A0A087XFH5_POEFO Loading...

Exocyst complex component 3

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087XFH5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 750 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	56.5	Low	71.6	Confident	205 Å²	205	117.2 Å²	117.2	100%	1.01	62%	0.623	S	S	*	*				0	-39.4	0	-90.1	-155.4	-77.1	0	0	112.9	T4 S5	M1-T4 WeakPolarHBondContact CA-OG1 3.43Å; M1-T4 PolarHBondContact O-OG1 2.86Å; M1-S5 VanDerWaalsContact O-CB 3.32Å; M1-S5 WeakPolarHBondContact O-CB 3.41Å; M1-S5 PolarHBondContact O-N 2.9Å
2	E	64.4	Low	72.1	Confident	158 Å²	158	111.6 Å²	111.6	74%	0.738	61%	0.605	S	S	*	*	H	α-helix	trans	-66.7	-38.6	179.2	-72.1	-172.9	148.5	0	0	113.8	S5 R6	E2-S5 WeakPolarHBondContact O-CB 3.41Å; E2-S5 PolarHBondContact O-N 3.17Å; E2-R6 PolarHBondContact O-N 3.37Å
3	E	65.1	Low	72.7	Confident	160 Å²	160	110.2 Å²	110.2	75%	0.748	60%	0.602	S	S	*	*	H	α-helix	trans	-68.3	-46.5	-179.3	-151.6	164.8	-151.1	0	0	112.1	S5 R6 E7	E3-S5 VanDerWaalsContact C-N 3.26Å; E3-S5 PolarHBondContact O-N 3.34Å; E3-R6 PolarHBondContact O-N 3.31Å; E3-R6 VanDerWaalsContact O-N 3.15Å; E3-E7 PolarHBondContact O-N 3.08Å
4	T	68.1	Low	73	Confident	86 Å²	86	112.9 Å²	112.9	53%	0.528	61%	0.609	S	S	.	*	H	α-helix	trans	-62	-31.4	171.8	46.2	0	0	0	0	113.1	M1 A8	M1-T4 WeakPolarHBondContact CA-OG1 3.43Å; M1-T4 PolarHBondContact O-OG1 2.86Å; T4-A8 WeakPolarHBondContact O-CB 3.37Å; T4-A8 PolarHBondContact O-N 3.46Å; T4-A8 VanDerWaalsContact O-N 3.1Å
5	S	71.8	Confident	73.2	Confident	67 Å²	67	114.8 Å²	114.8	47%	0.469	60%	0.604	S	S	.	*	H	α-helix	trans	-71.7	-40.5	174.9	-179.2	0	0	0	0	111.1	M1 E2 E3 A8 V9	M1-S5 VanDerWaalsContact O-CB 3.32Å; M1-S5 WeakPolarHBondContact O-CB 3.41Å; M1-S5 PolarHBondContact O-N 2.9Å; E2-S5 WeakPolarHBondContact O-CB 3.41Å; E2-S5 PolarHBondContact O-N 3.17Å; E3-S5 VanDerWaalsContact C-N 3.26Å; E3-S5 PolarHBondContact O-N 3.34Å; S5-A8 PolarHBondContact O-N 2.85Å; S5-V9 VanDerWaalsContact O-CG2 3.25Å; S5-V9 WeakPolarHBondContact O-CG2 3.49Å; S5-V9 PolarHBondContact O-N 3.41Å
6	R	76.4	Confident	73.4	Confident	192 Å²	192	112.8 Å²	112.8	73%	0.725	60%	0.597	S	S	*	*	H	α-helix	trans	-63.9	-43.7	175.1	-76.8	-178.8	-178.6	171.8	2.8	112.3	E2 E3 V9 A10	E2-R6 PolarHBondContact O-N 3.37Å; E3-R6 PolarHBondContact O-N 3.31Å; E3-R6 VanDerWaalsContact O-N 3.15Å; R6-V9 PolarHBondContact O-N 3.41Å; R6-A10 WeakPolarHBondContact O-CB 3.48Å; R6-A10 PolarHBondContact O-N 3.47Å
7	E	75.2	Confident	73.5	Confident	131 Å²	131	109.9 Å²	109.9	61%	0.612	59%	0.593	S	S	*	*	H	α-helix	trans	-63.4	-42.9	175.4	-79.1	-174.2	147.8	0	0	112.7	E3 V9 A10 T11	E3-E7 PolarHBondContact O-N 3.08Å; E7-V9 VanDerWaalsContact C-N 3.32Å; E7-V9 PolarHBondContact O-N 3.35Å; E7-A10 PolarHBondContact O-N 2.91Å; E7-T11 WeakPolarHBondContact O-CB 3.46Å; E7-T11 PolarHBondContact O-N 2.66Å; E7-T11 PolarHBondContact O-OG1 3.21Å
8	A	75.7	Confident	73.5	Confident	60 Å²	60	106.3 Å²	106.3	50%	0.496	59%	0.586	S	S	.	*	H	α-helix	trans	-62.9	-39.2	177.2	0	0	0	0	0	111.9	T4 S5 A12	T4-A8 WeakPolarHBondContact O-CB 3.37Å; T4-A8 PolarHBondContact O-N 3.46Å; T4-A8 VanDerWaalsContact O-N 3.1Å; S5-A8 PolarHBondContact O-N 2.85Å; A8-A12 VanDerWaalsContact O-CB 3.29Å; A8-A12 WeakPolarHBondContact O-CB 3.37Å; A8-A12 PolarHBondContact O-N 3.37Å
9	V	79.1	Confident	73.5	Confident	87 Å²	87	103.7 Å²	103.7	53%	0.527	57%	0.57	S	S	.	*	H	α-helix	trans	-66.9	-47.1	174.7	171.7	0	0	0	0	110.9	S5 R6 E7 T11 A12 V13	S5-V9 VanDerWaalsContact O-CG2 3.25Å; S5-V9 WeakPolarHBondContact O-CG2 3.49Å; S5-V9 PolarHBondContact O-N 3.41Å; R6-V9 PolarHBondContact O-N 3.41Å; E7-V9 VanDerWaalsContact C-N 3.32Å; E7-V9 PolarHBondContact O-N 3.35Å; V9-T11 VanDerWaalsContact C-N 3.31Å; V9-T11 PolarHBondContact O-N 3.05Å; V9-A12 PolarHBondContact O-N 2.7Å; V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 VanDerWaalsContact O-CG2 3.28Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.03Å
10	A	77.3	Confident	73.6	Confident	56 Å²	56	101.6 Å²	101.6	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-59.1	-42.1	177.8	0	0	0	0	0	112.2	R6 E7 V13 Q14	R6-A10 WeakPolarHBondContact O-CB 3.48Å; R6-A10 PolarHBondContact O-N 3.47Å; E7-A10 PolarHBondContact O-N 2.91Å; A10-V13 PolarHBondContact O-N 2.72Å; A10-Q14 PolarHBondContact O-N 2.94Å
11	T	78	Confident	73.5	Confident	87 Å²	87	104 Å²	104	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-66.9	-40.7	176.5	-50.7	0	0	0	0	111.7	E7 V9 Q14 R15	E7-T11 WeakPolarHBondContact O-CB 3.46Å; E7-T11 PolarHBondContact O-N 2.66Å; E7-T11 PolarHBondContact O-OG1 3.21Å; V9-T11 VanDerWaalsContact C-N 3.31Å; V9-T11 PolarHBondContact O-N 3.05Å; T11-Q14 PolarHBondContact O-N 3.49Å; T11-R15 VanDerWaalsContact O-CB 3.28Å; T11-R15 WeakPolarHBondContact O-CB 3.29Å; T11-R15 PolarHBondContact O-N 2.98Å
12	A	77.8	Confident	74.3	Confident	50 Å²	50	103.1 Å²	103.1	41%	0.413	55%	0.55	S	S	.	*	H	α-helix	trans	-64.6	-40.4	175.5	0	0	0	0	0	111.7	A8 V9 R15 V16	A8-A12 VanDerWaalsContact O-CB 3.29Å; A8-A12 WeakPolarHBondContact O-CB 3.37Å; A8-A12 PolarHBondContact O-N 3.37Å; V9-A12 PolarHBondContact O-N 2.7Å; A12-R15 PolarHBondContact O-N 3.38Å; A12-V16 VanDerWaalsContact O-CG2 3.3Å; A12-V16 WeakPolarHBondContact O-CG2 3.23Å; A12-V16 PolarHBondContact O-N 2.9Å
13	V	79.1	Confident	74.4	Confident	93 Å²	93	100.5 Å²	100.5	56%	0.564	55%	0.55	S	S	*	.	H	α-helix	trans	-63	-48.2	175.9	170.4	0	0	0	0	110.9	V9 A10 R15 V16 A17	V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 VanDerWaalsContact O-CG2 3.28Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.03Å; A10-V13 PolarHBondContact O-N 2.72Å; V13-R15 VanDerWaalsContact C-N 3.28Å; V13-R15 PolarHBondContact O-N 3.4Å; V13-V16 PolarHBondContact O-N 3.31Å; V13-A17 WeakPolarHBondContact O-CB 3.45Å; V13-A17 PolarHBondContact O-N 2.67Å
14	Q	77.5	Confident	74.7	Confident	149 Å²	149	98 Å²	98	70%	0.696	54%	0.541	S	S	*	.	H	α-helix	trans	-58.2	-41.3	174.2	-83.8	-174.8	-18.2	0	0	112.2	A10 T11 A17 G18	A10-Q14 PolarHBondContact O-N 2.94Å; T11-Q14 PolarHBondContact O-N 3.49Å; Q14-A17 PolarHBondContact O-N 3.04Å; Q14-G18 PolarHBondContact O-N 2.86Å
15	R	76.1	Confident	74.8	Confident	141 Å²	141	96.6 Å²	96.6	53%	0.532	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-40.3	179.7	-168.1	179.5	-168.3	171.8	10.4	112.4	T11 A12 V13 G18 M19	T11-R15 VanDerWaalsContact O-CB 3.28Å; T11-R15 WeakPolarHBondContact O-CB 3.29Å; T11-R15 PolarHBondContact O-N 2.98Å; A12-R15 PolarHBondContact O-N 3.38Å; V13-R15 VanDerWaalsContact C-N 3.28Å; V13-R15 PolarHBondContact O-N 3.4Å; R15-G18 PolarHBondContact O-N 2.98Å; R15-M19 HydrophobicContact CG-CE 3.73Å; R15-M19 VanDerWaalsContact O-CG 3.25Å; R15-M19 WeakPolarHBondContact O-CG 3.19Å; R15-M19 PolarHBondContact O-N 3.25Å
16	V	76.6	Confident	74.8	Confident	83 Å²	83	98.1 Å²	98.1	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-69.3	-42	175.9	172.8	0	0	0	0	110.7	A12 V13 G18 M19 L20	A12-V16 VanDerWaalsContact O-CG2 3.3Å; A12-V16 WeakPolarHBondContact O-CG2 3.23Å; A12-V16 PolarHBondContact O-N 2.9Å; V13-V16 PolarHBondContact O-N 3.31Å; V16-G18 VanDerWaalsContact C-N 3.28Å; V16-G18 PolarHBondContact O-N 3.13Å; V16-M19 PolarHBondContact O-N 2.99Å; V16-L20 HydrophobicContact CG1-CD1 4.28Å; V16-L20 PolarHBondContact O-N 3.01Å
17	A	74.8	Confident	74.7	Confident	63 Å²	63	96 Å²	96	52%	0.521	53%	0.534	S	S	.	.	H	α-helix	trans	-59.9	-37.7	174.9	0	0	0	0	0	112.3	V13 Q14 M19	V13-A17 WeakPolarHBondContact O-CB 3.45Å; V13-A17 PolarHBondContact O-N 2.67Å; Q14-A17 PolarHBondContact O-N 3.04Å; A17-M19 VanDerWaalsContact C-N 3.3Å; A17-M19 PolarHBondContact O-N 3.35Å
18	G	73.6	Confident	74.6	Confident	46 Å²	46	94.9 Å²	94.9	47%	0.474	53%	0.527	S	S	.	.	H	α-helix	trans	-69.8	-20.5	174	0	0	0	0	0	114.9	Q14 R15 V16	Q14-G18 PolarHBondContact O-N 2.86Å; R15-G18 PolarHBondContact O-N 2.98Å; V16-G18 VanDerWaalsContact C-N 3.28Å; V16-G18 PolarHBondContact O-N 3.13Å
19	M	73.3	Confident	74.8	Confident	57 Å²	57	94.7 Å²	94.7	28%	0.281	52%	0.52	S	S	.	.	H	α-helix	trans	-90.6	-15.7	-177.6	-73.7	174.6	-179.7	0	0	114.3	R15 V16 A17 Q25 Y32	R15-M19 HydrophobicContact CG-CE 3.73Å; R15-M19 VanDerWaalsContact O-CG 3.25Å; R15-M19 WeakPolarHBondContact O-CG 3.19Å; R15-M19 PolarHBondContact O-N 3.25Å; V16-M19 PolarHBondContact O-N 2.99Å; A17-M19 VanDerWaalsContact C-N 3.3Å; A17-M19 PolarHBondContact O-N 3.35Å; M19-Q25 PolarHBondContact O-OE1 2.98Å; M19-Y32 HydrophobicContact CB-CE2 4.5Å
20	L	75	Confident	74.8	Confident	60 Å²	60	96.2 Å²	96.2	31%	0.314	52%	0.521	S	S	.	.			trans	-131.3	62.8	-172.6	-63.9	172.4	0	0	0	111.1	V16 Q25 V29	V16-L20 HydrophobicContact CG1-CD1 4.28Å; V16-L20 PolarHBondContact O-N 3.01Å; L20-Q25 HydrophobicContact CD2-CB 4.24Å; L20-Q25 WeakPolarHBondContact CD2-O 3.26Å; L20-V29 HydrophobicContact CD1-CG2 3.91Å; L20-V29 HydrophobicContact CD2-CG2 3.6Å; L20-V29 HydrophobicContact CG-CG2 4.42Å
21	Q	72.9	Confident	74.9	Confident	154 Å²	154	100 Å²	100	72%	0.72	53%	0.529	S	S	*	.			trans	-90.1	-15.1	-175	-67	-165.5	-11.6	0	0	114.4
22	R	71.8	Confident	75	Confident	185 Å²	185	99.3 Å²	99.3	70%	0.698	52%	0.518	S	S	*	.	S	Bend	trans	-134.9	151.3	-179.8	-61.5	-176	-177.9	-172.4	-0.4	111.1	D24 Q25	R22-D24 VanDerWaalsContact C-N 3.27Å; R22-D24 WeakPolarHBondContact CB-OD1 3.34Å; R22-D24 PolarHBondContact O-N 2.92Å; R22-Q25 HydrophobicContact CB-CG 4.41Å; R22-Q25 WeakPolarHBondContact O-CB 3.29Å; R22-Q25 PolarHBondContact O-N 3.14Å
23	S	68.2	Low	75.2	Confident	104 Å²	104	106.3 Å²	106.3	73%	0.727	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-62.8	-27.6	-172.5	-171.3	0	0	0	0	114.3	Q25	S23-Q25 PolarHBondContact O-N 3.24Å
24	D	70.1	Confident	75.4	Confident	107 Å²	107	108.7 Å²	108.7	57%	0.572	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-72	-11.8	176.7	62.3	-46.2	0	0	0	113.3	R22	R22-D24 VanDerWaalsContact C-N 3.27Å; R22-D24 WeakPolarHBondContact CB-OD1 3.34Å; R22-D24 PolarHBondContact O-N 2.92Å
25	Q	70.6	Confident	75.6	Confident	56 Å²	56	108.3 Å²	108.3	26%	0.262	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-88	-7.7	180	-58.5	-173.4	-24	0	0	113.3	M19 L20 R22 S23 D27 K28	M19-Q25 PolarHBondContact O-OE1 2.98Å; L20-Q25 HydrophobicContact CD2-CB 4.24Å; L20-Q25 WeakPolarHBondContact CD2-O 3.26Å; R22-Q25 HydrophobicContact CB-CG 4.41Å; R22-Q25 WeakPolarHBondContact O-CB 3.29Å; R22-Q25 PolarHBondContact O-N 3.14Å; S23-Q25 PolarHBondContact O-N 3.24Å; Q25-D27 VanDerWaalsContact C-N 3.26Å; Q25-D27 PolarHBondContact O-N 3.33Å; Q25-K28 PolarHBondContact O-N 3.3Å
26	L	72.3	Confident	75.9	Confident	100 Å²	100	105.3 Å²	105.3	52%	0.524	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-64.8	-29.9	176	-73.6	168.4	0	0	0	112.4	K28 V29	L26-K28 PolarHBondContact O-N 2.88Å; L26-K28 VanDerWaalsContact O-N 3.15Å; L26-V29 HydrophobicContact CD2-CG2 4.14Å; L26-V29 VanDerWaalsContact O-CB 3.32Å; L26-V29 WeakPolarHBondContact O-CB 3.45Å; L26-V29 VanDerWaalsContact O-CG2 3.23Å; L26-V29 WeakPolarHBondContact O-CG2 3.34Å; L26-V29 PolarHBondContact O-N 3.23Å; L26-V29 VanDerWaalsContact O-N 3.1Å
27	D	73	Confident	76.3	Confident	148 Å²	148	104.1 Å²	104.1	79%	0.791	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-63	-21.7	176	-66.9	-20.9	0	0	0	112.7	Q25	Q25-D27 VanDerWaalsContact C-N 3.26Å; Q25-D27 PolarHBondContact O-N 3.33Å
28	K	73.6	Confident	76.8	Confident	107 Å²	107	109.9 Å²	109.9	47%	0.465	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-91.2	-4.3	179.5	-63.7	179.1	-178.1	172.2	0	113.6	Q25 L26 E30 Q31 Y32	Q25-K28 PolarHBondContact O-N 3.3Å; L26-K28 PolarHBondContact O-N 2.88Å; L26-K28 VanDerWaalsContact O-N 3.15Å; K28-E30 VanDerWaalsContact C-N 3.3Å; K28-E30 PolarHBondContact O-N 2.9Å; K28-Q31 WeakPolarHBondContact O-CB 3.31Å; K28-Q31 PolarHBondContact O-N 3.24Å; K28-Q31 VanDerWaalsContact O-N 3.13Å; K28-Y32 HydrophobicContact CB-CD2 4.4Å; K28-Y32 HydrophobicContact CB-CE2 3.98Å; K28-Y32 WeakPolarHBondContact O-CD2 3.31Å; K28-Y32 PolarHBondContact O-N 3.12Å
29	V	79.6	Confident	77.3	Confident	55 Å²	55	111.1 Å²	111.1	33%	0.333	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-40.7	-177.7	171.1	0	0	0	0	111.7	L20 L26 Q31 Y32 R33	L20-V29 HydrophobicContact CD1-CG2 3.91Å; L20-V29 HydrophobicContact CD2-CG2 3.6Å; L20-V29 HydrophobicContact CG-CG2 4.42Å; L26-V29 HydrophobicContact CD2-CG2 4.14Å; L26-V29 VanDerWaalsContact O-CB 3.32Å; L26-V29 WeakPolarHBondContact O-CB 3.45Å; L26-V29 VanDerWaalsContact O-CG2 3.23Å; L26-V29 WeakPolarHBondContact O-CG2 3.34Å; L26-V29 PolarHBondContact O-N 3.23Å; L26-V29 VanDerWaalsContact O-N 3.1Å; V29-Q31 VanDerWaalsContact C-N 3.29Å; V29-Q31 PolarHBondContact O-N 3.29Å; V29-Y32 PolarHBondContact O-N 3.29Å; V29-R33 WeakPolarHBondContact O-CB 3.5Å; V29-R33 PolarHBondContact O-N 2.92Å
30	E	78.9	Confident	77.9	Confident	120 Å²	120	114.7 Å²	114.7	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-66.5	-35.2	-179.8	-153.9	-177.6	153.5	0	0	111.7	K28 R33 R34	K28-E30 VanDerWaalsContact C-N 3.3Å; K28-E30 PolarHBondContact O-N 2.9Å; E30-R33 PolarHBondContact O-N 3Å; E30-R34 WeakPolarHBondContact O-CB 3.45Å; E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.33Å; E30-R34 PolarHBondContact O-N 3.44Å; E30-R34 IonicContact OE1-CZ 2.83Å; E30-R34 IonicContact OE1-NE 2.94Å; E30-R34 IonicContact OE1-NH2 2.97Å; E30-R34 PolarHBondContact OE1-NH2 3.35Å
31	Q	79.9	Confident	78.4	Confident	135 Å²	135	114.4 Å²	114.4	63%	0.631	54%	0.536	S	S	*	.	H	α-helix	trans	-66.7	-42.3	173.7	-164.8	-178.6	15.2	0	0	111.5	K28 V29 R34 R35	K28-Q31 WeakPolarHBondContact O-CB 3.31Å; K28-Q31 PolarHBondContact O-N 3.24Å; K28-Q31 VanDerWaalsContact O-N 3.13Å; V29-Q31 VanDerWaalsContact C-N 3.29Å; V29-Q31 PolarHBondContact O-N 3.29Å; Q31-R34 PolarHBondContact O-N 3.35Å; Q31-R35 WeakPolarHBondContact O-CB 3.27Å; Q31-R35 PolarHBondContact O-N 3.1Å
32	Y	80.9	Confident	79.1	Confident	73 Å²	73	109.4 Å²	109.4	29%	0.286	52%	0.518	S	S	.	.	H	α-helix	trans	-66.6	-39.9	174.9	-65.3	-40.3	0	0	0	112.6	M19 K28 V29 R34 R35 E36	M19-Y32 HydrophobicContact CB-CE2 4.5Å; K28-Y32 HydrophobicContact CB-CD2 4.4Å; K28-Y32 HydrophobicContact CB-CE2 3.98Å; K28-Y32 WeakPolarHBondContact O-CD2 3.31Å; K28-Y32 PolarHBondContact O-N 3.12Å; V29-Y32 PolarHBondContact O-N 3.29Å; Y32-R34 PolarHBondContact O-N 2.95Å; Y32-R35 WeakPolarHBondContact O-CB 3.46Å; Y32-R35 PolarHBondContact O-N 3.29Å; Y32-R35 VanDerWaalsContact O-N 3.13Å; Y32-E36 PolarHBondContact O-N 3.41Å
33	R	81.3	Confident	79.8	Confident	196 Å²	196	104.2 Å²	104.2	74%	0.74	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-42.6	174.9	-168.6	177.3	179	179.3	-0.2	111.2	V29 E30 R35 E36 A37	V29-R33 WeakPolarHBondContact O-CB 3.5Å; V29-R33 PolarHBondContact O-N 2.92Å; E30-R33 PolarHBondContact O-N 3Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R33-E36 PolarHBondContact O-N 3.45Å; R33-A37 WeakPolarHBondContact O-CB 3.4Å; R33-A37 PolarHBondContact O-N 2.98Å
34	R	83	Confident	80.7	Confident	144 Å²	144	103.8 Å²	103.8	54%	0.543	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-38.7	172.8	-72.1	176.1	-168.7	-175.4	5.8	111.7	E30 Q31 Y32 R38	E30-R34 WeakPolarHBondContact O-CB 3.45Å; E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.33Å; E30-R34 PolarHBondContact O-N 3.44Å; E30-R34 IonicContact OE1-CZ 2.83Å; E30-R34 IonicContact OE1-NE 2.94Å; E30-R34 IonicContact OE1-NH2 2.97Å; E30-R34 PolarHBondContact OE1-NH2 3.35Å; Q31-R34 PolarHBondContact O-N 3.35Å; Y32-R34 PolarHBondContact O-N 2.95Å; R34-R38 VanDerWaalsContact O-CG 3.28Å; R34-R38 WeakPolarHBondContact O-CG 3.48Å; R34-R38 PolarHBondContact O-N 2.82Å
35	R	81.9	Confident	81.5	Confident	140 Å²	140	101.4 Å²	101.4	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-46.9	176.9	-172.3	-178.7	-176.4	-174.1	1.5	112.1	Q31 Y32 R33 R38 K39	Q31-R35 WeakPolarHBondContact O-CB 3.27Å; Q31-R35 PolarHBondContact O-N 3.1Å; Y32-R35 WeakPolarHBondContact O-CB 3.46Å; Y32-R35 PolarHBondContact O-N 3.29Å; Y32-R35 VanDerWaalsContact O-N 3.13Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R35-R38 PolarHBondContact O-N 3.09Å; R35-K39 PolarHBondContact O-N 2.78Å
36	E	83.6	Confident	82.2	Confident	79 Å²	79	106.6 Å²	106.6	37%	0.369	51%	0.506	S	S	.	.	H	α-helix	trans	-71.3	-34.6	178.4	-68.9	-53.6	133.8	0	0	112	Y32 R33 R38 K39 K40	Y32-E36 PolarHBondContact O-N 3.41Å; R33-E36 PolarHBondContact O-N 3.45Å; E36-R38 PolarHBondContact O-N 3.27Å; E36-K39 PolarHBondContact O-N 3.4Å; E36-K39 IonicContact OE1-NZ 3.5Å; E36-K39 PolarHBondContact OE1-NZ 2.75Å; E36-K40 WeakPolarHBondContact O-CB 3.46Å; E36-K40 PolarHBondContact O-N 3.37Å
37	A	85	Confident	82.9	Confident	58 Å²	58	106.5 Å²	106.5	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-42.2	170.8	0	0	0	0	0	112	R33 K40 A41	R33-A37 WeakPolarHBondContact O-CB 3.4Å; R33-A37 PolarHBondContact O-N 2.98Å; A37-K40 PolarHBondContact O-N 2.83Å; A37-A41 WeakPolarHBondContact O-CB 3.34Å; A37-A41 PolarHBondContact O-N 3.38Å
38	R	84.4	Confident	83.7	Confident	184 Å²	184	106.8 Å²	106.8	69%	0.694	50%	0.499	S	S	*	.	H	α-helix	trans	-64.4	-41	173.8	-73.2	178.2	-155.1	175.1	4.3	112.2	R34 R35 E36 A41 S42	R34-R38 VanDerWaalsContact O-CG 3.28Å; R34-R38 WeakPolarHBondContact O-CG 3.48Å; R34-R38 PolarHBondContact O-N 2.82Å; R35-R38 PolarHBondContact O-N 3.09Å; E36-R38 PolarHBondContact O-N 3.27Å; R38-A41 PolarHBondContact O-N 3.48Å; R38-S42 WeakPolarHBondContact O-CB 3.49Å; R38-S42 PolarHBondContact O-N 2.94Å
39	K	83.8	Confident	84.3	Confident	71 Å²	71	104.7 Å²	104.7	31%	0.309	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-45.7	175.4	-75.6	-178.5	-172.1	164.6	0	111.5	R35 E36 S42 V43	R35-K39 PolarHBondContact O-N 2.78Å; E36-K39 PolarHBondContact O-N 3.4Å; E36-K39 IonicContact OE1-NZ 3.5Å; E36-K39 PolarHBondContact OE1-NZ 2.75Å; K39-S42 PolarHBondContact O-N 3.31Å; K39-V43 WeakPolarHBondContact O-CG2 3.43Å; K39-V43 PolarHBondContact O-N 3.49Å
40	K	86.8	Confident	84.6	Confident	133 Å²	133	104.7 Å²	104.7	58%	0.578	51%	0.507	S	S	*	.	H	α-helix	trans	-57.9	-49.7	175.3	-179.6	177.4	171.7	178.6	0	110.9	E36 A37 S42 V43 E44	E36-K40 WeakPolarHBondContact O-CB 3.46Å; E36-K40 PolarHBondContact O-N 3.37Å; A37-K40 PolarHBondContact O-N 2.83Å; K40-S42 VanDerWaalsContact C-N 3.31Å; K40-S42 PolarHBondContact O-N 2.64Å; K40-V43 PolarHBondContact O-N 2.9Å; K40-E44 WeakPolarHBondContact CE-OE1 3.13Å; K40-E44 HydrophobicContact CG-CG 4.4Å; K40-E44 IonicContact NZ-OE1 2.93Å; K40-E44 WeakPolarHBondContact O-CB 3.35Å; K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.42Å
41	A	85.4	Confident	85.1	Confident	54 Å²	54	103.2 Å²	103.2	45%	0.446	50%	0.503	S	S	.	.	H	α-helix	trans	-60.4	-39.3	177	0	0	0	0	0	112.4	A37 R38 A45	A37-A41 WeakPolarHBondContact O-CB 3.34Å; A37-A41 PolarHBondContact O-N 3.38Å; R38-A41 PolarHBondContact O-N 3.48Å; A41-A45 VanDerWaalsContact O-CB 3.25Å; A41-A45 WeakPolarHBondContact O-CB 3.3Å; A41-A45 PolarHBondContact O-N 2.88Å
42	S	87.1	Confident	85.5	Confident	49 Å²	49	101.6 Å²	101.6	34%	0.343	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-41.1	175.4	-180	0	0	0	0	112.7	R38 K39 K40 R46	R38-S42 WeakPolarHBondContact O-CB 3.49Å; R38-S42 PolarHBondContact O-N 2.94Å; K39-S42 PolarHBondContact O-N 3.31Å; K40-S42 VanDerWaalsContact C-N 3.31Å; K40-S42 PolarHBondContact O-N 2.64Å; S42-R46 WeakPolarHBondContact O-CB 3.39Å; S42-R46 PolarHBondContact O-N 3.26Å; S42-R46 PolarHBondContact O-NE 3.19Å; S42-R46 PolarHBondContact OG-NH2 2.92Å
43	V	86.6	Confident	85.8	Confident	75 Å²	75	101.8 Å²	101.8	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-68.2	-46.6	176.6	172.4	0	0	0	0	110	K39 K40 A45 R46 L47	K39-V43 WeakPolarHBondContact O-CG2 3.43Å; K39-V43 PolarHBondContact O-N 3.49Å; K40-V43 PolarHBondContact O-N 2.9Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 3.02Å; V43-R46 PolarHBondContact O-N 3.42Å; V43-L47 HydrophobicContact CG1-CD1 4.5Å; V43-L47 WeakPolarHBondContact O-CB 3.36Å; V43-L47 PolarHBondContact O-N 2.86Å
44	E	87.1	Confident	86.1	Confident	95 Å²	95	98.9 Å²	98.9	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-60	-40.8	176.1	-77.1	179.3	175.5	0	0	112.2	K40 L47 K48	K40-E44 WeakPolarHBondContact CE-OE1 3.13Å; K40-E44 HydrophobicContact CG-CG 4.4Å; K40-E44 IonicContact NZ-OE1 2.93Å; K40-E44 WeakPolarHBondContact O-CB 3.35Å; K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.42Å; E44-L47 PolarHBondContact O-N 3.19Å; E44-K48 WeakPolarHBondContact O-CB 3.35Å; E44-K48 WeakPolarHBondContact O-CG 3.39Å; E44-K48 PolarHBondContact O-N 2.81Å
45	A	86.3	Confident	86.5	Confident	58 Å²	58	96.9 Å²	96.9	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-44	175.2	0	0	0	0	0	111.7	A41 V43 K48 A49	A41-A45 VanDerWaalsContact O-CB 3.25Å; A41-A45 WeakPolarHBondContact O-CB 3.3Å; A41-A45 PolarHBondContact O-N 2.88Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 3.02Å; A45-K48 PolarHBondContact O-N 3.41Å; A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 2.86Å
46	R	86	Confident	86.8	Confident	165 Å²	165	93.4 Å²	93.4	62%	0.623	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-40.8	174.8	-87.5	-177.7	-90.3	163	-11.5	112.3	S42 V43 A49 A50	S42-R46 WeakPolarHBondContact O-CB 3.39Å; S42-R46 PolarHBondContact O-N 3.26Å; S42-R46 PolarHBondContact O-NE 3.19Å; S42-R46 PolarHBondContact OG-NH2 2.92Å; V43-R46 PolarHBondContact O-N 3.42Å; R46-A49 PolarHBondContact O-N 3.24Å; R46-A50 VanDerWaalsContact O-CB 3.32Å; R46-A50 WeakPolarHBondContact O-CB 2.88Å; R46-A50 PolarHBondContact O-N 3.24Å
47	L	87.3	Confident	87	Confident	97 Å²	97	91.8 Å²	91.8	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-68.6	-41.8	179.7	-132.7	153.5	0	0	0	111	V43 E44 A50 I51	V43-L47 HydrophobicContact CG1-CD1 4.5Å; V43-L47 WeakPolarHBondContact O-CB 3.36Å; V43-L47 PolarHBondContact O-N 2.86Å; E44-L47 PolarHBondContact O-N 3.19Å; L47-A50 PolarHBondContact O-N 3.01Å; L47-I51 HydrophobicContact CD2-CD1 3.46Å; L47-I51 VanDerWaalsContact CD2-CD1 3.46Å; L47-I51 HydrophobicContact CD2-CG1 4.04Å; L47-I51 WeakPolarHBondContact O-CB 3.33Å; L47-I51 VanDerWaalsContact O-CG1 3.31Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 3.43Å
48	K	88.4	Confident	87.2	Confident	155 Å²	155	93.1 Å²	93.1	67%	0.674	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-45.5	171.9	-78.7	-178.6	178.8	-179.2	0	111.9	E44 A45 A50 I51 Q52	E44-K48 WeakPolarHBondContact O-CB 3.35Å; E44-K48 WeakPolarHBondContact O-CG 3.39Å; E44-K48 PolarHBondContact O-N 2.81Å; A45-K48 PolarHBondContact O-N 3.41Å; K48-A50 PolarHBondContact O-N 3.39Å; K48-I51 PolarHBondContact O-N 3Å; K48-Q52 WeakPolarHBondContact O-CB 3.43Å; K48-Q52 PolarHBondContact O-N 3.16Å
49	A	87.1	Confident	87.5	Confident	62 Å²	62	92.8 Å²	92.8	51%	0.512	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-41.8	177.1	0	0	0	0	0	111.9	A45 R46 S53	A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 2.86Å; R46-A49 PolarHBondContact O-N 3.24Å; A49-S53 VanDerWaalsContact O-CB 3.26Å; A49-S53 WeakPolarHBondContact O-CB 3.48Å; A49-S53 PolarHBondContact O-N 3.06Å
50	A	86.4	Confident	87.7	Confident	55 Å²	55	92.9 Å²	92.9	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-44.8	177.1	0	0	0	0	0	112.3	R46 L47 K48 S53 Q54	R46-A50 VanDerWaalsContact O-CB 3.32Å; R46-A50 WeakPolarHBondContact O-CB 2.88Å; R46-A50 PolarHBondContact O-N 3.24Å; L47-A50 PolarHBondContact O-N 3.01Å; K48-A50 PolarHBondContact O-N 3.39Å; A50-S53 PolarHBondContact O-N 2.74Å; A50-Q54 WeakPolarHBondContact O-CG 3.46Å; A50-Q54 PolarHBondContact O-N 2.94Å
51	I	87.8	Confident	87.8	Confident	90 Å²	90	88 Å²	88	46%	0.462	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.3	-73.4	171.9	0	0	0	110.5	L47 K48 Q54 L55	L47-I51 HydrophobicContact CD2-CD1 3.46Å; L47-I51 VanDerWaalsContact CD2-CD1 3.46Å; L47-I51 HydrophobicContact CD2-CG1 4.04Å; L47-I51 WeakPolarHBondContact O-CB 3.33Å; L47-I51 VanDerWaalsContact O-CG1 3.31Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 3.43Å; K48-I51 PolarHBondContact O-N 3Å; I51-Q54 PolarHBondContact O-N 2.99Å; I51-L55 HydrophobicContact CG2-CD1 3.86Å; I51-L55 WeakPolarHBondContact O-CB 3.44Å; I51-L55 PolarHBondContact O-N 3.23Å
52	Q	88.7	Confident	88.1	Confident	100 Å²	100	91.1 Å²	91.1	47%	0.467	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-45.1	177.7	-172.6	61.4	37.7	0	0	110.9	K48 Q54 L55 D56	K48-Q52 WeakPolarHBondContact O-CB 3.43Å; K48-Q52 PolarHBondContact O-N 3.16Å; Q52-Q54 VanDerWaalsContact C-N 3.35Å; Q52-Q54 PolarHBondContact O-N 3.34Å; Q52-L55 PolarHBondContact O-N 2.95Å; Q52-D56 PolarHBondContact NE2-OD1 3.33Å; Q52-D56 VanDerWaalsContact NE2-OD1 3.11Å; Q52-D56 PolarHBondContact NE2-OD2 3.13Å; Q52-D56 WeakPolarHBondContact O-CB 3.38Å; Q52-D56 VanDerWaalsContact O-CG 3.28Å; Q52-D56 PolarHBondContact O-N 2.87Å
53	S	88.3	Confident	88.3	Confident	78 Å²	78	92.4 Å²	92.4	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-42.1	175.7	-178.7	0	0	0	0	112.6	A49 A50 G57	A49-S53 VanDerWaalsContact O-CB 3.26Å; A49-S53 WeakPolarHBondContact O-CB 3.48Å; A49-S53 PolarHBondContact O-N 3.06Å; A50-S53 PolarHBondContact O-N 2.74Å; S53-G57 PolarHBondContact O-N 2.82Å
