; A188-N190 PolarHBondContact O-N 3.26Å
191	F	74.9	Confident	76.2	Confident	76 Å²	76	56.9 Å²	56.9	33%	0.333	33%	0.328	S	S	.	.			trans	-96.3	147.4	-178.4	-67.4	-92.3	0	0	0	112.8	Q170 I172 A186 A188	Q170-F191 HydrophobicContact CB-CD1 4.45Å; Q170-F191 WeakPolarHBondContact O-CD1 3.17Å; I172-F191 HydrophobicContact CB-CB 4.32Å; I172-F191 HydrophobicContact CB-CD1 4.28Å; I172-F191 HydrophobicContact CD1-CB 3.99Å; I172-F191 HydrophobicContact CD1-CD1 3.1Å; I172-F191 HydrophobicContact CD1-CD2 3.88Å; I172-F191 HydrophobicContact CD1-CE1 3.36Å; I172-F191 HydrophobicContact CD1-CE2 4.1Å; I172-F191 HydrophobicContact CD1-CG 3.36Å; I172-F191 HydrophobicContact CD1-CZ 3.84Å; I172-F191 HydrophobicContact CG1-CB 4.24Å; I172-F191 HydrophobicContact CG1-CD1 3.34Å; I172-F191 HydrophobicContact CG1-CE1 3.83Å; I172-F191 HydrophobicContact CG1-CG 3.91Å; A186-F191 HydrophobicContact CB-CE2 4.25Å; A186-F191 HydrophobicContact CB-CZ 4.27Å; A186-F191 WeakPolarHBondContact O-CE2 3.26Å; A186-F191 WeakPolarHBondContact O-CZ 3.24Å; A188-F191 VanDerWaalsContact CA-CD2 3.45Å; A188-F191 HydrophobicContact CB-CD2 4.04Å; A188-F191 HydrophobicContact CB-CE2 4.38Å
192	T	83.1	Confident	77.7	Confident	41 Å²	41	52.5 Å²	52.5	25%	0.252	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-108.4	151.7	-179.7	47.9	0	0	0	0	110.3	Q170 I172 E197	Q170-T192 PolarHBondContact O-N 2.93Å; Q170-T192 VanDerWaalsContact O-N 3.08Å; Q170-T192 PolarHBondContact O-OG1 2.79Å; I172-T192 PolarHBondContact N-O 3.38Å; T192-E197 WeakPolarHBondContact OG1-CG 3.46Å; T192-E197 PolarHBondContact OG1-OE1 3.24Å
193	S	87.6	Confident	79.3	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.084	28%	0.279	C	S	.	.			trans	-85.6	151	176.3	82.5	0	0	0	0	110.9	V195 T196 E197	S193-V195 PolarHBondContact O-N 2.92Å; S193-V195 VanDerWaalsContact O-N 3.15Å; S193-T196 WeakPolarHBondContact O-CB 3.43Å; S193-T196 PolarHBondContact O-N 3.39Å; S193-T196 PolarHBondContact OG-N 3.06Å; S193-T196 PolarHBondContact OG-OG1 3.19Å; S193-E197 PolarHBondContact O-N 2.78Å
194	P	91.6	Very high	80.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-58.3	-30.5	178.4	20.9	-32.3	0	0	0	112.7	K161 I172 F198	K161-P194 WeakPolarHBondContact O-CB 3.16Å; I172-P194 WeakPolarHBondContact O-CD 3.43Å; P194-F198 VanDerWaalsContact O-CB 3.27Å; P194-F198 WeakPolarHBondContact O-CB 3.41Å; P194-F198 PolarHBondContact O-N 3.14Å
195	V	92	Very high	82.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-71.8	-40.9	176.4	-168.1	0	0	0	0	111.9	W159 S193 F198 W199 I372 P375 K376	W159-V195 HydrophobicContact CB-CB 4.4Å; W159-V195 HydrophobicContact CB-CG1 4.3Å; W159-V195 HydrophobicContact CB-CG2 4.15Å; W159-V195 HydrophobicContact CG-CG1 4.5Å; W159-V195 HydrophobicContact CG-CG2 4.47Å; W159-V195 WeakPolarHBondContact O-CG2 3.4Å; S193-V195 PolarHBondContact O-N 2.92Å; S193-V195 VanDerWaalsContact O-N 3.15Å; V195-F198 PolarHBondContact O-N 2.78Å; V195-W199 PolarHBondContact O-N 3.34Å; V195-I372 HydrophobicContact CG1-CG2 4.33Å; V195-I372 WeakPolarHBondContact CG1-O 3.24Å; V195-P375 HydrophobicContact CG1-CB 4.12Å; V195-K376 HydrophobicContact CB-CB 4.34Å; V195-K376 HydrophobicContact CG1-CB 4.44Å; V195-K376 HydrophobicContact CG2-CB 3.84Å; V195-K376 HydrophobicContact CG2-CG 4.12Å
196	T	90.5	Very high	83.9	Confident	32 Å²	32	37.4 Å²	37.4	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-48.7	175	-52.4	0	0	0	0	110.4	S193 F198 W199 E200	S193-T196 WeakPolarHBondContact O-CB 3.43Å; S193-T196 PolarHBondContact O-N 3.39Å; S193-T196 PolarHBondContact OG-N 3.06Å; S193-T196 PolarHBondContact OG-OG1 3.19Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 2.88Å; T196-W199 PolarHBondContact O-N 3.41Å; T196-E200 HydrophobicContact CG2-CG 4.36Å; T196-E200 WeakPolarHBondContact O-CB 3.5Å; T196-E200 WeakPolarHBondContact O-CG 3.41Å; T196-E200 PolarHBondContact O-N 3.33Å
197	E	93.6	Very high	85.5	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-67.3	-34.4	178.8	-65.8	-162.8	158.3	0	0	112.6	N167 T168 C171 T192 S193 W199 H201	N167-E197 WeakPolarHBondContact CA-OE2 3.33Å; N167-E197 WeakPolarHBondContact CB-OE2 3.43Å; N167-E197 PolarHBondContact ND2-OE2 3.26Å; T168-E197 PolarHBondContact N-OE2 3.03Å; T168-E197 PolarHBondContact OG1-OE1 3.25Å; C171-E197 WeakPolarHBondContact CB-OE2 3.17Å; T192-E197 WeakPolarHBondContact OG1-CG 3.46Å; T192-E197 PolarHBondContact OG1-OE1 3.24Å; S193-E197 PolarHBondContact O-N 2.78Å; E197-W199 VanDerWaalsContact C-N 3.33Å; E197-W199 PolarHBondContact O-N 2.98Å; E197-H201 WeakPolarHBondContact O-CA 3.38Å; E197-H201 VanDerWaalsContact O-CB 3.27Å; E197-H201 WeakPolarHBondContact O-CB 3.4Å; E197-H201 PolarHBondContact O-N 2.99Å
198	F	95.6	Very high	87.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.2	C	C	.	.	I	π-helix	trans	-60	-45.2	172.1	-179.4	-100.2	0	0	0	111.3	Y147 Y148 Q151 P158 W159 W166 P194 V195 T196 N202 V203	Y147-F198 HydrophobicContact CE1-CZ 4.1Å; Y148-F198 HydrophobicContact CD1-CE1 4.11Å; Y148-F198 AromaticContact CE1-CD1 3.83Å; Y148-F198 HydrophobicContact CE1-CD1 3.83Å; Y148-F198 AromaticContact CE1-CE1 3.5Å; Y148-F198 HydrophobicContact CE1-CE1 3.5Å; Y148-F198 HydrophobicContact CE2-CE1 4.25Å; Y148-F198 AromaticContact CZ-CD1 3.77Å; Y148-F198 AromaticContact CZ-CE1 3.6Å; Y148-F198 WeakPolarHBondContact OH-CD1 3.16Å; Q151-F198 HydrophobicContact CB-CZ 4.41Å; Q151-F198 HydrophobicContact CG-CZ 4.13Å; P158-F198 HydrophobicContact CB-CD2 4.36Å; P158-F198 HydrophobicContact CB-CE2 3.85Å; P158-F198 HydrophobicContact CB-CZ 4.5Å; P158-F198 HydrophobicContact CG-CE2 3.85Å; P158-F198 HydrophobicContact CG-CZ 4Å; W159-F198 HydrophobicContact CB-CB 3.84Å; W159-F198 HydrophobicContact CB-CD1 3.95Å; W159-F198 HydrophobicContact CB-CD2 4.47Å; W159-F198 HydrophobicContact CB-CG 3.83Å; W159-F198 HydrophobicContact CD2-CD1 4.48Å; W159-F198 HydrophobicContact CD2-CE1 4.46Å; W159-F198 AromaticContact CE3-CD1 3.86Å; W159-F198 HydrophobicContact CE3-CD1 3.86Å; W159-F198 AromaticContact CE3-CE1 3.47Å; W159-F198 HydrophobicContact CE3-CE1 3.47Å; W159-F198 VanDerWaalsContact CE3-CE1 3.47Å; W159-F198 HydrophobicContact CE3-CE2 4.42Å; W159-F198 HydrophobicContact CE3-CG 4.5Å; W159-F198 AromaticContact CE3-CZ 3.78Å; W159-F198 HydrophobicContact CE3-CZ 3.78Å; W159-F198 AromaticContact CZ3-CE1 4Å; W159-F198 HydrophobicContact CZ3-CE1 4Å; W159-F198 HydrophobicContact CZ3-CZ 4.16Å; W166-F198 AromaticContact CE2-CD2 3.7Å; W166-F198 HydrophobicContact CH2-CD2 4.39Å; W166-F198 HydrophobicContact CH2-CE2 4.3Å; W166-F198 AromaticContact CZ2-CD2 3.56Å; W166-F198 HydrophobicContact CZ2-CD2 3.56Å; W166-F198 AromaticContact CZ2-CE2 3.89Å; W166-F198 HydrophobicContact CZ2-CE2 3.89Å; W166-F198 AromaticContact NE1-CD2 3.8Å; P194-F198 VanDerWaalsContact O-CB 3.27Å; P194-F198 WeakPolarHBondContact O-CB 3.41Å; P194-F198 PolarHBondContact O-N 3.14Å; V195-F198 PolarHBondContact O-N 2.78Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 2.88Å; F198-N202 HydrophobicContact CD2-CB 4.17Å; F198-N202 HydrophobicContact CE2-CB 4.46Å; F198-N202 WeakPolarHBondContact CE2-ND2 3.36Å; F198-N202 WeakPolarHBondContact O-CB 3.23Å; F198-N202 PolarHBondContact O-N 3.18Å; F198-V203 HydrophobicContact CD1-CG2 3.75Å; F198-V203 HydrophobicContact CE1-CG2 3.4Å; F198-V203 HydrophobicContact CZ-CG2 3.95Å; F198-V203 WeakPolarHBondContact O-CG2 3.17Å; F198-V203 PolarHBondContact O-N 2.98Å
199	W	95.3	Very high	88.9	Confident	5 Å²	5	33.2 Å²	33.2	2%	0.019	19%	0.192	C	C	.	.	I	π-helix	trans	-65.4	-53.5	177.1	174.7	-110	0	0	0	112.4	W144 Y148 V195 T196 E197 V203 L204 P367 F371 I372	W144-W199 HydrophobicContact CB-CH2 4.43Å; W144-W199 HydrophobicContact CB-CZ3 4.24Å; W144-W199 AromaticContact CD2-CH2 3.64Å; W144-W199 HydrophobicContact CD2-CH2 3.64Å; W144-W199 HydrophobicContact CD2-CZ3 4.26Å; W144-W199 AromaticContact CE3-CH2 3.69Å; W144-W199 HydrophobicContact CE3-CH2 3.69Å; W144-W199 AromaticContact CG-CH2 3.98Å; W144-W199 HydrophobicContact CG-CH2 3.98Å; W144-W199 HydrophobicContact CG-CZ3 4.12Å; W144-W199 HydrophobicContact CZ2-CH2 4.49Å; W144-W199 HydrophobicContact CZ3-CH2 4.17Å; Y148-W199 AromaticContact CE2-CE3 3.8Å; Y148-W199 HydrophobicContact CE2-CE3 3.8Å; Y148-W199 AromaticContact CE2-CZ3 3.95Å; Y148-W199 HydrophobicContact CE2-CZ3 3.95Å; V195-W199 PolarHBondContact O-N 3.34Å; T196-W199 PolarHBondContact O-N 3.41Å; E197-W199 VanDerWaalsContact C-N 3.33Å; E197-W199 PolarHBondContact O-N 2.98Å; W199-V203 HydrophobicContact CE3-CB 4.02Å; W199-V203 HydrophobicContact CE3-CG1 3.84Å; W199-V203 HydrophobicContact CE3-CG2 4.37Å; W199-V203 HydrophobicContact CZ3-CB 4.49Å; W199-V203 HydrophobicContact CZ3-CG1 3.8Å; W199-V203 WeakPolarHBondContact O-CB 3.44Å; W199-L204 HydrophobicContact CD2-CD1 4.17Å; W199-L204 HydrophobicContact CD2-CG 4.21Å; W199-L204 HydrophobicContact CH2-CD2 4.12Å; W199-L204 HydrophobicContact CH2-CG 4.42Å; W199-L204 HydrophobicContact CZ2-CD1 3.73Å; W199-L204 HydrophobicContact CZ2-CD2 4.07Å; W199-L204 HydrophobicContact CZ2-CG 4.07Å; W199-L204 WeakPolarHBondContact O-CB 3.23Å; W199-L204 WeakPolarHBondContact O-CG 3.47Å; W199-L204 PolarHBondContact O-N 2.97Å; W199-P367 HydrophobicContact CZ2-CB 4.28Å; W199-F371 HydrophobicContact CD2-CB 4.06Å; W199-F371 HydrophobicContact CE3-CB 3.6Å; W199-F371 HydrophobicContact CE3-CG 4.14Å; W199-F371 HydrophobicContact CH2-CB 4.03Å; W199-F371 AromaticContact CH2-CD2 3.73Å; W199-F371 HydrophobicContact CH2-CD2 3.73Å; W199-F371 HydrophobicContact CH2-CE2 4.41Å; W199-F371 AromaticContact CH2-CG 3.92Å; W199-F371 HydrophobicContact CH2-CG 3.92Å; W199-F371 HydrophobicContact CZ2-CB 4.48Å; W199-F371 HydrophobicContact CZ2-CD2 4.46Å; W199-F371 HydrophobicContact CZ3-CB 3.58Å; W199-F371 HydrophobicContact CZ3-CD1 4.12Å; W199-F371 AromaticContact CZ3-CD2 3.89Å; W199-F371 HydrophobicContact CZ3-CD2 3.89Å; W199-F371 AromaticContact CZ3-CG 3.59Å; W199-F371 HydrophobicContact CZ3-CG 3.59Å; W199-I372 HydrophobicContact CB-CD1 4.46Å; W199-I372 HydrophobicContact CB-CG1 4.07Å; W199-I372 HydrophobicContact CG-CD1 4.16Å; W199-I372 HydrophobicContact CG-CG1 4Å
200	E	93.4	Very high	90.6	Very high	38 Å²	38	28.9 Å²	28.9	18%	0.178	16%	0.161	C	C	.	.	I	π-helix	trans	-74.8	-45.1	-171.7	-67.6	-176.8	165.8	0	0	112.2	T196 G205 I206	T196-E200 HydrophobicContact CG2-CG 4.36Å; T196-E200 WeakPolarHBondContact O-CB 3.5Å; T196-E200 WeakPolarHBondContact O-CG 3.41Å; T196-E200 PolarHBondContact O-N 3.33Å; E200-G205 CarbonylContact O-C 3.49Å; E200-G205 VanDerWaalsContact O-CA 3.24Å; E200-G205 WeakPolarHBondContact O-CA 3.39Å; E200-G205 PolarHBondContact O-N 3.37Å; E200-I206 HydrophobicContact CB-CG2 3.99Å; E200-I206 HydrophobicContact CG-CG2 4.49Å; E200-I206 PolarHBondContact O-N 3.4Å
201	H	94.6	Very high	92	Very high	80 Å²	80	28.1 Å²	28.1	37%	0.37	15%	0.154	S	C	.	.	I	π-helix	trans	-93.7	-33.8	-172.1	-58.9	171.3	0	0	0	113.6	W166 E197 G205	W166-H201 HydrophobicContact CB-CB 4.16Å; W166-H201 PolarHBondContact O-ND1 3.23Å; E197-H201 WeakPolarHBondContact O-CA 3.38Å; E197-H201 VanDerWaalsContact O-CB 3.27Å; E197-H201 WeakPolarHBondContact O-CB 3.4Å; E197-H201 PolarHBondContact O-N 2.99Å; H201-G205 WeakPolarHBondContact O-CA 3.35Å
202	N	95.3	Very high	92.9	Very high	29 Å²	29	30 Å²	30	16%	0.155	16%	0.163	C	C	.	.	I	π-helix	trans	-97.8	-55.1	-177.4	-175.2	56.7	0	0	0	113.3	Y147 W166 F198 K217	Y147-N202 PolarHBondContact OH-ND2 3.09Å; W166-N202 HydrophobicContact CB-CB 3.89Å; W166-N202 HydrophobicContact CD2-CB 3.64Å; W166-N202 HydrophobicContact CE3-CB 3.99Å; W166-N202 HydrophobicContact CG-CB 3.6Å; F198-N202 HydrophobicContact CD2-CB 4.17Å; F198-N202 HydrophobicContact CE2-CB 4.46Å; F198-N202 WeakPolarHBondContact CE2-ND2 3.36Å; F198-N202 WeakPolarHBondContact O-CB 3.23Å; F198-N202 PolarHBondContact O-N 3.18Å; N202-K217 VanDerWaalsContact O-CE 3.23Å; N202-K217 WeakPolarHBondContact O-CE 3.46Å; N202-K217 PolarHBondContact O-NZ 3.28Å
203	V	96.1	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	I	π-helix	trans	-67.2	-60.1	-177.9	179.4	0	0	0	0	109.7	Y147 Y148 F198 W199 K217 L220	Y147-V203 HydrophobicContact CD1-CG1 4.28Å; Y147-V203 HydrophobicContact CD1-CG2 3.99Å; Y147-V203 HydrophobicContact CE1-CB 4.46Å; Y147-V203 HydrophobicContact CE1-CG2 3.73Å; Y148-V203 HydrophobicContact CE2-CG1 4.29Å; Y148-V203 HydrophobicContact CE2-CG2 3.79Å; F198-V203 HydrophobicContact CD1-CG2 3.75Å; F198-V203 HydrophobicContact CE1-CG2 3.4Å; F198-V203 HydrophobicContact CZ-CG2 3.95Å; F198-V203 WeakPolarHBondContact O-CG2 3.17Å; F198-V203 PolarHBondContact O-N 2.98Å; W199-V203 HydrophobicContact CE3-CB 4.02Å; W199-V203 HydrophobicContact CE3-CG1 3.84Å; W199-V203 HydrophobicContact CE3-CG2 4.37Å; W199-V203 HydrophobicContact CZ3-CB 4.49Å; W199-V203 HydrophobicContact CZ3-CG1 3.8Å; W199-V203 WeakPolarHBondContact O-CB 3.44Å; V203-K217 WeakPolarHBondContact O-CE 3.45Å; V203-L220 HydrophobicContact CG1-CD1 4.42Å; V203-L220 HydrophobicContact CG1-CD2 4.33Å; V203-L220 WeakPolarHBondContact O-CD1 2.97Å
204	L	95	Very high	93.5	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.042	19%	0.189	C	C	.	.	I	π-helix	trans	-80.5	-44	-179.8	-61.6	-178.3	0	0	0	111.7	W144 W199 I206 M452	W144-L204 HydrophobicContact CZ2-CD2 4.15Å; W199-L204 HydrophobicContact CD2-CD1 4.17Å; W199-L204 HydrophobicContact CD2-CG 4.21Å; W199-L204 HydrophobicContact CH2-CD2 4.12Å; W199-L204 HydrophobicContact CH2-CG 4.42Å; W199-L204 HydrophobicContact CZ2-CD1 3.73Å; W199-L204 HydrophobicContact CZ2-CD2 4.07Å; W199-L204 HydrophobicContact CZ2-CG 4.07Å; W199-L204 WeakPolarHBondContact O-CB 3.23Å; W199-L204 WeakPolarHBondContact O-CG 3.47Å; W199-L204 PolarHBondContact O-N 2.97Å; L204-I206 VanDerWaalsContact C-N 3.29Å; L204-I206 HydrophobicContact CB-CB 4.14Å; L204-I206 HydrophobicContact CD1-CD1 4.36Å; L204-M452 HydrophobicContact CD1-CB 4.13Å; L204-M452 HydrophobicContact CD1-CG 4.1Å; L204-M452 HydrophobicContact CD1-SD 4.35Å
205	G	93.8	Very high	93.8	Very high	13 Å²	13	37.2 Å²	37.2	13%	0.134	21%	0.214	C	C	.	.			trans	59.7	45.5	-165.5	0	0	0	0	0	110.6	E200 H201 K449	E200-G205 CarbonylContact O-C 3.49Å; E200-G205 VanDerWaalsContact O-CA 3.24Å; E200-G205 WeakPolarHBondContact O-CA 3.39Å; E200-G205 PolarHBondContact O-N 3.37Å; H201-G205 WeakPolarHBondContact O-CA 3.35Å; G205-K449 WeakPolarHBondContact O-CB 3.32Å; G205-K449 WeakPolarHBondContact O-CD 3.36Å; G205-K449 WeakPolarHBondContact O-CG 3.43Å
206	I	92.8	Very high	94	Very high	39 Å²	39	39 Å²	39	20%	0.2	23%	0.225	C	C	.	.			trans	-59.7	135.9	-164.1	-163.6	167.9	0	0	0	112	E200 L204 K449 M452 Y453 Y532	E200-I206 HydrophobicContact CB-CG2 3.99Å; E200-I206 HydrophobicContact CG-CG2 4.49Å; E200-I206 PolarHBondContact O-N 3.4Å; L204-I206 VanDerWaalsContact C-N 3.29Å; L204-I206 HydrophobicContact CB-CB 4.14Å; L204-I206 HydrophobicContact CD1-CD1 4.36Å; I206-K449 VanDerWaalsContact CA-O 3.28Å; I206-K449 WeakPolarHBondContact CA-O 3.4Å; I206-M452 HydrophobicContact CD1-CB 4.03Å; I206-M452 HydrophobicContact CD1-CG 4.26Å; I206-Y453 HydrophobicContact CD1-CE2 4.41Å; I206-Y453 HydrophobicContact CG1-CE2 4.1Å; I206-Y532 HydrophobicContact CD1-CE1 3.54Å; I206-Y532 VanDerWaalsContact CD1-OH 3.3Å; I206-Y532 WeakPolarHBondContact CD1-OH 3.45Å
207	S	94.4	Very high	94.3	Very high	20 Å²	20	39 Å²	39	14%	0.14	22%	0.222	C	C	.	.			trans	-84.6	174.5	175.6	65.2	0	0	0	0	112.5	G209 E212 K449 G450 Y453	S207-G209 PolarHBondContact O-N 3.14Å; S207-G209 PolarHBondContact OG-O 2.94Å; S207-G209 VanDerWaalsContact OG-O 3.09Å; S207-E212 WeakPolarHBondContact CB-O 3.43Å; S207-E212 PolarHBondContact OG-O 3.38Å; S207-K449 PolarHBondContact N-O 3.26Å; S207-K449 VanDerWaalsContact N-O 3.12Å; S207-G450 WeakPolarHBondContact OG-CA 3.21Å; S207-G450 PolarHBondContact OG-N 2.92Å; S207-Y453 WeakPolarHBondContact O-CE2 3.37Å; S207-Y453 PolarHBondContact O-OH 3.2Å
208	S	91.6	Very high	94.5	Very high	78 Å²	78	48.5 Å²	48.5	55%	0.545	26%	0.258	S	S	.	.	S	Bend	trans	-65.2	-25.3	-179.6	66.5	0	0	0	0	113.9	E212 Y453	S208-E212 PolarHBondContact OG-OE2 2.89Å; S208-Y453 PolarHBondContact O-OH 3.44Å
209	G	92.6	Very high	94.5	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.01	27%	0.272	C	S	.	.	S	Bend	trans	-177.5	176.4	-175.5	0	0	0	0	0	113.6	S207 E211 E212 Y453 Y536	S207-G209 PolarHBondContact O-N 3.14Å; S207-G209 PolarHBondContact OG-O 2.94Å; S207-G209 VanDerWaalsContact OG-O 3.09Å; G209-E211 PolarHBondContact O-N 3.31Å; G209-E212 CarbonylContact O-C 3.59Å; G209-E212 PolarHBondContact O-N 2.73Å; G209-E212 VanDerWaalsContact O-N 3.13Å; G209-Y453 VanDerWaalsContact C-CD2 3.42Å; G209-Y453 VanDerWaalsContact C-CE2 3.47Å; G209-Y453 VanDerWaalsContact CA-CE2 3.4Å; G209-Y536 VanDerWaalsContact CA-CE2 3.42Å
210	I	94.3	Very high	94.6	Very high	9 Å²	9	51 Å²	51	5%	0.046	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21	178.1	-159.1	175.2	0	0	0	112.6	E212 I213 Y453 V454 Y536 Y538 P539 W541 A542	I210-E212 PolarHBondContact O-N 2.84Å; I210-I213 WeakPolarHBondContact O-CG1 3.28Å; I210-Y453 HydrophobicContact CB-CG 4.32Å; I210-V454 HydrophobicContact CD1-CG2 4.41Å; I210-V454 HydrophobicContact CG1-CG2 4.28Å; I210-Y536 VanDerWaalsContact CG2-OH 3.31Å; I210-Y536 WeakPolarHBondContact CG2-OH 3.03Å; I210-Y536 PolarHBondContact N-OH 2.87Å; I210-Y538 HydrophobicContact CD1-CD1 4.39Å; I210-Y538 HydrophobicContact CD1-CE1 4.18Å; I210-P539 HydrophobicContact CG2-CG 3.81Å; I210-W541 HydrophobicContact CD1-CH2 4.32Å; I210-W541 HydrophobicContact CG1-CH2 4.25Å; I210-W541 HydrophobicContact CG2-CH2 3.81Å; I210-W541 HydrophobicContact CG2-CZ2 3.68Å; I210-A542 HydrophobicContact CD1-CB 4.06Å; I210-A542 HydrophobicContact CG2-CB 4.12Å
211	E	93.9	Very high	94.9	Very high	105 Å²	105	49.4 Å²	49.4	49%	0.491	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.4	174.2	-58.2	87.4	166.3	0	0	111.9	G209 Y536 P539 W541	G209-E211 PolarHBondContact O-N 3.31Å; E211-Y536 PolarHBondContact OE2-OH 3.47Å; E211-P539 VanDerWaalsContact OE1-CG 3.32Å; E211-P539 WeakPolarHBondContact OE1-CG 3.43Å; E211-W541 HydrophobicContact CG-CZ2 4.34Å
212	E	93.6	Very high	95	Very high	115 Å²	115	51.3 Å²	51.3	54%	0.537	28%	0.277	S	S	.	.			trans	-113.2	70.2	-177.5	-65.7	-174.7	174.8	0	0	110.6	S207 S208 G209 I210 G214	S207-E212 WeakPolarHBondContact CB-O 3.43Å; S207-E212 PolarHBondContact OG-O 3.38Å; S208-E212 PolarHBondContact OG-OE2 2.89Å; G209-E212 CarbonylContact O-C 3.59Å; G209-E212 PolarHBondContact O-N 2.73Å; G209-E212 VanDerWaalsContact O-N 3.13Å; I210-E212 PolarHBondContact O-N 2.84Å; E212-G214 PolarHBondContact O-N 2.82Å
213	I	90.6	Very high	95.2	Very high	80 Å²	80	50.2 Å²	50.2	41%	0.41	27%	0.272	S	S	.	.			trans	-58.2	-36.2	-178.9	-70	178.7	0	0	0	112.4	I210 T448 K449 G450	I210-I213 WeakPolarHBondContact O-CG1 3.28Å; I213-T448 HydrophobicContact CG2-CG2 3.69Å; I213-T448 WeakPolarHBondContact CG2-OG1 2.95Å; I213-T448 WeakPolarHBondContact O-CB 3.24Å; I213-K449 PolarHBondContact O-N 2.94Å; I213-G450 PolarHBondContact O-N 3.06Å
214	G	93.9	Very high	95.3	Very high	46 Å²	46	50.2 Å²	50.2	47%	0.474	27%	0.272	S	S	.	.			trans	64.3	-172.8	-178.5	0	0	0	0	0	114	E212	E212-G214 PolarHBondContact O-N 2.82Å
215	P	96.2	Very high	95.5	Very high	81 Å²	81	53.3 Å²	53.3	53%	0.526	29%	0.288	S	S	.	.			trans	-74.5	160.6	-179.3	31.1	-35.8	0	0	0	112.5	T448 K449	P215-T448 WeakPolarHBondContact O-CA 3.21Å; P215-K449 HydrophobicContact CG-CD 4.29Å; P215-K449 HydrophobicContact CG-CG 4.41Å; P215-K449 PolarHBondContact O-N 3.43Å
216	V	97.4	Very high	95.7	Very high	40 Å²	40	56 Å²	56	24%	0.242	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-66.5	133.5	169.9	178.2	0	0	0	0	110	W218 A221 L444 T448	V216-W218 PolarHBondContact O-N 3.26Å; V216-A221 HydrophobicContact CG1-CB 3.88Å; V216-L444 HydrophobicContact CG1-CD2 4.29Å; V216-T448 HydrophobicContact CG2-CG2 3.89Å
217	K	97.3	Very high	95.9	Very high	31 Å²	31	54.4 Å²	54.4	14%	0.135	29%	0.291	C	S	.	.			trans	-77.4	96.9	170.8	-75.9	-85.3	-79.1	136.2	0	109.1	N202 V203 D219 L220 A221 V447	N202-K217 VanDerWaalsContact O-CE 3.23Å; N202-K217 WeakPolarHBondContact O-CE 3.46Å; N202-K217 PolarHBondContact O-NZ 3.28Å; V203-K217 WeakPolarHBondContact O-CE 3.45Å; K217-D219 VanDerWaalsContact C-N 3.27Å; K217-D219 IonicContact NZ-OD1 3.59Å; K217-D219 PolarHBondContact NZ-OD1 2.99Å; K217-D219 VanDerWaalsContact NZ-OD1 3.14Å; K217-D219 IonicContact NZ-OD2 2.79Å; K217-D219 PolarHBondContact NZ-OD2 3.42Å; K217-D219 PolarHBondContact O-N 2.89Å; K217-L220 HydrophobicContact CB-CB 4.18Å; K217-L220 HydrophobicContact CB-CD1 4.27Å; K217-L220 HydrophobicContact CB-CG 4.42Å; K217-L220 PolarHBondContact O-N 3.34Å; K217-L220 VanDerWaalsContact O-N 3.14Å; K217-A221 PolarHBondContact O-N 2.88Å; K217-V447 HydrophobicContact CB-CG1 4.44Å; K217-V447 WeakPolarHBondContact CB-O 3.48Å; K217-V447 PolarHBondContact N-O 3.13Å
218	W	96.8	Very high	96.1	Very high	201 Å²	201	53.8 Å²	53.8	76%	0.761	29%	0.285	S	S	*	.	H	α-helix	trans	-56.4	-37.5	-172.4	-62.8	108.5	0	0	0	114.2	V216 A221 L222	V216-W218 PolarHBondContact O-N 3.26Å; W218-A221 PolarHBondContact O-N 3.2Å; W218-L222 WeakPolarHBondContact O-CG 3.27Å; W218-L222 PolarHBondContact O-N 2.62Å
219	D	96.3	Very high	96.4	Very high	54 Å²	54	52.9 Å²	52.9	29%	0.289	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-45.9	176.8	52.5	-21.1	0	0	0	112.1	Y147 K217 L222 C223	Y147-D219 HydrophobicContact CE2-CB 4.02Å; Y147-D219 VanDerWaalsContact CE2-OD2 3.26Å; Y147-D219 WeakPolarHBondContact CE2-OD2 3.31Å; Y147-D219 PolarHBondContact OH-OD2 3.42Å; K217-D219 VanDerWaalsContact C-N 3.27Å; K217-D219 IonicContact NZ-OD1 3.59Å; K217-D219 PolarHBondContact NZ-OD1 2.99Å; K217-D219 VanDerWaalsContact NZ-OD1 3.14Å; K217-D219 IonicContact NZ-OD2 2.79Å; K217-D219 PolarHBondContact NZ-OD2 3.42Å; K217-D219 PolarHBondContact O-N 2.89Å; D219-L222 PolarHBondContact O-N 2.8Å; D219-C223 PolarHBondContact O-N 2.82Å; D219-C223 PolarHBondContact O-SG 3.1Å
220	L	97.3	Very high	96.6	Very high	4 Å²	4	56 Å²	56	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-34.4	173.5	-73.8	-176.8	0	0	0	112.5	Y147 V203 K217 L222 C223 L224 V447	Y147-L220 HydrophobicContact CD2-CD2 3.78Å; Y147-L220 HydrophobicContact CG-CD2 3.79Å; V203-L220 HydrophobicContact CG1-CD1 4.42Å; V203-L220 HydrophobicContact CG1-CD2 4.33Å; V203-L220 WeakPolarHBondContact O-CD1 2.97Å; K217-L220 HydrophobicContact CB-CB 4.18Å; K217-L220 HydrophobicContact CB-CD1 4.27Å; K217-L220 HydrophobicContact CB-CG 4.42Å; K217-L220 PolarHBondContact O-N 3.34Å; K217-L220 VanDerWaalsContact O-N 3.14Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 3.29Å; L220-C223 WeakPolarHBondContact O-CB 3.31Å; L220-C223 PolarHBondContact O-N 2.82Å; L220-C223 VanDerWaalsContact O-N 3.15Å; L220-L224 WeakPolarHBondContact O-CB 3.23Å; L220-L224 PolarHBondContact O-N 2.74Å; L220-V447 HydrophobicContact CB-CG1 3.18Å; L220-V447 HydrophobicContact CD1-CG1 4.21Å; L220-V447 HydrophobicContact CG-CG1 4.35Å
221	A	98.2	Very high	96.7	Very high	4 Å²	4	55.6 Å²	55.6	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-37.9	176.6	0	0	0	0	0	111.6	V216 K217 W218 L224 L225 L444 V447	V216-A221 HydrophobicContact CG1-CB 3.88Å; K217-A221 PolarHBondContact O-N 2.88Å; W218-A221 PolarHBondContact O-N 3.2Å; A221-L224 PolarHBondContact O-N 2.84Å; A221-L225 WeakPolarHBondContact O-CB 3.2Å; A221-L225 PolarHBondContact O-N 3.3Å; A221-L444 HydrophobicContact CB-CD2 3.75Å; A221-V447 HydrophobicContact CB-CG1 4.42Å
222	L	98.3	Very high	96.8	Very high	119 Å²	119	52.4 Å²	52.4	62%	0.623	28%	0.275	S	S	*	.	H	α-helix	trans	-66.9	-39.6	172.5	-70.4	174.8	0	0	0	112.3	W218 D219 L220 L224 L225 L226	W218-L222 WeakPolarHBondContact O-CG 3.27Å; W218-L222 PolarHBondContact O-N 2.62Å; D219-L222 PolarHBondContact O-N 2.8Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 3.29Å; L222-L224 VanDerWaalsContact C-N 3.35Å; L222-L225 PolarHBondContact O-N 2.92Å; L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 PolarHBondContact O-N 3.26Å
223	C	98.4	Very high	96.9	Very high	7 Å²	7	51.6 Å²	51.6	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-44.9	173.8	-63.9	0	0	0	0	110.8	A143 L146 D219 L220 L225 L226 V227	A143-C223 HydrophobicContact CB-CB 4.2Å; L146-C223 HydrophobicContact CB-CB 4.47Å; L146-C223 HydrophobicContact CD2-CB 4.33Å; D219-C223 PolarHBondContact O-N 2.82Å; D219-C223 PolarHBondContact O-SG 3.1Å; L220-C223 WeakPolarHBondContact O-CB 3.31Å; L220-C223 PolarHBondContact O-N 2.82Å; L220-C223 VanDerWaalsContact O-N 3.15Å; C223-L225 PolarHBondContact O-N 2.87Å; C223-L226 PolarHBondContact O-N 3.31Å; C223-V227 WeakPolarHBondContact O-CG2 3.45Å; C223-V227 PolarHBondContact O-N 3.41Å
224	L	98.5	Very high	97.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-45.4	176.2	-178.7	68	0	0	0	111.6	I139 V140 A143 L220 A221 L222 L226 V227 W228 Y440 L444 V447	I139-L224 HydrophobicContact CG2-CD1 3.73Å; V140-L224 HydrophobicContact CG2-CD1 4.34Å; A143-L224 HydrophobicContact CB-CB 3.96Å; A143-L224 HydrophobicContact CB-CD1 4.21Å; L220-L224 WeakPolarHBondContact O-CB 3.23Å; L220-L224 PolarHBondContact O-N 2.74Å; A221-L224 PolarHBondContact O-N 2.84Å; L222-L224 VanDerWaalsContact C-N 3.35Å; L224-L226 PolarHBondContact O-N 3.04Å; L224-V227 PolarHBondContact O-N 3.19Å; L224-W228 PolarHBondContact O-N 3.44Å; L224-Y440 HydrophobicContact CB-CE2 4.33Å; L224-Y440 HydrophobicContact CD2-CD2 3.86Å; L224-Y440 HydrophobicContact CD2-CE2 4.05Å; L224-Y440 HydrophobicContact CG-CD2 3.89Å; L224-Y440 HydrophobicContact CG-CE2 4.14Å; L224-L444 HydrophobicContact CD2-CD2 4.46Å; L224-V447 HydrophobicContact CD2-CG2 3.91Å
225	L	98.6	Very high	97.1	Very high	73 Å²	73	46 Å²	46	38%	0.382	23%	0.23	S	C	.	.	H	α-helix	trans	-59.9	-46.5	176.3	-179.2	62.9	0	0	0	111.1	A221 L222 C223 V227 W228 V229 Y440	A221-L225 WeakPolarHBondContact O-CB 3.2Å; A221-L225 PolarHBondContact O-N 3.3Å; L222-L225 PolarHBondContact O-N 2.92Å; C223-L225 PolarHBondContact O-N 2.87Å; L225-V227 PolarHBondContact O-N 3.34Å; L225-W228 PolarHBondContact O-N 3.46Å; L225-V229 VanDerWaalsContact O-CG2 3.32Å; L225-V229 WeakPolarHBondContact O-CG2 3.17Å; L225-V229 PolarHBondContact O-N 2.86Å; L225-Y440 HydrophobicContact CB-CD2 4.29Å; L225-Y440 HydrophobicContact CB-CE2 3.65Å; L225-Y440 HydrophobicContact CD1-CD2 4.31Å; L225-Y440 HydrophobicContact CD1-CE1 4.46Å; L225-Y440 HydrophobicContact CD1-CE2 4.16Å; L225-Y440 HydrophobicContact CG-CE2 4.48Å
226	L	98.4	Very high	96.9	Very high	70 Å²	70	46.2 Å²	46.2	37%	0.366	22%	0.22	S	C	.	.	H	α-helix	trans	-62.7	-42	-179.5	-179.9	52.6	0	0	0	111.8	L146 F150 L222 C223 L224 V229 I230	L146-L226 HydrophobicContact CD2-CB 4.04Å; L146-L226 HydrophobicContact CD2-CD2 3.81Å; L146-L226 HydrophobicContact CD2-CG 3.9Å; F150-L226 HydrophobicContact CE2-CD2 4.34Å; F150-L226 HydrophobicContact CZ-CD2 3.85Å; L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 PolarHBondContact O-N 3.26Å; C223-L226 PolarHBondContact O-N 3.31Å; L224-L226 PolarHBondContact O-N 3.04Å; L226-V229 PolarHBondContact O-N 3.22Å; L226-I230 HydrophobicContact CD1-CD1 4.31Å; L226-I230 HydrophobicContact CD1-CG1 4.37Å; L226-I230 HydrophobicContact CG-CD1 4.21Å; L226-I230 VanDerWaalsContact O-CG1 3.31Å; L226-I230 WeakPolarHBondContact O-CG1 3.47Å; L226-I230 PolarHBondContact O-N 3.14Å
227	V	97.9	Very high	96.4	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-41.8	175.9	179.6	0	0	0	0	111.5	I139 L142 L146 C223 L224 L225 V229 I230 C231	I139-V227 HydrophobicContact CD1-CB 4.48Å; I139-V227 HydrophobicContact CD1-CG1 3.81Å; I139-V227 HydrophobicContact CG1-CB 4.32Å; I139-V227 HydrophobicContact CG1-CG1 3.5Å; L142-V227 HydrophobicContact CB-CB 4.46Å; L142-V227 HydrophobicContact CB-CG1 3.64Å; L142-V227 HydrophobicContact CB-CG2 4.07Å; L142-V227 HydrophobicContact CD2-CG1 3.74Å; L142-V227 HydrophobicContact CG-CG1 4.32Å; L146-V227 HydrophobicContact CB-CG2 4.26Å; L146-V227 HydrophobicContact CD2-CG2 3.68Å; C223-V227 WeakPolarHBondContact O-CG2 3.45Å; C223-V227 PolarHBondContact O-N 3.41Å; L224-V227 PolarHBondContact O-N 3.19Å; L225-V227 PolarHBondContact O-N 3.34Å; V227-V229 VanDerWaalsContact C-N 3.32Å; V227-V229 PolarHBondContact O-N 3.08Å; V227-I230 PolarHBondContact O-N 2.98Å; V227-C231 WeakPolarHBondContact O-CB 3.35Å; V227-C231 PolarHBondContact O-N 3.32Å
228	W	98.1	Very high	96	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.027	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-39.2	174.4	-89	112.6	0	0	0	112.8	I139 L224 L225 C231 F232 V407 C436 S439	I139-W228 HydrophobicContact CB-CZ2 4.38Å; I139-W228 HydrophobicContact CD1-CB 4.46Å; I139-W228 HydrophobicContact CD1-CD2 3.36Å; I139-W228 HydrophobicContact CD1-CE3 3.74Å; I139-W228 HydrophobicContact CD1-CG 3.7Å; I139-W228 HydrophobicContact CD1-CH2 4.13Å; I139-W228 HydrophobicContact CD1-CZ2 3.76Å; I139-W228 HydrophobicContact CD1-CZ3 4.12Å; I139-W228 HydrophobicContact CG2-CZ2 3.73Å; L224-W228 PolarHBondContact O-N 3.44Å; L225-W228 PolarHBondContact O-N 3.46Å; W228-C231 PolarHBondContact O-N 3.1Å; W228-F232 WeakPolarHBondContact O-CB 3.36Å; W228-F232 PolarHBondContact O-N 3.21Å; W228-V407 HydrophobicContact CH2-CG2 4.36Å; W228-V407 HydrophobicContact CZ3-CG2 4.18Å; W228-C436 HydrophobicContact CD2-CB 4.29Å; W228-C436 HydrophobicContact CE3-CB 3.6Å; W228-C436 VanDerWaalsContact CE3-SG 3.55Å; W228-C436 HydrophobicContact CZ3-CB 4.08Å; W228-S439 VanDerWaalsContact CH2-CB 3.45Å
229	V	97.9	Very high	95.5	Very high	60 Å²	60	38.7 Å²	38.7	36%	0.364	19%	0.19	S	C	.	.	H	α-helix	trans	-63.6	-44.1	175.2	170.5	0	0	0	0	110.9	L225 L226 V227 F232 F233	L225-V229 VanDerWaalsContact O-CG2 3.32Å; L225-V229 WeakPolarHBondContact O-CG2 3.17Å; L225-V229 PolarHBondContact O-N 2.86Å; L226-V229 PolarHBondContact O-N 3.22Å; V227-V229 VanDerWaalsContact C-N 3.32Å; V227-V229 PolarHBondContact O-N 3.08Å; V229-F232 WeakPolarHBondContact O-CB 3.46Å; V229-F232 PolarHBondContact O-N 3.07Å; V229-F233 HydrophobicContact CG1-CD2 3.84Å; V229-F233 HydrophobicContact CG1-CE2 3.54Å; V229-F233 WeakPolarHBondContact O-CD2 3.48Å; V229-F233 PolarHBondContact O-N 3.01Å; V229-F233 VanDerWaalsContact O-N 3.16Å
230	I	96.8	Very high	95	Very high	66 Å²	66	41 Å²	41	34%	0.338	20%	0.198	S	C	.	.	H	α-helix	trans	-60.4	-50.2	174.9	-65.7	165.5	0	0	0	109.9	L226 V227 F232 F233 C234 L400	L226-I230 HydrophobicContact CD1-CD1 4.31Å; L226-I230 HydrophobicContact CD1-CG1 4.37Å; L226-I230 HydrophobicContact CG-CD1 4.21Å; L226-I230 VanDerWaalsContact O-CG1 3.31Å; L226-I230 WeakPolarHBondContact O-CG1 3.47Å; L226-I230 PolarHBondContact O-N 3.14Å; V227-I230 PolarHBondContact O-N 2.98Å; I230-F232 VanDerWaalsContact C-N 3.3Å; I230-F232 PolarHBondContact O-N 3.42Å; I230-F233 PolarHBondContact O-N 2.91Å; I230-F233 VanDerWaalsContact O-N 3.13Å; I230-C234 PolarHBondContact O-N 2.98Å; I230-C234 PolarHBondContact O-SG 3.48Å; I230-L400 HydrophobicContact CG2-CD1 3.83Å; I230-L400 HydrophobicContact CG2-CD2 3.75Å; I230-L400 HydrophobicContact CG2-CG 4.46Å
231	C	96.6	Very high	94.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.5	-43.2	178.6	-173.7	0	0	0	0	112	V227 W228 F233 C234 I235	V227-C231 WeakPolarHBondContact O-CB 3.35Å; V227-C231 PolarHBondContact O-N 3.32Å; W228-C231 PolarHBondContact O-N 3.1Å; C231-F233 PolarHBondContact O-N 2.89Å; C231-C234 WeakPolarHBondContact O-CB 3.3Å; C231-C234 PolarHBondContact O-N 3.25Å; C231-I235 WeakPolarHBondContact O-CG1 3.34Å; C231-I235 PolarHBondContact O-N 3.45Å
232	F	96.4	Very high	94.2	Very high	38 Å²	38	41.4 Å²	41.4	17%	0.167	20%	0.201	C	C	.	.	H	α-helix	trans	-56.3	-50.2	175.3	171.2	-96	0	0	0	111.6	W228 V229 I230 C234 I235 W236 E429 I432 A433	W228-F232 WeakPolarHBondContact O-CB 3.36Å; W228-F232 PolarHBondContact O-N 3.21Å; V229-F232 WeakPolarHBondContact O-CB 3.46Å; V229-F232 PolarHBondContact O-N 3.07Å; I230-F232 VanDerWaalsContact C-N 3.3Å; I230-F232 PolarHBondContact O-N 3.42Å; F232-C234 VanDerWaalsContact C-N 3.27Å; F232-C234 PolarHBondContact O-N 3.49Å; F232-I235 PolarHBondContact O-N 2.96Å; F232-I235 VanDerWaalsContact O-N 3.17Å; F232-W236 HydrophobicContact CE1-CB 4.17Å; F232-W236 HydrophobicContact CE1-CE3 4.11Å; F232-W236 HydrophobicContact CE2-CB 4.46Å; F232-W236 HydrophobicContact CZ-CB 4.1Å; F232-W236 WeakPolarHBondContact O-CB 3.42Å; F232-W236 PolarHBondContact O-N 3.35Å; F232-E429 WeakPolarHBondContact CE2-O 3.42Å; F232-I432 HydrophobicContact CD2-CB 4.33Å; F232-I432 HydrophobicContact CD2-CG2 3.73Å; F232-I432 HydrophobicContact CE2-CB 4.26Å; F232-I432 HydrophobicContact CE2-CG2 4.15Å; F232-A433 HydrophobicContact CD2-CB 4.27Å; F232-A433 HydrophobicContact CE2-CB 3.79Å; F232-A433 HydrophobicContact CZ-CB 4.49Å
233	F	95.4	Very high	93.6	Very high	98 Å²	98	35.8 Å²	35.8	43%	0.43	17%	0.172	S	C	.	.	H	α-helix	trans	-68.5	-23.9	179.6	-72.3	-61.3	0	0	0	113.5	V229 I230 C231 I235 W236 S241	V229-F233 HydrophobicContact CG1-CD2 3.84Å; V229-F233 HydrophobicContact CG1-CE2 3.54Å; V229-F233 WeakPolarHBondContact O-CD2 3.48Å; V229-F233 PolarHBondContact O-N 3.01Å; V229-F233 VanDerWaalsContact O-N 3.16Å; I230-F233 PolarHBondContact O-N 2.91Å; I230-F233 VanDerWaalsContact O-N 3.13Å; C231-F233 PolarHBondContact O-N 2.89Å; F233-I235 VanDerWaalsContact C-N 3.33Å; F233-W236 AromaticContact CD1-CD2 3.88Å; F233-W236 HydrophobicContact CD1-CD2 3.88Å; F233-W236 AromaticContact CD1-CE3 3.67Å; F233-W236 HydrophobicContact CD1-CE3 3.67Å; F233-W236 AromaticContact CD1-CH2 3.91Å; F233-W236 HydrophobicContact CD1-CH2 3.91Å; F233-W236 HydrophobicContact CD1-CZ2 4.11Å; F233-W236 AromaticContact CD1-CZ3 3.69Å; F233-W236 HydrophobicContact CD1-CZ3 3.69Å; F233-W236 HydrophobicContact CE1-CD2 4.5Å; F233-W236 AromaticContact CE1-CE3 3.83Å; F233-W236 HydrophobicContact CE1-CE3 3.83Å; F233-W236 AromaticContact CE1-CH2 3.99Å; F233-W236 HydrophobicContact CE1-CH2 3.99Å; F233-W236 AromaticContact CE1-CZ3 3.55Å; F233-W236 HydrophobicContact CE1-CZ3 3.55Å; F233-W236 PolarHBondContact O-NE1 3.45Å; F233-W236 VanDerWaalsContact O-NE1 3.16Å; F233-S241 PolarHBondContact O-OG 3.29Å
234	C	94.4	Very high	93.3	Very high	8 Å²	8	43 Å²	43	5%	0.054	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-38.4	171.8	-64.4	0	0	0	0	111.7	I230 C231 F232 S241 T242 F404	I230-C234 PolarHBondContact O-N 2.98Å; I230-C234 PolarHBondContact O-SG 3.48Å; C231-C234 WeakPolarHBondContact O-CB 3.3Å; C231-C234 PolarHBondContact O-N 3.25Å; F232-C234 VanDerWaalsContact C-N 3.27Å; F232-C234 PolarHBondContact O-N 3.49Å; C234-S241 CarbonylContact O-C 3.58Å; C234-S241 WeakPolarHBondContact O-CB 3.06Å; C234-S241 PolarHBondContact O-OG 2.93Å; C234-T242 PolarHBondContact O-N 3.32Å; C234-F404 HydrophobicContact CB-CB 4.1Å; C234-F404 HydrophobicContact CB-CD1 3.82Å; C234-F404 HydrophobicContact CB-CG 4.1Å
235	I	93.7	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-112.3	-8.7	-170	67.5	178.2	0	0	0	116	C231 F232 F233 K237 G238 F404 V407 E408 R428 I432	C231-I235 WeakPolarHBondContact O-CG1 3.34Å; C231-I235 PolarHBondContact O-N 3.45Å; F232-I235 PolarHBondContact O-N 2.96Å; F232-I235 VanDerWaalsContact O-N 3.17Å; F233-I235 VanDerWaalsContact C-N 3.33Å; I235-K237 PolarHBondContact O-N 2.95Å; I235-G238 WeakPolarHBondContact O-CA 3.42Å; I235-G238 PolarHBondContact O-N 3.37Å; I235-F404 HydrophobicContact CG2-CB 3.62Å; I235-F404 HydrophobicContact CG2-CG 4.35Å; I235-V407 HydrophobicContact CD1-CB 4.05Å; I235-V407 HydrophobicContact CD1-CG1 3.35Å; I235-E408 HydrophobicContact CG2-CB 4.33Å; I235-R428 PolarHBondContact O-NH1 3.17Å; I235-I432 HydrophobicContact CD1-CG2 3.57Å; I235-I432 HydrophobicContact CG1-CD1 4.39Å; I235-I432 HydrophobicContact CG1-CG2 3.88Å
236	W	91.5	Very high	92.7	Very high	86 Å²	86	41.4 Å²	41.4	33%	0.326	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-36.4	-173.4	67.4	-27.4	0	0	0	114.5	F232 F233 R428 E429	F232-W236 HydrophobicContact CE1-CB 4.17Å; F232-W236 HydrophobicContact CE1-CE3 4.11Å; F232-W236 HydrophobicContact CE2-CB 4.46Å; F232-W236 HydrophobicContact CZ-CB 4.1Å; F232-W236 WeakPolarHBondContact O-CB 3.42Å; F232-W236 PolarHBondContact O-N 3.35Å; F233-W236 AromaticContact CD1-CD2 3.88Å; F233-W236 HydrophobicContact CD1-CD2 3.88Å; F233-W236 AromaticContact CD1-CE3 3.67Å; F233-W236 HydrophobicContact CD1-CE3 3.67Å; F233-W236 AromaticContact CD1-CH2 3.91Å; F233-W236 HydrophobicContact CD1-CH2 3.91Å; F233-W236 HydrophobicContact CD1-CZ2 4.11Å; F233-W236 AromaticContact CD1-CZ3 3.69Å; F233-W236 HydrophobicContact CD1-CZ3 3.69Å; F233-W236 HydrophobicContact CE1-CD2 4.5Å; F233-W236 AromaticContact CE1-CE3 3.83Å; F233-W236 HydrophobicContact CE1-CE3 3.83Å; F233-W236 AromaticContact CE1-CH2 3.99Å; F233-W236 HydrophobicContact CE1-CH2 3.99Å; F233-W236 AromaticContact CE1-CZ3 3.55Å; F233-W236 HydrophobicContact CE1-CZ3 3.55Å; F233-W236 PolarHBondContact O-NE1 3.45Å; F233-W236 VanDerWaalsContact O-NE1 3.16Å; W236-R428 PolarHBondContact O-NH1 2.82Å; W236-E429 WeakPolarHBondContact O-CG 3.47Å
237	K	88.6	Confident	92.4	Very high	110 Å²	110	42.4 Å²	42.4	48%	0.478	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	21.9	175.9	-56.5	176.6	179.4	178.8	0	113.4	I235	I235-K237 PolarHBondContact O-N 2.95Å
238	G	87.8	Confident	92.1	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-149.9	-179.5	0	0	0	0	0	113	I235 K240 S241 T242 R428	I235-G238 WeakPolarHBondContact O-CA 3.42Å; I235-G238 PolarHBondContact O-N 3.37Å; G238-K240 PolarHBondContact O-N 3.45Å; G238-S241 PolarHBondContact O-N 3.29Å; G238-T242 PolarHBondContact O-N 3.27Å; G238-T242 VanDerWaalsContact O-N 3.08Å; G238-T242 PolarHBondContact O-OG1 2.88Å; G238-R428 VanDerWaalsContact CA-NH2 3.26Å
239	V	86.1	Confident	91.9	Very high	3 Å²	3	48 Å²	48	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-54.5	-21.1	-176.7	-64.7	0	0	0	0	114.8	E42 W44 G243 Y315	E42-V239 HydrophobicContact CB-CG2 4.34Å; W44-V239 HydrophobicContact CD2-CB 4.4Å; W44-V239 HydrophobicContact CE3-CB 3.88Å; W44-V239 HydrophobicContact CE3-CG1 4.37Å; W44-V239 HydrophobicContact CH2-CB 3.85Å; W44-V239 HydrophobicContact CH2-CG1 3.58Å; W44-V239 HydrophobicContact CZ2-CB 4.36Å; W44-V239 HydrophobicContact CZ2-CG1 3.81Å; W44-V239 HydrophobicContact CZ3-CB 3.59Å; W44-V239 HydrophobicContact CZ3-CG1 3.89Å; V239-G243 WeakPolarHBondContact O-CA 3.34Å; V239-G243 PolarHBondContact O-N 3.12Å; V239-Y315 HydrophobicContact CG1-CD1 4.06Å; V239-Y315 HydrophobicContact CG1-CD2 3.45Å; V239-Y315 VanDerWaalsContact CG1-CD2 3.45Å; V239-Y315 HydrophobicContact CG1-CE1 4.17Å; V239-Y315 HydrophobicContact CG1-CE2 3.58Å; V239-Y315 HydrophobicContact CG1-CG 3.71Å; V239-Y315 HydrophobicContact CG2-CD1 4.26Å; V239-Y315 HydrophobicContact CG2-CG 4.48Å
240	K	86.8	Confident	91.6	Very high	102 Å²	102	45.2 Å²	45.2	44%	0.443	21%	0.208	S	C	.	.	H	α-helix	trans	-71.8	-32	174.2	-70.1	171	177.7	156.7	0	113.7	E42 G238 K244	E42-K240 WeakPolarHBondContact OE1-CE 3.43Å; E42-K240 IonicContact OE1-NZ 2.76Å; E42-K240 PolarHBondContact OE1-NZ 3.15Å; G238-K240 PolarHBondContact O-N 3.45Å; K240-K244 WeakPolarHBondContact O-CG 3.35Å