54	Q	87.8	Confident	88.4	Confident	135 Å²	135	95 Å²	95	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-68.2	-42.2	175.9	-71.7	-65.2	-32.2	0	0	112.1	A50 I51 Q52 G57 V58	A50-Q54 WeakPolarHBondContact O-CG 3.46Å; A50-Q54 PolarHBondContact O-N 2.94Å; I51-Q54 PolarHBondContact O-N 2.99Å; Q52-Q54 VanDerWaalsContact C-N 3.35Å; Q52-Q54 PolarHBondContact O-N 3.34Å; Q54-G57 PolarHBondContact O-N 3.13Å; Q54-V58 WeakPolarHBondContact O-CB 3.4Å; Q54-V58 VanDerWaalsContact O-CG2 3.3Å; Q54-V58 WeakPolarHBondContact O-CG2 3.46Å; Q54-V58 PolarHBondContact O-N 3.2Å
55	L	89.8	Confident	88.6	Confident	102 Å²	102	96.3 Å²	96.3	53%	0.534	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-42.9	176	-94.3	161.9	0	0	0	112.1	I51 Q52 G57 V58 R59	I51-L55 HydrophobicContact CG2-CD1 3.86Å; I51-L55 WeakPolarHBondContact O-CB 3.44Å; I51-L55 PolarHBondContact O-N 3.23Å; Q52-L55 PolarHBondContact O-N 2.95Å; L55-G57 VanDerWaalsContact C-N 3.35Å; L55-V58 PolarHBondContact O-N 3.13Å; L55-R59 WeakPolarHBondContact O-CB 3.46Å; L55-R59 PolarHBondContact O-N 3.16Å
56	D	88.7	Confident	88.8	Confident	67 Å²	67	99.1 Å²	99.1	36%	0.358	53%	0.527	S	S	.	.	H	α-helix	trans	-67.5	-37.8	177	-71.3	-28	0	0	0	110.9	Q52 T60	Q52-D56 PolarHBondContact NE2-OD1 3.33Å; Q52-D56 VanDerWaalsContact NE2-OD1 3.11Å; Q52-D56 PolarHBondContact NE2-OD2 3.13Å; Q52-D56 WeakPolarHBondContact O-CB 3.38Å; Q52-D56 VanDerWaalsContact O-CG 3.28Å; Q52-D56 PolarHBondContact O-N 2.87Å; D56-T60 VanDerWaalsContact O-CB 3.24Å; D56-T60 WeakPolarHBondContact O-CB 3.5Å; D56-T60 PolarHBondContact O-N 3.22Å; D56-T60 PolarHBondContact O-OG1 3.44Å
57	G	88.9	Confident	89.1	Confident	45 Å²	45	94.4 Å²	94.4	46%	0.464	52%	0.516	S	S	.	.	H	α-helix	trans	-61.6	-48.3	172	0	0	0	0	0	112.5	S53 Q54 L55 T60 G61	S53-G57 PolarHBondContact O-N 2.82Å; Q54-G57 PolarHBondContact O-N 3.13Å; L55-G57 VanDerWaalsContact C-N 3.35Å; G57-T60 PolarHBondContact O-N 3.33Å; G57-G61 PolarHBondContact O-N 3.3Å
58	V	88.3	Confident	89.2	Confident	85 Å²	85	92.1 Å²	92.1	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-45.2	177	170.4	0	0	0	0	110.9	Q54 L55 G61 L62	Q54-V58 WeakPolarHBondContact O-CB 3.4Å; Q54-V58 VanDerWaalsContact O-CG2 3.3Å; Q54-V58 WeakPolarHBondContact O-CG2 3.46Å; Q54-V58 PolarHBondContact O-N 3.2Å; L55-V58 PolarHBondContact O-N 3.13Å; V58-G61 PolarHBondContact O-N 3.45Å; V58-L62 HydrophobicContact CG1-CD1 4.31Å; V58-L62 WeakPolarHBondContact O-CB 3.43Å; V58-L62 PolarHBondContact O-N 2.97Å
59	R	90.1	Very high	89.4	Confident	178 Å²	178	88.9 Å²	88.9	67%	0.672	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-45.8	178.1	177.6	-178.8	162.9	177	-4	111.4	L55 L62 T63	L55-R59 WeakPolarHBondContact O-CB 3.46Å; L55-R59 PolarHBondContact O-N 3.16Å; R59-L62 PolarHBondContact O-N 3.45Å; R59-T63 WeakPolarHBondContact O-CB 3.28Å; R59-T63 PolarHBondContact O-N 3.49Å; R59-T63 PolarHBondContact O-OG1 3.3Å
60	T	89.1	Confident	89.6	Confident	73 Å²	73	89.7 Å²	89.7	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-45.5	177.1	-55.7	0	0	0	0	110.3	D56 G57 L62 T63 Q64	D56-T60 VanDerWaalsContact O-CB 3.24Å; D56-T60 WeakPolarHBondContact O-CB 3.5Å; D56-T60 PolarHBondContact O-N 3.22Å; D56-T60 PolarHBondContact O-OG1 3.44Å; G57-T60 PolarHBondContact O-N 3.33Å; T60-L62 PolarHBondContact O-N 2.86Å; T60-T63 PolarHBondContact O-N 3.39Å; T60-Q64 HydrophobicContact CG2-CG 4.45Å; T60-Q64 WeakPolarHBondContact O-CB 3.36Å; T60-Q64 WeakPolarHBondContact O-CG 3.41Å; T60-Q64 PolarHBondContact O-N 3Å
61	G	89.3	Confident	89.8	Confident	30 Å²	30	91.1 Å²	91.1	31%	0.309	50%	0.496	S	S	.	.	H	α-helix	trans	-58.5	-47.1	175.9	0	0	0	0	0	112.6	G57 V58 T63 Q64 L65	G57-G61 PolarHBondContact O-N 3.3Å; V58-G61 PolarHBondContact O-N 3.45Å; G61-T63 VanDerWaalsContact C-N 3.34Å; G61-T63 PolarHBondContact O-N 3.45Å; G61-Q64 PolarHBondContact O-N 3.28Å; G61-L65 WeakPolarHBondContact O-CB 3.41Å; G61-L65 PolarHBondContact O-N 3.41Å
62	L	90.6	Very high	89.9	Confident	119 Å²	119	91.1 Å²	91.1	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-40.4	177.1	-116.8	153	0	0	0	112.2	V58 R59 T60 L65 H66	V58-L62 HydrophobicContact CG1-CD1 4.31Å; V58-L62 WeakPolarHBondContact O-CB 3.43Å; V58-L62 PolarHBondContact O-N 2.97Å; R59-L62 PolarHBondContact O-N 3.45Å; T60-L62 PolarHBondContact O-N 2.86Å; L62-L65 PolarHBondContact O-N 3.1Å; L62-H66 WeakPolarHBondContact O-CB 3.4Å; L62-H66 PolarHBondContact O-N 3.28Å
63	T	91.2	Very high	90	Very high	77 Å²	77	92.2 Å²	92.2	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-47	177.6	-49.7	0	0	0	0	110.1	R59 T60 G61 L65 H66 T67	R59-T63 WeakPolarHBondContact O-CB 3.28Å; R59-T63 PolarHBondContact O-N 3.49Å; R59-T63 PolarHBondContact O-OG1 3.3Å; T60-T63 PolarHBondContact O-N 3.39Å; G61-T63 VanDerWaalsContact C-N 3.34Å; G61-T63 PolarHBondContact O-N 3.45Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-L65 PolarHBondContact O-N 3.14Å; T63-H66 PolarHBondContact O-N 2.86Å; T63-T67 PolarHBondContact O-N 2.98Å; T63-T67 PolarHBondContact O-OG1 3.31Å
64	Q	89.9	Confident	90.1	Very high	129 Å²	129	93.1 Å²	93.1	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-61.6	-40.7	176.7	-73.7	175.4	-10.7	0	0	112.3	T60 G61 H66 T67 A68	T60-Q64 HydrophobicContact CG2-CG 4.45Å; T60-Q64 WeakPolarHBondContact O-CB 3.36Å; T60-Q64 WeakPolarHBondContact O-CG 3.41Å; T60-Q64 PolarHBondContact O-N 3Å; G61-Q64 PolarHBondContact O-N 3.28Å; Q64-H66 VanDerWaalsContact C-N 3.34Å; Q64-T67 PolarHBondContact O-N 2.97Å; Q64-A68 VanDerWaalsContact O-CB 3.31Å; Q64-A68 WeakPolarHBondContact O-CB 3.27Å; Q64-A68 PolarHBondContact O-N 3.36Å
65	L	90.3	Very high	90.2	Very high	123 Å²	123	92.1 Å²	92.1	64%	0.644	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-38.5	178.1	-134.1	155.2	0	0	0	111.3	G61 L62 T63 L69	G61-L65 WeakPolarHBondContact O-CB 3.41Å; G61-L65 PolarHBondContact O-N 3.41Å; L62-L65 PolarHBondContact O-N 3.1Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-L65 PolarHBondContact O-N 3.14Å; L65-L69 WeakPolarHBondContact O-CB 3.22Å; L65-L69 PolarHBondContact O-N 2.82Å
66	H	91.8	Very high	90.2	Very high	117 Å²	117	93.7 Å²	93.7	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-66	-45.9	174.8	-168.8	71.6	0	0	0	111.8	L62 T63 Q64 L69 L70	L62-H66 WeakPolarHBondContact O-CB 3.4Å; L62-H66 PolarHBondContact O-N 3.28Å; T63-H66 PolarHBondContact O-N 2.86Å; Q64-H66 VanDerWaalsContact C-N 3.34Å; H66-L69 PolarHBondContact O-N 3.14Å; H66-L70 PolarHBondContact O-N 3.07Å
67	T	91	Very high	90.2	Very high	66 Å²	66	93.3 Å²	93.3	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-47.9	175.4	-53.9	0	0	0	0	111.1	T63 Q64 L69 L70 D71	T63-T67 PolarHBondContact O-N 2.98Å; T63-T67 PolarHBondContact O-OG1 3.31Å; Q64-T67 PolarHBondContact O-N 2.97Å; T67-L69 PolarHBondContact O-N 2.82Å; T67-L70 WeakPolarHBondContact O-CB 3.17Å; T67-L70 PolarHBondContact O-N 2.93Å; T67-L70 VanDerWaalsContact O-N 3.08Å; T67-D71 VanDerWaalsContact O-CG 3.27Å; T67-D71 PolarHBondContact O-N 3.45Å
68	A	89.3	Confident	90.2	Very high	49 Å²	49	94.1 Å²	94.1	41%	0.405	51%	0.506	S	S	.	.	H	α-helix	trans	-59.7	-35.8	178	0	0	0	0	0	112.4	Q64 V72	Q64-A68 VanDerWaalsContact O-CB 3.31Å; Q64-A68 WeakPolarHBondContact O-CB 3.27Å; Q64-A68 PolarHBondContact O-N 3.36Å; A68-V72 WeakPolarHBondContact O-CB 3.34Å; A68-V72 WeakPolarHBondContact O-CG2 3.36Å; A68-V72 PolarHBondContact O-N 3.12Å
69	L	92.1	Very high	90.1	Very high	86 Å²	86	95.8 Å²	95.8	45%	0.45	51%	0.511	S	S	.	.	H	α-helix	trans	-70.1	-36.5	177	-168.9	143.6	0	0	0	112.4	L65 H66 T67 K73	L65-L69 WeakPolarHBondContact O-CB 3.22Å; L65-L69 PolarHBondContact O-N 2.82Å; H66-L69 PolarHBondContact O-N 3.14Å; T67-L69 PolarHBondContact O-N 2.82Å; L69-K73 HydrophobicContact CD2-CD 4.25Å; L69-K73 WeakPolarHBondContact O-CG 3.44Å; L69-K73 PolarHBondContact O-N 3.02Å
70	L	91.9	Very high	90	Very high	80 Å²	80	90 Å²	90	42%	0.419	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-48.4	171.7	-70.2	172.1	0	0	0	110.7	H66 T67 V72 K73 D74	H66-L70 PolarHBondContact O-N 3.07Å; T67-L70 WeakPolarHBondContact O-CB 3.17Å; T67-L70 PolarHBondContact O-N 2.93Å; T67-L70 VanDerWaalsContact O-N 3.08Å; L70-V72 VanDerWaalsContact C-N 3.3Å; L70-V72 PolarHBondContact O-N 3.14Å; L70-K73 WeakPolarHBondContact O-CB 3.42Å; L70-K73 PolarHBondContact O-N 3.15Å; L70-D74 PolarHBondContact O-N 3.44Å
71	D	90.9	Very high	89.9	Confident	84 Å²	84	90.9 Å²	90.9	45%	0.449	50%	0.503	S	S	.	.	H	α-helix	trans	-58.1	-42.4	178.5	-66.6	-17.5	0	0	0	111.5	T67 K73 D74 I75	T67-D71 VanDerWaalsContact O-CG 3.27Å; T67-D71 PolarHBondContact O-N 3.45Å; D71-K73 PolarHBondContact O-N 3.46Å; D71-D74 PolarHBondContact O-N 3.01Å; D71-I75 WeakPolarHBondContact O-CB 3.24Å; D71-I75 WeakPolarHBondContact O-CG1 3.49Å; D71-I75 PolarHBondContact O-N 2.7Å
72	V	89.9	Confident	89.7	Confident	90 Å²	90	93.7 Å²	93.7	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-41.2	176.7	167.5	0	0	0	0	111.4	A68 L70 I75 Q76	A68-V72 WeakPolarHBondContact O-CB 3.34Å; A68-V72 WeakPolarHBondContact O-CG2 3.36Å; A68-V72 PolarHBondContact O-N 3.12Å; L70-V72 VanDerWaalsContact C-N 3.3Å; L70-V72 PolarHBondContact O-N 3.14Å; V72-I75 PolarHBondContact O-N 3.07Å; V72-Q76 VanDerWaalsContact O-CB 3.26Å; V72-Q76 WeakPolarHBondContact O-CB 3.35Å; V72-Q76 PolarHBondContact O-N 2.71Å
73	K	90.9	Very high	89.4	Confident	123 Å²	123	90.6 Å²	90.6	54%	0.535	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.5	-78.9	-179.2	176.7	179.7	0	111.6	L69 L70 D71 Q76 S77	L69-K73 HydrophobicContact CD2-CD 4.25Å; L69-K73 WeakPolarHBondContact O-CG 3.44Å; L69-K73 PolarHBondContact O-N 3.02Å; L70-K73 WeakPolarHBondContact O-CB 3.42Å; L70-K73 PolarHBondContact O-N 3.15Å; D71-K73 PolarHBondContact O-N 3.46Å; K73-Q76 PolarHBondContact O-N 2.89Å; K73-S77 PolarHBondContact O-N 3.32Å
74	D	91.4	Very high	89	Confident	98 Å²	98	92.9 Å²	92.9	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-43.6	178.1	-76.1	-5.7	0	0	0	111.3	L70 D71 Q76 S77 S78	L70-D74 PolarHBondContact O-N 3.44Å; D71-D74 PolarHBondContact O-N 3.01Å; D74-Q76 VanDerWaalsContact C-N 3.34Å; D74-Q76 PolarHBondContact O-N 3.45Å; D74-S77 PolarHBondContact O-N 3.49Å; D74-S77 PolarHBondContact O-OG 2.78Å; D74-S78 WeakPolarHBondContact O-CB 3.49Å; D74-S78 PolarHBondContact O-N 2.56Å; D74-S78 PolarHBondContact O-OG 3.01Å
75	I	88.9	Confident	88.6	Confident	113 Å²	113	90.9 Å²	90.9	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-61.2	-43.4	173.3	-69.8	165.6	0	0	0	110.4	D71 V72 S77 S78 L79	D71-I75 WeakPolarHBondContact O-CB 3.24Å; D71-I75 WeakPolarHBondContact O-CG1 3.49Å; D71-I75 PolarHBondContact O-N 2.7Å; V72-I75 PolarHBondContact O-N 3.07Å; I75-S77 VanDerWaalsContact C-N 3.35Å; I75-S77 PolarHBondContact O-N 2.93Å; I75-S78 PolarHBondContact O-N 2.83Å; I75-L79 VanDerWaalsContact O-CB 3.29Å; I75-L79 WeakPolarHBondContact O-CB 3.27Å; I75-L79 PolarHBondContact O-N 3.45Å
76	Q	89.2	Confident	87.9	Confident	136 Å²	136	93 Å²	93	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-65.2	-40.1	-179.6	-163.1	174.9	18.3	0	0	111.6	V72 K73 D74 A80	V72-Q76 VanDerWaalsContact O-CB 3.26Å; V72-Q76 WeakPolarHBondContact O-CB 3.35Å; V72-Q76 PolarHBondContact O-N 2.71Å; K73-Q76 PolarHBondContact O-N 2.89Å; D74-Q76 VanDerWaalsContact C-N 3.34Å; D74-Q76 PolarHBondContact O-N 3.45Å; Q76-A80 WeakPolarHBondContact O-CB 3.42Å; Q76-A80 PolarHBondContact O-N 3.38Å
77	S	89.7	Confident	87.2	Confident	58 Å²	58	96.2 Å²	96.2	41%	0.406	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-41.9	174.2	78.1	0	0	0	0	111.9	K73 D74 I75 L79 A80 N81	K73-S77 PolarHBondContact O-N 3.32Å; D74-S77 PolarHBondContact O-N 3.49Å; D74-S77 PolarHBondContact O-OG 2.78Å; I75-S77 VanDerWaalsContact C-N 3.35Å; I75-S77 PolarHBondContact O-N 2.93Å; S77-L79 PolarHBondContact O-N 2.88Å; S77-A80 PolarHBondContact O-N 3.3Å; S77-N81 VanDerWaalsContact O-CG 3.28Å; S77-N81 PolarHBondContact O-N 2.95Å; S77-N81 PolarHBondContact O-ND2 3.38Å
78	S	88.5	Confident	86.4	Confident	63 Å²	63	98.8 Å²	98.8	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-42.6	176.4	-60.9	0	0	0	0	111.2	D74 I75 N81 V82	D74-S78 WeakPolarHBondContact O-CB 3.49Å; D74-S78 PolarHBondContact O-N 2.56Å; D74-S78 PolarHBondContact O-OG 3.01Å; I75-S78 PolarHBondContact O-N 2.83Å; S78-N81 PolarHBondContact O-N 3.46Å; S78-V82 VanDerWaalsContact O-CG2 3.31Å; S78-V82 WeakPolarHBondContact O-CG2 3.29Å; S78-V82 PolarHBondContact O-N 2.98Å
79	L	87.1	Confident	85.3	Confident	119 Å²	119	98.8 Å²	98.8	62%	0.623	51%	0.511	S	S	*	.	H	α-helix	trans	-67	-37.9	177.1	-168.5	70.7	0	0	0	111.6	I75 S77 V82 S83	I75-L79 VanDerWaalsContact O-CB 3.29Å; I75-L79 WeakPolarHBondContact O-CB 3.27Å; I75-L79 PolarHBondContact O-N 3.45Å; S77-L79 PolarHBondContact O-N 2.88Å; L79-V82 PolarHBondContact O-N 3.13Å; L79-S83 VanDerWaalsContact O-CB 3.3Å; L79-S83 WeakPolarHBondContact O-CB 3.38Å; L79-S83 PolarHBondContact O-N 3.09Å
80	A	86.9	Confident	83.9	Confident	57 Å²	57	98.5 Å²	98.5	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-41.1	173.5	0	0	0	0	0	111.6	Q76 S77 S83 K84	Q76-A80 WeakPolarHBondContact O-CB 3.42Å; Q76-A80 PolarHBondContact O-N 3.38Å; S77-A80 PolarHBondContact O-N 3.3Å; A80-S83 PolarHBondContact O-N 3.41Å; A80-K84 WeakPolarHBondContact O-CB 3.41Å; A80-K84 PolarHBondContact O-N 3.45Å
81	N	87.6	Confident	82.5	Confident	92 Å²	92	100.2 Å²	100.2	49%	0.492	52%	0.518	S	S	.	.	H	α-helix	trans	-64	-49	174.2	-70.1	-22.7	0	0	0	111.2	S77 S78 S83 K84 D85	S77-N81 VanDerWaalsContact O-CG 3.28Å; S77-N81 PolarHBondContact O-N 2.95Å; S77-N81 PolarHBondContact O-ND2 3.38Å; S78-N81 PolarHBondContact O-N 3.46Å; N81-S83 VanDerWaalsContact C-N 3.29Å; N81-S83 PolarHBondContact O-N 2.91Å; N81-K84 CarbonylContact O-C 3.56Å; N81-K84 WeakPolarHBondContact O-CA 3.35Å; N81-K84 WeakPolarHBondContact O-CB 3.47Å; N81-K84 PolarHBondContact O-N 3.38Å; N81-K84 VanDerWaalsContact O-N 3.07Å; N81-D85 WeakPolarHBondContact O-CB 3.35Å; N81-D85 VanDerWaalsContact O-CG 3.26Å; N81-D85 PolarHBondContact O-N 3.47Å
82	V	85.1	Confident	81.1	Confident	88 Å²	88	99.7 Å²	99.7	53%	0.533	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-41.1	175.6	170.7	0	0	0	0	111.3	S78 L79 K84 D85 W86	S78-V82 VanDerWaalsContact O-CG2 3.31Å; S78-V82 WeakPolarHBondContact O-CG2 3.29Å; S78-V82 PolarHBondContact O-N 2.98Å; L79-V82 PolarHBondContact O-N 3.13Å; V82-K84 VanDerWaalsContact C-N 3.34Å; V82-K84 PolarHBondContact O-N 3.13Å; V82-D85 PolarHBondContact O-N 3.14Å; V82-W86 WeakPolarHBondContact O-CB 3.43Å; V82-W86 PolarHBondContact O-N 3.06Å
83	S	82.9	Confident	79.7	Confident	55 Å²	55	99.5 Å²	99.5	39%	0.385	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-39.4	176.4	-170.3	0	0	0	0	112	L79 A80 N81 R87	L79-S83 VanDerWaalsContact O-CB 3.3Å; L79-S83 WeakPolarHBondContact O-CB 3.38Å; L79-S83 PolarHBondContact O-N 3.09Å; A80-S83 PolarHBondContact O-N 3.41Å; N81-S83 VanDerWaalsContact C-N 3.29Å; N81-S83 PolarHBondContact O-N 2.91Å; S83-R87 WeakPolarHBondContact O-CB 3.49Å; S83-R87 VanDerWaalsContact O-CG 3.31Å; S83-R87 WeakPolarHBondContact O-CG 3.48Å; S83-R87 PolarHBondContact O-N 2.89Å
84	K	84	Confident	78.4	Confident	124 Å²	124	100.9 Å²	100.9	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-66.2	-47.4	175.1	-175.6	-175.3	175.8	-171.8	0	111.3	A80 N81 V82 W86 R87 Q88	A80-K84 WeakPolarHBondContact O-CB 3.41Å; A80-K84 PolarHBondContact O-N 3.45Å; N81-K84 CarbonylContact O-C 3.56Å; N81-K84 WeakPolarHBondContact O-CA 3.35Å; N81-K84 WeakPolarHBondContact O-CB 3.47Å; N81-K84 PolarHBondContact O-N 3.38Å; N81-K84 VanDerWaalsContact O-N 3.07Å; V82-K84 VanDerWaalsContact C-N 3.34Å; V82-K84 PolarHBondContact O-N 3.13Å; K84-W86 VanDerWaalsContact C-N 3.32Å; K84-W86 PolarHBondContact O-N 3.34Å; K84-R87 PolarHBondContact O-N 3.39Å; K84-Q88 WeakPolarHBondContact O-CG 3.43Å; K84-Q88 PolarHBondContact O-N 3.04Å
85	D	81.9	Confident	77.1	Confident	87 Å²	87	102.4 Å²	102.4	47%	0.465	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-39.5	178.3	-67	-13.6	0	0	0	111	N81 V82 Q88 S89	N81-D85 WeakPolarHBondContact O-CB 3.35Å; N81-D85 VanDerWaalsContact O-CG 3.26Å; N81-D85 PolarHBondContact O-N 3.47Å; V82-D85 PolarHBondContact O-N 3.14Å; D85-Q88 PolarHBondContact O-N 3.44Å; D85-S89 VanDerWaalsContact O-CB 3.24Å; D85-S89 WeakPolarHBondContact O-CB 2.89Å; D85-S89 PolarHBondContact O-N 2.73Å; D85-S89 PolarHBondContact O-OG 3.21Å
86	W	75.7	Confident	76	Confident	169 Å²	169	101.2 Å²	101.2	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-46.9	173.8	-173.8	-91.1	0	0	0	111.5	V82 K84 Q88 S89 I90	V82-W86 WeakPolarHBondContact O-CB 3.43Å; V82-W86 PolarHBondContact O-N 3.06Å; K84-W86 VanDerWaalsContact C-N 3.32Å; K84-W86 PolarHBondContact O-N 3.34Å; W86-Q88 VanDerWaalsContact C-N 3.32Å; W86-Q88 PolarHBondContact O-N 3.31Å; W86-S89 CarbonylContact O-C 3.58Å; W86-S89 PolarHBondContact O-N 3.49Å; W86-S89 VanDerWaalsContact O-N 3.1Å; W86-I90 WeakPolarHBondContact O-CG1 3.09Å; W86-I90 PolarHBondContact O-N 2.81Å
87	R	76.1	Confident	75.1	Confident	184 Å²	184	101.2 Å²	101.2	69%	0.694	52%	0.522	S	S	*	.	H	α-helix	trans	-62.4	-38	176.2	-75.1	177.9	-174.8	-165.9	2	112.5	S83 K84 S89	S83-R87 WeakPolarHBondContact O-CB 3.49Å; S83-R87 VanDerWaalsContact O-CG 3.31Å; S83-R87 WeakPolarHBondContact O-CG 3.48Å; S83-R87 PolarHBondContact O-N 2.89Å; K84-R87 PolarHBondContact O-N 3.39Å; R87-S89 VanDerWaalsContact C-N 3.34Å
88	Q	74.9	Confident	74.3	Confident	120 Å²	120	104.6 Å²	104.6	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-69.1	-34.5	173.4	-72.5	-177.5	-14.9	0	0	111.8	K84 D85 W86 I90 N91	K84-Q88 WeakPolarHBondContact O-CG 3.43Å; K84-Q88 PolarHBondContact O-N 3.04Å; D85-Q88 PolarHBondContact O-N 3.44Å; W86-Q88 VanDerWaalsContact C-N 3.32Å; W86-Q88 PolarHBondContact O-N 3.31Å; Q88-I90 VanDerWaalsContact C-N 3.34Å; Q88-N91 PolarHBondContact O-N 3.11Å
89	S	64.9	Low	73.7	Confident	48 Å²	48	105.5 Å²	105.5	34%	0.336	54%	0.539	S	S	.	.	H	α-helix	trans	-72.7	-23.3	177.9	-60.7	0	0	0	0	113.5	D85 W86 R87 N91 T92 I93	D85-S89 VanDerWaalsContact O-CB 3.24Å; D85-S89 WeakPolarHBondContact O-CB 2.89Å; D85-S89 PolarHBondContact O-N 2.73Å; D85-S89 PolarHBondContact O-OG 3.21Å; W86-S89 CarbonylContact O-C 3.58Å; W86-S89 PolarHBondContact O-N 3.49Å; W86-S89 VanDerWaalsContact O-N 3.1Å; R87-S89 VanDerWaalsContact C-N 3.34Å; S89-N91 PolarHBondContact O-N 3.45Å; S89-T92 VanDerWaalsContact CA-OG1 3.25Å; S89-T92 WeakPolarHBondContact CA-OG1 3.23Å; S89-T92 CarbonylContact O-C 3.6Å; S89-T92 PolarHBondContact O-N 3.17Å; S89-T92 PolarHBondContact O-OG1 2.94Å; S89-I93 VanDerWaalsContact O-CG1 3.26Å; S89-I93 WeakPolarHBondContact O-CG1 3.41Å; S89-I93 PolarHBondContact O-N 3.41Å
90	I	64	Low	73	Confident	81 Å²	81	106.7 Å²	106.7	42%	0.415	54%	0.539	S	S	.	.	H	α-helix	trans	-58	-37.8	173.9	-72.5	168.5	0	0	0	111	W86 Q88 T92 I93 E94	W86-I90 WeakPolarHBondContact O-CG1 3.09Å; W86-I90 PolarHBondContact O-N 2.81Å; Q88-I90 VanDerWaalsContact C-N 3.34Å; I90-T92 VanDerWaalsContact C-N 3.33Å; I90-T92 PolarHBondContact O-N 3.32Å; I90-I93 PolarHBondContact O-N 3.18Å; I90-E94 PolarHBondContact O-N 3.3Å
91	N	62.3	Low	72.5	Confident	115 Å²	115	107.5 Å²	107.5	62%	0.615	54%	0.535	S	S	*	.	H	α-helix	trans	-71	-24.7	175.4	-77.9	-4.8	0	0	0	113.3	Q88 S89	Q88-N91 PolarHBondContact O-N 3.11Å; S89-N91 PolarHBondContact O-N 3.45Å
92	T	62.1	Low	72.1	Confident	73 Å²	73	105.5 Å²	105.5	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-85.8	-23.6	172.2	44.3	0	0	0	0	112.9	S89 I90 E94 N95 L96	S89-T92 VanDerWaalsContact CA-OG1 3.25Å; S89-T92 WeakPolarHBondContact CA-OG1 3.23Å; S89-T92 CarbonylContact O-C 3.6Å; S89-T92 PolarHBondContact O-N 3.17Å; S89-T92 PolarHBondContact O-OG1 2.94Å; I90-T92 VanDerWaalsContact C-N 3.33Å; I90-T92 PolarHBondContact O-N 3.32Å; T92-E94 VanDerWaalsContact C-N 3.33Å; T92-E94 PolarHBondContact O-N 3.22Å; T92-N95 WeakPolarHBondContact O-CB 3.33Å; T92-N95 PolarHBondContact O-N 2.55Å; T92-N95 VanDerWaalsContact O-N 3.15Å; T92-L96 WeakPolarHBondContact O-CG 3.16Å; T92-L96 PolarHBondContact O-N 2.96Å
93	I	60.6	Low	71.8	Confident	87 Å²	87	105.7 Å²	105.7	45%	0.446	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-33.7	175.2	-72.1	165.3	0	0	0	111.6	S89 I90 N95 L96	S89-I93 VanDerWaalsContact O-CG1 3.26Å; S89-I93 WeakPolarHBondContact O-CG1 3.41Å; S89-I93 PolarHBondContact O-N 3.41Å; I90-I93 PolarHBondContact O-N 3.18Å; I93-N95 VanDerWaalsContact C-N 3.26Å; I93-N95 PolarHBondContact O-N 2.92Å; I93-L96 PolarHBondContact O-N 3.28Å; I93-L96 VanDerWaalsContact O-N 3.08Å
94	E	62	Low	71.5	Confident	152 Å²	152	106.1 Å²	106.1	71%	0.71	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-61	-36.2	171.6	-76.3	-172.1	156.2	0	0	112.2	I90 T92 L96	I90-E94 PolarHBondContact O-N 3.3Å; T92-E94 VanDerWaalsContact C-N 3.33Å; T92-E94 PolarHBondContact O-N 3.22Å; E94-L96 VanDerWaalsContact C-N 3.26Å; E94-L96 PolarHBondContact O-N 2.79Å
95	N	64.7	Low	71.2	Confident	130 Å²	130	106.1 Å²	106.1	70%	0.695	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-75.8	-10.9	175.7	-62.9	-29.8	0	0	0	113.4	T92 I93	T92-N95 WeakPolarHBondContact O-CB 3.33Å; T92-N95 PolarHBondContact O-N 2.55Å; T92-N95 VanDerWaalsContact O-N 3.15Å; I93-N95 VanDerWaalsContact C-N 3.26Å; I93-N95 PolarHBondContact O-N 2.92Å
96	L	65.8	Low	71.1	Confident	88 Å²	88	108.5 Å²	108.5	46%	0.461	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-98.7	11.9	178.7	-71.5	169.5	0	0	0	113	T92 I93 E94 D98 V99 K100	T92-L96 WeakPolarHBondContact O-CG 3.16Å; T92-L96 PolarHBondContact O-N 2.96Å; I93-L96 PolarHBondContact O-N 3.28Å; I93-L96 VanDerWaalsContact O-N 3.08Å; E94-L96 VanDerWaalsContact C-N 3.26Å; E94-L96 PolarHBondContact O-N 2.79Å; L96-D98 PolarHBondContact O-N 3.04Å; L96-V99 HydrophobicContact CD2-CB 4.19Å; L96-V99 HydrophobicContact CD2-CG2 3.79Å; L96-V99 PolarHBondContact O-N 3.21Å; L96-K100 PolarHBondContact O-N 3.46Å
97	K	70.5	Confident	71.1	Confident	135 Å²	135	102.9 Å²	102.9	59%	0.587	53%	0.529	S	S	*	.	H	α-helix	trans	-53.8	-42.3	177.1	-169.7	178.4	178.1	-175.4	0	112	V99 K100 D101	K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 2.96Å; K97-K100 WeakPolarHBondContact O-CB 3.39Å; K97-K100 PolarHBondContact O-N 3.48Å; K97-D101 WeakPolarHBondContact O-CB 3.31Å; K97-D101 VanDerWaalsContact O-CG 3.28Å; K97-D101 PolarHBondContact O-N 3.5Å
98	D	73.4	Confident	70.9	Confident	129 Å²	129	97.6 Å²	97.6	69%	0.69	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-35.8	178.1	-60.1	-23.6	0	0	0	112.4	L96 A102	L96-D98 PolarHBondContact O-N 3.04Å; D98-A102 VanDerWaalsContact O-CB 3.29Å; D98-A102 WeakPolarHBondContact O-CB 3.35Å; D98-A102 PolarHBondContact O-N 3.04Å
99	V	74.7	Confident	71	Confident	83 Å²	83	97.6 Å²	97.6	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-70.9	-39.8	175.4	178.7	0	0	0	0	110.6	L96 K97 A102 V103	L96-V99 HydrophobicContact CD2-CB 4.19Å; L96-V99 HydrophobicContact CD2-CG2 3.79Å; L96-V99 PolarHBondContact O-N 3.21Å; K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 2.96Å; V99-A102 PolarHBondContact O-N 3.09Å; V99-V103 HydrophobicContact CG1-CG2 4.41Å; V99-V103 WeakPolarHBondContact O-CB 3.35Å; V99-V103 VanDerWaalsContact O-CG2 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.26Å; V99-V103 PolarHBondContact O-N 3.45Å
100	K	72.6	Confident	71.6	Confident	144 Å²	144	97.6 Å²	97.6	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-45.4	173.9	-178	-175.2	174.8	-175.2	0	110.9	L96 K97 A102 V103 V104	L96-K100 PolarHBondContact O-N 3.46Å; K97-K100 WeakPolarHBondContact O-CB 3.39Å; K97-K100 PolarHBondContact O-N 3.48Å; K100-A102 VanDerWaalsContact C-N 3.35Å; K100-V103 PolarHBondContact O-N 2.6Å; K100-V104 VanDerWaalsContact O-CG2 3.29Å; K100-V104 WeakPolarHBondContact O-CG2 3.27Å; K100-V104 PolarHBondContact O-N 3.1Å
101	D	76.7	Confident	71.9	Confident	73 Å²	73	94.7 Å²	94.7	39%	0.39	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-40.2	178.7	-68.4	-14.1	0	0	0	110.7	K97 V104 Q105	K97-D101 WeakPolarHBondContact O-CB 3.31Å; K97-D101 VanDerWaalsContact O-CG 3.28Å; K97-D101 PolarHBondContact O-N 3.5Å; D101-V104 PolarHBondContact O-N 3.1Å; D101-Q105 WeakPolarHBondContact O-CG 3.49Å; D101-Q105 PolarHBondContact O-N 3.32Å
102	A	79.3	Confident	72.3	Confident	50 Å²	50	91.4 Å²	91.4	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-39.1	172.8	0	0	0	0	0	113.1	D98 V99 K100 Q105 H106	D98-A102 VanDerWaalsContact O-CB 3.29Å; D98-A102 WeakPolarHBondContact O-CB 3.35Å; D98-A102 PolarHBondContact O-N 3.04Å; V99-A102 PolarHBondContact O-N 3.09Å; K100-A102 VanDerWaalsContact C-N 3.35Å; A102-Q105 PolarHBondContact O-N 2.89Å; A102-H106 WeakPolarHBondContact O-CB 3.38Å; A102-H106 PolarHBondContact O-N 3.34Å
103	V	79.3	Confident	73	Confident	92 Å²	92	92.9 Å²	92.9	56%	0.558	50%	0.504	S	S	*	.	H	α-helix	trans	-66.9	-38.4	174.8	167.9	0	0	0	0	111	V99 K100 H106 S107	V99-V103 HydrophobicContact CG1-CG2 4.41Å; V99-V103 WeakPolarHBondContact O-CB 3.35Å; V99-V103 VanDerWaalsContact O-CG2 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.26Å; V99-V103 PolarHBondContact O-N 3.45Å; K100-V103 PolarHBondContact O-N 2.6Å; V103-H106 PolarHBondContact O-N 3.37Å; V103-S107 WeakPolarHBondContact O-CB 3.32Å; V103-S107 PolarHBondContact O-N 2.92Å