241	S	88.7	Confident	91.3	Very high	17 Å²	17	45 Å²	45	12%	0.119	21%	0.209	C	C	.	.	H	α-helix	trans	-84.1	-50.7	174.3	-173.5	0	0	0	0	109.7	F233 C234 G238 G243 K244 V245	F233-S241 PolarHBondContact O-OG 3.29Å; C234-S241 CarbonylContact O-C 3.58Å; C234-S241 WeakPolarHBondContact O-CB 3.06Å; C234-S241 PolarHBondContact O-OG 2.93Å; G238-S241 PolarHBondContact O-N 3.29Å; S241-G243 VanDerWaalsContact C-N 3.33Å; S241-G243 PolarHBondContact O-N 3.15Å; S241-K244 PolarHBondContact O-N 3.08Å; S241-V245 WeakPolarHBondContact O-CG2 3.37Å; S241-V245 PolarHBondContact O-N 3.15Å; S241-V245 VanDerWaalsContact O-N 3.08Å
242	T	88.8	Confident	91.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-51.4	-52.3	177.6	-51.4	0	0	0	0	111	C234 G238 K244 V245 V246 F404	C234-T242 PolarHBondContact O-N 3.32Å; G238-T242 PolarHBondContact O-N 3.27Å; G238-T242 VanDerWaalsContact O-N 3.08Å; G238-T242 PolarHBondContact O-OG1 2.88Å; T242-K244 PolarHBondContact O-N 3.29Å; T242-V245 PolarHBondContact O-N 3.32Å; T242-V246 HydrophobicContact CG2-CG1 4.42Å; T242-V246 VanDerWaalsContact O-CG1 3.26Å; T242-V246 WeakPolarHBondContact O-CG1 3.2Å; T242-V246 WeakPolarHBondContact O-CG2 3.18Å; T242-V246 PolarHBondContact O-N 3.2Å; T242-V246 VanDerWaalsContact O-N 3.16Å; T242-F404 HydrophobicContact CG2-CD2 3.67Å; T242-F404 HydrophobicContact CG2-CE2 3.44Å; T242-F404 VanDerWaalsContact CG2-CE2 3.44Å; T242-F404 HydrophobicContact CG2-CZ 4.44Å
243	G	86.9	Confident	90.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-15.2	-179.7	0	0	0	0	0	114.9	V239 S241 V246 Y247	V239-G243 WeakPolarHBondContact O-CA 3.34Å; V239-G243 PolarHBondContact O-N 3.12Å; S241-G243 VanDerWaalsContact C-N 3.33Å; S241-G243 PolarHBondContact O-N 3.15Å; G243-V246 VanDerWaalsContact O-CG2 3.3Å; G243-V246 WeakPolarHBondContact O-CG2 2.94Å; G243-Y247 WeakPolarHBondContact O-CD2 3.48Å; G243-Y247 WeakPolarHBondContact O-CE2 3.09Å
244	K	90.6	Very high	90.7	Very high	160 Å²	160	43.8 Å²	43.8	70%	0.696	20%	0.204	S	C	*	.	H	α-helix	trans	-94.7	-40.4	174.5	-68.4	-179.8	-177.5	-175.9	0	112.6	K240 S241 T242 V246 Y247	K240-K244 WeakPolarHBondContact O-CG 3.35Å; S241-K244 PolarHBondContact O-N 3.08Å; T242-K244 PolarHBondContact O-N 3.29Å; K244-V246 VanDerWaalsContact C-N 3.31Å; K244-V246 PolarHBondContact O-N 3.49Å; K244-Y247 PolarHBondContact O-N 3.34Å
245	V	92.5	Very high	90.6	Very high	39 Å²	39	47.5 Å²	47.5	24%	0.236	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-41.4	-179	174.3	0	0	0	0	110.4	S241 T242 Y247 I248 T249 F404	S241-V245 WeakPolarHBondContact O-CG2 3.37Å; S241-V245 PolarHBondContact O-N 3.15Å; S241-V245 VanDerWaalsContact O-N 3.08Å; T242-V245 PolarHBondContact O-N 3.32Å; V245-Y247 PolarHBondContact O-N 2.95Å; V245-I248 PolarHBondContact O-N 3.33Å; V245-T249 HydrophobicContact CG1-CG2 3.49Å; V245-T249 VanDerWaalsContact CG1-CG2 3.49Å; V245-T249 PolarHBondContact O-N 3.45Å; V245-T249 VanDerWaalsContact O-N 3.17Å; V245-T249 PolarHBondContact O-OG1 2.92Å; V245-T249 VanDerWaalsContact O-OG1 3.11Å; V245-F404 HydrophobicContact CG1-CE1 4.23Å
246	V	92.8	Very high	90.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-54.8	-24	-180	-64.4	0	0	0	0	114.5	L52 T242 G243 K244 I248 T249 A250 F404	L52-V246 HydrophobicContact CB-CB 4.2Å; L52-V246 HydrophobicContact CB-CG2 3.89Å; T242-V246 HydrophobicContact CG2-CG1 4.42Å; T242-V246 VanDerWaalsContact O-CG1 3.26Å; T242-V246 WeakPolarHBondContact O-CG1 3.2Å; T242-V246 WeakPolarHBondContact O-CG2 3.18Å; T242-V246 PolarHBondContact O-N 3.2Å; T242-V246 VanDerWaalsContact O-N 3.16Å; G243-V246 VanDerWaalsContact O-CG2 3.3Å; G243-V246 WeakPolarHBondContact O-CG2 2.94Å; K244-V246 VanDerWaalsContact C-N 3.31Å; K244-V246 PolarHBondContact O-N 3.49Å; V246-I248 PolarHBondContact O-N 3.24Å; V246-T249 VanDerWaalsContact CA-OG1 3.26Å; V246-T249 WeakPolarHBondContact CA-OG1 3.18Å; V246-A250 WeakPolarHBondContact O-CB 3.19Å; V246-A250 PolarHBondContact O-N 2.96Å; V246-F404 HydrophobicContact CG1-CE2 3.76Å; V246-F404 HydrophobicContact CG1-CZ 3.49Å; V246-F404 VanDerWaalsContact CG1-CZ 3.49Å
247	Y	92.4	Very high	90.5	Very high	91 Å²	91	44.2 Å²	44.2	36%	0.357	22%	0.215	S	C	.	.	H	α-helix	trans	-64.4	-30.6	177.8	-81.1	-99.3	0	0	0	112.7	L48 D49 L52 G243 K244 V245 T251	L48-Y247 HydrophobicContact CD2-CD1 4.12Å; L48-Y247 HydrophobicContact CD2-CE1 3.18Å; L48-Y247 VanDerWaalsContact CD2-CZ 3.43Å; L48-Y247 VanDerWaalsContact CD2-OH 3.28Å; L48-Y247 WeakPolarHBondContact CD2-OH 3.48Å; D49-Y247 WeakPolarHBondContact OD1-CE2 3.33Å; D49-Y247 PolarHBondContact OD1-OH 3.32Å; L52-Y247 HydrophobicContact CD1-CD1 4.02Å; L52-Y247 HydrophobicContact CD1-CD2 4.4Å; L52-Y247 HydrophobicContact CD1-CE1 4.16Å; L52-Y247 HydrophobicContact CD1-CE2 4.5Å; L52-Y247 HydrophobicContact CD1-CG 4.16Å; G243-Y247 WeakPolarHBondContact O-CD2 3.48Å; G243-Y247 WeakPolarHBondContact O-CE2 3.09Å; K244-Y247 PolarHBondContact O-N 3.34Å; V245-Y247 PolarHBondContact O-N 2.95Å; Y247-T251 WeakPolarHBondContact O-CB 3.44Å; Y247-T251 WeakPolarHBondContact O-CG2 3.32Å; Y247-T251 PolarHBondContact O-OG1 2.84Å
248	I	91.8	Very high	90.7	Very high	119 Å²	119	43.7 Å²	43.7	61%	0.61	22%	0.216	S	C	*	.	H	α-helix	trans	-94.5	-50.1	176.6	-63.2	174.6	0	0	0	109.1	V245 V246 A250 T251 F252	V245-I248 PolarHBondContact O-N 3.33Å; V246-I248 PolarHBondContact O-N 3.24Å; I248-A250 PolarHBondContact O-N 3.21Å; I248-T251 PolarHBondContact O-N 3.27Å; I248-F252 WeakPolarHBondContact O-CB 3.45Å; I248-F252 PolarHBondContact O-N 2.94Å; I248-F252 VanDerWaalsContact O-N 3.09Å
249	T	93	Very high	90.9	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-69.5	-34.6	-168.8	56.8	0	0	0	0	112.1	V245 V246 P253 L397 L400 D401	V245-T249 HydrophobicContact CG1-CG2 3.49Å; V245-T249 VanDerWaalsContact CG1-CG2 3.49Å; V245-T249 PolarHBondContact O-N 3.45Å; V245-T249 VanDerWaalsContact O-N 3.17Å; V245-T249 PolarHBondContact O-OG1 2.92Å; V245-T249 VanDerWaalsContact O-OG1 3.11Å; V246-T249 VanDerWaalsContact CA-OG1 3.26Å; V246-T249 WeakPolarHBondContact CA-OG1 3.18Å; T249-P253 WeakPolarHBondContact O-CD 3.47Å; T249-P253 VanDerWaalsContact O-CG 3.26Å; T249-P253 WeakPolarHBondContact O-CG 3.44Å; T249-L397 HydrophobicContact CG2-CD2 3.84Å; T249-L400 HydrophobicContact CG2-CD2 4.39Å; T249-D401 WeakPolarHBondContact CB-OD1 3.43Å; T249-D401 PolarHBondContact OG1-OD1 2.95Å
250	A	91.4	Very high	91.1	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-35.4	177.1	0	0	0	0	0	112.5	V246 I248 F254 D401	V246-A250 WeakPolarHBondContact O-CB 3.19Å; V246-A250 PolarHBondContact O-N 2.96Å; I248-A250 PolarHBondContact O-N 3.21Å; A250-F254 WeakPolarHBondContact O-CD2 3.19Å; A250-F254 WeakPolarHBondContact O-CE2 3.39Å; A250-D401 WeakPolarHBondContact CA-OD2 3.48Å; A250-D401 WeakPolarHBondContact CB-OD2 3.24Å; A250-D401 PolarHBondContact N-OD2 3.34Å
251	T	92.1	Very high	91.4	Very high	60 Å²	60	43.7 Å²	43.7	37%	0.368	22%	0.223	S	C	.	.	H	α-helix	trans	-79.5	-37.1	-173.3	65.5	0	0	0	0	113.3	L52 Y247 I248 F254 V255	L52-T251 HydrophobicContact CD2-CG2 4.49Å; Y247-T251 WeakPolarHBondContact O-CB 3.44Å; Y247-T251 WeakPolarHBondContact O-CG2 3.32Å; Y247-T251 PolarHBondContact O-OG1 2.84Å; I248-T251 PolarHBondContact O-N 3.27Å; T251-F254 PolarHBondContact O-N 3.39Å; T251-V255 PolarHBondContact O-N 3.13Å
252	F	92	Very high	91.7	Very high	60 Å²	60	47.9 Å²	47.9	26%	0.263	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-44.4	-177.7	179.2	-86	0	0	0	112.6	I248 F254 V255 M256 L390 I393 M394 L397	I248-F252 WeakPolarHBondContact O-CB 3.45Å; I248-F252 PolarHBondContact O-N 2.94Å; I248-F252 VanDerWaalsContact O-N 3.09Å; F252-F254 VanDerWaalsContact C-N 3.33Å; F252-F254 PolarHBondContact O-N 3.37Å; F252-V255 PolarHBondContact O-N 3.41Å; F252-M256 HydrophobicContact CD1-CG 3.74Å; F252-M256 HydrophobicContact CE1-CB 4.44Å; F252-M256 HydrophobicContact CE1-CG 3.25Å; F252-M256 HydrophobicContact CE1-SD 4.21Å; F252-M256 HydrophobicContact CE2-CG 4.24Å; F252-M256 HydrophobicContact CG-CG 4.44Å; F252-M256 HydrophobicContact CZ-CG 3.54Å; F252-M256 HydrophobicContact CZ-SD 3.9Å; F252-M256 PolarHBondContact O-N 3.33Å; F252-L390 HydrophobicContact CZ-CD2 4.27Å; F252-I393 HydrophobicContact CD1-CG2 4.16Å; F252-I393 HydrophobicContact CE1-CB 4.26Å; F252-I393 HydrophobicContact CE1-CG2 3.53Å; F252-I393 HydrophobicContact CZ-CG2 3.94Å; F252-M394 HydrophobicContact CE1-CB 4.48Å; F252-L397 HydrophobicContact CB-CD1 3.83Å; F252-L397 HydrophobicContact CD1-CD1 3.61Å; F252-L397 HydrophobicContact CE1-CD1 4.41Å; F252-L397 HydrophobicContact CG-CD1 3.89Å
253	P	91.4	Very high	91.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-38.1	174.6	-28.8	37.1	0	0	0	114.9	T249 M256 L257 M394 L397 L398	T249-P253 WeakPolarHBondContact O-CD 3.47Å; T249-P253 VanDerWaalsContact O-CG 3.26Å; T249-P253 WeakPolarHBondContact O-CG 3.44Å; P253-M256 PolarHBondContact O-N 3.4Å; P253-L257 WeakPolarHBondContact O-CB 3.23Å; P253-L257 VanDerWaalsContact O-CG 3.32Å; P253-L257 WeakPolarHBondContact O-CG 3.37Å; P253-L257 PolarHBondContact O-N 2.97Å; P253-M394 HydrophobicContact CB-CG 4.05Å; P253-L397 HydrophobicContact CG-CB 3.9Å; P253-L398 HydrophobicContact CB-CD1 4.19Å; P253-L398 HydrophobicContact CB-CD2 3.38Å; P253-L398 HydrophobicContact CB-CG 3.55Å; P253-L398 HydrophobicContact CG-CD2 3.81Å; P253-L398 HydrophobicContact CG-CG 3.75Å
254	F	91.5	Very high	92.1	Very high	50 Å²	50	50.6 Å²	50.6	22%	0.219	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-43.8	175.3	-73.2	-70.2	0	0	0	111.9	V59 A250 T251 F252 M256 L257 I258 L332 T336	V59-F254 HydrophobicContact CB-CZ 4.3Å; V59-F254 HydrophobicContact CG1-CE1 4.3Å; V59-F254 HydrophobicContact CG1-CZ 4.05Å; V59-F254 HydrophobicContact CG2-CZ 4.16Å; A250-F254 WeakPolarHBondContact O-CD2 3.19Å; A250-F254 WeakPolarHBondContact O-CE2 3.39Å; T251-F254 PolarHBondContact O-N 3.39Å; F252-F254 VanDerWaalsContact C-N 3.33Å; F252-F254 PolarHBondContact O-N 3.37Å; F254-M256 VanDerWaalsContact C-N 3.31Å; F254-M256 PolarHBondContact O-N 2.65Å; F254-L257 PolarHBondContact O-N 3.15Å; F254-I258 WeakPolarHBondContact O-CG1 3.5Å; F254-I258 PolarHBondContact O-N 3.06Å; F254-I258 VanDerWaalsContact O-N 3.16Å; F254-L332 HydrophobicContact CE1-CD1 4.05Å; F254-L332 HydrophobicContact CE1-CG 4.48Å; F254-L332 HydrophobicContact CZ-CD1 4.27Å; F254-L332 HydrophobicContact CZ-CD2 4.21Å; F254-L332 HydrophobicContact CZ-CG 4.32Å; F254-T336 HydrophobicContact CD1-CG2 4.43Å; F254-T336 HydrophobicContact CE1-CG2 3.91Å; F254-T336 WeakPolarHBondContact CE1-OG1 3.48Å
255	V	93.1	Very high	92.3	Very high	85 Å²	85	46.2 Å²	46.2	52%	0.515	24%	0.239	S	C	.	.	H	α-helix	trans	-60.9	-45.4	175.3	176.7	0	0	0	0	110.1	T251 F252 I258 V259	T251-V255 PolarHBondContact O-N 3.13Å; F252-V255 PolarHBondContact O-N 3.41Å; V255-I258 PolarHBondContact O-N 2.86Å; V255-V259 WeakPolarHBondContact O-CG2 3.26Å; V255-V259 PolarHBondContact O-N 3.25Å
256	M	90.9	Very high	92.4	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.044	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-39.7	179.2	-78.8	-53.2	-46	0	0	113.2	F252 P253 F254 I258 V259 L260 L390 M394	F252-M256 HydrophobicContact CD1-CG 3.74Å; F252-M256 HydrophobicContact CE1-CB 4.44Å; F252-M256 HydrophobicContact CE1-CG 3.25Å; F252-M256 HydrophobicContact CE1-SD 4.21Å; F252-M256 HydrophobicContact CE2-CG 4.24Å; F252-M256 HydrophobicContact CG-CG 4.44Å; F252-M256 HydrophobicContact CZ-CG 3.54Å; F252-M256 HydrophobicContact CZ-SD 3.9Å; F252-M256 PolarHBondContact O-N 3.33Å; P253-M256 PolarHBondContact O-N 3.4Å; F254-M256 VanDerWaalsContact C-N 3.31Å; F254-M256 PolarHBondContact O-N 2.65Å; M256-I258 VanDerWaalsContact C-N 3.28Å; M256-I258 PolarHBondContact O-N 2.89Å; M256-V259 HydrophobicContact CE-CB 4.44Å; M256-V259 HydrophobicContact CE-CG1 4.44Å; M256-V259 PolarHBondContact O-N 3.2Å; M256-L260 HydrophobicContact CE-CD2 4.47Å; M256-L260 HydrophobicContact CE-CG 4.26Å; M256-L260 WeakPolarHBondContact O-CB 3.44Å; M256-L260 WeakPolarHBondContact O-CG 3.33Å; M256-L260 PolarHBondContact O-N 3.08Å; M256-L390 HydrophobicContact CE-CB 3.58Å; M256-L390 HydrophobicContact CE-CD1 4.08Å; M256-L390 HydrophobicContact CE-CG 4.28Å; M256-L390 HydrophobicContact SD-CB 4.14Å; M256-L390 HydrophobicContact SD-CD1 4.36Å; M256-L390 HydrophobicContact SD-CD2 4.03Å; M256-L390 HydrophobicContact SD-CG 4.41Å; M256-M394 HydrophobicContact CB-CB 4.15Å; M256-M394 HydrophobicContact CB-CG 4Å; M256-M394 HydrophobicContact CB-SD 3.67Å; M256-M394 HydrophobicContact CG-CB 4.32Å
257	L	90.6	Very high	92.4	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-38.6	174.8	-77.2	174	0	0	0	111.6	V64 P253 F254 L261 T336 M394	V64-L257 HydrophobicContact CG2-CD1 4.49Å; V64-L257 HydrophobicContact CG2-CD2 4.09Å; P253-L257 WeakPolarHBondContact O-CB 3.23Å; P253-L257 VanDerWaalsContact O-CG 3.32Å; P253-L257 WeakPolarHBondContact O-CG 3.37Å; P253-L257 PolarHBondContact O-N 2.97Å; F254-L257 PolarHBondContact O-N 3.15Å; L257-L261 WeakPolarHBondContact O-CB 3.4Å; L257-L261 PolarHBondContact O-N 3.24Å; L257-T336 HydrophobicContact CD1-CG2 3.77Å; L257-M394 HydrophobicContact CD2-SD 4.12Å; L257-M394 HydrophobicContact CG-SD 4.16Å
258	I	93.1	Very high	92.4	Very high	99 Å²	99	48 Å²	48	51%	0.508	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-44.7	174.2	-66.2	166	0	0	0	110.7	F254 V255 M256 L261 I262	F254-I258 WeakPolarHBondContact O-CG1 3.5Å; F254-I258 PolarHBondContact O-N 3.06Å; F254-I258 VanDerWaalsContact O-N 3.16Å; V255-I258 PolarHBondContact O-N 2.86Å; M256-I258 VanDerWaalsContact C-N 3.28Å; M256-I258 PolarHBondContact O-N 2.89Å; I258-L261 PolarHBondContact O-N 3.14Å; I258-I262 HydrophobicContact CG2-CD1 3.92Å; I258-I262 WeakPolarHBondContact O-CG1 3.38Å; I258-I262 PolarHBondContact O-N 3.46Å
259	V	92.9	Very high	92.4	Very high	55 Å²	55	42.7 Å²	42.7	33%	0.333	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-46.4	177.8	172.2	0	0	0	0	111.2	V255 M256 L261 I262 R263 W387	V255-V259 WeakPolarHBondContact O-CG2 3.26Å; V255-V259 PolarHBondContact O-N 3.25Å; M256-V259 HydrophobicContact CE-CB 4.44Å; M256-V259 HydrophobicContact CE-CG1 4.44Å; M256-V259 PolarHBondContact O-N 3.2Å; V259-L261 VanDerWaalsContact C-N 3.33Å; V259-I262 PolarHBondContact O-N 3.15Å; V259-R263 WeakPolarHBondContact O-CB 3.42Å; V259-R263 PolarHBondContact O-N 2.87Å; V259-W387 HydrophobicContact CG1-CH2 4.45Å; V259-W387 HydrophobicContact CG1-CZ3 4.05Å
260	L	89.2	Confident	92.5	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-35.2	177.5	-69.7	-177.5	0	0	0	112.1	M256 G264 A343 Y374 W387 F391 M394	M256-L260 HydrophobicContact CE-CD2 4.47Å; M256-L260 HydrophobicContact CE-CG 4.26Å; M256-L260 WeakPolarHBondContact O-CB 3.44Å; M256-L260 WeakPolarHBondContact O-CG 3.33Å; M256-L260 PolarHBondContact O-N 3.08Å; L260-G264 WeakPolarHBondContact O-CA 3.24Å; L260-G264 PolarHBondContact O-N 3.29Å; L260-A343 HydrophobicContact CB-CB 4.44Å; L260-Y374 WeakPolarHBondContact CD1-OH 3.49Å; L260-Y374 WeakPolarHBondContact CD2-OH 3.38Å; L260-W387 HydrophobicContact CD2-CE3 4.12Å; L260-W387 HydrophobicContact CD2-CZ3 4.23Å; L260-F391 HydrophobicContact CD1-CD2 4.47Å; L260-M394 HydrophobicContact CD1-CE 3.73Å; L260-M394 HydrophobicContact CD1-SD 3.92Å
261	L	93.4	Very high	92.6	Very high	45 Å²	45	46.3 Å²	46.3	24%	0.236	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-53.2	173.4	178.3	66.1	0	0	0	110.9	L257 I258 V259 R263 G264 V265 V339 F342 A343	L257-L261 WeakPolarHBondContact O-CB 3.4Å; L257-L261 PolarHBondContact O-N 3.24Å; I258-L261 PolarHBondContact O-N 3.14Å; V259-L261 VanDerWaalsContact C-N 3.33Å; L261-R263 VanDerWaalsContact C-N 3.29Å; L261-R263 PolarHBondContact O-N 2.88Å; L261-G264 PolarHBondContact O-N 3.28Å; L261-V265 HydrophobicContact CD1-CG1 3.96Å; L261-V265 WeakPolarHBondContact O-CG1 3.24Å; L261-V265 VanDerWaalsContact O-CG2 3.31Å; L261-V265 WeakPolarHBondContact O-CG2 3.33Å; L261-V265 PolarHBondContact O-N 3.21Å; L261-V339 HydrophobicContact CD2-CG1 3.93Å; L261-F342 HydrophobicContact CD1-CB 3.47Å; L261-F342 VanDerWaalsContact CD1-CB 3.47Å; L261-A343 HydrophobicContact CB-CB 4.17Å; L261-A343 HydrophobicContact CD1-CB 4.39Å
262	I	94.9	Very high	92.6	Very high	105 Å²	105	48.7 Å²	48.7	54%	0.538	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-44.6	179.1	-66.3	166.6	0	0	0	110.1	I258 V259 T266	I258-I262 HydrophobicContact CG2-CD1 3.92Å; I258-I262 WeakPolarHBondContact O-CG1 3.38Å; I258-I262 PolarHBondContact O-N 3.46Å; V259-I262 PolarHBondContact O-N 3.15Å; I262-T266 WeakPolarHBondContact O-CG2 3.48Å; I262-T266 PolarHBondContact O-N 2.95Å; I262-T266 PolarHBondContact O-OG1 3.45Å
263	R	92.1	Very high	92.6	Very high	59 Å²	59	45.8 Å²	45.8	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-47.8	177.9	179.9	56.5	-178.4	150.7	-1	111.5	V259 L261 T266 L267 W387	V259-R263 WeakPolarHBondContact O-CB 3.42Å; V259-R263 PolarHBondContact O-N 2.87Å; L261-R263 VanDerWaalsContact C-N 3.29Å; L261-R263 PolarHBondContact O-N 2.88Å; R263-T266 PolarHBondContact O-N 2.98Å; R263-T266 PolarHBondContact O-OG1 3.48Å; R263-L267 WeakPolarHBondContact O-CG 3.47Å; R263-L267 PolarHBondContact O-N 2.96Å; R263-W387 HydrophobicContact CB-CH2 3.85Å; R263-W387 HydrophobicContact CB-CZ3 4.12Å; R263-W387 HydrophobicContact CG-CH2 3.61Å; R263-W387 HydrophobicContact CG-CZ2 3.87Å; R263-W387 HydrophobicContact CG-CZ3 4.02Å
264	G	92.1	Very high	92.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-49.6	-177.7	0	0	0	0	0	112.2	L260 L261 T266 L267 A270 S346	L260-G264 WeakPolarHBondContact O-CA 3.24Å; L260-G264 PolarHBondContact O-N 3.29Å; L261-G264 PolarHBondContact O-N 3.28Å; G264-T266 PolarHBondContact O-N 3.33Å; G264-L267 WeakPolarHBondContact O-CB 3.5Å; G264-L267 PolarHBondContact O-N 3.26Å; G264-L267 VanDerWaalsContact O-N 3.13Å; G264-A270 WeakPolarHBondContact O-CB 3.47Å; G264-S346 VanDerWaalsContact C-CB 3.42Å; G264-S346 VanDerWaalsContact C-OG 3.23Å; G264-S346 VanDerWaalsContact CA-OG 3.24Å; G264-S346 WeakPolarHBondContact CA-OG 3.47Å; G264-S346 WeakPolarHBondContact O-CB 3.37Å
265	V	95.3	Very high	92.9	Very high	68 Å²	68	50.6 Å²	50.6	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-70.2	-15.7	-178.7	-56.5	0	0	0	0	114	L261 I274	L261-V265 HydrophobicContact CD1-CG1 3.96Å; L261-V265 WeakPolarHBondContact O-CG1 3.24Å; L261-V265 VanDerWaalsContact O-CG2 3.31Å; L261-V265 WeakPolarHBondContact O-CG2 3.33Å; L261-V265 PolarHBondContact O-N 3.21Å; V265-I274 HydrophobicContact CG1-CD1 4.29Å
266	T	94.3	Very high	92.7	Very high	90 Å²	90	49.8 Å²	49.8	55%	0.552	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-6.5	175.3	55.2	0	0	0	0	113.3	I262 R263 G264	I262-T266 WeakPolarHBondContact O-CG2 3.48Å; I262-T266 PolarHBondContact O-N 2.95Å; I262-T266 PolarHBondContact O-OG1 3.45Å; R263-T266 PolarHBondContact O-N 2.98Å; R263-T266 PolarHBondContact O-OG1 3.48Å; G264-T266 PolarHBondContact O-N 3.33Å
267	L	93.1	Very high	92.8	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.063	27%	0.265	C	S	.	.	S	Bend	trans	-76.6	148.2	175.1	-70.1	167.6	0	0	0	111.3	R263 G264 A270 V347 F350 M381	R263-L267 WeakPolarHBondContact O-CG 3.47Å; R263-L267 PolarHBondContact O-N 2.96Å; G264-L267 WeakPolarHBondContact O-CB 3.5Å; G264-L267 PolarHBondContact O-N 3.26Å; G264-L267 VanDerWaalsContact O-N 3.13Å; L267-A270 WeakPolarHBondContact O-CB 2.96Å; L267-A270 PolarHBondContact O-N 3.37Å; L267-V347 HydrophobicContact CD1-CG2 4.29Å; L267-F350 HydrophobicContact CB-CB 3.74Å; L267-F350 HydrophobicContact CB-CD2 3.89Å; L267-F350 HydrophobicContact CB-CG 3.87Å; L267-F350 HydrophobicContact CD1-CB 3.94Å; L267-F350 HydrophobicContact CD1-CD1 3.84Å; L267-F350 HydrophobicContact CD1-CD2 4.44Å; L267-F350 HydrophobicContact CD1-CE1 4.47Å; L267-F350 HydrophobicContact CD1-CG 3.8Å; L267-F350 HydrophobicContact CD2-CD1 4.43Å; L267-F350 HydrophobicContact CD2-CD2 4.04Å; L267-F350 HydrophobicContact CD2-CE1 4.46Å; L267-F350 HydrophobicContact CD2-CE2 4.08Å; L267-F350 HydrophobicContact CD2-CG 4.2Å; L267-F350 HydrophobicContact CD2-CZ 4.29Å; L267-F350 HydrophobicContact CG-CB 4.38Å; L267-F350 HydrophobicContact CG-CD2 4.34Å; L267-F350 HydrophobicContact CG-CG 4.17Å; L267-M381 HydrophobicContact CD1-CE 3.71Å; L267-M381 HydrophobicContact CD1-SD 4.19Å
268	P	92.8	Very high	93.1	Very high	64 Å²	64	51 Å²	51	42%	0.416	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	140.7	172.4	26.7	-31	0	0	0	109.7	A270 F350	P268-A270 VanDerWaalsContact C-N 3.3Å; P268-A270 PolarHBondContact O-N 3.14Å; P268-F350 HydrophobicContact CG-CD2 3.79Å; P268-F350 HydrophobicContact CG-CE2 3.98Å; P268-F350 WeakPolarHBondContact O-CA 3.38Å; P268-F350 WeakPolarHBondContact O-CB 3.26Å; P268-F350 WeakPolarHBondContact O-CD2 3.47Å
269	G	91.9	Very high	93.1	Very high	8 Å²	8	54 Å²	54	8%	0.082	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	-3.9	179.3	0	0	0	0	0	115.7	S271 E272 G273 G349	G269-S271 PolarHBondContact O-N 2.86Å; G269-S271 VanDerWaalsContact O-N 3.16Å; G269-E272 PolarHBondContact O-N 2.81Å; G269-G273 PolarHBondContact O-N 2.88Å; G269-G349 CarbonylContact O-C 3.41Å; G269-G349 WeakPolarHBondContact O-CA 3.4Å
270	A	93.7	Very high	93.2	Very high	5 Å²	5	54.9 Å²	54.9	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-55.8	-33.8	177.5	0	0	0	0	0	113.4	G264 L267 P268 E272 G273 I274	G264-A270 WeakPolarHBondContact O-CB 3.47Å; L267-A270 WeakPolarHBondContact O-CB 2.96Å; L267-A270 PolarHBondContact O-N 3.37Å; P268-A270 VanDerWaalsContact C-N 3.3Å; P268-A270 PolarHBondContact O-N 3.14Å; A270-E272 PolarHBondContact O-N 3.38Å; A270-G273 PolarHBondContact O-N 2.91Å; A270-I274 WeakPolarHBondContact O-CG1 3.36Å; A270-I274 PolarHBondContact O-N 3.44Å
271	S	93.3	Very high	93.5	Very high	82 Å²	82	58 Å²	58	57%	0.573	30%	0.303	S	S	*	.	H	α-helix	trans	-63.1	-40.3	179.8	56.9	0	0	0	0	113	G269 G273 I274 K275	G269-S271 PolarHBondContact O-N 2.86Å; G269-S271 VanDerWaalsContact O-N 3.16Å; S271-G273 VanDerWaalsContact C-N 3.32Å; S271-I274 PolarHBondContact O-N 2.84Å; S271-K275 VanDerWaalsContact O-CB 3.32Å; S271-K275 WeakPolarHBondContact O-CB 3.39Å; S271-K275 PolarHBondContact O-N 3.31Å
272	E	92.1	Very high	93.6	Very high	110 Å²	110	61.1 Å²	61.1	51%	0.514	32%	0.319	S	S	.	.	H	α-helix	trans	-68	-37.3	177.6	-66.8	-51.6	125.3	0	0	110.8	G269 A270 K275 F276	G269-E272 PolarHBondContact O-N 2.81Å; A270-E272 PolarHBondContact O-N 3.38Å; E272-K275 PolarHBondContact O-N 3.49Å; E272-F276 WeakPolarHBondContact O-CB 3.42Å; E272-F276 PolarHBondContact O-N 3.27Å
273	G	92.9	Very high	93.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.7	-48.4	173.1	0	0	0	0	0	113.9	G269 A270 S271 K275 F276 Y277 F345	G269-G273 PolarHBondContact O-N 2.88Å; A270-G273 PolarHBondContact O-N 2.91Å; S271-G273 VanDerWaalsContact C-N 3.32Å; G273-K275 VanDerWaalsContact C-N 3.3Å; G273-K275 PolarHBondContact O-N 3.08Å; G273-F276 PolarHBondContact O-N 2.87Å; G273-Y277 PolarHBondContact O-N 3.37Å; G273-F345 VanDerWaalsContact CA-O 3.27Å; G273-F345 WeakPolarHBondContact CA-O 3.31Å
274	I	94.6	Very high	93.7	Very high	44 Å²	44	62.8 Å²	62.8	23%	0.226	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-38.2	177.5	-65.7	166.3	0	0	0	110.9	V265 A270 S271 Y277 L278 F342	V265-I274 HydrophobicContact CG1-CD1 4.29Å; A270-I274 WeakPolarHBondContact O-CG1 3.36Å; A270-I274 PolarHBondContact O-N 3.44Å; S271-I274 PolarHBondContact O-N 2.84Å; I274-Y277 WeakPolarHBondContact O-CB 3.33Å; I274-Y277 PolarHBondContact O-N 2.63Å; I274-L278 PolarHBondContact O-N 3.41Å; I274-L278 VanDerWaalsContact O-N 3.12Å; I274-F342 HydrophobicContact CD1-CD1 4.23Å; I274-F342 HydrophobicContact CG1-CD1 4.12Å; I274-F342 HydrophobicContact CG2-CD1 3.94Å; I274-F342 HydrophobicContact CG2-CE1 3.78Å
275	K	93.7	Very high	93.8	Very high	109 Å²	109	64.4 Å²	64.4	47%	0.474	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-46.5	174.1	-174.4	-178.6	175	-169	0	110.5	S271 E272 G273 Y277 L278 Y279	S271-K275 VanDerWaalsContact O-CB 3.32Å; S271-K275 WeakPolarHBondContact O-CB 3.39Å; S271-K275 PolarHBondContact O-N 3.31Å; E272-K275 PolarHBondContact O-N 3.49Å; G273-K275 VanDerWaalsContact C-N 3.3Å; G273-K275 PolarHBondContact O-N 3.08Å; K275-Y277 VanDerWaalsContact C-N 3.26Å; K275-Y277 PolarHBondContact O-N 3.42Å; K275-L278 PolarHBondContact O-N 3.09Å; K275-Y279 HydrophobicContact CG-CD2 4.31Å; K275-Y279 WeakPolarHBondContact O-CB 3.37Å; K275-Y279 PolarHBondContact O-N 3.5Å
276	F	90.1	Very high	93.6	Very high	67 Å²	67	69.3 Å²	69.3	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-34	177.6	-167.1	-100.3	0	0	0	113.3	Y72 E272 G273 F345 I359 A360	Y72-F276 HydrophobicContact CD2-CD1 4.25Å; Y72-F276 AromaticContact CD2-CE1 3.36Å; Y72-F276 HydrophobicContact CD2-CE1 3.36Å; Y72-F276 AromaticContact CD2-CZ 3.95Å; Y72-F276 HydrophobicContact CD2-CZ 3.95Å; Y72-F276 AromaticContact CE2-CE1 3.93Å; Y72-F276 HydrophobicContact CE2-CE1 3.93Å; Y72-F276 HydrophobicContact CE2-CZ 4.37Å; Y72-F276 HydrophobicContact CG-CD1 4.31Å; Y72-F276 AromaticContact CG-CE1 3.82Å; Y72-F276 HydrophobicContact CG-CE1 3.82Å; E272-F276 WeakPolarHBondContact O-CB 3.42Å; E272-F276 PolarHBondContact O-N 3.27Å; G273-F276 PolarHBondContact O-N 2.87Å; F276-F345 HydrophobicContact CD1-CD1 4.22Å; F276-F345 AromaticContact CD1-CE1 3.78Å; F276-F345 HydrophobicContact CD1-CE1 3.78Å; F276-F345 HydrophobicContact CE1-CE1 4.33Å; F276-I359 HydrophobicContact CB-CD1 4.25Å; F276-I359 HydrophobicContact CB-CG2 3.67Å; F276-I359 HydrophobicContact CD1-CG2 3.5Å; F276-I359 HydrophobicContact CD2-CG2 3.17Å; F276-I359 HydrophobicContact CE1-CG2 3.79Å; F276-I359 HydrophobicContact CE2-CG2 3.5Å; F276-I359 HydrophobicContact CG-CG2 3.15Å; F276-I359 HydrophobicContact CZ-CG2 3.79Å; F276-A360 HydrophobicContact CE2-CB 4.27Å; F276-A360 HydrophobicContact CZ-CB 3.84Å
277	Y	93.8	Very high	93.4	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-41.7	176	173.3	-140.7	0	0	0	113.5	F67 C71 G76 G273 I274 K275 F338 F342 F345	F67-Y277 WeakPolarHBondContact CE1-OH 3.5Å; C71-Y277 HydrophobicContact CB-CD2 4.04Å; C71-Y277 HydrophobicContact CB-CE2 3.6Å; C71-Y277 WeakPolarHBondContact SG-CE2 3.49Å; G76-Y277 VanDerWaalsContact CA-O 3.24Å; G76-Y277 WeakPolarHBondContact CA-O 3.32Å; G273-Y277 PolarHBondContact O-N 3.37Å; I274-Y277 WeakPolarHBondContact O-CB 3.33Å; I274-Y277 PolarHBondContact O-N 2.63Å; K275-Y277 VanDerWaalsContact C-N 3.26Å; K275-Y277 PolarHBondContact O-N 3.42Å; Y277-F338 PolarHBondContact OH-O 3.03Å; Y277-F342 AromaticContact CE1-CD2 3.98Å; Y277-F342 HydrophobicContact CE1-CD2 3.98Å; Y277-F342 HydrophobicContact CE1-CE2 4.07Å; Y277-F342 HydrophobicContact CE1-CG 4.36Å; Y277-F345 HydrophobicContact CD2-CD2 4Å; Y277-F345 HydrophobicContact CD2-CE2 4.3Å; Y277-F345 HydrophobicContact CD2-CG 4.5Å; Y277-F345 HydrophobicContact CG-CB 4.33Å; Y277-F345 AromaticContact CG-CD2 3.99Å; Y277-F345 HydrophobicContact CG-CD2 3.99Å; Y277-F345 HydrophobicContact CG-CG 4.1Å
278	L	95.1	Very high	93.1	Very high	43 Å²	43	68.6 Å²	68.6	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-116.5	-10.4	-167.4	-67.5	179.3	0	0	0	115.9	G77 L80 I274 K275 P280 F338 F342	G77-L278 VanDerWaalsContact CA-O 3.31Å; G77-L278 WeakPolarHBondContact CA-O 3.42Å; G77-L278 PolarHBondContact N-O 2.79Å; L80-L278 HydrophobicContact CD1-CD2 4.49Å; I274-L278 PolarHBondContact O-N 3.41Å; I274-L278 VanDerWaalsContact O-N 3.12Å; K275-L278 PolarHBondContact O-N 3.09Å; L278-P280 WeakPolarHBondContact O-CD 3.39Å; L278-P280 VanDerWaalsContact O-N 3.13Å; L278-F338 HydrophobicContact CD1-CE2 4.44Å; L278-F338 HydrophobicContact CD1-CZ 4.35Å; L278-F338 HydrophobicContact CD2-CE2 3.87Å; L278-F342 HydrophobicContact CD1-CE1 3.82Å; L278-F342 HydrophobicContact CD1-CE2 4.23Å; L278-F342 HydrophobicContact CD1-CZ 3.44Å; L278-F342 VanDerWaalsContact CD1-CZ 3.44Å
279	Y	94.3	Very high	92.9	Very high	163 Å²	163	68.2 Å²	68.2	64%	0.639	34%	0.337	S	S	*	.			trans	-62.3	119.6	179.3	-163.7	-93.4	0	0	0	109.5	K275	K275-Y279 HydrophobicContact CG-CD2 4.31Å; K275-Y279 WeakPolarHBondContact O-CB 3.37Å; K275-Y279 PolarHBondContact O-N 3.5Å
280	P	95.6	Very high	92.9	Very high	72 Å²	72	67.9 Å²	67.9	47%	0.468	33%	0.333	S	S	.	.			trans	-81.6	127.1	-168.3	30.4	-33.5	0	0	0	111.4	G75 A78 L278	G75-P280 WeakPolarHBondContact O-CA 3.39Å; A78-P280 HydrophobicContact CB-CB 4.33Å; L278-P280 WeakPolarHBondContact O-CD 3.39Å; L278-P280 VanDerWaalsContact O-N 3.13Å
281	D	94.2	Very high	92.8	Very high	72 Å²	72	71.5 Å²	71.5	39%	0.385	35%	0.346	S	S	.	.			trans	-109.5	101.2	165.4	178.8	4.6	0	0	0	109.5	G75 A78 E283 R284	G75-D281 PolarHBondContact O-N 2.8Å; A78-D281 VanDerWaalsContact CB-O 3.32Å; A78-D281 WeakPolarHBondContact CB-O 3.26Å; D281-E283 PolarHBondContact O-N 3.25Å; D281-E283 WeakPolarHBondContact OD1-CB 3.41Å; D281-E283 PolarHBondContact OD1-N 3.16Å; D281-R284 HydrophobicContact CB-CG 4.3Å; D281-R284 PolarHBondContact O-N 3.17Å; D281-R284 WeakPolarHBondContact OD2-CG 2.98Å
282	L	95.3	Very high	92.5	Very high	111 Å²	111	68.8 Å²	68.8	58%	0.581	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.9	-17.6	-177.9	-64	176.6	0	0	0	112.9	A78 I81 R284 L285	A78-L282 HydrophobicContact CB-CD2 4.04Å; I81-L282 HydrophobicContact CD1-CD2 4.49Å; L282-R284 VanDerWaalsContact C-N 3.27Å; L282-R284 PolarHBondContact O-N 3.04Å; L282-L285 HydrophobicContact CD2-CD1 3.97Å; L282-L285 WeakPolarHBondContact O-CB 3.31Å; L282-L285 PolarHBondContact O-N 3.4Å
283	E	95.5	Very high	92.4	Very high	139 Å²	139	64.8 Å²	64.8	65%	0.65	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-68.8	-31.2	179.2	-59.6	-157.2	141.9	0	0	111.6	D281 L285 K286	D281-E283 PolarHBondContact O-N 3.25Å; D281-E283 WeakPolarHBondContact OD1-CB 3.41Å; D281-E283 PolarHBondContact OD1-N 3.16Å; E283-L285 PolarHBondContact O-N 3.28Å; E283-K286 WeakPolarHBondContact O-CB 3.4Å; E283-K286 PolarHBondContact O-N 3.49Å; E283-K286 VanDerWaalsContact O-N 3.13Å
284	R	93.6	Very high	92.4	Very high	59 Å²	59	64.8 Å²	64.8	22%	0.223	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-58.6	-28	175.3	-68.9	-70.6	-66.8	131.2	3	112.8	K73 N74 D281 L282 K286 D287 V290	K73-R284 PolarHBondContact O-NE 3.05Å; K73-R284 VanDerWaalsContact O-NE 3.14Å; K73-R284 PolarHBondContact O-NH2 3.38Å; N74-R284 PolarHBondContact OD1-NH2 3.35Å; D281-R284 HydrophobicContact CB-CG 4.3Å; D281-R284 PolarHBondContact O-N 3.17Å; D281-R284 WeakPolarHBondContact OD2-CG 2.98Å; L282-R284 VanDerWaalsContact C-N 3.27Å; L282-R284 PolarHBondContact O-N 3.04Å; R284-K286 PolarHBondContact O-N 3.26Å; R284-K286 VanDerWaalsContact O-N 3.13Å; R284-D287 IonicContact CZ-OD2 2.73Å; R284-D287 IonicContact NH1-OD2 3.93Å; R284-D287 PolarHBondContact NH1-OD2 2.74Å; R284-D287 IonicContact NH2-OD2 3.69Å; R284-D287 VanDerWaalsContact O-CB 3.32Å; R284-D287 WeakPolarHBondContact O-CB 3.01Å; R284-D287 PolarHBondContact O-N 3.33Å; R284-V290 HydrophobicContact CB-CG2 4.28Å; R284-V290 VanDerWaalsContact O-CG2 3.23Å; R284-V290 WeakPolarHBondContact O-CG2 3.11Å
285	L	94.1	Very high	92.2	Very high	35 Å²	35	62.7 Å²	62.7	18%	0.183	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-64.4	-18.1	178.9	-64.4	177.4	0	0	0	114	A78 I81 P82 L282 E283 D287 V290 W291	A78-L285 HydrophobicContact CB-CD1 4.42Å; A78-L285 HydrophobicContact CB-CD2 4.44Å; A78-L285 HydrophobicContact CB-CG 4.29Å; I81-L285 HydrophobicContact CD1-CD1 3.94Å; P82-L285 HydrophobicContact CG-CD2 4.06Å; L282-L285 HydrophobicContact CD2-CD1 3.97Å; L282-L285 WeakPolarHBondContact O-CB 3.31Å; L282-L285 PolarHBondContact O-N 3.4Å; E283-L285 PolarHBondContact O-N 3.28Å; L285-D287 VanDerWaalsContact C-N 3.26Å; L285-V290 HydrophobicContact CD2-CG1 4.24Å; L285-W291 PolarHBondContact O-NE1 2.87Å
286	K	92.4	Very high	91.9	Very high	170 Å²	170	58.1 Å²	58.1	74%	0.739	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-72.9	-20.3	173.3	-62.7	174.3	-176.1	165.7	0	112.4	E283 R284 P288	E283-K286 WeakPolarHBondContact O-CB 3.4Å; E283-K286 PolarHBondContact O-N 3.49Å; E283-K286 VanDerWaalsContact O-N 3.13Å; R284-K286 PolarHBondContact O-N 3.26Å; R284-K286 VanDerWaalsContact O-N 3.13Å; K286-P288 WeakPolarHBondContact O-CD 3.32Å
287	D	90.2	Very high	92	Very high	48 Å²	48	55 Å²	55	26%	0.257	26%	0.263	S	S	.	.	S	Bend	trans	-81.5	119.2	179.3	-174.5	-5	0	0	0	110.3	R284 L285 E289 V290	R284-D287 IonicContact CZ-OD2 2.73Å; R284-D287 IonicContact NH1-OD2 3.93Å; R284-D287 PolarHBondContact NH1-OD2 2.74Å; R284-D287 IonicContact NH2-OD2 3.69Å; R284-D287 VanDerWaalsContact O-CB 3.32Å; R284-D287 WeakPolarHBondContact O-CB 3.01Å; R284-D287 PolarHBondContact O-N 3.33Å; L285-D287 VanDerWaalsContact C-N 3.26Å; D287-E289 PolarHBondContact O-N 3.37Å; D287-E289 WeakPolarHBondContact OD1-CB 3.42Å; D287-E289 PolarHBondContact OD1-N 3.3Å; D287-V290 HydrophobicContact CB-CG2 4.17Å; D287-V290 WeakPolarHBondContact O-CB 3.43Å; D287-V290 PolarHBondContact O-N 3.47Å; D287-V290 VanDerWaalsContact O-N 3.16Å
288	P	86.8	Confident	92	Very high	40 Å²	40	55 Å²	55	26%	0.26	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-26.1	176.7	-23.9	34.8	0	0	0	114	K286 V290 W291 I292	K286-P288 WeakPolarHBondContact O-CD 3.32Å; P288-V290 PolarHBondContact O-N 3.39Å; P288-W291 PolarHBondContact O-N 2.97Å; P288-W291 VanDerWaalsContact O-N 3.11Å; P288-I292 PolarHBondContact O-N 3.09Å
289	E	87.7	Confident	91.8	Very high	56 Å²	56	53 Å²	53	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-58.9	-34.5	178.3	-163.4	176.4	140.6	0	0	111.2	K73 D287 W291 I292 D293 K528	K73-E289 IonicContact NZ-OE1 2.63Å; K73-E289 PolarHBondContact NZ-OE1 2.98Å; D287-E289 PolarHBondContact O-N 3.37Å; D287-E289 WeakPolarHBondContact OD1-CB 3.42Å; D287-E289 PolarHBondContact OD1-N 3.3Å; E289-W291 VanDerWaalsContact C-N 3.3Å; E289-W291 PolarHBondContact O-N 3.5Å; E289-I292 PolarHBondContact O-N 3.03Å; E289-D293 WeakPolarHBondContact O-CB 3.41Å; E289-D293 PolarHBondContact O-N 3.27Å; E289-K528 IonicContact OE2-NZ 2.66Å; E289-K528 PolarHBondContact OE2-NZ 3.11Å
290	V	92.2	Very high	91.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-38.1	177.5	171.6	0	0	0	0	112.2	N74 F79 P82 R284 L285 D287 P288 A294	N74-V290 HydrophobicContact CB-CB 4.3Å; N74-V290 HydrophobicContact CB-CG1 4.01Å; N74-V290 HydrophobicContact CB-CG2 3.8Å; F79-V290 HydrophobicContact CD2-CG1 4.11Å; P82-V290 HydrophobicContact CG-CG1 3.91Å; R284-V290 HydrophobicContact CB-CG2 4.28Å; R284-V290 VanDerWaalsContact O-CG2 3.23Å; R284-V290 WeakPolarHBondContact O-CG2 3.11Å; L285-V290 HydrophobicContact CD2-CG1 4.24Å; D287-V290 HydrophobicContact CB-CG2 4.17Å; D287-V290 WeakPolarHBondContact O-CB 3.43Å; D287-V290 PolarHBondContact O-N 3.47Å; D287-V290 VanDerWaalsContact O-N 3.16Å; P288-V290 PolarHBondContact O-N 3.39Å; V290-A294 WeakPolarHBondContact O-CB 3.07Å; V290-A294 PolarHBondContact O-N 3.31Å
291	W	91	Very high	91.4	Very high	82 Å²	82	43.5 Å²	43.5	31%	0.311	21%	0.208	S	C	.	.	H	α-helix	trans	-76	-38.1	-179.9	-64.6	82.5	0	0	0	111.9	P82 I85 F86 L285 P288 E289 A294 G295	P82-W291 HydrophobicContact CB-CD2 3.91Å; P82-W291 HydrophobicContact CB-CE3 3.64Å; P82-W291 HydrophobicContact CB-CH2 4.27Å; P82-W291 HydrophobicContact CB-CZ3 3.84Å; I85-W291 HydrophobicContact CD1-CH2 3.78Å; I85-W291 HydrophobicContact CD1-CZ3 3.74Å; F86-W291 HydrophobicContact CE2-CE3 4.09Å; F86-W291 VanDerWaalsContact CE2-O 3.3Å; F86-W291 WeakPolarHBondContact CE2-O 3.37Å; L285-W291 PolarHBondContact O-NE1 2.87Å; P288-W291 PolarHBondContact O-N 2.97Å; P288-W291 VanDerWaalsContact O-N 3.11Å; E289-W291 VanDerWaalsContact C-N 3.3Å; E289-W291 PolarHBondContact O-N 3.5Å; W291-A294 PolarHBondContact O-N 3.44Å; W291-G295 PolarHBondContact O-N 3.3Å
292	I	87.3	Confident	91.3	Very high	25 Å²	25	40 Å²	40	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-44.5	175	-64	167.1	0	0	0	110.2	P288 E289 G295 T296 F522	P288-I292 PolarHBondContact O-N 3.09Å; E289-I292 PolarHBondContact O-N 3.03Å; I292-G295 PolarHBondContact O-N 3.46Å; I292-T296 VanDerWaalsContact O-CB 3.23Å; I292-T296 WeakPolarHBondContact O-CB 3.42Å; I292-T296 PolarHBondContact O-N 3.33Å; I292-T296 PolarHBondContact O-OG1 3.37Å; I292-F522 HydrophobicContact CD1-CB 4.22Å
293	D	89.8	Confident	91.1	Very high	26 Å²	26	35 Å²	35	14%	0.139	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-43	176.8	-81.1	-8.3	0	0	0	111	L70 K73 N74 F79 E289 Q297	L70-D293 HydrophobicContact CD2-CB 4.12Å; K73-D293 IonicContact NZ-OD2 4Å; K73-D293 PolarHBondContact NZ-OD2 3.44Å; N74-D293 VanDerWaalsContact ND2-CB 3.31Å; N74-D293 WeakPolarHBondContact ND2-CB 3.35Å; N74-D293 PolarHBondContact ND2-OD2 3.08Å; F79-D293 HydrophobicContact CE2-CB 4.35Å; E289-D293 WeakPolarHBondContact O-CB 3.41Å; E289-D293 PolarHBondContact O-N 3.27Å; D293-Q297 WeakPolarHBondContact O-CB 3.25Å; D293-Q297 PolarHBondContact O-N 3.27Å
294	A	92.9	Very high	91	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.3	-48.3	177	0	0	0	0	0	112.6	F79 P82 F86 V290 W291 Q297 I298	F79-A294 HydrophobicContact CD2-CB 4.46Å; F79-A294 HydrophobicContact CE2-CB 3.66Å; F79-A294 HydrophobicContact CZ-CB 3.98Å; P82-A294 HydrophobicContact CB-CB 3.79Å; P82-A294 HydrophobicContact CG-CB 4.17Å; F86-A294 HydrophobicContact CD2-CB 3.93Å; F86-A294 HydrophobicContact CE2-CB 4.37Å; V290-A294 WeakPolarHBondContact O-CB 3.07Å; V290-A294 PolarHBondContact O-N 3.31Å; W291-A294 PolarHBondContact O-N 3.44Å; A294-Q297 PolarHBondContact O-N 2.88Å; A294-I298 WeakPolarHBondContact O-CG1 3.35Å; A294-I298 PolarHBondContact O-N 2.9Å; A294-I298 VanDerWaalsContact O-N 3.08Å
295	G	90.4	Very high	91.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-50.2	177.6	0	0	0	0	0	111.7	F86 W291 I292 Q297 I298 F299	F86-G295 VanDerWaalsContact CD1-CA 3.44Å; F86-G295 VanDerWaalsContact CG-CA 3.42Å; W291-G295 PolarHBondContact O-N 3.3Å; I292-G295 PolarHBondContact O-N 3.46Å; G295-Q297 VanDerWaalsContact C-N 3.3Å; G295-Q297 PolarHBondContact O-N 3.26Å; G295-I298 PolarHBondContact O-N 3.37Å; G295-F299 WeakPolarHBondContact O-CD2 3.3Å; G295-F299 PolarHBondContact O-N 2.96Å
296	T	87.6	Confident	91	Very high	13 Å²	13	24 Å²	24	8%	0.08	11%	0.114	C	C	.	.	H	α-helix	trans	-58.2	-43.7	177.8	-59.3	0	0	0	0	111.6	I292 I298 F299 F300 G465	I292-T296 VanDerWaalsContact O-CB 3.23Å; I292-T296 WeakPolarHBondContact O-CB 3.42Å; I292-T296 PolarHBondContact O-N 3.33Å; I292-T296 PolarHBondContact O-OG1 3.37Å; T296-I298 PolarHBondContact O-N 3.49Å; T296-F299 PolarHBondContact O-N 3.42Å; T296-F300 WeakPolarHBondContact O-CB 3.44Å; T296-F300 PolarHBondContact O-N 3.04Å; T296-G465 VanDerWaalsContact CG2-CA 3.41Å
297	Q	92.2	Very high	91	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-43.8	178.4	179	58.1	33.2	0	0	111.9	R66 F67 L70 Y83 D293 A294 G295 S301	R66-Q297 VanDerWaalsContact CD-OE1 3.23Å; F67-Q297 HydrophobicContact CB-CG 4.49Å; F67-Q297 HydrophobicContact CD2-CG 4.16Å; L70-Q297 HydrophobicContact CD1-CB 3.78Å; L70-Q297 HydrophobicContact CD1-CG 4.1Å; Y83-Q297 HydrophobicContact CE2-CG 4.16Å; D293-Q297 WeakPolarHBondContact O-CB 3.25Å; D293-Q297 PolarHBondContact O-N 3.27Å; A294-Q297 PolarHBondContact O-N 2.88Å; G295-Q297 VanDerWaalsContact C-N 3.3Å; G295-Q297 PolarHBondContact O-N 3.26Å; Q297-S301 WeakPolarHBondContact O-CA 3.41Å; Q297-S301 WeakPolarHBondContact O-CB 3.35Å; Q297-S301 PolarHBondContact O-N 3.48Å
298	I	93.6	Very high	91.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.1	-48.8	178.5	-73	-69	0	0	0	110.9	Y83 F86 L87 G91 A294 G295 T296 F300 S301 Y302	Y83-I298 HydrophobicContact CD1-CD1 4.26Å; Y83-I298 HydrophobicContact CD2-CD1 3.72Å; Y83-I298 HydrophobicContact CD2-CG1 3.94Å; Y83-I298 HydrophobicContact CE1-CD1 3.86Å; Y83-I298 HydrophobicContact CE2-CD1 3.26Å; Y83-I298 HydrophobicContact CE2-CG1 3.88Å; Y83-I298 HydrophobicContact CG-CD1 4.2Å; F86-I298 HydrophobicContact CB-CB 4.13Å; F86-I298 HydrophobicContact CB-CG1 3.83Å; F86-I298 HydrophobicContact CB-CG2 4.42Å; L87-I298 HydrophobicContact CB-CD1 3.89Å; L87-I298 HydrophobicContact CD1-CD1 4.21Å; G91-I298 VanDerWaalsContact CA-CG2 3.47Å; A294-I298 WeakPolarHBondContact O-CG1 3.35Å; A294-I298 PolarHBondContact O-N 2.9Å; A294-I298 VanDerWaalsContact O-N 3.08Å; G295-I298 PolarHBondContact O-N 3.37Å; T296-I298 PolarHBondContact O-N 3.49Å; I298-F300 PolarHBondContact O-N 3.28Å; I298-S301 PolarHBondContact O-N 2.94Å; I298-Y302 HydrophobicContact CD1-CE2 4.4Å; I298-Y302 HydrophobicContact CG2-CD2 4.33Å; I298-Y302 VanDerWaalsContact O-CD2 3.25Å; I298-Y302 WeakPolarHBondContact O-CD2 3.42Å; I298-Y302 PolarHBondContact O-N 3.5Å
299	F	92.1	Very high	91.5	Very high	1 Å²	1	11.8 Å²	11.8	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-66.6	-42.8	-175.4	-79.6	-112.6	0	0	0	111.6	F86 V94 G295 T296 A303 I304 L468 L469 A472 T512 C516	F86-F299 HydrophobicContact CD1-CE2 4.36Å; V94-F299 HydrophobicContact CG2-CE1 4.49Å; G295-F299 WeakPolarHBondContact O-CD2 3.3Å; G295-F299 PolarHBondContact O-N 2.96Å; T296-F299 PolarHBondContact O-N 3.42Å; F299-A303 PolarHBondContact O-N 2.83Å; F299-I304 HydrophobicContact CB-CD1 4.25Å; F299-I304 HydrophobicContact CB-CG1 4.2Å; F299-I304 HydrophobicContact CD1-CD1 3.41Å; F299-I304 VanDerWaalsContact CD1-CD1 3.41Å; F299-I304 HydrophobicContact CD1-CG1 3.95Å; F299-I304 HydrophobicContact CD2-CD1 4.35Å; F299-I304 HydrophobicContact CE1-CD1 3.66Å; F299-I304 HydrophobicContact CG-CD1 3.79Å; F299-I304 HydrophobicContact CG-CG1 4.25Å; F299-I304 HydrophobicContact CZ-CD1 4.31Å; F299-I304 WeakPolarHBondContact O-CG1 3.48Å; F299-I304 PolarHBondContact O-N 2.95Å; F299-L468 HydrophobicContact CB-CB 4.32Å; F299-L468 HydrophobicContact CB-CD1 4.29Å; F299-L469 HydrophobicContact CD1-CD2 4.41Å; F299-L469 HydrophobicContact CD2-CD2 4.19Å; F299-L469 HydrophobicContact CE1-CD2 4.39Å; F299-L469 HydrophobicContact CE2-CD2 4.12Å; F299-L469 HydrophobicContact CG-CD2 4.32Å; F299-L469 HydrophobicContact CZ-CD2 4.22Å; F299-A472 HydrophobicContact CD1-CB 4.07Å; F299-A472 HydrophobicContact CE1-CB 3.36Å; F299-A472 HydrophobicContact CZ-CB 4.28Å; F299-T512 HydrophobicContact CZ-CG2 4.4Å; F299-C516 VanDerWaalsContact CZ-SG 3.59Å
300	F	88.4	Confident	91.9	Very high	32 Å²	32	9.2 Å²	9.2	14%	0.14	4%	0.043	C	C	.	.	H	α-helix	trans	-67	-44.4	175.6	-167	-93.2	0	0	0	111.8	L134 T296 I298 Y302 A303 L468	L134-F300 HydrophobicContact CD1-CE2 4.05Å; T296-F300 WeakPolarHBondContact O-CB 3.44Å; T296-F300 PolarHBondContact O-N 3.04Å; I298-F300 PolarHBondContact O-N 3.28Å; F300-Y302 PolarHBondContact O-N 2.98Å; F300-A303 PolarHBondContact O-N 2.94Å; F300-L468 HydrophobicContact CB-CD1 4.4Å; F300-L468 HydrophobicContact CD2-CD1 4.33Å
301	S	92.2	Very high	92	Very high	4 Å²	4	9.2 Å²	9.2	3%	0.028	4%	0.043	C	C	.	.	H	α-helix	trans	-67.4	-21.4	-179.3	-174.3	0	0	0	0	113.6	F58 N63 Q297 I298 N333	F58-S301 WeakPolarHBondContact CB-O 3.35Å; N63-S301 PolarHBondContact ND2-OG 3.31Å; Q297-S301 WeakPolarHBondContact O-CA 3.41Å; Q297-S301 WeakPolarHBondContact O-CB 3.35Å; Q297-S301 PolarHBondContact O-N 3.48Å; I298-S301 PolarHBondContact O-N 2.94Å; S301-N333 PolarHBondContact O-ND2 3.28Å; S301-N333 PolarHBondContact OG-ND2 2.83Å; S301-N333 PolarHBondContact OG-OD1 3.21Å
302	Y	91.7	Very high	92.2	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-4.6	174.2	-83.3	-107.6	0	0	0	112.7	F58 L87 L92 F95 I298 F300 I304 G330 N333 S334	F58-Y302 HydrophobicContact CD2-CD1 4.15Å; F58-Y302 HydrophobicContact CE2-CD1 4.37Å; F58-Y302 HydrophobicContact CE2-CE1 4.39Å; L87-Y302 HydrophobicContact CD1-CE2 3.83Å; L87-Y302 WeakPolarHBondContact CD1-OH 3.4Å; L92-Y302 HydrophobicContact CD2-CE1 4.23Å; F95-Y302 HydrophobicContact CB-CD1 3.9Å; F95-Y302 AromaticContact CD1-CD1 3.9Å; F95-Y302 HydrophobicContact CD1-CD1 3.9Å; F95-Y302 HydrophobicContact CD1-CE1 4.01Å; F95-Y302 AromaticContact CG-CD1 3.91Å; F95-Y302 HydrophobicContact CG-CD1 3.91Å; F95-Y302 HydrophobicContact CG-CE1 4.46Å; I298-Y302 HydrophobicContact CD1-CE2 4.4Å; I298-Y302 HydrophobicContact CG2-CD2 4.33Å; I298-Y302 VanDerWaalsContact O-CD2 3.25Å; I298-Y302 WeakPolarHBondContact O-CD2 3.42Å; I298-Y302 PolarHBondContact O-N 3.5Å; F300-Y302 PolarHBondContact O-N 2.98Å; Y302-I304 PolarHBondContact O-N 3.49Å; Y302-G330 WeakPolarHBondContact OH-CA 3.33Å; Y302-G330 PolarHBondContact OH-O 2.96Å; Y302-N333 WeakPolarHBondContact CD2-ND2 3.32Å; Y302-N333 HydrophobicContact CE2-CB 4.35Å; Y302-N333 WeakPolarHBondContact CE2-ND2 3.45Å; Y302-S334 PolarHBondContact OH-OG 3.15Å
303	A	91.1	Very high	92.6	Very high	4 Å²	4	4.1 Å²	4.1	3%	0.033	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	37.3	-173.6	0	0	0	0	0	112.8	F299 F300 L306 M309	F299-A303 PolarHBondContact O-N 2.83Å; F300-A303 PolarHBondContact O-N 2.94Å; A303-L306 HydrophobicContact CB-CD1 4.08Å; A303-M309 HydrophobicContact CB-CE 4.16Å
304	I	94	Very high	92.8	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	2%	0.016	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	156	-179.4	52.6	166.7	0	0	0	111.6	V94 F95 E98 F299 Y302 L306 M309	V94-I304 HydrophobicContact CB-CD1 3.77Å; V94-I304 HydrophobicContact CG1-CB 4.1Å; V94-I304 HydrophobicContact CG1-CD1 3.76Å; V94-I304 HydrophobicContact CG1-CG1 4.46Å; F95-I304 HydrophobicContact CB-CG2 3.78Å; F95-I304 HydrophobicContact CD2-CG2 4.37Å; E98-I304 VanDerWaalsContact OE2-CA 3.29Å; E98-I304 WeakPolarHBondContact OE2-CA 3.45Å; E98-I304 WeakPolarHBondContact OE2-CG2 3.4Å; F299-I304 HydrophobicContact CB-CD1 4.25Å; F299-I304 HydrophobicContact CB-CG1 4.2Å; F299-I304 HydrophobicContact CD1-CD1 3.41Å; F299-I304 VanDerWaalsContact CD1-CD1 3.41Å; F299-I304 HydrophobicContact CD1-CG1 3.95Å; F299-I304 HydrophobicContact CD2-CD1 4.35Å; F299-I304 HydrophobicContact CE1-CD1 3.66Å; F299-I304 HydrophobicContact CG-CD1 3.79Å; F299-I304 HydrophobicContact CG-CG1 4.25Å; F299-I304 HydrophobicContact CZ-CD1 4.31Å; F299-I304 WeakPolarHBondContact O-CG1 3.48Å; F299-I304 PolarHBondContact O-N 2.95Å; Y302-I304 PolarHBondContact O-N 3.49Å; I304-L306 PolarHBondContact O-N 3.42Å; I304-M309 HydrophobicContact CG2-CG 4.49Å
305	C	94.8	Very high	92.9	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	10.2	-176.6	-52.8	0	0	0	0	114.2	E98 S127 L468 V471 A472 E475	E98-C305 VanDerWaalsContact CD-N 3.31Å; E98-C305 VanDerWaalsContact OE1-CA 3.24Å; E98-C305 WeakPolarHBondContact OE1-CA 3.25Å; E98-C305 PolarHBondContact OE1-N 3.35Å; E98-C305 PolarHBondContact OE2-N 2.93Å; S127-C305 VanDerWaalsContact CB-O 3.27Å; S127-C305 WeakPolarHBondContact CB-O 3.44Å; S127-C305 PolarHBondContact OG-O 3.42Å; C305-L468 HydrophobicContact CB-CD2 4.29Å; C305-V471 HydrophobicContact CB-CB 3.94Å; C305-V471 HydrophobicContact CB-CG1 3.69Å; C305-A472 VanDerWaalsContact SG-CA 3.59Å; C305-A472 VanDerWaalsContact SG-CB 3.55Å; C305-E475 PolarHBondContact SG-OE2 3.29Å
306	L	93.4	Very high	93.1	Very high	3 Å²	3	3.8 Å²	3.8	2%	0.016	2%	0.019	C	C	.	.	S	Bend	trans	-95.7	-5.5	173.5	-61.9	176.3	0	0	0	112.2	I130 V131 L134 A303 I304 A308 L468	I130-L306 HydrophobicContact CB-CD2 4.1Å; I130-L306 HydrophobicContact CG2-CD2 3.41Å; I130-L306 VanDerWaalsContact CG2-CD2 3.41Å; V131-L306 HydrophobicContact CB-CB 4.32Å; V131-L306 HydrophobicContact CB-CD2 4.38Å; V131-L306 HydrophobicContact CG2-CB 4.34Å; L134-L306 HydrophobicContact CD1-CD1 3.84Å; L134-L306 HydrophobicContact CD1-CD2 4.12Å; A303-L306 HydrophobicContact CB-CD1 4.08Å; I304-L306 PolarHBondContact O-N 3.42Å; L306-A308 PolarHBondContact O-N 3.44Å; L306-A308 VanDerWaalsContact O-N 3.16Å; L306-L468 HydrophobicContact CD2-CD2 3.78Å; L306-L468 HydrophobicContact CG-CD2 4.28Å
307	G	91.8	Very high	93.4	Very high	2 Å²	2	9.7 Å²	9.7	2%	0.021	4%	0.044	C	C	.	.	S	Bend	trans	74.3	-7.9	-175.9	0	0	0	0	0	114.4	T310 S311	G307-T310 PolarHBondContact O-N 3.46Å; G307-S311 WeakPolarHBondContact O-CB 3.17Å; G307-S311 PolarHBondContact O-N 3.4Å; G307-S311 PolarHBondContact O-OG 3.05Å
308	A	93.1	Very high	93.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.7	-46.3	177.4	0	0	0	0	0	112.1	L306 T310 S311 L312 V405	L306-A308 PolarHBondContact O-N 3.44Å; L306-A308 VanDerWaalsContact O-N 3.16Å; A308-T310 VanDerWaalsContact C-N 3.35Å; A308-T310 PolarHBondContact O-N 2.94Å; A308-S311 CarbonylContact O-C 3.6Å; A308-S311 WeakPolarHBondContact O-CB 3.28Å; A308-S311 PolarHBondContact O-N 3.42Å; A308-S311 VanDerWaalsContact O-N 3.17Å; A308-L312 WeakPolarHBondContact O-CG 3.32Å; A308-L312 PolarHBondContact O-N 3.03Å; A308-V405 HydrophobicContact CB-CG1 4.42Å
309	M	94.9	Very high	93.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-38.4	178.7	-63.6	-57	120.7	0	0	112.4	V54 F95 E98 V99 A303 I304 L312 G313 V405	V54-M309 HydrophobicContact CG1-SD 4.03Å; F95-M309 HydrophobicContact CD2-CB 4.45Å; F95-M309 HydrophobicContact CD2-CG 4.01Å; F95-M309 HydrophobicContact CD2-SD 4.18Å; F95-M309 HydrophobicContact CE2-CG 4.14Å; F95-M309 HydrophobicContact CE2-SD 3.71Å; E98-M309 HydrophobicContact CB-CB 3.98Å; E98-M309 WeakPolarHBondContact OE2-CB 3.46Å; V99-M309 HydrophobicContact CG2-CB 4.13Å; A303-M309 HydrophobicContact CB-CE 4.16Å; I304-M309 HydrophobicContact CG2-CG 4.49Å; M309-L312 HydrophobicContact CE-CD1 4.12Å; M309-L312 PolarHBondContact O-N 3.09Å; M309-L312 HydrophobicContact SD-CD1 4.44Å; M309-G313 PolarHBondContact O-N 3.11Å; M309-V405 HydrophobicContact CE-CG1 4.21Å
310	T	95.9	Very high	93.6	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-59.5	-47.9	171.2	-59.8	0	0	0	0	111	E98 G102 C112 G307 A308 G313 S314	E98-T310 WeakPolarHBondContact CB-OG1 3.43Å; E98-T310 WeakPolarHBondContact O-CA 3.38Å; E98-T310 PolarHBondContact O-OG1 3.3Å; G102-T310 VanDerWaalsContact CA-O 3.28Å; G102-T310 WeakPolarHBondContact CA-O 3.35Å; C112-T310 HydrophobicContact CB-CG2 4.19Å; G307-T310 PolarHBondContact O-N 3.46Å; A308-T310 VanDerWaalsContact C-N 3.35Å; A308-T310 PolarHBondContact O-N 2.94Å; T310-G313 PolarHBondContact O-N 3.29Å; T310-S314 PolarHBondContact O-N 3.34Å
311	S	94.2	Very high	93.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-45	175.8	-72.4	0	0	0	0	112.5	G307 A308 G313 S314 Y315 G409 S413	G307-S311 WeakPolarHBondContact O-CB 3.17Å; G307-S311 PolarHBondContact O-N 3.4Å; G307-S311 PolarHBondContact O-OG 3.05Å; A308-S311 CarbonylContact O-C 3.6Å; A308-S311 WeakPolarHBondContact O-CB 3.28Å; A308-S311 PolarHBondContact O-N 3.42Å; A308-S311 VanDerWaalsContact O-N 3.17Å; S311-G313 PolarHBondContact O-N 3.48Å; S311-S314 WeakPolarHBondContact O-CB 3.44Å; S311-S314 PolarHBondContact O-N 2.98Å; S311-S314 PolarHBondContact O-OG 3.36Å; S311-Y315 WeakPolarHBondContact O-CD2 3Å; S311-Y315 VanDerWaalsContact O-CE2 3.29Å; S311-Y315 WeakPolarHBondContact O-CE2 3.41Å; S311-G409 PolarHBondContact OG-O 3.09Å; S311-G409 VanDerWaalsContact OG-O 3.05Å; S311-S413 PolarHBondContact OG-OG 3.46Å
312	L	94.2	Very high	94.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64	-40.5	176.7	-65.4	-176	0	0	0	112.1	W44 F50 V54 A308 M309 S314 Y315 V405	W44-L312 HydrophobicContact CH2-CD2 4.01Å; W44-L312 HydrophobicContact CZ2-CB 4.38Å; W44-L312 HydrophobicContact CZ2-CD2 3.69Å; W44-L312 PolarHBondContact NE1-O 2.88Å; F50-L312 HydrophobicContact CE2-CB 4.39Å; V54-L312 HydrophobicContact CG2-CB 4.48Å; V54-L312 HydrophobicContact CG2-CD1 3.79Å; A308-L312 WeakPolarHBondContact O-CG 3.32Å; A308-L312 PolarHBondContact O-N 3.03Å; M309-L312 HydrophobicContact CE-CD1 4.12Å; M309-L312 PolarHBondContact O-N 3.09Å; M309-L312 HydrophobicContact SD-CD1 4.44Å; L312-S314 VanDerWaalsContact C-N 3.3Å; L312-S314 PolarHBondContact O-N 3.21Å; L312-Y315 PolarHBondContact O-N 3.28Å; L312-V405 HydrophobicContact CD1-CG1 3.67Å; L312-V405 HydrophobicContact CD2-CG1 4.49Å; L312-V405 HydrophobicContact CG-CG1 4.31Å
313	G	95.6	Very high	94.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-34.6	177.1	0	0	0	0	0	112.9	Q103 M309 T310 S311 Y315 N316	Q103-G313 VanDerWaalsContact CA-O 3.27Å; Q103-G313 WeakPolarHBondContact CA-O 2.9Å; Q103-G313 PolarHBondContact N-O 3.04Å; M309-G313 PolarHBondContact O-N 3.11Å; T310-G313 PolarHBondContact O-N 3.29Å; S311-G313 PolarHBondContact O-N 3.48Å; G313-Y315 PolarHBondContact O-N 3.02Å; G313-N316 WeakPolarHBondContact O-CB 3.34Å; G313-N316 PolarHBondContact O-N 3.32Å
314	S	95.6	Very high	94.6	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.5	-25.2	179.2	76.3	0	0	0	0	114.9	R41 K43 G102 E107 T310 S311 L312 N316	R41-S314 WeakPolarHBondContact CD-O 3.24Å; R41-S314 VanDerWaalsContact CZ-CB 3.41Å; R41-S314 PolarHBondContact NE-O 3.39Å; R41-S314 PolarHBondContact NE-OG 3.31Å; R41-S314 PolarHBondContact NH2-OG 2.95Å; K43-S314 PolarHBondContact NZ-O 3.2Å; G102-S314 WeakPolarHBondContact O-CA 3.47Å; E107-S314 VanDerWaalsContact O-CB 3.27Å; E107-S314 WeakPolarHBondContact O-CB 3.49Å; T310-S314 PolarHBondContact O-N 3.34Å; S311-S314 WeakPolarHBondContact O-CB 3.44Å; S311-S314 PolarHBondContact O-N 2.98Å; S311-S314 PolarHBondContact O-OG 3.36Å; L312-S314 VanDerWaalsContact C-N 3.3Å; L312-S314 PolarHBondContact O-N 3.21Å; S314-N316 VanDerWaalsContact C-N 3.28Å
315	Y	94.3	Very high	94.7	Very high	18 Å²	18	31.1 Å²	31.1	7%	0.071	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.2	175.3	-60.7	-66.9	0	0	0	112.4	R41 E42 K43 W44 V239 S311 L312 G313 T412	R41-Y315 HydrophobicContact CG-CD1 4.24Å; R41-Y315 HydrophobicContact CG-CE1 4.25Å; E42-Y315 WeakPolarHBondContact O-CD1 3.46Å; K43-Y315 VanDerWaalsContact CA-O 3.25Å; K43-Y315 WeakPolarHBondContact CA-O 3.26Å; K43-Y315 WeakPolarHBondContact CD-O 3.38Å; W44-Y315 VanDerWaalsContact CD1-C 3.4Å; W44-Y315 VanDerWaalsContact CD1-O 3.3Å; W44-Y315 HydrophobicContact CZ2-CD2 4.37Å; W44-Y315 PolarHBondContact N-O 3.28Å; W44-Y315 VanDerWaalsContact NE1-CB 3.33Å; V239-Y315 HydrophobicContact CG1-CD1 4.06Å; V239-Y315 HydrophobicContact CG1-CD2 3.45Å; V239-Y315 VanDerWaalsContact CG1-CD2 3.45Å; V239-Y315 HydrophobicContact CG1-CE1 4.17Å; V239-Y315 HydrophobicContact CG1-CE2 3.58Å; V239-Y315 HydrophobicContact CG1-CG 3.71Å; V239-Y315 HydrophobicContact CG2-CD1 4.26Å; V239-Y315 HydrophobicContact CG2-CG 4.48Å; S311-Y315 WeakPolarHBondContact O-CD2 3Å; S311-Y315 VanDerWaalsContact O-CE2 3.29Å; S311-Y315 WeakPolarHBondContact O-CE2 3.41Å; L312-Y315 PolarHBondContact O-N 3.28Å; G313-Y315 PolarHBondContact O-N 3.02Å; Y315-T412 HydrophobicContact CE2-CG2 4.03Å; Y315-T412 WeakPolarHBondContact OH-CB 3.18Å; Y315-T412 WeakPolarHBondContact OH-CG2 3.39Å; Y315-T412 PolarHBondContact OH-OG1 3.16Å
316	N	95.3	Very high	94.8	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.011	13%	0.133	C	C	.	.	S	Bend	trans	-70.4	152.8	173	-70.7	-19.7	0	0	0	111.6	K43 W44 F50 Q103 G313 S314 Y320	K43-N316 WeakPolarHBondContact CD-O 3.28Å; K43-N316 WeakPolarHBondContact CE-O 3.2Å; K43-N316 PolarHBondContact NZ-O 2.87Å; W44-N316 PolarHBondContact NE1-OD1 3.19Å; F50-N316 VanDerWaalsContact CD2-OD1 3.24Å; F50-N316 WeakPolarHBondContact CD2-OD1 3.41Å; F50-N316 WeakPolarHBondContact CE2-ND2 3.25Å; F50-N316 WeakPolarHBondContact CG-OD1 3.43Å; F50-N316 WeakPolarHBondContact CZ-ND2 3.28Å; Q103-N316 HydrophobicContact CB-CB 4.38Å; Q103-N316 HydrophobicContact CG-CB 3.91Å; Q103-N316 PolarHBondContact OE1-ND2 3.13Å; G313-N316 WeakPolarHBondContact O-CB 3.34Å; G313-N316 PolarHBondContact O-N 3.32Å; S314-N316 VanDerWaalsContact C-N 3.28Å; N316-Y320 HydrophobicContact CB-CG 4.34Å
317	K	93.6	Very high	94.9	Very high	137 Å²	137	33.8 Å²	33.8	60%	0.596	15%	0.146	S	C	*	.			trans	-67.7	146	167.8	-62.4	-179.8	-176.9	178.2	0	108.7	K319 Y320	K317-K319 VanDerWaalsContact C-N 3.27Å; K317-K319 PolarHBondContact O-N 3.34Å; K317-Y320 WeakPolarHBondContact O-CB 3.39Å; K317-Y320 PolarHBondContact O-N 2.86Å
318	Y	92.4	Very high	95.2	Very high	78 Å²	78	38.3 Å²	38.3	31%	0.306	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41	-175.6	-169.4	-100	0	0	0	113.5	Q103 F104 Y320 D494 M495	Q103-Y318 PolarHBondContact NE2-O 2.97Å; F104-Y318 HydrophobicContact CD2-CE2 4.06Å; Y318-Y320 VanDerWaalsContact C-N 3.3Å; Y318-Y320 PolarHBondContact O-N 3.3Å; Y318-D494 WeakPolarHBondContact CE1-OD2 3.24Å; Y318-D494 PolarHBondContact OH-OD2 3.31Å; Y318-M495 HydrophobicContact CD1-CG 4.36Å; Y318-M495 HydrophobicContact CD2-CG 4.22Å; Y318-M495 HydrophobicContact CE1-CG 3.96Å; Y318-M495 HydrophobicContact CE2-CG 3.79Å; Y318-M495 HydrophobicContact CE2-SD 4.5Å; Y318-M495 HydrophobicContact CG-CG 4.49Å; Y318-M495 WeakPolarHBondContact O-CB 3.36Å
319	K	93.4	Very high	95.3	Very high	136 Å²	136	38.5 Å²	38.5	59%	0.591	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	16.4	178.5	-58	-64.3	-169.1	179.4	0	114.6	K317 D494 M495	K317-K319 VanDerWaalsContact C-N 3.27Å; K317-K319 PolarHBondContact O-N 3.34Å; K319-D494 PolarHBondContact NZ-O 3.08Å; K319-D494 IonicContact NZ-OD1 3.27Å; K319-M495 VanDerWaalsContact CA-O 3.29Å; K319-M495 WeakPolarHBondContact CA-O 3.19Å; K319-M495 WeakPolarHBondContact CD-O 3.3Å
320	Y	94.9	Very high	95.4	Very high	19 Å²	19	38.5 Å²	38.5	8%	0.075	17%	0.171	C	C	.	.			trans	-71.7	133.9	177.5	-173.1	-87.4	0	0	0	110.2	K47 F50 Q103 N316 K317 Y318 C322 D325 I496	K47-Y320 HydrophobicContact CB-CE2 3.91Å; K47-Y320 HydrophobicContact CD-CD2 4.5Å; K47-Y320 HydrophobicContact CD-CE2 3.82Å; K47-Y320 HydrophobicContact CG-CD2 4.44Å; K47-Y320 HydrophobicContact CG-CE2 3.69Å; F50-Y320 AromaticContact CD1-CE1 3.86Å; F50-Y320 HydrophobicContact CD1-CE1 3.86Å; F50-Y320 AromaticContact CD1-CZ 3.74Å; F50-Y320 WeakPolarHBondContact CD1-OH 3.49Å; F50-Y320 AromaticContact CE1-CE1 3.82Å; F50-Y320 HydrophobicContact CE1-CE1 3.82Å; Q103-Y320 PolarHBondContact NE2-O 3.04Å; N316-Y320 HydrophobicContact CB-CG 4.34Å; K317-Y320 WeakPolarHBondContact O-CB 3.39Å; K317-Y320 PolarHBondContact O-N 2.86Å; Y318-Y320 VanDerWaalsContact C-N 3.3Å; Y318-Y320 PolarHBondContact O-N 3.3Å; Y320-C322 VanDerWaalsContact C-N 3.26Å; Y320-C322 HydrophobicContact CD1-CB 4.32Å; Y320-C322 PolarHBondContact O-N 3.4Å; Y320-D325 HydrophobicContact CE1-CB 4.34Å; Y320-D325 WeakPolarHBondContact CE1-OD2 3.34Å; Y320-D325 PolarHBondContact OH-OD2 3.14Å; Y320-I496 WeakPolarHBondContact O-CG2 3.4Å
321	N	96.4	Very high	95.3	Very high	50 Å²	50	41.6 Å²	41.6	27%	0.267	20%	0.197	S	C	.	.			trans	-79.4	75.5	-179.6	-170.9	-11.3	0	0	0	110.8	Y323 R324 Y498	N321-Y323 VanDerWaalsContact C-N 3.29Å; N321-Y323 PolarHBondContact O-N 3.48Å; N321-R324 PolarHBondContact OD1-N 3.05Å; N321-Y498 VanDerWaalsContact CG-OH 3.31Å; N321-Y498 PolarHBondContact ND2-OH 3.46Å; N321-Y498 PolarHBondContact OD1-OH 2.78Å
322	C	96.2	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-31.5	-179.5	54	0	0	0	0	112.7	V99 Y320 D325 C326	V99-C322 HydrophobicContact CG1-CB 3.89Å; Y320-C322 VanDerWaalsContact C-N 3.26Å; Y320-C322 HydrophobicContact CD1-CB 4.32Å; Y320-C322 PolarHBondContact O-N 3.4Å; C322-D325 PolarHBondContact O-N 3.28Å; C322-C326 WeakPolarHBondContact O-CB 3.32Å; C322-C326 PolarHBondContact O-N 3.12Å; C322-C326 PolarHBondContact O-SG 3.43Å
323	Y	96.9	Very high	95.5	Very high	28 Å²	28	44.8 Å²	44.8	11%	0.11	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-52.1	-179.7	177.1	-112.3	0	0	0	112.6	F96 N321 D325 C326 L327 Y498 P500 N501 M504	F96-Y323 HydrophobicContact CD1-CD2 4.01Å; F96-Y323 HydrophobicContact CD2-CD2 4.28Å; F96-Y323 AromaticContact CE1-CD2 3.7Å; F96-Y323 HydrophobicContact CE1-CD2 3.7Å; F96-Y323 HydrophobicContact CE1-CE2 4.4Å; F96-Y323 VanDerWaalsContact CE2-CA 3.46Å; F96-Y323 AromaticContact CE2-CD2 3.99Å; F96-Y323 HydrophobicContact CE2-CD2 3.99Å; F96-Y323 HydrophobicContact CE2-CG 4.33Å; F96-Y323 HydrophobicContact CG-CD2 4.31Å; F96-Y323 AromaticContact CZ-CD2 3.7Å; F96-Y323 HydrophobicContact CZ-CD2 3.7Å; F96-Y323 HydrophobicContact CZ-CG 4.18Å; N321-Y323 VanDerWaalsContact C-N 3.29Å; N321-Y323 PolarHBondContact O-N 3.48Å; Y323-D325 VanDerWaalsContact C-N 3.31Å; Y323-D325 PolarHBondContact O-N 3.37Å; Y323-C326 PolarHBondContact O-N 2.91Å; Y323-L327 HydrophobicContact CD1-CD1 4.49Å; Y323-L327 HydrophobicContact CE1-CD1 3.9Å; Y323-L327 HydrophobicContact CE2-CD1 4.13Å; Y323-L327 HydrophobicContact CE2-CG 4.44Å; Y323-L327 WeakPolarHBondContact O-CG 3.33Å; Y323-L327 PolarHBondContact O-N 3.37Å; Y323-Y498 AromaticContact CD1-CE2 4Å; Y323-Y498 HydrophobicContact CD1-CE2 4Å; Y323-P500 HydrophobicContact CD2-CB 3.88Å; Y323-P500 HydrophobicContact CD2-CG 4.33Å; Y323-P500 HydrophobicContact CE2-CB 3.77Å; Y323-P500 HydrophobicContact CG-CB 4.29Å; Y323-N501 VanDerWaalsContact OH-CB 3.29Å; Y323-N501 WeakPolarHBondContact OH-CB 3.48Å; Y323-M504 HydrophobicContact CD2-CE 4.28Å; Y323-M504 HydrophobicContact CE2-CE 3.7Å; Y323-M504 HydrophobicContact CE2-CG 3.96Å
324	R	96	Very high	95.4	Very high	155 Å²	155	45.3 Å²	45.3	59%	0.585	22%	0.217	S	C	*	.	H	α-helix	trans	-57.4	-47.3	178.1	174.5	-174.1	164	177.8	-2.5	111.1	N321 L327 L328	N321-R324 PolarHBondContact OD1-N 3.05Å; R324-L327 PolarHBondContact O-N 3.04Å; R324-L328 HydrophobicContact CG-CD1 4.11Å; R324-L328 WeakPolarHBondContact O-CG 3.42Å; R324-L328 PolarHBondContact O-N 3.19Å; R324-L328 VanDerWaalsContact O-N 3.12Å
325	D	95.8	Very high	95.4	Very high	25 Å²	25	46.8 Å²	46.8	13%	0.134	23%	0.233	C	C	.	.	H	α-helix	trans	-74.5	-32.7	-172.5	-68.3	-8.6	0	0	0	111.7	Y320 C322 Y323 L327 L328 L329	Y320-D325 HydrophobicContact CE1-CB 4.34Å; Y320-D325 WeakPolarHBondContact CE1-OD2 3.34Å; Y320-D325 PolarHBondContact OH-OD2 3.14Å; C322-D325 PolarHBondContact O-N 3.28Å; Y323-D325 VanDerWaalsContact C-N 3.31Å; Y323-D325 PolarHBondContact O-N 3.37Å; D325-L327 VanDerWaalsContact C-N 3.31Å; D325-L327 PolarHBondContact O-N 3.19Å; D325-L328 PolarHBondContact O-N 3.24Å; D325-L329 WeakPolarHBondContact O-CB 3.35Å; D325-L329 WeakPolarHBondContact O-CD1 3.45Å; D325-L329 WeakPolarHBondContact O-CG 3.47Å; D325-L329 PolarHBondContact O-N 3.49Å
326	C	96.6	Very high	95.4	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-38.9	171.5	-69.1	0	0	0	0	111.8	F95 F96 C322 Y323 G330	F95-C326 HydrophobicContact CD1-CB 4Å; F95-C326 HydrophobicContact CE1-CB 3.71Å; F95-C326 WeakPolarHBondContact CE1-O 3.27Å; F95-C326 HydrophobicContact CZ-CB 4.34Å; F96-C326 HydrophobicContact CB-CB 4.26Å; F96-C326 HydrophobicContact CD2-CB 4.24Å; C322-C326 WeakPolarHBondContact O-CB 3.32Å; C322-C326 PolarHBondContact O-N 3.12Å; C322-C326 PolarHBondContact O-SG 3.43Å; Y323-C326 PolarHBondContact O-N 2.91Å; C326-G330 PolarHBondContact O-N 3.02Å
327	L	96.5	Very high	95.4	Very high	57 Å²	57	46.4 Å²	46.4	30%	0.298	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-44	175.5	-66.9	178	0	0	0	112.2	L92 Y323 R324 D325 G330 A331 W503 M504	L92-L327 HydrophobicContact CD2-CD2 4.44Å; Y323-L327 HydrophobicContact CD1-CD1 4.49Å; Y323-L327 HydrophobicContact CE1-CD1 3.9Å; Y323-L327 HydrophobicContact CE2-CD1 4.13Å; Y323-L327 HydrophobicContact CE2-CG 4.44Å; Y323-L327 WeakPolarHBondContact O-CG 3.33Å; Y323-L327 PolarHBondContact O-N 3.37Å; R324-L327 PolarHBondContact O-N 3.04Å; D325-L327 VanDerWaalsContact C-N 3.31Å; D325-L327 PolarHBondContact O-N 3.19Å; L327-G330 PolarHBondContact O-N 3.09Å; L327-A331 PolarHBondContact O-N 3.11Å; L327-W503 HydrophobicContact CD2-CZ3 4.3Å; L327-M504 HydrophobicContact CD2-CE 3.88Å
328	L	96.4	Very high	95.5	Very high	98 Å²	98	43.4 Å²	43.4	51%	0.513	22%	0.219	S	C	.	.	H	α-helix	trans	-64.3	-43	177.4	-69.7	174.3	0	0	0	111.6	R324 D325 A331 L332	R324-L328 HydrophobicContact CG-CD1 4.11Å; R324-L328 WeakPolarHBondContact O-CG 3.42Å; R324-L328 PolarHBondContact O-N 3.19Å; R324-L328 VanDerWaalsContact O-N 3.12Å; D325-L328 PolarHBondContact O-N 3.24Å; L328-A331 PolarHBondContact O-N 2.82Å; L328-L332 WeakPolarHBondContact O-CB 3.35Å; L328-L332 PolarHBondContact O-N 2.92Å
329	L	96.4	Very high	95.6	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-43.7	176.6	-77	167.4	0	0	0	111	V51 V54 A55 F58 F95 D325 A331 L332 N333	V51-L329 HydrophobicContact CG1-CD2 4.02Å; V54-L329 HydrophobicContact CB-CD1 3.96Å; V54-L329 HydrophobicContact CG1-CD1 3.78Å; V54-L329 HydrophobicContact CG1-CD2 4.45Å; A55-L329 HydrophobicContact CB-CD2 4Å; F58-L329 HydrophobicContact CE1-CD2 4.35Å; F58-L329 HydrophobicContact CE2-CB 4Å; F58-L329 HydrophobicContact CZ-CB 3.66Å; F58-L329 HydrophobicContact CZ-CD2 3.9Å; F58-L329 HydrophobicContact CZ-CG 4.38Å; F58-L329 WeakPolarHBondContact CZ-O 3.47Å; F95-L329 HydrophobicContact CE1-CB 4.02Å; F95-L329 HydrophobicContact CZ-CB 4.2Å; F95-L329 HydrophobicContact CZ-CD1 4.25Å; D325-L329 WeakPolarHBondContact O-CB 3.35Å; D325-L329 WeakPolarHBondContact O-CD1 3.45Å; D325-L329 WeakPolarHBondContact O-CG 3.47Å; D325-L329 PolarHBondContact O-N 3.49Å; L329-A331 VanDerWaalsContact C-N 3.34Å; L329-A331 PolarHBondContact O-N 3.46Å; L329-L332 HydrophobicContact CD2-CD2 4.45Å; L329-L332 WeakPolarHBondContact O-CB 3.24Å; L329-L332 PolarHBondContact O-N 3Å; L329-L332 VanDerWaalsContact O-N 3.13Å; L329-N333 PolarHBondContact O-N 3.3Å
330	G	95.8	Very high	95.6	Very high	1 Å²	1	36 Å²	36	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-39	176.2	0	0	0	0	0	113.4	Y302 C326 L327 L332 N333 S334	Y302-G330 WeakPolarHBondContact OH-CA 3.33Å; Y302-G330 PolarHBondContact OH-O 2.96Å; C326-G330 PolarHBondContact O-N 3.02Å; L327-G330 PolarHBondContact O-N 3.09Å; G330-L332 VanDerWaalsContact C-N 3.32Å; G330-L332 PolarHBondContact O-N 3.04Å; G330-N333 PolarHBondContact O-N 3.41Å; G330-S334 PolarHBondContact O-N 3.5Å; G330-S334 VanDerWaalsContact O-N 3.08Å
331	A	95.6	Very high	95.5	Very high	66 Å²	66	35.1 Å²	35.1	55%	0.545	19%	0.19	S	C	.	.	H	α-helix	trans	-61.3	-41.4	171.7	0	0	0	0	0	111.9	L327 L328 L329 G335	L327-A331 PolarHBondContact O-N 3.11Å; L328-A331 PolarHBondContact O-N 2.82Å; L329-A331 VanDerWaalsContact C-N 3.34Å; L329-A331 PolarHBondContact O-N 3.46Å; A331-G335 WeakPolarHBondContact O-CA 3.4Å; A331-G335 PolarHBondContact O-N 3.27Å
332	L	95.8	Very high	95.4	Very high	67 Å²	67	35.1 Å²	35.1	35%	0.351	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-46.6	175	-179.3	66.8	0	0	0	111.4	A55 F254 L328 L329 G330 T336	A55-L332 HydrophobicContact CB-CD2 3.95Å; F254-L332 HydrophobicContact CE1-CD1 4.05Å; F254-L332 HydrophobicContact CE1-CG 4.48Å; F254-L332 HydrophobicContact CZ-CD1 4.27Å; F254-L332 HydrophobicContact CZ-CD2 4.21Å; F254-L332 HydrophobicContact CZ-CG 4.32Å; L328-L332 WeakPolarHBondContact O-CB 3.35Å; L328-L332 PolarHBondContact O-N 2.92Å; L329-L332 HydrophobicContact CD2-CD2 4.45Å; L329-L332 WeakPolarHBondContact O-CB 3.24Å; L329-L332 PolarHBondContact O-N 3Å; L329-L332 VanDerWaalsContact O-N 3.13Å; G330-L332 VanDerWaalsContact C-N 3.32Å; G330-L332 PolarHBondContact O-N 3.04Å; L332-T336 VanDerWaalsContact O-CB 3.31Å; L332-T336 WeakPolarHBondContact O-CB 3.35Å; L332-T336 PolarHBondContact O-N 2.84Å; L332-T336 PolarHBondContact O-OG1 3.17Å
333	N	95.4	Very high	95.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-56.9	-178.2	-171	23.7	0	0	0	112	F58 N63 S301 Y302 L329 G330 G335 T336 S337	F58-N333 HydrophobicContact CD2-CB 4Å; F58-N333 HydrophobicContact CE1-CB 4.1Å; F58-N333 HydrophobicContact CE2-CB 3.65Å; F58-N333 HydrophobicContact CG-CB 4.46Å; F58-N333 HydrophobicContact CZ-CB 3.73Å; F58-N333 PolarHBondContact O-OD1 3.41Å; N63-N333 PolarHBondContact ND2-O 2.95Å; N63-N333 PolarHBondContact ND2-OD1 3.41Å; S301-N333 PolarHBondContact O-ND2 3.28Å; S301-N333 PolarHBondContact OG-ND2 2.83Å; S301-N333 PolarHBondContact OG-OD1 3.21Å; Y302-N333 WeakPolarHBondContact CD2-ND2 3.32Å; Y302-N333 HydrophobicContact CE2-CB 4.35Å; Y302-N333 WeakPolarHBondContact CE2-ND2 3.45Å; L329-N333 PolarHBondContact O-N 3.3Å; G330-N333 PolarHBondContact O-N 3.41Å; N333-G335 PolarHBondContact O-N 3.22Å; N333-T336 PolarHBondContact O-N 3.11Å; N333-S337 PolarHBondContact O-N 3.45Å; N333-S337 VanDerWaalsContact O-N 3.09Å; N333-S337 PolarHBondContact O-OG 2.98Å
334	S	94.9	Very high	95	Very high	10 Å²	10	34.4 Å²	34.4	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-67.2	-36.4	179.9	-67.7	0	0	0	0	112.5	Y83 Y302 G330 T336 S337 F338	Y83-S334 WeakPolarHBondContact OH-CB 3.44Å; Y83-S334 PolarHBondContact OH-OG 3.43Å; Y302-S334 PolarHBondContact OH-OG 3.15Å; G330-S334 PolarHBondContact O-N 3.5Å; G330-S334 VanDerWaalsContact O-N 3.08Å; S334-T336 VanDerWaalsContact C-N 3.33Å; S334-T336 PolarHBondContact O-N 3.23Å; S334-S337 PolarHBondContact O-N 3.09Å; S334-F338 PolarHBondContact O-N 3.33Å
335	G	95.3	Very high	94.8	Very high	32 Å²	32	27.1 Å²	27.1	33%	0.33	16%	0.158	S	C	.	.	H	α-helix	trans	-62.1	-41.1	174	0	0	0	0	0	112.2	A331 N333 F338 V339	A331-G335 WeakPolarHBondContact O-CA 3.4Å; A331-G335 PolarHBondContact O-N 3.27Å; N333-G335 PolarHBondContact O-N 3.22Å; G335-F338 PolarHBondContact O-N 3.5Å; G335-V339 VanDerWaalsContact O-CG2 3.31Å; G335-V339 WeakPolarHBondContact O-CG2 3.44Å; G335-V339 PolarHBondContact O-N 3.5Å
336	T	94.7	Very high	94.8	Very high	12 Å²	12	25.9 Å²	25.9	7%	0.074	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-43.5	177.8	-54.5	0	0	0	0	111.6	V59 F254 L257 L332 N333 S334 F338 V339 S340	V59-T336 HydrophobicContact CG1-CG2 3.66Å; F254-T336 HydrophobicContact CD1-CG2 4.43Å; F254-T336 HydrophobicContact CE1-CG2 3.91Å; F254-T336 WeakPolarHBondContact CE1-OG1 3.48Å; L257-T336 HydrophobicContact CD1-CG2 3.77Å; L332-T336 VanDerWaalsContact O-CB 3.31Å; L332-T336 WeakPolarHBondContact O-CB 3.35Å; L332-T336 PolarHBondContact O-N 2.84Å; L332-T336 PolarHBondContact O-OG1 3.17Å; N333-T336 PolarHBondContact O-N 3.11Å; S334-T336 VanDerWaalsContact C-N 3.33Å; S334-T336 PolarHBondContact O-N 3.23Å; T336-F338 VanDerWaalsContact C-N 3.3Å; T336-F338 PolarHBondContact O-N 3.04Å; T336-V339 PolarHBondContact O-N 3.28Å; T336-S340 WeakPolarHBondContact O-CB 3.3Å; T336-S340 PolarHBondContact O-N 2.85Å; T336-S340 PolarHBondContact O-OG 3.08Å
337	S	94.8	Very high	94.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-41.7	173.3	-63.1	0	0	0	0	112.5	N63 F67 N333 S334 S340 G341	N63-S337 PolarHBondContact ND2-OG 3.42Å; F67-S337 VanDerWaalsContact CD1-C 3.49Å; F67-S337 WeakPolarHBondContact CD1-O 3.49Å; F67-S337 VanDerWaalsContact CE1-O 3.3Å; F67-S337 WeakPolarHBondContact CE1-O 3.42Å; N333-S337 PolarHBondContact O-N 3.45Å; N333-S337 VanDerWaalsContact O-N 3.09Å; N333-S337 PolarHBondContact O-OG 2.98Å; S334-S337 PolarHBondContact O-N 3.09Å; S337-S340 WeakPolarHBondContact CA-OG 3.06Å; S337-S340 PolarHBondContact O-OG 2.77Å; S337-G341 PolarHBondContact O-N 3.4Å
338	F	95.1	Very high	94.2	Very high	74 Å²	74	23.6 Å²	23.6	33%	0.325	14%	0.14	S	C	.	.	H	α-helix	trans	-65.7	-45.3	178.4	-174.8	-114.4	0	0	0	111.9	L80 Y277 L278 S334 G335 T336 G341 F342	L80-F338 HydrophobicContact CD1-CE2 4Å; Y277-F338 PolarHBondContact OH-O 3.03Å; L278-F338 HydrophobicContact CD1-CE2 4.44Å; L278-F338 HydrophobicContact CD1-CZ 4.35Å; L278-F338 HydrophobicContact CD2-CE2 3.87Å; S334-F338 PolarHBondContact O-N 3.33Å; G335-F338 PolarHBondContact O-N 3.5Å; T336-F338 VanDerWaalsContact C-N 3.3Å; T336-F338 PolarHBondContact O-N 3.04Å; F338-G341 PolarHBondContact O-N 3Å; F338-F342 AromaticContact CD1-CE2 3.9Å; F338-F342 HydrophobicContact CD1-CE2 3.9Å; F338-F342 HydrophobicContact CD2-CE2 4.48Å; F338-F342 AromaticContact CE1-CE2 3.47Å; F338-F342 HydrophobicContact CE1-CE2 3.47Å; F338-F342 VanDerWaalsContact CE1-CE2 3.47Å; F338-F342 HydrophobicContact CE1-CZ 4.04Å; F338-F342 HydrophobicContact CE2-CE2 4.09Å; F338-F342 HydrophobicContact CG-CE2 4.4Å; F338-F342 AromaticContact CZ-CE2 3.57Å; F338-F342 HydrophobicContact CZ-CE2 3.57Å; F338-F342 AromaticContact CZ-CZ 3.87Å; F338-F342 HydrophobicContact CZ-CZ 3.87Å; F338-F342 VanDerWaalsContact O-CD2 3.27Å; F338-F342 WeakPolarHBondContact O-CD2 3.5Å
339	V	94.9	Very high	94	Very high	59 Å²	59	19 Å²	19	36%	0.358	12%	0.117	S	C	.	.	H	α-helix	trans	-68.9	-41	179.9	172.4	0	0	0	0	112.3	L261 G335 T336 G341 F342 A343	L261-V339 HydrophobicContact CD2-CG1 3.93Å; G335-V339 VanDerWaalsContact O-CG2 3.31Å; G335-V339 WeakPolarHBondContact O-CG2 3.44Å; G335-V339 PolarHBondContact O-N 3.5Å; T336-V339 PolarHBondContact O-N 3.28Å; V339-G341 PolarHBondContact O-N 3.09Å; V339-F342 WeakPolarHBondContact O-CB 3.45Å; V339-F342 PolarHBondContact O-N 3.4Å; V339-F342 VanDerWaalsContact O-N 3.09Å; V339-A343 PolarHBondContact O-N 3.08Å
340	S	93.2	Very high	93.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.5	-34	175.8	65.6	0	0	0	0	111.2	N63 T336 S337 F342 A343 I344	N63-S340 PolarHBondContact O-OG 3.28Å; T336-S340 WeakPolarHBondContact O-CB 3.3Å; T336-S340 PolarHBondContact O-N 2.85Å; T336-S340 PolarHBondContact O-OG 3.08Å; S337-S340 WeakPolarHBondContact CA-OG 3.06Å; S337-S340 PolarHBondContact O-OG 2.77Å; S340-F342 VanDerWaalsContact C-N 3.33Å; S340-F342 PolarHBondContact O-N 3.03Å; S340-A343 WeakPolarHBondContact O-CB 3.49Å; S340-A343 PolarHBondContact O-N 3.43Å; S340-A343 VanDerWaalsContact O-N 3.1Å; S340-I344 WeakPolarHBondContact O-CG1 3.46Å; S340-I344 PolarHBondContact O-N 3.13Å
341	G	93.5	Very high	93.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-41.7	174	0	0	0	0	0	113.3	P68 S337 F338 V339 I344 F345	P68-G341 VanDerWaalsContact CG-CA 3.46Å; S337-G341 PolarHBondContact O-N 3.4Å; F338-G341 PolarHBondContact O-N 3Å; V339-G341 PolarHBondContact O-N 3.09Å; G341-I344 PolarHBondContact O-N 3.45Å; G341-F345 WeakPolarHBondContact O-CB 3.29Å; G341-F345 WeakPolarHBondContact O-CD2 3.45Å; G341-F345 PolarHBondContact O-N 3.42Å
342	F	94.8	Very high	93	Very high	49 Å²	49	16.7 Å²	16.7	22%	0.215	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-42.6	172.5	-70.4	-91.6	0	0	0	112	L261 I274 Y277 L278 F338 V339 S340 S346	L261-F342 HydrophobicContact CD1-CB 3.47Å; L261-F342 VanDerWaalsContact CD1-CB 3.47Å; I274-F342 HydrophobicContact CD1-CD1 4.23Å; I274-F342 HydrophobicContact CG1-CD1 4.12Å; I274-F342 HydrophobicContact CG2-CD1 3.94Å; I274-F342 HydrophobicContact CG2-CE1 3.78Å; Y277-F342 AromaticContact CE1-CD2 3.98Å; Y277-F342 HydrophobicContact CE1-CD2 3.98Å; Y277-F342 HydrophobicContact CE1-CE2 4.07Å; Y277-F342 HydrophobicContact CE1-CG 4.36Å; L278-F342 HydrophobicContact CD1-CE1 3.82Å; L278-F342 HydrophobicContact CD1-CE2 4.23Å; L278-F342 HydrophobicContact CD1-CZ 3.44Å; L278-F342 VanDerWaalsContact CD1-CZ 3.44Å; F338-F342 AromaticContact CD1-CE2 3.9Å; F338-F342 HydrophobicContact CD1-CE2 3.9Å; F338-F342 HydrophobicContact CD2-CE2 4.48Å; F338-F342 AromaticContact CE1-CE2 3.47Å; F338-F342 HydrophobicContact CE1-CE2 3.47Å; F338-F342 VanDerWaalsContact CE1-CE2 3.47Å; F338-F342 HydrophobicContact CE1-CZ 4.04Å; F338-F342 HydrophobicContact CE2-CE2 4.09Å; F338-F342 HydrophobicContact CG-CE2 4.4Å; F338-F342 AromaticContact CZ-CE2 3.57Å; F338-F342 HydrophobicContact CZ-CE2 3.57Å; F338-F342 AromaticContact CZ-CZ 3.87Å; F338-F342 HydrophobicContact CZ-CZ 3.87Å; F338-F342 VanDerWaalsContact O-CD2 3.27Å; F338-F342 WeakPolarHBondContact O-CD2 3.5Å; V339-F342 WeakPolarHBondContact O-CB 3.45Å; V339-F342 PolarHBondContact O-N 3.4Å; V339-F342 VanDerWaalsContact O-N 3.09Å; S340-F342 VanDerWaalsContact C-N 3.33Å; S340-F342 PolarHBondContact O-N 3.03Å; F342-S346 WeakPolarHBondContact O-CB 3.5Å; F342-S346 PolarHBondContact O-N 3.42Å; F342-S346 PolarHBondContact O-OG 2.93Å
343	A	92.9	Very high	92.7	Very high	2 Å²	2	18.8 Å²	18.8	2%	0.017	10%	0.103	C	C	.	.	H	α-helix	trans	-62.3	-44.4	179.4	0	0	0	0	0	111.8	L260 L261 V339 S340 S346 V347	L260-A343 HydrophobicContact CB-CB 4.44Å; L261-A343 HydrophobicContact CB-CB 4.17Å; L261-A343 HydrophobicContact CD1-CB 4.39Å; V339-A343 PolarHBondContact O-N 3.08Å; S340-A343 WeakPolarHBondContact O-CB 3.49Å; S340-A343 PolarHBondContact O-N 3.43Å; S340-A343 VanDerWaalsContact O-N 3.1Å; A343-S346 PolarHBondContact O-OG 2.98Å; A343-S346 VanDerWaalsContact O-OG 3.06Å; A343-V347 WeakPolarHBondContact O-CG2 3.41Å
344	I	91.1	Very high	92.1	Very high	12 Å²	12	21.4 Å²	21.4	6%	0.062	12%	0.116	C	C	.	.	H	α-helix	trans	-71.9	-51.1	179.9	-64	-56.1	0	0	0	111.6	V64 S340 G341 S346 V347 L348 L369 Y374	V64-I344 HydrophobicContact CG1-CD1 3.91Å; V64-I344 HydrophobicContact CG1-CG1 4.14Å; V64-I344 WeakPolarHBondContact O-CG1 3.41Å; S340-I344 WeakPolarHBondContact O-CG1 3.46Å; S340-I344 PolarHBondContact O-N 3.13Å; G341-I344 PolarHBondContact O-N 3.45Å; I344-S346 VanDerWaalsContact C-N 3.34Å; I344-S346 PolarHBondContact O-N 3.38Å; I344-V347 PolarHBondContact O-N 2.69Å; I344-L348 HydrophobicContact CG2-CD1 4.03Å; I344-L348 HydrophobicContact CG2-CG 4.32Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.4Å; I344-L369 HydrophobicContact CG2-CD2 4.24Å; I344-Y374 HydrophobicContact CD1-CD2 4.28Å; I344-Y374 HydrophobicContact CD1-CE2 4.41Å
345	F	92.1	Very high	91.5	Very high	1 Å²	1	21.5 Å²	21.5	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-70.9	-28.5	-174.3	-85.6	-90.4	0	0	0	113.4	P68 Y72 G273 F276 Y277 G341 V347 L348 G349	P68-F345 HydrophobicContact CB-CD2 3.88Å; P68-F345 HydrophobicContact CB-CE2 3.49Å; P68-F345 VanDerWaalsContact CB-CE2 3.49Å; P68-F345 WeakPolarHBondContact O-CE2 3.29Å; Y72-F345 AromaticContact CD1-CE1 3.94Å; Y72-F345 HydrophobicContact CD1-CE1 3.94Å; Y72-F345 HydrophobicContact CD1-CE2 4.2Å; Y72-F345 AromaticContact CD1-CZ 3.27Å; Y72-F345 HydrophobicContact CD1-CZ 3.27Å; Y72-F345 AromaticContact CE1-CZ 3.89Å; Y72-F345 HydrophobicContact CE1-CZ 3.89Å; Y72-F345 HydrophobicContact CG-CE1 4.18Å; Y72-F345 AromaticContact CG-CZ 3.91Å; Y72-F345 HydrophobicContact CG-CZ 3.91Å; G273-F345 VanDerWaalsContact CA-O 3.27Å; G273-F345 WeakPolarHBondContact CA-O 3.31Å; F276-F345 HydrophobicContact CD1-CD1 4.22Å; F276-F345 AromaticContact CD1-CE1 3.78Å; F276-F345 HydrophobicContact CD1-CE1 3.78Å; F276-F345 HydrophobicContact CE1-CE1 4.33Å; Y277-F345 HydrophobicContact CD2-CD2 4Å; Y277-F345 HydrophobicContact CD2-CE2 4.3Å; Y277-F345 HydrophobicContact CD2-CG 4.5Å; Y277-F345 HydrophobicContact CG-CB 4.33Å; Y277-F345 AromaticContact CG-CD2 3.99Å; Y277-F345 HydrophobicContact CG-CD2 3.99Å; Y277-F345 HydrophobicContact CG-CG 4.1Å; G341-F345 WeakPolarHBondContact O-CB 3.29Å; G341-F345 WeakPolarHBondContact O-CD2 3.45Å; G341-F345 PolarHBondContact O-N 3.42Å; F345-V347 VanDerWaalsContact C-N 3.33Å; F345-L348 HydrophobicContact CD1-CD1 4.19Å; F345-L348 HydrophobicContact CE1-CD1 4Å; F345-L348 HydrophobicContact CZ-CD1 4.15Å; F345-L348 PolarHBondContact O-N 2.78Å; F345-G349 PolarHBondContact O-N 3.01Å