104	V	77.1	Confident	73.5	Confident	64 Å²	64	95.3 Å²	95.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-46.7	173.4	169.8	0	0	0	0	110.2	K100 D101 H106 S107 Q108	K100-V104 VanDerWaalsContact O-CG2 3.29Å; K100-V104 WeakPolarHBondContact O-CG2 3.27Å; K100-V104 PolarHBondContact O-N 3.1Å; D101-V104 PolarHBondContact O-N 3.1Å; V104-H106 PolarHBondContact O-N 3.35Å; V104-S107 PolarHBondContact O-N 3.5Å; V104-Q108 HydrophobicContact CG1-CG 4.46Å; V104-Q108 WeakPolarHBondContact O-CB 3.39Å; V104-Q108 VanDerWaalsContact O-CG 3.23Å; V104-Q108 WeakPolarHBondContact O-CG 3.35Å; V104-Q108 PolarHBondContact O-N 3.03Å
105	Q	76.7	Confident	73.9	Confident	124 Å²	124	89 Å²	89	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-61.9	-43.5	176	-73	176.9	1.7	0	0	112.3	D101 A102 Q108 L109	D101-Q105 WeakPolarHBondContact O-CG 3.49Å; D101-Q105 PolarHBondContact O-N 3.32Å; A102-Q105 PolarHBondContact O-N 2.89Å; Q105-Q108 WeakPolarHBondContact O-CB 3.3Å; Q105-Q108 PolarHBondContact O-N 2.89Å; Q105-L109 WeakPolarHBondContact O-CB 3.21Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.04Å
106	H	79.5	Confident	74.4	Confident	137 Å²	137	87 Å²	87	63%	0.634	47%	0.473	S	S	*	.	H	α-helix	trans	-66.5	-38.9	176.9	-170.3	-66.9	0	0	0	111.6	A102 V103 V104 Q108 L109 A110	A102-H106 WeakPolarHBondContact O-CB 3.38Å; A102-H106 PolarHBondContact O-N 3.34Å; V103-H106 PolarHBondContact O-N 3.37Å; V104-H106 PolarHBondContact O-N 3.35Å; H106-Q108 VanDerWaalsContact C-N 3.34Å; H106-L109 PolarHBondContact O-N 3.44Å; H106-A110 VanDerWaalsContact O-CB 3.23Å; H106-A110 WeakPolarHBondContact O-CB 3.32Å; H106-A110 PolarHBondContact O-N 3Å
107	S	75.8	Confident	74.7	Confident	51 Å²	51	90.5 Å²	90.5	36%	0.357	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-40.2	174.2	-179.9	0	0	0	0	111.5	V103 V104 A111	V103-S107 WeakPolarHBondContact O-CB 3.32Å; V103-S107 PolarHBondContact O-N 2.92Å; V104-S107 PolarHBondContact O-N 3.5Å; S107-A111 VanDerWaalsContact O-CB 3.31Å; S107-A111 WeakPolarHBondContact O-CB 3.42Å; S107-A111 PolarHBondContact O-N 3.16Å
108	Q	72.6	Confident	74.7	Confident	74 Å²	74	87 Å²	87	35%	0.346	47%	0.472	S	S	.	.	H	α-helix	trans	-64.6	-46.6	175.6	-75.6	168.5	-11.6	0	0	111.3	V104 Q105 H106 A111 A112 M162	V104-Q108 HydrophobicContact CG1-CG 4.46Å; V104-Q108 WeakPolarHBondContact O-CB 3.39Å; V104-Q108 VanDerWaalsContact O-CG 3.23Å; V104-Q108 WeakPolarHBondContact O-CG 3.35Å; V104-Q108 PolarHBondContact O-N 3.03Å; Q105-Q108 WeakPolarHBondContact O-CB 3.3Å; Q105-Q108 PolarHBondContact O-N 2.89Å; H106-Q108 VanDerWaalsContact C-N 3.34Å; Q108-A111 PolarHBondContact O-N 3.33Å; Q108-A112 WeakPolarHBondContact O-CB 3.16Å; Q108-A112 PolarHBondContact O-N 2.79Å; Q108-M162 HydrophobicContact CG-CE 3.62Å; Q108-M162 VanDerWaalsContact NE2-CE 3.27Å; Q108-M162 PolarHBondContact NE2-SD 3.45Å
109	L	76.3	Confident	74.7	Confident	119 Å²	119	83.2 Å²	83.2	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-64.8	-41.4	177.7	-74	168.1	0	0	0	111.8	Q105 H106 A112 V113	Q105-L109 WeakPolarHBondContact O-CB 3.21Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.04Å; H106-L109 PolarHBondContact O-N 3.44Å; L109-A112 PolarHBondContact O-N 3.03Å; L109-V113 VanDerWaalsContact O-CG2 3.28Å; L109-V113 WeakPolarHBondContact O-CG2 3.33Å; L109-V113 PolarHBondContact O-N 2.7Å
110	A	76.9	Confident	74.8	Confident	48 Å²	48	87 Å²	87	40%	0.397	46%	0.462	S	S	.	.	H	α-helix	trans	-62.2	-47.1	175.5	0	0	0	0	0	111.6	H106 A112 V113 E114	H106-A110 VanDerWaalsContact O-CB 3.23Å; H106-A110 WeakPolarHBondContact O-CB 3.32Å; H106-A110 PolarHBondContact O-N 3Å; A110-A112 VanDerWaalsContact C-N 3.32Å; A110-A112 PolarHBondContact O-N 3.06Å; A110-V113 PolarHBondContact O-N 2.94Å; A110-E114 WeakPolarHBondContact O-CB 3.31Å; A110-E114 PolarHBondContact O-N 3.1Å
111	A	70.3	Confident	75.2	Confident	20 Å²	20	82.2 Å²	82.2	17%	0.165	45%	0.447	C	S	.	.	H	α-helix	trans	-61.9	-39.7	175.2	0	0	0	0	0	111.8	S107 Q108 N115	S107-A111 VanDerWaalsContact O-CB 3.31Å; S107-A111 WeakPolarHBondContact O-CB 3.42Å; S107-A111 PolarHBondContact O-N 3.16Å; Q108-A111 PolarHBondContact O-N 3.33Å; A111-N115 VanDerWaalsContact O-CB 3.24Å; A111-N115 WeakPolarHBondContact O-CB 3.37Å; A111-N115 VanDerWaalsContact O-CG 3.29Å; A111-N115 PolarHBondContact O-N 3.14Å; A111-N115 PolarHBondContact O-ND2 3.2Å
112	A	71.4	Confident	75.5	Confident	47 Å²	47	79.1 Å²	79.1	39%	0.388	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-43.9	176.5	0	0	0	0	0	112	Q108 L109 A110 L116	Q108-A112 WeakPolarHBondContact O-CB 3.16Å; Q108-A112 PolarHBondContact O-N 2.79Å; L109-A112 PolarHBondContact O-N 3.03Å; A110-A112 VanDerWaalsContact C-N 3.32Å; A110-A112 PolarHBondContact O-N 3.06Å; A112-L116 VanDerWaalsContact O-CB 3.23Å; A112-L116 WeakPolarHBondContact O-CB 3.36Å; A112-L116 WeakPolarHBondContact O-CD1 3.45Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.48Å; A112-L116 PolarHBondContact O-N 3Å
113	V	76.3	Confident	75.8	Confident	103 Å²	103	80.4 Å²	80.4	62%	0.624	44%	0.435	S	S	*	.	H	α-helix	trans	-65.3	-42	177.9	170.1	0	0	0	0	111.7	L109 A110	L109-V113 VanDerWaalsContact O-CG2 3.28Å; L109-V113 WeakPolarHBondContact O-CG2 3.33Å; L109-V113 PolarHBondContact O-N 2.7Å; A110-V113 PolarHBondContact O-N 2.94Å
114	E	72.3	Confident	76.1	Confident	138 Å²	138	82.9 Å²	82.9	65%	0.645	44%	0.44	S	S	*	.	H	α-helix	trans	-66	-47.1	177.2	-172.8	170.9	-170	0	0	111.6	A110 L116 K117	A110-E114 WeakPolarHBondContact O-CB 3.31Å; A110-E114 PolarHBondContact O-N 3.1Å; E114-L116 PolarHBondContact O-N 3.28Å; E114-K117 PolarHBondContact O-N 3.35Å
115	N	70.2	Confident	76.6	Confident	19 Å²	19	81.6 Å²	81.6	10%	0.102	43%	0.431	C	S	.	.	H	α-helix	trans	-68.1	-34.1	178.3	-74.5	-54.2	0	0	0	113.1	A111 K117 N118 I119 L155	A111-N115 VanDerWaalsContact O-CB 3.24Å; A111-N115 WeakPolarHBondContact O-CB 3.37Å; A111-N115 VanDerWaalsContact O-CG 3.29Å; A111-N115 PolarHBondContact O-N 3.14Å; A111-N115 PolarHBondContact O-ND2 3.2Å; N115-K117 VanDerWaalsContact C-N 3.3Å; N115-K117 PolarHBondContact O-N 3.38Å; N115-N118 PolarHBondContact O-N 3.39Å; N115-N118 VanDerWaalsContact O-N 3.09Å; N115-I119 VanDerWaalsContact O-CG1 3.25Å; N115-I119 WeakPolarHBondContact O-CG1 3.4Å; N115-I119 PolarHBondContact O-N 2.99Å; N115-L155 HydrophobicContact CB-CD2 3.72Å; N115-L155 HydrophobicContact CB-CG 4.35Å
116	L	74.6	Confident	77.1	Confident	89 Å²	89	76.5 Å²	76.5	47%	0.466	41%	0.408	S	S	.	.	H	α-helix	trans	-56.5	-43.8	176.6	-92.8	160	0	0	0	111.7	A112 E114 N118 I119 F120	A112-L116 VanDerWaalsContact O-CB 3.23Å; A112-L116 WeakPolarHBondContact O-CB 3.36Å; A112-L116 WeakPolarHBondContact O-CD1 3.45Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.48Å; A112-L116 PolarHBondContact O-N 3Å; E114-L116 PolarHBondContact O-N 3.28Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 2.64Å; L116-I119 PolarHBondContact O-N 2.93Å; L116-F120 HydrophobicContact CD2-CE2 3.9Å; L116-F120 WeakPolarHBondContact O-CD2 3.32Å; L116-F120 PolarHBondContact O-N 3.49Å
117	K	72.7	Confident	77.6	Confident	161 Å²	161	73.7 Å²	73.7	70%	0.7	40%	0.4	S	S	*	.	H	α-helix	trans	-60.3	-41.5	177	-173.4	-179	176.4	-174.2	0	111.4	E114 N115	E114-K117 PolarHBondContact O-N 3.35Å; N115-K117 VanDerWaalsContact C-N 3.3Å; N115-K117 PolarHBondContact O-N 3.38Å
118	N	69.4	Low	78.3	Confident	61 Å²	61	75.3 Å²	75.3	33%	0.326	40%	0.402	S	S	.	.	H	α-helix	trans	-72.3	-39.2	-178.8	-64.2	-20	0	0	0	111.9	N115 L116 F120 S121 V122	N115-N118 PolarHBondContact O-N 3.39Å; N115-N118 VanDerWaalsContact O-N 3.09Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 2.64Å; N118-F120 PolarHBondContact O-N 3Å; N118-S121 PolarHBondContact O-N 3.4Å; N118-S121 VanDerWaalsContact O-N 3.17Å; N118-V122 WeakPolarHBondContact O-CG2 3.22Å; N118-V122 PolarHBondContact O-N 3.42Å
119	I	73.3	Confident	79.2	Confident	50 Å²	50	71.9 Å²	71.9	26%	0.256	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-45.7	179.6	-70.8	165.1	0	0	0	111.4	N115 L116 S121 V122 L155 Y176	N115-I119 VanDerWaalsContact O-CG1 3.25Å; N115-I119 WeakPolarHBondContact O-CG1 3.4Å; N115-I119 PolarHBondContact O-N 2.99Å; L116-I119 PolarHBondContact O-N 2.93Å; I119-S121 PolarHBondContact O-N 3Å; I119-V122 PolarHBondContact O-N 3.23Å; I119-L155 HydrophobicContact CD1-CD1 4.01Å; I119-L155 HydrophobicContact CG1-CD1 4.08Å; I119-Y176 HydrophobicContact CG2-CE1 4.08Å; I119-Y176 PolarHBondContact O-OH 3.49Å
120	F	78.1	Confident	79.9	Confident	163 Å²	163	70.6 Å²	70.6	72%	0.715	38%	0.377	S	S	*	.	H	α-helix	trans	-66.1	-25.3	-179.8	-72.6	-68.7	0	0	0	113.8	L116 N118	L116-F120 HydrophobicContact CD2-CE2 3.9Å; L116-F120 WeakPolarHBondContact O-CD2 3.32Å; L116-F120 PolarHBondContact O-N 3.49Å; N118-F120 PolarHBondContact O-N 3Å
121	S	80.9	Confident	80.5	Confident	44 Å²	44	73 Å²	73	31%	0.308	38%	0.38	S	S	.	.	H	α-helix	trans	-88.1	-9.2	179	-62	0	0	0	0	113.7	N118 I119 E124 I125	N118-S121 PolarHBondContact O-N 3.4Å; N118-S121 VanDerWaalsContact O-N 3.17Å; I119-S121 PolarHBondContact O-N 3Å; S121-E124 PolarHBondContact O-N 2.95Å; S121-I125 VanDerWaalsContact O-CG1 3.25Å; S121-I125 WeakPolarHBondContact O-CG1 3.41Å; S121-I125 PolarHBondContact O-N 3.35Å
122	V	83.1	Confident	81.5	Confident	8 Å²	8	72.9 Å²	72.9	5%	0.048	38%	0.376	C	S	.	.	H	α-helix	trans	-55.8	-51.4	-176.5	171.3	0	0	0	0	112.7	N118 I119 E124 I125 V126 L148 Y176 F177	N118-V122 WeakPolarHBondContact O-CG2 3.22Å; N118-V122 PolarHBondContact O-N 3.42Å; I119-V122 PolarHBondContact O-N 3.23Å; V122-E124 VanDerWaalsContact C-N 3.32Å; V122-E124 PolarHBondContact O-N 3.18Å; V122-I125 PolarHBondContact O-N 2.85Å; V122-V126 HydrophobicContact CG1-CG2 4.09Å; V122-V126 WeakPolarHBondContact O-CB 3.36Å; V122-V126 WeakPolarHBondContact O-CG2 3.45Å; V122-V126 PolarHBondContact O-N 3.42Å; V122-L148 HydrophobicContact CB-CD2 4.26Å; V122-L148 HydrophobicContact CG1-CD2 4.08Å; V122-L148 HydrophobicContact CG2-CD2 4.02Å; V122-Y176 HydrophobicContact CB-CE1 4.2Å; V122-Y176 HydrophobicContact CG1-CE1 4.21Å; V122-Y176 HydrophobicContact CG2-CE1 4.22Å; V122-F177 HydrophobicContact CG1-CD1 4.33Å; V122-F177 HydrophobicContact CG1-CE1 4.18Å; V122-F177 HydrophobicContact CG2-CE1 3.69Å; V122-F177 HydrophobicContact CG2-CZ 4.14Å
123	P	84.3	Confident	82.4	Confident	77 Å²	77	70.8 Å²	70.8	50%	0.5	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-36.7	-176.5	-23	35.2	0	0	0	113.5	V127	P123-V127 WeakPolarHBondContact O-CG2 3.31Å; P123-V127 PolarHBondContact O-N 2.93Å
124	E	86.7	Confident	83	Confident	144 Å²	144	72.3 Å²	72.3	67%	0.673	36%	0.359	S	S	*	.	H	α-helix	trans	-67.6	-48	178.2	-175.8	178.5	-171.6	0	0	111.1	S121 V122 V126 V127 E128	S121-E124 PolarHBondContact O-N 2.95Å; V122-E124 VanDerWaalsContact C-N 3.32Å; V122-E124 PolarHBondContact O-N 3.18Å; E124-V126 VanDerWaalsContact C-N 3.27Å; E124-V126 PolarHBondContact O-N 3.25Å; E124-V127 PolarHBondContact O-N 2.82Å; E124-E128 WeakPolarHBondContact O-CB 3.27Å; E124-E128 PolarHBondContact O-N 2.9Å
125	I	86.8	Confident	83.7	Confident	37 Å²	37	72.1 Å²	72.1	19%	0.19	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-34.4	178.3	-61.8	167.3	0	0	0	110.6	S121 V122 E128 T129 K144 L148	S121-I125 VanDerWaalsContact O-CG1 3.25Å; S121-I125 WeakPolarHBondContact O-CG1 3.41Å; S121-I125 PolarHBondContact O-N 3.35Å; V122-I125 PolarHBondContact O-N 2.85Å; I125-E128 PolarHBondContact O-N 2.97Å; I125-T129 VanDerWaalsContact O-CB 3.22Å; I125-T129 WeakPolarHBondContact O-CB 3.48Å; I125-T129 PolarHBondContact O-N 3.39Å; I125-T129 PolarHBondContact O-OG1 3Å; I125-K144 HydrophobicContact CG2-CB 3.97Å; I125-K144 HydrophobicContact CG2-CD 4.48Å; I125-L148 HydrophobicContact CB-CD1 4.43Å; I125-L148 HydrophobicContact CB-CD2 4.07Å; I125-L148 HydrophobicContact CB-CG 4.44Å; I125-L148 HydrophobicContact CG2-CD1 3.81Å; I125-L148 HydrophobicContact CG2-CD2 3.94Å; I125-L148 HydrophobicContact CG2-CG 3.79Å
126	V	88.8	Confident	84.3	Confident	17 Å²	17	72.7 Å²	72.7	10%	0.103	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-50.8	175.7	162.5	0	0	0	0	111	V122 E124 E128 T129 Q130 L148 D179 V180 L183	V122-V126 HydrophobicContact CG1-CG2 4.09Å; V122-V126 WeakPolarHBondContact O-CB 3.36Å; V122-V126 WeakPolarHBondContact O-CG2 3.45Å; V122-V126 PolarHBondContact O-N 3.42Å; E124-V126 VanDerWaalsContact C-N 3.27Å; E124-V126 PolarHBondContact O-N 3.25Å; V126-E128 PolarHBondContact O-N 2.86Å; V126-T129 PolarHBondContact O-N 3.37Å; V126-Q130 PolarHBondContact O-N 3.27Å; V126-L148 HydrophobicContact CG2-CD1 3.79Å; V126-D179 HydrophobicContact CG1-CB 4.06Å; V126-V180 HydrophobicContact CG2-CG2 4.24Å; V126-L183 HydrophobicContact CB-CD1 3.99Å; V126-L183 HydrophobicContact CG1-CD1 3.81Å; V126-L183 HydrophobicContact CG1-CG 4.41Å; V126-L183 HydrophobicContact CG2-CD1 3.91Å
127	V	89.3	Confident	85.1	Confident	78 Å²	78	72.8 Å²	72.8	47%	0.473	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-43.6	178.6	173.3	0	0	0	0	111.1	P123 E124 T129 Q130 Q131	P123-V127 WeakPolarHBondContact O-CG2 3.31Å; P123-V127 PolarHBondContact O-N 2.93Å; E124-V127 PolarHBondContact O-N 2.82Å; V127-T129 VanDerWaalsContact C-N 3.35Å; V127-T129 PolarHBondContact O-N 3.1Å; V127-Q130 WeakPolarHBondContact O-CB 3.46Å; V127-Q130 PolarHBondContact O-N 2.96Å; V127-Q131 WeakPolarHBondContact O-CG 3.28Å; V127-Q131 PolarHBondContact O-N 3.5Å
128	E	90.8	Very high	86	Confident	84 Å²	84	65.5 Å²	65.5	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-38.7	179.2	-161	-174.9	179.2	0	0	112	E124 I125 V126 Q130 Q131 L132 K144	E124-E128 WeakPolarHBondContact O-CB 3.27Å; E124-E128 PolarHBondContact O-N 2.9Å; I125-E128 PolarHBondContact O-N 2.97Å; V126-E128 PolarHBondContact O-N 2.86Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; E128-Q131 PolarHBondContact O-N 2.83Å; E128-L132 WeakPolarHBondContact O-CG 3.47Å; E128-L132 PolarHBondContact O-N 3.25Å; E128-K144 IonicContact OE1-NZ 3Å; E128-K144 PolarHBondContact OE1-NZ 2.91Å; E128-K144 IonicContact OE2-NZ 2.7Å; E128-K144 PolarHBondContact OE2-NZ 3.06Å
129	T	90.4	Very high	87.1	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-37.9	175.6	-58	0	0	0	0	111.4	I125 V126 V127 L132 T133 A141 K144 L145 L183	I125-T129 VanDerWaalsContact O-CB 3.22Å; I125-T129 WeakPolarHBondContact O-CB 3.48Å; I125-T129 PolarHBondContact O-N 3.39Å; I125-T129 PolarHBondContact O-OG1 3Å; V126-T129 PolarHBondContact O-N 3.37Å; V127-T129 VanDerWaalsContact C-N 3.35Å; V127-T129 PolarHBondContact O-N 3.1Å; T129-L132 PolarHBondContact O-N 2.94Å; T129-T133 WeakPolarHBondContact O-CB 3.4Å; T129-T133 PolarHBondContact O-N 3.05Å; T129-T133 PolarHBondContact O-OG1 3.15Å; T129-A141 HydrophobicContact CG2-CB 4.33Å; T129-A141 WeakPolarHBondContact CG2-O 3.36Å; T129-K144 HydrophobicContact CG2-CB 4.46Å; T129-K144 WeakPolarHBondContact OG1-CB 3.18Å; T129-L145 HydrophobicContact CG2-CB 4.33Å; T129-L183 HydrophobicContact CG2-CD1 4.11Å; T129-L183 HydrophobicContact CG2-CD2 4.39Å
130	Q	90.9	Very high	87.9	Confident	92 Å²	92	66.9 Å²	66.9	43%	0.43	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-49	174.4	-168.3	-179.4	-22.6	0	0	111.3	V126 V127 E128 L132 T133 E134 L183	V126-Q130 PolarHBondContact O-N 3.27Å; V127-Q130 WeakPolarHBondContact O-CB 3.46Å; V127-Q130 PolarHBondContact O-N 2.96Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 3.02Å; Q130-T133 WeakPolarHBondContact O-CB 3.46Å; Q130-T133 PolarHBondContact O-N 3.19Å; Q130-T133 VanDerWaalsContact O-N 3.1Å; Q130-E134 PolarHBondContact NE2-OE1 3.09Å; Q130-E134 WeakPolarHBondContact O-CG 3.48Å; Q130-E134 PolarHBondContact O-N 3.33Å; Q130-L183 HydrophobicContact CB-CD2 3.84Å; Q130-L183 HydrophobicContact CG-CD2 4.39Å
131	Q	90.8	Very high	88.6	Confident	98 Å²	98	59.1 Å²	59.1	46%	0.458	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-42.4	178.6	-70	175.7	5.3	0	0	112.3	V127 E128 T133 E134 Q135	V127-Q131 WeakPolarHBondContact O-CG 3.28Å; V127-Q131 PolarHBondContact O-N 3.5Å; E128-Q131 PolarHBondContact O-N 2.83Å; Q131-T133 VanDerWaalsContact C-N 3.29Å; Q131-T133 PolarHBondContact O-N 3.18Å; Q131-E134 PolarHBondContact O-N 2.94Å; Q131-Q135 WeakPolarHBondContact O-CB 2.87Å; Q131-Q135 VanDerWaalsContact O-CG 3.22Å; Q131-Q135 WeakPolarHBondContact O-CG 3.48Å; Q131-Q135 PolarHBondContact O-N 2.97Å
132	L	91.1	Very high	89.3	Confident	18 Å²	18	57 Å²	57	9%	0.094	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-34.8	176.1	-71.9	169.6	0	0	0	112.4	E128 T129 Q130 Q135 G136 E137 Q140 A141 K144	E128-L132 WeakPolarHBondContact O-CG 3.47Å; E128-L132 PolarHBondContact O-N 3.25Å; T129-L132 PolarHBondContact O-N 2.94Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 3.02Å; L132-Q135 PolarHBondContact O-N 3.49Å; L132-G136 PolarHBondContact O-N 3.07Å; L132-E137 HydrophobicContact CB-CB 4.48Å; L132-E137 HydrophobicContact CD2-CB 3.98Å; L132-E137 HydrophobicContact CD2-CG 4.49Å; L132-E137 PolarHBondContact O-N 2.89Å; L132-Q140 HydrophobicContact CD1-CB 4.08Å; L132-Q140 HydrophobicContact CD2-CB 4.46Å; L132-A141 HydrophobicContact CB-CB 3.96Å; L132-K144 HydrophobicContact CD1-CD 3.86Å
133	T	89.5	Confident	89.7	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-66.9	-43.2	175.5	-56	0	0	0	0	110.8	T129 Q130 Q131 Q135 G136 A141 E186 L187 Q190	T129-T133 WeakPolarHBondContact O-CB 3.4Å; T129-T133 PolarHBondContact O-N 3.05Å; T129-T133 PolarHBondContact O-OG1 3.15Å; Q130-T133 WeakPolarHBondContact O-CB 3.46Å; Q130-T133 PolarHBondContact O-N 3.19Å; Q130-T133 VanDerWaalsContact O-N 3.1Å; Q131-T133 VanDerWaalsContact C-N 3.29Å; Q131-T133 PolarHBondContact O-N 3.18Å; T133-Q135 VanDerWaalsContact C-N 3.34Å; T133-Q135 PolarHBondContact O-N 2.73Å; T133-G136 PolarHBondContact O-N 2.52Å; T133-A141 WeakPolarHBondContact OG1-CB 3.03Å; T133-E186 HydrophobicContact CG2-CG 4.31Å; T133-L187 HydrophobicContact CG2-CD1 4.38Å; T133-Q190 HydrophobicContact CG2-CG 3.71Å
134	E	88.3	Confident	90	Very high	135 Å²	135	62.2 Å²	62.2	63%	0.631	30%	0.301	S	S	*	.	H	α-helix	trans	-66	-33.9	176.5	-70.1	171.9	-170.6	0	0	112.7	Q130 Q131 G136	Q130-E134 PolarHBondContact NE2-OE1 3.09Å; Q130-E134 WeakPolarHBondContact O-CG 3.48Å; Q130-E134 PolarHBondContact O-N 3.33Å; Q131-E134 PolarHBondContact O-N 2.94Å; E134-G136 VanDerWaalsContact C-N 3.29Å; E134-G136 PolarHBondContact O-N 2.9Å
135	Q	87.8	Confident	90.2	Very high	133 Å²	133	55.4 Å²	55.4	62%	0.621	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-9.3	177.1	-70.2	168.8	18.2	0	0	113.8	Q131 L132 T133	Q131-Q135 WeakPolarHBondContact O-CB 2.87Å; Q131-Q135 VanDerWaalsContact O-CG 3.22Å; Q131-Q135 WeakPolarHBondContact O-CG 3.48Å; Q131-Q135 PolarHBondContact O-N 2.97Å; L132-Q135 PolarHBondContact O-N 3.49Å; T133-Q135 VanDerWaalsContact C-N 3.34Å; T133-Q135 PolarHBondContact O-N 2.73Å
136	G	83.1	Confident	90.4	Very high	31 Å²	31	56.4 Å²	56.4	32%	0.32	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	11	-178.4	0	0	0	0	0	114.9	L132 T133 E134 L138	L132-G136 PolarHBondContact O-N 3.07Å; T133-G136 PolarHBondContact O-N 2.52Å; E134-G136 VanDerWaalsContact C-N 3.29Å; E134-G136 PolarHBondContact O-N 2.9Å; G136-L138 PolarHBondContact O-N 3.44Å
137	E	90.7	Very high	90.3	Very high	92 Å²	92	59.5 Å²	59.5	43%	0.43	29%	0.287	S	S	.	.			trans	-81.1	58.8	175.8	-73.4	-69.6	156.5	0	0	111.1	L132 L139 Q140 A141	L132-E137 HydrophobicContact CB-CB 4.48Å; L132-E137 HydrophobicContact CD2-CB 3.98Å; L132-E137 HydrophobicContact CD2-CG 4.49Å; L132-E137 PolarHBondContact O-N 2.89Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 3.03Å; E137-Q140 PolarHBondContact O-N 3.35Å; E137-Q140 VanDerWaalsContact O-N 3.09Å; E137-Q140 PolarHBondContact OE2-NE2 3.04Å; E137-A141 PolarHBondContact O-N 3.09Å
138	L	92.1	Very high	90.3	Very high	7 Å²	7	55.9 Å²	55.9	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-33.9	-164.5	-57.8	175.2	0	0	0	114.1	G136 H142 L187 Q190 L191 V194 V212 I215	G136-L138 PolarHBondContact O-N 3.44Å; L138-H142 VanDerWaalsContact O-CB 3.24Å; L138-H142 WeakPolarHBondContact O-CB 3.38Å; L138-H142 PolarHBondContact O-N 2.91Å; L138-L187 HydrophobicContact CB-CD1 4.49Å; L138-L187 HydrophobicContact CD2-CD1 3.94Å; L138-Q190 HydrophobicContact CD2-CB 3.92Å; L138-L191 HydrophobicContact CD1-CD2 4.12Å; L138-V194 HydrophobicContact CD1-CG2 4.33Å; L138-V212 HydrophobicContact CD1-CG2 3.85Å; L138-I215 HydrophobicContact CB-CD1 3.81Å; L138-I215 WeakPolarHBondContact O-CD1 3.31Å
139	L	91.9	Very high	90.2	Very high	42 Å²	42	52 Å²	52	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-36.3	179	-79	169.2	0	0	0	112.5	E137 R143 S211 R214 I215	E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 3.03Å; L139-R143 PolarHBondContact O-N 3.29Å; L139-R143 VanDerWaalsContact O-N 3.11Å; L139-S211 WeakPolarHBondContact CD1-OG 3.12Å; L139-R214 HydrophobicContact CD2-CB 4.41Å; L139-I215 HydrophobicContact CD2-CD1 4.26Å; L139-I215 HydrophobicContact CD2-CG1 3.79Å
140	Q	91	Very high	90	Very high	99 Å²	99	54.4 Å²	54.4	46%	0.463	26%	0.263	S	S	.	.	H	α-helix	trans	-74.3	-43.6	178.9	-55.7	-172.1	33.5	0	0	109.9	L132 E137 H142 R143 K144	L132-Q140 HydrophobicContact CD1-CB 4.08Å; L132-Q140 HydrophobicContact CD2-CB 4.46Å; E137-Q140 PolarHBondContact O-N 3.35Å; E137-Q140 VanDerWaalsContact O-N 3.09Å; E137-Q140 PolarHBondContact OE2-NE2 3.04Å; Q140-H142 VanDerWaalsContact C-N 3.35Å; Q140-H142 PolarHBondContact O-N 3.35Å; Q140-R143 PolarHBondContact O-N 3.4Å; Q140-K144 PolarHBondContact O-N 3.02Å; Q140-K144 VanDerWaalsContact O-N 3.16Å
141	A	92.8	Very high	89.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.9	-47.1	172.1	0	0	0	0	0	111.5	T129 L132 T133 E137 R143 K144 L145 L187	T129-A141 HydrophobicContact CG2-CB 4.33Å; T129-A141 WeakPolarHBondContact CG2-O 3.36Å; L132-A141 HydrophobicContact CB-CB 3.96Å; T133-A141 WeakPolarHBondContact OG1-CB 3.03Å; E137-A141 PolarHBondContact O-N 3.09Å; A141-R143 VanDerWaalsContact C-N 3.35Å; A141-R143 PolarHBondContact O-N 3.23Å; A141-K144 PolarHBondContact O-N 2.68Å; A141-L145 WeakPolarHBondContact O-CB 3.41Å; A141-L145 PolarHBondContact O-N 3.43Å; A141-L187 HydrophobicContact CB-CD1 4.23Å
142	H	94.7	Very high	89.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-41.6	177.1	178.1	-110.7	0	0	0	113	L138 Q140 L145 M146 L187 I215 E219	L138-H142 VanDerWaalsContact O-CB 3.24Å; L138-H142 WeakPolarHBondContact O-CB 3.38Å; L138-H142 PolarHBondContact O-N 2.91Å; Q140-H142 VanDerWaalsContact C-N 3.35Å; Q140-H142 PolarHBondContact O-N 3.35Å; H142-L145 PolarHBondContact O-N 2.98Å; H142-M146 WeakPolarHBondContact O-CB 3.41Å; H142-M146 PolarHBondContact O-N 2.99Å; H142-L187 HydrophobicContact CB-CD2 4Å; H142-I215 HydrophobicContact CB-CD1 3.99Å; H142-I215 HydrophobicContact CB-CG1 3.9Å; H142-I215 HydrophobicContact CB-CG2 4.22Å; H142-E219 IonicContact CD2-OE1 2.72Å; H142-E219 IonicContact CE1-OE1 3.49Å; H142-E219 IonicContact NE2-OE1 3.11Å; H142-E219 PolarHBondContact NE2-OE1 3.17Å
143	R	92.7	Very high	89.4	Confident	156 Å²	156	45.9 Å²	45.9	59%	0.589	23%	0.225	S	C	*	.	H	α-helix	trans	-60.5	-47.5	178.1	179.1	-177.7	173.6	171.6	2.6	111.5	L139 Q140 A141 M146 E147	L139-R143 PolarHBondContact O-N 3.29Å; L139-R143 VanDerWaalsContact O-N 3.11Å; Q140-R143 PolarHBondContact O-N 3.4Å; A141-R143 VanDerWaalsContact C-N 3.35Å; A141-R143 PolarHBondContact O-N 3.23Å; R143-M146 WeakPolarHBondContact O-CB 3.3Å; R143-M146 PolarHBondContact O-N 2.92Å; R143-E147 IonicContact NE-OE1 2.63Å; R143-E147 PolarHBondContact NE-OE1 3.02Å; R143-E147 IonicContact NH2-OE1 3.18Å; R143-E147 WeakPolarHBondContact O-CG 3.29Å; R143-E147 PolarHBondContact O-N 2.86Å
144	K	89.8	Confident	89.1	Confident	37 Å²	37	49 Å²	49	16%	0.161	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-39.7	179.9	-66.9	-174.5	-174.8	-176.1	0	112	I125 E128 T129 L132 Q140 A141 M146 E147 L148	I125-K144 HydrophobicContact CG2-CB 3.97Å; I125-K144 HydrophobicContact CG2-CD 4.48Å; E128-K144 IonicContact OE1-NZ 3Å; E128-K144 PolarHBondContact OE1-NZ 2.91Å; E128-K144 IonicContact OE2-NZ 2.7Å; E128-K144 PolarHBondContact OE2-NZ 3.06Å; T129-K144 HydrophobicContact CG2-CB 4.46Å; T129-K144 WeakPolarHBondContact OG1-CB 3.18Å; L132-K144 HydrophobicContact CD1-CD 3.86Å; Q140-K144 PolarHBondContact O-N 3.02Å; Q140-K144 VanDerWaalsContact O-N 3.16Å; A141-K144 PolarHBondContact O-N 2.68Å; K144-M146 VanDerWaalsContact C-N 3.3Å; K144-M146 PolarHBondContact O-N 3.23Å; K144-E147 PolarHBondContact O-N 2.83Å; K144-L148 WeakPolarHBondContact O-CG 3.15Å; K144-L148 PolarHBondContact O-N 3.37Å