346	S	94.4	Very high	90.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-39.5	171.5	57.9	0	0	0	0	112.3	G264 F342 A343 I344 G349 F350	G264-S346 VanDerWaalsContact C-CB 3.42Å; G264-S346 VanDerWaalsContact C-OG 3.23Å; G264-S346 VanDerWaalsContact CA-OG 3.24Å; G264-S346 WeakPolarHBondContact CA-OG 3.47Å; G264-S346 WeakPolarHBondContact O-CB 3.37Å; F342-S346 WeakPolarHBondContact O-CB 3.5Å; F342-S346 PolarHBondContact O-N 3.42Å; F342-S346 PolarHBondContact O-OG 2.93Å; A343-S346 PolarHBondContact O-OG 2.98Å; A343-S346 VanDerWaalsContact O-OG 3.06Å; I344-S346 VanDerWaalsContact C-N 3.34Å; I344-S346 PolarHBondContact O-N 3.38Å; S346-G349 PolarHBondContact O-N 2.9Å; S346-F350 PolarHBondContact O-N 2.87Å; S346-F350 VanDerWaalsContact O-N 3.14Å
347	V	91.4	Very high	90.2	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-69.3	-39.7	174.3	173.3	0	0	0	0	111.9	L267 A343 I344 F345 G349 F350 M351 Y374 A377 M381	L267-V347 HydrophobicContact CD1-CG2 4.29Å; A343-V347 WeakPolarHBondContact O-CG2 3.41Å; I344-V347 PolarHBondContact O-N 2.69Å; F345-V347 VanDerWaalsContact C-N 3.33Å; V347-G349 VanDerWaalsContact C-N 3.35Å; V347-F350 WeakPolarHBondContact O-CB 3.49Å; V347-F350 PolarHBondContact O-N 2.85Å; V347-M351 PolarHBondContact O-N 3.49Å; V347-Y374 HydrophobicContact CG1-CE2 4.49Å; V347-A377 HydrophobicContact CG1-CB 3.43Å; V347-A377 VanDerWaalsContact CG1-CB 3.43Å; V347-M381 HydrophobicContact CB-CE 4.42Å; V347-M381 HydrophobicContact CG1-CE 3.53Å; V347-M381 HydrophobicContact CG2-CE 4.09Å
348	L	90.1	Very high	89.7	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-37.4	174.2	-67.7	178	0	0	0	112.3	I344 F345 F350 M351 A352 I359 V362 L369 A373	I344-L348 HydrophobicContact CG2-CD1 4.03Å; I344-L348 HydrophobicContact CG2-CG 4.32Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.4Å; F345-L348 HydrophobicContact CD1-CD1 4.19Å; F345-L348 HydrophobicContact CE1-CD1 4Å; F345-L348 HydrophobicContact CZ-CD1 4.15Å; F345-L348 PolarHBondContact O-N 2.78Å; L348-F350 VanDerWaalsContact C-N 3.33Å; L348-F350 PolarHBondContact O-N 3.2Å; L348-M351 HydrophobicContact CD2-SD 4.37Å; L348-M351 WeakPolarHBondContact O-CB 3.41Å; L348-M351 PolarHBondContact O-N 3.21Å; L348-A352 WeakPolarHBondContact O-CB 3.11Å; L348-A352 PolarHBondContact O-N 2.92Å; L348-I359 HydrophobicContact CB-CD1 4.24Å; L348-I359 HydrophobicContact CB-CG1 4.3Å; L348-V362 HydrophobicContact CB-CG2 4.47Å; L348-V362 HydrophobicContact CD2-CG2 4.45Å; L348-L369 HydrophobicContact CD1-CD1 4.09Å; L348-L369 HydrophobicContact CD2-CD1 4.38Å; L348-A373 HydrophobicContact CD2-CB 4.05Å
349	G	92.1	Very high	89.1	Confident	2 Å²	2	25.9 Å²	25.9	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-41.3	175.1	0	0	0	0	0	112.1	G269 F345 S346 V347 A352 Q353	G269-G349 CarbonylContact O-C 3.41Å; G269-G349 WeakPolarHBondContact O-CA 3.4Å; F345-G349 PolarHBondContact O-N 3.01Å; S346-G349 PolarHBondContact O-N 2.9Å; V347-G349 VanDerWaalsContact C-N 3.35Å; G349-A352 PolarHBondContact O-N 3.42Å; G349-Q353 WeakPolarHBondContact O-CB 3.17Å; G349-Q353 PolarHBondContact O-N 3.14Å
350	F	90.8	Very high	88.6	Confident	10 Å²	10	25.6 Å²	25.6	4%	0.044	16%	0.155	C	C	.	.	H	α-helix	trans	-58.7	-48.5	170	165.1	-106.8	0	0	0	112.6	L267 P268 S346 V347 L348 A352 Q353 E354 M380 M381	L267-F350 HydrophobicContact CB-CB 3.74Å; L267-F350 HydrophobicContact CB-CD2 3.89Å; L267-F350 HydrophobicContact CB-CG 3.87Å; L267-F350 HydrophobicContact CD1-CB 3.94Å; L267-F350 HydrophobicContact CD1-CD1 3.84Å; L267-F350 HydrophobicContact CD1-CD2 4.44Å; L267-F350 HydrophobicContact CD1-CE1 4.47Å; L267-F350 HydrophobicContact CD1-CG 3.8Å; L267-F350 HydrophobicContact CD2-CD1 4.43Å; L267-F350 HydrophobicContact CD2-CD2 4.04Å; L267-F350 HydrophobicContact CD2-CE1 4.46Å; L267-F350 HydrophobicContact CD2-CE2 4.08Å; L267-F350 HydrophobicContact CD2-CG 4.2Å; L267-F350 HydrophobicContact CD2-CZ 4.29Å; L267-F350 HydrophobicContact CG-CB 4.38Å; L267-F350 HydrophobicContact CG-CD2 4.34Å; L267-F350 HydrophobicContact CG-CG 4.17Å; P268-F350 HydrophobicContact CG-CD2 3.79Å; P268-F350 HydrophobicContact CG-CE2 3.98Å; P268-F350 WeakPolarHBondContact O-CA 3.38Å; P268-F350 WeakPolarHBondContact O-CB 3.26Å; P268-F350 WeakPolarHBondContact O-CD2 3.47Å; S346-F350 PolarHBondContact O-N 2.87Å; S346-F350 VanDerWaalsContact O-N 3.14Å; V347-F350 WeakPolarHBondContact O-CB 3.49Å; V347-F350 PolarHBondContact O-N 2.85Å; L348-F350 VanDerWaalsContact C-N 3.33Å; L348-F350 PolarHBondContact O-N 3.2Å; F350-A352 VanDerWaalsContact C-N 3.34Å; F350-A352 PolarHBondContact O-N 3.19Å; F350-Q353 PolarHBondContact O-N 3.08Å; F350-E354 HydrophobicContact CD2-CG 3.82Å; F350-E354 HydrophobicContact CE1-CG 4.28Å; F350-E354 HydrophobicContact CE2-CG 3.33Å; F350-E354 HydrophobicContact CG-CG 4.49Å; F350-E354 HydrophobicContact CZ-CG 3.6Å; F350-E354 WeakPolarHBondContact O-CB 3.38Å; F350-E354 WeakPolarHBondContact O-CG 3.4Å; F350-E354 PolarHBondContact O-N 3.12Å; F350-M380 HydrophobicContact CE1-CB 3.93Å; F350-M380 HydrophobicContact CZ-CB 4.18Å; F350-M381 HydrophobicContact CD1-CE 4.37Å; F350-M381 HydrophobicContact CE1-CE 4.47Å; F350-M381 HydrophobicContact CE1-CG 4.01Å
351	M	88.4	Confident	87.8	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-43.4	179.1	179.9	-177.4	164.3	0	0	112.3	V347 L348 E354 Q355 V362 K376 A377	V347-M351 PolarHBondContact O-N 3.49Å; L348-M351 HydrophobicContact CD2-SD 4.37Å; L348-M351 WeakPolarHBondContact O-CB 3.41Å; L348-M351 PolarHBondContact O-N 3.21Å; M351-E354 PolarHBondContact O-N 3.22Å; M351-Q355 VanDerWaalsContact CG-NE2 3.25Å; M351-Q355 WeakPolarHBondContact O-CB 3Å; M351-Q355 WeakPolarHBondContact O-CG 3.37Å; M351-Q355 PolarHBondContact O-N 3.14Å; M351-V362 HydrophobicContact CE-CB 3.74Å; M351-V362 HydrophobicContact CE-CG1 3.78Å; M351-V362 HydrophobicContact CG-CG1 4.36Å; M351-V362 HydrophobicContact SD-CB 4.06Å; M351-V362 HydrophobicContact SD-CG1 4.41Å; M351-K376 HydrophobicContact CE-CB 4.09Å; M351-K376 HydrophobicContact CE-CD 3.41Å; M351-K376 VanDerWaalsContact CE-CD 3.41Å; M351-K376 HydrophobicContact CE-CG 3.7Å; M351-A377 HydrophobicContact CB-CB 4.23Å; M351-A377 HydrophobicContact SD-CB 4.17Å
352	A	88.4	Confident	87.2	Confident	8 Å²	8	32 Å²	32	7%	0.066	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-44.6	176.6	0	0	0	0	0	111.7	L348 G349 F350 Q355 G356 V357 I359 V362	L348-A352 WeakPolarHBondContact O-CB 3.11Å; L348-A352 PolarHBondContact O-N 2.92Å; G349-A352 PolarHBondContact O-N 3.42Å; F350-A352 VanDerWaalsContact C-N 3.34Å; F350-A352 PolarHBondContact O-N 3.19Å; A352-Q355 PolarHBondContact O-N 3.36Å; A352-G356 WeakPolarHBondContact O-CA 3.42Å; A352-G356 PolarHBondContact O-N 3.28Å; A352-V357 PolarHBondContact O-N 2.88Å; A352-V357 VanDerWaalsContact O-N 3.14Å; A352-I359 HydrophobicContact CB-CB 3.97Å; A352-I359 HydrophobicContact CB-CG1 3.94Å; A352-V362 HydrophobicContact CB-CG2 4.2Å
353	Q	87.7	Confident	86.2	Confident	110 Å²	110	30.1 Å²	30.1	51%	0.514	18%	0.179	S	C	.	.	H	α-helix	trans	-64.3	-44.2	176.8	177.7	166.8	-23.7	0	0	112.4	G349 F350 Q355 G356	G349-Q353 WeakPolarHBondContact O-CB 3.17Å; G349-Q353 PolarHBondContact O-N 3.14Å; F350-Q353 PolarHBondContact O-N 3.08Å; Q353-Q355 VanDerWaalsContact C-N 3.29Å; Q353-Q355 PolarHBondContact O-N 2.84Å; Q353-G356 PolarHBondContact O-N 2.93Å
354	E	84.3	Confident	85.3	Confident	56 Å²	56	33.5 Å²	33.5	26%	0.262	19%	0.194	S	C	.	.	H	α-helix	trans	-65.3	-33.1	179	-77.1	-62.7	140	0	0	112.7	K178 F350 M351 M380	K178-E354 WeakPolarHBondContact CE-O 3.4Å; K178-E354 IonicContact NZ-OE2 3.96Å; K178-E354 PolarHBondContact NZ-OE2 3.08Å; F350-E354 HydrophobicContact CD2-CG 3.82Å; F350-E354 HydrophobicContact CE1-CG 4.28Å; F350-E354 HydrophobicContact CE2-CG 3.33Å; F350-E354 HydrophobicContact CG-CG 4.49Å; F350-E354 HydrophobicContact CZ-CG 3.6Å; F350-E354 WeakPolarHBondContact O-CB 3.38Å; F350-E354 WeakPolarHBondContact O-CG 3.4Å; F350-E354 PolarHBondContact O-N 3.12Å; M351-E354 PolarHBondContact O-N 3.22Å; E354-M380 HydrophobicContact CB-SD 4.2Å
355	Q	81.1	Confident	84.4	Confident	11 Å²	11	35.9 Å²	35.9	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-87.6	-14.7	177.5	-70.6	175.1	30.3	0	0	113.5	M351 A352 Q353 V357 M380	M351-Q355 VanDerWaalsContact CG-NE2 3.25Å; M351-Q355 WeakPolarHBondContact O-CB 3Å; M351-Q355 WeakPolarHBondContact O-CG 3.37Å; M351-Q355 PolarHBondContact O-N 3.14Å; A352-Q355 PolarHBondContact O-N 3.36Å; Q353-Q355 VanDerWaalsContact C-N 3.29Å; Q353-Q355 PolarHBondContact O-N 2.84Å; Q355-V357 VanDerWaalsContact C-N 3.33Å; Q355-V357 HydrophobicContact CB-CG2 3.88Å; Q355-M380 HydrophobicContact CG-CE 3.98Å; Q355-M380 HydrophobicContact CG-SD 4.42Å
356	G	80.5	Confident	83.6	Confident	68 Å²	68	37.3 Å²	37.3	70%	0.701	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	32.4	-175.7	0	0	0	0	0	113.8	A352 Q353	A352-G356 WeakPolarHBondContact O-CA 3.42Å; A352-G356 PolarHBondContact O-N 3.28Å; Q353-G356 PolarHBondContact O-N 2.93Å
357	V	81.9	Confident	83.1	Confident	33 Å²	33	38 Å²	38	20%	0.2	23%	0.231	C	C	.	.	S	Bend	trans	-117	164.1	178.5	-64.8	0	0	0	0	112	R177 A352 Q355 V362	R177-V357 VanDerWaalsContact NH1-CG1 3.34Å; A352-V357 PolarHBondContact O-N 2.88Å; A352-V357 VanDerWaalsContact O-N 3.14Å; Q355-V357 VanDerWaalsContact C-N 3.33Å; Q355-V357 HydrophobicContact CB-CG2 3.88Å; V357-V362 HydrophobicContact CG2-CG1 3.68Å
358	D	85	Confident	82.8	Confident	96 Å²	96	38.2 Å²	38.2	51%	0.513	23%	0.234	S	C	.	.			trans	-66.3	144.4	171.6	-168.8	-87.7	0	0	0	110.5	A360 E361	D358-A360 PolarHBondContact O-N 3.44Å; D358-A360 WeakPolarHBondContact OD1-CB 3.17Å; D358-A360 PolarHBondContact OD1-N 3.5Å; D358-E361 WeakPolarHBondContact O-CB 3.37Å; D358-E361 PolarHBondContact O-N 2.99Å; D358-E361 VanDerWaalsContact O-N 3.07Å
359	I	83.7	Confident	82.5	Confident	13 Å²	13	38.5 Å²	38.5	7%	0.067	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23.7	-175.7	-156.1	174	0	0	0	112.7	F276 L348 A352 E361 V362 A363	F276-I359 HydrophobicContact CB-CD1 4.25Å; F276-I359 HydrophobicContact CB-CG2 3.67Å; F276-I359 HydrophobicContact CD1-CG2 3.5Å; F276-I359 HydrophobicContact CD2-CG2 3.17Å; F276-I359 HydrophobicContact CE1-CG2 3.79Å; F276-I359 HydrophobicContact CE2-CG2 3.5Å; F276-I359 HydrophobicContact CG-CG2 3.15Å; F276-I359 HydrophobicContact CZ-CG2 3.79Å; L348-I359 HydrophobicContact CB-CD1 4.24Å; L348-I359 HydrophobicContact CB-CG1 4.3Å; A352-I359 HydrophobicContact CB-CB 3.97Å; A352-I359 HydrophobicContact CB-CG1 3.94Å; I359-E361 PolarHBondContact O-N 2.83Å; I359-V362 HydrophobicContact CG1-CG2 3.89Å; I359-V362 VanDerWaalsContact O-CG2 3.22Å; I359-V362 WeakPolarHBondContact O-CG2 3.49Å; I359-V362 PolarHBondContact O-N 3.39Å; I359-A363 WeakPolarHBondContact O-CB 3.48Å; I359-A363 PolarHBondContact O-N 3.36Å; I359-A363 VanDerWaalsContact O-N 3.17Å
360	A	83.3	Confident	82.4	Confident	53 Å²	53	38.7 Å²	38.7	44%	0.438	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-63.7	-25.8	174	0	0	0	0	0	112.3	F276 D358	F276-A360 HydrophobicContact CE2-CB 4.27Å; F276-A360 HydrophobicContact CZ-CB 3.84Å; D358-A360 PolarHBondContact O-N 3.44Å; D358-A360 WeakPolarHBondContact OD1-CB 3.17Å; D358-A360 PolarHBondContact OD1-N 3.5Å
361	E	77.4	Confident	82.5	Confident	129 Å²	129	38.2 Å²	38.2	60%	0.603	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-78.5	-19.1	177.4	-62.9	-173.1	179.4	0	0	113.2	D358 I359	D358-E361 WeakPolarHBondContact O-CB 3.37Å; D358-E361 PolarHBondContact O-N 2.99Å; D358-E361 VanDerWaalsContact O-N 3.07Å; I359-E361 PolarHBondContact O-N 2.83Å
362	V	79.4	Confident	82.6	Confident	6 Å²	6	38.8 Å²	38.8	4%	0.036	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-10.8	178.9	-55.2	0	0	0	0	113	L348 M351 A352 V357 I359 E364	L348-V362 HydrophobicContact CB-CG2 4.47Å; L348-V362 HydrophobicContact CD2-CG2 4.45Å; M351-V362 HydrophobicContact CE-CB 3.74Å; M351-V362 HydrophobicContact CE-CG1 3.78Å; M351-V362 HydrophobicContact CG-CG1 4.36Å; M351-V362 HydrophobicContact SD-CB 4.06Å; M351-V362 HydrophobicContact SD-CG1 4.41Å; A352-V362 HydrophobicContact CB-CG2 4.2Å; V357-V362 HydrophobicContact CG2-CG1 3.68Å; I359-V362 HydrophobicContact CG1-CG2 3.89Å; I359-V362 VanDerWaalsContact O-CG2 3.22Å; I359-V362 WeakPolarHBondContact O-CG2 3.49Å; I359-V362 PolarHBondContact O-N 3.39Å; V362-E364 PolarHBondContact O-N 2.9Å; V362-E364 VanDerWaalsContact O-N 3.14Å
363	A	75.1	Confident	82.6	Confident	10 Å²	10	38.4 Å²	38.4	8%	0.083	24%	0.235	C	C	.	.			trans	-83.3	86	-178.2	0	0	0	0	0	111.4	Y72 I359	Y72-A363 HydrophobicContact CE1-CB 4.07Å; Y72-A363 HydrophobicContact CE2-CB 4.33Å; Y72-A363 PolarHBondContact OH-O 3.02Å; Y72-A363 VanDerWaalsContact OH-O 3.07Å; I359-A363 WeakPolarHBondContact O-CB 3.48Å; I359-A363 PolarHBondContact O-N 3.36Å; I359-A363 VanDerWaalsContact O-N 3.17Å
364	E	74.1	Confident	82.7	Confident	73 Å²	73	33.8 Å²	33.8	34%	0.341	21%	0.213	S	C	.	.			trans	-73	158.5	175.5	-71.5	-63.5	166.5	0	0	113.3	Y69 V362 A373	Y69-E364 WeakPolarHBondContact CD2-O 3.34Å; V362-E364 PolarHBondContact O-N 2.9Å; V362-E364 VanDerWaalsContact O-N 3.14Å; E364-A373 HydrophobicContact CB-CB 4.37Å; E364-A373 HydrophobicContact CG-CB 4.38Å
365	S	70.9	Confident	83.1	Confident	62 Å²	62	31.1 Å²	31.1	43%	0.434	20%	0.201	S	C	.	.			trans	-104	149.8	177.5	75.7	0	0	0	0	112.9	Y69 G368	Y69-S365 WeakPolarHBondContact OH-CB 3.33Å; S365-G368 PolarHBondContact O-N 3.26Å
366	G	75.6	Confident	83.5	Confident	30 Å²	30	31.4 Å²	31.4	31%	0.309	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	-136.4	173.7	0	0	0	0	0	113	G368 L369	G366-G368 PolarHBondContact O-N 2.9Å; G366-G368 VanDerWaalsContact O-N 3.16Å; G366-L369 PolarHBondContact O-N 3.48Å; G366-L369 VanDerWaalsContact O-N 3.13Å
367	P	83.3	Confident	83.9	Confident	15 Å²	15	28.2 Å²	28.2	10%	0.097	17%	0.169	C	C	.	.	H	α-helix	trans	-56.9	-28.3	178.5	-27.9	37.4	0	0	0	114.4	W65 W144 W199 L369 A370 F371 M452 F455	W65-P367 HydrophobicContact CH2-CG 4.46Å; W65-P367 HydrophobicContact CZ3-CB 4.47Å; W144-P367 HydrophobicContact CZ3-CB 4.09Å; W144-P367 HydrophobicContact CZ3-CG 4.03Å; W199-P367 HydrophobicContact CZ2-CB 4.28Å; P367-L369 PolarHBondContact O-N 3.46Å; P367-A370 PolarHBondContact O-N 3.42Å; P367-F371 HydrophobicContact CB-CD2 3.98Å; P367-F371 HydrophobicContact CB-CE2 4.41Å; P367-F371 WeakPolarHBondContact O-CB 3.26Å; P367-F371 VanDerWaalsContact O-CD2 3.26Å; P367-F371 WeakPolarHBondContact O-CD2 3.48Å; P367-F371 PolarHBondContact O-N 3.49Å; P367-M452 HydrophobicContact CG-CE 4.18Å; P367-F455 HydrophobicContact CG-CE1 4.07Å; P367-F455 HydrophobicContact CG-CZ 4.44Å
368	G	85.8	Confident	84.3	Confident	10 Å²	10	26.7 Å²	26.7	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-31	177.9	0	0	0	0	0	112.9	S365 G366 I372 A373	S365-G368 PolarHBondContact O-N 3.26Å; G366-G368 PolarHBondContact O-N 2.9Å; G366-G368 VanDerWaalsContact O-N 3.16Å; G368-I372 VanDerWaalsContact O-CA 3.32Å; G368-I372 WeakPolarHBondContact O-CA 3.5Å; G368-I372 WeakPolarHBondContact O-CB 3.23Å; G368-I372 PolarHBondContact O-N 3.49Å; G368-A373 PolarHBondContact O-N 3.2Å
369	L	84.4	Confident	84.6	Confident	9 Å²	9	23.9 Å²	23.9	5%	0.047	15%	0.146	C	C	.	.	I	π-helix	trans	-66	-43.8	178.7	-169.8	65.6	0	0	0	112.3	W65 I344 L348 G366 P367 A373 Y374	W65-L369 HydrophobicContact CB-CD2 3.94Å; W65-L369 VanDerWaalsContact O-CD2 3.23Å; W65-L369 WeakPolarHBondContact O-CD2 3.18Å; I344-L369 HydrophobicContact CG2-CD2 4.24Å; L348-L369 HydrophobicContact CD1-CD1 4.09Å; L348-L369 HydrophobicContact CD2-CD1 4.38Å; G366-L369 PolarHBondContact O-N 3.48Å; G366-L369 VanDerWaalsContact O-N 3.13Å; P367-L369 PolarHBondContact O-N 3.46Å; L369-A373 HydrophobicContact CD1-CB 4.04Å; L369-Y374 WeakPolarHBondContact O-CB 2.92Å; L369-Y374 PolarHBondContact O-N 3.12Å
370	A	88.8	Confident	84.7	Confident	6 Å²	6	25.7 Å²	25.7	5%	0.05	15%	0.154	C	C	.	.	I	π-helix	trans	-86.7	-26.6	-179.2	0	0	0	0	0	114.2	W65 P367 P375 F391 L395	W65-A370 HydrophobicContact CE3-CB 3.4Å; W65-A370 HydrophobicContact CZ3-CB 3.69Å; P367-A370 PolarHBondContact O-N 3.42Å; A370-P375 WeakPolarHBondContact O-CD 3.24Å; A370-P375 WeakPolarHBondContact O-CG 3.33Å; A370-F391 HydrophobicContact CB-CE1 4.39Å; A370-F391 HydrophobicContact CB-CZ 3.97Å; A370-F391 WeakPolarHBondContact O-CE1 2.94Å; A370-L395 HydrophobicContact CB-CD1 3.85Å
371	F	92.9	Very high	84.9	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.136	C	C	.	.	I	π-helix	trans	-106.4	-7.7	-175.8	-61	-67.4	0	0	0	114	W65 I141 W144 Y148 W199 P367 F392 L395	W65-F371 HydrophobicContact CH2-CE2 4.41Å; W65-F371 HydrophobicContact CZ3-CD2 4.43Å; W65-F371 AromaticContact CZ3-CE2 3.95Å; W65-F371 HydrophobicContact CZ3-CE2 3.95Å; I141-F371 HydrophobicContact CG2-CE2 4.08Å; I141-F371 HydrophobicContact CG2-CZ 4.2Å; W144-F371 HydrophobicContact CB-CD1 4.46Å; W144-F371 HydrophobicContact CB-CE1 3.81Å; W144-F371 HydrophobicContact CB-CE2 4.11Å; W144-F371 HydrophobicContact CB-CZ 3.61Å; W144-F371 HydrophobicContact CE3-CD2 4.33Å; W144-F371 AromaticContact CE3-CE2 3.8Å; W144-F371 HydrophobicContact CE3-CE2 3.8Å; W144-F371 HydrophobicContact CE3-CZ 4.39Å; Y148-F371 AromaticContact CD2-CD1 3.52Å; Y148-F371 HydrophobicContact CD2-CD1 3.52Å; Y148-F371 AromaticContact CD2-CE1 3.95Å; Y148-F371 HydrophobicContact CD2-CE1 3.95Å; Y148-F371 HydrophobicContact CE2-CB 4.09Å; Y148-F371 AromaticContact CE2-CD1 3.48Å; Y148-F371 HydrophobicContact CE2-CD1 3.48Å; Y148-F371 VanDerWaalsContact CE2-CD1 3.48Å; Y148-F371 HydrophobicContact CE2-CE1 4.31Å; Y148-F371 HydrophobicContact CE2-CG 4.13Å; Y148-F371 HydrophobicContact CG-CD1 4.22Å; Y148-F371 PolarHBondContact OH-O 3.27Å; W199-F371 HydrophobicContact CD2-CB 4.06Å; W199-F371 HydrophobicContact CE3-CB 3.6Å; W199-F371 HydrophobicContact CE3-CG 4.14Å; W199-F371 HydrophobicContact CH2-CB 4.03Å; W199-F371 AromaticContact CH2-CD2 3.73Å; W199-F371 HydrophobicContact CH2-CD2 3.73Å; W199-F371 HydrophobicContact CH2-CE2 4.41Å; W199-F371 AromaticContact CH2-CG 3.92Å; W199-F371 HydrophobicContact CH2-CG 3.92Å; W199-F371 HydrophobicContact CZ2-CB 4.48Å; W199-F371 HydrophobicContact CZ2-CD2 4.46Å; W199-F371 HydrophobicContact CZ3-CB 3.58Å; W199-F371 HydrophobicContact CZ3-CD1 4.12Å; W199-F371 AromaticContact CZ3-CD2 3.89Å; W199-F371 HydrophobicContact CZ3-CD2 3.89Å; W199-F371 AromaticContact CZ3-CG 3.59Å; W199-F371 HydrophobicContact CZ3-CG 3.59Å; P367-F371 HydrophobicContact CB-CD2 3.98Å; P367-F371 HydrophobicContact CB-CE2 4.41Å; P367-F371 WeakPolarHBondContact O-CB 3.26Å; P367-F371 VanDerWaalsContact O-CD2 3.26Å; P367-F371 WeakPolarHBondContact O-CD2 3.48Å; P367-F371 PolarHBondContact O-N 3.49Å; F371-F392 AromaticContact CD1-CE1 3.96Å; F371-F392 HydrophobicContact CD1-CE1 3.96Å; F371-F392 AromaticContact CE1-CE1 3.95Å; F371-F392 HydrophobicContact CE1-CE1 3.95Å; F371-L395 HydrophobicContact CE1-CD1 4.15Å; F371-L395 HydrophobicContact CZ-CD1 4.05Å; F371-L395 HydrophobicContact CZ-CD2 4.36Å
372	I	90.9	Very high	85.4	Confident	16 Å²	16	21 Å²	21	8%	0.082	13%	0.13	C	C	.	.	I	π-helix	trans	-123.9	-63.7	175.2	-52	174.3	0	0	0	110.6	V195 W199 G368 Y374 P375 K376	V195-I372 HydrophobicContact CG1-CG2 4.33Å; V195-I372 WeakPolarHBondContact CG1-O 3.24Å; W199-I372 HydrophobicContact CB-CD1 4.46Å; W199-I372 HydrophobicContact CB-CG1 4.07Å; W199-I372 HydrophobicContact CG-CD1 4.16Å; W199-I372 HydrophobicContact CG-CG1 4Å; G368-I372 VanDerWaalsContact O-CA 3.32Å; G368-I372 WeakPolarHBondContact O-CA 3.5Å; G368-I372 WeakPolarHBondContact O-CB 3.23Å; G368-I372 PolarHBondContact O-N 3.49Å; I372-Y374 PolarHBondContact O-N 2.93Å; I372-P375 WeakPolarHBondContact O-CD 3.47Å; I372-K376 WeakPolarHBondContact O-CB 3.24Å; I372-K376 PolarHBondContact O-N 2.95Å; I372-K376 VanDerWaalsContact O-N 3.11Å
373	A	89.3	Confident	85.9	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.008	16%	0.162	C	C	.	.	I	π-helix	trans	-64.8	-46.7	-172.5	0	0	0	0	0	112.6	L348 E364 G368 L369 K376 A377	L348-A373 HydrophobicContact CD2-CB 4.05Å; E364-A373 HydrophobicContact CB-CB 4.37Å; E364-A373 HydrophobicContact CG-CB 4.38Å; G368-A373 PolarHBondContact O-N 3.2Å; L369-A373 HydrophobicContact CD1-CB 4.04Å; A373-K376 WeakPolarHBondContact O-CB 3.29Å; A373-K376 PolarHBondContact O-N 2.8Å; A373-A377 PolarHBondContact O-N 3.19Å
374	Y	88.6	Confident	86.7	Confident	12 Å²	12	30 Å²	30	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-68.2	-48.1	-178.8	-166.3	-82.5	0	0	0	113.6	L260 I344 V347 L369 I372 K376 A377 V378 F391	L260-Y374 WeakPolarHBondContact CD1-OH 3.49Å; L260-Y374 WeakPolarHBondContact CD2-OH 3.38Å; I344-Y374 HydrophobicContact CD1-CD2 4.28Å; I344-Y374 HydrophobicContact CD1-CE2 4.41Å; V347-Y374 HydrophobicContact CG1-CE2 4.49Å; L369-Y374 WeakPolarHBondContact O-CB 2.92Å; L369-Y374 PolarHBondContact O-N 3.12Å; I372-Y374 PolarHBondContact O-N 2.93Å; Y374-K376 PolarHBondContact O-N 2.92Å; Y374-A377 PolarHBondContact O-N 3.36Å; Y374-A377 VanDerWaalsContact O-N 3.08Å; Y374-V378 HydrophobicContact CD1-CG2 3.67Å; Y374-V378 HydrophobicContact CE1-CG2 3.26Å; Y374-V378 WeakPolarHBondContact O-CG2 3.39Å; Y374-V378 PolarHBondContact O-N 3.4Å; Y374-F391 HydrophobicContact CD1-CB 4.17Å; Y374-F391 AromaticContact CD1-CD1 3.42Å; Y374-F391 HydrophobicContact CD1-CD1 3.42Å; Y374-F391 VanDerWaalsContact CD1-CD1 3.42Å; Y374-F391 AromaticContact CD1-CD2 3.48Å; Y374-F391 HydrophobicContact CD1-CD2 3.48Å; Y374-F391 VanDerWaalsContact CD1-CD2 3.48Å; Y374-F391 AromaticContact CD1-CE1 3.49Å; Y374-F391 HydrophobicContact CD1-CE1 3.49Å; Y374-F391 VanDerWaalsContact CD1-CE1 3.49Å; Y374-F391 AromaticContact CD1-CE2 3.55Å; Y374-F391 HydrophobicContact CD1-CE2 3.55Å; Y374-F391 AromaticContact CD1-CG 3.4Å; Y374-F391 HydrophobicContact CD1-CG 3.4Å; Y374-F391 VanDerWaalsContact CD1-CG 3.4Å; Y374-F391 AromaticContact CD1-CZ 3.55Å; Y374-F391 HydrophobicContact CD1-CZ 3.55Å; Y374-F391 HydrophobicContact CD2-CD2 4.18Å; Y374-F391 AromaticContact CD2-CE2 3.79Å; Y374-F391 HydrophobicContact CD2-CE2 3.79Å; Y374-F391 HydrophobicContact CD2-CZ 4.2Å; Y374-F391 HydrophobicContact CE1-CB 3.42Å; Y374-F391 VanDerWaalsContact CE1-CB 3.42Å; Y374-F391 AromaticContact CE1-CD1 3.61Å; Y374-F391 HydrophobicContact CE1-CD1 3.61Å; Y374-F391 AromaticContact CE1-CD2 3.12Å; Y374-F391 HydrophobicContact CE1-CD2 3.12Å; Y374-F391 HydrophobicContact CE1-CE1 4.1Å; Y374-F391 AromaticContact CE1-CE2 3.67Å; Y374-F391 HydrophobicContact CE1-CE2 3.67Å; Y374-F391 AromaticContact CE1-CG 3.07Å; Y374-F391 HydrophobicContact CE1-CG 3.07Å; Y374-F391 HydrophobicContact CE1-CZ 4.12Å; Y374-F391 AromaticContact CE2-CD2 3.86Å; Y374-F391 HydrophobicContact CE2-CD2 3.86Å; Y374-F391 AromaticContact CE2-CE2 3.88Å; Y374-F391 HydrophobicContact CE2-CE2 3.88Å; Y374-F391 HydrophobicContact CG-CD1 4.31Å; Y374-F391 AromaticContact CG-CD2 4Å; Y374-F391 HydrophobicContact CG-CD2 4Å; Y374-F391 AromaticContact CG-CE1 3.97Å; Y374-F391 HydrophobicContact CG-CE1 3.97Å; Y374-F391 AromaticContact CG-CE2 3.61Å; Y374-F391 HydrophobicContact CG-CE2 3.61Å; Y374-F391 HydrophobicContact CG-CG 4.32Å; Y374-F391 AromaticContact CG-CZ 3.6Å; Y374-F391 HydrophobicContact CG-CZ 3.6Å; Y374-F391 AromaticContact CZ-CD2 3.31Å; Y374-F391 AromaticContact CZ-CE2 3.82Å; Y374-F391 AromaticContact CZ-CG 3.76Å
375	P	92.1	Very high	87.6	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-34.6	176.1	-26.3	38.5	0	0	0	112	Y148 W159 V195 A370 I372 V378 T379 F392	Y148-P375 HydrophobicContact CE1-CG 4.33Å; W159-P375 HydrophobicContact CZ2-CB 4.5Å; V195-P375 HydrophobicContact CG1-CB 4.12Å; A370-P375 WeakPolarHBondContact O-CD 3.24Å; A370-P375 WeakPolarHBondContact O-CG 3.33Å; I372-P375 WeakPolarHBondContact O-CD 3.47Å; P375-V378 PolarHBondContact O-N 3.02Å; P375-T379 WeakPolarHBondContact O-CG2 3.39Å; P375-T379 PolarHBondContact O-N 3.04Å; P375-T379 VanDerWaalsContact O-N 3.1Å; P375-T379 PolarHBondContact O-OG1 3.28Å; P375-F392 HydrophobicContact CG-CZ 3.82Å
376	K	90.3	Very high	88.6	Confident	17 Å²	17	30.2 Å²	30.2	7%	0.074	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-41.9	173.5	-171.1	167.1	-177.9	-159.9	0	113	D174 V195 M351 I372 A373 Y374 V378 T379 M380	D174-K376 WeakPolarHBondContact OD1-CE 3.32Å; D174-K376 IonicContact OD1-NZ 3.81Å; D174-K376 PolarHBondContact OD1-NZ 3.12Å; D174-K376 WeakPolarHBondContact OD2-CE 3.32Å; D174-K376 IonicContact OD2-NZ 3.71Å; V195-K376 HydrophobicContact CB-CB 4.34Å; V195-K376 HydrophobicContact CG1-CB 4.44Å; V195-K376 HydrophobicContact CG2-CB 3.84Å; V195-K376 HydrophobicContact CG2-CG 4.12Å; M351-K376 HydrophobicContact CE-CB 4.09Å; M351-K376 HydrophobicContact CE-CD 3.41Å; M351-K376 VanDerWaalsContact CE-CD 3.41Å; M351-K376 HydrophobicContact CE-CG 3.7Å; I372-K376 WeakPolarHBondContact O-CB 3.24Å; I372-K376 PolarHBondContact O-N 2.95Å; I372-K376 VanDerWaalsContact O-N 3.11Å; A373-K376 WeakPolarHBondContact O-CB 3.29Å; A373-K376 PolarHBondContact O-N 2.8Å; Y374-K376 PolarHBondContact O-N 2.92Å; K376-V378 VanDerWaalsContact C-N 3.34Å; K376-T379 PolarHBondContact O-OG1 3.43Å; K376-M380 HydrophobicContact CG-CE 4.22Å
377	A	89.2	Confident	89.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.1	-39.2	174.3	0	0	0	0	0	111.7	V347 M351 A373 Y374 T379 M380 M381	V347-A377 HydrophobicContact CG1-CB 3.43Å; V347-A377 VanDerWaalsContact CG1-CB 3.43Å; M351-A377 HydrophobicContact CB-CB 4.23Å; M351-A377 HydrophobicContact SD-CB 4.17Å; A373-A377 PolarHBondContact O-N 3.19Å; Y374-A377 PolarHBondContact O-N 3.36Å; Y374-A377 VanDerWaalsContact O-N 3.08Å; A377-T379 PolarHBondContact O-N 3.16Å; A377-M380 WeakPolarHBondContact O-CB 3.36Å; A377-M380 PolarHBondContact O-N 2.82Å; A377-M380 VanDerWaalsContact O-N 3.16Å; A377-M381 HydrophobicContact CB-CE 4.39Å
378	V	90.5	Very high	90	Very high	1 Å²	1	30 Å²	30	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-39.3	179.4	165.9	0	0	0	0	112.5	L157 Y374 P375 K376 M380 M381 P384 W387 A388	L157-V378 HydrophobicContact CD1-CG1 4.42Å; Y374-V378 HydrophobicContact CD1-CG2 3.67Å; Y374-V378 HydrophobicContact CE1-CG2 3.26Å; Y374-V378 WeakPolarHBondContact O-CG2 3.39Å; Y374-V378 PolarHBondContact O-N 3.4Å; P375-V378 PolarHBondContact O-N 3.02Å; K376-V378 VanDerWaalsContact C-N 3.34Å; V378-M380 PolarHBondContact O-N 3.16Å; V378-M380 VanDerWaalsContact O-N 3.13Å; V378-M381 PolarHBondContact O-N 3.41Å; V378-P384 HydrophobicContact CG1-CB 4.25Å; V378-P384 WeakPolarHBondContact CG1-O 3.27Å; V378-P384 WeakPolarHBondContact O-CB 3.35Å; V378-W387 HydrophobicContact CG1-CB 3.85Å; V378-W387 HydrophobicContact CG2-CB 4.17Å; V378-A388 HydrophobicContact CG1-CB 3.96Å
379	T	90.4	Very high	90.4	Very high	37 Å²	37	31.2 Å²	31.2	23%	0.227	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-19.2	177.4	49	0	0	0	0	113.2	L157 A160 P375 K376 A377	L157-T379 HydrophobicContact CD1-CG2 4.02Å; A160-T379 HydrophobicContact CB-CG2 3.81Å; P375-T379 WeakPolarHBondContact O-CG2 3.39Å; P375-T379 PolarHBondContact O-N 3.04Å; P375-T379 VanDerWaalsContact O-N 3.1Å; P375-T379 PolarHBondContact O-OG1 3.28Å; K376-T379 PolarHBondContact O-OG1 3.43Å; A377-T379 PolarHBondContact O-N 3.16Å
380	M	86.8	Confident	90.8	Very high	51 Å²	51	32.7 Å²	32.7	25%	0.251	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-8	177.7	-57.7	-179.7	-179	0	0	113.1	D174 F350 E354 Q355 K376 A377 V378	D174-M380 HydrophobicContact CB-CE 3.78Å; F350-M380 HydrophobicContact CE1-CB 3.93Å; F350-M380 HydrophobicContact CZ-CB 4.18Å; E354-M380 HydrophobicContact CB-SD 4.2Å; Q355-M380 HydrophobicContact CG-CE 3.98Å; Q355-M380 HydrophobicContact CG-SD 4.42Å; K376-M380 HydrophobicContact CG-CE 4.22Å; A377-M380 WeakPolarHBondContact O-CB 3.36Å; A377-M380 PolarHBondContact O-N 2.82Å; A377-M380 VanDerWaalsContact O-N 3.16Å; V378-M380 PolarHBondContact O-N 3.16Å; V378-M380 VanDerWaalsContact O-N 3.13Å
381	M	86.6	Confident	91	Very high	9 Å²	9	32.8 Å²	32.8	4%	0.044	17%	0.17	C	C	.	.	S	Bend	trans	-91.4	152.8	179.9	-62.1	-170.9	-158.8	0	0	111.9	L267 V347 F350 A377 V378 P384	L267-M381 HydrophobicContact CD1-CE 3.71Å; L267-M381 HydrophobicContact CD1-SD 4.19Å; V347-M381 HydrophobicContact CB-CE 4.42Å; V347-M381 HydrophobicContact CG1-CE 3.53Å; V347-M381 HydrophobicContact CG2-CE 4.09Å; F350-M381 HydrophobicContact CD1-CE 4.37Å; F350-M381 HydrophobicContact CE1-CE 4.47Å; F350-M381 HydrophobicContact CE1-CG 4.01Å; A377-M381 HydrophobicContact CB-CE 4.39Å; V378-M381 PolarHBondContact O-N 3.41Å; M381-P384 WeakPolarHBondContact O-CD 3.29Å
382	P	87.6	Confident	91.1	Very high	74 Å²	74	32.8 Å²	32.8	48%	0.481	17%	0.171	S	C	.	.	S	Bend	trans	-62.8	141	168.8	27.7	-35.1	0	0	0	110.6	W387	P382-W387 VanDerWaalsContact O-CD1 3.25Å; P382-W387 PolarHBondContact O-NE1 3.34Å
383	F	90.3	Very high	91.3	Very high	161 Å²	161	34.5 Å²	34.5	71%	0.706	18%	0.179	S	C	*	.	S	Bend	trans	57.5	55.2	-174.8	-48.9	-75	0	0	0	113.2	T385 L386 W387	F383-T385 VanDerWaalsContact C-N 3.27Å; F383-T385 PolarHBondContact O-N 3.04Å; F383-L386 HydrophobicContact CB-CB 4.36Å; F383-L386 PolarHBondContact O-N 3.01Å; F383-L386 VanDerWaalsContact O-N 3.1Å; F383-W387 VanDerWaalsContact O-CD1 3.23Å
384	P	91.9	Very high	91.5	Very high	44 Å²	44	34.5 Å²	34.5	29%	0.286	18%	0.179	S	C	.	.	H	α-helix	trans	-59.4	-36.9	-170.2	26.3	-36	0	0	0	112.6	L157 V378 M381 L386 W387 A388	L157-P384 HydrophobicContact CD1-CB 3.88Å; V378-P384 HydrophobicContact CG1-CB 4.25Å; V378-P384 WeakPolarHBondContact CG1-O 3.27Å; V378-P384 WeakPolarHBondContact O-CB 3.35Å; M381-P384 WeakPolarHBondContact O-CD 3.29Å; P384-L386 VanDerWaalsContact C-N 3.34Å; P384-L386 PolarHBondContact O-N 3.49Å; P384-W387 PolarHBondContact O-N 3.16Å; P384-A388 WeakPolarHBondContact O-CB 3.14Å; P384-A388 PolarHBondContact O-N 3.05Å
385	T	93.9	Very high	91.7	Very high	43 Å²	43	34.1 Å²	34.1	26%	0.264	18%	0.178	S	C	.	.	H	α-helix	trans	-59.6	-40.4	178	-48	0	0	0	0	112.9	C152 F383 A388 I389	C152-T385 VanDerWaalsContact O-CG2 3.32Å; C152-T385 WeakPolarHBondContact O-CG2 3.36Å; F383-T385 VanDerWaalsContact C-N 3.27Å; F383-T385 PolarHBondContact O-N 3.04Å; T385-A388 PolarHBondContact O-N 2.91Å; T385-I389 HydrophobicContact CG2-CD1 3.98Å; T385-I389 VanDerWaalsContact O-CG1 3.28Å; T385-I389 WeakPolarHBondContact O-CG1 3.33Å; T385-I389 PolarHBondContact O-N 3.31Å
386	L	92.4	Very high	91.8	Very high	97 Å²	97	35.2 Å²	35.2	51%	0.508	18%	0.183	S	C	.	.	H	α-helix	trans	-64	-48	179.3	176.4	63.8	0	0	0	110.8	F383 P384 A388 I389 L390	F383-L386 HydrophobicContact CB-CB 4.36Å; F383-L386 PolarHBondContact O-N 3.01Å; F383-L386 VanDerWaalsContact O-N 3.1Å; P384-L386 VanDerWaalsContact C-N 3.34Å; P384-L386 PolarHBondContact O-N 3.49Å; L386-A388 VanDerWaalsContact C-N 3.34Å; L386-A388 PolarHBondContact O-N 3.43Å; L386-I389 PolarHBondContact O-N 3.29Å; L386-L390 HydrophobicContact CD1-CD1 4.04Å; L386-L390 HydrophobicContact CD1-CG 4.25Å; L386-L390 HydrophobicContact CG-CD1 4.07Å; L386-L390 VanDerWaalsContact O-CG 3.3Å; L386-L390 WeakPolarHBondContact O-CG 3.33Å; L386-L390 PolarHBondContact O-N 3.04Å
387	W	92.4	Very high	92	Very high	39 Å²	39	35.8 Å²	35.8	15%	0.148	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-38.2	179.7	-63.5	110.3	0	0	0	112.2	V259 L260 R263 V378 P382 F383 P384 F391	V259-W387 HydrophobicContact CG1-CH2 4.45Å; V259-W387 HydrophobicContact CG1-CZ3 4.05Å; L260-W387 HydrophobicContact CD2-CE3 4.12Å; L260-W387 HydrophobicContact CD2-CZ3 4.23Å; R263-W387 HydrophobicContact CB-CH2 3.85Å; R263-W387 HydrophobicContact CB-CZ3 4.12Å; R263-W387 HydrophobicContact CG-CH2 3.61Å; R263-W387 HydrophobicContact CG-CZ2 3.87Å; R263-W387 HydrophobicContact CG-CZ3 4.02Å; V378-W387 HydrophobicContact CG1-CB 3.85Å; V378-W387 HydrophobicContact CG2-CB 4.17Å; P382-W387 VanDerWaalsContact O-CD1 3.25Å; P382-W387 PolarHBondContact O-NE1 3.34Å; F383-W387 VanDerWaalsContact O-CD1 3.23Å; P384-W387 PolarHBondContact O-N 3.16Å; W387-F391 VanDerWaalsContact O-CB 3.24Å; W387-F391 WeakPolarHBondContact O-CB 3.41Å; W387-F391 PolarHBondContact O-N 3.34Å
388	A	94	Very high	92.2	Very high	2 Å²	2	36 Å²	36	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-49.3	176.2	0	0	0	0	0	111.4	L157 W159 V378 P384 T385 L386 L390 F391 F392	L157-A388 HydrophobicContact CD1-CB 4.12Å; L157-A388 HydrophobicContact CD2-CB 4.14Å; W159-A388 HydrophobicContact CZ2-CB 4.21Å; V378-A388 HydrophobicContact CG1-CB 3.96Å; P384-A388 WeakPolarHBondContact O-CB 3.14Å; P384-A388 PolarHBondContact O-N 3.05Å; T385-A388 PolarHBondContact O-N 2.91Å; L386-A388 VanDerWaalsContact C-N 3.34Å; L386-A388 PolarHBondContact O-N 3.43Å; A388-L390 PolarHBondContact O-N 3.48Å; A388-F391 PolarHBondContact O-N 3.17Å; A388-F392 WeakPolarHBondContact O-CD2 3.31Å; A388-F392 PolarHBondContact O-N 3.43Å
389	I	94.8	Very high	92.4	Very high	35 Å²	35	36 Å²	36	18%	0.179	19%	0.188	C	C	.	.	H	α-helix	trans	-58.4	-49.6	178.2	-69.7	170.3	0	0	0	110.6	L149 C152 F153 T385 L386 F391 F392 I393	L149-I389 HydrophobicContact CD1-CG2 4.21Å; C152-I389 HydrophobicContact CB-CD1 4.36Å; C152-I389 HydrophobicContact CB-CG1 3.54Å; F153-I389 HydrophobicContact CD1-CD1 4.46Å; F153-I389 HydrophobicContact CE1-CD1 4.09Å; T385-I389 HydrophobicContact CG2-CD1 3.98Å; T385-I389 VanDerWaalsContact O-CG1 3.28Å; T385-I389 WeakPolarHBondContact O-CG1 3.33Å; T385-I389 PolarHBondContact O-N 3.31Å; L386-I389 PolarHBondContact O-N 3.29Å; I389-F391 VanDerWaalsContact C-N 3.33Å; I389-F391 PolarHBondContact O-N 2.99Å; I389-F392 PolarHBondContact O-N 2.92Å; I389-I393 HydrophobicContact CG2-CD1 3.66Å; I389-I393 HydrophobicContact CG2-CG1 4.39Å; I389-I393 WeakPolarHBondContact O-CB 3.24Å; I389-I393 VanDerWaalsContact O-CG1 3.25Å; I389-I393 WeakPolarHBondContact O-CG1 3.49Å; I389-I393 PolarHBondContact O-N 2.62Å
390	L	93.3	Very high	92.7	Very high	41 Å²	41	35 Å²	35	22%	0.215	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-39.6	-179	-69.7	175.8	0	0	0	112.3	F252 M256 L386 A388 M394	F252-L390 HydrophobicContact CZ-CD2 4.27Å; M256-L390 HydrophobicContact CE-CB 3.58Å; M256-L390 HydrophobicContact CE-CD1 4.08Å; M256-L390 HydrophobicContact CE-CG 4.28Å; M256-L390 HydrophobicContact SD-CB 4.14Å; M256-L390 HydrophobicContact SD-CD1 4.36Å; M256-L390 HydrophobicContact SD-CD2 4.03Å; M256-L390 HydrophobicContact SD-CG 4.41Å; L386-L390 HydrophobicContact CD1-CD1 4.04Å; L386-L390 HydrophobicContact CD1-CG 4.25Å; L386-L390 HydrophobicContact CG-CD1 4.07Å; L386-L390 VanDerWaalsContact O-CG 3.3Å; L386-L390 WeakPolarHBondContact O-CG 3.33Å; L386-L390 PolarHBondContact O-N 3.04Å; A388-L390 PolarHBondContact O-N 3.48Å; L390-M394 WeakPolarHBondContact O-CB 3.4Å; L390-M394 PolarHBondContact O-N 3.2Å
391	F	92.5	Very high	93	Very high	7 Å²	7	32.6 Å²	32.6	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-48	177.1	174.5	-103.7	0	0	0	112.4	L260 A370 Y374 W387 A388 I389 I393 M394 L395	L260-F391 HydrophobicContact CD1-CD2 4.47Å; A370-F391 HydrophobicContact CB-CE1 4.39Å; A370-F391 HydrophobicContact CB-CZ 3.97Å; A370-F391 WeakPolarHBondContact O-CE1 2.94Å; Y374-F391 HydrophobicContact CD1-CB 4.17Å; Y374-F391 AromaticContact CD1-CD1 3.42Å; Y374-F391 HydrophobicContact CD1-CD1 3.42Å; Y374-F391 VanDerWaalsContact CD1-CD1 3.42Å; Y374-F391 AromaticContact CD1-CD2 3.48Å; Y374-F391 HydrophobicContact CD1-CD2 3.48Å; Y374-F391 VanDerWaalsContact CD1-CD2 3.48Å; Y374-F391 AromaticContact CD1-CE1 3.49Å; Y374-F391 HydrophobicContact CD1-CE1 3.49Å; Y374-F391 VanDerWaalsContact CD1-CE1 3.49Å; Y374-F391 AromaticContact CD1-CE2 3.55Å; Y374-F391 HydrophobicContact CD1-CE2 3.55Å; Y374-F391 AromaticContact CD1-CG 3.4Å; Y374-F391 HydrophobicContact CD1-CG 3.4Å; Y374-F391 VanDerWaalsContact CD1-CG 3.4Å; Y374-F391 AromaticContact CD1-CZ 3.55Å; Y374-F391 HydrophobicContact CD1-CZ 3.55Å; Y374-F391 HydrophobicContact CD2-CD2 4.18Å; Y374-F391 AromaticContact CD2-CE2 3.79Å; Y374-F391 HydrophobicContact CD2-CE2 3.79Å; Y374-F391 HydrophobicContact CD2-CZ 4.2Å; Y374-F391 HydrophobicContact CE1-CB 3.42Å; Y374-F391 VanDerWaalsContact CE1-CB 3.42Å; Y374-F391 AromaticContact CE1-CD1 3.61Å; Y374-F391 HydrophobicContact CE1-CD1 3.61Å; Y374-F391 AromaticContact CE1-CD2 3.12Å; Y374-F391 HydrophobicContact CE1-CD2 3.12Å; Y374-F391 HydrophobicContact CE1-CE1 4.1Å; Y374-F391 AromaticContact CE1-CE2 3.67Å; Y374-F391 HydrophobicContact CE1-CE2 3.67Å; Y374-F391 AromaticContact CE1-CG 3.07Å; Y374-F391 HydrophobicContact CE1-CG 3.07Å; Y374-F391 HydrophobicContact CE1-CZ 4.12Å; Y374-F391 AromaticContact CE2-CD2 3.86Å; Y374-F391 HydrophobicContact CE2-CD2 3.86Å; Y374-F391 AromaticContact CE2-CE2 3.88Å; Y374-F391 HydrophobicContact CE2-CE2 3.88Å; Y374-F391 HydrophobicContact CG-CD1 4.31Å; Y374-F391 AromaticContact CG-CD2 4Å; Y374-F391 HydrophobicContact CG-CD2 4Å; Y374-F391 AromaticContact CG-CE1 3.97Å; Y374-F391 HydrophobicContact CG-CE1 3.97Å; Y374-F391 AromaticContact CG-CE2 3.61Å; Y374-F391 HydrophobicContact CG-CE2 3.61Å; Y374-F391 HydrophobicContact CG-CG 4.32Å; Y374-F391 AromaticContact CG-CZ 3.6Å; Y374-F391 HydrophobicContact CG-CZ 3.6Å; Y374-F391 AromaticContact CZ-CD2 3.31Å; Y374-F391 AromaticContact CZ-CE2 3.82Å; Y374-F391 AromaticContact CZ-CG 3.76Å; W387-F391 VanDerWaalsContact O-CB 3.24Å; W387-F391 WeakPolarHBondContact O-CB 3.41Å; W387-F391 PolarHBondContact O-N 3.34Å; A388-F391 PolarHBondContact O-N 3.17Å; I389-F391 VanDerWaalsContact C-N 3.33Å; I389-F391 PolarHBondContact O-N 2.99Å; F391-I393 PolarHBondContact O-N 3.03Å; F391-M394 HydrophobicContact CD2-CE 3.73Å; F391-M394 HydrophobicContact CE2-CE 4Å; F391-M394 WeakPolarHBondContact O-CB 3.39Å; F391-M394 PolarHBondContact O-N 2.88Å; F391-L395 HydrophobicContact CE1-CD1 3.97Å; F391-L395 HydrophobicContact CZ-CD1 4.16Å; F391-L395 WeakPolarHBondContact O-CB 3.45Å; F391-L395 PolarHBondContact O-N 2.93Å
392	F	95	Very high	93.4	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-71.5	-29.7	-179.1	-72	-63.6	0	0	0	112.7	Y148 L149 W159 F371 P375 A388 I389 L395 L396	Y148-F392 VanDerWaalsContact CB-CE1 3.41Å; Y148-F392 VanDerWaalsContact CB-CZ 3.43Å; Y148-F392 AromaticContact CD1-CE1 3.92Å; Y148-F392 HydrophobicContact CD1-CE1 3.92Å; Y148-F392 AromaticContact CD1-CE2 3.67Å; Y148-F392 HydrophobicContact CD1-CE2 3.67Å; Y148-F392 AromaticContact CD1-CZ 3.21Å; Y148-F392 HydrophobicContact CD1-CZ 3.21Å; Y148-F392 HydrophobicContact CD2-CE1 4.33Å; Y148-F392 HydrophobicContact CD2-CZ 4.41Å; Y148-F392 HydrophobicContact CE1-CZ 4.03Å; Y148-F392 HydrophobicContact CG-CD1 4.36Å; Y148-F392 AromaticContact CG-CE1 3.65Å; Y148-F392 HydrophobicContact CG-CE1 3.65Å; Y148-F392 HydrophobicContact CG-CE2 4.03Å; Y148-F392 AromaticContact CG-CZ 3.44Å; Y148-F392 HydrophobicContact CG-CZ 3.44Å; Y148-F392 VanDerWaalsContact CG-CZ 3.44Å; L149-F392 HydrophobicContact CB-CB 4.09Å; L149-F392 HydrophobicContact CD1-CB 4.43Å; W159-F392 HydrophobicContact CH2-CE2 4.04Å; W159-F392 HydrophobicContact CZ2-CE2 4.06Å; F371-F392 AromaticContact CD1-CE1 3.96Å; F371-F392 HydrophobicContact CD1-CE1 3.96Å; F371-F392 AromaticContact CE1-CE1 3.95Å; F371-F392 HydrophobicContact CE1-CE1 3.95Å; P375-F392 HydrophobicContact CG-CZ 3.82Å; A388-F392 WeakPolarHBondContact O-CD2 3.31Å; A388-F392 PolarHBondContact O-N 3.43Å; I389-F392 PolarHBondContact O-N 2.92Å; F392-L395 HydrophobicContact CD1-CD1 4.2Å; F392-L395 HydrophobicContact CE1-CD1 4.38Å; F392-L396 WeakPolarHBondContact O-CB 3.25Å; F392-L396 VanDerWaalsContact O-CG 3.26Å; F392-L396 WeakPolarHBondContact O-CG 3.28Å; F392-L396 PolarHBondContact O-N 3.44Å
393	I	95.1	Very high	93.8	Very high	52 Å²	52	29 Å²	29	27%	0.267	15%	0.147	S	C	.	.	H	α-helix	trans	-63.7	-48	167.5	-69	171.6	0	0	0	110.2	L149 F252 I389 F391 L395 L396 L397	L149-I393 HydrophobicContact CD1-CG1 3.94Å; L149-I393 HydrophobicContact CD2-CG1 4.07Å; F252-I393 HydrophobicContact CD1-CG2 4.16Å; F252-I393 HydrophobicContact CE1-CB 4.26Å; F252-I393 HydrophobicContact CE1-CG2 3.53Å; F252-I393 HydrophobicContact CZ-CG2 3.94Å; I389-I393 HydrophobicContact CG2-CD1 3.66Å; I389-I393 HydrophobicContact CG2-CG1 4.39Å; I389-I393 WeakPolarHBondContact O-CB 3.24Å; I389-I393 VanDerWaalsContact O-CG1 3.25Å; I389-I393 WeakPolarHBondContact O-CG1 3.49Å; I389-I393 PolarHBondContact O-N 2.62Å; F391-I393 PolarHBondContact O-N 3.03Å; I393-L395 VanDerWaalsContact C-N 3.33Å; I393-L395 PolarHBondContact O-N 3.4Å; I393-L396 PolarHBondContact O-N 3.32Å; I393-L397 HydrophobicContact CG2-CD1 4Å; I393-L397 HydrophobicContact CG2-CG 4.27Å; I393-L397 WeakPolarHBondContact O-CG 3.37Å; I393-L397 PolarHBondContact O-N 2.96Å
394	M	93.3	Very high	94	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-46.5	176.6	177.6	-172.1	76.5	0	0	111.5	F252 P253 M256 L257 L260 L390 F391 L396 L397 L398	F252-M394 HydrophobicContact CE1-CB 4.48Å; P253-M394 HydrophobicContact CB-CG 4.05Å; M256-M394 HydrophobicContact CB-CB 4.15Å; M256-M394 HydrophobicContact CB-CG 4Å; M256-M394 HydrophobicContact CB-SD 3.67Å; M256-M394 HydrophobicContact CG-CB 4.32Å; L257-M394 HydrophobicContact CD2-SD 4.12Å; L257-M394 HydrophobicContact CG-SD 4.16Å; L260-M394 HydrophobicContact CD1-CE 3.73Å; L260-M394 HydrophobicContact CD1-SD 3.92Å; L390-M394 WeakPolarHBondContact O-CB 3.4Å; L390-M394 PolarHBondContact O-N 3.2Å; F391-M394 HydrophobicContact CD2-CE 3.73Å; F391-M394 HydrophobicContact CE2-CE 4Å; F391-M394 WeakPolarHBondContact O-CB 3.39Å; F391-M394 PolarHBondContact O-N 2.88Å; M394-L396 PolarHBondContact O-N 2.86Å; M394-L397 PolarHBondContact O-N 3.02Å; M394-L398 HydrophobicContact CG-CD1 3.92Å; M394-L398 HydrophobicContact CG-CG 4.43Å; M394-L398 WeakPolarHBondContact O-CB 3.27Å; M394-L398 WeakPolarHBondContact O-CG 3.42Å; M394-L398 PolarHBondContact O-N 3.32Å
395	L	92.9	Very high	94.1	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-58.6	-47.5	177.8	-169.5	162.6	0	0	0	110.8	L61 A370 F371 F391 F392 I393 L397 G399	L61-L395 HydrophobicContact CD1-CD2 4.39Å; L61-L395 HydrophobicContact CD2-CB 4.43Å; L61-L395 HydrophobicContact CD2-CD2 3.92Å; L61-L395 HydrophobicContact CD2-CG 3.66Å; A370-L395 HydrophobicContact CB-CD1 3.85Å; F371-L395 HydrophobicContact CE1-CD1 4.15Å; F371-L395 HydrophobicContact CZ-CD1 4.05Å; F371-L395 HydrophobicContact CZ-CD2 4.36Å; F391-L395 HydrophobicContact CE1-CD1 3.97Å; F391-L395 HydrophobicContact CZ-CD1 4.16Å; F391-L395 WeakPolarHBondContact O-CB 3.45Å; F391-L395 PolarHBondContact O-N 2.93Å; F392-L395 HydrophobicContact CD1-CD1 4.2Å; F392-L395 HydrophobicContact CE1-CD1 4.38Å; I393-L395 VanDerWaalsContact C-N 3.33Å; I393-L395 PolarHBondContact O-N 3.4Å; L395-L397 PolarHBondContact O-N 3.49Å; L395-G399 PolarHBondContact O-N 2.89Å
396	L	95.1	Very high	94.1	Very high	23 Å²	23	17.7 Å²	17.7	12%	0.12	9%	0.09	C	C	.	.	H	α-helix	trans	-61.3	-44.5	177.3	-77.9	172.5	0	0	0	112.5	L142 L146 L149 F392 I393 M394 G399 L400	L142-L396 HydrophobicContact CB-CD2 4.21Å; L142-L396 VanDerWaalsContact O-CD2 3.24Å; L142-L396 WeakPolarHBondContact O-CD2 3.28Å; L146-L396 HydrophobicContact CB-CD1 4.39Å; L146-L396 HydrophobicContact CB-CD2 4Å; L146-L396 HydrophobicContact CD1-CD1 4Å; L149-L396 HydrophobicContact CB-CD1 4.29Å; L149-L396 HydrophobicContact CD2-CD1 3.56Å; F392-L396 WeakPolarHBondContact O-CB 3.25Å; F392-L396 VanDerWaalsContact O-CG 3.26Å; F392-L396 WeakPolarHBondContact O-CG 3.28Å; F392-L396 PolarHBondContact O-N 3.44Å; I393-L396 PolarHBondContact O-N 3.32Å; M394-L396 PolarHBondContact O-N 2.86Å; L396-G399 PolarHBondContact O-N 3.07Å; L396-L400 WeakPolarHBondContact O-CB 3.31Å; L396-L400 PolarHBondContact O-N 3.41Å
397	L	95.1	Very high	94.3	Very high	29 Å²	29	13.1 Å²	13.1	15%	0.152	7%	0.066	C	C	.	.	H	α-helix	trans	-69	-41.9	-178.3	-66.9	-174	0	0	0	112.3	T249 F252 P253 I393 M394 L395 G399 L400 D401	T249-L397 HydrophobicContact CG2-CD2 3.84Å; F252-L397 HydrophobicContact CB-CD1 3.83Å; F252-L397 HydrophobicContact CD1-CD1 3.61Å; F252-L397 HydrophobicContact CE1-CD1 4.41Å; F252-L397 HydrophobicContact CG-CD1 3.89Å; P253-L397 HydrophobicContact CG-CB 3.9Å; I393-L397 HydrophobicContact CG2-CD1 4Å; I393-L397 HydrophobicContact CG2-CG 4.27Å; I393-L397 WeakPolarHBondContact O-CG 3.37Å; I393-L397 PolarHBondContact O-N 2.96Å; M394-L397 PolarHBondContact O-N 3.02Å; L395-L397 PolarHBondContact O-N 3.49Å; L397-G399 VanDerWaalsContact C-N 3.35Å; L397-G399 PolarHBondContact O-N 3.27Å; L397-L400 PolarHBondContact O-N 2.74Å; L397-D401 PolarHBondContact O-N 2.97Å; L397-D401 VanDerWaalsContact O-N 3.12Å
398	L	93.1	Very high	94.4	Very high	6 Å²	6	11.3 Å²	11.3	3%	0.031	6%	0.059	C	C	.	.	H	α-helix	trans	-60.3	-43.5	172.5	-74.6	171.1	0	0	0	112.1	V59 L61 V64 P253 M394 S402	V59-L398 HydrophobicContact CG1-CD2 4.31Å; V59-L398 WeakPolarHBondContact O-CD2 3.27Å; L61-L398 HydrophobicContact CD2-CB 4.17Å; V64-L398 HydrophobicContact CG2-CD1 3.62Å; P253-L398 HydrophobicContact CB-CD1 4.19Å; P253-L398 HydrophobicContact CB-CD2 3.38Å; P253-L398 HydrophobicContact CB-CG 3.55Å; P253-L398 HydrophobicContact CG-CD2 3.81Å; P253-L398 HydrophobicContact CG-CG 3.75Å; M394-L398 HydrophobicContact CG-CD1 3.92Å; M394-L398 HydrophobicContact CG-CG 4.43Å; M394-L398 WeakPolarHBondContact O-CB 3.27Å; M394-L398 WeakPolarHBondContact O-CG 3.42Å; M394-L398 PolarHBondContact O-N 3.32Å; L398-S402 PolarHBondContact O-OG 3.45Å
399	G	94.8	Very high	94.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-66	-41.6	176.1	0	0	0	0	0	112	Y138 L395 L396 L397 D401 S402 Q403	Y138-G399 WeakPolarHBondContact CE1-O 3.32Å; L395-G399 PolarHBondContact O-N 2.89Å; L396-G399 PolarHBondContact O-N 3.07Å; L397-G399 VanDerWaalsContact C-N 3.35Å; L397-G399 PolarHBondContact O-N 3.27Å; G399-D401 VanDerWaalsContact C-N 3.35Å; G399-D401 PolarHBondContact O-N 3.47Å; G399-S402 PolarHBondContact O-N 3.46Å; G399-Q403 WeakPolarHBondContact O-CB 3.32Å; G399-Q403 PolarHBondContact O-N 3.39Å
400	L	95.3	Very high	94.4	Very high	16 Å²	16	10.1 Å²	10.1	8%	0.084	5%	0.052	C	C	.	.	H	α-helix	trans	-66.9	-39.7	-172.7	-172.8	70.7	0	0	0	111.1	L142 I230 T249 L396 L397 Q403 F404	L142-L400 HydrophobicContact CD2-CB 4Å; L142-L400 HydrophobicContact CD2-CD1 4.25Å; I230-L400 HydrophobicContact CG2-CD1 3.83Å; I230-L400 HydrophobicContact CG2-CD2 3.75Å; I230-L400 HydrophobicContact CG2-CG 4.46Å; T249-L400 HydrophobicContact CG2-CD2 4.39Å; L396-L400 WeakPolarHBondContact O-CB 3.31Å; L396-L400 PolarHBondContact O-N 3.41Å; L397-L400 PolarHBondContact O-N 2.74Å; L400-Q403 PolarHBondContact O-N 2.83Å; L400-F404 HydrophobicContact CG-CD1 4.08Å; L400-F404 HydrophobicContact CG-CE1 4.46Å; L400-F404 WeakPolarHBondContact O-CD1 3.47Å; L400-F404 WeakPolarHBondContact O-CG 3.48Å; L400-F404 PolarHBondContact O-N 3.39Å
401	D	94.1	Very high	94.5	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-61.8	-50.2	177.6	-77.5	-12.1	0	0	0	113.1	G56 T249 A250 L397 G399 Q403 F404 V405	G56-D401 VanDerWaalsContact C-CB 3.48Å; G56-D401 VanDerWaalsContact O-CB 3.24Å; G56-D401 WeakPolarHBondContact O-CB 3.05Å; T249-D401 WeakPolarHBondContact CB-OD1 3.43Å; T249-D401 PolarHBondContact OG1-OD1 2.95Å; A250-D401 WeakPolarHBondContact CA-OD2 3.48Å; A250-D401 WeakPolarHBondContact CB-OD2 3.24Å; A250-D401 PolarHBondContact N-OD2 3.34Å; L397-D401 PolarHBondContact O-N 2.97Å; L397-D401 VanDerWaalsContact O-N 3.12Å; G399-D401 VanDerWaalsContact C-N 3.35Å; G399-D401 PolarHBondContact O-N 3.47Å; D401-Q403 VanDerWaalsContact C-N 3.35Å; D401-Q403 PolarHBondContact O-N 3.49Å; D401-F404 VanDerWaalsContact CA-CE1 3.48Å; D401-F404 HydrophobicContact CB-CE1 4.28Å; D401-F404 HydrophobicContact CB-CZ 4.14Å; D401-F404 WeakPolarHBondContact OD1-CE1 3.45Å; D401-F404 WeakPolarHBondContact OD1-CZ 3.14Å; D401-V405 WeakPolarHBondContact O-CB 3.33Å; D401-V405 VanDerWaalsContact O-CG2 3.28Å; D401-V405 WeakPolarHBondContact O-CG2 3.44Å; D401-V405 PolarHBondContact O-N 3.24Å; D401-V405 VanDerWaalsContact O-N 3.16Å
402	S	94.5	Very high	94.6	Very high	6 Å²	6	7.9 Å²	7.9	4%	0.042	4%	0.041	C	C	.	.	H	α-helix	trans	-57.8	-49.4	174.8	-58.1	0	0	0	0	111.1	G57 G60 L398 G399 F404 V405 E406	G57-S402 WeakPolarHBondContact O-CA 3.3Å; G57-S402 WeakPolarHBondContact O-CB 3.34Å; G57-S402 PolarHBondContact O-OG 3.05Å; G60-S402 WeakPolarHBondContact CA-OG 3.46Å; L398-S402 PolarHBondContact O-OG 3.45Å; G399-S402 PolarHBondContact O-N 3.46Å; S402-F404 PolarHBondContact O-N 2.94Å; S402-V405 PolarHBondContact O-N 3.37Å; S402-E406 WeakPolarHBondContact O-CG 3.18Å; S402-E406 PolarHBondContact O-N 3.19Å
403	Q	95.9	Very high	94.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-58.8	-50.9	-176.9	-177	71.3	30.7	0	0	111.9	N135 Y138 I139 G399 L400 D401 V405 E406 V407	N135-Q403 PolarHBondContact O-NE2 3.5Å; Y138-Q403 HydrophobicContact CD1-CB 4.38Å; I139-Q403 HydrophobicContact CB-CG 4.39Å; I139-Q403 HydrophobicContact CD1-CG 4.04Å; I139-Q403 HydrophobicContact CG1-CG 4.1Å; G399-Q403 WeakPolarHBondContact O-CB 3.32Å; G399-Q403 PolarHBondContact O-N 3.39Å; L400-Q403 PolarHBondContact O-N 2.83Å; D401-Q403 VanDerWaalsContact C-N 3.35Å; D401-Q403 PolarHBondContact O-N 3.49Å; Q403-V405 VanDerWaalsContact C-N 3.3Å; Q403-V405 PolarHBondContact O-N 2.78Å; Q403-E406 PolarHBondContact O-N 2.6Å; Q403-V407 HydrophobicContact CG-CG2 4.44Å; Q403-V407 VanDerWaalsContact O-CG2 3.24Å; Q403-V407 WeakPolarHBondContact O-CG2 3.47Å; Q403-V407 PolarHBondContact O-N 3.43Å
404	F	93.8	Very high	94.4	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-71.9	-27.5	-175.7	71.9	-125.6	0	0	0	112.6	C234 I235 T242 V245 V246 L400 D401 S402 E408	C234-F404 HydrophobicContact CB-CB 4.1Å; C234-F404 HydrophobicContact CB-CD1 3.82Å; C234-F404 HydrophobicContact CB-CG 4.1Å; I235-F404 HydrophobicContact CG2-CB 3.62Å; I235-F404 HydrophobicContact CG2-CG 4.35Å; T242-F404 HydrophobicContact CG2-CD2 3.67Å; T242-F404 HydrophobicContact CG2-CE2 3.44Å; T242-F404 VanDerWaalsContact CG2-CE2 3.44Å; T242-F404 HydrophobicContact CG2-CZ 4.44Å; V245-F404 HydrophobicContact CG1-CE1 4.23Å; V246-F404 HydrophobicContact CG1-CE2 3.76Å; V246-F404 HydrophobicContact CG1-CZ 3.49Å; V246-F404 VanDerWaalsContact CG1-CZ 3.49Å; L400-F404 HydrophobicContact CG-CD1 4.08Å; L400-F404 HydrophobicContact CG-CE1 4.46Å; L400-F404 WeakPolarHBondContact O-CD1 3.47Å; L400-F404 WeakPolarHBondContact O-CG 3.48Å; L400-F404 PolarHBondContact O-N 3.39Å; D401-F404 VanDerWaalsContact CA-CE1 3.48Å; D401-F404 HydrophobicContact CB-CE1 4.28Å; D401-F404 HydrophobicContact CB-CZ 4.14Å; D401-F404 WeakPolarHBondContact OD1-CE1 3.45Å; D401-F404 WeakPolarHBondContact OD1-CZ 3.14Å; S402-F404 PolarHBondContact O-N 2.94Å; F404-E408 WeakPolarHBondContact O-CB 3.48Å; F404-E408 PolarHBondContact O-N 3.45Å
405	V	94.1	Very high	94.3	Very high	2 Å²	2	7.5 Å²	7.5	1%	0.012	4%	0.04	C	C	.	.	H	α-helix	trans	-68.1	-43.4	175.5	163.5	0	0	0	0	110.5	S53 A308 M309 L312 D401 S402 Q403 E408 G409	S53-V405 WeakPolarHBondContact O-CG2 3.45Å; A308-V405 HydrophobicContact CB-CG1 4.42Å; M309-V405 HydrophobicContact CE-CG1 4.21Å; L312-V405 HydrophobicContact CD1-CG1 3.67Å; L312-V405 HydrophobicContact CD2-CG1 4.49Å; L312-V405 HydrophobicContact CG-CG1 4.31Å; D401-V405 WeakPolarHBondContact O-CB 3.33Å; D401-V405 VanDerWaalsContact O-CG2 3.28Å; D401-V405 WeakPolarHBondContact O-CG2 3.44Å; D401-V405 PolarHBondContact O-N 3.24Å; D401-V405 VanDerWaalsContact O-N 3.16Å; S402-V405 PolarHBondContact O-N 3.37Å; Q403-V405 VanDerWaalsContact C-N 3.3Å; Q403-V405 PolarHBondContact O-N 2.78Å; V405-E408 PolarHBondContact O-N 3.39Å; V405-G409 PolarHBondContact O-N 2.98Å
406	E	95.1	Very high	94.2	Very high	10 Å²	10	7.8 Å²	7.8	5%	0.047	4%	0.041	C	C	.	.	H	α-helix	trans	-67.9	-43.6	178.3	-72.1	172.6	159.1	0	0	111.7	V131 L134 N135 S402 Q403 G409 Q410	V131-E406 HydrophobicContact CG2-CB 3.73Å; V131-E406 HydrophobicContact CG2-CG 4.24Å; L134-E406 WeakPolarHBondContact CD2-OE2 3.48Å; N135-E406 VanDerWaalsContact OD1-CB 3.29Å; N135-E406 WeakPolarHBondContact OD1-CB 3.19Å; S402-E406 WeakPolarHBondContact O-CG 3.18Å; S402-E406 PolarHBondContact O-N 3.19Å; Q403-E406 PolarHBondContact O-N 2.6Å; E406-G409 PolarHBondContact O-N 3.45Å; E406-Q410 PolarHBondContact O-N 3.24Å
407	V	95.9	Very high	93.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.1	-44.6	173.4	-180	0	0	0	0	110.7	N135 W228 I235 Q403 G409 Q410 I411	N135-V407 HydrophobicContact CB-CG2 4.3Å; W228-V407 HydrophobicContact CH2-CG2 4.36Å; W228-V407 HydrophobicContact CZ3-CG2 4.18Å; I235-V407 HydrophobicContact CD1-CB 4.05Å; I235-V407 HydrophobicContact CD1-CG1 3.35Å; Q403-V407 HydrophobicContact CG-CG2 4.44Å; Q403-V407 VanDerWaalsContact O-CG2 3.24Å; Q403-V407 WeakPolarHBondContact O-CG2 3.47Å; Q403-V407 PolarHBondContact O-N 3.43Å; V407-G409 VanDerWaalsContact C-N 3.31Å; V407-G409 PolarHBondContact O-N 3.1Å; V407-Q410 WeakPolarHBondContact O-CB 3.14Å; V407-Q410 PolarHBondContact O-N 3.06Å; V407-I411 HydrophobicContact CG1-CG1 4.11Å; V407-I411 WeakPolarHBondContact O-CB 3.1Å; V407-I411 WeakPolarHBondContact O-CG1 3.5Å; V407-I411 PolarHBondContact O-N 3.32Å
408	E	94.6	Very high	93.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-58.5	-45.6	174.6	-177.9	66.6	-165	0	0	110.3	I235 F404 V405 Q410 I411 T412 R428	I235-E408 HydrophobicContact CG2-CB 4.33Å; F404-E408 WeakPolarHBondContact O-CB 3.48Å; F404-E408 PolarHBondContact O-N 3.45Å; V405-E408 PolarHBondContact O-N 3.39Å; E408-Q410 VanDerWaalsContact C-N 3.32Å; E408-Q410 PolarHBondContact O-N 2.82Å; E408-I411 PolarHBondContact O-N 3.12Å; E408-T412 VanDerWaalsContact O-CB 3.32Å; E408-T412 WeakPolarHBondContact O-CB 3.42Å; E408-T412 PolarHBondContact O-N 3.31Å; E408-T412 PolarHBondContact O-OG1 3.34Å; E408-R428 IonicContact OE1-CZ 2.64Å; E408-R428 IonicContact OE1-NH2 3.34Å; E408-R428 PolarHBondContact OE1-NH2 3.25Å; E408-R428 IonicContact OE2-CZ 3.02Å; E408-R428 IonicContact OE2-NH2 2.73Å; E408-R428 PolarHBondContact OE2-NH2 2.96Å
409	G	94.2	Very high	93.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.4	-41.8	177.2	0	0	0	0	0	114	S311 V405 E406 V407 S413	S311-G409 PolarHBondContact OG-O 3.09Å; S311-G409 VanDerWaalsContact OG-O 3.05Å; V405-G409 PolarHBondContact O-N 2.98Å; E406-G409 PolarHBondContact O-N 3.45Å; V407-G409 VanDerWaalsContact C-N 3.31Å; V407-G409 PolarHBondContact O-N 3.1Å; G409-S413 PolarHBondContact O-N 2.9Å; G409-S413 PolarHBondContact O-OG 3.48Å
410	Q	95.8	Very high	92.5	Very high	12 Å²	12	20.7 Å²	20.7	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-50.8	174.4	-174.9	-174.3	-13.2	0	0	111.4	I128 V131 S132 N135 E406 V407 E408 T412 S413 L414	I128-Q410 HydrophobicContact CD1-CB 4.44Å; I128-Q410 HydrophobicContact CD1-CG 4.32Å; I128-Q410 HydrophobicContact CG2-CG 4.41Å; V131-Q410 HydrophobicContact CG1-CB 3.87Å; V131-Q410 HydrophobicContact CG1-CG 4.04Å; S132-Q410 PolarHBondContact OG-NE2 3.48Å; N135-Q410 PolarHBondContact ND2-OE1 3.31Å; E406-Q410 PolarHBondContact O-N 3.24Å; V407-Q410 WeakPolarHBondContact O-CB 3.14Å; V407-Q410 PolarHBondContact O-N 3.06Å; E408-Q410 VanDerWaalsContact C-N 3.32Å; E408-Q410 PolarHBondContact O-N 2.82Å; Q410-T412 PolarHBondContact O-N 2.87Å; Q410-S413 PolarHBondContact O-N 2.82Å; Q410-L414 HydrophobicContact CG-CD1 4.08Å; Q410-L414 WeakPolarHBondContact O-CG 3.41Å; Q410-L414 PolarHBondContact O-N 2.92Å; Q410-L414 VanDerWaalsContact O-N 3.08Å
411	I	94.5	Very high	92	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-47.4	-178.8	-66.7	-68.4	0	0	0	110.5	V407 E408 S413 L414 V415 F431 I432 I435	V407-I411 HydrophobicContact CG1-CG1 4.11Å; V407-I411 WeakPolarHBondContact O-CB 3.1Å; V407-I411 WeakPolarHBondContact O-CG1 3.5Å; V407-I411 PolarHBondContact O-N 3.32Å; E408-I411 PolarHBondContact O-N 3.12Å; I411-S413 VanDerWaalsContact C-N 3.3Å; I411-S413 PolarHBondContact O-N 3.46Å; I411-L414 PolarHBondContact O-N 2.82Å; I411-V415 HydrophobicContact CG2-CG2 3.91Å; I411-V415 VanDerWaalsContact O-CB 3.3Å; I411-V415 WeakPolarHBondContact O-CB 3.44Å; I411-V415 WeakPolarHBondContact O-CG2 3.42Å; I411-V415 PolarHBondContact O-N 3.47Å; I411-F431 HydrophobicContact CD1-CD1 3.95Å; I411-F431 HydrophobicContact CD1-CE1 3.97Å; I411-I432 HydrophobicContact CB-CG1 4.46Å; I411-I432 HydrophobicContact CD1-CB 4.36Å; I411-I432 HydrophobicContact CD1-CG1 3.79Å; I411-I432 HydrophobicContact CG1-CG1 3.93Å; I411-I432 HydrophobicContact CG2-CD1 4.18Å; I411-I432 HydrophobicContact CG2-CG1 3.76Å; I411-I435 HydrophobicContact CD1-CB 4.2Å; I411-I435 HydrophobicContact CD1-CD1 3.33Å; I411-I435 HydrophobicContact CD1-CG1 4.3Å; I411-I435 HydrophobicContact CD1-CG2 4.34Å
412	T	93.4	Very high	91.7	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-53.6	-48.1	176.8	-62.4	0	0	0	0	111.5	Y315 E408 Q410 L414 V415 D416	Y315-T412 HydrophobicContact CE2-CG2 4.03Å; Y315-T412 WeakPolarHBondContact OH-CB 3.18Å; Y315-T412 WeakPolarHBondContact OH-CG2 3.39Å; Y315-T412 PolarHBondContact OH-OG1 3.16Å; E408-T412 VanDerWaalsContact O-CB 3.32Å; E408-T412 WeakPolarHBondContact O-CB 3.42Å; E408-T412 PolarHBondContact O-N 3.31Å; E408-T412 PolarHBondContact O-OG1 3.34Å; Q410-T412 PolarHBondContact O-N 2.87Å; T412-L414 PolarHBondContact O-N 3.41Å; T412-V415 PolarHBondContact O-N 2.82Å; T412-D416 WeakPolarHBondContact O-CB 3.43Å; T412-D416 PolarHBondContact O-N 2.78Å
413	S	93.6	Very high	91.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-38.5	-178.2	-55.8	0	0	0	0	112.8	G109 I128 S311 G409 Q410 I411	G109-S413 WeakPolarHBondContact CA-OG 3.28Å; G109-S413 PolarHBondContact N-OG 2.91Å; I128-S413 VanDerWaalsContact CD1-CB 3.43Å; S311-S413 PolarHBondContact OG-OG 3.46Å; G409-S413 PolarHBondContact O-N 2.9Å; G409-S413 PolarHBondContact O-OG 3.48Å; Q410-S413 PolarHBondContact O-N 2.82Å; I411-S413 VanDerWaalsContact C-N 3.3Å; I411-S413 PolarHBondContact O-N 3.46Å
414	L	93.8	Very high	90.4	Very high	40 Å²	40	36 Å²	36	21%	0.209	17%	0.173	C	C	.	.	H	α-helix	trans	-75.3	-38.7	178.5	-67.7	173.4	0	0	0	112.3	I128 Q410 I411 T412 D416 L417 F431 I435	I128-L414 HydrophobicContact CG2-CD2 4.24Å; Q410-L414 HydrophobicContact CG-CD1 4.08Å; Q410-L414 WeakPolarHBondContact O-CG 3.41Å; Q410-L414 PolarHBondContact O-N 2.92Å; Q410-L414 VanDerWaalsContact O-N 3.08Å; I411-L414 PolarHBondContact O-N 2.82Å; T412-L414 PolarHBondContact O-N 3.41Å; L414-D416 VanDerWaalsContact C-N 3.29Å; L414-D416 PolarHBondContact O-N 3.2Å; L414-L417 HydrophobicContact CD2-CD1 4.5Å; L414-L417 PolarHBondContact O-N 3.09Å; L414-F431 HydrophobicContact CB-CE1 3.84Å; L414-F431 HydrophobicContact CB-CZ 3.87Å; L414-F431 HydrophobicContact CD1-CE1 4.24Å; L414-F431 HydrophobicContact CD1-CZ 3.94Å; L414-I435 HydrophobicContact CD1-CD1 3.93Å
415	V	91.4	Very high	89.8	Confident	6 Å²	6	37.4 Å²	37.4	4%	0.036	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-35.9	176.3	169.7	0	0	0	0	111.1	I411 T412 L417 Y418 P419 L422 R423 F431	I411-V415 HydrophobicContact CG2-CG2 3.91Å; I411-V415 VanDerWaalsContact O-CB 3.3Å; I411-V415 WeakPolarHBondContact O-CB 3.44Å; I411-V415 WeakPolarHBondContact O-CG2 3.42Å; I411-V415 PolarHBondContact O-N 3.47Å; T412-V415 PolarHBondContact O-N 2.82Å; V415-L417 VanDerWaalsContact C-N 3.26Å; V415-L417 PolarHBondContact O-N 2.6Å; V415-Y418 CarbonylContact O-C 3.58Å; V415-Y418 VanDerWaalsContact O-C 3.31Å; V415-Y418 PolarHBondContact O-N 3.29Å; V415-P419 WeakPolarHBondContact O-CA 3.4Å; V415-L422 HydrophobicContact CB-CB 4.38Å; V415-L422 HydrophobicContact CG1-CB 4.04Å; V415-L422 HydrophobicContact CG2-CB 4.14Å; V415-L422 HydrophobicContact CG2-CD1 4.27Å; V415-R423 HydrophobicContact CG1-CG 3.58Å; V415-F431 HydrophobicContact CG2-CD1 4.09Å; V415-F431 HydrophobicContact CG2-CE1 4.27Å
416	D	89.8	Confident	89.4	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.053	21%	0.212	C	C	.	.	H	α-helix	trans	-70.2	-19.1	179.9	-72.4	-2.5	0	0	0	113.3	R41 G108 T111 T412 L414 P419 R423	R41-D416 IonicContact CZ-OD2 3.77Å; R41-D416 IonicContact NH1-OD1 2.9Å; R41-D416 IonicContact NH1-OD2 2.67Å; R41-D416 PolarHBondContact NH1-OD2 2.89Å; R41-D416 IonicContact NH2-OD2 3.73Å; R41-D416 PolarHBondContact NH2-OD2 2.96Å; G108-D416 WeakPolarHBondContact CA-OD2 3.27Å; G108-D416 PolarHBondContact N-OD2 2.88Å; T111-D416 HydrophobicContact CG2-CB 4.24Å; T412-D416 WeakPolarHBondContact O-CB 3.43Å; T412-D416 PolarHBondContact O-N 2.78Å; L414-D416 VanDerWaalsContact C-N 3.29Å; L414-D416 PolarHBondContact O-N 3.2Å; D416-P419 WeakPolarHBondContact O-CD 3.46Å; D416-R423 IonicContact OD1-CZ 2.62Å; D416-R423 IonicContact OD1-NE 2.75Å; D416-R423 IonicContact OD1-NH2 2.63Å; D416-R423 PolarHBondContact OD1-NH2 2.88Å
417	L	89.8	Confident	89.2	Confident	44 Å²	44	45.2 Å²	45.2	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-72.2	-34	171.6	-71.5	172.9	0	0	0	112.9	I110 T111 L414 V415 P419	I110-L417 HydrophobicContact CB-CD2 4.36Å; I110-L417 HydrophobicContact CD1-CD1 3.77Å; I110-L417 HydrophobicContact CD1-CG 4.45Å; I110-L417 HydrophobicContact CG2-CD2 3.91Å; T111-L417 HydrophobicContact CG2-CD2 3.92Å; T111-L417 HydrophobicContact CG2-CG 4.48Å; L414-L417 HydrophobicContact CD2-CD1 4.5Å; L414-L417 PolarHBondContact O-N 3.09Å; V415-L417 VanDerWaalsContact C-N 3.26Å; V415-L417 PolarHBondContact O-N 2.6Å; L417-P419 VanDerWaalsContact C-CD 3.44Å
418	Y	88	Confident	88.9	Confident	157 Å²	157	46.8 Å²	46.8	62%	0.616	23%	0.23	S	C	*	.	S	Bend	trans	-131.4	57.9	-177.4	-58.1	-76.1	0	0	0	112.1	V415 S420 F421 L422	V415-Y418 CarbonylContact O-C 3.58Å; V415-Y418 VanDerWaalsContact O-C 3.31Å; V415-Y418 PolarHBondContact O-N 3.29Å; Y418-S420 VanDerWaalsContact C-N 3.27Å; Y418-S420 PolarHBondContact O-N 3.46Å; Y418-F421 PolarHBondContact O-N 3.45Å; Y418-L422 PolarHBondContact O-N 2.97Å
419	P	83.9	Confident	88.8	Confident	44 Å²	44	48 Å²	48	29%	0.286	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-28.8	-169.9	27.5	-34.9	0	0	0	112.4	V415 D416 L417 F421 R423	V415-P419 WeakPolarHBondContact O-CA 3.4Å; D416-P419 WeakPolarHBondContact O-CD 3.46Å; L417-P419 VanDerWaalsContact C-CD 3.44Å; P419-F421 PolarHBondContact O-N 2.84Å; P419-R423 HydrophobicContact CB-CG 4.28Å; P419-R423 WeakPolarHBondContact O-CB 3.02Å; P419-R423 PolarHBondContact O-N 3.48Å
420	S	81.8	Confident	88.8	Confident	84 Å²	84	52 Å²	52	59%	0.587	26%	0.259	S	S	*	.	H	α-helix	trans	-66.9	-19	179.2	58.4	0	0	0	0	113.9	Y418 K424	Y418-S420 VanDerWaalsContact C-N 3.27Å; Y418-S420 PolarHBondContact O-N 3.46Å; S420-K424 WeakPolarHBondContact O-CD 3.13Å; S420-K424 WeakPolarHBondContact O-CE 3.33Å; S420-K424 PolarHBondContact O-NZ 2.95Å
421	F	84.8	Confident	88.7	Confident	137 Å²	137	53.6 Å²	53.6	60%	0.601	27%	0.266	S	S	*	.	H	α-helix	trans	-108.8	-51.8	178.2	179.9	-109.1	0	0	0	111.1	Y418 P419 K424	Y418-F421 PolarHBondContact O-N 3.45Å; P419-F421 PolarHBondContact O-N 2.84Å; F421-K424 PolarHBondContact O-N 3.45Å
422	L	87.1	Confident	88.8	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-78.4	-22.3	-169.6	-67.3	174.3	0	0	0	114.3	V415 Y418 K424 R428 F431	V415-L422 HydrophobicContact CB-CB 4.38Å; V415-L422 HydrophobicContact CG1-CB 4.04Å; V415-L422 HydrophobicContact CG2-CB 4.14Å; V415-L422 HydrophobicContact CG2-CD1 4.27Å; Y418-L422 PolarHBondContact O-N 2.97Å; L422-K424 VanDerWaalsContact C-N 3.32Å; L422-R428 PolarHBondContact O-N 3.47Å; L422-R428 VanDerWaalsContact O-N 3.15Å; L422-F431 HydrophobicContact CD1-CE1 4.48Å; L422-F431 HydrophobicContact CD2-CB 4.17Å; L422-F431 HydrophobicContact CD2-CD2 4.15Å; L422-F431 HydrophobicContact CD2-CG 4.08Å
423	R	82.5	Confident	88.9	Confident	58 Å²	58	55.1 Å²	55.1	22%	0.219	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	5.4	175.9	-59.8	-176.9	-179.1	173.1	2.1	113.7	S25 V415 D416 P419	S25-R423 PolarHBondContact OG-O 2.85Å; V415-R423 HydrophobicContact CG1-CG 3.58Å; D416-R423 IonicContact OD1-CZ 2.62Å; D416-R423 IonicContact OD1-NE 2.75Å; D416-R423 IonicContact OD1-NH2 2.63Å; D416-R423 PolarHBondContact OD1-NH2 2.88Å; P419-R423 HydrophobicContact CB-CG 4.28Å; P419-R423 WeakPolarHBondContact O-CB 3.02Å; P419-R423 PolarHBondContact O-N 3.48Å
424	K	80.3	Confident	89	Confident	134 Å²	134	59.3 Å²	59.3	58%	0.583	30%	0.3	S	S	*	.	S	Bend	trans	-96.6	139	-178	-71.7	-176.4	177.5	159.1	0	111.8	S420 F421 L422 Y426 C427	S420-K424 WeakPolarHBondContact O-CD 3.13Å; S420-K424 WeakPolarHBondContact O-CE 3.33Å; S420-K424 PolarHBondContact O-NZ 2.95Å; F421-K424 PolarHBondContact O-N 3.45Å; L422-K424 VanDerWaalsContact C-N 3.32Å; K424-Y426 PolarHBondContact O-N 3.39Å; K424-C427 WeakPolarHBondContact O-CB 3.33Å; K424-C427 PolarHBondContact O-N 3.17Å; K424-C427 PolarHBondContact O-SG 2.82Å
425	G	81.4	Confident	89.1	Confident	30 Å²	30	58.2 Å²	58.2	31%	0.309	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	-127.3	176.9	0	0	0	0	0	112.8	S25	S25-G425 WeakPolarHBondContact CB-O 3.49Å; S25-G425 PolarHBondContact OG-O 3.08Å
426	Y	86.3	Confident	89.4	Confident	133 Å²	133	58.3 Å²	58.3	52%	0.522	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	12.3	178	-61.9	-73.7	0	0	0	113.6	G23 K424 R428 E429 V430	G23-Y426 WeakPolarHBondContact CA-OH 3.46Å; G23-Y426 WeakPolarHBondContact O-CE2 3.43Å; K424-Y426 PolarHBondContact O-N 3.39Å; Y426-R428 VanDerWaalsContact C-N 3.28Å; Y426-R428 PolarHBondContact O-N 2.48Å; Y426-E429 VanDerWaalsContact C-OE2 3.24Å; Y426-E429 WeakPolarHBondContact CA-OE2 3.43Å; Y426-E429 PolarHBondContact O-N 3.32Å; Y426-V430 WeakPolarHBondContact O-CG2 3.46Å; Y426-V430 PolarHBondContact O-N 3.05Å
427	C	89.6	Confident	89.8	Confident	44 Å²	44	61.5 Å²	61.5	30%	0.297	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-33.2	-174.3	-67.8	0	0	0	0	112.2	K424 F431	K424-C427 WeakPolarHBondContact O-CB 3.33Å; K424-C427 PolarHBondContact O-N 3.17Å; K424-C427 PolarHBondContact O-SG 2.82Å; C427-F431 WeakPolarHBondContact O-CB 3.28Å; C427-F431 PolarHBondContact O-N 3.16Å
428	R	89.7	Confident	90.2	Very high	33 Å²	33	63.4 Å²	63.4	13%	0.125	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-48.8	175.3	-177.4	-177.7	179.3	-78.7	-6	110.6	I235 W236 G238 E408 L422 Y426 F431 I432	I235-R428 PolarHBondContact O-NH1 3.17Å; W236-R428 PolarHBondContact O-NH1 2.82Å; G238-R428 VanDerWaalsContact CA-NH2 3.26Å; E408-R428 IonicContact OE1-CZ 2.64Å; E408-R428 IonicContact OE1-NH2 3.34Å; E408-R428 PolarHBondContact OE1-NH2 3.25Å; E408-R428 IonicContact OE2-CZ 3.02Å; E408-R428 IonicContact OE2-NH2 2.73Å; E408-R428 PolarHBondContact OE2-NH2 2.96Å; L422-R428 PolarHBondContact O-N 3.47Å; L422-R428 VanDerWaalsContact O-N 3.15Å; Y426-R428 VanDerWaalsContact C-N 3.28Å; Y426-R428 PolarHBondContact O-N 2.48Å; R428-F431 WeakPolarHBondContact O-CB 3.41Å; R428-F431 PolarHBondContact O-N 3.11Å; R428-I432 HydrophobicContact CG-CD1 4.05Å; R428-I432 VanDerWaalsContact O-CG1 3.25Å; R428-I432 WeakPolarHBondContact O-CG1 3.03Å; R428-I432 PolarHBondContact O-N 3.45Å
429	E	93.3	Very high	90.6	Very high	27 Å²	27	56.3 Å²	56.3	13%	0.126	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-44.9	-179.7	-64.9	88.2	154.6	0	0	111.1	F232 W236 Y426 F431 I432 A433	F232-E429 WeakPolarHBondContact CE2-O 3.42Å; W236-E429 WeakPolarHBondContact O-CG 3.47Å; Y426-E429 VanDerWaalsContact C-OE2 3.24Å; Y426-E429 WeakPolarHBondContact CA-OE2 3.43Å; Y426-E429 PolarHBondContact O-N 3.32Å; E429-F431 VanDerWaalsContact C-N 3.33Å; E429-F431 PolarHBondContact O-N 3.05Å; E429-I432 PolarHBondContact O-N 2.95Å; E429-A433 PolarHBondContact O-N 3.49Å
430	V	94.1	Very high	91.3	Very high	83 Å²	83	56.4 Å²	56.4	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-41.5	175.2	173.7	0	0	0	0	111	Y426 A433 I434	Y426-V430 WeakPolarHBondContact O-CG2 3.46Å; Y426-V430 PolarHBondContact O-N 3.05Å; V430-A433 PolarHBondContact O-N 2.91Å; V430-I434 HydrophobicContact CG1-CD1 3.9Å; V430-I434 HydrophobicContact CG1-CG1 4.47Å; V430-I434 VanDerWaalsContact O-CG1 3.3Å; V430-I434 WeakPolarHBondContact O-CG1 3Å; V430-I434 PolarHBondContact O-N 3.15Å
431	F	94.7	Very high	92.1	Very high	46 Å²	46	57.8 Å²	57.8	20%	0.202	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-42.5	177.9	-178	-113.5	0	0	0	112.5	I411 L414 V415 L422 C427 R428 E429 I434 I435	I411-F431 HydrophobicContact CD1-CD1 3.95Å; I411-F431 HydrophobicContact CD1-CE1 3.97Å; L414-F431 HydrophobicContact CB-CE1 3.84Å; L414-F431 HydrophobicContact CB-CZ 3.87Å; L414-F431 HydrophobicContact CD1-CE1 4.24Å; L414-F431 HydrophobicContact CD1-CZ 3.94Å; V415-F431 HydrophobicContact CG2-CD1 4.09Å; V415-F431 HydrophobicContact CG2-CE1 4.27Å; L422-F431 HydrophobicContact CD1-CE1 4.48Å; L422-F431 HydrophobicContact CD2-CB 4.17Å; L422-F431 HydrophobicContact CD2-CD2 4.15Å; L422-F431 HydrophobicContact CD2-CG 4.08Å; C427-F431 WeakPolarHBondContact O-CB 3.28Å; C427-F431 PolarHBondContact O-N 3.16Å; R428-F431 WeakPolarHBondContact O-CB 3.41Å; R428-F431 PolarHBondContact O-N 3.11Å; E429-F431 VanDerWaalsContact C-N 3.33Å; E429-F431 PolarHBondContact O-N 3.05Å; F431-I434 PolarHBondContact O-N 3.43Å; F431-I435 HydrophobicContact CD1-CD1 3.96Å; F431-I435 HydrophobicContact CD2-CD1 4.4Å; F431-I435 HydrophobicContact CE1-CD1 3.39Å; F431-I435 HydrophobicContact CE2-CD1 3.88Å; F431-I435 HydrophobicContact CE2-CG1 4.49Å; F431-I435 HydrophobicContact CG-CD1 4.44Å; F431-I435 HydrophobicContact CZ-CD1 3.35Å; F431-I435 HydrophobicContact CZ-CG1 4.39Å; F431-I435 PolarHBondContact O-N 3.47Å
432	I	94.9	Very high	92.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-47.6	173.4	-63.8	164.1	0	0	0	110.1	F232 I235 I411 R428 E429 I434 I435 C436	F232-I432 HydrophobicContact CD2-CB 4.33Å; F232-I432 HydrophobicContact CD2-CG2 3.73Å; F232-I432 HydrophobicContact CE2-CB 4.26Å; F232-I432 HydrophobicContact CE2-CG2 4.15Å; I235-I432 HydrophobicContact CD1-CG2 3.57Å; I235-I432 HydrophobicContact CG1-CD1 4.39Å; I235-I432 HydrophobicContact CG1-CG2 3.88Å; I411-I432 HydrophobicContact CB-CG1 4.46Å; I411-I432 HydrophobicContact CD1-CB 4.36Å; I411-I432 HydrophobicContact CD1-CG1 3.79Å; I411-I432 HydrophobicContact CG1-CG1 3.93Å; I411-I432 HydrophobicContact CG2-CD1 4.18Å; I411-I432 HydrophobicContact CG2-CG1 3.76Å; R428-I432 HydrophobicContact CG-CD1 4.05Å; R428-I432 VanDerWaalsContact O-CG1 3.25Å; R428-I432 WeakPolarHBondContact O-CG1 3.03Å; R428-I432 PolarHBondContact O-N 3.45Å; E429-I432 PolarHBondContact O-N 2.95Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.88Å; I432-I435 PolarHBondContact O-N 3.1Å; I432-I435 VanDerWaalsContact O-N 3.15Å; I432-C436 PolarHBondContact O-N 3.28Å; I432-C436 PolarHBondContact O-SG 3.05Å
433	A	96.3	Very high	93.1	Very high	34 Å²	34	56.2 Å²	56.2	28%	0.281	29%	0.288	S	S	.	.	H	α-helix	trans	-58.4	-41.8	178.8	0	0	0	0	0	111.7	F232 E429 V430 C436 C437	F232-A433 HydrophobicContact CD2-CB 4.27Å; F232-A433 HydrophobicContact CE2-CB 3.79Å; F232-A433 HydrophobicContact CZ-CB 4.49Å; E429-A433 PolarHBondContact O-N 3.49Å; V430-A433 PolarHBondContact O-N 2.91Å; A433-C436 PolarHBondContact O-N 2.89Å; A433-C437 WeakPolarHBondContact O-CB 2.96Å; A433-C437 PolarHBondContact O-N 3.24Å; A433-C437 PolarHBondContact O-SG 3.41Å
434	I	96.4	Very high	93.8	Very high	87 Å²	87	55.1 Å²	55.1	45%	0.446	29%	0.287	S	S	.	.	H	α-helix	trans	-61.5	-46.4	175.7	-69.4	165.4	0	0	0	111	V430 F431 I432 C437 I438	V430-I434 HydrophobicContact CG1-CD1 3.9Å; V430-I434 HydrophobicContact CG1-CG1 4.47Å; V430-I434 VanDerWaalsContact O-CG1 3.3Å; V430-I434 WeakPolarHBondContact O-CG1 3Å; V430-I434 PolarHBondContact O-N 3.15Å; F431-I434 PolarHBondContact O-N 3.43Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.88Å; I434-C437 PolarHBondContact O-N 3.24Å; I434-I438 HydrophobicContact CG2-CD1 3.75Å; I434-I438 HydrophobicContact CG2-CG1 4.41Å; I434-I438 WeakPolarHBondContact O-CG1 3.35Å; I434-I438 PolarHBondContact O-N 3.27Å
435	I	96	Very high	94.6	Very high	18 Å²	18	51.7 Å²	51.7	9%	0.092	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-43.4	179.1	-75.4	170.9	0	0	0	111.4	I411 L414 F431 I432 C437 I438 S439	I411-I435 HydrophobicContact CD1-CB 4.2Å; I411-I435 HydrophobicContact CD1-CD1 3.33Å; I411-I435 HydrophobicContact CD1-CG1 4.3Å; I411-I435 HydrophobicContact CD1-CG2 4.34Å; L414-I435 HydrophobicContact CD1-CD1 3.93Å; F431-I435 HydrophobicContact CD1-CD1 3.96Å; F431-I435 HydrophobicContact CD2-CD1 4.4Å; F431-I435 HydrophobicContact CE1-CD1 3.39Å; F431-I435 HydrophobicContact CE2-CD1 3.88Å; F431-I435 HydrophobicContact CE2-CG1 4.49Å; F431-I435 HydrophobicContact CG-CD1 4.44Å; F431-I435 HydrophobicContact CZ-CD1 3.35Å; F431-I435 HydrophobicContact CZ-CG1 4.39Å; F431-I435 PolarHBondContact O-N 3.47Å; I432-I435 PolarHBondContact O-N 3.1Å; I432-I435 VanDerWaalsContact O-N 3.15Å; I435-C437 VanDerWaalsContact C-N 3.34Å; I435-C437 PolarHBondContact O-N 3Å; I435-I438 PolarHBondContact O-N 3.09Å; I435-S439 VanDerWaalsContact O-CB 3.31Å; I435-S439 WeakPolarHBondContact O-CB 3.27Å; I435-S439 PolarHBondContact O-N 2.82Å; I435-S439 PolarHBondContact O-OG 3.45Å
436	C	97.3	Very high	95.3	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.054	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-42.6	174.1	-66.2	0	0	0	0	111.4	W228 I432 A433 S439 Y440	W228-C436 HydrophobicContact CD2-CB 4.29Å; W228-C436 HydrophobicContact CE3-CB 3.6Å; W228-C436 VanDerWaalsContact CE3-SG 3.55Å; W228-C436 HydrophobicContact CZ3-CB 4.08Å; I432-C436 PolarHBondContact O-N 3.28Å; I432-C436 PolarHBondContact O-SG 3.05Å; A433-C436 PolarHBondContact O-N 2.89Å; C436-S439 PolarHBondContact O-N 2.86Å; C436-Y440 WeakPolarHBondContact O-CB 3.5Å; C436-Y440 PolarHBondContact O-N 2.87Å
437	C	97.8	Very high	95.8	Very high	77 Å²	77	44.2 Å²	44.2	52%	0.52	24%	0.239	S	C	.	.	H	α-helix	trans	-63.9	-45.5	177.3	-75.5	0	0	0	0	112.4	A433 I434 I435 S439 Y440 L441	A433-C437 WeakPolarHBondContact O-CB 2.96Å; A433-C437 PolarHBondContact O-N 3.24Å; A433-C437 PolarHBondContact O-SG 3.41Å; I434-C437 PolarHBondContact O-N 3.24Å; I435-C437 VanDerWaalsContact C-N 3.34Å; I435-C437 PolarHBondContact O-N 3Å; C437-S439 VanDerWaalsContact C-N 3.33Å; C437-S439 PolarHBondContact O-N 3.41Å; C437-Y440 PolarHBondContact O-N 2.93Å; C437-L441 WeakPolarHBondContact O-CG 3.26Å; C437-L441 PolarHBondContact O-N 3.4Å
438	I	97.6	Very high	96.2	Very high	84 Å²	84	42.7 Å²	42.7	43%	0.431	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-45.7	176.1	-69.2	168.5	0	0	0	109.9	I434 I435 Y440 L441 F442	I434-I438 HydrophobicContact CG2-CD1 3.75Å; I434-I438 HydrophobicContact CG2-CG1 4.41Å; I434-I438 WeakPolarHBondContact O-CG1 3.35Å; I434-I438 PolarHBondContact O-N 3.27Å; I435-I438 PolarHBondContact O-N 3.09Å; I438-Y440 VanDerWaalsContact C-N 3.34Å; I438-Y440 PolarHBondContact O-N 2.97Å; I438-L441 PolarHBondContact O-N 3.41Å; I438-F442 HydrophobicContact CG2-CD2 3.83Å; I438-F442 HydrophobicContact CG2-CE2 3.71Å; I438-F442 VanDerWaalsContact O-CD2 3.3Å; I438-F442 WeakPolarHBondContact O-CD2 3.5Å; I438-F442 PolarHBondContact O-N 2.95Å; I438-F442 VanDerWaalsContact O-N 3.09Å
439	S	97.1	Very high	96.5	Very high	8 Å²	8	45.4 Å²	45.4	6%	0.056	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-37	-179.7	-53.8	0	0	0	0	112.1	W228 I435 C436 C437 F442 G443	W228-S439 VanDerWaalsContact CH2-CB 3.45Å; I435-S439 VanDerWaalsContact O-CB 3.31Å; I435-S439 WeakPolarHBondContact O-CB 3.27Å; I435-S439 PolarHBondContact O-N 2.82Å; I435-S439 PolarHBondContact O-OG 3.45Å; C436-S439 PolarHBondContact O-N 2.86Å; C437-S439 VanDerWaalsContact C-N 3.33Å; C437-S439 PolarHBondContact O-N 3.41Å; S439-F442 PolarHBondContact O-N 2.97Å; S439-G443 PolarHBondContact O-N 3.27Å
440	Y	98.1	Very high	96.6	Very high	46 Å²	46	44.1 Å²	44.1	18%	0.18	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-47.3	170.9	169.5	-102.5	0	0	0	111.8	L224 L225 C436 C437 I438 F442 G443 L444	L224-Y440 HydrophobicContact CB-CE2 4.33Å; L224-Y440 HydrophobicContact CD2-CD2 3.86Å; L224-Y440 HydrophobicContact CD2-CE2 4.05Å; L224-Y440 HydrophobicContact CG-CD2 3.89Å; L224-Y440 HydrophobicContact CG-CE2 4.14Å; L225-Y440 HydrophobicContact CB-CD2 4.29Å; L225-Y440 HydrophobicContact CB-CE2 3.65Å; L225-Y440 HydrophobicContact CD1-CD2 4.31Å; L225-Y440 HydrophobicContact CD1-CE1 4.46Å; L225-Y440 HydrophobicContact CD1-CE2 4.16Å; L225-Y440 HydrophobicContact CG-CE2 4.48Å; C436-Y440 WeakPolarHBondContact O-CB 3.5Å; C436-Y440 PolarHBondContact O-N 2.87Å; C437-Y440 PolarHBondContact O-N 2.93Å; I438-Y440 VanDerWaalsContact C-N 3.34Å; I438-Y440 PolarHBondContact O-N 2.97Å; Y440-F442 VanDerWaalsContact C-N 3.34Å; Y440-F442 PolarHBondContact O-N 2.97Å; Y440-G443 WeakPolarHBondContact O-CA 3.36Å; Y440-G443 PolarHBondContact O-N 3.48Å; Y440-G443 VanDerWaalsContact O-N 3.11Å; Y440-L444 HydrophobicContact CE1-CD1 4.05Å; Y440-L444 HydrophobicContact CE1-CD2 4.38Å; Y440-L444 HydrophobicContact CE1-CG 4.29Å; Y440-L444 HydrophobicContact CE2-CD2 4.03Å; Y440-L444 WeakPolarHBondContact O-CG 3.39Å; Y440-L444 PolarHBondContact O-N 3.26Å
441	L	98.1	Very high	96.7	Very high	113 Å²	113	40.2 Å²	40.2	59%	0.592	21%	0.211	S	C	*	.	H	α-helix	trans	-61.5	-40.7	179.5	-68.7	173.5	0	0	0	112.3	C437 I438 L444	C437-L441 WeakPolarHBondContact O-CG 3.26Å; C437-L441 PolarHBondContact O-N 3.4Å; I438-L441 PolarHBondContact O-N 3.41Å; L441-L444 HydrophobicContact CD2-CD1 4.33Å; L441-L444 WeakPolarHBondContact O-CB 3.14Å