145	L	91.6	Very high	88.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-43.6	171.6	179.5	65.8	0	0	0	111.5	T129 A141 H142 E147 L148 E149 V180 L183 L187	T129-L145 HydrophobicContact CG2-CB 4.33Å; A141-L145 WeakPolarHBondContact O-CB 3.41Å; A141-L145 PolarHBondContact O-N 3.43Å; H142-L145 PolarHBondContact O-N 2.98Å; L145-E147 VanDerWaalsContact C-N 3.34Å; L145-E147 PolarHBondContact O-N 3.16Å; L145-L148 WeakPolarHBondContact O-CB 3.49Å; L145-L148 PolarHBondContact O-N 3.49Å; L145-E149 HydrophobicContact CD1-CG 4.34Å; L145-E149 HydrophobicContact CG-CG 4.41Å; L145-E149 WeakPolarHBondContact O-CB 3.23Å; L145-E149 WeakPolarHBondContact O-CG 3.27Å; L145-E149 PolarHBondContact O-N 3.44Å; L145-V180 HydrophobicContact CD1-CG1 3.8Å; L145-L183 HydrophobicContact CD1-CB 3.95Å; L145-L187 HydrophobicContact CD2-CB 4.48Å; L145-L187 HydrophobicContact CD2-CD2 3.66Å
146	M	90.4	Very high	88.7	Confident	59 Å²	59	38.3 Å²	38.3	29%	0.291	19%	0.192	S	C	.	.	H	α-helix	trans	-63.7	-39.1	177.5	-173	-171.9	70.9	0	0	111.8	H142 R143 K144 L148 E149 C150 L222	H142-M146 WeakPolarHBondContact O-CB 3.41Å; H142-M146 PolarHBondContact O-N 2.99Å; R143-M146 WeakPolarHBondContact O-CB 3.3Å; R143-M146 PolarHBondContact O-N 2.92Å; K144-M146 VanDerWaalsContact C-N 3.3Å; K144-M146 PolarHBondContact O-N 3.23Å; M146-L148 VanDerWaalsContact C-N 3.34Å; M146-E149 PolarHBondContact O-N 3.42Å; M146-C150 VanDerWaalsContact O-CB 3.31Å; M146-C150 WeakPolarHBondContact O-CB 3.33Å; M146-C150 PolarHBondContact O-N 3.33Å; M146-C150 PolarHBondContact O-SG 3.19Å; M146-L222 HydrophobicContact CG-CD1 4.11Å; M146-L222 HydrophobicContact SD-CD1 3.97Å
147	E	87.5	Confident	88.7	Confident	81 Å²	81	38.9 Å²	38.9	38%	0.379	19%	0.185	S	C	.	.	H	α-helix	trans	-63	-40.4	175.2	-70.8	169	-167.3	0	0	111.6	R143 K144 L145 S151	R143-E147 IonicContact NE-OE1 2.63Å; R143-E147 PolarHBondContact NE-OE1 3.02Å; R143-E147 IonicContact NH2-OE1 3.18Å; R143-E147 WeakPolarHBondContact O-CG 3.29Å; R143-E147 PolarHBondContact O-N 2.86Å; K144-E147 PolarHBondContact O-N 2.83Å; L145-E147 VanDerWaalsContact C-N 3.34Å; L145-E147 PolarHBondContact O-N 3.16Å; E147-S151 PolarHBondContact O-N 3.44Å; E147-S151 VanDerWaalsContact O-N 3.09Å; E147-S151 PolarHBondContact O-OG 3.26Å
148	L	88	Confident	88.2	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-66.7	-46	174.1	-69.5	175.1	0	0	0	112.6	V122 I125 V126 K144 L145 M146 S151 R152 V180 L183	V122-L148 HydrophobicContact CB-CD2 4.26Å; V122-L148 HydrophobicContact CG1-CD2 4.08Å; V122-L148 HydrophobicContact CG2-CD2 4.02Å; I125-L148 HydrophobicContact CB-CD1 4.43Å; I125-L148 HydrophobicContact CB-CD2 4.07Å; I125-L148 HydrophobicContact CB-CG 4.44Å; I125-L148 HydrophobicContact CG2-CD1 3.81Å; I125-L148 HydrophobicContact CG2-CD2 3.94Å; I125-L148 HydrophobicContact CG2-CG 3.79Å; V126-L148 HydrophobicContact CG2-CD1 3.79Å; K144-L148 WeakPolarHBondContact O-CG 3.15Å; K144-L148 PolarHBondContact O-N 3.37Å; L145-L148 WeakPolarHBondContact O-CB 3.49Å; L145-L148 PolarHBondContact O-N 3.49Å; M146-L148 VanDerWaalsContact C-N 3.34Å; L148-S151 PolarHBondContact O-N 2.9Å; L148-R152 PolarHBondContact O-N 2.82Å; L148-V180 HydrophobicContact CB-CG1 3.88Å; L148-V180 HydrophobicContact CB-CG2 4.04Å; L148-V180 HydrophobicContact CD1-CG2 4.18Å; L148-L183 HydrophobicContact CD1-CD1 4.24Å
149	E	88.8	Confident	87.7	Confident	3 Å²	3	38 Å²	38	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-41.9	177.2	-74.6	-171.3	163.8	0	0	111.7	L145 M146 S151 R152 D153 V180 R240 K242	L145-E149 HydrophobicContact CD1-CG 4.34Å; L145-E149 HydrophobicContact CG-CG 4.41Å; L145-E149 WeakPolarHBondContact O-CB 3.23Å; L145-E149 WeakPolarHBondContact O-CG 3.27Å; L145-E149 PolarHBondContact O-N 3.44Å; M146-E149 PolarHBondContact O-N 3.42Å; E149-S151 PolarHBondContact O-N 2.96Å; E149-R152 PolarHBondContact O-N 3.02Å; E149-D153 WeakPolarHBondContact O-CB 3.24Å; E149-D153 PolarHBondContact O-N 2.85Å; E149-V180 HydrophobicContact CG-CG1 3.87Å; E149-R240 IonicContact OE2-CZ 2.68Å; E149-R240 IonicContact OE2-NH2 2.61Å; E149-R240 PolarHBondContact OE2-NH2 2.61Å; E149-K242 VanDerWaalsContact CD-NZ 3.31Å; E149-K242 IonicContact OE1-NZ 3.32Å; E149-K242 PolarHBondContact OE1-NZ 2.82Å; E149-K242 IonicContact OE2-NZ 2.96Å; E149-K242 PolarHBondContact OE2-NZ 3.39Å; E149-K242 VanDerWaalsContact OE2-NZ 3.11Å
150	C	87.1	Confident	87.2	Confident	51 Å²	51	39.7 Å²	39.7	35%	0.345	19%	0.185	S	C	.	.	H	α-helix	trans	-60.2	-45.8	174.7	-75.4	0	0	0	0	111.5	M146 R152 D153 D154	M146-C150 VanDerWaalsContact O-CB 3.31Å; M146-C150 WeakPolarHBondContact O-CB 3.33Å; M146-C150 PolarHBondContact O-N 3.33Å; M146-C150 PolarHBondContact O-SG 3.19Å; C150-R152 VanDerWaalsContact C-N 3.34Å; C150-R152 PolarHBondContact O-N 3.39Å; C150-D153 PolarHBondContact O-N 2.67Å; C150-D154 WeakPolarHBondContact O-CB 3.41Å; C150-D154 PolarHBondContact O-N 2.66Å
151	S	85.1	Confident	86.7	Confident	18 Å²	18	40.5 Å²	40.5	13%	0.126	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-43.6	178.2	-58.4	0	0	0	0	111.8	E147 L148 E149 L155	E147-S151 PolarHBondContact O-N 3.44Å; E147-S151 VanDerWaalsContact O-N 3.09Å; E147-S151 PolarHBondContact O-OG 3.26Å; L148-S151 PolarHBondContact O-N 2.9Å; E149-S151 PolarHBondContact O-N 2.96Å; S151-L155 WeakPolarHBondContact O-CB 3.33Å; S151-L155 VanDerWaalsContact O-CG 3.32Å; S151-L155 WeakPolarHBondContact O-CG 3.32Å; S151-L155 PolarHBondContact O-N 2.72Å
152	R	86.9	Confident	85.8	Confident	9 Å²	9	44.6 Å²	44.6	3%	0.034	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-52.2	173.8	-179	-165.3	68.3	-169.5	-2.1	111.1	L148 E149 C150 D154 L155 M156 I173 F177	L148-R152 PolarHBondContact O-N 2.82Å; E149-R152 PolarHBondContact O-N 3.02Å; C150-R152 VanDerWaalsContact C-N 3.34Å; C150-R152 PolarHBondContact O-N 3.39Å; R152-D154 VanDerWaalsContact C-N 3.33Å; R152-D154 PolarHBondContact O-N 3.5Å; R152-L155 PolarHBondContact O-N 2.9Å; R152-M156 HydrophobicContact CG-CG 4.44Å; R152-M156 HydrophobicContact CG-SD 4.14Å; R152-M156 VanDerWaalsContact O-CG 3.28Å; R152-M156 WeakPolarHBondContact O-CG 3.49Å; R152-M156 PolarHBondContact O-N 3.41Å; R152-I173 HydrophobicContact CG-CG2 4.48Å; R152-F177 HydrophobicContact CB-CB 4.27Å; R152-F177 HydrophobicContact CB-CD1 3.78Å; R152-F177 HydrophobicContact CB-CD2 3.97Å; R152-F177 HydrophobicContact CB-CE1 4.01Å; R152-F177 HydrophobicContact CB-CE2 4.22Å; R152-F177 HydrophobicContact CB-CG 3.76Å; R152-F177 HydrophobicContact CB-CZ 4.24Å; R152-F177 HydrophobicContact CG-CB 3.78Å; R152-F177 HydrophobicContact CG-CD1 4.23Å; R152-F177 HydrophobicContact CG-CD2 3.78Å; R152-F177 HydrophobicContact CG-CE2 4.42Å; R152-F177 HydrophobicContact CG-CG 3.68Å
153	D	87.1	Confident	84.9	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-35.3	-172.6	-68.3	-1.8	0	0	0	111.8	E149 C150 Y157 M226 P237	E149-D153 WeakPolarHBondContact O-CB 3.24Å; E149-D153 PolarHBondContact O-N 2.85Å; C150-D153 PolarHBondContact O-N 2.67Å; D153-Y157 WeakPolarHBondContact O-CB 3.46Å; D153-Y157 PolarHBondContact O-N 3.47Å; D153-M226 HydrophobicContact CB-CE 4.47Å; D153-P237 HydrophobicContact CB-CB 4.18Å; D153-P237 HydrophobicContact CB-CG 3.7Å; D153-P237 VanDerWaalsContact CG-CB 3.45Å; D153-P237 WeakPolarHBondContact OD1-CB 3.37Å; D153-P237 WeakPolarHBondContact OD2-CG 3.36Å
154	D	83.3	Confident	83.9	Confident	69 Å²	69	44.3 Å²	44.3	37%	0.369	22%	0.22	S	C	.	.	H	α-helix	trans	-70.8	-41.6	175.4	-73.5	-27.6	0	0	0	111.7	C150 R152 M156 Y157 E158 R229	C150-D154 WeakPolarHBondContact O-CB 3.41Å; C150-D154 PolarHBondContact O-N 2.66Å; R152-D154 VanDerWaalsContact C-N 3.33Å; R152-D154 PolarHBondContact O-N 3.5Å; D154-M156 VanDerWaalsContact C-N 3.35Å; D154-M156 PolarHBondContact O-N 2.84Å; D154-Y157 PolarHBondContact O-N 3.19Å; D154-E158 WeakPolarHBondContact O-CB 3.41Å; D154-E158 WeakPolarHBondContact O-CG 3.31Å; D154-E158 PolarHBondContact O-N 3.48Å; D154-R229 IonicContact OD1-NH1 3.43Å
155	L	82.6	Confident	83.1	Confident	33 Å²	33	50.8 Å²	50.8	17%	0.173	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-44	172.1	-77.8	172.4	0	0	0	111.9	N115 I119 S151 R152 E158 Q159 I173 F177	N115-L155 HydrophobicContact CB-CD2 3.72Å; N115-L155 HydrophobicContact CB-CG 4.35Å; I119-L155 HydrophobicContact CD1-CD1 4.01Å; I119-L155 HydrophobicContact CG1-CD1 4.08Å; S151-L155 WeakPolarHBondContact O-CB 3.33Å; S151-L155 VanDerWaalsContact O-CG 3.32Å; S151-L155 WeakPolarHBondContact O-CG 3.32Å; S151-L155 PolarHBondContact O-N 2.72Å; R152-L155 PolarHBondContact O-N 2.9Å; L155-E158 PolarHBondContact O-N 3.25Å; L155-Q159 PolarHBondContact O-N 3.43Å; L155-I173 HydrophobicContact CB-CD1 4.42Å; L155-I173 HydrophobicContact CB-CG2 4.44Å; L155-F177 HydrophobicContact CD1-CE2 3.78Å; L155-F177 HydrophobicContact CD1-CZ 3.95Å
156	M	84.8	Confident	82.3	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.054	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-39.4	176.6	-66.5	-172.4	82.3	0	0	111.5	R152 D154 Q159 Y160 M170 I173 F235 P238	R152-M156 HydrophobicContact CG-CG 4.44Å; R152-M156 HydrophobicContact CG-SD 4.14Å; R152-M156 VanDerWaalsContact O-CG 3.28Å; R152-M156 WeakPolarHBondContact O-CG 3.49Å; R152-M156 PolarHBondContact O-N 3.41Å; D154-M156 VanDerWaalsContact C-N 3.35Å; D154-M156 PolarHBondContact O-N 2.84Å; M156-Q159 PolarHBondContact O-N 3.12Å; M156-Y160 WeakPolarHBondContact O-CB 3.25Å; M156-Y160 PolarHBondContact O-N 2.96Å; M156-M170 HydrophobicContact CB-SD 4.39Å; M156-M170 HydrophobicContact CE-SD 4.24Å; M156-M170 VanDerWaalsContact O-CE 3.32Å; M156-M170 WeakPolarHBondContact O-CE 3.45Å; M156-I173 HydrophobicContact CG-CB 4.43Å; M156-I173 HydrophobicContact CG-CG2 3.65Å; M156-F235 HydrophobicContact CB-CE1 4.4Å; M156-F235 HydrophobicContact CB-CZ 3.68Å; M156-P238 HydrophobicContact CE-CG 3.61Å; M156-P238 HydrophobicContact SD-CG 4.02Å
157	Y	83.7	Confident	81.5	Confident	42 Å²	42	54.4 Å²	54.4	17%	0.165	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-42	176.5	178.1	-105.9	0	0	0	112.3	D153 D154 Y160 R161 R229 T233 F235	D153-Y157 WeakPolarHBondContact O-CB 3.46Å; D153-Y157 PolarHBondContact O-N 3.47Å; D154-Y157 PolarHBondContact O-N 3.19Å; Y157-Y160 WeakPolarHBondContact O-CB 3.36Å; Y157-Y160 PolarHBondContact O-N 3.22Å; Y157-R161 WeakPolarHBondContact O-CB 3.27Å; Y157-R161 PolarHBondContact O-N 3.29Å; Y157-R229 VanDerWaalsContact CE1-NH2 3.26Å; Y157-T233 HydrophobicContact CE2-CG2 3.97Å; Y157-T233 WeakPolarHBondContact OH-CG2 3.06Å; Y157-F235 HydrophobicContact CD2-CB 4Å; Y157-F235 AromaticContact CD2-CD1 3.61Å; Y157-F235 HydrophobicContact CD2-CD1 3.61Å; Y157-F235 HydrophobicContact CD2-CE1 4.38Å; Y157-F235 HydrophobicContact CD2-CG 4Å; Y157-F235 HydrophobicContact CE2-CB 4.3Å; Y157-F235 HydrophobicContact CG-CD1 4.3Å
158	E	79.6	Confident	81	Confident	43 Å²	43	54.5 Å²	54.5	20%	0.201	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-44.3	176.6	-77.5	-60.8	152.5	0	0	111.3	D154 L155 Y160 R161 M162	D154-E158 WeakPolarHBondContact O-CB 3.41Å; D154-E158 WeakPolarHBondContact O-CG 3.31Å; D154-E158 PolarHBondContact O-N 3.48Å; L155-E158 PolarHBondContact O-N 3.25Å; E158-Y160 VanDerWaalsContact C-N 3.31Å; E158-Y160 PolarHBondContact O-N 2.86Å; E158-R161 VanDerWaalsContact CD-NH2 3.29Å; E158-R161 WeakPolarHBondContact O-CB 3.32Å; E158-R161 PolarHBondContact O-N 3.47Å; E158-R161 IonicContact OE1-CZ 2.92Å; E158-R161 IonicContact OE1-NE 2.55Å; E158-R161 IonicContact OE1-NH1 2.91Å; E158-R161 PolarHBondContact OE1-NH1 3.2Å; E158-R161 IonicContact OE1-NH2 3.72Å; E158-R161 PolarHBondContact OE1-NH2 2.88Å; E158-R161 IonicContact OE2-CZ 4Å; E158-R161 IonicContact OE2-NE 2.75Å; E158-R161 PolarHBondContact OE2-NE 3.48Å; E158-R161 IonicContact OE2-NH1 2.77Å; E158-R161 IonicContact OE2-NH2 2.76Å; E158-R161 PolarHBondContact OE2-NH2 3.49Å; E158-M162 WeakPolarHBondContact O-CG 3.43Å; E158-M162 PolarHBondContact O-N 3.34Å; E158-M162 VanDerWaalsContact O-N 3.07Å
159	Q	81.4	Confident	80.6	Confident	38 Å²	38	57.4 Å²	57.4	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-41.5	173.4	-174.9	63.4	12.7	0	0	111.8	L155 M156 R161 M162 D163 N166 D169 M170 I173	L155-Q159 PolarHBondContact O-N 3.43Å; M156-Q159 PolarHBondContact O-N 3.12Å; Q159-R161 VanDerWaalsContact C-N 3.28Å; Q159-R161 PolarHBondContact O-N 3.27Å; Q159-M162 PolarHBondContact O-N 3.39Å; Q159-D163 PolarHBondContact O-N 2.93Å; Q159-N166 PolarHBondContact NE2-ND2 2.81Å; Q159-D169 HydrophobicContact CG-CB 4.24Å; Q159-D169 VanDerWaalsContact NE2-CB 3.25Å; Q159-D169 PolarHBondContact NE2-OD2 3.33Å; Q159-D169 VanDerWaalsContact NE2-OD2 3.14Å; Q159-M170 HydrophobicContact CB-CE 3.72Å; Q159-M170 HydrophobicContact CB-SD 4Å; Q159-M170 HydrophobicContact CG-CE 3.69Å; Q159-M170 HydrophobicContact CG-CG 4.22Å; Q159-M170 HydrophobicContact CG-SD 3.89Å; Q159-I173 HydrophobicContact CB-CD1 4.18Å
160	Y	83.1	Confident	80.2	Confident	77 Å²	77	58.5 Å²	58.5	30%	0.302	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-37.6	178.5	177.7	-96.7	0	0	0	111.7	M156 Y157 E158 S164 M170 F235	M156-Y160 WeakPolarHBondContact O-CB 3.25Å; M156-Y160 PolarHBondContact O-N 2.96Å; Y157-Y160 WeakPolarHBondContact O-CB 3.36Å; Y157-Y160 PolarHBondContact O-N 3.22Å; E158-Y160 VanDerWaalsContact C-N 3.31Å; E158-Y160 PolarHBondContact O-N 2.86Å; Y160-S164 PolarHBondContact O-N 2.82Å; Y160-M170 VanDerWaalsContact CA-CE 3.4Å; Y160-F235 HydrophobicContact CD1-CB 3.66Å; Y160-F235 HydrophobicContact CD1-CD2 4.06Å; Y160-F235 HydrophobicContact CD1-CG 4.1Å; Y160-F235 AromaticContact CD2-CD2 3.7Å; Y160-F235 HydrophobicContact CD2-CD2 3.7Å; Y160-F235 HydrophobicContact CD2-CE2 4.42Å; Y160-F235 HydrophobicContact CE1-CB 3.76Å; Y160-F235 HydrophobicContact CE2-CD2 4.29Å; Y160-F235 HydrophobicContact CG-CB 4.08Å; Y160-F235 AromaticContact CG-CD2 3.55Å; Y160-F235 HydrophobicContact CG-CD2 3.55Å; Y160-F235 HydrophobicContact CG-CE2 4.32Å; Y160-F235 HydrophobicContact CG-CG 4.05Å
161	R	79.6	Confident	79.9	Confident	116 Å²	116	60.1 Å²	60.1	44%	0.438	31%	0.308	S	S	.	.	H	α-helix	trans	-68.9	-33	177.7	-167.3	178.5	70.7	177.5	5.2	112.3	Y157 E158 Q159	Y157-R161 WeakPolarHBondContact O-CB 3.27Å; Y157-R161 PolarHBondContact O-N 3.29Å; E158-R161 VanDerWaalsContact CD-NH2 3.29Å; E158-R161 WeakPolarHBondContact O-CB 3.32Å; E158-R161 PolarHBondContact O-N 3.47Å; E158-R161 IonicContact OE1-CZ 2.92Å; E158-R161 IonicContact OE1-NE 2.55Å; E158-R161 IonicContact OE1-NH1 2.91Å; E158-R161 PolarHBondContact OE1-NH1 3.2Å; E158-R161 IonicContact OE1-NH2 3.72Å; E158-R161 PolarHBondContact OE1-NH2 2.88Å; E158-R161 IonicContact OE2-CZ 4Å; E158-R161 IonicContact OE2-NE 2.75Å; E158-R161 PolarHBondContact OE2-NE 3.48Å; E158-R161 IonicContact OE2-NH1 2.77Å; E158-R161 IonicContact OE2-NH2 2.76Å; E158-R161 PolarHBondContact OE2-NH2 3.49Å; Q159-R161 VanDerWaalsContact C-N 3.28Å; Q159-R161 PolarHBondContact O-N 3.27Å
162	M	74.4	Confident	79.8	Confident	87 Å²	87	64.8 Å²	64.8	43%	0.429	33%	0.331	S	S	.	.	H	α-helix	trans	-78	-52.2	178.3	-65	-59.9	151.7	0	0	112.1	Q108 E158 Q159	Q108-M162 HydrophobicContact CG-CE 3.62Å; Q108-M162 VanDerWaalsContact NE2-CE 3.27Å; Q108-M162 PolarHBondContact NE2-SD 3.45Å; E158-M162 WeakPolarHBondContact O-CG 3.43Å; E158-M162 PolarHBondContact O-N 3.34Å; E158-M162 VanDerWaalsContact O-N 3.07Å; Q159-M162 PolarHBondContact O-N 3.39Å
163	D	75.8	Confident	79.6	Confident	73 Å²	73	65.8 Å²	65.8	39%	0.39	34%	0.336	S	S	.	.			trans	-150.1	97.7	177.5	-173.2	-3.7	0	0	0	111.1	Q159 K165 N166	Q159-D163 PolarHBondContact O-N 2.93Å; D163-K165 PolarHBondContact O-N 2.98Å; D163-K165 WeakPolarHBondContact OD1-CB 3.37Å; D163-K165 PolarHBondContact OD1-N 3.49Å; D163-N166 HydrophobicContact CB-CB 3.97Å; D163-N166 PolarHBondContact O-N 3.13Å; D163-N166 PolarHBondContact OD1-N 3.27Å
164	S	72.1	Confident	79.4	Confident	77 Å²	77	70.1 Å²	70.1	54%	0.538	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.8	178.6	68	0	0	0	0	114	Y160	Y160-S164 PolarHBondContact O-N 2.82Å
165	K	71.7	Confident	79.5	Confident	173 Å²	173	72 Å²	72	75%	0.752	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-10	-178.6	-64	-178.7	-179.1	177.2	0	113	D163 T167	D163-K165 PolarHBondContact O-N 2.98Å; D163-K165 WeakPolarHBondContact OD1-CB 3.37Å; D163-K165 PolarHBondContact OD1-N 3.49Å; K165-T167 PolarHBondContact O-N 3.45Å; K165-T167 PolarHBondContact O-OG1 3.45Å
166	N	76.1	Confident	79.6	Confident	44 Å²	44	75.2 Å²	75.2	24%	0.235	38%	0.375	C	S	.	.			trans	-79.7	85.4	-179.1	-172.4	-12.2	0	0	0	111.5	Q159 D163 S168 D169 M170	Q159-N166 PolarHBondContact NE2-ND2 2.81Å; D163-N166 HydrophobicContact CB-CB 3.97Å; D163-N166 PolarHBondContact O-N 3.13Å; D163-N166 PolarHBondContact OD1-N 3.27Å; N166-S168 VanDerWaalsContact C-N 3.31Å; N166-S168 PolarHBondContact O-N 2.97Å; N166-S168 PolarHBondContact OD1-N 3.1Å; N166-D169 PolarHBondContact ND2-OD2 3.23Å; N166-D169 PolarHBondContact OD1-N 3.04Å; N166-M170 WeakPolarHBondContact O-CG 3.28Å
167	T	73.5	Confident	79.7	Confident	92 Å²	92	75 Å²	75	56%	0.564	37%	0.374	S	S	*	.	H	α-helix	trans	-71.4	-24.4	-179.8	-41	0	0	0	0	113	K165 N171	K165-T167 PolarHBondContact O-N 3.45Å; K165-T167 PolarHBondContact O-OG1 3.45Å; T167-N171 WeakPolarHBondContact O-CB 3.43Å; T167-N171 PolarHBondContact O-N 2.92Å; T167-N171 PolarHBondContact O-ND2 3.14Å
168	S	77	Confident	79.8	Confident	83 Å²	83	77 Å²	77	58%	0.58	38%	0.384	S	S	*	.	H	α-helix	trans	-65.4	-49.6	-178.9	179.7	0	0	0	0	111.6	N166 N171 L172	N166-S168 VanDerWaalsContact C-N 3.31Å; N166-S168 PolarHBondContact O-N 2.97Å; N166-S168 PolarHBondContact OD1-N 3.1Å; S168-N171 WeakPolarHBondContact O-CB 3.21Å; S168-N171 PolarHBondContact O-N 3.31Å; S168-L172 PolarHBondContact O-N 3.41Å
169	D	78.4	Confident	80.1	Confident	63 Å²	63	78.4 Å²	78.4	34%	0.337	39%	0.393	S	S	.	.	H	α-helix	trans	-72.3	-34	-177.8	-66.2	-10.1	0	0	0	111.8	Q159 N166 N171 L172 I173	Q159-D169 HydrophobicContact CG-CB 4.24Å; Q159-D169 VanDerWaalsContact NE2-CB 3.25Å; Q159-D169 PolarHBondContact NE2-OD2 3.33Å; Q159-D169 VanDerWaalsContact NE2-OD2 3.14Å; N166-D169 PolarHBondContact ND2-OD2 3.23Å; N166-D169 PolarHBondContact OD1-N 3.04Å; D169-N171 VanDerWaalsContact C-N 3.31Å; D169-N171 PolarHBondContact O-N 3.36Å; D169-L172 PolarHBondContact O-N 2.97Å; D169-I173 WeakPolarHBondContact O-CG1 3.42Å; D169-I173 PolarHBondContact O-N 3.46Å
170	M	80.3	Confident	80.4	Confident	26 Å²	26	76.7 Å²	76.7	13%	0.128	39%	0.385	C	S	.	.	H	α-helix	trans	-59.8	-42.3	170.3	-72.1	-65.1	-170.9	0	0	112	M156 Q159 Y160 N166 F174	M156-M170 HydrophobicContact CB-SD 4.39Å; M156-M170 HydrophobicContact CE-SD 4.24Å; M156-M170 VanDerWaalsContact O-CE 3.32Å; M156-M170 WeakPolarHBondContact O-CE 3.45Å; Q159-M170 HydrophobicContact CB-CE 3.72Å; Q159-M170 HydrophobicContact CB-SD 4Å; Q159-M170 HydrophobicContact CG-CE 3.69Å; Q159-M170 HydrophobicContact CG-CG 4.22Å; Q159-M170 HydrophobicContact CG-SD 3.89Å; Y160-M170 VanDerWaalsContact CA-CE 3.4Å; N166-M170 WeakPolarHBondContact O-CG 3.28Å; M170-F174 WeakPolarHBondContact O-CB 3.25Å; M170-F174 PolarHBondContact O-N 3.08Å
171	N	81.3	Confident	80.6	Confident	86 Å²	86	75.7 Å²	75.7	46%	0.46	38%	0.384	S	S	.	.	H	α-helix	trans	-68.5	-35.2	176.6	-75	-18.1	0	0	0	112	T167 S168 D169 F174 I175	T167-N171 WeakPolarHBondContact O-CB 3.43Å; T167-N171 PolarHBondContact O-N 2.92Å; T167-N171 PolarHBondContact O-ND2 3.14Å; S168-N171 WeakPolarHBondContact O-CB 3.21Å; S168-N171 PolarHBondContact O-N 3.31Å; D169-N171 VanDerWaalsContact C-N 3.31Å; D169-N171 PolarHBondContact O-N 3.36Å; N171-F174 WeakPolarHBondContact O-CB 3.26Å; N171-F174 PolarHBondContact O-N 3.29Å; N171-I175 VanDerWaalsContact O-CG1 3.26Å; N171-I175 WeakPolarHBondContact O-CG1 3.45Å; N171-I175 PolarHBondContact O-N 3.18Å
172	L	84.1	Confident	81	Confident	115 Å²	115	76.5 Å²	76.5	60%	0.602	39%	0.387	S	S	*	.	H	α-helix	trans	-63.9	-44.7	176.1	-173.4	67.6	0	0	0	111.7	S168 D169 F174 I175 Y176	S168-L172 PolarHBondContact O-N 3.41Å; D169-L172 PolarHBondContact O-N 2.97Å; L172-F174 VanDerWaalsContact C-N 3.32Å; L172-F174 PolarHBondContact O-N 2.93Å; L172-I175 PolarHBondContact O-N 2.92Å; L172-Y176 PolarHBondContact O-N 2.99Å
173	I	82.8	Confident	81.8	Confident	30 Å²	30	72.9 Å²	72.9	15%	0.154	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-44.2	174.3	-63.7	166.4	0	0	0	109.8	R152 L155 M156 Q159 D169 I175 Y176 F177	R152-I173 HydrophobicContact CG-CG2 4.48Å; L155-I173 HydrophobicContact CB-CD1 4.42Å; L155-I173 HydrophobicContact CB-CG2 4.44Å; M156-I173 HydrophobicContact CG-CB 4.43Å; M156-I173 HydrophobicContact CG-CG2 3.65Å; Q159-I173 HydrophobicContact CB-CD1 4.18Å; D169-I173 WeakPolarHBondContact O-CG1 3.42Å; D169-I173 PolarHBondContact O-N 3.46Å; I173-I175 PolarHBondContact O-N 3.46Å; I173-Y176 PolarHBondContact O-N 3.46Å; I173-F177 HydrophobicContact CG2-CD2 3.85Å; I173-F177 HydrophobicContact CG2-CE2 4.12Å; I173-F177 WeakPolarHBondContact O-CD2 3.3Å; I173-F177 PolarHBondContact O-N 3.04Å; I173-F177 VanDerWaalsContact O-N 3.09Å
174	F	83.1	Confident	82.5	Confident	94 Å²	94	69.5 Å²	69.5	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-45.9	177.5	-177.7	-93.7	0	0	0	112.7	M170 N171 L172 F177 E178	M170-F174 WeakPolarHBondContact O-CB 3.25Å; M170-F174 PolarHBondContact O-N 3.08Å; N171-F174 WeakPolarHBondContact O-CB 3.26Å; N171-F174 PolarHBondContact O-N 3.29Å; L172-F174 VanDerWaalsContact C-N 3.32Å; L172-F174 PolarHBondContact O-N 2.93Å; F174-F177 CarbonylContact O-C 2.94Å; F174-F177 PolarHBondContact O-N 3.28Å; F174-E178 PolarHBondContact O-N 2.71Å; F174-E178 VanDerWaalsContact O-N 3.14Å
175	I	83.9	Confident	83.5	Confident	108 Å²	108	69.6 Å²	69.6	55%	0.554	35%	0.345	S	S	*	.	H	α-helix	trans	-63.7	-43.2	178.2	-69	164.1	0	0	0	110.9	N171 L172 I173 F177 E178	N171-I175 VanDerWaalsContact O-CG1 3.26Å; N171-I175 WeakPolarHBondContact O-CG1 3.45Å; N171-I175 PolarHBondContact O-N 3.18Å; L172-I175 PolarHBondContact O-N 2.92Å; I173-I175 PolarHBondContact O-N 3.46Å; I175-F177 VanDerWaalsContact C-N 3.29Å; I175-F177 PolarHBondContact O-N 3.36Å; I175-E178 WeakPolarHBondContact O-CB 3.42Å; I175-E178 PolarHBondContact O-N 3.25Å
176	Y	85	Confident	84.4	Confident	102 Å²	102	64.4 Å²	64.4	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-36.9	179.7	-177	-98.7	0	0	0	112.7	I119 V122 L172 I173	I119-Y176 HydrophobicContact CG2-CE1 4.08Å; I119-Y176 PolarHBondContact O-OH 3.49Å; V122-Y176 HydrophobicContact CB-CE1 4.2Å; V122-Y176 HydrophobicContact CG1-CE1 4.21Å; V122-Y176 HydrophobicContact CG2-CE1 4.22Å; L172-Y176 PolarHBondContact O-N 2.99Å; I173-Y176 PolarHBondContact O-N 3.46Å
177	F	86.2	Confident	85.2	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.026	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	16.6	179.2	-72.4	-83.9	0	0	0	113.7	V122 R152 L155 I173 F174 I175 D179 V180	V122-F177 HydrophobicContact CG1-CD1 4.33Å; V122-F177 HydrophobicContact CG1-CE1 4.18Å; V122-F177 HydrophobicContact CG2-CE1 3.69Å; V122-F177 HydrophobicContact CG2-CZ 4.14Å; R152-F177 HydrophobicContact CB-CB 4.27Å; R152-F177 HydrophobicContact CB-CD1 3.78Å; R152-F177 HydrophobicContact CB-CD2 3.97Å; R152-F177 HydrophobicContact CB-CE1 4.01Å; R152-F177 HydrophobicContact CB-CE2 4.22Å; R152-F177 HydrophobicContact CB-CG 3.76Å; R152-F177 HydrophobicContact CB-CZ 4.24Å; R152-F177 HydrophobicContact CG-CB 3.78Å; R152-F177 HydrophobicContact CG-CD1 4.23Å; R152-F177 HydrophobicContact CG-CD2 3.78Å; R152-F177 HydrophobicContact CG-CE2 4.42Å; R152-F177 HydrophobicContact CG-CG 3.68Å; L155-F177 HydrophobicContact CD1-CE2 3.78Å; L155-F177 HydrophobicContact CD1-CZ 3.95Å; I173-F177 HydrophobicContact CG2-CD2 3.85Å; I173-F177 HydrophobicContact CG2-CE2 4.12Å; I173-F177 WeakPolarHBondContact O-CD2 3.3Å; I173-F177 PolarHBondContact O-N 3.04Å; I173-F177 VanDerWaalsContact O-N 3.09Å; F174-F177 CarbonylContact O-C 2.94Å; F174-F177 PolarHBondContact O-N 3.28Å; I175-F177 VanDerWaalsContact C-N 3.29Å; I175-F177 PolarHBondContact O-N 3.36Å; F177-D179 VanDerWaalsContact C-N 3.27Å; F177-D179 PolarHBondContact O-N 3Å; F177-V180 HydrophobicContact CB-CG2 4.33Å; F177-V180 HydrophobicContact CD1-CG2 3.78Å; F177-V180 WeakPolarHBondContact O-CB 3.48Å; F177-V180 PolarHBondContact O-N 2.74Å
178	E	86.1	Confident	86.1	Confident	84 Å²	84	58.3 Å²	58.3	39%	0.393	29%	0.289	S	S	.	.	H	α-helix	trans	-57.8	-40.5	-178.5	-170.4	-169.4	167.7	0	0	111.9	F174 I175 V180 Q181 R182	F174-E178 PolarHBondContact O-N 2.71Å; F174-E178 VanDerWaalsContact O-N 3.14Å; I175-E178 WeakPolarHBondContact O-CB 3.42Å; I175-E178 PolarHBondContact O-N 3.25Å; E178-V180 PolarHBondContact O-N 3.14Å; E178-Q181 WeakPolarHBondContact O-CB 3.36Å; E178-Q181 PolarHBondContact O-N 2.86Å; E178-R182 VanDerWaalsContact CD-NH2 3.26Å; E178-R182 PolarHBondContact O-N 3.3Å; E178-R182 IonicContact OE1-CZ 3.63Å; E178-R182 IonicContact OE1-NE 3.58Å; E178-R182 IonicContact OE1-NH2 2.82Å; E178-R182 PolarHBondContact OE1-NH2 2.82Å; E178-R182 IonicContact OE2-NH2 3.96Å
179	D	86.4	Confident	86.9	Confident	73 Å²	73	60 Å²	60	39%	0.39	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-25.1	179.4	-69.5	-35	0	0	0	112.9	V126 F177 Q181 R182 L183	V126-D179 HydrophobicContact CG1-CB 4.06Å; F177-D179 VanDerWaalsContact C-N 3.27Å; F177-D179 PolarHBondContact O-N 3Å; D179-Q181 VanDerWaalsContact C-N 3.35Å; D179-R182 PolarHBondContact O-N 3.37Å; D179-R182 IonicContact OD1-CZ 2.78Å; D179-R182 IonicContact OD1-NE 3.56Å; D179-R182 IonicContact OD1-NH1 3.93Å; D179-R182 PolarHBondContact OD1-NH1 3.43Å; D179-L183 WeakPolarHBondContact O-CG 3.22Å; D179-L183 PolarHBondContact O-N 3Å