442	F	96.9	Very high	96.6	Very high	117 Å²	117	38.3 Å²	38.3	51%	0.513	20%	0.203	S	C	.	.	H	α-helix	trans	-68.2	-40.6	172.2	-78.2	-72.2	0	0	0	112	I136 I438 S439 Y440 L444 T445	I136-F442 HydrophobicContact CD1-CB 4.02Å; I136-F442 HydrophobicContact CD1-CD2 4.4Å; I136-F442 HydrophobicContact CD1-CG 4.33Å; I136-F442 HydrophobicContact CG1-CB 4.38Å; I136-F442 HydrophobicContact CG2-CB 3.81Å; I438-F442 HydrophobicContact CG2-CD2 3.83Å; I438-F442 HydrophobicContact CG2-CE2 3.71Å; I438-F442 VanDerWaalsContact O-CD2 3.3Å; I438-F442 WeakPolarHBondContact O-CD2 3.5Å; I438-F442 PolarHBondContact O-N 2.95Å; I438-F442 VanDerWaalsContact O-N 3.09Å; S439-F442 PolarHBondContact O-N 2.97Å; Y440-F442 VanDerWaalsContact C-N 3.34Å; Y440-F442 PolarHBondContact O-N 2.97Å; F442-L444 PolarHBondContact O-N 3.08Å; F442-T445 WeakPolarHBondContact O-CB 3.46Å; F442-T445 WeakPolarHBondContact O-CG2 3.13Å; F442-T445 PolarHBondContact O-N 2.9Å; F442-T445 PolarHBondContact O-OG1 3.38Å
443	G	97.1	Very high	96.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-29	177.2	0	0	0	0	0	113.4	S439 Y440 T445 M446 V447	S439-G443 PolarHBondContact O-N 3.27Å; Y440-G443 WeakPolarHBondContact O-CA 3.36Å; Y440-G443 PolarHBondContact O-N 3.48Å; Y440-G443 VanDerWaalsContact O-N 3.11Å; G443-T445 PolarHBondContact O-N 2.88Å; G443-T445 VanDerWaalsContact O-N 3.15Å; G443-M446 PolarHBondContact O-N 3.33Å; G443-V447 PolarHBondContact O-N 2.86Å
444	L	97.9	Very high	96.6	Very high	36 Å²	36	38.2 Å²	38.2	19%	0.188	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-56.8	-29.7	174.4	-70.3	178.1	0	0	0	113.2	V216 A221 L224 Y440 L441 F442 M446 V447	V216-L444 HydrophobicContact CG1-CD2 4.29Å; A221-L444 HydrophobicContact CB-CD2 3.75Å; L224-L444 HydrophobicContact CD2-CD2 4.46Å; Y440-L444 HydrophobicContact CE1-CD1 4.05Å; Y440-L444 HydrophobicContact CE1-CD2 4.38Å; Y440-L444 HydrophobicContact CE1-CG 4.29Å; Y440-L444 HydrophobicContact CE2-CD2 4.03Å; Y440-L444 WeakPolarHBondContact O-CG 3.39Å; Y440-L444 PolarHBondContact O-N 3.26Å; L441-L444 HydrophobicContact CD2-CD1 4.33Å; L441-L444 WeakPolarHBondContact O-CB 3.14Å; F442-L444 PolarHBondContact O-N 3.08Å; L444-M446 PolarHBondContact O-N 3.39Å; L444-V447 PolarHBondContact O-N 3Å; L444-V447 VanDerWaalsContact O-N 3.13Å
445	T	96.6	Very high	96.5	Very high	61 Å²	61	34.2 Å²	34.2	37%	0.374	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-62.6	-31.2	176.4	65.1	0	0	0	0	112.4	F442 G443 V447 T448	F442-T445 WeakPolarHBondContact O-CB 3.46Å; F442-T445 WeakPolarHBondContact O-CG2 3.13Å; F442-T445 PolarHBondContact O-N 2.9Å; F442-T445 PolarHBondContact O-OG1 3.38Å; G443-T445 PolarHBondContact O-N 2.88Å; G443-T445 VanDerWaalsContact O-N 3.15Å; T445-V447 VanDerWaalsContact C-N 3.35Å; T445-T448 PolarHBondContact O-OG1 3.24Å
446	M	96.3	Very high	96.3	Very high	3 Å²	3	35 Å²	35	2%	0.015	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-88.8	-4.4	179	-58.9	173.4	-158.9	0	0	113	I136 Y137 V140 G443 L444 G451 V454 F455 F458	I136-M446 HydrophobicContact CG2-CE 3.71Å; Y137-M446 VanDerWaalsContact CA-SD 3.6Å; Y137-M446 VanDerWaalsContact CB-SD 3.51Å; V140-M446 HydrophobicContact CG1-CB 4.38Å; V140-M446 HydrophobicContact CG2-CB 3.96Å; V140-M446 HydrophobicContact CG2-SD 4.05Å; G443-M446 PolarHBondContact O-N 3.33Å; L444-M446 PolarHBondContact O-N 3.39Å; M446-G451 CarbonylContact O-C 3.02Å; M446-G451 WeakPolarHBondContact O-CA 3.48Å; M446-V454 HydrophobicContact CG-CB 4.28Å; M446-V454 HydrophobicContact CG-CG1 3.93Å; M446-F455 HydrophobicContact CB-CB 4.35Å; M446-F455 HydrophobicContact CG-CB 4.35Å; M446-F455 HydrophobicContact SD-CB 4.46Å; M446-F455 HydrophobicContact SD-CD2 4.46Å; M446-F458 HydrophobicContact CE-CB 4.14Å; M446-F458 HydrophobicContact CE-CD1 3.53Å; M446-F458 HydrophobicContact CE-CD2 3.55Å; M446-F458 HydrophobicContact CE-CE1 3.69Å; M446-F458 HydrophobicContact CE-CE2 3.71Å; M446-F458 HydrophobicContact CE-CG 3.46Å; M446-F458 VanDerWaalsContact CE-CG 3.46Å; M446-F458 HydrophobicContact CE-CZ 3.77Å
447	V	97.1	Very high	96.1	Very high	3 Å²	3	35 Å²	35	2%	0.018	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-109.9	21.7	177.8	-173.6	0	0	0	0	111.1	V140 K217 L220 A221 L224 G443 L444 T445	V140-V447 HydrophobicContact CG1-CG2 4.08Å; K217-V447 HydrophobicContact CB-CG1 4.44Å; K217-V447 WeakPolarHBondContact CB-O 3.48Å; K217-V447 PolarHBondContact N-O 3.13Å; L220-V447 HydrophobicContact CB-CG1 3.18Å; L220-V447 HydrophobicContact CD1-CG1 4.21Å; L220-V447 HydrophobicContact CG-CG1 4.35Å; A221-V447 HydrophobicContact CB-CG1 4.42Å; L224-V447 HydrophobicContact CD2-CG2 3.91Å; G443-V447 PolarHBondContact O-N 2.86Å; L444-V447 PolarHBondContact O-N 3Å; L444-V447 VanDerWaalsContact O-N 3.13Å; T445-V447 VanDerWaalsContact C-N 3.35Å
448	T	97.4	Very high	95.9	Very high	13 Å²	13	32.5 Å²	32.5	8%	0.08	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-89.9	172.3	168.1	59.3	0	0	0	0	110.7	I213 P215 V216 T445 G450 G451	I213-T448 HydrophobicContact CG2-CG2 3.69Å; I213-T448 WeakPolarHBondContact CG2-OG1 2.95Å; I213-T448 WeakPolarHBondContact O-CB 3.24Å; P215-T448 WeakPolarHBondContact O-CA 3.21Å; V216-T448 HydrophobicContact CG2-CG2 3.89Å; T445-T448 PolarHBondContact O-OG1 3.24Å; T448-G450 VanDerWaalsContact C-N 3.28Å; T448-G450 PolarHBondContact O-N 2.65Å; T448-G451 WeakPolarHBondContact O-CA 3.41Å; T448-G451 PolarHBondContact O-N 2.82Å; T448-G451 WeakPolarHBondContact OG1-CA 3.31Å; T448-G451 PolarHBondContact OG1-N 2.88Å
449	K	95.7	Very high	95.5	Very high	90 Å²	90	31.2 Å²	31.2	39%	0.391	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.6	173.1	-69.2	-162.7	177.6	-170.7	0	112.9	G205 I206 S207 I213 P215 G451	G205-K449 WeakPolarHBondContact O-CB 3.32Å; G205-K449 WeakPolarHBondContact O-CD 3.36Å; G205-K449 WeakPolarHBondContact O-CG 3.43Å; I206-K449 VanDerWaalsContact CA-O 3.28Å; I206-K449 WeakPolarHBondContact CA-O 3.4Å; S207-K449 PolarHBondContact N-O 3.26Å; S207-K449 VanDerWaalsContact N-O 3.12Å; I213-K449 PolarHBondContact O-N 2.94Å; P215-K449 HydrophobicContact CG-CD 4.29Å; P215-K449 HydrophobicContact CG-CG 4.41Å; P215-K449 PolarHBondContact O-N 3.43Å; K449-G451 VanDerWaalsContact C-N 3.27Å
450	G	95.1	Very high	95.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8.4	171.6	0	0	0	0	0	113.9	S207 I213 T448 M452 Y453	S207-G450 WeakPolarHBondContact OG-CA 3.21Å; S207-G450 PolarHBondContact OG-N 2.92Å; I213-G450 PolarHBondContact O-N 3.06Å; T448-G450 VanDerWaalsContact C-N 3.28Å; T448-G450 PolarHBondContact O-N 2.65Å; G450-M452 VanDerWaalsContact C-N 3.26Å; G450-M452 PolarHBondContact O-N 2.81Å; G450-Y453 PolarHBondContact O-N 3.07Å; G450-Y453 VanDerWaalsContact O-N 3.12Å
451	G	95.9	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-28.7	-171.3	0	0	0	0	0	113.8	M446 T448 K449 Y453 V454 F455	M446-G451 CarbonylContact O-C 3.02Å; M446-G451 WeakPolarHBondContact O-CA 3.48Å; T448-G451 WeakPolarHBondContact O-CA 3.41Å; T448-G451 PolarHBondContact O-N 2.82Å; T448-G451 WeakPolarHBondContact OG1-CA 3.31Å; T448-G451 PolarHBondContact OG1-N 2.88Å; K449-G451 VanDerWaalsContact C-N 3.27Å; G451-Y453 VanDerWaalsContact C-N 3.3Å; G451-Y453 PolarHBondContact O-N 3.24Å; G451-V454 PolarHBondContact O-N 3Å; G451-F455 WeakPolarHBondContact O-CB 3.36Å; G451-F455 PolarHBondContact O-N 3.39Å
452	M	94.1	Very high	94.2	Very high	7 Å²	7	28.2 Å²	28.2	3%	0.034	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-36.9	175.3	-171.4	61.6	-164.9	0	0	112.1	W144 L204 I206 P367 G450 F455 Q456 Y532	W144-M452 HydrophobicContact CH2-SD 3.72Å; W144-M452 HydrophobicContact CZ2-SD 4.09Å; L204-M452 HydrophobicContact CD1-CB 4.13Å; L204-M452 HydrophobicContact CD1-CG 4.1Å; L204-M452 HydrophobicContact CD1-SD 4.35Å; I206-M452 HydrophobicContact CD1-CB 4.03Å; I206-M452 HydrophobicContact CD1-CG 4.26Å; P367-M452 HydrophobicContact CG-CE 4.18Å; G450-M452 VanDerWaalsContact C-N 3.26Å; G450-M452 PolarHBondContact O-N 2.81Å; M452-F455 HydrophobicContact CE-CD1 4.17Å; M452-F455 HydrophobicContact CE-CE1 4.49Å; M452-F455 PolarHBondContact O-N 3.32Å; M452-F455 HydrophobicContact SD-CD1 4.17Å; M452-Q456 HydrophobicContact CE-CG 3.98Å; M452-Q456 WeakPolarHBondContact O-CG 3.38Å; M452-Q456 PolarHBondContact O-N 3.48Å; M452-Y532 HydrophobicContact CE-CE2 4.12Å; M452-Y532 HydrophobicContact CG-CE2 3.87Å
453	Y	94.9	Very high	93.2	Very high	12 Å²	12	22.8 Å²	22.8	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-68.8	-39.4	178	-58.9	-69.5	0	0	0	111.9	I206 S207 S208 G209 I210 G450 G451 L457 Y532 Y536 Y538	I206-Y453 HydrophobicContact CD1-CE2 4.41Å; I206-Y453 HydrophobicContact CG1-CE2 4.1Å; S207-Y453 WeakPolarHBondContact O-CE2 3.37Å; S207-Y453 PolarHBondContact O-OH 3.2Å; S208-Y453 PolarHBondContact O-OH 3.44Å; G209-Y453 VanDerWaalsContact C-CD2 3.42Å; G209-Y453 VanDerWaalsContact C-CE2 3.47Å; G209-Y453 VanDerWaalsContact CA-CE2 3.4Å; I210-Y453 HydrophobicContact CB-CG 4.32Å; G450-Y453 PolarHBondContact O-N 3.07Å; G450-Y453 VanDerWaalsContact O-N 3.12Å; G451-Y453 VanDerWaalsContact C-N 3.3Å; G451-Y453 PolarHBondContact O-N 3.24Å; Y453-L457 PolarHBondContact O-N 2.88Å; Y453-Y532 HydrophobicContact CD1-CD1 4.36Å; Y453-Y532 HydrophobicContact CD1-CG 4.22Å; Y453-Y532 AromaticContact CE1-CD1 3.53Å; Y453-Y532 HydrophobicContact CE1-CD1 3.53Å; Y453-Y532 HydrophobicContact CE1-CE1 4.21Å; Y453-Y532 AromaticContact CE1-CG 3.81Å; Y453-Y532 HydrophobicContact CE1-CG 3.81Å; Y453-Y536 AromaticContact CD1-CD1 3.84Å; Y453-Y536 HydrophobicContact CD1-CD1 3.84Å; Y453-Y536 AromaticContact CD1-CE1 3.78Å; Y453-Y536 HydrophobicContact CD1-CE1 3.78Å; Y453-Y536 AromaticContact CE1-CD1 3.6Å; Y453-Y536 HydrophobicContact CE1-CD1 3.6Å; Y453-Y536 HydrophobicContact CE1-CD2 4.48Å; Y453-Y536 AromaticContact CE1-CE1 3.88Å; Y453-Y536 HydrophobicContact CE1-CE1 3.88Å; Y453-Y536 AromaticContact CE1-CG 3.93Å; Y453-Y536 HydrophobicContact CE1-CG 3.93Å; Y453-Y538 VanDerWaalsContact CA-OH 3.31Å; Y453-Y538 WeakPolarHBondContact CA-OH 3.29Å; Y453-Y538 PolarHBondContact O-OH 2.94Å
454	V	95.4	Very high	92.1	Very high	20 Å²	20	23.5 Å²	23.5	12%	0.121	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-45.3	175.4	-177.5	0	0	0	0	110.5	I210 M446 G451 Q456 L457 F458	I210-V454 HydrophobicContact CD1-CG2 4.41Å; I210-V454 HydrophobicContact CG1-CG2 4.28Å; M446-V454 HydrophobicContact CG-CB 4.28Å; M446-V454 HydrophobicContact CG-CG1 3.93Å; G451-V454 PolarHBondContact O-N 3Å; V454-Q456 VanDerWaalsContact C-N 3.31Å; V454-Q456 PolarHBondContact O-N 2.91Å; V454-L457 WeakPolarHBondContact O-CB 3.37Å; V454-L457 PolarHBondContact O-N 3.28Å; V454-L457 VanDerWaalsContact O-N 3.12Å; V454-F458 HydrophobicContact CG1-CD2 4.28Å; V454-F458 HydrophobicContact CG1-CE2 4.19Å; V454-F458 WeakPolarHBondContact O-CD2 3.45Å; V454-F458 PolarHBondContact O-N 2.88Å; V454-F458 VanDerWaalsContact O-N 3.16Å
455	F	94.8	Very high	91	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.009	11%	0.11	C	C	.	.	H	α-helix	trans	-53.4	-48.5	175.5	171	-86.6	0	0	0	111.3	Y137 V140 I141 W144 P367 M446 G451 M452 L457 F458 D459	Y137-F455 HydrophobicContact CD2-CD2 4.16Å; Y137-F455 AromaticContact CD2-CE2 3.64Å; Y137-F455 HydrophobicContact CD2-CE2 3.64Å; Y137-F455 AromaticContact CD2-CZ 3.98Å; Y137-F455 HydrophobicContact CD2-CZ 3.98Å; Y137-F455 HydrophobicContact CE2-CE2 4.46Å; Y137-F455 HydrophobicContact CE2-CZ 4.39Å; Y137-F455 WeakPolarHBondContact O-CE2 3.34Å; V140-F455 HydrophobicContact CB-CD2 4.22Å; V140-F455 HydrophobicContact CB-CE2 4.41Å; V140-F455 HydrophobicContact CG1-CD2 4.39Å; I141-F455 HydrophobicContact CD1-CE2 4.15Å; I141-F455 HydrophobicContact CD1-CZ 3.84Å; I141-F455 HydrophobicContact CG1-CE2 3.66Å; I141-F455 HydrophobicContact CG1-CZ 3.68Å; W144-F455 AromaticContact CH2-CD1 3.9Å; W144-F455 HydrophobicContact CH2-CD1 3.9Å; W144-F455 AromaticContact CH2-CD2 3.72Å; W144-F455 HydrophobicContact CH2-CD2 3.72Å; W144-F455 AromaticContact CH2-CE1 3.98Å; W144-F455 HydrophobicContact CH2-CE1 3.98Å; W144-F455 AromaticContact CH2-CE2 3.76Å; W144-F455 HydrophobicContact CH2-CE2 3.76Å; W144-F455 AromaticContact CH2-CG 3.8Å; W144-F455 HydrophobicContact CH2-CG 3.8Å; W144-F455 AromaticContact CH2-CZ 3.9Å; W144-F455 HydrophobicContact CH2-CZ 3.9Å; W144-F455 HydrophobicContact CZ2-CD2 4.39Å; W144-F455 HydrophobicContact CZ2-CG 4.49Å; W144-F455 HydrophobicContact CZ3-CD2 4.41Å; W144-F455 HydrophobicContact CZ3-CE1 4.22Å; W144-F455 AromaticContact CZ3-CE2 3.98Å; W144-F455 HydrophobicContact CZ3-CE2 3.98Å; W144-F455 AromaticContact CZ3-CZ 3.89Å; W144-F455 HydrophobicContact CZ3-CZ 3.89Å; P367-F455 HydrophobicContact CG-CE1 4.07Å; P367-F455 HydrophobicContact CG-CZ 4.44Å; M446-F455 HydrophobicContact CB-CB 4.35Å; M446-F455 HydrophobicContact CG-CB 4.35Å; M446-F455 HydrophobicContact SD-CB 4.46Å; M446-F455 HydrophobicContact SD-CD2 4.46Å; G451-F455 WeakPolarHBondContact O-CB 3.36Å; G451-F455 PolarHBondContact O-N 3.39Å; M452-F455 HydrophobicContact CE-CD1 4.17Å; M452-F455 HydrophobicContact CE-CE1 4.49Å; M452-F455 PolarHBondContact O-N 3.32Å; M452-F455 HydrophobicContact SD-CD1 4.17Å; F455-L457 VanDerWaalsContact C-N 3.31Å; F455-L457 PolarHBondContact O-N 2.87Å; F455-F458 PolarHBondContact O-N 3.45Å; F455-D459 HydrophobicContact CE1-CB 4.41Å; F455-D459 PolarHBondContact O-N 3.41Å
456	Q	92.1	Very high	90.4	Very high	36 Å²	36	20.6 Å²	20.6	17%	0.168	10%	0.101	C	C	.	.	H	α-helix	trans	-66.5	-31.6	179.3	-75.1	-161.7	-22	0	0	113.7	M452 V454 F458 D459 Y460 L530 Y532 Y538	M452-Q456 HydrophobicContact CE-CG 3.98Å; M452-Q456 WeakPolarHBondContact O-CG 3.38Å; M452-Q456 PolarHBondContact O-N 3.48Å; V454-Q456 VanDerWaalsContact C-N 3.31Å; V454-Q456 PolarHBondContact O-N 2.91Å; Q456-F458 VanDerWaalsContact C-N 3.31Å; Q456-D459 PolarHBondContact O-N 3.26Å; Q456-Y460 WeakPolarHBondContact O-CB 3.29Å; Q456-Y460 PolarHBondContact O-N 3.19Å; Q456-L530 HydrophobicContact CB-CD2 4.27Å; Q456-Y532 VanDerWaalsContact CD-CD2 3.47Å; Q456-Y532 VanDerWaalsContact NE2-CD2 3.32Å; Q456-Y538 WeakPolarHBondContact CB-OH 3.03Å; Q456-Y538 PolarHBondContact OE1-OH 2.96Å
457	L	92.6	Very high	90.2	Very high	6 Å²	6	20.5 Å²	20.5	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-41	175.1	-163.4	73.4	0	0	0	111	Y453 V454 F455 Y461 L530 A542 I545 L549	Y453-L457 PolarHBondContact O-N 2.88Å; V454-L457 WeakPolarHBondContact O-CB 3.37Å; V454-L457 PolarHBondContact O-N 3.28Å; V454-L457 VanDerWaalsContact O-N 3.12Å; F455-L457 VanDerWaalsContact C-N 3.31Å; F455-L457 PolarHBondContact O-N 2.87Å; L457-Y461 HydrophobicContact CD1-CD2 3.7Å; L457-Y461 HydrophobicContact CD1-CE2 3.75Å; L457-Y461 HydrophobicContact CG-CD2 4.24Å; L457-Y461 WeakPolarHBondContact O-CB 3.42Å; L457-Y461 PolarHBondContact O-N 3.27Å; L457-L530 HydrophobicContact CD1-CD2 4.33Å; L457-A542 WeakPolarHBondContact CD1-O 3.48Å; L457-I545 HydrophobicContact CD2-CB 4.06Å; L457-I545 HydrophobicContact CD2-CG2 3.71Å; L457-L549 HydrophobicContact CD2-CD1 4.4Å; L457-L549 HydrophobicContact CG-CD1 4.46Å
458	F	93.2	Very high	90	Very high	25 Å²	25	20.4 Å²	20.4	11%	0.11	10%	0.1	C	C	.	.	I	π-helix	trans	-66.5	-49.8	174.6	-87	-114.2	0	0	0	111.8	L133 Y137 M446 V454 F455 Q456 Y460 A462 A463 L549	L133-F458 HydrophobicContact CB-CD1 4.48Å; L133-F458 HydrophobicContact CD2-CE1 3.84Å; Y137-F458 HydrophobicContact CD1-CB 4.07Å; Y137-F458 HydrophobicContact CG-CB 4.05Å; M446-F458 HydrophobicContact CE-CB 4.14Å; M446-F458 HydrophobicContact CE-CD1 3.53Å; M446-F458 HydrophobicContact CE-CD2 3.55Å; M446-F458 HydrophobicContact CE-CE1 3.69Å; M446-F458 HydrophobicContact CE-CE2 3.71Å; M446-F458 HydrophobicContact CE-CG 3.46Å; M446-F458 VanDerWaalsContact CE-CG 3.46Å; M446-F458 HydrophobicContact CE-CZ 3.77Å; V454-F458 HydrophobicContact CG1-CD2 4.28Å; V454-F458 HydrophobicContact CG1-CE2 4.19Å; V454-F458 WeakPolarHBondContact O-CD2 3.45Å; V454-F458 PolarHBondContact O-N 2.88Å; V454-F458 VanDerWaalsContact O-N 3.16Å; F455-F458 PolarHBondContact O-N 3.45Å; Q456-F458 VanDerWaalsContact C-N 3.31Å; F458-Y460 VanDerWaalsContact C-N 3.3Å; F458-Y460 PolarHBondContact O-N 2.63Å; F458-A462 HydrophobicContact CB-CB 4.43Å; F458-A462 HydrophobicContact CD1-CB 4.22Å; F458-A462 HydrophobicContact CG-CB 4.45Å; F458-A462 VanDerWaalsContact O-CB 3.26Å; F458-A462 WeakPolarHBondContact O-CB 3.16Å; F458-A462 PolarHBondContact O-N 2.76Å; F458-A463 PolarHBondContact O-N 2.84Å; F458-L549 HydrophobicContact CD2-CD1 4Å; F458-L549 HydrophobicContact CE2-CD1 3.98Å; F458-L549 HydrophobicContact CG-CD1 4.48Å; F458-L549 HydrophobicContact CZ-CD1 4.44Å; F458-L549 HydrophobicContact CZ-CD2 4.26Å
459	D	90.1	Very high	89.7	Confident	57 Å²	57	19.9 Å²	19.9	31%	0.305	10%	0.096	S	C	.	.	I	π-helix	trans	-61.1	-39.2	-179.3	-173.1	50.3	0	0	0	112	Y137 F455 Q456	Y137-D459 HydrophobicContact CD2-CB 4.15Å; Y137-D459 HydrophobicContact CE2-CB 3.72Å; Y137-D459 WeakPolarHBondContact CE2-OD1 3.39Å; Y137-D459 PolarHBondContact OH-OD1 2.68Å; F455-D459 HydrophobicContact CE1-CB 4.41Å; F455-D459 PolarHBondContact O-N 3.41Å; Q456-D459 PolarHBondContact O-N 3.26Å
460	Y	88.9	Confident	89.6	Confident	97 Å²	97	17.9 Å²	17.9	38%	0.38	9%	0.087	S	C	.	.	I	π-helix	trans	-79.4	-38.4	-177.9	-169	-91.4	0	0	0	113.8	Q456 F458 S464 K528 L530	Q456-Y460 WeakPolarHBondContact O-CB 3.29Å; Q456-Y460 PolarHBondContact O-N 3.19Å; F458-Y460 VanDerWaalsContact C-N 3.3Å; F458-Y460 PolarHBondContact O-N 2.63Å; Y460-S464 WeakPolarHBondContact O-CB 3.44Å; Y460-K528 PolarHBondContact OH-O 2.9Å; Y460-L530 HydrophobicContact CD1-CB 4.3Å; Y460-L530 HydrophobicContact CD1-CD1 4.48Å; Y460-L530 HydrophobicContact CD2-CD1 3.73Å; Y460-L530 HydrophobicContact CE2-CD1 4.31Å; Y460-L530 HydrophobicContact CG-CB 4.45Å; Y460-L530 HydrophobicContact CG-CD1 3.81Å; Y460-L530 HydrophobicContact CG-CD2 4.41Å; Y460-L530 HydrophobicContact CG-CG 4.45Å
461	Y	90.6	Very high	89.7	Confident	7 Å²	7	17.9 Å²	17.9	3%	0.027	9%	0.087	C	C	.	.	I	π-helix	trans	-109.8	-43.9	-173.2	-68.7	-80.8	0	0	0	115	L457 S464 Y527 L530 G546 W547	L457-Y461 HydrophobicContact CD1-CD2 3.7Å; L457-Y461 HydrophobicContact CD1-CE2 3.75Å; L457-Y461 HydrophobicContact CG-CD2 4.24Å; L457-Y461 WeakPolarHBondContact O-CB 3.42Å; L457-Y461 PolarHBondContact O-N 3.27Å; Y461-S464 WeakPolarHBondContact O-CB 3.42Å; Y461-S464 PolarHBondContact O-OG 3.33Å; Y461-Y527 HydrophobicContact CE1-CE2 4.09Å; Y461-Y527 PolarHBondContact OH-OH 3.31Å; Y461-L530 HydrophobicContact CE2-CB 4.24Å; Y461-L530 HydrophobicContact CE2-CD2 4.36Å; Y461-G546 WeakPolarHBondContact CB-O 3.5Å; Y461-G546 VanDerWaalsContact CD2-CA 3.49Å; Y461-G546 VanDerWaalsContact CG-C 3.5Å; Y461-W547 HydrophobicContact CE1-CD2 4.37Å; Y461-W547 HydrophobicContact CE1-CG 4.46Å; Y461-W547 AromaticContact CE1-NE1 3.99Å
462	A	86.6	Confident	89.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-71.5	-50.8	-167.5	0	0	0	0	0	112.5	L133 F458 L549	L133-A462 HydrophobicContact CB-CB 3.9Å; L133-A462 HydrophobicContact CD1-CB 3.87Å; L133-A462 HydrophobicContact CG-CB 4.42Å; F458-A462 HydrophobicContact CB-CB 4.43Å; F458-A462 HydrophobicContact CD1-CB 4.22Å; F458-A462 HydrophobicContact CG-CB 4.45Å; F458-A462 VanDerWaalsContact O-CB 3.26Å; F458-A462 WeakPolarHBondContact O-CB 3.16Å; F458-A462 PolarHBondContact O-N 2.76Å; A462-L549 HydrophobicContact CB-CB 4.03Å; A462-L549 HydrophobicContact CB-CD1 4.39Å
463	A	74.5	Confident	89.8	Confident	4 Å²	4	19.3 Å²	19.3	3%	0.033	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	35.6	173.1	0	0	0	0	0	111.4	I130 L134 Y137 F458	I130-A463 HydrophobicContact CG2-CB 4.26Å; L134-A463 HydrophobicContact CB-CB 3.93Å; L134-A463 HydrophobicContact CD1-CB 3.97Å; L134-A463 HydrophobicContact CG-CB 4.02Å; Y137-A463 HydrophobicContact CE1-CB 3.82Å; F458-A463 PolarHBondContact O-N 2.84Å
464	S	73.6	Confident	90	Very high	14 Å²	14	20.5 Å²	20.5	10%	0.098	10%	0.098	C	C	.	.			trans	-64.6	153.1	-177.4	76.1	0	0	0	0	111.7	Y460 Y461 V466 C467 L468	Y460-S464 WeakPolarHBondContact O-CB 3.44Å; Y461-S464 WeakPolarHBondContact O-CB 3.42Å; Y461-S464 PolarHBondContact O-OG 3.33Å; S464-V466 PolarHBondContact O-N 3.23Å; S464-V466 VanDerWaalsContact O-N 3.15Å; S464-V466 PolarHBondContact OG-N 3.42Å; S464-C467 PolarHBondContact O-N 2.49Å; S464-C467 VanDerWaalsContact O-N 3.12Å; S464-C467 PolarHBondContact OG-N 3.39Å; S464-C467 PolarHBondContact OG-SG 3.23Å; S464-L468 PolarHBondContact O-N 3.02Å
465	G	75.6	Confident	90.1	Very high	7 Å²	7	19.6 Å²	19.6	7%	0.072	9%	0.093	C	C	.	.	H	α-helix	trans	-54	-33.5	171.3	0	0	0	0	0	112.8	T296 C467 L468 L469	T296-G465 VanDerWaalsContact CG2-CA 3.41Å; G465-C467 PolarHBondContact O-N 2.76Å; G465-L468 PolarHBondContact O-N 3.07Å; G465-L469 WeakPolarHBondContact O-CB 3.31Å; G465-L469 WeakPolarHBondContact O-CG 3Å; G465-L469 PolarHBondContact O-N 3.46Å
466	V	84.6	Confident	90.2	Very high	29 Å²	29	19.5 Å²	19.5	18%	0.176	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-42.5	179.7	-177.3	0	0	0	0	111.6	S464 L469 W470 F520 S523	S464-V466 PolarHBondContact O-N 3.23Å; S464-V466 VanDerWaalsContact O-N 3.15Å; S464-V466 PolarHBondContact OG-N 3.42Å; V466-L469 PolarHBondContact O-N 2.86Å; V466-W470 WeakPolarHBondContact O-CB 3.26Å; V466-W470 PolarHBondContact O-N 3.36Å; V466-F520 HydrophobicContact CG1-CD2 3.44Å; V466-F520 VanDerWaalsContact CG1-CD2 3.44Å; V466-F520 HydrophobicContact CG1-CE2 3.45Å; V466-F520 VanDerWaalsContact CG1-CE2 3.45Å; V466-S523 WeakPolarHBondContact CG2-OG 3.17Å
467	C	91.7	Very high	90.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-62.4	-43.1	175	-62.7	0	0	0	0	111.4	I130 S464 G465 W470 V471	I130-C467 HydrophobicContact CD1-CB 4.02Å; I130-C467 HydrophobicContact CG1-CB 4.47Å; S464-C467 PolarHBondContact O-N 2.49Å; S464-C467 VanDerWaalsContact O-N 3.12Å; S464-C467 PolarHBondContact OG-N 3.39Å; S464-C467 PolarHBondContact OG-SG 3.23Å; G465-C467 PolarHBondContact O-N 2.76Å; C467-W470 WeakPolarHBondContact O-CB 3.44Å; C467-W470 PolarHBondContact O-N 2.93Å; C467-V471 WeakPolarHBondContact O-CG2 3.42Å; C467-V471 PolarHBondContact O-N 3.03Å; C467-V471 VanDerWaalsContact O-N 3.09Å
468	L	92.3	Very high	90.6	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-65.9	-43.1	178.6	-61.3	178.7	0	0	0	112	I130 F299 F300 C305 L306 S464 G465 W470 V471 A472	I130-L468 HydrophobicContact CD1-CD2 4.42Å; I130-L468 HydrophobicContact CG2-CD2 4.12Å; F299-L468 HydrophobicContact CB-CB 4.32Å; F299-L468 HydrophobicContact CB-CD1 4.29Å; F300-L468 HydrophobicContact CB-CD1 4.4Å; F300-L468 HydrophobicContact CD2-CD1 4.33Å; C305-L468 HydrophobicContact CB-CD2 4.29Å; L306-L468 HydrophobicContact CD2-CD2 3.78Å; L306-L468 HydrophobicContact CG-CD2 4.28Å; S464-L468 PolarHBondContact O-N 3.02Å; G465-L468 PolarHBondContact O-N 3.07Å; L468-W470 VanDerWaalsContact C-N 3.3Å; L468-W470 PolarHBondContact O-N 2.88Å; L468-V471 PolarHBondContact O-N 3.31Å; L468-A472 WeakPolarHBondContact O-CB 3.32Å; L468-A472 PolarHBondContact O-N 3.45Å
469	L	91.7	Very high	90.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-38	176	-66.7	171	0	0	0	111.8	F299 G465 V466 F473 C516 C519	F299-L469 HydrophobicContact CD1-CD2 4.41Å; F299-L469 HydrophobicContact CD2-CD2 4.19Å; F299-L469 HydrophobicContact CE1-CD2 4.39Å; F299-L469 HydrophobicContact CE2-CD2 4.12Å; F299-L469 HydrophobicContact CG-CD2 4.32Å; F299-L469 HydrophobicContact CZ-CD2 4.22Å; G465-L469 WeakPolarHBondContact O-CB 3.31Å; G465-L469 WeakPolarHBondContact O-CG 3Å; G465-L469 PolarHBondContact O-N 3.46Å; V466-L469 PolarHBondContact O-N 2.86Å; L469-F473 PolarHBondContact O-N 3.19Å; L469-C516 HydrophobicContact CB-CB 4.39Å; L469-C516 HydrophobicContact CD2-CB 4.32Å; L469-C519 HydrophobicContact CD1-CB 3.68Å
470	W	94.2	Very high	91	Very high	48 Å²	48	15.9 Å²	15.9	18%	0.182	8%	0.076	C	C	.	.	H	α-helix	trans	-61.6	-49.2	174.8	177.4	-101.9	0	0	0	111.7	V466 C467 L468 F473 F474 F520 M554	V466-W470 WeakPolarHBondContact O-CB 3.26Å; V466-W470 PolarHBondContact O-N 3.36Å; C467-W470 WeakPolarHBondContact O-CB 3.44Å; C467-W470 PolarHBondContact O-N 2.93Å; L468-W470 VanDerWaalsContact C-N 3.3Å; L468-W470 PolarHBondContact O-N 2.88Å; W470-F473 PolarHBondContact O-N 2.96Å; W470-F474 HydrophobicContact CD2-CD2 4.25Å; W470-F474 AromaticContact CD2-CE2 3.8Å; W470-F474 HydrophobicContact CD2-CE2 3.8Å; W470-F474 AromaticContact CE2-CD2 4Å; W470-F474 AromaticContact CE2-CE2 3.41Å; W470-F474 VanDerWaalsContact CE2-CE2 3.41Å; W470-F474 HydrophobicContact CE3-CE2 4.06Å; W470-F474 AromaticContact CH2-CE2 3.64Å; W470-F474 HydrophobicContact CH2-CE2 3.64Å; W470-F474 HydrophobicContact CH2-CZ 4.02Å; W470-F474 HydrophobicContact CZ2-CD2 4.34Å; W470-F474 AromaticContact CZ2-CE2 3.35Å; W470-F474 HydrophobicContact CZ2-CE2 3.35Å; W470-F474 AromaticContact CZ2-CZ 3.94Å; W470-F474 HydrophobicContact CZ2-CZ 3.94Å; W470-F474 AromaticContact CZ3-CE2 3.99Å; W470-F474 HydrophobicContact CZ3-CE2 3.99Å; W470-F474 AromaticContact NE1-CE2 3.93Å; W470-F474 VanDerWaalsContact O-CD2 3.32Å; W470-F474 WeakPolarHBondContact O-CD2 3.32Å; W470-F474 PolarHBondContact O-N 3.4Å; W470-F520 HydrophobicContact CB-CD2 4.45Å; W470-F520 HydrophobicContact CB-CE2 4.36Å; W470-F520 HydrophobicContact CE3-CD2 4.37Å; W470-F520 HydrophobicContact CE3-CE1 4.11Å; W470-F520 AromaticContact CE3-CE2 3.94Å; W470-F520 HydrophobicContact CE3-CE2 3.94Å; W470-F520 AromaticContact CE3-CZ 3.8Å; W470-F520 HydrophobicContact CE3-CZ 3.8Å; W470-F520 HydrophobicContact CZ3-CE1 4.14Å; W470-F520 HydrophobicContact CZ3-CZ 4.1Å; W470-M554 HydrophobicContact CB-CE 4.23Å; W470-M554 HydrophobicContact CB-CG 4.4Å; W470-M554 HydrophobicContact CD2-CE 3.72Å; W470-M554 HydrophobicContact CE3-CE 4Å; W470-M554 HydrophobicContact CG-CB 4.41Å; W470-M554 HydrophobicContact CG-CE 3.84Å; W470-M554 HydrophobicContact CG-CG 4.03Å; W470-M554 PolarHBondContact NE1-O 3.32Å; W470-M554 VanDerWaalsContact NE1-O 3.11Å
471	V	96.2	Very high	91.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.2	-47.4	178.3	176.8	0	0	0	0	110.7	I123 A126 I130 C305 C467 L468 F473 F474 E475 I557	I123-V471 HydrophobicContact CG2-CG1 3.96Å; A126-V471 HydrophobicContact CB-CG2 3.99Å; I130-V471 HydrophobicContact CD1-CG2 3.77Å; C305-V471 HydrophobicContact CB-CB 3.94Å; C305-V471 HydrophobicContact CB-CG1 3.69Å; C467-V471 WeakPolarHBondContact O-CG2 3.42Å; C467-V471 PolarHBondContact O-N 3.03Å; C467-V471 VanDerWaalsContact O-N 3.09Å; L468-V471 PolarHBondContact O-N 3.31Å; V471-F473 VanDerWaalsContact C-N 3.29Å; V471-F473 PolarHBondContact O-N 3.44Å; V471-F474 PolarHBondContact O-N 2.62Å; V471-E475 HydrophobicContact CG1-CG 4.19Å; V471-E475 WeakPolarHBondContact O-CG 3.38Å; V471-E475 PolarHBondContact O-N 2.8Å; V471-I557 HydrophobicContact CG2-CD1 4.41Å
472	A	96.1	Very high	91.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-56.6	-39.7	179.2	0	0	0	0	0	114	F299 C305 L468 E475 C476	F299-A472 HydrophobicContact CD1-CB 4.07Å; F299-A472 HydrophobicContact CE1-CB 3.36Å; F299-A472 HydrophobicContact CZ-CB 4.28Å; C305-A472 VanDerWaalsContact SG-CA 3.59Å; C305-A472 VanDerWaalsContact SG-CB 3.55Å; L468-A472 WeakPolarHBondContact O-CB 3.32Å; L468-A472 PolarHBondContact O-N 3.45Å; A472-E475 PolarHBondContact O-N 3.38Å; A472-C476 PolarHBondContact O-N 3.37Å; A472-C476 VanDerWaalsContact O-N 3.08Å; A472-C476 PolarHBondContact O-SG 3.32Å
473	F	96.9	Very high	91.7	Very high	37 Å²	37	22.1 Å²	22.1	16%	0.162	11%	0.105	C	C	.	.	H	α-helix	trans	-57.9	-51.2	174.4	170.5	-97.9	0	0	0	110.3	L469 W470 V471 E475 C476 I477 P513 C516 M517	L469-F473 PolarHBondContact O-N 3.19Å; W470-F473 PolarHBondContact O-N 2.96Å; V471-F473 VanDerWaalsContact C-N 3.29Å; V471-F473 PolarHBondContact O-N 3.44Å; F473-E475 PolarHBondContact O-N 2.85Å; F473-C476 PolarHBondContact O-N 3.2Å; F473-I477 HydrophobicContact CD1-CG1 4.36Å; F473-I477 HydrophobicContact CD2-CG1 4.46Å; F473-I477 HydrophobicContact CE1-CG1 3.93Å; F473-I477 HydrophobicContact CE2-CD1 4.18Å; F473-I477 HydrophobicContact CE2-CG1 4.04Å; F473-I477 HydrophobicContact CZ-CD1 4.13Å; F473-I477 HydrophobicContact CZ-CG1 3.75Å; F473-I477 WeakPolarHBondContact O-CG1 3.44Å; F473-I477 PolarHBondContact O-N 2.94Å; F473-P513 HydrophobicContact CD2-CB 3.98Å; F473-P513 HydrophobicContact CE2-CB 4.11Å; F473-C516 HydrophobicContact CB-CB 4.22Å; F473-M517 HydrophobicContact CD1-CE 3.68Å; F473-M517 HydrophobicContact CD2-CB 4.15Å; F473-M517 HydrophobicContact CD2-CE 3.75Å; F473-M517 HydrophobicContact CE1-CE 3.57Å; F473-M517 HydrophobicContact CE2-CB 4.3Å; F473-M517 HydrophobicContact CE2-CE 3.64Å; F473-M517 HydrophobicContact CG-CE 3.77Å; F473-M517 HydrophobicContact CZ-CE 3.55Å
474	F	97.8	Very high	92.6	Very high	37 Å²	37	22.8 Å²	22.8	16%	0.162	11%	0.113	C	C	.	.	H	α-helix	trans	-69.3	-32.2	-179.7	-77.2	-72.5	0	0	0	113.7	F120 I123 W470 V471 C476 I477 A478 I557	F120-F474 HydrophobicContact CD1-CD1 4.4Å; F120-F474 AromaticContact CE1-CD1 3.72Å; F120-F474 HydrophobicContact CE1-CD1 3.72Å; F120-F474 HydrophobicContact CE1-CE1 4.29Å; F120-F474 HydrophobicContact CZ-CD1 4.49Å; I123-F474 HydrophobicContact CD1-CB 4Å; I123-F474 WeakPolarHBondContact CD1-O 3.32Å; I123-F474 HydrophobicContact CG1-CB 4.11Å; W470-F474 HydrophobicContact CD2-CD2 4.25Å; W470-F474 AromaticContact CD2-CE2 3.8Å; W470-F474 HydrophobicContact CD2-CE2 3.8Å; W470-F474 AromaticContact CE2-CD2 4Å; W470-F474 AromaticContact CE2-CE2 3.41Å; W470-F474 VanDerWaalsContact CE2-CE2 3.41Å; W470-F474 HydrophobicContact CE3-CE2 4.06Å; W470-F474 AromaticContact CH2-CE2 3.64Å; W470-F474 HydrophobicContact CH2-CE2 3.64Å; W470-F474 HydrophobicContact CH2-CZ 4.02Å; W470-F474 HydrophobicContact CZ2-CD2 4.34Å; W470-F474 AromaticContact CZ2-CE2 3.35Å; W470-F474 HydrophobicContact CZ2-CE2 3.35Å; W470-F474 AromaticContact CZ2-CZ 3.94Å; W470-F474 HydrophobicContact CZ2-CZ 3.94Å; W470-F474 AromaticContact CZ3-CE2 3.99Å; W470-F474 HydrophobicContact CZ3-CE2 3.99Å; W470-F474 AromaticContact NE1-CE2 3.93Å; W470-F474 VanDerWaalsContact O-CD2 3.32Å; W470-F474 WeakPolarHBondContact O-CD2 3.32Å; W470-F474 PolarHBondContact O-N 3.4Å; V471-F474 PolarHBondContact O-N 2.62Å; F474-C476 VanDerWaalsContact C-N 3.34Å; F474-I477 PolarHBondContact O-N 3.01Å; F474-A478 VanDerWaalsContact O-CB 3.24Å; F474-A478 WeakPolarHBondContact O-CB 3.28Å; F474-A478 PolarHBondContact O-N 3Å; F474-I557 HydrophobicContact CB-CD1 3.9Å; F474-I557 HydrophobicContact CB-CG2 4.29Å; F474-I557 HydrophobicContact CD1-CG2 3.99Å; F474-I557 HydrophobicContact CD2-CD1 3.65Å; F474-I557 HydrophobicContact CD2-CG2 4.1Å; F474-I557 HydrophobicContact CE1-CG2 4.36Å; F474-I557 HydrophobicContact CG-CD1 3.97Å; F474-I557 HydrophobicContact CG-CG2 3.84Å
475	E	97.3	Very high	93.6	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-58.6	-47.4	171.5	-71.5	-172.3	168.4	0	0	111.3	W113 I123 C305 V471 A472 F473 A478 V479	W113-E475 HydrophobicContact CH2-CB 4.01Å; W113-E475 HydrophobicContact CH2-CG 3.96Å; W113-E475 HydrophobicContact CZ2-CB 4.18Å; W113-E475 HydrophobicContact CZ2-CG 3.63Å; I123-E475 HydrophobicContact CD1-CG 4.35Å; I123-E475 HydrophobicContact CG2-CG 3.56Å; C305-E475 PolarHBondContact SG-OE2 3.29Å; V471-E475 HydrophobicContact CG1-CG 4.19Å; V471-E475 WeakPolarHBondContact O-CG 3.38Å; V471-E475 PolarHBondContact O-N 2.8Å; A472-E475 PolarHBondContact O-N 3.38Å; F473-E475 PolarHBondContact O-N 2.85Å; E475-A478 PolarHBondContact O-N 3.4Å; E475-V479 WeakPolarHBondContact O-CG2 3.46Å; E475-V479 PolarHBondContact O-N 3.41Å
476	C	97.5	Very high	94.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-42.5	177.7	-68.4	0	0	0	0	111.8	A472 F473 F474 A480 W508 P513	A472-C476 PolarHBondContact O-N 3.37Å; A472-C476 VanDerWaalsContact O-N 3.08Å; A472-C476 PolarHBondContact O-SG 3.32Å; F473-C476 PolarHBondContact O-N 3.2Å; F474-C476 VanDerWaalsContact C-N 3.34Å; C476-A480 WeakPolarHBondContact O-CB 3.44Å; C476-A480 PolarHBondContact O-N 3.33Å; C476-W508 WeakPolarHBondContact CB-O 3.39Å; C476-P513 HydrophobicContact CB-CG 3.73Å
477	I	97.1	Very high	94.9	Very high	39 Å²	39	28.4 Å²	28.4	20%	0.2	14%	0.14	C	C	.	.	I	π-helix	trans	-62.4	-46	175.6	-65.1	-54.6	0	0	0	111.4	F120 F473 F474 V479 W481 V482	F120-I477 HydrophobicContact CZ-CG2 4.32Å; F473-I477 HydrophobicContact CD1-CG1 4.36Å; F473-I477 HydrophobicContact CD2-CG1 4.46Å; F473-I477 HydrophobicContact CE1-CG1 3.93Å; F473-I477 HydrophobicContact CE2-CD1 4.18Å; F473-I477 HydrophobicContact CE2-CG1 4.04Å; F473-I477 HydrophobicContact CZ-CD1 4.13Å; F473-I477 HydrophobicContact CZ-CG1 3.75Å; F473-I477 WeakPolarHBondContact O-CG1 3.44Å; F473-I477 PolarHBondContact O-N 2.94Å; F474-I477 PolarHBondContact O-N 3.01Å; I477-V479 PolarHBondContact O-N 2.96Å; I477-W481 HydrophobicContact CD1-CG 4.42Å; I477-W481 WeakPolarHBondContact O-CB 3.3Å; I477-W481 PolarHBondContact O-N 2.77Å; I477-W481 VanDerWaalsContact O-N 3.08Å; I477-V482 PolarHBondContact O-N 3.45Å; I477-V482 VanDerWaalsContact O-N 3.14Å
478	A	96.1	Very high	95.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-61.8	-46.7	-179.4	0	0	0	0	0	111.7	W113 F120 I123 F474 E475 Y483	W113-A478 HydrophobicContact CE3-CB 4.29Å; W113-A478 HydrophobicContact CH2-CB 4.39Å; W113-A478 HydrophobicContact CZ3-CB 3.63Å; F120-A478 HydrophobicContact CB-CB 3.91Å; F120-A478 HydrophobicContact CD2-CB 3.59Å; F120-A478 HydrophobicContact CE2-CB 4.27Å; F120-A478 HydrophobicContact CG-CB 3.8Å; I123-A478 HydrophobicContact CD1-CB 3.88Å; F474-A478 VanDerWaalsContact O-CB 3.24Å; F474-A478 WeakPolarHBondContact O-CB 3.28Å; F474-A478 PolarHBondContact O-N 3Å; E475-A478 PolarHBondContact O-N 3.4Å; A478-Y483 WeakPolarHBondContact O-CB 3.48Å; A478-Y483 PolarHBondContact O-N 3.49Å
479	V	95.7	Very high	95.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	I	π-helix	trans	-76.9	-51.4	-177.9	176.3	0	0	0	0	112.1	L97 W113 L116 E475 I477 G484 F488	L97-V479 HydrophobicContact CD1-CB 4.11Å; L97-V479 HydrophobicContact CD1-CG1 4.25Å; L97-V479 HydrophobicContact CD1-CG2 4.06Å; L97-V479 HydrophobicContact CD2-CG2 4.14Å; L97-V479 HydrophobicContact CG-CG2 4.3Å; W113-V479 HydrophobicContact CH2-CG2 3.8Å; W113-V479 HydrophobicContact CZ3-CG2 3.85Å; L116-V479 HydrophobicContact CD2-CG2 3.94Å; E475-V479 WeakPolarHBondContact O-CG2 3.46Å; E475-V479 PolarHBondContact O-N 3.41Å; I477-V479 PolarHBondContact O-N 2.96Å; V479-G484 CarbonylContact O-C 3.5Å; V479-G484 VanDerWaalsContact O-C 3.31Å; V479-G484 PolarHBondContact O-N 3Å; V479-F488 HydrophobicContact CG1-CB 3.92Å; V479-F488 HydrophobicContact CG1-CD1 3.56Å; V479-F488 HydrophobicContact CG1-CD2 4.21Å; V479-F488 HydrophobicContact CG1-CE1 4.07Å; V479-F488 HydrophobicContact CG1-CG 3.63Å
480	A	95.5	Very high	95.3	Very high	9 Å²	9	31.3 Å²	31.3	7%	0.074	16%	0.155	C	C	.	.	I	π-helix	trans	-79	-35.9	-169.7	0	0	0	0	0	113.1	C476 G484 A485 W508	C476-A480 WeakPolarHBondContact O-CB 3.44Å; C476-A480 PolarHBondContact O-N 3.33Å; A480-G484 CarbonylContact O-C 3.55Å; A480-G484 WeakPolarHBondContact O-CA 3.22Å; A480-A485 HydrophobicContact CB-CB 4.18Å; A480-A485 PolarHBondContact O-N 3.35Å; A480-W508 HydrophobicContact CB-CB 4.24Å
481	W	94.6	Very high	95.3	Very high	158 Å²	158	29.4 Å²	29.4	60%	0.598	15%	0.15	S	C	*	.	I	π-helix	trans	-107.3	-33.5	-170.8	-65.6	90.3	0	0	0	114	I477 T509	I477-W481 HydrophobicContact CD1-CG 4.42Å; I477-W481 WeakPolarHBondContact O-CB 3.3Å; I477-W481 PolarHBondContact O-N 2.77Å; I477-W481 VanDerWaalsContact O-N 3.08Å; W481-T509 HydrophobicContact CH2-CG2 4.28Å; W481-T509 HydrophobicContact CZ2-CG2 3.57Å; W481-T509 PolarHBondContact NE1-O 3.27Å
482	V	93.4	Very high	95.3	Very high	58 Å²	58	29.4 Å²	29.4	35%	0.352	15%	0.15	S	C	.	.	I	π-helix	trans	-95.3	-53.7	-178.8	-176.6	0	0	0	0	112.1	C117 F120 I477 A580	C117-V482 WeakPolarHBondContact SG-CG1 3.46Å; F120-V482 HydrophobicContact CD2-CG2 4.48Å; F120-V482 HydrophobicContact CE2-CB 4.3Å; F120-V482 HydrophobicContact CE2-CG2 3.69Å; I477-V482 PolarHBondContact O-N 3.45Å; I477-V482 VanDerWaalsContact O-N 3.14Å; V482-A580 HydrophobicContact CG1-CB 3.81Å
483	Y	93.3	Very high	95.2	Very high	19 Å²	19	32.9 Å²	32.9	8%	0.075	17%	0.166	C	C	.	.	I	π-helix	trans	-70.6	-37.6	172.3	-177	-105.1	0	0	0	111.5	L116 A478 N487 F488 P582 S588	L116-Y483 HydrophobicContact CD1-CD1 3.95Å; L116-Y483 HydrophobicContact CD1-CD2 3.72Å; L116-Y483 HydrophobicContact CD1-CE1 3.81Å; L116-Y483 HydrophobicContact CD1-CE2 3.59Å; L116-Y483 HydrophobicContact CD1-CG 3.9Å; L116-Y483 HydrophobicContact CD2-CG 4.33Å; L116-Y483 HydrophobicContact CG-CD1 4.39Å; L116-Y483 HydrophobicContact CG-CD2 3.81Å; L116-Y483 HydrophobicContact CG-CE2 4.17Å; L116-Y483 HydrophobicContact CG-CG 3.93Å; A478-Y483 WeakPolarHBondContact O-CB 3.48Å; A478-Y483 PolarHBondContact O-N 3.49Å; Y483-N487 HydrophobicContact CD1-CB 4.11Å; Y483-N487 HydrophobicContact CE1-CB 3.69Å; Y483-N487 PolarHBondContact O-ND2 3.01Å; Y483-F488 HydrophobicContact CD1-CB 4.1Å; Y483-F488 HydrophobicContact CE1-CB 4.1Å; Y483-F488 HydrophobicContact CE1-CD2 4.37Å; Y483-P582 HydrophobicContact CD2-CB 4.39Å; Y483-P582 HydrophobicContact CD2-CG 4.39Å; Y483-P582 HydrophobicContact CE2-CB 4.08Å; Y483-P582 HydrophobicContact CE2-CG 4.12Å; Y483-S588 PolarHBondContact OH-OG 3.31Å
484	G	94.3	Very high	95.1	Very high	18 Å²	18	35 Å²	35	19%	0.186	18%	0.179	C	C	.	.	I	π-helix	trans	102.3	121.8	178.1	0	0	0	0	0	112	V479 A480 D486 N487 F488	V479-G484 CarbonylContact O-C 3.5Å; V479-G484 VanDerWaalsContact O-C 3.31Å; V479-G484 PolarHBondContact O-N 3Å; A480-G484 CarbonylContact O-C 3.55Å; A480-G484 WeakPolarHBondContact O-CA 3.22Å; G484-D486 VanDerWaalsContact C-N 3.27Å; G484-D486 PolarHBondContact O-N 3.34Å; G484-N487 WeakPolarHBondContact O-CB 3.38Å; G484-N487 PolarHBondContact O-N 3.41Å; G484-N487 VanDerWaalsContact O-N 3.09Å; G484-F488 PolarHBondContact O-N 3.45Å; G484-F488 VanDerWaalsContact O-N 3.1Å
485	A	94.1	Very high	95	Very high	7 Å²	7	33.3 Å²	33.3	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-35.8	-177.4	0	0	0	0	0	113.3	A480 F488 Y489 K505	A480-A485 HydrophobicContact CB-CB 4.18Å; A480-A485 PolarHBondContact O-N 3.35Å; A485-F488 PolarHBondContact O-N 2.53Å; A485-Y489 WeakPolarHBondContact O-CD2 3.42Å; A485-Y489 PolarHBondContact O-N 2.96Å; A485-K505 HydrophobicContact CB-CD 4.42Å; A485-K505 HydrophobicContact CB-CG 3.88Å
486	D	94.2	Very high	95	Very high	83 Å²	83	34.2 Å²	34.2	44%	0.444	18%	0.176	S	C	.	.	H	α-helix	trans	-67	-41.8	175.5	-74.3	-60.5	0	0	0	112.3	G484 F488 Y489 D490 K505	G484-D486 VanDerWaalsContact C-N 3.27Å; G484-D486 PolarHBondContact O-N 3.34Å; D486-F488 VanDerWaalsContact C-N 3.27Å; D486-F488 PolarHBondContact O-N 3.16Å; D486-Y489 PolarHBondContact O-N 3.49Å; D486-D490 VanDerWaalsContact O-CG 3.24Å; D486-D490 PolarHBondContact O-N 3.08Å; D486-K505 IonicContact OD1-NZ 3Å; D486-K505 PolarHBondContact OD1-NZ 3.46Å; D486-K505 IonicContact OD2-NZ 2.82Å; D486-K505 PolarHBondContact OD2-NZ 3.24Å
487	N	93.2	Very high	94.8	Very high	79 Å²	79	37.1 Å²	37.1	42%	0.422	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-39.1	176.5	-64.2	-31.7	0	0	0	111.1	Y483 G484 D490 A491	Y483-N487 HydrophobicContact CD1-CB 4.11Å; Y483-N487 HydrophobicContact CE1-CB 3.69Å; Y483-N487 PolarHBondContact O-ND2 3.01Å; G484-N487 WeakPolarHBondContact O-CB 3.38Å; G484-N487 PolarHBondContact O-N 3.41Å; G484-N487 VanDerWaalsContact O-N 3.09Å; N487-D490 PolarHBondContact O-N 3.02Å; N487-A491 PolarHBondContact O-N 2.99Å