180	V	87.8	Confident	87.6	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-68.2	-37	174	-176.8	0	0	0	0	111	V126 L145 L148 E149 F177 E178 L183 S184	V126-V180 HydrophobicContact CG2-CG2 4.24Å; L145-V180 HydrophobicContact CD1-CG1 3.8Å; L148-V180 HydrophobicContact CB-CG1 3.88Å; L148-V180 HydrophobicContact CB-CG2 4.04Å; L148-V180 HydrophobicContact CD1-CG2 4.18Å; E149-V180 HydrophobicContact CG-CG1 3.87Å; F177-V180 HydrophobicContact CB-CG2 4.33Å; F177-V180 HydrophobicContact CD1-CG2 3.78Å; F177-V180 WeakPolarHBondContact O-CB 3.48Å; F177-V180 PolarHBondContact O-N 2.74Å; E178-V180 PolarHBondContact O-N 3.14Å; V180-L183 PolarHBondContact O-N 3.06Å; V180-S184 PolarHBondContact O-N 3.29Å
181	Q	87	Confident	88.3	Confident	57 Å²	57	58.4 Å²	58.4	27%	0.266	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-43.2	173.6	-175.3	59	45	0	0	110.8	E178 D179 L183 S184 D185	E178-Q181 WeakPolarHBondContact O-CB 3.36Å; E178-Q181 PolarHBondContact O-N 2.86Å; D179-Q181 VanDerWaalsContact C-N 3.35Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; Q181-L183 PolarHBondContact O-N 3.21Å; Q181-S184 WeakPolarHBondContact O-CB 3.45Å; Q181-S184 PolarHBondContact O-N 3.25Å; Q181-D185 PolarHBondContact NE2-OD1 3Å; Q181-D185 PolarHBondContact O-N 3.25Å
182	R	89	Confident	89	Confident	133 Å²	133	55.4 Å²	55.4	50%	0.502	26%	0.258	S	S	.	.	H	α-helix	trans	-60.6	-41.9	176	-63.3	178.8	-173.9	159.6	-2.8	111.9	E178 D179 D185 E186	E178-R182 VanDerWaalsContact CD-NH2 3.26Å; E178-R182 PolarHBondContact O-N 3.3Å; E178-R182 IonicContact OE1-CZ 3.63Å; E178-R182 IonicContact OE1-NE 3.58Å; E178-R182 IonicContact OE1-NH2 2.82Å; E178-R182 PolarHBondContact OE1-NH2 2.82Å; E178-R182 IonicContact OE2-NH2 3.96Å; D179-R182 PolarHBondContact O-N 3.37Å; D179-R182 IonicContact OD1-CZ 2.78Å; D179-R182 IonicContact OD1-NE 3.56Å; D179-R182 IonicContact OD1-NH1 3.93Å; D179-R182 PolarHBondContact OD1-NH1 3.43Å; R182-D185 PolarHBondContact O-N 2.91Å; R182-E186 PolarHBondContact O-N 3.01Å
183	L	90.4	Very high	89.4	Confident	11 Å²	11	53.4 Å²	53.4	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-41.7	174.2	-75.5	176	0	0	0	112.7	V126 T129 Q130 L145 L148 D179 V180 Q181 D185 E186 L187	V126-L183 HydrophobicContact CB-CD1 3.99Å; V126-L183 HydrophobicContact CG1-CD1 3.81Å; V126-L183 HydrophobicContact CG1-CG 4.41Å; V126-L183 HydrophobicContact CG2-CD1 3.91Å; T129-L183 HydrophobicContact CG2-CD1 4.11Å; T129-L183 HydrophobicContact CG2-CD2 4.39Å; Q130-L183 HydrophobicContact CB-CD2 3.84Å; Q130-L183 HydrophobicContact CG-CD2 4.39Å; L145-L183 HydrophobicContact CD1-CB 3.95Å; L148-L183 HydrophobicContact CD1-CD1 4.24Å; D179-L183 WeakPolarHBondContact O-CG 3.22Å; D179-L183 PolarHBondContact O-N 3Å; V180-L183 PolarHBondContact O-N 3.06Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; Q181-L183 PolarHBondContact O-N 3.21Å; L183-D185 VanDerWaalsContact C-N 3.3Å; L183-D185 PolarHBondContact O-N 3.1Å; L183-E186 PolarHBondContact O-N 2.84Å; L183-L187 WeakPolarHBondContact O-CB 3.38Å; L183-L187 PolarHBondContact O-N 3.32Å
184	S	91.2	Very high	89.8	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-41.7	174.8	175.9	0	0	0	0	111.4	V180 Q181 A188 K242	V180-S184 PolarHBondContact O-N 3.29Å; Q181-S184 WeakPolarHBondContact O-CB 3.45Å; Q181-S184 PolarHBondContact O-N 3.25Å; S184-A188 VanDerWaalsContact O-CB 3.29Å; S184-A188 WeakPolarHBondContact O-CB 3.48Å; S184-A188 PolarHBondContact O-N 3.32Å; S184-K242 PolarHBondContact OG-NZ 3.15Å
185	D	91.5	Very high	90.3	Very high	78 Å²	78	48 Å²	48	42%	0.417	22%	0.223	S	C	.	.	H	α-helix	trans	-68.6	-39.5	178.5	-67	-24.2	0	0	0	112	Q181 R182 L183 A188 K189	Q181-D185 PolarHBondContact NE2-OD1 3Å; Q181-D185 PolarHBondContact O-N 3.25Å; R182-D185 PolarHBondContact O-N 2.91Å; L183-D185 VanDerWaalsContact C-N 3.3Å; L183-D185 PolarHBondContact O-N 3.1Å; D185-A188 PolarHBondContact O-N 2.91Å; D185-K189 WeakPolarHBondContact O-CG 3.34Å; D185-K189 PolarHBondContact O-N 3.15Å
186	E	91.4	Very high	90.8	Very high	64 Å²	64	48.4 Å²	48.4	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-68.4	-44.3	177.4	-168.3	53.3	-139.2	0	0	112	T133 R182 L183 A188 K189 Q190	T133-E186 HydrophobicContact CG2-CG 4.31Å; R182-E186 PolarHBondContact O-N 3.01Å; L183-E186 PolarHBondContact O-N 2.84Å; E186-A188 VanDerWaalsContact C-N 3.29Å; E186-A188 PolarHBondContact O-N 3.43Å; E186-K189 WeakPolarHBondContact O-CB 3.27Å; E186-K189 PolarHBondContact O-N 2.96Å; E186-K189 IonicContact OE2-NZ 3.77Å; E186-K189 PolarHBondContact OE2-NZ 3.48Å; E186-Q190 PolarHBondContact O-N 3.01Å; E186-Q190 VanDerWaalsContact O-N 3.08Å; E186-Q190 PolarHBondContact OE1-NE2 3.2Å
187	L	93.3	Very high	91	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-57	-46.9	172.2	-177.8	66.3	0	0	0	110.1	T133 L138 A141 H142 L145 L183 K189 Q190 L191	T133-L187 HydrophobicContact CG2-CD1 4.38Å; L138-L187 HydrophobicContact CB-CD1 4.49Å; L138-L187 HydrophobicContact CD2-CD1 3.94Å; A141-L187 HydrophobicContact CB-CD1 4.23Å; H142-L187 HydrophobicContact CB-CD2 4Å; L145-L187 HydrophobicContact CD2-CB 4.48Å; L145-L187 HydrophobicContact CD2-CD2 3.66Å; L183-L187 WeakPolarHBondContact O-CB 3.38Å; L183-L187 PolarHBondContact O-N 3.32Å; L187-K189 VanDerWaalsContact C-N 3.33Å; L187-K189 PolarHBondContact O-N 3.37Å; L187-Q190 PolarHBondContact O-N 3.37Å; L187-Q190 VanDerWaalsContact O-N 3.13Å; L187-L191 WeakPolarHBondContact O-CG 3.25Å; L187-L191 PolarHBondContact O-N 3.44Å
188	A	93	Very high	91.3	Very high	7 Å²	7	50.3 Å²	50.3	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-58	-43.9	178	0	0	0	0	0	111.8	S184 D185 E186 Q190 L191 W192 W244	S184-A188 VanDerWaalsContact O-CB 3.29Å; S184-A188 WeakPolarHBondContact O-CB 3.48Å; S184-A188 PolarHBondContact O-N 3.32Å; D185-A188 PolarHBondContact O-N 2.91Å; E186-A188 VanDerWaalsContact C-N 3.29Å; E186-A188 PolarHBondContact O-N 3.43Å; A188-Q190 VanDerWaalsContact C-N 3.33Å; A188-Q190 PolarHBondContact O-N 2.74Å; A188-L191 WeakPolarHBondContact O-CB 3.41Å; A188-L191 PolarHBondContact O-N 2.91Å; A188-W192 HydrophobicContact CB-CZ2 4.23Å; A188-W192 PolarHBondContact O-N 3.36Å; A188-W192 PolarHBondContact O-NE1 2.98Å; A188-W192 VanDerWaalsContact O-NE1 3.09Å; A188-W244 HydrophobicContact CB-CH2 4.42Å; A188-W244 HydrophobicContact CB-CZ2 3.93Å
189	K	93.3	Very high	91.4	Very high	117 Å²	117	46.6 Å²	46.6	51%	0.509	21%	0.211	S	C	.	.	H	α-helix	trans	-57.3	-44.5	174.8	-70.9	177.4	-150.1	154.4	0	112.1	D185 E186 L187 L191 W192 M193	D185-K189 WeakPolarHBondContact O-CG 3.34Å; D185-K189 PolarHBondContact O-N 3.15Å; E186-K189 WeakPolarHBondContact O-CB 3.27Å; E186-K189 PolarHBondContact O-N 2.96Å; E186-K189 IonicContact OE2-NZ 3.77Å; E186-K189 PolarHBondContact OE2-NZ 3.48Å; L187-K189 VanDerWaalsContact C-N 3.33Å; L187-K189 PolarHBondContact O-N 3.37Å; K189-L191 PolarHBondContact O-N 2.87Å; K189-W192 PolarHBondContact O-N 3.19Å; K189-M193 WeakPolarHBondContact O-CB 3.32Å; K189-M193 PolarHBondContact O-N 3Å
190	Q	93.3	Very high	91.6	Very high	57 Å²	57	46.8 Å²	46.8	27%	0.266	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-41.9	176.6	-62.6	-54.9	-39.4	0	0	111.7	T133 L138 E186 L187 A188 W192 M193 V194	T133-Q190 HydrophobicContact CG2-CG 3.71Å; L138-Q190 HydrophobicContact CD2-CB 3.92Å; E186-Q190 PolarHBondContact O-N 3.01Å; E186-Q190 VanDerWaalsContact O-N 3.08Å; E186-Q190 PolarHBondContact OE1-NE2 3.2Å; L187-Q190 PolarHBondContact O-N 3.37Å; L187-Q190 VanDerWaalsContact O-N 3.13Å; A188-Q190 VanDerWaalsContact C-N 3.33Å; A188-Q190 PolarHBondContact O-N 2.74Å; Q190-W192 PolarHBondContact O-N 3.14Å; Q190-M193 PolarHBondContact O-N 3.48Å; Q190-V194 WeakPolarHBondContact O-CG2 3.32Å; Q190-V194 PolarHBondContact O-N 3.08Å; Q190-V194 VanDerWaalsContact O-N 3.08Å
191	L	94.4	Very high	91.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-47.1	174.3	-58.9	-179.4	0	0	0	111.3	L138 L187 A188 K189 M193 V194 L195 V212 I215 W244	L138-L191 HydrophobicContact CD1-CD2 4.12Å; L187-L191 WeakPolarHBondContact O-CG 3.25Å; L187-L191 PolarHBondContact O-N 3.44Å; A188-L191 WeakPolarHBondContact O-CB 3.41Å; A188-L191 PolarHBondContact O-N 2.91Å; K189-L191 PolarHBondContact O-N 2.87Å; L191-M193 PolarHBondContact O-N 2.96Å; L191-V194 PolarHBondContact O-N 3.25Å; L191-L195 WeakPolarHBondContact O-CD1 3.38Å; L191-L195 WeakPolarHBondContact O-CG 3.5Å; L191-L195 PolarHBondContact O-N 3.49Å; L191-V212 HydrophobicContact CB-CG1 4.11Å; L191-V212 HydrophobicContact CD2-CB 4.2Å; L191-V212 HydrophobicContact CD2-CG1 3.99Å; L191-V212 HydrophobicContact CD2-CG2 3.81Å; L191-I215 HydrophobicContact CD1-CG2 3.91Å; L191-I215 HydrophobicContact CD2-CD1 3.88Å; L191-I215 HydrophobicContact CD2-CG2 4.49Å; L191-W244 HydrophobicContact CD1-CE3 3.8Å; L191-W244 HydrophobicContact CD1-CH2 4.35Å; L191-W244 HydrophobicContact CD1-CZ3 3.57Å
192	W	95.3	Very high	91.9	Very high	23 Å²	23	45 Å²	45	9%	0.087	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-39.1	179.7	-49.8	137.2	0	0	0	112	A188 K189 Q190 V194 L195 Q196 I216 W244 K247 M248 V251	A188-W192 HydrophobicContact CB-CZ2 4.23Å; A188-W192 PolarHBondContact O-N 3.36Å; A188-W192 PolarHBondContact O-NE1 2.98Å; A188-W192 VanDerWaalsContact O-NE1 3.09Å; K189-W192 PolarHBondContact O-N 3.19Å; Q190-W192 PolarHBondContact O-N 3.14Å; W192-V194 VanDerWaalsContact C-N 3.35Å; W192-V194 PolarHBondContact O-N 3.39Å; W192-L195 HydrophobicContact CE3-CD1 3.56Å; W192-L195 HydrophobicContact CZ3-CD1 3.72Å; W192-L195 PolarHBondContact O-N 3.31Å; W192-Q196 WeakPolarHBondContact O-CB 3.28Å; W192-Q196 VanDerWaalsContact O-CG 3.32Å; W192-Q196 WeakPolarHBondContact O-CG 3.38Å; W192-Q196 PolarHBondContact O-N 3.23Å; W192-I216 HydrophobicContact CZ3-CD1 4.36Å; W192-W244 HydrophobicContact CH2-CB 4.02Å; W192-W244 HydrophobicContact CH2-CD2 4.46Å; W192-W244 HydrophobicContact CH2-CG 4.02Å; W192-W244 HydrophobicContact CZ2-CD2 4.45Å; W192-W244 HydrophobicContact CZ2-CG 4.18Å; W192-K247 HydrophobicContact CD2-CG 4.43Å; W192-K247 HydrophobicContact CH2-CB 4.02Å; W192-K247 HydrophobicContact CH2-CD 4.27Å; W192-K247 HydrophobicContact CH2-CG 4.03Å; W192-K247 HydrophobicContact CZ2-CB 4.21Å; W192-K247 HydrophobicContact CZ2-CD 3.61Å; W192-K247 HydrophobicContact CZ2-CG 3.84Å; W192-K247 HydrophobicContact CZ3-CB 4.48Å; W192-K247 HydrophobicContact CZ3-CG 4.38Å; W192-M248 HydrophobicContact CZ3-CB 4.09Å; W192-V251 HydrophobicContact CB-CG2 4.27Å; W192-V251 HydrophobicContact CD2-CG2 4.21Å; W192-V251 HydrophobicContact CE3-CG2 4.03Å; W192-V251 HydrophobicContact CG-CG2 4.28Å
193	M	92.6	Very high	92	Very high	72 Å²	72	44.4 Å²	44.4	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-62.5	-40.6	176.9	-175.1	177.7	175.9	0	0	112.2	K189 Q190 L191 R197	K189-M193 WeakPolarHBondContact O-CB 3.32Å; K189-M193 PolarHBondContact O-N 3Å; Q190-M193 PolarHBondContact O-N 3.48Å; L191-M193 PolarHBondContact O-N 2.96Å; M193-R197 VanDerWaalsContact CE-CZ 3.5Å; M193-R197 PolarHBondContact O-N 2.96Å
194	V	92.4	Very high	92	Very high	12 Å²	12	54 Å²	54	7%	0.073	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-40.7	174.9	175.5	0	0	0	0	111	L138 Q190 L191 W192 R197 S198 T201 M208 V212	L138-V194 HydrophobicContact CD1-CG2 4.33Å; Q190-V194 WeakPolarHBondContact O-CG2 3.32Å; Q190-V194 PolarHBondContact O-N 3.08Å; Q190-V194 VanDerWaalsContact O-N 3.08Å; L191-V194 PolarHBondContact O-N 3.25Å; W192-V194 VanDerWaalsContact C-N 3.35Å; W192-V194 PolarHBondContact O-N 3.39Å; V194-R197 CarbonylContact O-C 3.54Å; V194-R197 PolarHBondContact O-N 2.92Å; V194-S198 PolarHBondContact O-N 2.97Å; V194-T201 HydrophobicContact CG1-CG2 4.06Å; V194-M208 HydrophobicContact CG1-CG 4.1Å; V194-M208 HydrophobicContact CG1-SD 4.15Å; V194-M208 HydrophobicContact CG2-CE 3.73Å; V194-M208 HydrophobicContact CG2-CG 4.42Å; V194-M208 HydrophobicContact CG2-SD 3.94Å; V194-V212 HydrophobicContact CB-CG2 4Å; V194-V212 HydrophobicContact CG1-CG2 3.8Å; V194-V212 HydrophobicContact CG2-CG2 4.41Å
195	L	93.2	Very high	91.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-38.5	177.7	-72.4	160.7	0	0	0	112.7	L191 W192 R197 S198 L209 V212 I216 M248 V251 L252	L191-L195 WeakPolarHBondContact O-CD1 3.38Å; L191-L195 WeakPolarHBondContact O-CG 3.5Å; L191-L195 PolarHBondContact O-N 3.49Å; W192-L195 HydrophobicContact CE3-CD1 3.56Å; W192-L195 HydrophobicContact CZ3-CD1 3.72Å; W192-L195 PolarHBondContact O-N 3.31Å; L195-R197 PolarHBondContact O-N 3.24Å; L195-S198 WeakPolarHBondContact O-CB 3.45Å; L195-S198 PolarHBondContact O-N 3.35Å; L195-S198 PolarHBondContact O-OG 3Å; L195-L209 HydrophobicContact CD2-CD1 3.96Å; L195-V212 HydrophobicContact CD1-CG1 3.9Å; L195-V212 HydrophobicContact CD2-CG1 4.21Å; L195-V212 HydrophobicContact CG-CG1 3.91Å; L195-I216 HydrophobicContact CD1-CD1 4.11Å; L195-M248 HydrophobicContact CD1-CB 4.2Å; L195-M248 HydrophobicContact CD1-CG 3.63Å; L195-M248 HydrophobicContact CD2-CG 3.85Å; L195-M248 HydrophobicContact CD2-SD 4.44Å; L195-M248 HydrophobicContact CG-CG 4.38Å; L195-V251 HydrophobicContact CB-CG1 3.92Å; L195-L252 HydrophobicContact CB-CD2 4.29Å; L195-L252 HydrophobicContact CD2-CD2 4.07Å; L195-L252 HydrophobicContact CD2-CG 4.45Å
196	Q	93.1	Very high	91.8	Very high	115 Å²	115	56 Å²	56	54%	0.537	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-28.8	172.9	-76.4	176.7	-20	0	0	112.5	W192 V251 T255	W192-Q196 WeakPolarHBondContact O-CB 3.28Å; W192-Q196 VanDerWaalsContact O-CG 3.32Å; W192-Q196 WeakPolarHBondContact O-CG 3.38Å; W192-Q196 PolarHBondContact O-N 3.23Å; Q196-V251 HydrophobicContact CG-CG1 3.63Å; Q196-T255 WeakPolarHBondContact CA-OG1 3.41Å; Q196-T255 WeakPolarHBondContact O-CG2 3.43Å
197	R	90.7	Very high	91.8	Very high	148 Å²	148	57.3 Å²	57.3	56%	0.558	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	13.2	176.9	-62.9	178.3	-178.8	-175.8	-0.1	112.8	M193 V194 L195 M199 V200 T201	M193-R197 VanDerWaalsContact CE-CZ 3.5Å; M193-R197 PolarHBondContact O-N 2.96Å; V194-R197 CarbonylContact O-C 3.54Å; V194-R197 PolarHBondContact O-N 2.92Å; L195-R197 PolarHBondContact O-N 3.24Å; R197-M199 PolarHBondContact O-N 3.35Å; R197-V200 PolarHBondContact O-N 3.29Å; R197-T201 PolarHBondContact O-N 3.33Å; R197-T201 PolarHBondContact O-OG1 2.77Å
198	S	91.1	Very high	91.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-50.7	-38.4	-169.3	51.4	0	0	0	0	114.4	V194 L195 T201 V202 M297	V194-S198 PolarHBondContact O-N 2.97Å; L195-S198 WeakPolarHBondContact O-CB 3.45Å; L195-S198 PolarHBondContact O-N 3.35Å; L195-S198 PolarHBondContact O-OG 3Å; S198-T201 PolarHBondContact O-N 3.4Å; S198-V202 WeakPolarHBondContact O-CB 3.42Å; S198-V202 WeakPolarHBondContact O-CG1 3.44Å; S198-V202 PolarHBondContact O-N 3.12Å; S198-M297 VanDerWaalsContact CB-CE 3.48Å
199	M	88.9	Confident	91.7	Very high	7 Å²	7	59.9 Å²	59.9	3%	0.034	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-35	177.9	-67.7	-76.1	179.9	0	0	113.7	R197 R203 R259 D289 V292 V293 M297 F311 Y315	R197-M199 PolarHBondContact O-N 3.35Å; M199-R203 WeakPolarHBondContact O-CG 3.44Å; M199-R259 VanDerWaalsContact CB-NH1 3.25Å; M199-R259 VanDerWaalsContact CG-NH1 3.28Å; M199-D289 HydrophobicContact CE-CB 4.25Å; M199-D289 HydrophobicContact SD-CB 4.3Å; M199-V292 HydrophobicContact SD-CG1 4.48Å; M199-V293 HydrophobicContact CE-CG2 3.39Å; M199-V293 HydrophobicContact SD-CG2 4.17Å; M199-M297 HydrophobicContact CE-SD 4.36Å; M199-F311 HydrophobicContact CE-CD1 4.1Å; M199-F311 HydrophobicContact CE-CE1 3.93Å; M199-Y315 HydrophobicContact CE-CE2 4.06Å; M199-Y315 WeakPolarHBondContact CE-OH 3.42Å
200	V	90.3	Very high	91.7	Very high	76 Å²	76	56.5 Å²	56.5	46%	0.461	27%	0.268	S	S	.	.	H	α-helix	trans	-79.9	-41.8	174.9	-179.3	0	0	0	0	109.7	R197 R203 R204	R197-V200 PolarHBondContact O-N 3.29Å; V200-R203 PolarHBondContact O-N 2.76Å; V200-R204 PolarHBondContact O-N 3.41Å; V200-R204 VanDerWaalsContact O-N 3.12Å
201	T	90.1	Very high	91.6	Very high	19 Å²	19	55 Å²	55	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-48.4	178.5	-53.4	0	0	0	0	110.9	V194 R197 S198 R203 R204 D205 M208 L209	V194-T201 HydrophobicContact CG1-CG2 4.06Å; R197-T201 PolarHBondContact O-N 3.33Å; R197-T201 PolarHBondContact O-OG1 2.77Å; S198-T201 PolarHBondContact O-N 3.4Å; T201-R203 PolarHBondContact O-N 2.58Å; T201-R204 PolarHBondContact O-N 3.43Å; T201-R204 VanDerWaalsContact O-N 3.11Å; T201-D205 CarbonylContact O-C 3.13Å; T201-D205 WeakPolarHBondContact O-CA 3.49Å; T201-D205 PolarHBondContact O-N 3.41Å; T201-D205 VanDerWaalsContact O-O 3.12Å; T201-M208 HydrophobicContact CG2-CB 4Å; T201-M208 HydrophobicContact CG2-CG 4.45Å; T201-M208 HydrophobicContact CG2-SD 4.23Å; T201-L209 HydrophobicContact CG2-CB 4.4Å
202	V	92.1	Very high	91.6	Very high	1 Å²	1	55 Å²	55	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-27.1	-178.8	79.5	0	0	0	0	113	S198 P206 L209 V292 L296 M297	S198-V202 WeakPolarHBondContact O-CB 3.42Å; S198-V202 WeakPolarHBondContact O-CG1 3.44Å; S198-V202 PolarHBondContact O-N 3.12Å; V202-P206 WeakPolarHBondContact O-CG 3.49Å; V202-L209 HydrophobicContact CB-CD2 4.18Å; V202-L209 HydrophobicContact CG2-CD2 4.2Å; V202-V292 HydrophobicContact CG1-CG1 3.74Å; V202-L296 HydrophobicContact CG1-CB 4.38Å; V202-L296 HydrophobicContact CG2-CB 3.72Å; V202-M297 HydrophobicContact CG2-CB 4.36Å
203	R	90.8	Very high	91.6	Very high	121 Å²	121	54.1 Å²	54.1	46%	0.457	26%	0.261	S	S	.	.	H	α-helix	trans	-79.2	-32.4	175.9	-71.5	176.2	177.5	155.8	2.8	112.8	M199 V200 T201 D289 V292 L296	M199-R203 WeakPolarHBondContact O-CG 3.44Å; V200-R203 PolarHBondContact O-N 2.76Å; T201-R203 PolarHBondContact O-N 2.58Å; R203-D289 IonicContact NH2-OD1 3.73Å; R203-V292 HydrophobicContact CG-CG1 4.25Å; R203-L296 HydrophobicContact CG-CD1 4.25Å
204	R	90.9	Very high	91.7	Very high	214 Å²	214	56.4 Å²	56.4	81%	0.808	27%	0.265	S	S	*	.	H	α-helix	trans	-93.7	-49.1	-175.9	-70.2	-174.1	175.5	-169.7	-1.1	112.7	V200 T201	V200-R204 PolarHBondContact O-N 3.41Å; V200-R204 VanDerWaalsContact O-N 3.12Å; T201-R204 PolarHBondContact O-N 3.43Å; T201-R204 VanDerWaalsContact O-N 3.11Å
205	D	88.6	Confident	91.8	Very high	67 Å²	67	55.9 Å²	55.9	36%	0.358	26%	0.262	S	S	.	.			trans	-148.8	90	-178.2	-179.1	13.1	0	0	0	111.2	T201 T207 M208	T201-D205 CarbonylContact O-C 3.13Å; T201-D205 WeakPolarHBondContact O-CA 3.49Å; T201-D205 PolarHBondContact O-N 3.41Å; T201-D205 VanDerWaalsContact O-O 3.12Å; D205-T207 PolarHBondContact O-N 3.4Å; D205-T207 WeakPolarHBondContact OD1-CB 3.41Å; D205-T207 PolarHBondContact OD1-N 2.74Å; D205-T207 PolarHBondContact OD1-OG1 3.02Å; D205-T207 PolarHBondContact OD2-OG1 3.34Å; D205-M208 PolarHBondContact O-N 2.89Å
206	P	89.9	Confident	91.9	Very high	55 Å²	55	55.9 Å²	55.9	36%	0.357	26%	0.262	S	S	.	.	H	α-helix	trans	-59	-25.5	174.8	-18.8	26.9	0	0	0	113.7	V202 M208 L209 V210	V202-P206 WeakPolarHBondContact O-CG 3.49Å; P206-M208 VanDerWaalsContact C-N 3.31Å; P206-M208 PolarHBondContact O-N 3.5Å; P206-L209 PolarHBondContact O-N 2.92Å; P206-V210 WeakPolarHBondContact O-CG2 3.5Å; P206-V210 PolarHBondContact O-N 2.99Å
207	T	90.4	Very high	92	Very high	91 Å²	91	51.4 Å²	51.4	56%	0.558	24%	0.241	S	C	*	.	H	α-helix	trans	-69.6	-31.8	-173.4	73.1	0	0	0	0	112	D205 V210 S211	D205-T207 PolarHBondContact O-N 3.4Å; D205-T207 WeakPolarHBondContact OD1-CB 3.41Å; D205-T207 PolarHBondContact OD1-N 2.74Å; D205-T207 PolarHBondContact OD1-OG1 3.02Å; D205-T207 PolarHBondContact OD2-OG1 3.34Å; T207-V210 PolarHBondContact O-N 2.84Å; T207-S211 WeakPolarHBondContact O-CB 3.05Å; T207-S211 PolarHBondContact O-N 3.48Å; T207-S211 PolarHBondContact O-OG 3.48Å
208	M	90.8	Very high	92.1	Very high	63 Å²	63	49.4 Å²	49.4	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-43.8	173.4	-165.1	-176.5	-152.5	0	0	111.3	V194 T201 D205 P206 S211 V212	V194-M208 HydrophobicContact CG1-CG 4.1Å; V194-M208 HydrophobicContact CG1-SD 4.15Å; V194-M208 HydrophobicContact CG2-CE 3.73Å; V194-M208 HydrophobicContact CG2-CG 4.42Å; V194-M208 HydrophobicContact CG2-SD 3.94Å; T201-M208 HydrophobicContact CG2-CB 4Å; T201-M208 HydrophobicContact CG2-CG 4.45Å; T201-M208 HydrophobicContact CG2-SD 4.23Å; D205-M208 PolarHBondContact O-N 2.89Å; P206-M208 VanDerWaalsContact C-N 3.31Å; P206-M208 PolarHBondContact O-N 3.5Å; M208-S211 WeakPolarHBondContact O-CB 3.28Å; M208-S211 PolarHBondContact O-N 3.4Å; M208-V212 WeakPolarHBondContact O-CG2 3.46Å; M208-V212 PolarHBondContact O-N 3.01Å
209	L	92.5	Very high	92.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-43.4	177.8	-176.5	61.7	0	0	0	111.6	L195 T201 V202 P206 S211 V212 V213 M297 C300 F301	L195-L209 HydrophobicContact CD2-CD1 3.96Å; T201-L209 HydrophobicContact CG2-CB 4.4Å; V202-L209 HydrophobicContact CB-CD2 4.18Å; V202-L209 HydrophobicContact CG2-CD2 4.2Å; P206-L209 PolarHBondContact O-N 2.92Å; L209-S211 VanDerWaalsContact C-N 3.25Å; L209-S211 PolarHBondContact O-N 3.42Å; L209-V212 PolarHBondContact O-N 2.87Å; L209-V213 WeakPolarHBondContact O-CG2 3.38Å; L209-V213 PolarHBondContact O-N 2.91Å; L209-M297 HydrophobicContact CD2-CE 4.04Å; L209-M297 HydrophobicContact CD2-CG 4.2Å; L209-C300 HydrophobicContact CD2-CB 3.86Å; L209-C300 HydrophobicContact CG-CB 4.1Å; L209-F301 HydrophobicContact CD2-CE2 4.07Å; L209-F301 HydrophobicContact CG-CE2 4.45Å
210	V	93.6	Very high	92.4	Very high	46 Å²	46	50.2 Å²	50.2	28%	0.279	24%	0.237	S	C	.	.	H	α-helix	trans	-57.5	-41.6	173.3	171.5	0	0	0	0	110.9	P206 T207 V213 R214 C300	P206-V210 WeakPolarHBondContact O-CG2 3.5Å; P206-V210 PolarHBondContact O-N 2.99Å; T207-V210 PolarHBondContact O-N 2.84Å; V210-V213 PolarHBondContact O-N 2.93Å; V210-R214 HydrophobicContact CG1-CG 4.19Å; V210-R214 WeakPolarHBondContact O-CB 3.39Å; V210-R214 WeakPolarHBondContact O-CG 3.42Å; V210-R214 PolarHBondContact O-N 3.41Å; V210-C300 HydrophobicContact CG2-CB 3.88Å
211	S	92.9	Very high	92.5	Very high	26 Å²	26	51.4 Å²	51.4	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-45.7	178.3	-64.3	0	0	0	0	111.8	L139 T207 M208 L209 R214 I215	L139-S211 WeakPolarHBondContact CD1-OG 3.12Å; T207-S211 WeakPolarHBondContact O-CB 3.05Å; T207-S211 PolarHBondContact O-N 3.48Å; T207-S211 PolarHBondContact O-OG 3.48Å; M208-S211 WeakPolarHBondContact O-CB 3.28Å; M208-S211 PolarHBondContact O-N 3.4Å; L209-S211 VanDerWaalsContact C-N 3.25Å; L209-S211 PolarHBondContact O-N 3.42Å; S211-R214 PolarHBondContact O-N 3.01Å; S211-I215 VanDerWaalsContact O-CG1 3.32Å; S211-I215 WeakPolarHBondContact O-CG1 3.44Å; S211-I215 PolarHBondContact O-N 3.32Å
212	V	94.4	Very high	92.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-48.9	174.9	171.2	0	0	0	0	111.6	L138 L191 V194 L195 M208 L209 R214 I215 I216	L138-V212 HydrophobicContact CD1-CG2 3.85Å; L191-V212 HydrophobicContact CB-CG1 4.11Å; L191-V212 HydrophobicContact CD2-CB 4.2Å; L191-V212 HydrophobicContact CD2-CG1 3.99Å; L191-V212 HydrophobicContact CD2-CG2 3.81Å; V194-V212 HydrophobicContact CB-CG2 4Å; V194-V212 HydrophobicContact CG1-CG2 3.8Å; V194-V212 HydrophobicContact CG2-CG2 4.41Å; L195-V212 HydrophobicContact CD1-CG1 3.9Å; L195-V212 HydrophobicContact CD2-CG1 4.21Å; L195-V212 HydrophobicContact CG-CG1 3.91Å; M208-V212 WeakPolarHBondContact O-CG2 3.46Å; M208-V212 PolarHBondContact O-N 3.01Å; L209-V212 PolarHBondContact O-N 2.87Å; V212-R214 VanDerWaalsContact C-N 3.3Å; V212-R214 PolarHBondContact O-N 3.29Å; V212-I215 WeakPolarHBondContact O-CB 3.45Å; V212-I215 PolarHBondContact O-N 2.95Å; V212-I216 HydrophobicContact CG1-CD1 3.87Å; V212-I216 WeakPolarHBondContact O-CG1 3.29Å; V212-I216 PolarHBondContact O-N 2.87Å; V212-I216 VanDerWaalsContact O-N 3.08Å
213	V	94.3	Very high	92.5	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-36.9	-179.9	176.6	0	0	0	0	111.4	L209 V210 I216 E217 F301 P302	L209-V213 WeakPolarHBondContact O-CG2 3.38Å; L209-V213 PolarHBondContact O-N 2.91Å; V210-V213 PolarHBondContact O-N 2.93Å; V213-I216 PolarHBondContact O-N 3.09Å; V213-E217 WeakPolarHBondContact O-CB 3.28Å; V213-E217 PolarHBondContact O-N 3.11Å; V213-F301 HydrophobicContact CG1-CD1 4Å; V213-F301 HydrophobicContact CG1-CE1 4.49Å; V213-F301 HydrophobicContact CG2-CD1 3.77Å; V213-F301 HydrophobicContact CG2-CE1 3.52Å; V213-F301 HydrophobicContact CG2-CE2 4.39Å; V213-F301 HydrophobicContact CG2-CG 4.33Å; V213-F301 HydrophobicContact CG2-CZ 3.87Å; V213-P302 HydrophobicContact CG1-CG 4.44Å
214	R	94.4	Very high	92.5	Very high	120 Å²	120	52.3 Å²	52.3	45%	0.453	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-38.5	175.1	-76.3	173.6	73.3	-172.5	5.7	112.7	L139 V210 S211 V212 R218	L139-R214 HydrophobicContact CD2-CB 4.41Å; V210-R214 HydrophobicContact CG1-CG 4.19Å; V210-R214 WeakPolarHBondContact O-CB 3.39Å; V210-R214 WeakPolarHBondContact O-CG 3.42Å; V210-R214 PolarHBondContact O-N 3.41Å; S211-R214 PolarHBondContact O-N 3.01Å; V212-R214 VanDerWaalsContact C-N 3.3Å; V212-R214 PolarHBondContact O-N 3.29Å; R214-R218 VanDerWaalsContact O-CG 3.29Å; R214-R218 WeakPolarHBondContact O-CG 3.48Å; R214-R218 PolarHBondContact O-N 3.4Å; R214-R218 VanDerWaalsContact O-N 3.08Å