488	F	94.8	Very high	94.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.5	-37.2	176.7	-165.8	-121.6	0	0	0	112.3	L97 A100 L101 V479 Y483 G484 A485 D486 A491 I492 W508	L97-F488 HydrophobicContact CG-CE1 4.27Å; A100-F488 HydrophobicContact CB-CZ 4.01Å; L101-F488 HydrophobicContact CB-CE2 4.49Å; L101-F488 HydrophobicContact CB-CZ 4.32Å; L101-F488 HydrophobicContact CD1-CE2 4.46Å; V479-F488 HydrophobicContact CG1-CB 3.92Å; V479-F488 HydrophobicContact CG1-CD1 3.56Å; V479-F488 HydrophobicContact CG1-CD2 4.21Å; V479-F488 HydrophobicContact CG1-CE1 4.07Å; V479-F488 HydrophobicContact CG1-CG 3.63Å; Y483-F488 HydrophobicContact CD1-CB 4.1Å; Y483-F488 HydrophobicContact CE1-CB 4.1Å; Y483-F488 HydrophobicContact CE1-CD2 4.37Å; G484-F488 PolarHBondContact O-N 3.45Å; G484-F488 VanDerWaalsContact O-N 3.1Å; A485-F488 PolarHBondContact O-N 2.53Å; D486-F488 VanDerWaalsContact C-N 3.27Å; D486-F488 PolarHBondContact O-N 3.16Å; F488-A491 WeakPolarHBondContact O-CB 3.28Å; F488-A491 PolarHBondContact O-N 3.19Å; F488-I492 HydrophobicContact CD1-CD1 3.83Å; F488-I492 HydrophobicContact CE1-CD1 3.76Å; F488-I492 HydrophobicContact CE1-CG1 4.47Å; F488-I492 HydrophobicContact CG-CD1 4.48Å; F488-I492 HydrophobicContact CZ-CD1 4.36Å; F488-I492 VanDerWaalsContact O-CG1 3.3Å; F488-I492 WeakPolarHBondContact O-CG1 3.38Å; F488-I492 PolarHBondContact O-N 3.16Å; F488-W508 HydrophobicContact CD1-CE3 4.24Å; F488-W508 AromaticContact CD1-CH2 3.96Å; F488-W508 HydrophobicContact CD1-CH2 3.96Å; F488-W508 AromaticContact CD1-CZ3 3.61Å; F488-W508 HydrophobicContact CD1-CZ3 3.61Å; F488-W508 AromaticContact CE1-CH2 3.8Å; F488-W508 HydrophobicContact CE1-CH2 3.8Å; F488-W508 HydrophobicContact CE1-CZ2 4.39Å; F488-W508 AromaticContact CE1-CZ3 3.95Å; F488-W508 HydrophobicContact CE1-CZ3 3.95Å
489	Y	94.8	Very high	94.6	Very high	8 Å²	8	44.8 Å²	44.8	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-41.7	172.1	-101.7	-115.1	0	0	0	112.6	A485 D486 A491 I492 E493 R499 P500 N501 M504 K505 W508	A485-Y489 WeakPolarHBondContact O-CD2 3.42Å; A485-Y489 PolarHBondContact O-N 2.96Å; D486-Y489 PolarHBondContact O-N 3.49Å; Y489-A491 VanDerWaalsContact C-N 3.32Å; Y489-I492 PolarHBondContact O-N 3.19Å; Y489-E493 WeakPolarHBondContact O-CB 3.33Å; Y489-E493 PolarHBondContact O-N 3.3Å; Y489-R499 HydrophobicContact CD1-CB 4.36Å; Y489-P500 HydrophobicContact CE1-CB 4.28Å; Y489-P500 WeakPolarHBondContact CE1-O 3.28Å; Y489-N501 PolarHBondContact OH-O 3.21Å; Y489-M504 WeakPolarHBondContact OH-CB 3.29Å; Y489-K505 HydrophobicContact CD2-CB 4.27Å; Y489-K505 HydrophobicContact CD2-CG 4.25Å; Y489-K505 HydrophobicContact CE1-CB 4.44Å; Y489-K505 HydrophobicContact CE2-CB 3.45Å; Y489-K505 VanDerWaalsContact CE2-CB 3.45Å; Y489-K505 HydrophobicContact CE2-CG 3.91Å; Y489-K505 WeakPolarHBondContact OH-CB 3.47Å; Y489-K505 PolarHBondContact OH-N 3.2Å; Y489-W508 HydrophobicContact CD2-CE3 4.47Å; Y489-W508 AromaticContact CD2-CZ3 3.81Å; Y489-W508 HydrophobicContact CD2-CZ3 3.81Å; Y489-W508 AromaticContact CE2-CE3 3.95Å; Y489-W508 HydrophobicContact CE2-CE3 3.95Å; Y489-W508 HydrophobicContact CE2-CH2 4.24Å; Y489-W508 AromaticContact CE2-CZ3 3.39Å; Y489-W508 HydrophobicContact CE2-CZ3 3.39Å
490	D	94.8	Very high	94.5	Very high	56 Å²	56	45 Å²	45	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-41.9	174.7	-68.1	-2.5	0	0	0	110.7	D486 N487 E493 D494 R499	D486-D490 VanDerWaalsContact O-CG 3.24Å; D486-D490 PolarHBondContact O-N 3.08Å; N487-D490 PolarHBondContact O-N 3.02Å; D490-E493 PolarHBondContact O-N 3.15Å; D490-D494 PolarHBondContact O-N 3.2Å; D490-R499 IonicContact OD1-CZ 2.79Å; D490-R499 VanDerWaalsContact OD1-CZ 3.24Å; D490-R499 IonicContact OD1-NH1 2.78Å; D490-R499 PolarHBondContact OD1-NH1 2.7Å; D490-R499 IonicContact OD1-NH2 3.03Å; D490-R499 PolarHBondContact OD1-NH2 2.78Å
491	A	93.3	Very high	94.5	Very high	9 Å²	9	48.8 Å²	48.8	7%	0.074	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-40	174.7	0	0	0	0	0	112.2	F104 N487 F488 Y489 D494 M495	F104-A491 HydrophobicContact CD1-CB 4.38Å; F104-A491 HydrophobicContact CD2-CB 3.95Å; F104-A491 HydrophobicContact CE1-CB 4.06Å; F104-A491 HydrophobicContact CE2-CB 3.61Å; F104-A491 HydrophobicContact CG-CB 4.33Å; F104-A491 HydrophobicContact CZ-CB 3.67Å; N487-A491 PolarHBondContact O-N 2.99Å; F488-A491 WeakPolarHBondContact O-CB 3.28Å; F488-A491 PolarHBondContact O-N 3.19Å; Y489-A491 VanDerWaalsContact C-N 3.32Å; A491-D494 PolarHBondContact O-N 3.31Å; A491-M495 WeakPolarHBondContact O-CG 3.21Å; A491-M495 PolarHBondContact O-N 3.49Å
492	I	95.7	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-43.7	174.9	-66.8	162.6	0	0	0	110.9	F96 A100 F488 Y489 D494 M495 I496 P500 W508	F96-I492 HydrophobicContact CE1-CD1 3.98Å; F96-I492 HydrophobicContact CZ-CD1 3.94Å; F96-I492 HydrophobicContact CZ-CG1 4.48Å; F96-I492 HydrophobicContact CZ-CG2 4.07Å; A100-I492 HydrophobicContact CB-CD1 4.48Å; A100-I492 HydrophobicContact CB-CG1 4.32Å; F488-I492 HydrophobicContact CD1-CD1 3.83Å; F488-I492 HydrophobicContact CE1-CD1 3.76Å; F488-I492 HydrophobicContact CE1-CG1 4.47Å; F488-I492 HydrophobicContact CG-CD1 4.48Å; F488-I492 HydrophobicContact CZ-CD1 4.36Å; F488-I492 VanDerWaalsContact O-CG1 3.3Å; F488-I492 WeakPolarHBondContact O-CG1 3.38Å; F488-I492 PolarHBondContact O-N 3.16Å; Y489-I492 PolarHBondContact O-N 3.19Å; I492-D494 VanDerWaalsContact C-N 3.28Å; I492-D494 PolarHBondContact O-N 3.04Å; I492-M495 HydrophobicContact CB-CE 4.39Å; I492-M495 HydrophobicContact CG1-CE 3.96Å; I492-M495 WeakPolarHBondContact O-CB 3.35Å; I492-M495 PolarHBondContact O-N 2.82Å; I492-I496 HydrophobicContact CG2-CD1 3.68Å; I492-I496 HydrophobicContact CG2-CG1 4.04Å; I492-I496 WeakPolarHBondContact O-CG1 3.45Å; I492-I496 PolarHBondContact O-N 3.37Å; I492-P500 HydrophobicContact CB-CG 4.42Å; I492-P500 HydrophobicContact CD1-CG 4.45Å; I492-P500 HydrophobicContact CG2-CG 3.51Å; I492-W508 HydrophobicContact CD1-CH2 3.81Å; I492-W508 HydrophobicContact CD1-CZ3 4.19Å
493	E	95.9	Very high	94.6	Very high	72 Å²	72	45.8 Å²	45.8	34%	0.336	25%	0.246	S	C	.	.	H	α-helix	trans	-58.9	-41.5	176.1	-179.9	170.1	-149.5	0	0	111.3	Y489 D490 M495 G497 R499	Y489-E493 WeakPolarHBondContact O-CB 3.33Å; Y489-E493 PolarHBondContact O-N 3.3Å; D490-E493 PolarHBondContact O-N 3.15Å; E493-M495 PolarHBondContact O-N 3.4Å; E493-G497 WeakPolarHBondContact O-CA 3.45Å; E493-G497 PolarHBondContact O-N 3.3Å; E493-R499 HydrophobicContact CB-CG 4.02Å; E493-R499 HydrophobicContact CG-CG 4.18Å; E493-R499 IonicContact OE1-NE 3.92Å; E493-R499 WeakPolarHBondContact OE2-CG 3.39Å; E493-R499 IonicContact OE2-CZ 2.74Å; E493-R499 VanDerWaalsContact OE2-CZ 3.25Å; E493-R499 IonicContact OE2-NE 2.6Å; E493-R499 PolarHBondContact OE2-NE 2.85Å; E493-R499 IonicContact OE2-NH2 3.14Å; E493-R499 PolarHBondContact OE2-NH2 2.81Å
494	D	95	Very high	94.7	Very high	83 Å²	83	44.9 Å²	44.9	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-63.9	-38.3	172.7	-178.7	49.4	0	0	0	112.2	Y318 K319 D490 A491 I492	Y318-D494 WeakPolarHBondContact CE1-OD2 3.24Å; Y318-D494 PolarHBondContact OH-OD2 3.31Å; K319-D494 PolarHBondContact NZ-O 3.08Å; K319-D494 IonicContact NZ-OD1 3.27Å; D490-D494 PolarHBondContact O-N 3.2Å; A491-D494 PolarHBondContact O-N 3.31Å; I492-D494 VanDerWaalsContact C-N 3.28Å; I492-D494 PolarHBondContact O-N 3.04Å
495	M	95.2	Very high	94.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-58.4	175.2	-73.9	-170.1	-67.2	0	0	112.8	A100 Q103 F104 Y318 K319 A491 I492 E493	A100-M495 HydrophobicContact CB-CE 4.24Å; Q103-M495 HydrophobicContact CB-SD 4.11Å; Q103-M495 HydrophobicContact CG-SD 3.86Å; F104-M495 WeakPolarHBondContact CA-SD 3.45Å; F104-M495 HydrophobicContact CB-CE 3.81Å; F104-M495 HydrophobicContact CB-SD 3.58Å; F104-M495 VanDerWaalsContact CB-SD 3.58Å; F104-M495 HydrophobicContact CD2-CE 4.48Å; F104-M495 HydrophobicContact CD2-CG 4.2Å; F104-M495 HydrophobicContact CD2-SD 4.14Å; F104-M495 HydrophobicContact CG-CE 4.49Å; F104-M495 HydrophobicContact CG-SD 4.35Å; F104-M495 PolarHBondContact N-SD 3.13Å; F104-M495 VanDerWaalsContact N-SD 3.43Å; Y318-M495 HydrophobicContact CD1-CG 4.36Å; Y318-M495 HydrophobicContact CD2-CG 4.22Å; Y318-M495 HydrophobicContact CE1-CG 3.96Å; Y318-M495 HydrophobicContact CE2-CG 3.79Å; Y318-M495 HydrophobicContact CE2-SD 4.5Å; Y318-M495 HydrophobicContact CG-CG 4.49Å; Y318-M495 WeakPolarHBondContact O-CB 3.36Å; K319-M495 VanDerWaalsContact CA-O 3.29Å; K319-M495 WeakPolarHBondContact CA-O 3.19Å; K319-M495 WeakPolarHBondContact CD-O 3.3Å; A491-M495 WeakPolarHBondContact O-CG 3.21Å; A491-M495 PolarHBondContact O-N 3.49Å; I492-M495 HydrophobicContact CB-CE 4.39Å; I492-M495 HydrophobicContact CG1-CE 3.96Å; I492-M495 WeakPolarHBondContact O-CB 3.35Å; I492-M495 PolarHBondContact O-N 2.82Å; E493-M495 PolarHBondContact O-N 3.4Å
496	I	95.9	Very high	94.9	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.108	27%	0.273	C	S	.	.	H	α-helix	trans	-98	-8.5	-166.6	74.1	-177.5	0	0	0	113.8	Y320 I492 Y498 P500	Y320-I496 WeakPolarHBondContact O-CG2 3.4Å; I492-I496 HydrophobicContact CG2-CD1 3.68Å; I492-I496 HydrophobicContact CG2-CG1 4.04Å; I492-I496 WeakPolarHBondContact O-CG1 3.45Å; I492-I496 PolarHBondContact O-N 3.37Å; I496-Y498 HydrophobicContact CB-CD1 4.44Å; I496-Y498 HydrophobicContact CB-CE1 4.09Å; I496-Y498 HydrophobicContact CD1-CD1 4.21Å; I496-Y498 HydrophobicContact CD1-CD2 4.26Å; I496-Y498 HydrophobicContact CD1-CE1 3.74Å; I496-Y498 HydrophobicContact CD1-CE2 3.83Å; I496-Y498 HydrophobicContact CD1-CG 4.44Å; I496-Y498 HydrophobicContact CG1-CD1 3.84Å; I496-Y498 HydrophobicContact CG1-CE1 3.7Å; I496-Y498 HydrophobicContact CG1-CE2 4.49Å; I496-Y498 HydrophobicContact CG1-CG 4.27Å; I496-Y498 VanDerWaalsContact CG1-O 3.28Å; I496-Y498 WeakPolarHBondContact CG1-O 3.45Å; I496-Y498 WeakPolarHBondContact O-CD1 3.27Å; I496-P500 HydrophobicContact CD1-CG 4.4Å
497	G	94.6	Very high	95	Very high	61 Å²	61	50.4 Å²	50.4	63%	0.629	25%	0.252	S	S	*	.	S	Bend	trans	86	4.4	177.8	0	0	0	0	0	115.3	E493	E493-G497 WeakPolarHBondContact O-CA 3.45Å; E493-G497 PolarHBondContact O-N 3.3Å
498	Y	95.2	Very high	95.2	Very high	84 Å²	84	46.7 Å²	46.7	33%	0.329	23%	0.232	S	C	.	.	S	Bend	trans	-156	156.6	177.3	64.7	-83.5	0	0	0	111.1	N321 Y323 I496	N321-Y498 VanDerWaalsContact CG-OH 3.31Å; N321-Y498 PolarHBondContact ND2-OH 3.46Å; N321-Y498 PolarHBondContact OD1-OH 2.78Å; Y323-Y498 AromaticContact CD1-CE2 4Å; Y323-Y498 HydrophobicContact CD1-CE2 4Å; I496-Y498 HydrophobicContact CB-CD1 4.44Å; I496-Y498 HydrophobicContact CB-CE1 4.09Å; I496-Y498 HydrophobicContact CD1-CD1 4.21Å; I496-Y498 HydrophobicContact CD1-CD2 4.26Å; I496-Y498 HydrophobicContact CD1-CE1 3.74Å; I496-Y498 HydrophobicContact CD1-CE2 3.83Å; I496-Y498 HydrophobicContact CD1-CG 4.44Å; I496-Y498 HydrophobicContact CG1-CD1 3.84Å; I496-Y498 HydrophobicContact CG1-CE1 3.7Å; I496-Y498 HydrophobicContact CG1-CE2 4.49Å; I496-Y498 HydrophobicContact CG1-CG 4.27Å; I496-Y498 VanDerWaalsContact CG1-O 3.28Å; I496-Y498 WeakPolarHBondContact CG1-O 3.45Å; I496-Y498 WeakPolarHBondContact O-CD1 3.27Å
499	R	93.8	Very high	95.3	Very high	116 Å²	116	48 Å²	48	44%	0.438	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-78	132.9	174.6	-68.6	-172	-174.3	-129.4	-11.6	111.8	Y489 D490 E493	Y489-R499 HydrophobicContact CD1-CB 4.36Å; D490-R499 IonicContact OD1-CZ 2.79Å; D490-R499 VanDerWaalsContact OD1-CZ 3.24Å; D490-R499 IonicContact OD1-NH1 2.78Å; D490-R499 PolarHBondContact OD1-NH1 2.7Å; D490-R499 IonicContact OD1-NH2 3.03Å; D490-R499 PolarHBondContact OD1-NH2 2.78Å; E493-R499 HydrophobicContact CB-CG 4.02Å; E493-R499 HydrophobicContact CG-CG 4.18Å; E493-R499 IonicContact OE1-NE 3.92Å; E493-R499 WeakPolarHBondContact OE2-CG 3.39Å; E493-R499 IonicContact OE2-CZ 2.74Å; E493-R499 VanDerWaalsContact OE2-CZ 3.25Å; E493-R499 IonicContact OE2-NE 2.6Å; E493-R499 PolarHBondContact OE2-NE 2.85Å; E493-R499 IonicContact OE2-NH2 3.14Å; E493-R499 PolarHBondContact OE2-NH2 2.81Å
500	P	94.2	Very high	95.4	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.032	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-59.9	166.5	170.5	-23.7	34.1	0	0	0	113	F96 Y323 Y489 I492 I496	F96-P500 HydrophobicContact CE1-CB 4.23Å; F96-P500 HydrophobicContact CE1-CG 3.92Å; F96-P500 HydrophobicContact CZ-CG 3.93Å; Y323-P500 HydrophobicContact CD2-CB 3.88Å; Y323-P500 HydrophobicContact CD2-CG 4.33Å; Y323-P500 HydrophobicContact CE2-CB 3.77Å; Y323-P500 HydrophobicContact CG-CB 4.29Å; Y489-P500 HydrophobicContact CE1-CB 4.28Å; Y489-P500 WeakPolarHBondContact CE1-O 3.28Å; I492-P500 HydrophobicContact CB-CG 4.42Å; I492-P500 HydrophobicContact CD1-CG 4.45Å; I492-P500 HydrophobicContact CG2-CG 3.51Å; I496-P500 HydrophobicContact CD1-CG 4.4Å
501	N	94.1	Very high	95.5	Very high	87 Å²	87	50.5 Å²	50.5	47%	0.465	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.1	133.2	174	-174.3	-38.8	0	0	0	110.2	Y323 Y489 W503 M504	Y323-N501 VanDerWaalsContact OH-CB 3.29Å; Y323-N501 WeakPolarHBondContact OH-CB 3.48Å; Y489-N501 PolarHBondContact OH-O 3.21Å; N501-W503 PolarHBondContact O-N 3.35Å; N501-W503 PolarHBondContact OD1-N 2.73Å; N501-M504 PolarHBondContact O-N 3.25Å; N501-M504 VanDerWaalsContact O-N 3.08Å
502	P	94.9	Very high	95.7	Very high	80 Å²	80	50.1 Å²	50.1	52%	0.519	25%	0.254	S	S	.	.	H	α-helix	trans	-53.3	-22.2	179.1	-29.1	35.5	0	0	0	115.5	M504 K505 W506	P502-M504 PolarHBondContact O-N 2.84Å; P502-K505 VanDerWaalsContact O-CB 3.29Å; P502-K505 WeakPolarHBondContact O-CB 3.46Å; P502-K505 PolarHBondContact O-N 3.09Å; P502-K505 VanDerWaalsContact O-N 3.08Å; P502-W506 VanDerWaalsContact O-CD1 3.3Å; P502-W506 PolarHBondContact O-N 3.35Å; P502-W506 VanDerWaalsContact O-N 3.09Å
503	W	96	Very high	95.7	Very high	73 Å²	73	50.6 Å²	50.6	28%	0.277	26%	0.258	S	S	.	.	H	α-helix	trans	-53.8	-37.6	173.7	159.3	69.4	0	0	0	112.9	F88 L92 P93 L327 N501 K505 W506 S507	F88-W503 HydrophobicContact CB-CZ2 3.76Å; F88-W503 AromaticContact CD1-CH2 3.99Å; F88-W503 HydrophobicContact CD1-CH2 3.99Å; F88-W503 AromaticContact CD1-CZ2 3.81Å; F88-W503 HydrophobicContact CD1-CZ2 3.81Å; F88-W503 HydrophobicContact CG-CZ2 4.29Å; F88-W503 VanDerWaalsContact O-CE2 3.28Å; F88-W503 WeakPolarHBondContact O-CZ2 3.02Å; F88-W503 PolarHBondContact O-NE1 3.18Å; F88-W503 VanDerWaalsContact O-NE1 3.15Å; L92-W503 HydrophobicContact CB-CH2 4.05Å; L92-W503 HydrophobicContact CD1-CH2 4.17Å; P93-W503 HydrophobicContact CG-CZ2 4.15Å; L327-W503 HydrophobicContact CD2-CZ3 4.3Å; N501-W503 PolarHBondContact O-N 3.35Å; N501-W503 PolarHBondContact OD1-N 2.73Å; W503-K505 VanDerWaalsContact C-N 3.33Å; W503-K505 PolarHBondContact O-N 3.46Å; W503-W506 PolarHBondContact O-N 3.01Å; W503-S507 PolarHBondContact NE1-OG 3.47Å; W503-S507 WeakPolarHBondContact O-CB 3.48Å; W503-S507 PolarHBondContact O-N 3.36Å; W503-S507 PolarHBondContact O-OG 3.16Å; W503-S507 VanDerWaalsContact O-OG 3.08Å
504	M	95.8	Very high	95.8	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-42.8	176.3	-65.7	-63.5	-163.6	0	0	111.5	P93 F96 Y323 L327 Y489 N501 P502 W506 S507 W508	P93-M504 HydrophobicContact CB-SD 4.16Å; P93-M504 HydrophobicContact CG-SD 4.16Å; F96-M504 HydrophobicContact CB-CE 4.11Å; F96-M504 HydrophobicContact CD1-CB 4.49Å; F96-M504 HydrophobicContact CD1-CE 4.01Å; F96-M504 HydrophobicContact CD1-CG 4.01Å; F96-M504 HydrophobicContact CD1-SD 4.13Å; F96-M504 HydrophobicContact CE1-CG 4.37Å; F96-M504 HydrophobicContact CG-CE 4.28Å; Y323-M504 HydrophobicContact CD2-CE 4.28Å; Y323-M504 HydrophobicContact CE2-CE 3.7Å; Y323-M504 HydrophobicContact CE2-CG 3.96Å; L327-M504 HydrophobicContact CD2-CE 3.88Å; Y489-M504 WeakPolarHBondContact OH-CB 3.29Å; N501-M504 PolarHBondContact O-N 3.25Å; N501-M504 VanDerWaalsContact O-N 3.08Å; P502-M504 PolarHBondContact O-N 2.84Å; M504-W506 PolarHBondContact O-N 3.17Å; M504-S507 PolarHBondContact O-N 3.35Å; M504-W508 HydrophobicContact CB-CH2 4.13Å; M504-W508 HydrophobicContact CB-CZ2 4.06Å; M504-W508 HydrophobicContact CB-CZ3 4.46Å; M504-W508 VanDerWaalsContact O-CG 3.26Å; M504-W508 PolarHBondContact O-N 3.16Å
505	K	94.8	Very high	95.8	Very high	54 Å²	54	50.6 Å²	50.6	24%	0.235	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-49.7	176	-161.2	-177.6	174.3	-175.9	0	111.3	A485 D486 Y489 P502 W503 S507 W508 T509	A485-K505 HydrophobicContact CB-CD 4.42Å; A485-K505 HydrophobicContact CB-CG 3.88Å; D486-K505 IonicContact OD1-NZ 3Å; D486-K505 PolarHBondContact OD1-NZ 3.46Å; D486-K505 IonicContact OD2-NZ 2.82Å; D486-K505 PolarHBondContact OD2-NZ 3.24Å; Y489-K505 HydrophobicContact CD2-CB 4.27Å; Y489-K505 HydrophobicContact CD2-CG 4.25Å; Y489-K505 HydrophobicContact CE1-CB 4.44Å; Y489-K505 HydrophobicContact CE2-CB 3.45Å; Y489-K505 VanDerWaalsContact CE2-CB 3.45Å; Y489-K505 HydrophobicContact CE2-CG 3.91Å; Y489-K505 WeakPolarHBondContact OH-CB 3.47Å; Y489-K505 PolarHBondContact OH-N 3.2Å; P502-K505 VanDerWaalsContact O-CB 3.29Å; P502-K505 WeakPolarHBondContact O-CB 3.46Å; P502-K505 PolarHBondContact O-N 3.09Å; P502-K505 VanDerWaalsContact O-N 3.08Å; W503-K505 VanDerWaalsContact C-N 3.33Å; W503-K505 PolarHBondContact O-N 3.46Å; K505-S507 VanDerWaalsContact C-N 3.29Å; K505-S507 PolarHBondContact O-N 3.19Å; K505-W508 PolarHBondContact O-N 2.83Å; K505-T509 VanDerWaalsContact O-CB 3.32Å; K505-T509 WeakPolarHBondContact O-CB 3.31Å; K505-T509 PolarHBondContact O-N 3.32Å; K505-T509 PolarHBondContact O-OG1 3.35Å
506	W	96.6	Very high	95.7	Very high	170 Å²	170	50.6 Å²	50.6	64%	0.644	26%	0.259	S	S	*	.	H	α-helix	trans	-63.4	-38	179.6	-78.3	109.4	0	0	0	111.8	P502 W503 M504 T509 V510 V511	P502-W506 VanDerWaalsContact O-CD1 3.3Å; P502-W506 PolarHBondContact O-N 3.35Å; P502-W506 VanDerWaalsContact O-N 3.09Å; W503-W506 PolarHBondContact O-N 3.01Å; M504-W506 PolarHBondContact O-N 3.17Å; W506-T509 PolarHBondContact O-N 3.01Å; W506-V510 HydrophobicContact CE3-CG2 4.33Å; W506-V510 HydrophobicContact CZ3-CG2 4.46Å; W506-V510 PolarHBondContact O-N 3.15Å; W506-V511 PolarHBondContact O-N 2.91Å
507	S	97	Very high	95.6	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	I	π-helix	trans	-62.9	-50.6	176.2	-64.7	0	0	0	0	112	W503 M504 K505 T509 V511 T512 P513	W503-S507 PolarHBondContact NE1-OG 3.47Å; W503-S507 WeakPolarHBondContact O-CB 3.48Å; W503-S507 PolarHBondContact O-N 3.36Å; W503-S507 PolarHBondContact O-OG 3.16Å; W503-S507 VanDerWaalsContact O-OG 3.08Å; M504-S507 PolarHBondContact O-N 3.35Å; K505-S507 VanDerWaalsContact C-N 3.29Å; K505-S507 PolarHBondContact O-N 3.19Å; S507-T509 VanDerWaalsContact C-N 3.31Å; S507-T509 PolarHBondContact O-N 2.98Å; S507-V511 PolarHBondContact O-N 2.93Å; S507-T512 WeakPolarHBondContact O-CB 3.26Å; S507-T512 PolarHBondContact O-N 3.49Å; S507-T512 PolarHBondContact O-OG1 2.83Å; S507-P513 WeakPolarHBondContact O-CD 3.25Å
508	W	97	Very high	95.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-64.3	-35.1	177.7	-56.1	-34.9	0	0	0	113.5	P93 F96 L97 C476 A480 F488 Y489 I492 M504 K505 P513	P93-W508 PolarHBondContact O-NE1 2.86Å; F96-W508 AromaticContact CD1-CH2 3.76Å; F96-W508 HydrophobicContact CD1-CH2 3.76Å; F96-W508 AromaticContact CD1-CZ2 3.49Å; F96-W508 HydrophobicContact CD1-CZ2 3.49Å; F96-W508 VanDerWaalsContact CD1-CZ2 3.49Å; F96-W508 AromaticContact CE1-CH2 3.68Å; F96-W508 HydrophobicContact CE1-CH2 3.68Å; F96-W508 AromaticContact CE1-CZ2 3.93Å; F96-W508 HydrophobicContact CE1-CZ2 3.93Å; F96-W508 HydrophobicContact CG-CZ2 4.41Å; L97-W508 HydrophobicContact CB-CZ2 3.99Å; L97-W508 HydrophobicContact CD1-CD2 4.32Å; L97-W508 HydrophobicContact CD1-CG 4.1Å; C476-W508 WeakPolarHBondContact CB-O 3.39Å; A480-W508 HydrophobicContact CB-CB 4.24Å; F488-W508 HydrophobicContact CD1-CE3 4.24Å; F488-W508 AromaticContact CD1-CH2 3.96Å; F488-W508 HydrophobicContact CD1-CH2 3.96Å; F488-W508 AromaticContact CD1-CZ3 3.61Å; F488-W508 HydrophobicContact CD1-CZ3 3.61Å; F488-W508 AromaticContact CE1-CH2 3.8Å; F488-W508 HydrophobicContact CE1-CH2 3.8Å; F488-W508 HydrophobicContact CE1-CZ2 4.39Å; F488-W508 AromaticContact CE1-CZ3 3.95Å; F488-W508 HydrophobicContact CE1-CZ3 3.95Å; Y489-W508 HydrophobicContact CD2-CE3 4.47Å; Y489-W508 AromaticContact CD2-CZ3 3.81Å; Y489-W508 HydrophobicContact CD2-CZ3 3.81Å; Y489-W508 AromaticContact CE2-CE3 3.95Å; Y489-W508 HydrophobicContact CE2-CE3 3.95Å; Y489-W508 HydrophobicContact CE2-CH2 4.24Å; Y489-W508 AromaticContact CE2-CZ3 3.39Å; Y489-W508 HydrophobicContact CE2-CZ3 3.39Å; I492-W508 HydrophobicContact CD1-CH2 3.81Å; I492-W508 HydrophobicContact CD1-CZ3 4.19Å; M504-W508 HydrophobicContact CB-CH2 4.13Å; M504-W508 HydrophobicContact CB-CZ2 4.06Å; M504-W508 HydrophobicContact CB-CZ3 4.46Å; M504-W508 VanDerWaalsContact O-CG 3.26Å; M504-W508 PolarHBondContact O-N 3.16Å; K505-W508 PolarHBondContact O-N 2.83Å; W508-P513 WeakPolarHBondContact O-CG 3.41Å
509	T	96.9	Very high	95.2	Very high	29 Å²	29	46.7 Å²	46.7	18%	0.178	24%	0.235	C	C	.	.	I	π-helix	trans	-78.6	-39.3	-174.6	-51.3	0	0	0	0	111.9	W481 K505 W506 S507	W481-T509 HydrophobicContact CH2-CG2 4.28Å; W481-T509 HydrophobicContact CZ2-CG2 3.57Å; W481-T509 PolarHBondContact NE1-O 3.27Å; K505-T509 VanDerWaalsContact O-CB 3.32Å; K505-T509 WeakPolarHBondContact O-CB 3.31Å; K505-T509 PolarHBondContact O-N 3.32Å; K505-T509 PolarHBondContact O-OG1 3.35Å; W506-T509 PolarHBondContact O-N 3.01Å; S507-T509 VanDerWaalsContact C-N 3.31Å; S507-T509 PolarHBondContact O-N 2.98Å
510	V	96.7	Very high	95	Very high	59 Å²	59	42.3 Å²	42.3	36%	0.358	22%	0.219	S	C	.	.	I	π-helix	trans	-132.6	-53.9	-168.3	-177.5	0	0	0	0	112.9	W506 P513 L514	W506-V510 HydrophobicContact CE3-CG2 4.33Å; W506-V510 HydrophobicContact CZ3-CG2 4.46Å; W506-V510 PolarHBondContact O-N 3.15Å; V510-P513 WeakPolarHBondContact O-CD 3.47Å; V510-L514 HydrophobicContact CG1-CD1 3.62Å; V510-L514 HydrophobicContact CG1-CG 4.4Å; V510-L514 WeakPolarHBondContact O-CB 3.44Å; V510-L514 VanDerWaalsContact O-CG 3.23Å; V510-L514 WeakPolarHBondContact O-CG 3.2Å; V510-L514 PolarHBondContact O-N 3.39Å; V510-L514 VanDerWaalsContact O-N 3.14Å
511	V	97.3	Very high	94.8	Very high	57 Å²	57	46.2 Å²	46.2	35%	0.345	24%	0.239	S	C	.	.	I	π-helix	trans	-67.6	-53.3	-167.8	-171.2	0	0	0	0	112	W506 S507 L514 L515	W506-V511 PolarHBondContact O-N 2.91Å; S507-V511 PolarHBondContact O-N 2.93Å; V511-L514 PolarHBondContact O-N 3.41Å; V511-L515 HydrophobicContact CG1-CD1 3.83Å; V511-L515 HydrophobicContact CG1-CG 4.24Å; V511-L515 WeakPolarHBondContact O-CB 3.5Å; V511-L515 WeakPolarHBondContact O-CG 3.18Å; V511-L515 PolarHBondContact O-N 3.44Å
512	T	96.8	Very high	94.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-50.3	-180	-49.2	0	0	0	0	111.3	G89 V94 F299 S507 L514 L515 C516	G89-T512 PolarHBondContact O-N 2.93Å; G89-T512 PolarHBondContact O-OG1 3.05Å; V94-T512 HydrophobicContact CG2-CG2 3.62Å; F299-T512 HydrophobicContact CZ-CG2 4.4Å; S507-T512 WeakPolarHBondContact O-CB 3.26Å; S507-T512 PolarHBondContact O-N 3.49Å; S507-T512 PolarHBondContact O-OG1 2.83Å; T512-L514 VanDerWaalsContact C-N 3.31Å; T512-L514 PolarHBondContact O-N 3.01Å; T512-L515 PolarHBondContact O-N 3.43Å; T512-C516 WeakPolarHBondContact O-CB 3.4Å; T512-C516 PolarHBondContact O-N 3.4Å; T512-C516 PolarHBondContact O-SG 2.82Å
513	P	96.9	Very high	94.1	Very high	11 Å²	11	44.2 Å²	44.2	7%	0.071	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-41.9	177.6	-27.3	35.4	0	0	0	113.8	F473 C476 S507 W508 V510 M517	F473-P513 HydrophobicContact CD2-CB 3.98Å; F473-P513 HydrophobicContact CE2-CB 4.11Å; C476-P513 HydrophobicContact CB-CG 3.73Å; S507-P513 WeakPolarHBondContact O-CD 3.25Å; W508-P513 WeakPolarHBondContact O-CG 3.41Å; V510-P513 WeakPolarHBondContact O-CD 3.47Å; P513-M517 WeakPolarHBondContact O-CB 3.31Å; P513-M517 PolarHBondContact O-N 2.82Å
514	L	96.6	Very high	93.6	Very high	119 Å²	119	44.5 Å²	44.5	62%	0.623	23%	0.227	S	C	*	.	H	α-helix	trans	-67.9	-44.5	178.8	-72.3	176.3	0	0	0	112.1	V510 V511 T512 G518	V510-L514 HydrophobicContact CG1-CD1 3.62Å; V510-L514 HydrophobicContact CG1-CG 4.4Å; V510-L514 WeakPolarHBondContact O-CB 3.44Å; V510-L514 VanDerWaalsContact O-CG 3.23Å; V510-L514 WeakPolarHBondContact O-CG 3.2Å; V510-L514 PolarHBondContact O-N 3.39Å; V510-L514 VanDerWaalsContact O-N 3.14Å; V511-L514 PolarHBondContact O-N 3.41Å; T512-L514 VanDerWaalsContact C-N 3.31Å; T512-L514 PolarHBondContact O-N 3.01Å; L514-G518 WeakPolarHBondContact O-CA 3.33Å; L514-G518 PolarHBondContact O-N 2.95Å
515	L	94.6	Very high	93.2	Very high	35 Å²	35	49.3 Å²	49.3	18%	0.183	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-46.7	177.2	-73.8	178.9	0	0	0	111.4	I85 F86 V511 T512 C519	I85-L515 HydrophobicContact CG2-CD1 4.32Å; I85-L515 HydrophobicContact CG2-CD2 4.17Å; F86-L515 HydrophobicContact CD1-CB 4.42Å; F86-L515 HydrophobicContact CD1-CD1 4.29Å; F86-L515 HydrophobicContact CE1-CB 3.84Å; F86-L515 HydrophobicContact CE1-CD1 4.37Å; F86-L515 HydrophobicContact CE1-CD2 4.25Å; F86-L515 HydrophobicContact CE1-CG 4.38Å; F86-L515 HydrophobicContact CZ-CD2 4.19Å; V511-L515 HydrophobicContact CG1-CD1 3.83Å; V511-L515 HydrophobicContact CG1-CG 4.24Å; V511-L515 WeakPolarHBondContact O-CB 3.5Å; V511-L515 WeakPolarHBondContact O-CG 3.18Å; V511-L515 PolarHBondContact O-N 3.44Å; T512-L515 PolarHBondContact O-N 3.43Å; L515-C519 WeakPolarHBondContact O-CB 3.32Å; L515-C519 PolarHBondContact O-N 3.2Å; L515-C519 PolarHBondContact O-SG 2.97Å
516	C	93.8	Very high	92.8	Very high	1 Å²	1	53 Å²	53	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-50.2	-179.9	-68.4	0	0	0	0	112	F299 L469 F473 T512 C519 F520	F299-C516 VanDerWaalsContact CZ-SG 3.59Å; L469-C516 HydrophobicContact CB-CB 4.39Å; L469-C516 HydrophobicContact CD2-CB 4.32Å; F473-C516 HydrophobicContact CB-CB 4.22Å; T512-C516 WeakPolarHBondContact O-CB 3.4Å; T512-C516 PolarHBondContact O-N 3.4Å; T512-C516 PolarHBondContact O-SG 2.82Å; C516-C519 PolarHBondContact O-N 3.3Å; C516-F520 VanDerWaalsContact O-CB 3.22Å; C516-F520 WeakPolarHBondContact O-CB 3.18Å; C516-F520 PolarHBondContact O-N 3.47Å
517	M	93.1	Very high	92.3	Very high	50 Å²	50	48.4 Å²	48.4	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-67.7	-39.4	-179.4	-173.2	57.8	65.3	0	0	111.8	F473 P513 F520 I521	F473-M517 HydrophobicContact CD1-CE 3.68Å; F473-M517 HydrophobicContact CD2-CB 4.15Å; F473-M517 HydrophobicContact CD2-CE 3.75Å; F473-M517 HydrophobicContact CE1-CE 3.57Å; F473-M517 HydrophobicContact CE2-CB 4.3Å; F473-M517 HydrophobicContact CE2-CE 3.64Å; F473-M517 HydrophobicContact CG-CE 3.77Å; F473-M517 HydrophobicContact CZ-CE 3.55Å; P513-M517 WeakPolarHBondContact O-CB 3.31Å; P513-M517 PolarHBondContact O-N 2.82Å; M517-F520 PolarHBondContact O-N 3.33Å; M517-F520 HydrophobicContact SD-CD1 4.25Å; M517-I521 HydrophobicContact CG-CD1 3.95Å; M517-I521 VanDerWaalsContact O-CG1 3.3Å; M517-I521 WeakPolarHBondContact O-CG1 3.36Å; M517-I521 PolarHBondContact O-N 3.43Å; M517-I521 HydrophobicContact SD-CD1 4.17Å; M517-I521 HydrophobicContact SD-CG1 4.24Å
518	G	92.1	Very high	91.7	Very high	24 Å²	24	54.5 Å²	54.5	25%	0.247	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-52.5	174.5	0	0	0	0	0	111.4	L514 F520 I521 F522	L514-G518 WeakPolarHBondContact O-CA 3.33Å; L514-G518 PolarHBondContact O-N 2.95Å; G518-F520 VanDerWaalsContact C-N 3.35Å; G518-F520 PolarHBondContact O-N 3.05Å; G518-I521 PolarHBondContact O-N 3.47Å; G518-F522 WeakPolarHBondContact O-CD2 3.13Å; G518-F522 PolarHBondContact O-N 3.46Å
519	C	89.7	Confident	91.3	Very high	10 Å²	10	58.1 Å²	58.1	7%	0.068	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-38.8	178.1	-70.8	0	0	0	0	113.1	F86 L469 L515 C516 F522 S523	F86-C519 WeakPolarHBondContact CZ-SG 3.3Å; L469-C519 HydrophobicContact CD1-CB 3.68Å; L515-C519 WeakPolarHBondContact O-CB 3.32Å; L515-C519 PolarHBondContact O-N 3.2Å; L515-C519 PolarHBondContact O-SG 2.97Å; C516-C519 PolarHBondContact O-N 3.3Å; C519-F522 PolarHBondContact O-N 3.07Å; C519-S523 WeakPolarHBondContact O-CB 3.49Å; C519-S523 PolarHBondContact O-N 3.29Å; C519-S523 PolarHBondContact O-OG 3.16Å
520	F	89.9	Confident	90.8	Very high	23 Å²	23	57.6 Å²	57.6	10%	0.101	30%	0.301	C	S	.	.	H	α-helix	trans	-58.5	-51.9	175.3	179.9	-94.5	0	0	0	110.8	V466 W470 C516 M517 G518 F522 S523 L524 M554	V466-F520 HydrophobicContact CG1-CD2 3.44Å; V466-F520 VanDerWaalsContact CG1-CD2 3.44Å; V466-F520 HydrophobicContact CG1-CE2 3.45Å; V466-F520 VanDerWaalsContact CG1-CE2 3.45Å; W470-F520 HydrophobicContact CB-CD2 4.45Å; W470-F520 HydrophobicContact CB-CE2 4.36Å; W470-F520 HydrophobicContact CE3-CD2 4.37Å; W470-F520 HydrophobicContact CE3-CE1 4.11Å; W470-F520 AromaticContact CE3-CE2 3.94Å; W470-F520 HydrophobicContact CE3-CE2 3.94Å; W470-F520 AromaticContact CE3-CZ 3.8Å; W470-F520 HydrophobicContact CE3-CZ 3.8Å; W470-F520 HydrophobicContact CZ3-CE1 4.14Å; W470-F520 HydrophobicContact CZ3-CZ 4.1Å; C516-F520 VanDerWaalsContact O-CB 3.22Å; C516-F520 WeakPolarHBondContact O-CB 3.18Å; C516-F520 PolarHBondContact O-N 3.47Å; M517-F520 PolarHBondContact O-N 3.33Å; M517-F520 HydrophobicContact SD-CD1 4.25Å; G518-F520 VanDerWaalsContact C-N 3.35Å; G518-F520 PolarHBondContact O-N 3.05Å; F520-F522 VanDerWaalsContact C-N 3.35Å; F520-F522 PolarHBondContact O-N 3.05Å; F520-S523 PolarHBondContact O-N 3.17Å; F520-S523 PolarHBondContact O-OG 2.65Å; F520-L524 HydrophobicContact CD1-CD1 4.12Å; F520-L524 HydrophobicContact CE1-CD1 3.51Å; F520-L524 HydrophobicContact CE1-CG 4.36Å; F520-L524 HydrophobicContact CZ-CD1 3.86Å; F520-L524 HydrophobicContact CZ-CG 4.47Å; F520-L524 WeakPolarHBondContact O-CG 3.5Å; F520-L524 PolarHBondContact O-N 3.26Å; F520-M554 HydrophobicContact CE2-CE 3.44Å; F520-M554 VanDerWaalsContact CE2-CE 3.44Å; F520-M554 HydrophobicContact CZ-CE 3.55Å
521	I	90.5	Very high	90.3	Very high	87 Å²	87	58.8 Å²	58.8	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-60.1	-45.5	177.5	-67.4	167.7	0	0	0	110.8	M517 G518 S523 L524 V525	M517-I521 HydrophobicContact CG-CD1 3.95Å; M517-I521 VanDerWaalsContact O-CG1 3.3Å; M517-I521 WeakPolarHBondContact O-CG1 3.36Å; M517-I521 PolarHBondContact O-N 3.43Å; M517-I521 HydrophobicContact SD-CD1 4.17Å; M517-I521 HydrophobicContact SD-CG1 4.24Å; G518-I521 PolarHBondContact O-N 3.47Å; I521-S523 VanDerWaalsContact C-N 3.32Å; I521-S523 PolarHBondContact O-N 2.8Å; I521-L524 PolarHBondContact O-N 2.93Å; I521-V525 HydrophobicContact CG2-CG2 4.32Å; I521-V525 WeakPolarHBondContact O-CG2 3.47Å; I521-V525 PolarHBondContact O-N 3.19Å
522	F	87.4	Confident	89.7	Confident	110 Å²	110	57.4 Å²	57.4	48%	0.482	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-38.1	178.3	-75.8	-57.7	0	0	0	113	I292 G518 C519 F520 L524 V525 K526	I292-F522 HydrophobicContact CD1-CB 4.22Å; G518-F522 WeakPolarHBondContact O-CD2 3.13Å; G518-F522 PolarHBondContact O-N 3.46Å; C519-F522 PolarHBondContact O-N 3.07Å; F520-F522 VanDerWaalsContact C-N 3.35Å; F520-F522 PolarHBondContact O-N 3.05Å; F522-L524 VanDerWaalsContact C-N 3.29Å; F522-L524 PolarHBondContact O-N 3.07Å; F522-V525 PolarHBondContact O-N 3.44Å; F522-K526 WeakPolarHBondContact O-CB 3.25Å; F522-K526 PolarHBondContact O-N 2.81Å
523	S	85.9	Confident	88.8	Confident	15 Å²	15	62 Å²	62	11%	0.105	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-34.7	177.4	75.1	0	0	0	0	112.5	V466 C519 F520 I521 Y527	V466-S523 WeakPolarHBondContact CG2-OG 3.17Å; C519-S523 WeakPolarHBondContact O-CB 3.49Å; C519-S523 PolarHBondContact O-N 3.29Å; C519-S523 PolarHBondContact O-OG 3.16Å; F520-S523 PolarHBondContact O-N 3.17Å; F520-S523 PolarHBondContact O-OG 2.65Å; I521-S523 VanDerWaalsContact C-N 3.32Å; I521-S523 PolarHBondContact O-N 2.8Å; S523-Y527 WeakPolarHBondContact O-CA 3.47Å; S523-Y527 WeakPolarHBondContact O-CB 3.3Å; S523-Y527 PolarHBondContact O-N 2.74Å; S523-Y527 VanDerWaalsContact O-N 3.16Å
524	L	86.6	Confident	87.8	Confident	79 Å²	79	70.5 Å²	70.5	41%	0.414	35%	0.353	S	S	.	.	H	α-helix	trans	-72.6	-42.4	174.5	-63.5	179.1	0	0	0	111.6	F520 I521 F522 W547	F520-L524 HydrophobicContact CD1-CD1 4.12Å; F520-L524 HydrophobicContact CE1-CD1 3.51Å; F520-L524 HydrophobicContact CE1-CG 4.36Å; F520-L524 HydrophobicContact CZ-CD1 3.86Å; F520-L524 HydrophobicContact CZ-CG 4.47Å; F520-L524 WeakPolarHBondContact O-CG 3.5Å; F520-L524 PolarHBondContact O-N 3.26Å; I521-L524 PolarHBondContact O-N 2.93Å; F522-L524 VanDerWaalsContact C-N 3.29Å; F522-L524 PolarHBondContact O-N 3.07Å; L524-W547 HydrophobicContact CD2-CH2 3.85Å; L524-W547 HydrophobicContact CD2-CZ3 4.28Å
525	V	87.9	Confident	87.1	Confident	103 Å²	103	72 Å²	72	62%	0.624	36%	0.361	S	S	*	.	H	α-helix	trans	-70.2	-35.7	-178.1	172.1	0	0	0	0	112.3	I521 F522	I521-V525 HydrophobicContact CG2-CG2 4.32Å; I521-V525 WeakPolarHBondContact O-CG2 3.47Å; I521-V525 PolarHBondContact O-N 3.19Å; F522-V525 PolarHBondContact O-N 3.44Å
526	K	85.2	Confident	86.8	Confident	132 Å²	132	72.1 Å²	72.1	57%	0.574	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	21.1	-178.6	-66.2	-63.7	-172.5	178.8	0	113	F522 K528	F522-K526 WeakPolarHBondContact O-CB 3.25Å; F522-K526 PolarHBondContact O-N 2.81Å; K526-K528 PolarHBondContact O-N 3.28Å
527	Y	86.8	Confident	86.7	Confident	72 Å²	72	79 Å²	79	28%	0.282	39%	0.391	S	S	.	.			trans	-55.1	132.9	178.2	172.3	-104.3	0	0	0	111.3	Y461 S523 P529 I543 W547	Y461-Y527 HydrophobicContact CE1-CE2 4.09Å; Y461-Y527 PolarHBondContact OH-OH 3.31Å; S523-Y527 WeakPolarHBondContact O-CA 3.47Å; S523-Y527 WeakPolarHBondContact O-CB 3.3Å; S523-Y527 PolarHBondContact O-N 2.74Å; S523-Y527 VanDerWaalsContact O-N 3.16Å; Y527-P529 HydrophobicContact CE1-CG 4.35Å; Y527-I543 WeakPolarHBondContact OH-CG2 3.4Å; Y527-W547 HydrophobicContact CD1-CZ2 4.48Å; Y527-W547 HydrophobicContact CD2-CH2 4.46Å; Y527-W547 AromaticContact CD2-CZ2 3.7Å; Y527-W547 HydrophobicContact CD2-CZ2 3.7Å; Y527-W547 HydrophobicContact CE1-CZ2 4.38Å; Y527-W547 AromaticContact CE2-CZ2 3.59Å; Y527-W547 HydrophobicContact CE2-CZ2 3.59Å; Y527-W547 AromaticContact CE2-NE1 3.97Å; Y527-W547 HydrophobicContact CG-CZ2 4.14Å; Y527-W547 AromaticContact CZ-CZ2 3.94Å; Y527-W547 AromaticContact CZ-NE1 3.55Å; Y527-W547 PolarHBondContact OH-NE1 3.25Å
528	K	84.9	Confident	86.8	Confident	128 Å²	128	77.1 Å²	77.1	56%	0.557	38%	0.382	S	S	*	.			trans	-123.7	134.2	171.7	-67.2	174.9	-171.4	160.3	0	107.8	E289 Y460 K526	E289-K528 IonicContact OE2-NZ 2.66Å; E289-K528 PolarHBondContact OE2-NZ 3.11Å; Y460-K528 PolarHBondContact OH-O 2.9Å; K526-K528 PolarHBondContact O-N 3.28Å
529	P	87.1	Confident	86.9	Confident	76 Å²	76	77.2 Å²	77.2	49%	0.494	38%	0.378	S	S	.	.			trans	-54.9	144.3	173.9	-26.5	35.4	0	0	0	112	Y527 I543	Y527-P529 HydrophobicContact CE1-CG 4.35Å; P529-I543 HydrophobicContact CB-CD1 4.03Å
530	L	87.4	Confident	87.2	Confident	18 Å²	18	83.4 Å²	83.4	9%	0.094	41%	0.41	C	S	.	.			trans	-61.1	138.5	173.5	177.5	64.6	0	0	0	109.8	Q456 L457 Y460 Y461 Y538	Q456-L530 HydrophobicContact CB-CD2 4.27Å; L457-L530 HydrophobicContact CD1-CD2 4.33Å; Y460-L530 HydrophobicContact CD1-CB 4.3Å; Y460-L530 HydrophobicContact CD1-CD1 4.48Å; Y460-L530 HydrophobicContact CD2-CD1 3.73Å; Y460-L530 HydrophobicContact CE2-CD1 4.31Å; Y460-L530 HydrophobicContact CG-CB 4.45Å; Y460-L530 HydrophobicContact CG-CD1 3.81Å; Y460-L530 HydrophobicContact CG-CD2 4.41Å; Y460-L530 HydrophobicContact CG-CG 4.45Å; Y461-L530 HydrophobicContact CE2-CB 4.24Å; Y461-L530 HydrophobicContact CE2-CD2 4.36Å; L530-Y538 HydrophobicContact CB-CD2 4.24Å; L530-Y538 HydrophobicContact CB-CE2 4.46Å; L530-Y538 HydrophobicContact CD2-CD2 4.14Å; L530-Y538 HydrophobicContact CD2-CE1 4.18Å; L530-Y538 HydrophobicContact CD2-CE2 3.7Å; L530-Y538 HydrophobicContact CG-CD2 3.9Å; L530-Y538 HydrophobicContact CG-CE2 3.63Å; L530-Y538 VanDerWaalsContact O-CD2 3.3Å; L530-Y538 WeakPolarHBondContact O-CD2 3.14Å
531	M	86.6	Confident	87.5	Confident	85 Å²	85	88.4 Å²	88.4	42%	0.419	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	145.2	173.1	-55.5	-167.5	-24.1	0	0	110	K534 Y536 Q537	M531-K534 HydrophobicContact CE-CB 4.38Å; M531-K534 WeakPolarHBondContact CE-O 3.42Å; M531-Y536 WeakPolarHBondContact CA-O 3.48Å; M531-Q537 HydrophobicContact SD-CG 4.21Å
532	Y	84.6	Confident	87.7	Confident	27 Å²	27	84.2 Å²	84.2	11%	0.106	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.4	173.5	-179.3	-109.3	0	0	0	111	I206 M452 Y453 Q456 K534 L535 Y536	I206-Y532 HydrophobicContact CD1-CE1 3.54Å; I206-Y532 VanDerWaalsContact CD1-OH 3.3Å; I206-Y532 WeakPolarHBondContact CD1-OH 3.45Å; M452-Y532 HydrophobicContact CE-CE2 4.12Å; M452-Y532 HydrophobicContact CG-CE2 3.87Å; Y453-Y532 HydrophobicContact CD1-CD1 4.36Å; Y453-Y532 HydrophobicContact CD1-CG 4.22Å; Y453-Y532 AromaticContact CE1-CD1 3.53Å; Y453-Y532 HydrophobicContact CE1-CD1 3.53Å; Y453-Y532 HydrophobicContact CE1-CE1 4.21Å; Y453-Y532 AromaticContact CE1-CG 3.81Å; Y453-Y532 HydrophobicContact CE1-CG 3.81Å; Q456-Y532 VanDerWaalsContact CD-CD2 3.47Å; Q456-Y532 VanDerWaalsContact NE2-CD2 3.32Å; Y532-K534 PolarHBondContact O-N 3.49Å; Y532-L535 PolarHBondContact O-N 2.68Å; Y532-L535 VanDerWaalsContact O-N 3.11Å; Y532-Y536 PolarHBondContact N-O 2.74Å; Y532-Y536 PolarHBondContact O-N 2.84Å
533	N	76.3	Confident	88	Confident	98 Å²	98	80.2 Å²	80.2	52%	0.524	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	33.4	-179.5	-157.6	9.3	0	0	0	114.9	L535	N533-L535 WeakPolarHBondContact O-CG 3.42Å; N533-L535 PolarHBondContact O-N 2.9Å
534	K	76.6	Confident	88.4	Confident	188 Å²	188	81.1 Å²	81.1	82%	0.817	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	-3.9	-175.1	-57.4	175.2	-176.8	169.1	0	116.4	M531 Y532	M531-K534 HydrophobicContact CE-CB 4.38Å; M531-K534 WeakPolarHBondContact CE-O 3.42Å; Y532-K534 PolarHBondContact O-N 3.49Å
535	L	81.9	Confident	88.8	Confident	152 Å²	152	81 Å²	81	80%	0.796	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-44.7	-173.3	-68.8	172.2	0	0	0	112	Y532 N533	Y532-L535 PolarHBondContact O-N 2.68Å; Y532-L535 VanDerWaalsContact O-N 3.11Å; N533-L535 WeakPolarHBondContact O-CG 3.42Å; N533-L535 PolarHBondContact O-N 2.9Å
536	Y	88.1	Confident	89.1	Confident	37 Å²	37	76.1 Å²	76.1	15%	0.145	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.3	-177.5	176.1	-93.7	0	0	0	110.6	G209 I210 E211 Y453 M531 Y532 Y538	G209-Y536 VanDerWaalsContact CA-CE2 3.42Å; I210-Y536 VanDerWaalsContact CG2-OH 3.31Å; I210-Y536 WeakPolarHBondContact CG2-OH 3.03Å; I210-Y536 PolarHBondContact N-OH 2.87Å; E211-Y536 PolarHBondContact OE2-OH 3.47Å; Y453-Y536 AromaticContact CD1-CD1 3.84Å; Y453-Y536 HydrophobicContact CD1-CD1 3.84Å; Y453-Y536 AromaticContact CD1-CE1 3.78Å; Y453-Y536 HydrophobicContact CD1-CE1 3.78Å; Y453-Y536 AromaticContact CE1-CD1 3.6Å; Y453-Y536 HydrophobicContact CE1-CD1 3.6Å; Y453-Y536 HydrophobicContact CE1-CD2 4.48Å; Y453-Y536 AromaticContact CE1-CE1 3.88Å; Y453-Y536 HydrophobicContact CE1-CE1 3.88Å; Y453-Y536 AromaticContact CE1-CG 3.93Å; Y453-Y536 HydrophobicContact CE1-CG 3.93Å; M531-Y536 WeakPolarHBondContact CA-O 3.48Å; Y532-Y536 PolarHBondContact N-O 2.74Å; Y532-Y536 PolarHBondContact O-N 2.84Å; Y536-Y538 HydrophobicContact CD1-CD2 4.12Å; Y536-Y538 HydrophobicContact CD1-CE2 4.13Å; Y536-Y538 HydrophobicContact CE1-CD1 4.26Å; Y536-Y538 HydrophobicContact CE1-CD2 4.01Å; Y536-Y538 HydrophobicContact CE1-CE1 4.44Å; Y536-Y538 HydrophobicContact CE1-CE2 4.18Å; Y536-Y538 HydrophobicContact CE1-CG 4.07Å