215	I	95	Very high	92.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-49.1	175	-69.4	164.4	0	0	0	109.4	L138 L139 H142 L191 S211 V212 E217 R218 E219 W244	L138-I215 HydrophobicContact CB-CD1 3.81Å; L138-I215 WeakPolarHBondContact O-CD1 3.31Å; L139-I215 HydrophobicContact CD2-CD1 4.26Å; L139-I215 HydrophobicContact CD2-CG1 3.79Å; H142-I215 HydrophobicContact CB-CD1 3.99Å; H142-I215 HydrophobicContact CB-CG1 3.9Å; H142-I215 HydrophobicContact CB-CG2 4.22Å; L191-I215 HydrophobicContact CD1-CG2 3.91Å; L191-I215 HydrophobicContact CD2-CD1 3.88Å; L191-I215 HydrophobicContact CD2-CG2 4.49Å; S211-I215 VanDerWaalsContact O-CG1 3.32Å; S211-I215 WeakPolarHBondContact O-CG1 3.44Å; S211-I215 PolarHBondContact O-N 3.32Å; V212-I215 WeakPolarHBondContact O-CB 3.45Å; V212-I215 PolarHBondContact O-N 2.95Å; I215-E217 PolarHBondContact O-N 3.45Å; I215-R218 WeakPolarHBondContact O-CB 3.46Å; I215-R218 PolarHBondContact O-N 2.89Å; I215-R218 VanDerWaalsContact O-N 3.1Å; I215-E219 HydrophobicContact CG2-CG 4.48Å; I215-E219 WeakPolarHBondContact O-CG 3.17Å; I215-E219 PolarHBondContact O-N 3.48Å; I215-W244 HydrophobicContact CG2-CE3 4.47Å; I215-W244 HydrophobicContact CG2-CZ3 3.99Å
216	I	95.1	Very high	92.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-46.3	179.4	-65.4	162.4	0	0	0	111.2	W192 L195 V212 V213 R218 E219 E220 W244 K245 M248	W192-I216 HydrophobicContact CZ3-CD1 4.36Å; L195-I216 HydrophobicContact CD1-CD1 4.11Å; V212-I216 HydrophobicContact CG1-CD1 3.87Å; V212-I216 WeakPolarHBondContact O-CG1 3.29Å; V212-I216 PolarHBondContact O-N 2.87Å; V212-I216 VanDerWaalsContact O-N 3.08Å; V213-I216 PolarHBondContact O-N 3.09Å; I216-R218 VanDerWaalsContact C-N 3.26Å; I216-R218 PolarHBondContact O-N 3.43Å; I216-E219 PolarHBondContact O-N 3.43Å; I216-E220 HydrophobicContact CG2-CG 4.47Å; I216-E220 WeakPolarHBondContact O-CG 3.26Å; I216-E220 PolarHBondContact O-N 3.02Å; I216-W244 HydrophobicContact CG1-CB 4.45Å; I216-W244 HydrophobicContact CG2-CB 4.28Å; I216-K245 HydrophobicContact CG2-CB 4.14Å; I216-M248 HydrophobicContact CD1-CB 3.91Å; I216-M248 HydrophobicContact CD1-CG 3.8Å; I216-M248 HydrophobicContact CD1-SD 3.68Å
217	E	94.4	Very high	92.3	Very high	22 Å²	22	47.8 Å²	47.8	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-33	176.2	-92.8	-73.6	104.8	0	0	113.3	V213 I215 K221 P302 H304 Y305	V213-E217 WeakPolarHBondContact O-CB 3.28Å; V213-E217 PolarHBondContact O-N 3.11Å; I215-E217 PolarHBondContact O-N 3.45Å; E217-K221 VanDerWaalsContact O-CG 3.28Å; E217-K221 WeakPolarHBondContact O-CG 3.44Å; E217-K221 PolarHBondContact O-N 2.75Å; E217-K221 IonicContact OE2-NZ 2.71Å; E217-P302 HydrophobicContact CG-CG 4Å; E217-H304 IonicContact OE1-NE2 3.85Å; E217-H304 IonicContact OE2-CE1 2.66Å; E217-Y305 PolarHBondContact OE1-OH 2.8Å
218	R	93.2	Very high	92.3	Very high	105 Å²	105	47.2 Å²	47.2	40%	0.396	21%	0.211	S	C	.	.	H	α-helix	trans	-70.8	-45.1	174.8	-77.2	173.4	175.4	-175.8	-2	111.1	R214 I215 I216 E220 K221 L222	R214-R218 VanDerWaalsContact O-CG 3.29Å; R214-R218 WeakPolarHBondContact O-CG 3.48Å; R214-R218 PolarHBondContact O-N 3.4Å; R214-R218 VanDerWaalsContact O-N 3.08Å; I215-R218 WeakPolarHBondContact O-CB 3.46Å; I215-R218 PolarHBondContact O-N 2.89Å; I215-R218 VanDerWaalsContact O-N 3.1Å; I216-R218 VanDerWaalsContact C-N 3.26Å; I216-R218 PolarHBondContact O-N 3.43Å; R218-E220 PolarHBondContact O-N 2.91Å; R218-K221 WeakPolarHBondContact O-CB 3.37Å; R218-K221 PolarHBondContact O-N 3.03Å; R218-K221 VanDerWaalsContact O-N 3.14Å; R218-L222 WeakPolarHBondContact O-CG 3.44Å; R218-L222 PolarHBondContact O-N 3.41Å
219	E	93.9	Very high	92	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-42.9	177.1	-71.1	-67.1	125.9	0	0	111.8	H142 I215 I216 K221 L222 D223 R240 K242 W244	H142-E219 IonicContact CD2-OE1 2.72Å; H142-E219 IonicContact CE1-OE1 3.49Å; H142-E219 IonicContact NE2-OE1 3.11Å; H142-E219 PolarHBondContact NE2-OE1 3.17Å; I215-E219 HydrophobicContact CG2-CG 4.48Å; I215-E219 WeakPolarHBondContact O-CG 3.17Å; I215-E219 PolarHBondContact O-N 3.48Å; I216-E219 PolarHBondContact O-N 3.43Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 3.35Å; E219-L222 CarbonylContact O-C 3.59Å; E219-L222 WeakPolarHBondContact O-CB 3.36Å; E219-L222 PolarHBondContact O-N 2.97Å; E219-D223 PolarHBondContact O-N 3.25Å; E219-R240 IonicContact OE1-NH2 3.71Å; E219-R240 IonicContact OE2-CZ 3.2Å; E219-R240 IonicContact OE2-NH1 3.54Å; E219-R240 PolarHBondContact OE2-NH1 3.41Å; E219-R240 IonicContact OE2-NH2 3.39Å; E219-R240 PolarHBondContact OE2-NH2 2.86Å; E219-K242 WeakPolarHBondContact OE2-CD 3.29Å; E219-K242 IonicContact OE2-NZ 3.28Å; E219-K242 PolarHBondContact OE2-NZ 2.95Å; E219-W244 HydrophobicContact CB-CE3 4.13Å; E219-W244 HydrophobicContact CG-CD2 4.4Å; E219-W244 HydrophobicContact CG-CE3 3.63Å; E219-W244 HydrophobicContact CG-CZ3 3.69Å
220	E	92.8	Very high	91.8	Very high	25 Å²	25	52.4 Å²	52.4	12%	0.117	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-30.4	175	-70.7	-60.6	146.5	0	0	113.3	I216 R218 R224 W244 K245	I216-E220 HydrophobicContact CG2-CG 4.47Å; I216-E220 WeakPolarHBondContact O-CG 3.26Å; I216-E220 PolarHBondContact O-N 3.02Å; R218-E220 PolarHBondContact O-N 2.91Å; E220-R224 WeakPolarHBondContact O-CB 3.47Å; E220-R224 WeakPolarHBondContact O-CG 3.4Å; E220-R224 PolarHBondContact O-N 3.06Å; E220-R224 VanDerWaalsContact O-N 3.16Å; E220-R224 PolarHBondContact O-NE 3.3Å; E220-R224 VanDerWaalsContact O-NE 3.13Å; E220-W244 PolarHBondContact OE1-N 2.91Å; E220-W244 VanDerWaalsContact OE1-N 3.16Å; E220-K245 VanDerWaalsContact CD-CB 3.46Å; E220-K245 HydrophobicContact CG-CB 3.63Å; E220-K245 HydrophobicContact CG-CD 4.42Å; E220-K245 WeakPolarHBondContact OE1-CB 3.31Å; E220-K245 PolarHBondContact OE1-N 2.88Å
221	K	92.1	Very high	91.6	Very high	100 Å²	100	57.6 Å²	57.6	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-75.7	-30	172.9	-74.1	171.5	-173	172.6	0	112	E217 R218 E219 R225	E217-K221 VanDerWaalsContact O-CG 3.28Å; E217-K221 WeakPolarHBondContact O-CG 3.44Å; E217-K221 PolarHBondContact O-N 2.75Å; E217-K221 IonicContact OE2-NZ 2.71Å; R218-K221 WeakPolarHBondContact O-CB 3.37Å; R218-K221 PolarHBondContact O-N 3.03Å; R218-K221 VanDerWaalsContact O-N 3.14Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 3.35Å; K221-R225 WeakPolarHBondContact O-CG 3.29Å; K221-R225 PolarHBondContact O-N 2.96Å; K221-R225 PolarHBondContact O-NE 3.09Å
222	L	90.4	Very high	91.2	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-72.3	-46.5	173.3	-70.2	171.1	0	0	0	110.2	M146 R218 E219 R224 R225 M226	M146-L222 HydrophobicContact CG-CD1 4.11Å; M146-L222 HydrophobicContact SD-CD1 3.97Å; R218-L222 WeakPolarHBondContact O-CG 3.44Å; R218-L222 PolarHBondContact O-N 3.41Å; E219-L222 CarbonylContact O-C 3.59Å; E219-L222 WeakPolarHBondContact O-CB 3.36Å; E219-L222 PolarHBondContact O-N 2.97Å; L222-R224 VanDerWaalsContact C-N 3.34Å; L222-R224 PolarHBondContact O-N 2.95Å; L222-R225 WeakPolarHBondContact O-CB 3.45Å; L222-R225 PolarHBondContact O-N 3.36Å; L222-R225 VanDerWaalsContact O-N 3.07Å; L222-M226 WeakPolarHBondContact O-CG 3.28Å; L222-M226 PolarHBondContact O-N 2.91Å
223	D	92.4	Very high	90.7	Very high	5 Å²	5	66.2 Å²	66.2	3%	0.027	29%	0.289	C	S	.	.	H	α-helix	trans	-56.5	-46.5	176.5	-78.1	-7.5	0	0	0	111.5	E219 R225 M226 V227 R240 P241 K242 H243	E219-D223 PolarHBondContact O-N 3.25Å; D223-R225 PolarHBondContact O-N 3.07Å; D223-M226 PolarHBondContact O-N 2.92Å; D223-V227 WeakPolarHBondContact O-CB 3.3Å; D223-V227 VanDerWaalsContact O-CG2 3.29Å; D223-V227 WeakPolarHBondContact O-CG2 3.25Å; D223-V227 PolarHBondContact O-N 2.94Å; D223-R240 WeakPolarHBondContact OD1-CD 3.35Å; D223-R240 IonicContact OD1-CZ 3.71Å; D223-R240 IonicContact OD1-NE 3.14Å; D223-R240 IonicContact OD1-NH1 3.79Å; D223-R240 PolarHBondContact OD1-NH1 2.55Å; D223-P241 HydrophobicContact CB-CB 3.82Å; D223-P241 WeakPolarHBondContact OD1-CA 3.38Å; D223-K242 PolarHBondContact OD1-N 3.12Å; D223-K242 PolarHBondContact OD2-N 3.09Å; D223-H243 PolarHBondContact OD2-N 3.14Å
224	R	90.6	Very high	90.2	Very high	134 Å²	134	68.2 Å²	68.2	51%	0.506	31%	0.31	S	S	.	.	H	α-helix	trans	-56.7	-47.1	173.6	-81.2	-178.5	-85.2	177.5	-11.7	112.6	E220 L222 M226 V227 D228	E220-R224 WeakPolarHBondContact O-CB 3.47Å; E220-R224 WeakPolarHBondContact O-CG 3.4Å; E220-R224 PolarHBondContact O-N 3.06Å; E220-R224 VanDerWaalsContact O-N 3.16Å; E220-R224 PolarHBondContact O-NE 3.3Å; E220-R224 VanDerWaalsContact O-NE 3.13Å; L222-R224 VanDerWaalsContact C-N 3.34Å; L222-R224 PolarHBondContact O-N 2.95Å; R224-M226 PolarHBondContact O-N 3.31Å; R224-V227 PolarHBondContact O-N 3.41Å; R224-D228 PolarHBondContact O-N 2.91Å
225	R	89.3	Confident	89.7	Confident	160 Å²	160	63.6 Å²	63.6	60%	0.604	29%	0.294	S	S	*	.	H	α-helix	trans	-62.7	-40.5	177.8	-78.8	-175.3	-88.3	176.8	-4.2	112.3	K221 L222 D223 D228 R229	K221-R225 WeakPolarHBondContact O-CG 3.29Å; K221-R225 PolarHBondContact O-N 2.96Å; K221-R225 PolarHBondContact O-NE 3.09Å; L222-R225 WeakPolarHBondContact O-CB 3.45Å; L222-R225 PolarHBondContact O-N 3.36Å; L222-R225 VanDerWaalsContact O-N 3.07Å; D223-R225 PolarHBondContact O-N 3.07Å; R225-D228 PolarHBondContact O-N 3.38Å; R225-R229 WeakPolarHBondContact O-CB 3.01Å; R225-R229 PolarHBondContact O-N 3.04Å
226	M	87.3	Confident	89.4	Confident	27 Å²	27	65.5 Å²	65.5	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-40	178.2	-67.8	-58.4	-161.6	0	0	112	D153 L222 D223 R224 R229 K230 P237	D153-M226 HydrophobicContact CB-CE 4.47Å; L222-M226 WeakPolarHBondContact O-CG 3.28Å; L222-M226 PolarHBondContact O-N 2.91Å; D223-M226 PolarHBondContact O-N 2.92Å; R224-M226 PolarHBondContact O-N 3.31Å; M226-R229 PolarHBondContact O-N 3.48Å; M226-K230 WeakPolarHBondContact O-CB 3.46Å; M226-K230 PolarHBondContact O-N 3.37Å; M226-P237 HydrophobicContact CE-CG 4.23Å; M226-P237 HydrophobicContact SD-CG 4.44Å
227	V	89.8	Confident	88.9	Confident	53 Å²	53	65.8 Å²	65.8	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-40.6	175	170.8	0	0	0	0	111.2	D223 R224 K230 K231	D223-V227 WeakPolarHBondContact O-CB 3.3Å; D223-V227 VanDerWaalsContact O-CG2 3.29Å; D223-V227 WeakPolarHBondContact O-CG2 3.25Å; D223-V227 PolarHBondContact O-N 2.94Å; R224-V227 PolarHBondContact O-N 3.41Å; V227-K230 WeakPolarHBondContact O-CB 3.49Å; V227-K230 PolarHBondContact O-N 3.28Å; V227-K231 PolarHBondContact O-N 3.07Å
228	D	89	Confident	88.3	Confident	79 Å²	79	67.2 Å²	67.2	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-38.6	175.6	-72.1	-27.1	0	0	0	112.2	R224 R225 K230 K231 Q232	R224-D228 PolarHBondContact O-N 2.91Å; R225-D228 PolarHBondContact O-N 3.38Å; D228-K230 VanDerWaalsContact C-N 3.33Å; D228-K230 PolarHBondContact O-N 3.43Å; D228-K231 WeakPolarHBondContact O-CB 3.26Å; D228-K231 PolarHBondContact O-N 3.25Å; D228-K231 IonicContact OD1-NZ 2.67Å; D228-K231 PolarHBondContact OD1-NZ 3.2Å; D228-Q232 PolarHBondContact O-N 3.39Å
229	R	85.9	Confident	87.7	Confident	71 Å²	71	64.8 Å²	64.8	27%	0.268	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-42.7	171.8	-171.9	177.7	-179.2	178.1	1.9	111.1	D154 Y157 R225 M226 K231 Q232 T233	D154-R229 IonicContact OD1-NH1 3.43Å; Y157-R229 VanDerWaalsContact CE1-NH2 3.26Å; R225-R229 WeakPolarHBondContact O-CB 3.01Å; R225-R229 PolarHBondContact O-N 3.04Å; M226-R229 PolarHBondContact O-N 3.48Å; R229-K231 VanDerWaalsContact C-N 3.27Å; R229-K231 PolarHBondContact O-N 2.68Å; R229-Q232 WeakPolarHBondContact O-CA 3.48Å; R229-Q232 WeakPolarHBondContact O-CB 3.37Å; R229-Q232 PolarHBondContact O-N 2.96Å; R229-T233 HydrophobicContact CG-CG2 4.01Å; R229-T233 PolarHBondContact O-N 3.37Å; R229-T233 PolarHBondContact O-OG1 3.16Å; R229-T233 VanDerWaalsContact O-OG1 3.08Å
230	K	88.2	Confident	87.4	Confident	101 Å²	101	65.7 Å²	65.7	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-56.8	-38.8	176.3	-174.7	-172.8	-177.1	174.3	0	112.4	M226 V227 D228 Q232 G234 F235 I236	M226-K230 WeakPolarHBondContact O-CB 3.46Å; M226-K230 PolarHBondContact O-N 3.37Å; V227-K230 WeakPolarHBondContact O-CB 3.49Å; V227-K230 PolarHBondContact O-N 3.28Å; D228-K230 VanDerWaalsContact C-N 3.33Å; D228-K230 PolarHBondContact O-N 3.43Å; K230-Q232 PolarHBondContact O-N 3.38Å; K230-G234 VanDerWaalsContact O-CA 3.29Å; K230-G234 WeakPolarHBondContact O-CA 3.34Å; K230-G234 PolarHBondContact O-N 3.03Å; K230-F235 WeakPolarHBondContact CA-O 3.43Å; K230-I236 HydrophobicContact CB-CB 4.34Å; K230-I236 HydrophobicContact CD-CB 3.97Å; K230-I236 HydrophobicContact CD-CD1 4.2Å; K230-I236 HydrophobicContact CD-CG2 4.03Å; K230-I236 HydrophobicContact CG-CB 4.21Å
231	K	88.9	Confident	87.2	Confident	156 Å²	156	66.6 Å²	66.6	68%	0.678	34%	0.335	S	S	*	.	H	α-helix	trans	-62.5	-30.4	176.2	-65.6	171	-170.8	157.2	0	112.3	V227 D228 R229	V227-K231 PolarHBondContact O-N 3.07Å; D228-K231 WeakPolarHBondContact O-CB 3.26Å; D228-K231 PolarHBondContact O-N 3.25Å; D228-K231 IonicContact OD1-NZ 2.67Å; D228-K231 PolarHBondContact OD1-NZ 3.2Å; R229-K231 VanDerWaalsContact C-N 3.27Å; R229-K231 PolarHBondContact O-N 2.68Å
232	Q	84.6	Confident	87	Confident	168 Å²	168	63.5 Å²	63.5	79%	0.785	32%	0.322	S	S	*	.	H	α-helix	trans	-88.8	-39.3	-179.2	-62.4	176.8	3.2	0	0	112.6	D228 R229 K230	D228-Q232 PolarHBondContact O-N 3.39Å; R229-Q232 WeakPolarHBondContact O-CA 3.48Å; R229-Q232 WeakPolarHBondContact O-CB 3.37Å; R229-Q232 PolarHBondContact O-N 2.96Å; K230-Q232 PolarHBondContact O-N 3.38Å
233	T	83.5	Confident	87.1	Confident	38 Å²	38	67 Å²	67	23%	0.233	34%	0.337	C	S	.	.	H	α-helix	trans	-112	-12.7	-168.1	69.4	0	0	0	0	114.5	Y157 R229 F235	Y157-T233 HydrophobicContact CE2-CG2 3.97Å; Y157-T233 WeakPolarHBondContact OH-CG2 3.06Å; R229-T233 HydrophobicContact CG-CG2 4.01Å; R229-T233 PolarHBondContact O-N 3.37Å; R229-T233 PolarHBondContact O-OG1 3.16Å; R229-T233 VanDerWaalsContact O-OG1 3.08Å; T233-F235 PolarHBondContact O-N 3.08Å; T233-F235 PolarHBondContact OG1-N 3.21Å
234	G	83.4	Confident	87.2	Confident	47 Å²	47	67.5 Å²	67.5	49%	0.485	34%	0.339	S	S	.	.	S	Bend	trans	76	-10.6	-174.7	0	0	0	0	0	115.2	K230	K230-G234 VanDerWaalsContact O-CA 3.29Å; K230-G234 WeakPolarHBondContact O-CA 3.34Å; K230-G234 PolarHBondContact O-N 3.03Å
235	F	85.1	Confident	87.3	Confident	23 Å²	23	64 Å²	64	10%	0.101	33%	0.327	C	S	.	.			trans	-100	140.9	-176.8	-179.4	-102.5	0	0	0	112.5	M156 Y157 Y160 K230 T233 P237	M156-F235 HydrophobicContact CB-CE1 4.4Å; M156-F235 HydrophobicContact CB-CZ 3.68Å; Y157-F235 HydrophobicContact CD2-CB 4Å; Y157-F235 AromaticContact CD2-CD1 3.61Å; Y157-F235 HydrophobicContact CD2-CD1 3.61Å; Y157-F235 HydrophobicContact CD2-CE1 4.38Å; Y157-F235 HydrophobicContact CD2-CG 4Å; Y157-F235 HydrophobicContact CE2-CB 4.3Å; Y157-F235 HydrophobicContact CG-CD1 4.3Å; Y160-F235 HydrophobicContact CD1-CB 3.66Å; Y160-F235 HydrophobicContact CD1-CD2 4.06Å; Y160-F235 HydrophobicContact CD1-CG 4.1Å; Y160-F235 AromaticContact CD2-CD2 3.7Å; Y160-F235 HydrophobicContact CD2-CD2 3.7Å; Y160-F235 HydrophobicContact CD2-CE2 4.42Å; Y160-F235 HydrophobicContact CE1-CB 3.76Å; Y160-F235 HydrophobicContact CE2-CD2 4.29Å; Y160-F235 HydrophobicContact CG-CB 4.08Å; Y160-F235 AromaticContact CG-CD2 3.55Å; Y160-F235 HydrophobicContact CG-CD2 3.55Å; Y160-F235 HydrophobicContact CG-CE2 4.32Å; Y160-F235 HydrophobicContact CG-CG 4.05Å; K230-F235 WeakPolarHBondContact CA-O 3.43Å; T233-F235 PolarHBondContact O-N 3.08Å; T233-F235 PolarHBondContact OG1-N 3.21Å; F235-P237 HydrophobicContact CE1-CG 4Å
236	I	87.4	Confident	87.4	Confident	39 Å²	39	60.2 Å²	60.2	20%	0.2	32%	0.319	C	S	.	.			trans	-138.8	135.6	166.6	-167.4	164.2	0	0	0	108.9	K230 R240	K230-I236 HydrophobicContact CB-CB 4.34Å; K230-I236 HydrophobicContact CD-CB 3.97Å; K230-I236 HydrophobicContact CD-CD1 4.2Å; K230-I236 HydrophobicContact CD-CG2 4.03Å; K230-I236 HydrophobicContact CG-CB 4.21Å; I236-R240 HydrophobicContact CD1-CB 4.29Å; I236-R240 WeakPolarHBondContact CD1-O 3.45Å; I236-R240 HydrophobicContact CG1-CB 4.1Å
237	P	85.1	Confident	87.8	Confident	6 Å²	6	63.6 Å²	63.6	4%	0.039	33%	0.333	C	S	.	.			trans	-60.9	150.8	176.4	-23.5	33.5	0	0	0	112.6	D153 M226 F235 R240	D153-P237 HydrophobicContact CB-CB 4.18Å; D153-P237 HydrophobicContact CB-CG 3.7Å; D153-P237 VanDerWaalsContact CG-CB 3.45Å; D153-P237 WeakPolarHBondContact OD1-CB 3.37Å; D153-P237 WeakPolarHBondContact OD2-CG 3.36Å; M226-P237 HydrophobicContact CE-CG 4.23Å; M226-P237 HydrophobicContact SD-CG 4.44Å; F235-P237 HydrophobicContact CE1-CG 4Å; P237-R240 HydrophobicContact CB-CG 4.45Å; P237-R240 PolarHBondContact O-N 3.25Å
238	P	81.2	Confident	88	Confident	53 Å²	53	61 Å²	61	34%	0.344	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	139.4	174.5	-13.8	26	0	0	0	111	M156 R240	M156-P238 HydrophobicContact CE-CG 3.61Å; M156-P238 HydrophobicContact SD-CG 4.02Å; P238-R240 VanDerWaalsContact C-N 3.33Å
239	G	80.4	Confident	88.1	Confident	53 Å²	53	57.7 Å²	57.7	55%	0.546	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	4.8	179.1	0	0	0	0	0	115.3	K242	G239-K242 WeakPolarHBondContact O-CG 3.42Å
240	R	87.3	Confident	88.5	Confident	20 Å²	20	60.3 Å²	60.3	8%	0.075	31%	0.314	C	S	.	.			trans	-112	144.8	173.1	-68.1	-77.8	-177.5	-172.8	-3.5	110.9	E149 E219 D223 I236 P237 P238 K242	E149-R240 IonicContact OE2-CZ 2.68Å; E149-R240 IonicContact OE2-NH2 2.61Å; E149-R240 PolarHBondContact OE2-NH2 2.61Å; E219-R240 IonicContact OE1-NH2 3.71Å; E219-R240 IonicContact OE2-CZ 3.2Å; E219-R240 IonicContact OE2-NH1 3.54Å; E219-R240 PolarHBondContact OE2-NH1 3.41Å; E219-R240 IonicContact OE2-NH2 3.39Å; E219-R240 PolarHBondContact OE2-NH2 2.86Å; D223-R240 WeakPolarHBondContact OD1-CD 3.35Å; D223-R240 IonicContact OD1-CZ 3.71Å; D223-R240 IonicContact OD1-NE 3.14Å; D223-R240 IonicContact OD1-NH1 3.79Å; D223-R240 PolarHBondContact OD1-NH1 2.55Å; I236-R240 HydrophobicContact CD1-CB 4.29Å; I236-R240 WeakPolarHBondContact CD1-O 3.45Å; I236-R240 HydrophobicContact CG1-CB 4.1Å; P237-R240 HydrophobicContact CB-CG 4.45Å; P237-R240 PolarHBondContact O-N 3.25Å; P238-R240 VanDerWaalsContact C-N 3.33Å; R240-K242 VanDerWaalsContact CZ-CE 3.48Å
241	P	88.8	Confident	88.8	Confident	44 Å²	44	56.5 Å²	56.5	29%	0.286	30%	0.3	S	S	.	.			cis	-68.2	149.7	-9.6	29.8	-37.4	0	0	0	113.1	D223 H243	D223-P241 HydrophobicContact CB-CB 3.82Å; D223-P241 WeakPolarHBondContact OD1-CA 3.38Å; P241-H243 WeakPolarHBondContact CG-NE2 3.37Å
242	K	89.2	Confident	88.9	Confident	35 Å²	35	49.1 Å²	49.1	15%	0.152	27%	0.268	C	S	.	.			trans	-85.3	-24	-178.7	-69.1	-172	-173.6	175.6	0	113.7	E149 S184 E219 D223 G239 R240 W244	E149-K242 VanDerWaalsContact CD-NZ 3.31Å; E149-K242 IonicContact OE1-NZ 3.32Å; E149-K242 PolarHBondContact OE1-NZ 2.82Å; E149-K242 IonicContact OE2-NZ 2.96Å; E149-K242 PolarHBondContact OE2-NZ 3.39Å; E149-K242 VanDerWaalsContact OE2-NZ 3.11Å; S184-K242 PolarHBondContact OG-NZ 3.15Å; E219-K242 WeakPolarHBondContact OE2-CD 3.29Å; E219-K242 IonicContact OE2-NZ 3.28Å; E219-K242 PolarHBondContact OE2-NZ 2.95Å; D223-K242 PolarHBondContact OD1-N 3.12Å; D223-K242 PolarHBondContact OD2-N 3.09Å; G239-K242 WeakPolarHBondContact O-CG 3.42Å; R240-K242 VanDerWaalsContact CZ-CE 3.48Å; K242-W244 VanDerWaalsContact C-N 3.29Å; K242-W244 HydrophobicContact CB-CG 4.19Å; K242-W244 HydrophobicContact CD-CD2 4.41Å; K242-W244 HydrophobicContact CD-CH2 4.48Å; K242-W244 HydrophobicContact CD-CZ2 3.72Å; K242-W244 PolarHBondContact O-N 3.34Å
243	H	91.8	Very high	89.3	Confident	95 Å²	95	45.5 Å²	45.5	44%	0.44	25%	0.251	S	S	.	.			trans	54.7	39	179.1	-62.3	-73.9	0	0	0	114.3	D223 P241 K245 D246 K247	D223-H243 PolarHBondContact OD2-N 3.14Å; P241-H243 WeakPolarHBondContact CG-NE2 3.37Å; H243-K245 PolarHBondContact O-N 3.17Å; H243-D246 IonicContact ND1-OD2 3.87Å; H243-D246 PolarHBondContact O-N 3.44Å; H243-K247 PolarHBondContact O-N 3.47Å
244	W	94.2	Very high	89.6	Confident	15 Å²	15	45.3 Å²	45.3	6%	0.057	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-24.5	-176.5	-79.2	8.6	0	0	0	113.3	A188 L191 W192 I215 I216 E219 E220 K242 M248	A188-W244 HydrophobicContact CB-CH2 4.42Å; A188-W244 HydrophobicContact CB-CZ2 3.93Å; L191-W244 HydrophobicContact CD1-CE3 3.8Å; L191-W244 HydrophobicContact CD1-CH2 4.35Å; L191-W244 HydrophobicContact CD1-CZ3 3.57Å; W192-W244 HydrophobicContact CH2-CB 4.02Å; W192-W244 HydrophobicContact CH2-CD2 4.46Å; W192-W244 HydrophobicContact CH2-CG 4.02Å; W192-W244 HydrophobicContact CZ2-CD2 4.45Å; W192-W244 HydrophobicContact CZ2-CG 4.18Å; I215-W244 HydrophobicContact CG2-CE3 4.47Å; I215-W244 HydrophobicContact CG2-CZ3 3.99Å; I216-W244 HydrophobicContact CG1-CB 4.45Å; I216-W244 HydrophobicContact CG2-CB 4.28Å; E219-W244 HydrophobicContact CB-CE3 4.13Å; E219-W244 HydrophobicContact CG-CD2 4.4Å; E219-W244 HydrophobicContact CG-CE3 3.63Å; E219-W244 HydrophobicContact CG-CZ3 3.69Å; E220-W244 PolarHBondContact OE1-N 2.91Å; E220-W244 VanDerWaalsContact OE1-N 3.16Å; K242-W244 VanDerWaalsContact C-N 3.29Å; K242-W244 HydrophobicContact CB-CG 4.19Å; K242-W244 HydrophobicContact CD-CD2 4.41Å; K242-W244 HydrophobicContact CD-CH2 4.48Å; K242-W244 HydrophobicContact CD-CZ2 3.72Å; K242-W244 PolarHBondContact O-N 3.34Å; W244-M248 VanDerWaalsContact O-CB 3.3Å; W244-M248 WeakPolarHBondContact O-CB 3.46Å; W244-M248 PolarHBondContact O-N 3.36Å
245	K	93	Very high	90	Very high	61 Å²	61	44.3 Å²	44.3	27%	0.265	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-45.9	172.1	179.3	-178.5	178.6	179.1	0	111.9	I216 E220 H243 K247 M248 F249 Y305	I216-K245 HydrophobicContact CG2-CB 4.14Å; E220-K245 VanDerWaalsContact CD-CB 3.46Å; E220-K245 HydrophobicContact CG-CB 3.63Å; E220-K245 HydrophobicContact CG-CD 4.42Å; E220-K245 WeakPolarHBondContact OE1-CB 3.31Å; E220-K245 PolarHBondContact OE1-N 2.88Å; H243-K245 PolarHBondContact O-N 3.17Å; K245-K247 VanDerWaalsContact C-N 3.34Å; K245-M248 WeakPolarHBondContact O-CB 3.31Å; K245-M248 PolarHBondContact O-N 3.3Å; K245-F249 HydrophobicContact CD-CE2 4.5Å; K245-F249 HydrophobicContact CG-CD2 4.04Å; K245-F249 HydrophobicContact CG-CE2 3.75Å; K245-F249 WeakPolarHBondContact O-CD2 3.37Å; K245-F249 PolarHBondContact O-N 3.19Å; K245-Y305 HydrophobicContact CD-CE1 4.34Å; K245-Y305 WeakPolarHBondContact CD-OH 3.48Å
246	D	92.4	Very high	90.3	Very high	81 Å²	81	43.3 Å²	43.3	43%	0.433	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-43.8	-179.8	-63.1	-33.4	0	0	0	110.2	H243 M248 F249 Q250	H243-D246 IonicContact ND1-OD2 3.87Å; H243-D246 PolarHBondContact O-N 3.44Å; D246-M248 PolarHBondContact O-N 3.08Å; D246-F249 PolarHBondContact O-N 3.29Å; D246-Q250 WeakPolarHBondContact O-CG 3.36Å; D246-Q250 PolarHBondContact O-N 3.14Å
247	K	93.7	Very high	90.4	Very high	97 Å²	97	43.2 Å²	43.2	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-39.2	175.3	-168.5	163.3	-178.3	174.2	0	113	W192 H243 K245 F249 Q250 V251	W192-K247 HydrophobicContact CD2-CG 4.43Å; W192-K247 HydrophobicContact CH2-CB 4.02Å; W192-K247 HydrophobicContact CH2-CD 4.27Å; W192-K247 HydrophobicContact CH2-CG 4.03Å; W192-K247 HydrophobicContact CZ2-CB 4.21Å; W192-K247 HydrophobicContact CZ2-CD 3.61Å; W192-K247 HydrophobicContact CZ2-CG 3.84Å; W192-K247 HydrophobicContact CZ3-CB 4.48Å; W192-K247 HydrophobicContact CZ3-CG 4.38Å; H243-K247 PolarHBondContact O-N 3.47Å; K245-K247 VanDerWaalsContact C-N 3.34Å; K247-F249 VanDerWaalsContact C-N 3.33Å; K247-F249 PolarHBondContact O-N 3.4Å; K247-Q250 PolarHBondContact O-N 2.94Å; K247-V251 VanDerWaalsContact O-CG2 3.31Å; K247-V251 WeakPolarHBondContact O-CG2 3.42Å; K247-V251 PolarHBondContact O-N 3.29Å
248	M	94.1	Very high	90.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.4	-47.9	174.2	179.5	-164	71.9	0	0	111.1	W192 L195 I216 W244 K245 D246 V251 L252 F301 Y305	W192-M248 HydrophobicContact CZ3-CB 4.09Å; L195-M248 HydrophobicContact CD1-CB 4.2Å; L195-M248 HydrophobicContact CD1-CG 3.63Å; L195-M248 HydrophobicContact CD2-CG 3.85Å; L195-M248 HydrophobicContact CD2-SD 4.44Å; L195-M248 HydrophobicContact CG-CG 4.38Å; I216-M248 HydrophobicContact CD1-CB 3.91Å; I216-M248 HydrophobicContact CD1-CG 3.8Å; I216-M248 HydrophobicContact CD1-SD 3.68Å; W244-M248 VanDerWaalsContact O-CB 3.3Å; W244-M248 WeakPolarHBondContact O-CB 3.46Å; W244-M248 PolarHBondContact O-N 3.36Å; K245-M248 WeakPolarHBondContact O-CB 3.31Å; K245-M248 PolarHBondContact O-N 3.3Å; D246-M248 PolarHBondContact O-N 3.08Å; M248-V251 PolarHBondContact O-N 3.34Å; M248-L252 HydrophobicContact CG-CD1 4.3Å; M248-L252 WeakPolarHBondContact O-CG 3.27Å; M248-L252 PolarHBondContact O-N 3.49Å; M248-F301 HydrophobicContact CE-CE1 4.04Å; M248-F301 HydrophobicContact SD-CE1 3.89Å; M248-Y305 HydrophobicContact CE-CD2 4.18Å; M248-Y305 HydrophobicContact CE-CE2 3.77Å
249	F	92.4	Very high	90.8	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.035	26%	0.261	C	S	.	.	H	α-helix	trans	-69.4	-35.1	-179.4	-73.2	-67	0	0	0	112.8	K245 D246 K247 V251 L252 E253 Y305 R310	K245-F249 HydrophobicContact CD-CE2 4.5Å; K245-F249 HydrophobicContact CG-CD2 4.04Å; K245-F249 HydrophobicContact CG-CE2 3.75Å; K245-F249 WeakPolarHBondContact O-CD2 3.37Å; K245-F249 PolarHBondContact O-N 3.19Å; D246-F249 PolarHBondContact O-N 3.29Å; K247-F249 VanDerWaalsContact C-N 3.33Å; K247-F249 PolarHBondContact O-N 3.4Å; F249-V251 VanDerWaalsContact C-N 3.34Å; F249-L252 HydrophobicContact CD1-CD1 4.27Å; F249-L252 PolarHBondContact O-N 2.86Å; F249-E253 WeakPolarHBondContact O-CB 3.44Å; F249-E253 PolarHBondContact O-N 2.89Å; F249-Y305 HydrophobicContact CE2-CD2 4.14Å; F249-Y305 HydrophobicContact CE2-CE2 4.12Å; F249-Y305 AromaticContact CZ-CD2 3.55Å; F249-Y305 HydrophobicContact CZ-CD2 3.55Å; F249-Y305 AromaticContact CZ-CE2 3.96Å; F249-Y305 HydrophobicContact CZ-CE2 3.96Å; F249-Y305 HydrophobicContact CZ-CG 4.17Å; F249-R310 VanDerWaalsContact CD1-NH1 3.33Å; F249-R310 VanDerWaalsContact CD2-CZ 3.5Å; F249-R310 VanDerWaalsContact CE1-NH1 3.31Å
250	Q	93.4	Very high	91.1	Very high	126 Å²	126	46 Å²	46	59%	0.589	24%	0.237	S	C	*	.	H	α-helix	trans	-61	-41.8	170.8	-70	170.7	-0.1	0	0	111.9	D246 K247 E253 G254	D246-Q250 WeakPolarHBondContact O-CG 3.36Å; D246-Q250 PolarHBondContact O-N 3.14Å; K247-Q250 PolarHBondContact O-N 2.94Å; Q250-E253 PolarHBondContact O-N 2.79Å; Q250-G254 PolarHBondContact O-N 2.97Å
251	V	94.5	Very high	90.9	Very high	22 Å²	22	50 Å²	50	13%	0.133	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-42	176.7	172	0	0	0	0	111.2	W192 L195 Q196 K247 M248 F249 G254 T255	W192-V251 HydrophobicContact CB-CG2 4.27Å; W192-V251 HydrophobicContact CD2-CG2 4.21Å; W192-V251 HydrophobicContact CE3-CG2 4.03Å; W192-V251 HydrophobicContact CG-CG2 4.28Å; L195-V251 HydrophobicContact CB-CG1 3.92Å; Q196-V251 HydrophobicContact CG-CG1 3.63Å; K247-V251 VanDerWaalsContact O-CG2 3.31Å; K247-V251 WeakPolarHBondContact O-CG2 3.42Å; K247-V251 PolarHBondContact O-N 3.29Å; M248-V251 PolarHBondContact O-N 3.34Å; F249-V251 VanDerWaalsContact C-N 3.34Å; V251-G254 PolarHBondContact O-N 2.9Å; V251-T255 WeakPolarHBondContact O-CB 3.31Å; V251-T255 PolarHBondContact O-N 3.06Å; V251-T255 PolarHBondContact O-OG1 3.45Å
252	L	92.6	Very high	90.3	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-40.2	176.8	-68	175.9	0	0	0	112.1	L195 M248 F249 T255 V256 M297 F301 F311	L195-L252 HydrophobicContact CB-CD2 4.29Å; L195-L252 HydrophobicContact CD2-CD2 4.07Å; L195-L252 HydrophobicContact CD2-CG 4.45Å; M248-L252 HydrophobicContact CG-CD1 4.3Å; M248-L252 WeakPolarHBondContact O-CG 3.27Å; M248-L252 PolarHBondContact O-N 3.49Å; F249-L252 HydrophobicContact CD1-CD1 4.27Å; F249-L252 PolarHBondContact O-N 2.86Å; L252-T255 WeakPolarHBondContact O-CB 3.16Å; L252-T255 PolarHBondContact O-N 3.21Å; L252-V256 WeakPolarHBondContact O-CG2 3.34Å; L252-V256 PolarHBondContact O-N 3.48Å; L252-M297 HydrophobicContact CD2-CE 4.28Å; L252-F301 HydrophobicContact CD1-CE1 4.44Å; L252-F301 HydrophobicContact CD1-CZ 4.21Å; L252-F311 HydrophobicContact CB-CZ 4.25Å; L252-F311 HydrophobicContact CD1-CE2 4.18Å; L252-F311 HydrophobicContact CD1-CZ 3.89Å; L252-F311 HydrophobicContact CD2-CZ 4.02Å; L252-F311 HydrophobicContact CG-CZ 4.26Å
253	E	91.3	Very high	89.4	Confident	92 Å²	92	49.4 Å²	49.4	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-46.7	173.7	173.7	167.4	-147.7	0	0	112.2	F249 Q250 T255 V256 S257 L314	F249-E253 WeakPolarHBondContact O-CB 3.44Å; F249-E253 PolarHBondContact O-N 2.89Å; Q250-E253 PolarHBondContact O-N 2.79Å; E253-T255 VanDerWaalsContact C-N 3.26Å; E253-T255 PolarHBondContact O-N 3.24Å; E253-V256 PolarHBondContact O-N 3.1Å; E253-S257 PolarHBondContact O-N 3.31Å; E253-S257 PolarHBondContact O-OG 2.81Å; E253-L314 HydrophobicContact CB-CD1 4.34Å; E253-L314 HydrophobicContact CB-CD2 3.68Å; E253-L314 HydrophobicContact CG-CD2 3.69Å
254	G	91.3	Very high	88.2	Confident	33 Å²	33	49 Å²	49	34%	0.34	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-38.2	173.6	0	0	0	0	0	112.2	Q250 V251 S257 T258	Q250-G254 PolarHBondContact O-N 2.97Å; V251-G254 PolarHBondContact O-N 2.9Å; G254-S257 PolarHBondContact O-N 3.49Å; G254-T258 WeakPolarHBondContact O-CB 3.25Å; G254-T258 PolarHBondContact O-N 3.25Å; G254-T258 PolarHBondContact O-OG1 3.48Å; G254-T258 VanDerWaalsContact O-OG1 3.05Å
255	T	90.7	Very high	86.6	Confident	26 Å²	26	53 Å²	53	16%	0.16	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-44.5	177.5	-55	0	0	0	0	112.1	Q196 V251 L252 E253 R259	Q196-T255 WeakPolarHBondContact CA-OG1 3.41Å; Q196-T255 WeakPolarHBondContact O-CG2 3.43Å; V251-T255 WeakPolarHBondContact O-CB 3.31Å; V251-T255 PolarHBondContact O-N 3.06Å; V251-T255 PolarHBondContact O-OG1 3.45Å; L252-T255 WeakPolarHBondContact O-CB 3.16Å; L252-T255 PolarHBondContact O-N 3.21Å; E253-T255 VanDerWaalsContact C-N 3.26Å; E253-T255 PolarHBondContact O-N 3.24Å; T255-R259 VanDerWaalsContact O-CB 3.28Å; T255-R259 WeakPolarHBondContact O-CB 3.45Å; T255-R259 PolarHBondContact O-N 3.07Å; T255-R259 VanDerWaalsContact O-N 3.1Å
256	V	91.6	Very high	85.4	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-45.3	176	170.8	0	0	0	0	110.3	L252 E253 R259 I260 F311 L314 Y315 A318	L252-V256 WeakPolarHBondContact O-CG2 3.34Å; L252-V256 PolarHBondContact O-N 3.48Å; E253-V256 PolarHBondContact O-N 3.1Å; V256-R259 WeakPolarHBondContact O-CB 3.34Å; V256-R259 PolarHBondContact O-N 3.43Å; V256-I260 WeakPolarHBondContact O-CG1 3.21Å; V256-I260 PolarHBondContact O-N 3.47Å; V256-F311 HydrophobicContact CG2-CD1 4.1Å; V256-F311 HydrophobicContact CG2-CE1 4.12Å; V256-L314 HydrophobicContact CG1-CB 4.44Å; V256-L314 HydrophobicContact CG2-CB 4.46Å; V256-Y315 HydrophobicContact CG1-CD1 3.58Å; V256-Y315 HydrophobicContact CG1-CD2 4.26Å; V256-Y315 HydrophobicContact CG1-CE1 3.67Å; V256-Y315 HydrophobicContact CG1-CE2 4.33Å; V256-Y315 HydrophobicContact CG1-CG 3.89Å; V256-Y315 HydrophobicContact CG2-CD2 4.4Å; V256-Y315 HydrophobicContact CG2-CE1 4.41Å; V256-Y315 HydrophobicContact CG2-CE2 3.95Å; V256-A318 HydrophobicContact CG1-CB 4Å
257	S	89.5	Confident	84.4	Confident	37 Å²	37	50.1 Å²	50.1	26%	0.259	29%	0.291	S	S	.	.	H	α-helix	trans	-62.2	-52	-179.5	-54.9	0	0	0	0	112.2	E253 G254 R259 I260 E261	E253-S257 PolarHBondContact O-N 3.31Å; E253-S257 PolarHBondContact O-OG 2.81Å; G254-S257 PolarHBondContact O-N 3.49Å; S257-R259 PolarHBondContact O-N 3.42Å; S257-R259 VanDerWaalsContact O-N 3.16Å; S257-I260 PolarHBondContact O-N 2.99Å; S257-I260 VanDerWaalsContact O-N 3.1Å; S257-E261 WeakPolarHBondContact O-CG 3.36Å; S257-E261 PolarHBondContact O-N 3.29Å
258	T	88.8	Confident	83.7	Confident	91 Å²	91	49.9 Å²	49.9	56%	0.558	29%	0.288	S	S	*	.	H	α-helix	trans	-58.6	-31.3	176	-58.9	0	0	0	0	112.1	G254 G262	G254-T258 WeakPolarHBondContact O-CB 3.25Å; G254-T258 PolarHBondContact O-N 3.25Å; G254-T258 PolarHBondContact O-OG1 3.48Å; G254-T258 VanDerWaalsContact O-OG1 3.05Å; T258-G262 PolarHBondContact O-N 3.25Å
259	R	86.8	Confident	82.9	Confident	73 Å²	73	57.8 Å²	57.8	28%	0.275	33%	0.325	S	S	.	.	H	α-helix	trans	-72	-39.1	177.9	-168.4	162.7	-166.3	-170.8	-15.1	112.8	M199 T255 V256 S257 D289	M199-R259 VanDerWaalsContact CB-NH1 3.25Å; M199-R259 VanDerWaalsContact CG-NH1 3.28Å; T255-R259 VanDerWaalsContact O-CB 3.28Å; T255-R259 WeakPolarHBondContact O-CB 3.45Å; T255-R259 PolarHBondContact O-N 3.07Å; T255-R259 VanDerWaalsContact O-N 3.1Å; V256-R259 WeakPolarHBondContact O-CB 3.34Å; V256-R259 PolarHBondContact O-N 3.43Å; S257-R259 PolarHBondContact O-N 3.42Å; S257-R259 VanDerWaalsContact O-N 3.16Å; R259-D289 VanDerWaalsContact CD-OD2 3.31Å; R259-D289 WeakPolarHBondContact CD-OD2 3.21Å; R259-D289 IonicContact CZ-OD1 2.68Å; R259-D289 IonicContact CZ-OD2 2.75Å; R259-D289 IonicContact NE-OD2 2.75Å; R259-D289 PolarHBondContact NE-OD2 3.42Å; R259-D289 VanDerWaalsContact NE-OD2 3.11Å; R259-D289 IonicContact NH1-OD1 2.7Å; R259-D289 PolarHBondContact NH1-OD1 2.88Å; R259-D289 IonicContact NH1-OD2 2.75Å; R259-D289 PolarHBondContact NH1-OD2 3.22Å; R259-D289 VanDerWaalsContact NH2-CG 3.34Å; R259-D289 IonicContact NH2-OD1 3.57Å; R259-D289 PolarHBondContact NH2-OD1 2.95Å; R259-D289 IonicContact NH2-OD2 3.56Å; R259-D289 PolarHBondContact NH2-OD2 2.82Å; R259-D289 VanDerWaalsContact NH2-OD2 3.16Å
260	I	86.8	Confident	82.3	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.036	36%	0.355	C	S	.	.	H	α-helix	trans	-67.4	-44.2	172.8	-62.2	-59.4	0	0	0	110.2	V256 S257 G262 T263 T282 V286 Y315 A318 V319 R322	V256-I260 WeakPolarHBondContact O-CG1 3.21Å; V256-I260 PolarHBondContact O-N 3.47Å; S257-I260 PolarHBondContact O-N 2.99Å; S257-I260 VanDerWaalsContact O-N 3.1Å; I260-G262 VanDerWaalsContact C-N 3.31Å; I260-G262 PolarHBondContact O-N 3.41Å; I260-T263 WeakPolarHBondContact O-CB 3.39Å; I260-T263 PolarHBondContact O-N 2.93Å; I260-T263 VanDerWaalsContact O-N 3.17Å; I260-T263 PolarHBondContact O-OG1 3.36Å; I260-T282 HydrophobicContact CD1-CG2 4.38Å; I260-V286 HydrophobicContact CD1-CG2 3.57Å; I260-Y315 HydrophobicContact CD1-CD1 4.24Å; I260-Y315 HydrophobicContact CD1-CE1 4.36Å; I260-A318 HydrophobicContact CG1-CB 3.97Å; I260-V319 HydrophobicContact CD1-CG2 4.23Å; I260-R322 HydrophobicContact CG2-CB 4.05Å; I260-R322 HydrophobicContact CG2-CG 4.2Å
261	E	82.5	Confident	81.6	Confident	102 Å²	102	57.7 Å²	57.7	48%	0.477	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-39.6	174.9	-70.3	167.1	-169.3	0	0	112.3	S257 T263 Q264	S257-E261 WeakPolarHBondContact O-CG 3.36Å; S257-E261 PolarHBondContact O-N 3.29Å; E261-T263 PolarHBondContact O-N 3.43Å; E261-Q264 VanDerWaalsContact O-CB 3.25Å; E261-Q264 WeakPolarHBondContact O-CB 3.39Å; E261-Q264 WeakPolarHBondContact O-CG 3.43Å; E261-Q264 PolarHBondContact O-N 3.26Å
262	G	76.4	Confident	80.9	Confident	60 Å²	60	65.7 Å²	65.7	62%	0.619	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.4	177.8	0	0	0	0	0	114.9	T258 I260 Q264	T258-G262 PolarHBondContact O-N 3.25Å; I260-G262 VanDerWaalsContact C-N 3.31Å; I260-G262 PolarHBondContact O-N 3.41Å; G262-Q264 PolarHBondContact O-N 2.75Å
263	T	69.9	Low	80.5	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.043	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.5	172.7	66.2	0	0	0	0	113.7	I260 E261 A265 L278 I281 Y285	I260-T263 WeakPolarHBondContact O-CB 3.39Å; I260-T263 PolarHBondContact O-N 2.93Å; I260-T263 VanDerWaalsContact O-N 3.17Å; I260-T263 PolarHBondContact O-OG1 3.36Å; E261-T263 PolarHBondContact O-N 3.43Å; T263-A265 PolarHBondContact O-N 2.97Å; T263-L278 WeakPolarHBondContact O-CD1 3.43Å; T263-I281 HydrophobicContact CG2-CG2 4.05Å; T263-Y285 HydrophobicContact CG2-CD2 3.57Å; T263-Y285 HydrophobicContact CG2-CE2 4Å
264	Q	66	Low	80.4	Confident	88 Å²	88	67.6 Å²	67.6	41%	0.411	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	15.9	-178.2	-69.4	177.5	9.9	0	0	115.8	E261 G262 V266	E261-Q264 VanDerWaalsContact O-CB 3.25Å; E261-Q264 WeakPolarHBondContact O-CB 3.39Å; E261-Q264 WeakPolarHBondContact O-CG 3.43Å; E261-Q264 PolarHBondContact O-N 3.26Å; G262-Q264 PolarHBondContact O-N 2.75Å; Q264-V266 PolarHBondContact O-N 3.38Å
265	A	61.9	Low	80.4	Confident	97 Å²	97	66.1 Å²	66.1	80%	0.802	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.5	177	0	0	0	0	0	113.9	T263	T263-A265 PolarHBondContact O-N 2.97Å
266	V	66.3	Low	80.3	Confident	18 Å²	18	68.1 Å²	68.1	11%	0.109	38%	0.379	C	S	.	.			trans	-108.1	112.2	179.4	-168.1	0	0	0	0	109	Q264 D271 W274 R277 I281	Q264-V266 PolarHBondContact O-N 3.38Å; V266-D271 HydrophobicContact CG1-CB 4.29Å; V266-W274 HydrophobicContact CG1-CB 3.79Å; V266-R277 HydrophobicContact CG2-CG 4.28Å; V266-I281 HydrophobicContact CG2-CD1 4.17Å
267	T	72.7	Confident	80.2	Confident	65 Å²	65	74.4 Å²	74.4	40%	0.399	40%	0.403	S	S	.	.			trans	-102.9	158.5	177.8	78.4	0	0	0	0	111.8	E269 A270 D271	T267-E269 WeakPolarHBondContact CB-OE2 3.38Å; T267-E269 PolarHBondContact O-N 3.14Å; T267-E269 PolarHBondContact OG1-OE2 3.06Å; T267-A270 PolarHBondContact O-N 3.2Å; T267-A270 VanDerWaalsContact O-N 3.16Å; T267-D271 PolarHBondContact O-N 3.22Å
268	R	79.3	Confident	80.2	Confident	91 Å²	91	72.8 Å²	72.8	34%	0.343	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-29.4	179.5	-175.9	167.6	179.5	177.3	-1.6	112.9	W274 D330 E332 E335	R268-W274 HydrophobicContact CB-CD2 4.18Å; R268-W274 HydrophobicContact CB-CG 4.11Å; R268-D330 PolarHBondContact NH1-O 3.15Å; R268-E332 IonicContact CZ-OE1 3.15Å; R268-E332 VanDerWaalsContact NH2-CD 3.33Å; R268-E332 VanDerWaalsContact NH2-CG 3.35Å; R268-E332 IonicContact NH2-OE1 3.19Å; R268-E332 PolarHBondContact NH2-OE1 3.39Å; R268-E335 IonicContact CZ-OE1 2.73Å; R268-E335 IonicContact CZ-OE2 2.94Å; R268-E335 IonicContact NE-OE1 3.76Å; R268-E335 PolarHBondContact NE-OE1 2.98Å; R268-E335 IonicContact NH1-OE2 3.24Å; R268-E335 IonicContact NH2-OE2 3.93Å
269	E	77.4	Confident	80.3	Confident	166 Å²	166	68.8 Å²	68.8	78%	0.776	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-27.8	179.2	-54.3	72.9	-156	0	0	112.5	T267	T267-E269 WeakPolarHBondContact CB-OE2 3.38Å; T267-E269 PolarHBondContact O-N 3.14Å; T267-E269 PolarHBondContact OG1-OE2 3.06Å
270	A	77.9	Confident	80.5	Confident	82 Å²	82	68.3 Å²	68.3	68%	0.678	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-30.4	-175.5	0	0	0	0	0	113	T267	T267-A270 PolarHBondContact O-N 3.2Å; T267-A270 VanDerWaalsContact O-N 3.16Å
271	D	79	Confident	80.7	Confident	50 Å²	50	70 Å²	70	27%	0.267	38%	0.376	S	S	.	.			trans	-146.9	128.7	-174.1	-165.9	-20.9	0	0	0	111.6	V266 T267 M273 W274 R277	V266-D271 HydrophobicContact CG1-CB 4.29Å; T267-D271 PolarHBondContact O-N 3.22Å; D271-M273 PolarHBondContact O-N 3.38Å; D271-M273 PolarHBondContact OD1-N 2.92Å; D271-W274 HydrophobicContact CB-CB 4.38Å; D271-W274 VanDerWaalsContact O-CB 3.27Å; D271-W274 WeakPolarHBondContact O-CB 3.45Å; D271-W274 PolarHBondContact O-N 3.33Å; D271-W274 VanDerWaalsContact O-N 3.15Å; D271-R277 IonicContact OD2-NH1 2.72Å
272	K	79.8	Confident	81.1	Confident	190 Å²	190	65.6 Å²	65.6	83%	0.826	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.6	176	-69	-172.9	178	-175.8	0	112.9
273	M	85.4	Confident	81.9	Confident	120 Å²	120	64.5 Å²	64.5	59%	0.591	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	23.1	177.1	-62.9	-66	176.6	0	0	111.8	D271 L275 V276 R277	D271-M273 PolarHBondContact O-N 3.38Å; D271-M273 PolarHBondContact OD1-N 2.92Å; M273-L275 VanDerWaalsContact C-N 3.26Å; M273-L275 PolarHBondContact O-N 3.18Å; M273-V276 PolarHBondContact O-N 3.5Å; M273-R277 PolarHBondContact O-N 3.45Å
274	W	89.6	Confident	82.9	Confident	13 Å²	13	69 Å²	69	5%	0.049	35%	0.352	C	S	.	.	H	α-helix	trans	-50.6	-44.7	-174.9	71.9	-81.8	0	0	0	112.8	V266 R268 D271 R277 L278 L326 E335	V266-W274 HydrophobicContact CG1-CB 3.79Å; R268-W274 HydrophobicContact CB-CD2 4.18Å; R268-W274 HydrophobicContact CB-CG 4.11Å; D271-W274 HydrophobicContact CB-CB 4.38Å; D271-W274 VanDerWaalsContact O-CB 3.27Å; D271-W274 WeakPolarHBondContact O-CB 3.45Å; D271-W274 PolarHBondContact O-N 3.33Å; D271-W274 VanDerWaalsContact O-N 3.15Å; W274-R277 PolarHBondContact O-N 3.44Å; W274-L278 HydrophobicContact CE3-CD2 4.31Å; W274-L278 HydrophobicContact CZ3-CD2 3.88Å; W274-L278 VanDerWaalsContact O-CB 3.31Å; W274-L278 WeakPolarHBondContact O-CB 3.45Å; W274-L278 PolarHBondContact O-N 3.31Å; W274-L326 HydrophobicContact CH2-CD2 3.84Å; W274-L326 HydrophobicContact CZ3-CD2 4Å; W274-E335 PolarHBondContact NE1-OE1 3.44Å
275	L	89.8	Confident	84.1	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-69.4	-44	-175.5	-175.5	59.5	0	0	0	111.7	M273 R277 L278 L279 L326 L331 E335 L339	M273-L275 VanDerWaalsContact C-N 3.26Å; M273-L275 PolarHBondContact O-N 3.18Å; L275-R277 VanDerWaalsContact C-N 3.27Å; L275-R277 PolarHBondContact O-N 3.22Å; L275-L278 HydrophobicContact CD1-CD2 4.49Å; L275-L278 PolarHBondContact O-N 3.06Å; L275-L279 HydrophobicContact CD1-CD1 4.19Å; L275-L279 HydrophobicContact CD1-CG 4.19Å; L275-L279 HydrophobicContact CG-CD1 4Å; L275-L279 HydrophobicContact CG-CG 4.43Å; L275-L279 WeakPolarHBondContact O-CB 3.45Å; L275-L279 WeakPolarHBondContact O-CG 3.39Å; L275-L279 PolarHBondContact O-N 3.2Å; L275-L326 HydrophobicContact CD1-CD1 4.02Å; L275-L326 HydrophobicContact CD1-CD2 4.25Å; L275-L331 HydrophobicContact CD2-CD2 4.44Å; L275-E335 HydrophobicContact CD2-CB 3.78Å; L275-E335 HydrophobicContact CD2-CG 4.4Å; L275-E335 WeakPolarHBondContact CD2-O 3.39Å; L275-L339 HydrophobicContact CD2-CB 4.3Å
276	V	89.7	Confident	85.6	Confident	67 Å²	67	65.7 Å²	65.7	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-58.2	-44.8	175.3	177.3	0	0	0	0	110.1	M273 E280 S338	M273-V276 PolarHBondContact O-N 3.5Å; V276-E280 WeakPolarHBondContact O-CB 3.31Å; V276-E280 PolarHBondContact O-N 3.34Å; V276-S338 WeakPolarHBondContact CG2-OG 3.4Å
277	R	88.9	Confident	86.8	Confident	136 Å²	136	65.5 Å²	65.5	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-66.7	-42.5	179.2	-172.5	173.1	179.2	177.1	-1.4	112.2	V266 D271 M273 W274 L275 E280 I281	V266-R277 HydrophobicContact CG2-CG 4.28Å; D271-R277 IonicContact OD2-NH1 2.72Å; M273-R277 PolarHBondContact O-N 3.45Å; W274-R277 PolarHBondContact O-N 3.44Å; L275-R277 VanDerWaalsContact C-N 3.27Å; L275-R277 PolarHBondContact O-N 3.22Å; R277-E280 PolarHBondContact O-N 2.93Å; R277-I281 HydrophobicContact CG-CD1 3.85Å; R277-I281 HydrophobicContact CG-CG1 4.45Å; R277-I281 WeakPolarHBondContact O-CB 3.45Å; R277-I281 WeakPolarHBondContact O-CG1 3.31Å; R277-I281 PolarHBondContact O-N 2.9Å
278	L	89.8	Confident	87.8	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-47.5	176.5	177.8	65.6	0	0	0	111.3	T263 W274 L275 E280 I281 T282 L326	T263-L278 WeakPolarHBondContact O-CD1 3.43Å; W274-L278 HydrophobicContact CE3-CD2 4.31Å; W274-L278 HydrophobicContact CZ3-CD2 3.88Å; W274-L278 VanDerWaalsContact O-CB 3.31Å; W274-L278 WeakPolarHBondContact O-CB 3.45Å; W274-L278 PolarHBondContact O-N 3.31Å; L275-L278 HydrophobicContact CD1-CD2 4.49Å; L275-L278 PolarHBondContact O-N 3.06Å; L278-E280 PolarHBondContact O-N 2.96Å; L278-I281 PolarHBondContact O-N 3.26Å; L278-T282 WeakPolarHBondContact O-CB 3.26Å; L278-T282 PolarHBondContact O-N 3.44Å; L278-T282 PolarHBondContact O-OG1 3.29Å; L278-L326 HydrophobicContact CD2-CD1 4.14Å; L278-L326 HydrophobicContact CD2-CD2 4.19Å
279	L	91.3	Very high	88.4	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-39.9	179.1	-68	171.7	0	0	0	111.7	L275 T282 R283 L339 W342	L275-L279 HydrophobicContact CD1-CD1 4.19Å; L275-L279 HydrophobicContact CD1-CG 4.19Å; L275-L279 HydrophobicContact CG-CD1 4Å; L275-L279 HydrophobicContact CG-CG 4.43Å; L275-L279 WeakPolarHBondContact O-CB 3.45Å; L275-L279 WeakPolarHBondContact O-CG 3.39Å; L275-L279 PolarHBondContact O-N 3.2Å; L279-T282 PolarHBondContact O-N 2.91Å; L279-R283 WeakPolarHBondContact O-CB 3.41Å; L279-R283 PolarHBondContact O-N 3.41Å; L279-L339 HydrophobicContact CD1-CD1 4.34Å; L279-L339 HydrophobicContact CD2-CD1 4.19Å; L279-W342 HydrophobicContact CB-CD2 4.22Å; L279-W342 HydrophobicContact CB-CG 3.97Å; L279-W342 HydrophobicContact CD1-CB 3.84Å; L279-W342 HydrophobicContact CD1-CG 4.02Å; L279-W342 HydrophobicContact CD2-CD2 3.84Å; L279-W342 HydrophobicContact CD2-CE3 3.92Å; L279-W342 HydrophobicContact CD2-CG 4.17Å; L279-W342 HydrophobicContact CD2-CZ3 4.36Å; L279-W342 HydrophobicContact CG-CD2 4.41Å; L279-W342 HydrophobicContact CG-CG 4.27Å; L279-W342 PolarHBondContact O-NE1 3.47Å
280	E	90.9	Very high	89.2	Confident	63 Å²	63	54.2 Å²	54.2	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-69.6	-39.2	177.5	177.1	56.1	-163.2	0	0	112.9	V276 R277 L278 R283 K284	V276-E280 WeakPolarHBondContact O-CB 3.31Å; V276-E280 PolarHBondContact O-N 3.34Å; R277-E280 PolarHBondContact O-N 2.93Å; L278-E280 PolarHBondContact O-N 2.96Å; E280-R283 PolarHBondContact O-N 2.79Å; E280-R283 IonicContact OE1-CZ 3.25Å; E280-R283 IonicContact OE1-NE 3.31Å; E280-R283 IonicContact OE1-NH2 3.87Å; E280-R283 PolarHBondContact OE1-NH2 3.27Å; E280-R283 IonicContact OE2-CZ 3.19Å; E280-R283 IonicContact OE2-NE 3.76Å; E280-R283 PolarHBondContact OE2-NE 3.44Å; E280-R283 IonicContact OE2-NH2 3.84Å; E280-R283 PolarHBondContact OE2-NH2 3.1Å; E280-K284 PolarHBondContact O-N 3.19Å; E280-K284 VanDerWaalsContact O-N 3.09Å; E280-K284 WeakPolarHBondContact OE1-CE 3.23Å; E280-K284 IonicContact OE1-NZ 3.23Å; E280-K284 PolarHBondContact OE1-NZ 3.45Å
281	I	90.4	Very high	89.9	Confident	43 Å²	43	52 Å²	52	22%	0.221	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-45.2	172.9	-72.6	170.1	0	0	0	110	T263 V266 R277 L278 K284 Y285	T263-I281 HydrophobicContact CG2-CG2 4.05Å; V266-I281 HydrophobicContact CG2-CD1 4.17Å; R277-I281 HydrophobicContact CG-CD1 3.85Å; R277-I281 HydrophobicContact CG-CG1 4.45Å; R277-I281 WeakPolarHBondContact O-CB 3.45Å; R277-I281 WeakPolarHBondContact O-CG1 3.31Å; R277-I281 PolarHBondContact O-N 2.9Å; L278-I281 PolarHBondContact O-N 3.26Å; I281-K284 PolarHBondContact O-N 3.39Å; I281-Y285 HydrophobicContact CG2-CD2 3.42Å; I281-Y285 VanDerWaalsContact CG2-CD2 3.42Å; I281-Y285 HydrophobicContact CG2-CE2 3.22Å; I281-Y285 WeakPolarHBondContact O-CD2 3.32Å; I281-Y285 PolarHBondContact O-N 2.86Å
282	T	91.8	Very high	90.5	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-47.4	177.3	-57.5	0	0	0	0	110.9	I260 L278 L279 K284 Y285 V286 V319	I260-T282 HydrophobicContact CD1-CG2 4.38Å; L278-T282 WeakPolarHBondContact O-CB 3.26Å; L278-T282 PolarHBondContact O-N 3.44Å; L278-T282 PolarHBondContact O-OG1 3.29Å; L279-T282 PolarHBondContact O-N 2.91Å; T282-K284 PolarHBondContact O-N 3.47Å; T282-Y285 PolarHBondContact O-N 2.99Å; T282-V286 HydrophobicContact CG2-CG2 4.16Å; T282-V286 WeakPolarHBondContact O-CB 3.41Å; T282-V286 VanDerWaalsContact O-CG2 3.25Å; T282-V286 WeakPolarHBondContact O-CG2 3.39Å; T282-V286 PolarHBondContact O-N 3.41Å; T282-V319 HydrophobicContact CG2-CG2 4.31Å
283	R	92.8	Very high	91.2	Very high	36 Å²	36	41.5 Å²	41.5	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-53.3	-52.6	176.8	-173.4	-167.5	66.7	82.4	-2.4	111.5	L279 E280 L287 W342 E351 M352	L279-R283 WeakPolarHBondContact O-CB 3.41Å; L279-R283 PolarHBondContact O-N 3.41Å; E280-R283 PolarHBondContact O-N 2.79Å; E280-R283 IonicContact OE1-CZ 3.25Å; E280-R283 IonicContact OE1-NE 3.31Å; E280-R283 IonicContact OE1-NH2 3.87Å; E280-R283 PolarHBondContact OE1-NH2 3.27Å; E280-R283 IonicContact OE2-CZ 3.19Å; E280-R283 IonicContact OE2-NE 3.76Å; E280-R283 PolarHBondContact OE2-NE 3.44Å; E280-R283 IonicContact OE2-NH2 3.84Å; E280-R283 PolarHBondContact OE2-NH2 3.1Å; R283-L287 WeakPolarHBondContact O-CB 3.38Å; R283-L287 PolarHBondContact O-N 3.36Å; R283-L287 VanDerWaalsContact O-N 3.13Å; R283-W342 HydrophobicContact CB-CZ2 4.34Å; R283-E351 PolarHBondContact NH1-O 2.92Å; R283-M352 HydrophobicContact CB-SD 4.25Å; R283-M352 HydrophobicContact CG-CB 3.86Å; R283-M352 HydrophobicContact CG-CG 3.84Å; R283-M352 HydrophobicContact CG-SD 3.88Å
284	K	91.1	Very high	91.5	Very high	103 Å²	103	37.6 Å²	37.6	45%	0.448	17%	0.173	S	C	.	.	H	α-helix	trans	-61.8	-49.4	-179.7	-78.2	176.4	164.8	129.4	0	112.1	E280 I281 T282 L287 D288	E280-K284 PolarHBondContact O-N 3.19Å; E280-K284 VanDerWaalsContact O-N 3.09Å; E280-K284 WeakPolarHBondContact OE1-CE 3.23Å; E280-K284 IonicContact OE1-NZ 3.23Å; E280-K284 PolarHBondContact OE1-NZ 3.45Å; I281-K284 PolarHBondContact O-N 3.39Å; T282-K284 PolarHBondContact O-N 3.47Å; K284-L287 PolarHBondContact O-N 3Å; K284-D288 WeakPolarHBondContact O-CB 3.23Å; K284-D288 VanDerWaalsContact O-CG 3.26Å; K284-D288 PolarHBondContact O-N 3.11Å
285	Y	90.4	Very high	91.5	Very high	114 Å²	114	41.5 Å²	41.5	45%	0.447	20%	0.195	S	C	.	.	H	α-helix	trans	-65	-43.7	-177.1	-76.4	-40.8	0	0	0	113.3	T263 I281 T282 L287 D288 D289	T263-Y285 HydrophobicContact CG2-CD2 3.57Å; T263-Y285 HydrophobicContact CG2-CE2 4Å; I281-Y285 HydrophobicContact CG2-CD2 3.42Å; I281-Y285 VanDerWaalsContact CG2-CD2 3.42Å; I281-Y285 HydrophobicContact CG2-CE2 3.22Å; I281-Y285 WeakPolarHBondContact O-CD2 3.32Å; I281-Y285 PolarHBondContact O-N 2.86Å; T282-Y285 PolarHBondContact O-N 2.99Å; Y285-L287 VanDerWaalsContact C-N 3.34Å; Y285-D288 PolarHBondContact O-N 2.82Å; Y285-D289 VanDerWaalsContact O-CB 3.32Å; Y285-D289 WeakPolarHBondContact O-CB 3.35Å; Y285-D289 VanDerWaalsContact O-CG 3.26Å; Y285-D289 PolarHBondContact O-N 3.18Å
286	V	92.9	Very high	91.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-45.5	178	172.8	0	0	0	0	110.3	I260 T282 D289 L290 Y315 V319 M352 M353	I260-V286 HydrophobicContact CD1-CG2 3.57Å; T282-V286 HydrophobicContact CG2-CG2 4.16Å; T282-V286 WeakPolarHBondContact O-CB 3.41Å; T282-V286 VanDerWaalsContact O-CG2 3.25Å; T282-V286 WeakPolarHBondContact O-CG2 3.39Å; T282-V286 PolarHBondContact O-N 3.41Å; V286-D289 PolarHBondContact O-N 3.3Å; V286-L290 HydrophobicContact CG1-CD1 3.84Å; V286-L290 HydrophobicContact CG1-CG 4.36Å; V286-L290 WeakPolarHBondContact O-CB 3.39Å; V286-L290 VanDerWaalsContact O-CG 3.3Å; V286-L290 WeakPolarHBondContact O-CG 3.47Å; V286-L290 PolarHBondContact O-N 3.15Å; V286-Y315 HydrophobicContact CB-CD1 4.47Å; V286-Y315 HydrophobicContact CG1-CD1 4.13Å; V286-Y315 HydrophobicContact CG1-CG 4.3Å; V286-Y315 HydrophobicContact CG2-CD1 4Å; V286-Y315 HydrophobicContact CG2-CE1 4.47Å; V286-V319 HydrophobicContact CG2-CG2 3.93Å; V286-M352 HydrophobicContact CB-CE 3.85Å; V286-M352 HydrophobicContact CG1-CE 3.82Å; V286-M352 HydrophobicContact CG2-CE 4.23Å; V286-M353 HydrophobicContact CG1-SD 4.37Å