537	Q	92.8	Very high	89.5	Confident	145 Å²	145	73.5 Å²	73.5	68%	0.678	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.5	174.7	-65.6	-176.7	5.3	0	0	109.2	M531	M531-Q537 HydrophobicContact SD-CG 4.21Å
538	Y	94.1	Very high	89.9	Confident	11 Å²	11	74.1 Å²	74.1	4%	0.043	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-69.6	139.1	177.8	-79.2	-103.4	0	0	0	110.6	I210 Y453 Q456 L530 Y536 A542	I210-Y538 HydrophobicContact CD1-CD1 4.39Å; I210-Y538 HydrophobicContact CD1-CE1 4.18Å; Y453-Y538 VanDerWaalsContact CA-OH 3.31Å; Y453-Y538 WeakPolarHBondContact CA-OH 3.29Å; Y453-Y538 PolarHBondContact O-OH 2.94Å; Q456-Y538 WeakPolarHBondContact CB-OH 3.03Å; Q456-Y538 PolarHBondContact OE1-OH 2.96Å; L530-Y538 HydrophobicContact CB-CD2 4.24Å; L530-Y538 HydrophobicContact CB-CE2 4.46Å; L530-Y538 HydrophobicContact CD2-CD2 4.14Å; L530-Y538 HydrophobicContact CD2-CE1 4.18Å; L530-Y538 HydrophobicContact CD2-CE2 3.7Å; L530-Y538 HydrophobicContact CG-CD2 3.9Å; L530-Y538 HydrophobicContact CG-CE2 3.63Å; L530-Y538 VanDerWaalsContact O-CD2 3.3Å; L530-Y538 WeakPolarHBondContact O-CD2 3.14Å; Y536-Y538 HydrophobicContact CD1-CD2 4.12Å; Y536-Y538 HydrophobicContact CD1-CE2 4.13Å; Y536-Y538 HydrophobicContact CE1-CD1 4.26Å; Y536-Y538 HydrophobicContact CE1-CD2 4.01Å; Y536-Y538 HydrophobicContact CE1-CE1 4.44Å; Y536-Y538 HydrophobicContact CE1-CE2 4.18Å; Y536-Y538 HydrophobicContact CE1-CG 4.07Å; Y538-A542 HydrophobicContact CD1-CB 4.11Å
539	P	95.2	Very high	90.3	Very high	25 Å²	25	69.2 Å²	69.2	16%	0.162	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-67.9	153.3	174.9	30.4	-37.7	0	0	0	111.2	I210 E211 W541 A542 I543	I210-P539 HydrophobicContact CG2-CG 3.81Å; E211-P539 VanDerWaalsContact OE1-CG 3.32Å; E211-P539 WeakPolarHBondContact OE1-CG 3.43Å; P539-W541 HydrophobicContact CB-CG 4.48Å; P539-W541 HydrophobicContact CG-CD2 4.28Å; P539-W541 HydrophobicContact CG-CG 4.45Å; P539-W541 HydrophobicContact CG-CZ2 3.86Å; P539-W541 PolarHBondContact O-N 2.89Å; P539-W541 VanDerWaalsContact O-N 3.13Å; P539-A542 HydrophobicContact CG-CB 3.84Å; P539-A542 WeakPolarHBondContact O-CA 3.48Å; P539-A542 WeakPolarHBondContact O-CB 3.11Å; P539-A542 PolarHBondContact O-N 2.95Å; P539-I543 PolarHBondContact O-N 3.08Å; P539-I543 VanDerWaalsContact O-N 3.14Å
540	D	95	Very high	90.6	Very high	140 Å²	140	65.8 Å²	65.8	75%	0.749	33%	0.327	S	S	*	.	H	α-helix	trans	-56.2	-35.6	-174.7	-67.8	-28.1	0	0	0	113.6	A542 I543 G544	D540-A542 VanDerWaalsContact C-N 3.32Å; D540-A542 PolarHBondContact O-N 2.63Å; D540-I543 PolarHBondContact O-N 2.87Å; D540-G544 PolarHBondContact O-N 3.36Å
541	W	95.9	Very high	90.9	Very high	128 Å²	128	69.3 Å²	69.3	49%	0.485	35%	0.346	S	S	.	.	H	α-helix	trans	-65.3	-35.9	177	67.8	-98.7	0	0	0	111.9	I210 E211 P539 G544 I545	I210-W541 HydrophobicContact CD1-CH2 4.32Å; I210-W541 HydrophobicContact CG1-CH2 4.25Å; I210-W541 HydrophobicContact CG2-CH2 3.81Å; I210-W541 HydrophobicContact CG2-CZ2 3.68Å; E211-W541 HydrophobicContact CG-CZ2 4.34Å; P539-W541 HydrophobicContact CB-CG 4.48Å; P539-W541 HydrophobicContact CG-CD2 4.28Å; P539-W541 HydrophobicContact CG-CG 4.45Å; P539-W541 HydrophobicContact CG-CZ2 3.86Å; P539-W541 PolarHBondContact O-N 2.89Å; P539-W541 VanDerWaalsContact O-N 3.13Å; W541-G544 PolarHBondContact O-N 3.46Å; W541-I545 HydrophobicContact CE3-CD1 3.57Å; W541-I545 HydrophobicContact CE3-CG1 4.48Å; W541-I545 HydrophobicContact CZ3-CD1 3.55Å; W541-I545 WeakPolarHBondContact O-CG1 3.27Å; W541-I545 PolarHBondContact O-N 3.33Å
542	A	95.4	Very high	91.3	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71.3	-39	177.6	0	0	0	0	0	110.6	I210 L457 Y538 P539 D540 G544 I545 G546	I210-A542 HydrophobicContact CD1-CB 4.06Å; I210-A542 HydrophobicContact CG2-CB 4.12Å; L457-A542 WeakPolarHBondContact CD1-O 3.48Å; Y538-A542 HydrophobicContact CD1-CB 4.11Å; P539-A542 HydrophobicContact CG-CB 3.84Å; P539-A542 WeakPolarHBondContact O-CA 3.48Å; P539-A542 WeakPolarHBondContact O-CB 3.11Å; P539-A542 PolarHBondContact O-N 2.95Å; D540-A542 VanDerWaalsContact C-N 3.32Å; D540-A542 PolarHBondContact O-N 2.63Å; A542-G544 VanDerWaalsContact C-N 3.3Å; A542-G544 PolarHBondContact O-N 2.64Å; A542-I545 WeakPolarHBondContact O-CB 3.37Å; A542-I545 PolarHBondContact O-N 3.02Å; A542-G546 PolarHBondContact O-N 2.73Å
543	I	94	Very high	91.8	Very high	25 Å²	25	67.1 Å²	67.1	13%	0.128	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-42.2	171.1	-63.9	170.2	0	0	0	110.6	Y527 P529 P539 D540 I545 G546 W547	Y527-I543 WeakPolarHBondContact OH-CG2 3.4Å; P529-I543 HydrophobicContact CB-CD1 4.03Å; P539-I543 PolarHBondContact O-N 3.08Å; P539-I543 VanDerWaalsContact O-N 3.14Å; D540-I543 PolarHBondContact O-N 2.87Å; I543-I545 VanDerWaalsContact C-N 3.34Å; I543-I545 PolarHBondContact O-N 2.8Å; I543-G546 WeakPolarHBondContact O-CA 3.19Å; I543-G546 PolarHBondContact O-N 3.25Å; I543-G546 VanDerWaalsContact O-N 3.12Å; I543-W547 PolarHBondContact O-N 3.32Å
544	G	95	Very high	92.7	Very high	34 Å²	34	63.4 Å²	63.4	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-59.5	-40.3	174.2	0	0	0	0	0	113.3	D540 W541 A542 T548	D540-G544 PolarHBondContact O-N 3.36Å; W541-G544 PolarHBondContact O-N 3.46Å; A542-G544 VanDerWaalsContact C-N 3.3Å; A542-G544 PolarHBondContact O-N 2.64Å; G544-T548 WeakPolarHBondContact O-CB 3.42Å; G544-T548 PolarHBondContact O-N 3.15Å; G544-T548 PolarHBondContact O-OG1 2.99Å
545	I	94.8	Very high	93.7	Very high	77 Å²	77	59 Å²	59	40%	0.395	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-44.7	171.8	-67.1	171.6	0	0	0	110.5	L457 W541 A542 I543 W547 T548 L549	L457-I545 HydrophobicContact CD2-CB 4.06Å; L457-I545 HydrophobicContact CD2-CG2 3.71Å; W541-I545 HydrophobicContact CE3-CD1 3.57Å; W541-I545 HydrophobicContact CE3-CG1 4.48Å; W541-I545 HydrophobicContact CZ3-CD1 3.55Å; W541-I545 WeakPolarHBondContact O-CG1 3.27Å; W541-I545 PolarHBondContact O-N 3.33Å; A542-I545 WeakPolarHBondContact O-CB 3.37Å; A542-I545 PolarHBondContact O-N 3.02Å; I543-I545 VanDerWaalsContact C-N 3.34Å; I543-I545 PolarHBondContact O-N 2.8Å; I545-W547 PolarHBondContact O-N 3.06Å; I545-T548 WeakPolarHBondContact O-CB 3.25Å; I545-T548 PolarHBondContact O-N 3.36Å; I545-T548 VanDerWaalsContact O-N 3.1Å; I545-L549 HydrophobicContact CG2-CD1 4.31Å; I545-L549 HydrophobicContact CG2-CG 4.45Å; I545-L549 WeakPolarHBondContact O-CG 3.16Å; I545-L549 PolarHBondContact O-N 3.24Å
546	G	93.5	Very high	94.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-53.5	-53	175.5	0	0	0	0	0	112.4	Y461 A542 I543 T548 L549 A550	Y461-G546 WeakPolarHBondContact CB-O 3.5Å; Y461-G546 VanDerWaalsContact CD2-CA 3.49Å; Y461-G546 VanDerWaalsContact CG-C 3.5Å; A542-G546 PolarHBondContact O-N 2.73Å; I543-G546 WeakPolarHBondContact O-CA 3.19Å; I543-G546 PolarHBondContact O-N 3.25Å; I543-G546 VanDerWaalsContact O-N 3.12Å; G546-T548 VanDerWaalsContact C-N 3.29Å; G546-T548 PolarHBondContact O-N 2.9Å; G546-L549 WeakPolarHBondContact O-CB 3.44Å; G546-L549 PolarHBondContact O-N 2.95Å; G546-L549 VanDerWaalsContact O-N 3.16Å; G546-A550 PolarHBondContact O-N 2.92Å; G546-A550 VanDerWaalsContact O-N 3.12Å
547	W	93.5	Very high	94.8	Very high	77 Å²	77	50.7 Å²	50.7	29%	0.292	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-35.4	175.9	-80.6	106.6	0	0	0	113.3	Y461 L524 Y527 I543 I545 L549 A550 L551	Y461-W547 HydrophobicContact CE1-CD2 4.37Å; Y461-W547 HydrophobicContact CE1-CG 4.46Å; Y461-W547 AromaticContact CE1-NE1 3.99Å; L524-W547 HydrophobicContact CD2-CH2 3.85Å; L524-W547 HydrophobicContact CD2-CZ3 4.28Å; Y527-W547 HydrophobicContact CD1-CZ2 4.48Å; Y527-W547 HydrophobicContact CD2-CH2 4.46Å; Y527-W547 AromaticContact CD2-CZ2 3.7Å; Y527-W547 HydrophobicContact CD2-CZ2 3.7Å; Y527-W547 HydrophobicContact CE1-CZ2 4.38Å; Y527-W547 AromaticContact CE2-CZ2 3.59Å; Y527-W547 HydrophobicContact CE2-CZ2 3.59Å; Y527-W547 AromaticContact CE2-NE1 3.97Å; Y527-W547 HydrophobicContact CG-CZ2 4.14Å; Y527-W547 AromaticContact CZ-CZ2 3.94Å; Y527-W547 AromaticContact CZ-NE1 3.55Å; Y527-W547 PolarHBondContact OH-NE1 3.25Å; I543-W547 PolarHBondContact O-N 3.32Å; I545-W547 PolarHBondContact O-N 3.06Å; W547-L549 VanDerWaalsContact C-N 3.34Å; W547-A550 PolarHBondContact O-N 2.98Å; W547-L551 WeakPolarHBondContact O-CB 3.06Å; W547-L551 VanDerWaalsContact O-CG 3.23Å; W547-L551 WeakPolarHBondContact O-CG 3.21Å; W547-L551 PolarHBondContact O-N 3.17Å
548	T	94.9	Very high	95	Very high	85 Å²	85	46.5 Å²	46.5	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-41.3	175.2	-57.6	0	0	0	0	111.6	G544 I545 G546 L551 T552	G544-T548 WeakPolarHBondContact O-CB 3.42Å; G544-T548 PolarHBondContact O-N 3.15Å; G544-T548 PolarHBondContact O-OG1 2.99Å; I545-T548 WeakPolarHBondContact O-CB 3.25Å; I545-T548 PolarHBondContact O-N 3.36Å; I545-T548 VanDerWaalsContact O-N 3.1Å; G546-T548 VanDerWaalsContact C-N 3.29Å; G546-T548 PolarHBondContact O-N 2.9Å; T548-L551 PolarHBondContact O-N 2.54Å; T548-T552 WeakPolarHBondContact O-CB 3.16Å; T548-T552 PolarHBondContact O-N 3.43Å; T548-T552 PolarHBondContact O-OG1 2.82Å
549	L	94.1	Very high	95	Very high	25 Å²	25	50.3 Å²	50.3	13%	0.131	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-46.3	174.8	-68.3	169.1	0	0	0	111.2	L133 L457 F458 A462 I545 G546 W547	L133-L549 HydrophobicContact CD1-CD2 4.46Å; L133-L549 HydrophobicContact CD2-CD2 4.29Å; L457-L549 HydrophobicContact CD2-CD1 4.4Å; L457-L549 HydrophobicContact CG-CD1 4.46Å; F458-L549 HydrophobicContact CD2-CD1 4Å; F458-L549 HydrophobicContact CE2-CD1 3.98Å; F458-L549 HydrophobicContact CG-CD1 4.48Å; F458-L549 HydrophobicContact CZ-CD1 4.44Å; F458-L549 HydrophobicContact CZ-CD2 4.26Å; A462-L549 HydrophobicContact CB-CB 4.03Å; A462-L549 HydrophobicContact CB-CD1 4.39Å; I545-L549 HydrophobicContact CG2-CD1 4.31Å; I545-L549 HydrophobicContact CG2-CG 4.45Å; I545-L549 WeakPolarHBondContact O-CG 3.16Å; I545-L549 PolarHBondContact O-N 3.24Å; G546-L549 WeakPolarHBondContact O-CB 3.44Å; G546-L549 PolarHBondContact O-N 2.95Å; G546-L549 VanDerWaalsContact O-N 3.16Å; W547-L549 VanDerWaalsContact C-N 3.34Å
550	A	93.4	Very high	95	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-49.7	176.5	0	0	0	0	0	111.5	G546 W547 T552 S553 M554	G546-A550 PolarHBondContact O-N 2.92Å; G546-A550 VanDerWaalsContact O-N 3.12Å; W547-A550 PolarHBondContact O-N 2.98Å; A550-T552 VanDerWaalsContact C-N 3.31Å; A550-T552 PolarHBondContact O-N 3.48Å; A550-S553 PolarHBondContact O-N 3.29Å; A550-S553 PolarHBondContact O-OG 3.21Å; A550-M554 WeakPolarHBondContact O-CG 3.45Å; A550-M554 PolarHBondContact O-N 2.61Å
551	L	94.4	Very high	95	Very high	92 Å²	92	44.6 Å²	44.6	48%	0.482	24%	0.238	S	C	.	.	H	α-helix	trans	-65.9	-29.7	-176.7	-71.5	172.1	0	0	0	113.5	W547 T548 S553 M554 I555	W547-L551 WeakPolarHBondContact O-CB 3.06Å; W547-L551 VanDerWaalsContact O-CG 3.23Å; W547-L551 WeakPolarHBondContact O-CG 3.21Å; W547-L551 PolarHBondContact O-N 3.17Å; T548-L551 PolarHBondContact O-N 2.54Å; L551-S553 PolarHBondContact O-N 3.08Å; L551-M554 PolarHBondContact O-N 3.43Å; L551-I555 WeakPolarHBondContact O-CB 3.36Å; L551-I555 VanDerWaalsContact O-CG2 3.24Å; L551-I555 WeakPolarHBondContact O-CG2 3.33Å; L551-I555 PolarHBondContact O-N 2.67Å
552	T	94.8	Very high	94.9	Very high	67 Å²	67	42.3 Å²	42.3	41%	0.411	24%	0.238	S	C	.	.	H	α-helix	trans	-58.1	-36.7	178.7	-67.4	0	0	0	0	111.8	V129 T548 A550 C556	V129-T552 HydrophobicContact CG1-CG2 3.86Å; T548-T552 WeakPolarHBondContact O-CB 3.16Å; T548-T552 PolarHBondContact O-N 3.43Å; T548-T552 PolarHBondContact O-OG1 2.82Å; A550-T552 VanDerWaalsContact C-N 3.31Å; A550-T552 PolarHBondContact O-N 3.48Å; T552-C556 PolarHBondContact O-SG 2.96Å
553	S	94.9	Very high	94.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-80.9	-45.5	174.6	65.5	0	0	0	0	112.6	A126 I130 A550 L551 I555 C556	A126-S553 VanDerWaalsContact CB-O 3.27Å; A126-S553 WeakPolarHBondContact CB-O 3.35Å; I130-S553 VanDerWaalsContact CG1-CB 3.43Å; A550-S553 PolarHBondContact O-N 3.29Å; A550-S553 PolarHBondContact O-OG 3.21Å; L551-S553 PolarHBondContact O-N 3.08Å; S553-I555 VanDerWaalsContact C-N 3.31Å; S553-I555 PolarHBondContact O-N 3.21Å; S553-C556 WeakPolarHBondContact O-CB 3.35Å; S553-C556 PolarHBondContact O-N 2.84Å
554	M	94.9	Very high	94.7	Very high	19 Å²	19	47.4 Å²	47.4	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-35.3	-173.7	-67.3	175	63.2	0	0	112.9	W470 F520 A550 L551 C556 P558	W470-M554 HydrophobicContact CB-CE 4.23Å; W470-M554 HydrophobicContact CB-CG 4.4Å; W470-M554 HydrophobicContact CD2-CE 3.72Å; W470-M554 HydrophobicContact CE3-CE 4Å; W470-M554 HydrophobicContact CG-CB 4.41Å; W470-M554 HydrophobicContact CG-CE 3.84Å; W470-M554 HydrophobicContact CG-CG 4.03Å; W470-M554 PolarHBondContact NE1-O 3.32Å; W470-M554 VanDerWaalsContact NE1-O 3.11Å; F520-M554 HydrophobicContact CE2-CE 3.44Å; F520-M554 VanDerWaalsContact CE2-CE 3.44Å; F520-M554 HydrophobicContact CZ-CE 3.55Å; A550-M554 WeakPolarHBondContact O-CG 3.45Å; A550-M554 PolarHBondContact O-N 2.61Å; L551-M554 PolarHBondContact O-N 3.43Å; M554-C556 VanDerWaalsContact C-N 3.27Å; M554-C556 PolarHBondContact O-N 3.26Å; M554-P558 VanDerWaalsContact O-CD 3.28Å; M554-P558 WeakPolarHBondContact O-CD 3.41Å
555	I	96.2	Very high	94.5	Very high	95 Å²	95	47.2 Å²	47.2	49%	0.487	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.5	-178.6	-158.5	167.8	0	0	0	112.9	L551 S553 I557 P558 M559	L551-I555 WeakPolarHBondContact O-CB 3.36Å; L551-I555 VanDerWaalsContact O-CG2 3.24Å; L551-I555 WeakPolarHBondContact O-CG2 3.33Å; L551-I555 PolarHBondContact O-N 2.67Å; S553-I555 VanDerWaalsContact C-N 3.31Å; S553-I555 PolarHBondContact O-N 3.21Å; I555-I557 PolarHBondContact O-N 3.27Å; I555-P558 VanDerWaalsContact O-CD 3.25Å; I555-P558 WeakPolarHBondContact O-CD 3.43Å; I555-P558 WeakPolarHBondContact O-CG 3.38Å; I555-M559 WeakPolarHBondContact O-CB 3.48Å; I555-M559 PolarHBondContact O-N 3.15Å
556	C	96.9	Very high	94.4	Very high	13 Å²	13	49.1 Å²	49.1	9%	0.088	26%	0.262	C	S	.	.	H	α-helix	trans	-55.8	-38.4	179.7	-66.9	0	0	0	0	112.2	A126 T552 S553 M554 V560	A126-C556 HydrophobicContact CB-CB 4Å; T552-C556 PolarHBondContact O-SG 2.96Å; S553-C556 WeakPolarHBondContact O-CB 3.35Å; S553-C556 PolarHBondContact O-N 2.84Å; M554-C556 VanDerWaalsContact C-N 3.27Å; M554-C556 PolarHBondContact O-N 3.26Å; C556-V560 WeakPolarHBondContact O-CB 3.32Å; C556-V560 VanDerWaalsContact O-CG2 3.25Å; C556-V560 WeakPolarHBondContact O-CG2 3.43Å; C556-V560 PolarHBondContact O-N 3.42Å
557	I	96.6	Very high	94.3	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-64.4	-179.2	-54.6	178.7	0	0	0	111.3	F120 I123 A126 V471 F474 I555 M559 V560 V561	F120-I557 HydrophobicContact CD1-CG2 4.24Å; F120-I557 HydrophobicContact CE1-CG2 4.5Å; I123-I557 HydrophobicContact CG1-CD1 4.2Å; I123-I557 HydrophobicContact CG1-CG1 4.36Å; A126-I557 HydrophobicContact CB-CD1 4.38Å; A126-I557 HydrophobicContact CB-CG1 4.02Å; V471-I557 HydrophobicContact CG2-CD1 4.41Å; F474-I557 HydrophobicContact CB-CD1 3.9Å; F474-I557 HydrophobicContact CB-CG2 4.29Å; F474-I557 HydrophobicContact CD1-CG2 3.99Å; F474-I557 HydrophobicContact CD2-CD1 3.65Å; F474-I557 HydrophobicContact CD2-CG2 4.1Å; F474-I557 HydrophobicContact CE1-CG2 4.36Å; F474-I557 HydrophobicContact CG-CD1 3.97Å; F474-I557 HydrophobicContact CG-CG2 3.84Å; I555-I557 PolarHBondContact O-N 3.27Å; I557-M559 VanDerWaalsContact C-N 3.29Å; I557-M559 PolarHBondContact O-N 2.91Å; I557-V560 PolarHBondContact O-N 3.03Å; I557-V561 WeakPolarHBondContact O-CG2 3.36Å; I557-V561 PolarHBondContact O-N 2.97Å; I557-V561 VanDerWaalsContact O-N 3.16Å
558	P	96.6	Very high	94	Very high	57 Å²	57	56.6 Å²	56.6	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-34.7	-179.8	25.5	-35.1	0	0	0	112.5	M554 I555 V561 V562	M554-P558 VanDerWaalsContact O-CD 3.28Å; M554-P558 WeakPolarHBondContact O-CD 3.41Å; I555-P558 VanDerWaalsContact O-CD 3.25Å; I555-P558 WeakPolarHBondContact O-CD 3.43Å; I555-P558 WeakPolarHBondContact O-CG 3.38Å; P558-V561 WeakPolarHBondContact O-CB 3.5Å; P558-V561 PolarHBondContact O-N 3.32Å; P558-V562 WeakPolarHBondContact O-CG2 3.48Å; P558-V562 PolarHBondContact O-N 3.31Å
559	M	96.1	Very high	93.5	Very high	91 Å²	91	60.2 Å²	60.2	45%	0.448	31%	0.311	S	S	.	.	H	α-helix	trans	-61.5	-46.4	178.5	-177.1	-179.3	67	0	0	111.7	I555 I557 V562 I563	I555-M559 WeakPolarHBondContact O-CB 3.48Å; I555-M559 PolarHBondContact O-N 3.15Å; I557-M559 VanDerWaalsContact C-N 3.29Å; I557-M559 PolarHBondContact O-N 2.91Å; M559-V562 PolarHBondContact O-N 3.11Å; M559-I563 HydrophobicContact CG-CD1 3.8Å; M559-I563 VanDerWaalsContact O-CG1 3.27Å; M559-I563 WeakPolarHBondContact O-CG1 3.15Å; M559-I563 PolarHBondContact O-N 3.21Å
560	V	95.3	Very high	93.1	Very high	16 Å²	16	61.4 Å²	61.4	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-37.8	178.4	171.5	0	0	0	0	111.6	Y125 C556 I557 V562 I563 K564	Y125-V560 HydrophobicContact CD2-CG2 4.05Å; Y125-V560 HydrophobicContact CE2-CG2 4.5Å; C556-V560 WeakPolarHBondContact O-CB 3.32Å; C556-V560 VanDerWaalsContact O-CG2 3.25Å; C556-V560 WeakPolarHBondContact O-CG2 3.43Å; C556-V560 PolarHBondContact O-N 3.42Å; I557-V560 PolarHBondContact O-N 3.03Å; V560-V562 VanDerWaalsContact C-N 3.33Å; V560-V562 PolarHBondContact O-N 2.79Å; V560-I563 PolarHBondContact O-N 3.07Å; V560-K564 HydrophobicContact CG1-CG 4.04Å; V560-K564 WeakPolarHBondContact O-CB 3.2Å; V560-K564 WeakPolarHBondContact O-CG 3.19Å; V560-K564 PolarHBondContact O-N 3.34Å
561	V	94.3	Very high	92.9	Very high	30 Å²	30	64.7 Å²	64.7	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-55.4	-50.3	173	171.7	0	0	0	0	110.2	I119 F120 I557 P558 K564 I565	I119-V561 HydrophobicContact CD1-CG1 4.25Å; I119-V561 HydrophobicContact CG1-CB 4.49Å; I119-V561 HydrophobicContact CG1-CG1 4.13Å; I119-V561 HydrophobicContact CG1-CG2 4.24Å; I119-V561 WeakPolarHBondContact O-CG2 3.41Å; F120-V561 HydrophobicContact CD1-CG2 4.39Å; F120-V561 HydrophobicContact CE1-CG2 4.35Å; I557-V561 WeakPolarHBondContact O-CG2 3.36Å; I557-V561 PolarHBondContact O-N 2.97Å; I557-V561 VanDerWaalsContact O-N 3.16Å; P558-V561 WeakPolarHBondContact O-CB 3.5Å; P558-V561 PolarHBondContact O-N 3.32Å; V561-K564 PolarHBondContact O-N 2.88Å; V561-I565 HydrophobicContact CG1-CD1 3.79Å; V561-I565 WeakPolarHBondContact O-CB 3.35Å; V561-I565 VanDerWaalsContact O-CG1 3.24Å; V561-I565 WeakPolarHBondContact O-CG1 3.15Å; V561-I565 PolarHBondContact O-N 3.11Å
562	V	94.1	Very high	92.5	Very high	80 Å²	80	65.3 Å²	65.3	49%	0.485	35%	0.354	S	S	.	.	H	α-helix	trans	-62.4	-46.7	178.9	171.8	0	0	0	0	111.4	P558 M559 V560 K564 I565 I566	P558-V562 WeakPolarHBondContact O-CG2 3.48Å; P558-V562 PolarHBondContact O-N 3.31Å; M559-V562 PolarHBondContact O-N 3.11Å; V560-V562 VanDerWaalsContact C-N 3.33Å; V560-V562 PolarHBondContact O-N 2.79Å; V562-K564 PolarHBondContact O-N 3.46Å; V562-I565 PolarHBondContact O-N 2.88Å; V562-I566 HydrophobicContact CG1-CD1 3.55Å; V562-I566 HydrophobicContact CG1-CG1 4.29Å; V562-I566 WeakPolarHBondContact O-CB 3.32Å; V562-I566 VanDerWaalsContact O-CG1 3.27Å; V562-I566 WeakPolarHBondContact O-CG1 3.47Å; V562-I566 PolarHBondContact O-N 3.26Å
563	I	93.6	Very high	92	Very high	70 Å²	70	67.7 Å²	67.7	36%	0.359	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-46.4	180	-69.6	167.3	0	0	0	111.4	M559 V560 I566 R567	M559-I563 HydrophobicContact CG-CD1 3.8Å; M559-I563 VanDerWaalsContact O-CG1 3.27Å; M559-I563 WeakPolarHBondContact O-CG1 3.15Å; M559-I563 PolarHBondContact O-N 3.21Å; V560-I563 PolarHBondContact O-N 3.07Å; I563-I566 PolarHBondContact O-N 3.49Å; I563-R567 WeakPolarHBondContact O-CB 3.17Å; I563-R567 WeakPolarHBondContact O-CG 2.96Å; I563-R567 PolarHBondContact O-N 3.37Å
564	K	91.4	Very high	91.6	Very high	61 Å²	61	73.6 Å²	73.6	27%	0.265	39%	0.391	S	S	.	.	H	α-helix	trans	-63.9	-44	179.9	-74.8	-80.6	-171.7	173.9	0	110.6	E114 V560 V561 V562 R567 S568 V579	E114-K564 IonicContact OE1-NZ 3.24Å; V560-K564 HydrophobicContact CG1-CG 4.04Å; V560-K564 WeakPolarHBondContact O-CB 3.2Å; V560-K564 WeakPolarHBondContact O-CG 3.19Å; V560-K564 PolarHBondContact O-N 3.34Å; V561-K564 PolarHBondContact O-N 2.88Å; V562-K564 PolarHBondContact O-N 3.46Å; K564-R567 PolarHBondContact O-N 3.22Å; K564-S568 PolarHBondContact O-N 2.62Å; K564-S568 PolarHBondContact O-OG 3.26Å; K564-S568 VanDerWaalsContact O-OG 3.09Å; K564-V579 HydrophobicContact CB-CG1 4.39Å
565	I	90.9	Very high	91.2	Very high	30 Å²	30	75.2 Å²	75.2	15%	0.154	40%	0.396	C	S	.	.	H	α-helix	trans	-59.1	-54.9	174.8	-67.9	167.9	0	0	0	109.3	V561 V562 R567 S568 L572 R575 I576 V579	V561-I565 HydrophobicContact CG1-CD1 3.79Å; V561-I565 WeakPolarHBondContact O-CB 3.35Å; V561-I565 VanDerWaalsContact O-CG1 3.24Å; V561-I565 WeakPolarHBondContact O-CG1 3.15Å; V561-I565 PolarHBondContact O-N 3.11Å; V562-I565 PolarHBondContact O-N 2.88Å; I565-R567 VanDerWaalsContact C-N 3.25Å; I565-R567 PolarHBondContact O-N 3.21Å; I565-S568 PolarHBondContact O-N 3.01Å; I565-L572 HydrophobicContact CG2-CD1 3.89Å; I565-R575 PolarHBondContact O-NE 2.95Å; I565-R575 PolarHBondContact O-NH2 3.31Å; I565-I576 HydrophobicContact CD1-CG1 4Å; I565-I576 HydrophobicContact CG1-CG1 4.22Å; I565-V579 HydrophobicContact CG1-CG2 4.41Å
566	I	92.1	Very high	90.7	Very high	117 Å²	117	73.9 Å²	73.9	60%	0.6	39%	0.389	S	S	*	.	H	α-helix	trans	-57.1	-35.1	-176.5	-70.3	174	0	0	0	112.7	V562 I563 R575	V562-I566 HydrophobicContact CG1-CD1 3.55Å; V562-I566 HydrophobicContact CG1-CG1 4.29Å; V562-I566 WeakPolarHBondContact O-CB 3.32Å; V562-I566 VanDerWaalsContact O-CG1 3.27Å; V562-I566 WeakPolarHBondContact O-CG1 3.47Å; V562-I566 PolarHBondContact O-N 3.26Å; I563-I566 PolarHBondContact O-N 3.49Å; I566-R575 PolarHBondContact O-NH2 3.46Å
567	R	90.8	Very high	90.1	Very high	205 Å²	205	80.2 Å²	80.2	77%	0.774	42%	0.415	S	S	*	.	H	α-helix	trans	-82.2	-14.5	179.9	-72.8	-177.4	175.1	-178.2	0	115.1	I563 K564 I565	I563-R567 WeakPolarHBondContact O-CB 3.17Å; I563-R567 WeakPolarHBondContact O-CG 2.96Å; I563-R567 PolarHBondContact O-N 3.37Å; K564-R567 PolarHBondContact O-N 3.22Å; I565-R567 VanDerWaalsContact C-N 3.25Å; I565-R567 PolarHBondContact O-N 3.21Å
568	S	87.8	Confident	89.5	Confident	29 Å²	29	83.4 Å²	83.4	20%	0.203	44%	0.441	C	S	.	.	S	Bend	trans	-83.8	140.2	176.3	-63.4	0	0	0	0	111.8	K564 I565 R575 V579	K564-S568 PolarHBondContact O-N 2.62Å; K564-S568 PolarHBondContact O-OG 3.26Å; K564-S568 VanDerWaalsContact O-OG 3.09Å; I565-S568 PolarHBondContact O-N 3.01Å; S568-R575 VanDerWaalsContact O-CD 3.26Å; S568-R575 WeakPolarHBondContact O-CD 3.5Å; S568-R575 PolarHBondContact O-NE 3.48Å; S568-R575 PolarHBondContact O-NH2 2.97Å; S568-V579 WeakPolarHBondContact OG-CG1 3.25Å
569	D	84.4	Confident	88.9	Confident	161 Å²	161	81.3 Å²	81.3	86%	0.861	43%	0.427	S	S	*	.			trans	-81.9	152.3	176.7	-61.7	-48.3	0	0	0	112	R575	D569-R575 WeakPolarHBondContact O-CG 3.24Å
570	G	86.7	Confident	88.4	Confident	50 Å²	50	77.9 Å²	77.9	52%	0.515	41%	0.414	S	S	.	.	S	Bend	trans	108.9	-175.8	175.1	0	0	0	0	0	115.2	R575	G570-R575 WeakPolarHBondContact O-CD 3.47Å
571	P	87.8	Confident	87.7	Confident	74 Å²	74	79.3 Å²	79.3	48%	0.481	43%	0.427	S	S	.	.			trans	-69.9	153	175.4	28.2	-32.2	0	0	0	111.5	I573 E574 R575	P571-I573 VanDerWaalsContact C-N 3.32Å; P571-I573 PolarHBondContact O-N 3.12Å; P571-I573 VanDerWaalsContact O-N 3.16Å; P571-E574 VanDerWaalsContact CD-OE2 3.31Å; P571-E574 WeakPolarHBondContact CD-OE2 3.4Å; P571-E574 HydrophobicContact CG-CB 3.96Å; P571-E574 VanDerWaalsContact CG-CD 3.45Å; P571-E574 HydrophobicContact CG-CG 3.81Å; P571-E574 WeakPolarHBondContact CG-OE2 3.07Å; P571-E574 PolarHBondContact O-N 2.75Å; P571-R575 WeakPolarHBondContact O-CG 3.34Å; P571-R575 PolarHBondContact O-N 3.29Å
572	L	85.6	Confident	86.9	Confident	104 Å²	104	80.1 Å²	80.1	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-52	-44.1	-169.4	-177.1	65.4	0	0	0	114.2	I565 R575 I576	I565-L572 HydrophobicContact CG2-CD1 3.89Å; L572-R575 PolarHBondContact O-N 3.4Å; L572-I576 HydrophobicContact CD1-CD1 4.22Å; L572-I576 HydrophobicContact CG-CD1 4.06Å; L572-I576 VanDerWaalsContact O-CG1 3.31Å; L572-I576 WeakPolarHBondContact O-CG1 3.47Å; L572-I576 PolarHBondContact O-N 3Å
573	I	85.6	Confident	85.9	Confident	117 Å²	117	79.6 Å²	79.6	60%	0.6	43%	0.43	S	S	*	.	H	α-helix	trans	-67.7	-39.5	-178	-63.9	171.2	0	0	0	111.2	P571 K577	P571-I573 VanDerWaalsContact C-N 3.32Å; P571-I573 PolarHBondContact O-N 3.12Å; P571-I573 VanDerWaalsContact O-N 3.16Å; I573-K577 HydrophobicContact CG2-CD 4.3Å; I573-K577 WeakPolarHBondContact O-CG 3.3Å; I573-K577 PolarHBondContact O-N 3.37Å
574	E	85.9	Confident	83.7	Confident	125 Å²	125	88.2 Å²	88.2	58%	0.584	46%	0.458	S	S	*	.	H	α-helix	trans	-70.1	-38.6	178	-68.7	179.8	-174.2	0	0	111.1	P571 K577 A578	P571-E574 VanDerWaalsContact CD-OE2 3.31Å; P571-E574 WeakPolarHBondContact CD-OE2 3.4Å; P571-E574 HydrophobicContact CG-CB 3.96Å; P571-E574 VanDerWaalsContact CG-CD 3.45Å; P571-E574 HydrophobicContact CG-CG 3.81Å; P571-E574 WeakPolarHBondContact CG-OE2 3.07Å; P571-E574 PolarHBondContact O-N 2.75Å; E574-K577 PolarHBondContact O-N 3.39Å; E574-A578 VanDerWaalsContact O-CB 3.27Å; E574-A578 WeakPolarHBondContact O-CB 3.23Å; E574-A578 PolarHBondContact O-N 3.47Å
575	R	86.3	Confident	81.6	Confident	53 Å²	53	88.3 Å²	88.3	20%	0.2	48%	0.476	C	S	.	.	H	α-helix	trans	-56.9	-52.3	173.1	-71.1	165.6	63.1	163.4	35.9	111.3	I565 I566 S568 D569 G570 P571 L572 K577 A578 V579	I565-R575 PolarHBondContact O-NE 2.95Å; I565-R575 PolarHBondContact O-NH2 3.31Å; I566-R575 PolarHBondContact O-NH2 3.46Å; S568-R575 VanDerWaalsContact O-CD 3.26Å; S568-R575 WeakPolarHBondContact O-CD 3.5Å; S568-R575 PolarHBondContact O-NE 3.48Å; S568-R575 PolarHBondContact O-NH2 2.97Å; D569-R575 WeakPolarHBondContact O-CG 3.24Å; G570-R575 WeakPolarHBondContact O-CD 3.47Å; P571-R575 WeakPolarHBondContact O-CG 3.34Å; P571-R575 PolarHBondContact O-N 3.29Å; L572-R575 PolarHBondContact O-N 3.4Å; R575-K577 VanDerWaalsContact C-N 3.34Å; R575-K577 PolarHBondContact O-N 3.21Å; R575-A578 PolarHBondContact O-N 3.43Å; R575-V579 WeakPolarHBondContact O-CG2 3.38Å; R575-V579 PolarHBondContact O-N 2.82Å
576	I	86.5	Confident	79.5	Confident	67 Å²	67	87.7 Å²	87.7	34%	0.344	48%	0.477	S	S	.	.	H	α-helix	trans	-58.7	-46.7	179.3	-67.8	166.9	0	0	0	110.4	I119 I565 L572 A578 V579 A580	I119-I576 HydrophobicContact CD1-CG2 4.43Å; I565-I576 HydrophobicContact CD1-CG1 4Å; I565-I576 HydrophobicContact CG1-CG1 4.22Å; L572-I576 HydrophobicContact CD1-CD1 4.22Å; L572-I576 HydrophobicContact CG-CD1 4.06Å; L572-I576 VanDerWaalsContact O-CG1 3.31Å; L572-I576 WeakPolarHBondContact O-CG1 3.47Å; L572-I576 PolarHBondContact O-N 3Å; I576-A578 VanDerWaalsContact C-N 3.34Å; I576-A578 PolarHBondContact O-N 3.42Å; I576-V579 WeakPolarHBondContact O-CG2 3.25Å; I576-V579 PolarHBondContact O-N 2.88Å; I576-A580 WeakPolarHBondContact O-CB 3.45Å; I576-A580 PolarHBondContact O-N 3.43Å
577	K	84.6	Confident	77.1	Confident	146 Å²	146	84.5 Å²	84.5	64%	0.635	47%	0.469	S	S	*	.	H	α-helix	trans	-62.2	-40.3	177.5	-74.1	177.9	-179.8	-179.4	0	112.4	I573 E574 R575 A581	I573-K577 HydrophobicContact CG2-CD 4.3Å; I573-K577 WeakPolarHBondContact O-CG 3.3Å; I573-K577 PolarHBondContact O-N 3.37Å; E574-K577 PolarHBondContact O-N 3.39Å; R575-K577 VanDerWaalsContact C-N 3.34Å; R575-K577 PolarHBondContact O-N 3.21Å; K577-A581 PolarHBondContact O-N 2.66Å; K577-A581 VanDerWaalsContact O-N 3.16Å
578	A	82.8	Confident	74.8	Confident	69 Å²	69	76.5 Å²	76.5	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-66.2	-43.7	-179.5	0	0	0	0	0	112	E574 R575 I576	E574-A578 VanDerWaalsContact O-CB 3.27Å; E574-A578 WeakPolarHBondContact O-CB 3.23Å; E574-A578 PolarHBondContact O-N 3.47Å; R575-A578 PolarHBondContact O-N 3.43Å; I576-A578 VanDerWaalsContact C-N 3.34Å; I576-A578 PolarHBondContact O-N 3.42Å
579	V	85.4	Confident	72.4	Confident	12 Å²	12	78.2 Å²	78.2	7%	0.073	46%	0.456	C	S	.	.	H	α-helix	trans	-79.3	-21.3	179.1	-61.4	0	0	0	0	113.5	P118 I119 K564 I565 S568 R575 I576	P118-V579 CarbonylContact C-O 3.31Å; P118-V579 WeakPolarHBondContact CB-O 3.48Å; P118-V579 WeakPolarHBondContact CD-O 3.48Å; I119-V579 HydrophobicContact CB-CB 4.22Å; I119-V579 HydrophobicContact CB-CG2 3.82Å; I119-V579 WeakPolarHBondContact CB-O 3.44Å; I119-V579 HydrophobicContact CD1-CG2 3.81Å; I119-V579 HydrophobicContact CG1-CG2 3.78Å; I119-V579 PolarHBondContact N-O 3.02Å; K564-V579 HydrophobicContact CB-CG1 4.39Å; I565-V579 HydrophobicContact CG1-CG2 4.41Å; S568-V579 WeakPolarHBondContact OG-CG1 3.25Å; R575-V579 WeakPolarHBondContact O-CG2 3.38Å; R575-V579 PolarHBondContact O-N 2.82Å; I576-V579 WeakPolarHBondContact O-CG2 3.25Å; I576-V579 PolarHBondContact O-N 2.88Å
580	A	84.4	Confident	70.2	Confident	20 Å²	20	79.5 Å²	79.5	17%	0.165	45%	0.449	C	S	.	.	H	α-helix	trans	-78.1	-26	174.7	0	0	0	0	0	112.9	I119 V482 I576	I119-A580 HydrophobicContact CG2-CB 4.16Å; V482-A580 HydrophobicContact CG1-CB 3.81Å; I576-A580 WeakPolarHBondContact O-CB 3.45Å; I576-A580 PolarHBondContact O-N 3.43Å
581	A	81.1	Confident	67.5	Low	45 Å²	45	83 Å²	83	37%	0.372	46%	0.463	S	S	.	.	S	Bend	trans	-70.1	141.1	-179.1	0	0	0	0	0	112	P118 K577	P118-A581 VanDerWaalsContact CD-O 3.25Å; P118-A581 WeakPolarHBondContact CD-O 3.49Å; K577-A581 PolarHBondContact O-N 2.66Å; K577-A581 VanDerWaalsContact O-N 3.16Å
582	P	77.3	Confident	65.1	Low	48 Å²	48	84.2 Å²	84.2	31%	0.312	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-61.6	148.8	173.3	24.3	-32.2	0	0	0	111.2	L116 Y483 R584	L116-P582 WeakPolarHBondContact O-CB 3.34Å; Y483-P582 HydrophobicContact CD2-CB 4.39Å; Y483-P582 HydrophobicContact CD2-CG 4.39Å; Y483-P582 HydrophobicContact CE2-CB 4.08Å; Y483-P582 HydrophobicContact CE2-CG 4.12Å; P582-R584 PolarHBondContact O-N 3.13Å
583	V	72.2	Confident	62.5	Low	69 Å²	69	85.8 Å²	85.8	42%	0.418	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-65.7	123.1	-176.6	-178.6	0	0	0	0	110.6	E114 K115 P118 G585 G586	E114-V583 VanDerWaalsContact O-CG2 3.31Å; E114-V583 WeakPolarHBondContact O-CG2 3.31Å; K115-V583 PolarHBondContact O-N 3.04Å; P118-V583 HydrophobicContact CG-CG2 3.95Å; V583-G585 PolarHBondContact O-N 3Å; V583-G586 PolarHBondContact O-N 2.97Å; V583-G586 VanDerWaalsContact O-N 3.17Å
584	R	48.2	Very low	59.8	Low	250 Å²	250	88.3 Å²	88.3	94%	0.943	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	122.4	175.5	-76.4	-176.7	177.5	178.2	0	110.1	P582	P582-R584 PolarHBondContact O-N 3.13Å
585	G	47.7	Very low	56.9	Low	63 Å²	63	93.1 Å²	93.1	65%	0.649	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-1.8	-179.3	0	0	0	0	0	115.3	V583 S589	V583-G585 PolarHBondContact O-N 3Å; G585-S589 WeakPolarHBondContact CA-OG 3.26Å
586	G	45.4	Very low	54.1	Low	17 Å²	17	96.3 Å²	96.3	18%	0.175	53%	0.534	C	S	.	.	S	Bend	trans	-74.8	179.4	165.5	0	0	0	0	0	111.6	V583 S588 S589	V583-G586 PolarHBondContact O-N 2.97Å; V583-G586 VanDerWaalsContact O-N 3.17Å; G586-S588 PolarHBondContact O-N 3.42Å; G586-S589 PolarHBondContact O-N 2.84Å; G586-S589 PolarHBondContact O-OG 2.84Å
587	A	43.4	Very low	51.4	Low	51 Å²	51	99.1 Å²	99.1	42%	0.421	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.5	-11.8	178.5	0	0	0	0	0	115.3	F104	F104-A587 WeakPolarHBondContact CZ-O 3.42Å
588	S	42.8	Very low	48.7	Very low	37 Å²	37	98.9 Å²	98.9	26%	0.259	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-7	172.7	-172.8	0	0	0	0	115.4	Y483 G586 R590	Y483-S588 PolarHBondContact OH-OG 3.31Å; G586-S588 PolarHBondContact O-N 3.42Å; S588-R590 PolarHBondContact O-N 3.3Å
589	S	37	Very low	46	Very low	65 Å²	65	104 Å²	104	46%	0.455	57%	0.574	S	S	.	*	S	Bend	trans	-79.2	107.1	173.1	51.7	0	0	0	0	109.2	G585 G586	G585-S589 WeakPolarHBondContact CA-OG 3.26Å; G586-S589 PolarHBondContact O-N 2.84Å; G586-S589 PolarHBondContact O-OG 2.84Å
590	R	37	Very low	43.2	Very low	187 Å²	187	111 Å²	111	71%	0.706	61%	0.611	S	S	*	*			trans	-41	137.2	164.3	-69.6	-178.9	178.2	-175	-2.1	109.2	S588 A592	S588-R590 PolarHBondContact O-N 3.3Å; R590-A592 PolarHBondContact O-N 3.28Å; R590-A592 VanDerWaalsContact O-N 3.08Å
591	P	30.5	Very low	40.5	Very low	125 Å²	125	116.4 Å²	116.4	81%	0.812	64%	0.642	S	S	*	*			trans	-53.3	121.7	156.3	-13.9	27.3	0	0	0	105.8	D593	P591-D593 VanDerWaalsContact C-N 3.33Å; P591-D593 PolarHBondContact O-N 2.89Å
592	A	36.6	Very low	37.9	Very low	98 Å²	98	118.9 Å²	118.9	81%	0.81	66%	0.655	S	S	*	*			trans	-64.1	101.7	174.9	0	0	0	0	0	106.9	R590	R590-A592 PolarHBondContact O-N 3.28Å; R590-A592 VanDerWaalsContact O-N 3.08Å
593	D	32.7	Very low	35.6	Very low	137 Å²	137	122.4 Å²	122.4	73%	0.733	68%	0.678	S	S	*	*			trans	-148.7	133.2	158.4	-115.2	-35.1	0	0	0	114.4	P591	P591-D593 VanDerWaalsContact C-N 3.33Å; P591-D593 PolarHBondContact O-N 2.89Å
594	H	28.4	Very low	33.6	Very low	170 Å²	170	127.5 Å²	127.5	79%	0.787	70%	0.702	S	S	*	*			trans	76.3	57.7	167.4	-59.8	16.7	0	0	0	117.1
595	R	25	Very low	32.7	Very low	227 Å²	227	122.1 Å²	122.1	86%	0.857	69%	0.692	S	S	*	*			trans	-98.6	116.1	137.6	-73.3	-172.6	-169.8	-177.8	3.3	107.8
596	V	26.5	Very low	32	Very low	120 Å²	120	124.4 Å²	124.4	73%	0.727	70%	0.696	S	S	*	*			trans	-48.8	127.1	163.4	179.4	0	0	0	0	107.5	N598	V596-N598 PolarHBondContact O-N 3.35Å
597	P	29.5	Very low	31.3	Very low	125 Å²	125	130.7 Å²	130.7	81%	0.812	73%	0.725	S	S	*	*			trans	-72.9	98.4	177.7	27.7	-30.1	0	0	0	108.2	E599	P597-E599 PolarHBondContact O-N 3.34Å
598	N	28.2	Very low	30.6	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	74%	0.742	S	S	*	*			trans	-73.4	116.8	163.8	-92.2	5.1	0	0	0	108.7	V596	V596-N598 PolarHBondContact O-N 3.35Å
599	E	26.8	Very low	30	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	77%	0.773	S	S	*	*			trans	61.2	100.5	153	-63.7	-176.1	162.4	0	0	117.5	P597 T601	P597-E599 PolarHBondContact O-N 3.34Å; E599-T601 PolarHBondContact O-N 3.16Å; E599-T601 VanDerWaalsContact O-N 3.15Å
600	L	27.2	Very low	29.6	Very low	159 Å²	159	145.1 Å²	145.1	83%	0.832	80%	0.795	S	S	*	*			trans	-38.7	110.3	151.6	-111.3	77.1	0	0	0	111.3
601	T	26.4	Very low	29.1	Very low	135 Å²	135	139.9 Å²	139.9	83%	0.828	80%	0.799	S	S	*	*			trans	-96.4	95.3	147.1	48.4	0	0	0	0	107.8	E599	E599-T601 PolarHBondContact O-N 3.16Å; E599-T601 VanDerWaalsContact O-N 3.15Å
602	C	27.4	Very low	28.9	Very low	96 Å²	96	141.8 Å²	141.8	65%	0.649	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.9	133.5	165.7	-81.6	0	0	0	0	109.8
603	P	29.7	Very low	28.5	Very low	122 Å²	122	145.6 Å²	145.6	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.6	127.8	155.5	-3.9	20.7	0	0	0	108.3	D605	P603-D605 PolarHBondContact O-N 3.17Å
604	L	29.1	Very low	28.1	Very low	176 Å²	176	148.3 Å²	148.3	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.9	117.1	167.3	-77.6	154.8	0	0	0	108.9
605	D	28.4	Very low	28	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-88.6	118.5	167.2	-168.3	-2.8	0	0	0	108.8	P603 N607	P603-D605 PolarHBondContact O-N 3.17Å; D605-N607 VanDerWaalsContact C-N 3.33Å; D605-N607 PolarHBondContact O-N 3.04Å
606	P	34.1	Very low	28.1	Very low	111 Å²	111	143.5 Å²	143.5	72%	0.721	82%	0.816	S	S	*	*	S	Bend	trans	-90.1	71.1	177	36.2	-29.5	0	0	0	109.2
607	N	31.4	Very low	28.2	Very low	149 Å²	149	143.7 Å²	143.7	80%	0.797	82%	0.82	S	S	*	*			trans	178.1	98.5	149.3	-92.9	-23.2	0	0	0	110.3	D605 N609	D605-N607 VanDerWaalsContact C-N 3.33Å; D605-N607 PolarHBondContact O-N 3.04Å; N607-N609 PolarHBondContact O-N 3.06Å
608	G	28.6	Very low	28.1	Very low	75 Å²	75	144.1 Å²	144.1	77%	0.773	82%	0.82	S	S	*	*			trans	-67.9	128.7	172.5	0	0	0	0	0	112.2
609	N	28.5	Very low	28	Very low	171 Å²	171	146 Å²	146	91%	0.914	82%	0.824	S	S	*	*			trans	-156.6	135.1	136.9	-108.9	-17.9	0	0	0	112	N607	N607-N609 PolarHBondContact O-N 3.06Å
610	K	30.1	Very low	28	Very low	210 Å²	210	143.5 Å²	143.5	91%	0.913	82%	0.821	S	S	*	*			trans	-72.2	149.4	-171.7	-68.5	174	174.8	176.4	0	113.1
611	G	26	Very low	28	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	82%	0.816	S	S	*	*			trans	-168.8	111.5	160.5	0	0	0	0	0	112.8
612	L	26.9	Very low	28	Very low	165 Å²	165	142.5 Å²	142.5	86%	0.864	81%	0.814	S	S	*	*			trans	-50.1	144	177.2	-87.8	72.2	0	0	0	114.5
613	M	26.6	Very low	28	Very low	178 Å²	178	145.7 Å²	145.7	88%	0.877	82%	0.819	S	S	*	*				179.8	112.9	110.4	-89.1	-142.8	166.3	0	0	111.8
614	M	26	Very low	27.9	Very low	194 Å²	194	145.4 Å²	145.4	96%	0.956	82%	0.816	S	S	*	*			trans	-83.5	132.7	162.3	-92.8	177.8	158.9	0	0	109.5
615	K	26.3	Very low	27.9	Very low	203 Å²	203	145.5 Å²	145.5	88%	0.883	81%	0.813	S	S	*	*			trans	-130.8	114.9	156.6	-98.8	-176.1	176.1	178.8	0	108.8
616	A	26.1	Very low	28.1	Very low	93 Å²	93	151.8 Å²	151.8	77%	0.769	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-79.5	150.3	170.3	0	0	0	0	0	110.8
617	P	29.5	Very low	27.8	Very low	125 Å²	125	153.9 Å²	153.9	81%	0.812	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-91	125.9	165.8	30.9	-23.6	0	0	0	111.2
618	T	27.1	Very low	27.6	Very low	133 Å²	133	154.1 Å²	154.1	82%	0.816	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-72.8	131.2	176.7	32.7	0	0	0	0	112.6
619	H	25.8	Very low	27.5	Very low	182 Å²	182	158.5 Å²	158.5	84%	0.843	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-74.4	136.5	159.7	-82.7	-94.2	0	0	0	110.2
620	T	26.3	Very low	27.4	Very low	122 Å²	122	157.8 Å²	157.8	75%	0.748	85%	0.851	S	S	*	*			trans	-123.9	109.4	164.6	-50.6	0	0	0	0	108.9	V622	T620-V622 HydrophobicContact CG2-CG2 4.04Å
621	I	27.2	Very low	27.3	Very low	145 Å²	145	154.5 Å²	154.5	74%	0.744	85%	0.848	S	S	*	*			trans	-87.8	133.4	163.4	-66.5	168.4	0	0	0	106.4
622	V	27.8	Very low	27.4	Very low	128 Å²	128	159.7 Å²	159.7	78%	0.776	85%	0.851	S	S	*	*			trans	-133.1	100.2	160.3	-176.9	0	0	0	0	108.2	T620	T620-V622 HydrophobicContact CG2-CG2 4.04Å
623	E	27	Very low	27.4	Very low	163 Å²	163	159.3 Å²	159.3	76%	0.762	85%	0.85	S	S	*	*			trans	-84.1	143.1	151.3	-75.9	-177.4	141.9	0	0	108.8
624	T	27.5	Very low	27.5	Very low	117 Å²	117	157.8 Å²	157.8	72%	0.718	85%	0.848	S	S	*	*				175.4	116.6	123.3	19.5	0	0	0	0	109.8
625	M	28.7	Very low	27.6	Very low	177 Å²	177	154.8 Å²	154.8	87%	0.872	84%	0.839	S	S	*	*				79.4	102.8	101.4	-77.1	-174.4	172.7	0	0	116.1
626	M	31.8	Very low	27.7	Very low	270 Å²	270	150.5 Å²	150.5	100%	1.33	84%	0.835	S	S	*	*				-180	0	103.2	-107.4	-171.8	178.5	0	0	110.2

Retrieved 626 of 626 residues in 453.2 ms (Link to these results)

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