287	L	93	Very high	91.8	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.079	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-50.3	178.6	179.8	59.3	0	0	0	111.7	R283 K284 Y285 D289 L290 I291 H355 L358	R283-L287 WeakPolarHBondContact O-CB 3.38Å; R283-L287 PolarHBondContact O-N 3.36Å; R283-L287 VanDerWaalsContact O-N 3.13Å; K284-L287 PolarHBondContact O-N 3Å; Y285-L287 VanDerWaalsContact C-N 3.34Å; L287-D289 VanDerWaalsContact C-N 3.26Å; L287-D289 PolarHBondContact O-N 2.68Å; L287-L290 PolarHBondContact O-N 2.8Å; L287-I291 HydrophobicContact CD1-CD1 3.93Å; L287-I291 HydrophobicContact CD1-CG1 4.25Å; L287-I291 HydrophobicContact CG-CD1 3.92Å; L287-I291 VanDerWaalsContact O-CG1 3.28Å; L287-I291 WeakPolarHBondContact O-CG1 3.25Å; L287-I291 PolarHBondContact O-N 3.31Å; L287-H355 HydrophobicContact CD1-CB 3.73Å; L287-L358 HydrophobicContact CD1-CD1 3.77Å; L287-L358 HydrophobicContact CD1-CG 4.29Å
288	D	92.4	Very high	91.9	Very high	84 Å²	84	37.5 Å²	37.5	45%	0.449	18%	0.183	S	C	.	.	H	α-helix	trans	-58.9	-39.2	179.4	-74.8	-14.1	0	0	0	112	K284 Y285 V292	K284-D288 WeakPolarHBondContact O-CB 3.23Å; K284-D288 VanDerWaalsContact O-CG 3.26Å; K284-D288 PolarHBondContact O-N 3.11Å; Y285-D288 PolarHBondContact O-N 2.82Å; D288-V292 WeakPolarHBondContact O-CG2 3.12Å; D288-V292 PolarHBondContact O-N 2.83Å; D288-V292 VanDerWaalsContact O-N 3.15Å
289	D	92.7	Very high	91.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-43.3	178.7	-75	-21.8	0	0	0	112.1	M199 R203 R259 Y285 V286 L287 I291 V292 V293 Y315	M199-D289 HydrophobicContact CE-CB 4.25Å; M199-D289 HydrophobicContact SD-CB 4.3Å; R203-D289 IonicContact NH2-OD1 3.73Å; R259-D289 VanDerWaalsContact CD-OD2 3.31Å; R259-D289 WeakPolarHBondContact CD-OD2 3.21Å; R259-D289 IonicContact CZ-OD1 2.68Å; R259-D289 IonicContact CZ-OD2 2.75Å; R259-D289 IonicContact NE-OD2 2.75Å; R259-D289 PolarHBondContact NE-OD2 3.42Å; R259-D289 VanDerWaalsContact NE-OD2 3.11Å; R259-D289 IonicContact NH1-OD1 2.7Å; R259-D289 PolarHBondContact NH1-OD1 2.88Å; R259-D289 IonicContact NH1-OD2 2.75Å; R259-D289 PolarHBondContact NH1-OD2 3.22Å; R259-D289 VanDerWaalsContact NH2-CG 3.34Å; R259-D289 IonicContact NH2-OD1 3.57Å; R259-D289 PolarHBondContact NH2-OD1 2.95Å; R259-D289 IonicContact NH2-OD2 3.56Å; R259-D289 PolarHBondContact NH2-OD2 2.82Å; R259-D289 VanDerWaalsContact NH2-OD2 3.16Å; Y285-D289 VanDerWaalsContact O-CB 3.32Å; Y285-D289 WeakPolarHBondContact O-CB 3.35Å; Y285-D289 VanDerWaalsContact O-CG 3.26Å; Y285-D289 PolarHBondContact O-N 3.18Å; V286-D289 PolarHBondContact O-N 3.3Å; L287-D289 VanDerWaalsContact C-N 3.26Å; L287-D289 PolarHBondContact O-N 2.68Å; D289-I291 VanDerWaalsContact C-N 3.3Å; D289-I291 PolarHBondContact O-N 3.21Å; D289-V292 CarbonylContact O-C 3.38Å; D289-V292 PolarHBondContact O-N 3.14Å; D289-V292 VanDerWaalsContact O-N 3.13Å; D289-V293 VanDerWaalsContact O-CG2 3.31Å; D289-V293 WeakPolarHBondContact O-CG2 3.35Å; D289-V293 PolarHBondContact O-N 3.42Å; D289-Y315 HydrophobicContact CB-CE1 4.41Å; D289-Y315 HydrophobicContact CB-CE2 4.21Å; D289-Y315 VanDerWaalsContact CB-OH 3.3Å; D289-Y315 WeakPolarHBondContact CB-OH 3.43Å; D289-Y315 PolarHBondContact OD2-OH 2.86Å
290	L	93.4	Very high	92	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-37.2	176.7	-72.6	174.9	0	0	0	112	V286 L287 V292 V293 K294 F312 Y315 M353 L358	V286-L290 HydrophobicContact CG1-CD1 3.84Å; V286-L290 HydrophobicContact CG1-CG 4.36Å; V286-L290 WeakPolarHBondContact O-CB 3.39Å; V286-L290 VanDerWaalsContact O-CG 3.3Å; V286-L290 WeakPolarHBondContact O-CG 3.47Å; V286-L290 PolarHBondContact O-N 3.15Å; L287-L290 PolarHBondContact O-N 2.8Å; L290-V292 VanDerWaalsContact C-N 3.32Å; L290-V292 PolarHBondContact O-N 3.13Å; L290-V293 PolarHBondContact O-N 3.01Å; L290-K294 WeakPolarHBondContact O-CB 3.35Å; L290-K294 PolarHBondContact O-N 3.26Å; L290-F312 HydrophobicContact CD1-CD2 4.08Å; L290-F312 HydrophobicContact CD1-CE2 4.43Å; L290-F312 HydrophobicContact CD2-CB 4.43Å; L290-F312 HydrophobicContact CD2-CD2 4.33Å; L290-Y315 HydrophobicContact CD2-CD2 3.65Å; L290-Y315 HydrophobicContact CD2-CE2 4.29Å; L290-Y315 HydrophobicContact CD2-CG 4.35Å; L290-Y315 HydrophobicContact CG-CD2 4.19Å; L290-M353 HydrophobicContact CD1-CE 4.21Å; L290-M353 HydrophobicContact CD1-SD 3.83Å; L290-L358 HydrophobicContact CB-CD1 4.18Å; L290-L358 HydrophobicContact CB-CD2 3.86Å; L290-L358 HydrophobicContact CD1-CD1 3.99Å
291	I	92.4	Very high	92.1	Very high	36 Å²	36	42.6 Å²	42.6	19%	0.185	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-42.2	173.2	-69.8	169.1	0	0	0	110.5	L287 D289 K294 N295 L358	L287-I291 HydrophobicContact CD1-CD1 3.93Å; L287-I291 HydrophobicContact CD1-CG1 4.25Å; L287-I291 HydrophobicContact CG-CD1 3.92Å; L287-I291 VanDerWaalsContact O-CG1 3.28Å; L287-I291 WeakPolarHBondContact O-CG1 3.25Å; L287-I291 PolarHBondContact O-N 3.31Å; D289-I291 VanDerWaalsContact C-N 3.3Å; D289-I291 PolarHBondContact O-N 3.21Å; I291-K294 PolarHBondContact O-N 2.99Å; I291-N295 WeakPolarHBondContact CG2-ND2 3.3Å; I291-N295 WeakPolarHBondContact O-CB 3.47Å; I291-N295 PolarHBondContact O-N 2.77Å; I291-N295 PolarHBondContact O-ND2 3.36Å; I291-L358 HydrophobicContact CG1-CD2 4.34Å
292	V	93.2	Very high	92.1	Very high	18 Å²	18	41.9 Å²	41.9	11%	0.109	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-36.7	176.9	165.7	0	0	0	0	112.4	M199 V202 R203 D288 D289 L290 L296 M297	M199-V292 HydrophobicContact SD-CG1 4.48Å; V202-V292 HydrophobicContact CG1-CG1 3.74Å; R203-V292 HydrophobicContact CG-CG1 4.25Å; D288-V292 WeakPolarHBondContact O-CG2 3.12Å; D288-V292 PolarHBondContact O-N 2.83Å; D288-V292 VanDerWaalsContact O-N 3.15Å; D289-V292 CarbonylContact O-C 3.38Å; D289-V292 PolarHBondContact O-N 3.14Å; D289-V292 VanDerWaalsContact O-N 3.13Å; L290-V292 VanDerWaalsContact C-N 3.32Å; L290-V292 PolarHBondContact O-N 3.13Å; V292-L296 HydrophobicContact CG1-CD1 4.29Å; V292-L296 WeakPolarHBondContact O-CB 3.25Å; V292-L296 PolarHBondContact O-N 2.87Å; V292-M297 PolarHBondContact O-N 2.89Å; V292-M297 VanDerWaalsContact O-N 3.16Å
293	V	93.1	Very high	92	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	I	π-helix	trans	-59.7	-50.9	173.6	171.7	0	0	0	0	109.7	M199 D289 L290 M297 V298 F308 F311	M199-V293 HydrophobicContact CE-CG2 3.39Å; M199-V293 HydrophobicContact SD-CG2 4.17Å; D289-V293 VanDerWaalsContact O-CG2 3.31Å; D289-V293 WeakPolarHBondContact O-CG2 3.35Å; D289-V293 PolarHBondContact O-N 3.42Å; L290-V293 PolarHBondContact O-N 3.01Å; V293-M297 HydrophobicContact CB-CB 4.33Å; V293-M297 HydrophobicContact CG1-CB 4.29Å; V293-M297 HydrophobicContact CG2-CB 4.46Å; V293-M297 HydrophobicContact CG2-SD 4.07Å; V293-M297 CarbonylContact O-C 3.59Å; V293-M297 WeakPolarHBondContact O-CA 3.46Å; V293-M297 WeakPolarHBondContact O-CB 3.44Å; V293-M297 PolarHBondContact O-N 3.41Å; V293-M297 VanDerWaalsContact O-N 3.09Å; V293-V298 WeakPolarHBondContact O-CG2 3.27Å; V293-V298 PolarHBondContact O-N 3.11Å; V293-F308 HydrophobicContact CG1-CD2 4.12Å; V293-F311 HydrophobicContact CG1-CB 3.84Å; V293-F311 HydrophobicContact CG1-CD2 3.96Å; V293-F311 HydrophobicContact CG1-CG 3.98Å; V293-F311 HydrophobicContact CG2-CB 4.2Å; V293-F311 HydrophobicContact CG2-CD1 4.08Å; V293-F311 HydrophobicContact CG2-CD2 4.42Å; V293-F311 HydrophobicContact CG2-CG 3.98Å
294	K	91.3	Very high	91.9	Very high	39 Å²	39	51.7 Å²	51.7	17%	0.17	26%	0.263	C	S	.	.	I	π-helix	trans	-57.2	-53.5	178.8	-176	-176.3	178.4	-177	0	111.9	L290 I291 F308 D357 S360 E361	L290-K294 WeakPolarHBondContact O-CB 3.35Å; L290-K294 PolarHBondContact O-N 3.26Å; I291-K294 PolarHBondContact O-N 2.99Å; K294-F308 HydrophobicContact CB-CD2 3.88Å; K294-F308 HydrophobicContact CB-CE2 3.81Å; K294-F308 HydrophobicContact CG-CD2 4.46Å; K294-F308 HydrophobicContact CG-CE2 4.44Å; K294-D357 WeakPolarHBondContact CD-O 3.37Å; K294-D357 WeakPolarHBondContact CE-O 3.3Å; K294-D357 PolarHBondContact NZ-O 3.05Å; K294-S360 PolarHBondContact NZ-OG 3.25Å; K294-E361 HydrophobicContact CD-CG 3.99Å; K294-E361 WeakPolarHBondContact CE-OE1 3.43Å; K294-E361 HydrophobicContact CG-CG 4.24Å
295	N	91.1	Very high	91.8	Very high	94 Å²	94	47.4 Å²	47.4	50%	0.503	24%	0.244	S	C	.	.	I	π-helix	trans	-81	-34.7	-167.5	-68	-24.7	0	0	0	113.4	I291	I291-N295 WeakPolarHBondContact CG2-ND2 3.3Å; I291-N295 WeakPolarHBondContact O-CB 3.47Å; I291-N295 PolarHBondContact O-N 2.77Å; I291-N295 PolarHBondContact O-ND2 3.36Å
296	L	91.9	Very high	91.8	Very high	71 Å²	71	46.1 Å²	46.1	37%	0.372	25%	0.245	S	C	.	.	I	π-helix	trans	-117.1	-44.4	-172.3	-55.3	-179.5	0	0	0	112.6	V202 R203 V292 C300	V202-L296 HydrophobicContact CG1-CB 4.38Å; V202-L296 HydrophobicContact CG2-CB 3.72Å; R203-L296 HydrophobicContact CG-CD1 4.25Å; V292-L296 HydrophobicContact CG1-CD1 4.29Å; V292-L296 WeakPolarHBondContact O-CB 3.25Å; V292-L296 PolarHBondContact O-N 2.87Å; L296-C300 PolarHBondContact O-SG 3.31Å
297	M	92	Very high	91.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	I	π-helix	trans	-75.1	-38.8	-170.8	-158.1	162.5	-171.3	0	0	112.8	S198 M199 V202 L209 L252 V292 V293 Q299 C300 F301 F311	S198-M297 VanDerWaalsContact CB-CE 3.48Å; M199-M297 HydrophobicContact CE-SD 4.36Å; V202-M297 HydrophobicContact CG2-CB 4.36Å; L209-M297 HydrophobicContact CD2-CE 4.04Å; L209-M297 HydrophobicContact CD2-CG 4.2Å; L252-M297 HydrophobicContact CD2-CE 4.28Å; V292-M297 PolarHBondContact O-N 2.89Å; V292-M297 VanDerWaalsContact O-N 3.16Å; V293-M297 HydrophobicContact CB-CB 4.33Å; V293-M297 HydrophobicContact CG1-CB 4.29Å; V293-M297 HydrophobicContact CG2-CB 4.46Å; V293-M297 HydrophobicContact CG2-SD 4.07Å; V293-M297 CarbonylContact O-C 3.59Å; V293-M297 WeakPolarHBondContact O-CA 3.46Å; V293-M297 WeakPolarHBondContact O-CB 3.44Å; V293-M297 PolarHBondContact O-N 3.41Å; V293-M297 VanDerWaalsContact O-N 3.09Å; M297-Q299 PolarHBondContact O-N 3.17Å; M297-Q299 VanDerWaalsContact O-N 3.17Å; M297-C300 WeakPolarHBondContact O-CB 3.48Å; M297-C300 PolarHBondContact O-N 3Å; M297-F301 HydrophobicContact CE-CE2 3.72Å; M297-F301 HydrophobicContact CE-CZ 3.99Å; M297-F301 HydrophobicContact CG-CD2 4.18Å; M297-F301 HydrophobicContact CG-CE2 3.68Å; M297-F301 VanDerWaalsContact O-CD2 3.31Å; M297-F301 WeakPolarHBondContact O-CD2 3.45Å; M297-F311 HydrophobicContact CE-CE1 4.34Å; M297-F311 HydrophobicContact CE-CE2 3.74Å; M297-F311 HydrophobicContact CE-CZ 3.37Å; M297-F311 HydrophobicContact SD-CD2 4.48Å; M297-F311 HydrophobicContact SD-CE1 4.26Å; M297-F311 HydrophobicContact SD-CE2 3.75Å; M297-F311 HydrophobicContact SD-CZ 3.62Å
298	V	92.1	Very high	91.6	Very high	52 Å²	52	46 Å²	46	32%	0.315	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-54.2	-37.7	177.7	169.2	0	0	0	0	111.7	V293 C300 F301 F308	V293-V298 WeakPolarHBondContact O-CG2 3.27Å; V293-V298 PolarHBondContact O-N 3.11Å; V298-C300 PolarHBondContact O-N 3.12Å; V298-F301 PolarHBondContact O-N 2.94Å; V298-F308 HydrophobicContact CG2-CB 3.8Å
299	Q	90.3	Very high	91.5	Very high	156 Å²	156	44.2 Å²	44.2	73%	0.729	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-68.5	-17.6	179.3	-54.9	-63.5	5.1	0	0	113.7	M297	M297-Q299 PolarHBondContact O-N 3.17Å; M297-Q299 VanDerWaalsContact O-N 3.17Å
300	C	91.9	Very high	91.3	Very high	10 Å²	10	49 Å²	49	7%	0.068	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-86.9	-13.8	-179.9	-60.3	0	0	0	0	113.5	L209 V210 L296 M297 V298	L209-C300 HydrophobicContact CD2-CB 3.86Å; L209-C300 HydrophobicContact CG-CB 4.1Å; V210-C300 HydrophobicContact CG2-CB 3.88Å; L296-C300 PolarHBondContact O-SG 3.31Å; M297-C300 WeakPolarHBondContact O-CB 3.48Å; M297-C300 PolarHBondContact O-N 3Å; V298-C300 PolarHBondContact O-N 3.12Å
301	F	93.2	Very high	91.2	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	25%	0.254	C	S	.	.	S	Bend	trans	-115.2	153.7	-175.3	-71.4	-98.2	0	0	0	111.8	L209 V213 M248 L252 M297 V298 Y305 T307	L209-F301 HydrophobicContact CD2-CE2 4.07Å; L209-F301 HydrophobicContact CG-CE2 4.45Å; V213-F301 HydrophobicContact CG1-CD1 4Å; V213-F301 HydrophobicContact CG1-CE1 4.49Å; V213-F301 HydrophobicContact CG2-CD1 3.77Å; V213-F301 HydrophobicContact CG2-CE1 3.52Å; V213-F301 HydrophobicContact CG2-CE2 4.39Å; V213-F301 HydrophobicContact CG2-CG 4.33Å; V213-F301 HydrophobicContact CG2-CZ 3.87Å; M248-F301 HydrophobicContact CE-CE1 4.04Å; M248-F301 HydrophobicContact SD-CE1 3.89Å; L252-F301 HydrophobicContact CD1-CE1 4.44Å; L252-F301 HydrophobicContact CD1-CZ 4.21Å; M297-F301 HydrophobicContact CE-CE2 3.72Å; M297-F301 HydrophobicContact CE-CZ 3.99Å; M297-F301 HydrophobicContact CG-CD2 4.18Å; M297-F301 HydrophobicContact CG-CE2 3.68Å; M297-F301 VanDerWaalsContact O-CD2 3.31Å; M297-F301 WeakPolarHBondContact O-CD2 3.45Å; V298-F301 PolarHBondContact O-N 2.94Å; F301-Y305 AromaticContact CD1-CD2 3.85Å; F301-Y305 HydrophobicContact CD1-CD2 3.85Å; F301-Y305 HydrophobicContact CD1-CE2 4.41Å; F301-T307 HydrophobicContact CB-CG2 4.38Å; F301-T307 WeakPolarHBondContact CB-OG1 3.49Å; F301-T307 HydrophobicContact CD2-CG2 3.77Å; F301-T307 HydrophobicContact CE2-CG2 4.16Å; F301-T307 HydrophobicContact CG-CG2 4.03Å; F301-T307 WeakPolarHBondContact CG-OG1 3.45Å
302	P	91.9	Very high	91.1	Very high	29 Å²	29	47.7 Å²	47.7	19%	0.188	25%	0.246	C	C	.	.			trans	-61.4	144.6	172.3	-23.4	33.5	0	0	0	112.8	V213 E217 H304 Y305	V213-P302 HydrophobicContact CG1-CG 4.44Å; E217-P302 HydrophobicContact CG-CG 4Å; P302-H304 VanDerWaalsContact C-N 3.25Å; P302-H304 WeakPolarHBondContact CB-CE1 3.5Å; P302-H304 WeakPolarHBondContact CB-ND1 3.48Å; P302-H304 PolarHBondContact O-N 3.26Å; P302-H304 VanDerWaalsContact O-N 3.14Å; P302-Y305 HydrophobicContact CB-CD1 4.35Å; P302-Y305 HydrophobicContact CG-CD1 4.49Å; P302-Y305 WeakPolarHBondContact O-CB 3.36Å; P302-Y305 PolarHBondContact O-N 3.01Å
303	P	89.4	Confident	91	Very high	129 Å²	129	49.5 Å²	49.5	84%	0.838	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-57.5	-34.3	-178.4	-27.6	34.6	0	0	0	114.5	Y305 N306	P303-Y305 PolarHBondContact O-N 3.27Å; P303-Y305 VanDerWaalsContact O-N 3.14Å; P303-N306 PolarHBondContact O-N 3.42Å
304	H	89.4	Confident	90.9	Very high	122 Å²	122	50.5 Å²	50.5	57%	0.565	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-70.4	-5.7	-179.4	67.3	-86	0	0	0	114	E217 P302	E217-H304 IonicContact OE1-NE2 3.85Å; E217-H304 IonicContact OE2-CE1 2.66Å; P302-H304 VanDerWaalsContact C-N 3.25Å; P302-H304 WeakPolarHBondContact CB-CE1 3.5Å; P302-H304 WeakPolarHBondContact CB-ND1 3.48Å; P302-H304 PolarHBondContact O-N 3.26Å; P302-H304 VanDerWaalsContact O-N 3.14Å
305	Y	90.1	Very high	91	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.047	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-82.6	-15.5	173.7	-81.2	25.2	0	0	0	112.7	E217 K245 M248 F249 F301 P302 P303 T307	E217-Y305 PolarHBondContact OE1-OH 2.8Å; K245-Y305 HydrophobicContact CD-CE1 4.34Å; K245-Y305 WeakPolarHBondContact CD-OH 3.48Å; M248-Y305 HydrophobicContact CE-CD2 4.18Å; M248-Y305 HydrophobicContact CE-CE2 3.77Å; F249-Y305 HydrophobicContact CE2-CD2 4.14Å; F249-Y305 HydrophobicContact CE2-CE2 4.12Å; F249-Y305 AromaticContact CZ-CD2 3.55Å; F249-Y305 HydrophobicContact CZ-CD2 3.55Å; F249-Y305 AromaticContact CZ-CE2 3.96Å; F249-Y305 HydrophobicContact CZ-CE2 3.96Å; F249-Y305 HydrophobicContact CZ-CG 4.17Å; F301-Y305 AromaticContact CD1-CD2 3.85Å; F301-Y305 HydrophobicContact CD1-CD2 3.85Å; F301-Y305 HydrophobicContact CD1-CE2 4.41Å; P302-Y305 HydrophobicContact CB-CD1 4.35Å; P302-Y305 HydrophobicContact CG-CD1 4.49Å; P302-Y305 WeakPolarHBondContact O-CB 3.36Å; P302-Y305 PolarHBondContact O-N 3.01Å; P303-Y305 PolarHBondContact O-N 3.27Å; P303-Y305 VanDerWaalsContact O-N 3.14Å; Y305-T307 VanDerWaalsContact C-N 3.28Å; Y305-T307 PolarHBondContact O-N 3.43Å
306	N	89.7	Confident	91.1	Very high	87 Å²	87	45 Å²	45	47%	0.465	24%	0.236	S	C	.	.			trans	46.5	51.3	-176.4	-163.4	10	0	0	0	112.8	P303 F308 N309 R310	P303-N306 PolarHBondContact O-N 3.42Å; N306-F308 VanDerWaalsContact C-N 3.34Å; N306-F308 PolarHBondContact O-N 3.13Å; N306-N309 WeakPolarHBondContact ND2-CB 3.47Å; N306-N309 PolarHBondContact ND2-ND2 3.1Å; N306-N309 PolarHBondContact O-N 3.28Å; N306-N309 PolarHBondContact OD1-ND2 2.81Å; N306-R310 PolarHBondContact O-N 2.83Å; N306-R310 VanDerWaalsContact O-N 3.13Å
307	T	90.3	Very high	91.1	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.043	24%	0.24	C	C	.	.	H	α-helix	trans	-56.8	-43.9	-167.1	-56.5	0	0	0	0	112.8	F301 Y305 R310 F311	F301-T307 HydrophobicContact CB-CG2 4.38Å; F301-T307 WeakPolarHBondContact CB-OG1 3.49Å; F301-T307 HydrophobicContact CD2-CG2 3.77Å; F301-T307 HydrophobicContact CE2-CG2 4.16Å; F301-T307 HydrophobicContact CG-CG2 4.03Å; F301-T307 WeakPolarHBondContact CG-OG1 3.45Å; Y305-T307 VanDerWaalsContact C-N 3.28Å; Y305-T307 PolarHBondContact O-N 3.43Å; T307-R310 PolarHBondContact O-N 2.79Å; T307-F311 HydrophobicContact CG2-CD2 3.65Å; T307-F311 HydrophobicContact CG2-CE2 3.73Å; T307-F311 WeakPolarHBondContact O-CD2 3.18Å; T307-F311 PolarHBondContact O-N 3.46Å
308	F	91.5	Very high	91.1	Very high	7 Å²	7	46.1 Å²	46.1	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-54.7	-179.6	-178.3	-98.3	0	0	0	111.6	V293 K294 V298 N306 R310 F311 F312 L358 E361 F362	V293-F308 HydrophobicContact CG1-CD2 4.12Å; K294-F308 HydrophobicContact CB-CD2 3.88Å; K294-F308 HydrophobicContact CB-CE2 3.81Å; K294-F308 HydrophobicContact CG-CD2 4.46Å; K294-F308 HydrophobicContact CG-CE2 4.44Å; V298-F308 HydrophobicContact CG2-CB 3.8Å; N306-F308 VanDerWaalsContact C-N 3.34Å; N306-F308 PolarHBondContact O-N 3.13Å; F308-R310 PolarHBondContact O-N 2.8Å; F308-F311 PolarHBondContact O-N 2.69Å; F308-F312 HydrophobicContact CE1-CD2 4.32Å; F308-F312 HydrophobicContact CZ-CD2 4.26Å; F308-F312 VanDerWaalsContact O-CB 3.29Å; F308-F312 WeakPolarHBondContact O-CB 3.49Å; F308-F312 PolarHBondContact O-N 2.89Å; F308-L358 HydrophobicContact CE2-CD2 4.16Å; F308-L358 HydrophobicContact CZ-CD2 4.02Å; F308-E361 HydrophobicContact CD1-CB 3.56Å; F308-E361 HydrophobicContact CD1-CG 4.26Å; F308-E361 HydrophobicContact CE1-CB 3.38Å; F308-E361 HydrophobicContact CE1-CG 4.19Å; F308-E361 HydrophobicContact CG-CB 4.39Å; F308-E361 HydrophobicContact CZ-CB 4.08Å; F308-F362 HydrophobicContact CE1-CB 4.29Å
309	N	89.7	Confident	91.2	Very high	46 Å²	46	43.7 Å²	43.7	25%	0.246	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-33.8	-179.6	-68.7	0.9	0	0	0	112.1	N306 S313	N306-N309 WeakPolarHBondContact ND2-CB 3.47Å; N306-N309 PolarHBondContact ND2-ND2 3.1Å; N306-N309 PolarHBondContact O-N 3.28Å; N306-N309 PolarHBondContact OD1-ND2 2.81Å; N309-S313 WeakPolarHBondContact O-CB 3.5Å; N309-S313 PolarHBondContact O-N 3.08Å; N309-S313 PolarHBondContact O-OG 3.47Å
310	R	89.8	Confident	91.3	Very high	101 Å²	101	36.6 Å²	36.6	38%	0.381	20%	0.197	S	C	.	.	H	α-helix	trans	-69.9	-47.2	177.8	-161.8	164.8	-174.3	177.1	0.7	112	F249 N306 T307 F308 F312 S313 L314	F249-R310 VanDerWaalsContact CD1-NH1 3.33Å; F249-R310 VanDerWaalsContact CD2-CZ 3.5Å; F249-R310 VanDerWaalsContact CE1-NH1 3.31Å; N306-R310 PolarHBondContact O-N 2.83Å; N306-R310 VanDerWaalsContact O-N 3.13Å; T307-R310 PolarHBondContact O-N 2.79Å; F308-R310 PolarHBondContact O-N 2.8Å; R310-F312 VanDerWaalsContact C-N 3.32Å; R310-F312 PolarHBondContact O-N 3.39Å; R310-S313 PolarHBondContact O-N 2.84Å; R310-L314 VanDerWaalsContact O-CG 3.28Å; R310-L314 WeakPolarHBondContact O-CG 3.17Å; R310-L314 PolarHBondContact O-N 3.44Å
311	F	91.1	Very high	91.3	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.022	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-40.5	173.4	-90.2	-81.4	0	0	0	112	M199 L252 V256 V293 M297 T307 F308 S313 L314 Y315	M199-F311 HydrophobicContact CE-CD1 4.1Å; M199-F311 HydrophobicContact CE-CE1 3.93Å; L252-F311 HydrophobicContact CB-CZ 4.25Å; L252-F311 HydrophobicContact CD1-CE2 4.18Å; L252-F311 HydrophobicContact CD1-CZ 3.89Å; L252-F311 HydrophobicContact CD2-CZ 4.02Å; L252-F311 HydrophobicContact CG-CZ 4.26Å; V256-F311 HydrophobicContact CG2-CD1 4.1Å; V256-F311 HydrophobicContact CG2-CE1 4.12Å; V293-F311 HydrophobicContact CG1-CB 3.84Å; V293-F311 HydrophobicContact CG1-CD2 3.96Å; V293-F311 HydrophobicContact CG1-CG 3.98Å; V293-F311 HydrophobicContact CG2-CB 4.2Å; V293-F311 HydrophobicContact CG2-CD1 4.08Å; V293-F311 HydrophobicContact CG2-CD2 4.42Å; V293-F311 HydrophobicContact CG2-CG 3.98Å; M297-F311 HydrophobicContact CE-CE1 4.34Å; M297-F311 HydrophobicContact CE-CE2 3.74Å; M297-F311 HydrophobicContact CE-CZ 3.37Å; M297-F311 HydrophobicContact SD-CD2 4.48Å; M297-F311 HydrophobicContact SD-CE1 4.26Å; M297-F311 HydrophobicContact SD-CE2 3.75Å; M297-F311 HydrophobicContact SD-CZ 3.62Å; T307-F311 HydrophobicContact CG2-CD2 3.65Å; T307-F311 HydrophobicContact CG2-CE2 3.73Å; T307-F311 WeakPolarHBondContact O-CD2 3.18Å; T307-F311 PolarHBondContact O-N 3.46Å; F308-F311 PolarHBondContact O-N 2.69Å; F311-S313 VanDerWaalsContact C-N 3.32Å; F311-S313 PolarHBondContact O-N 3.38Å; F311-L314 PolarHBondContact O-N 2.96Å; F311-Y315 HydrophobicContact CD1-CE2 4.14Å; F311-Y315 VanDerWaalsContact O-CD2 3.26Å; F311-Y315 WeakPolarHBondContact O-CD2 3.33Å; F311-Y315 PolarHBondContact O-N 3.26Å
312	F	91.1	Very high	91.2	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-46.7	175.1	-172.8	-92.2	0	0	0	111.5	L290 F308 R310 Y315 H316 M353 F362 L367	L290-F312 HydrophobicContact CD1-CD2 4.08Å; L290-F312 HydrophobicContact CD1-CE2 4.43Å; L290-F312 HydrophobicContact CD2-CB 4.43Å; L290-F312 HydrophobicContact CD2-CD2 4.33Å; F308-F312 HydrophobicContact CE1-CD2 4.32Å; F308-F312 HydrophobicContact CZ-CD2 4.26Å; F308-F312 VanDerWaalsContact O-CB 3.29Å; F308-F312 WeakPolarHBondContact O-CB 3.49Å; F308-F312 PolarHBondContact O-N 2.89Å; R310-F312 VanDerWaalsContact C-N 3.32Å; R310-F312 PolarHBondContact O-N 3.39Å; F312-Y315 PolarHBondContact O-N 3.11Å; F312-H316 WeakPolarHBondContact O-CB 3.47Å; F312-H316 PolarHBondContact O-N 2.85Å; F312-M353 HydrophobicContact CD2-CE 4.34Å; F312-M353 HydrophobicContact CE2-CE 3.87Å; F312-M353 HydrophobicContact CE2-SD 4.12Å; F312-M353 HydrophobicContact CZ-CE 4Å; F312-F362 HydrophobicContact CD1-CD1 4.18Å; F312-F362 HydrophobicContact CD1-CD2 4.08Å; F312-F362 HydrophobicContact CD1-CE1 4.25Å; F312-F362 HydrophobicContact CD1-CE2 4.13Å; F312-F362 HydrophobicContact CD1-CG 4.1Å; F312-F362 HydrophobicContact CD1-CZ 4.22Å; F312-F362 AromaticContact CE1-CD1 3.37Å; F312-F362 HydrophobicContact CE1-CD1 3.37Å; F312-F362 HydrophobicContact CE1-CD2 4.08Å; F312-F362 AromaticContact CE1-CE1 3.4Å; F312-F362 HydrophobicContact CE1-CE1 3.4Å; F312-F362 VanDerWaalsContact CE1-CE1 3.4Å; F312-F362 HydrophobicContact CE1-CE2 4.09Å; F312-F362 AromaticContact CE1-CG 3.74Å; F312-F362 HydrophobicContact CE1-CG 3.74Å; F312-F362 AromaticContact CE1-CZ 3.77Å; F312-F362 HydrophobicContact CE1-CZ 3.77Å; F312-F362 HydrophobicContact CE2-CD1 4.44Å; F312-F362 HydrophobicContact CZ-CB 4.46Å; F312-F362 AromaticContact CZ-CD1 3.53Å; F312-F362 HydrophobicContact CZ-CD1 3.53Å; F312-F362 AromaticContact CZ-CE1 3.94Å; F312-F362 HydrophobicContact CZ-CE1 3.94Å; F312-F362 AromaticContact CZ-CG 4Å; F312-F362 HydrophobicContact CZ-CG 4Å; F312-L367 HydrophobicContact CD1-CD2 4.47Å; F312-L367 HydrophobicContact CE1-CD1 4.29Å; F312-L367 HydrophobicContact CE1-CD2 3.46Å; F312-L367 VanDerWaalsContact CE1-CD2 3.46Å; F312-L367 HydrophobicContact CE1-CG 3.97Å; F312-L367 HydrophobicContact CZ-CD1 3.92Å; F312-L367 HydrophobicContact CZ-CD2 3.93Å; F312-L367 HydrophobicContact CZ-CG 4.1Å
313	S	90.5	Very high	91.2	Very high	55 Å²	55	39.5 Å²	39.5	39%	0.385	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-40.8	175.6	-54.7	0	0	0	0	112.3	N309 R310 F311 H316 N317	N309-S313 WeakPolarHBondContact O-CB 3.5Å; N309-S313 PolarHBondContact O-N 3.08Å; N309-S313 PolarHBondContact O-OG 3.47Å; R310-S313 PolarHBondContact O-N 2.84Å; F311-S313 VanDerWaalsContact C-N 3.32Å; F311-S313 PolarHBondContact O-N 3.38Å; S313-H316 PolarHBondContact O-N 2.96Å; S313-N317 WeakPolarHBondContact O-CB 3.44Å; S313-N317 PolarHBondContact O-N 3.21Å; S313-N317 PolarHBondContact O-ND2 3.12Å
314	L	91.6	Very high	91.4	Very high	21 Å²	21	37.5 Å²	37.5	11%	0.11	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-45	176.9	-71.6	174.3	0	0	0	111.8	E253 V256 R310 F311 N317 A318	E253-L314 HydrophobicContact CB-CD1 4.34Å; E253-L314 HydrophobicContact CB-CD2 3.68Å; E253-L314 HydrophobicContact CG-CD2 3.69Å; V256-L314 HydrophobicContact CG1-CB 4.44Å; V256-L314 HydrophobicContact CG2-CB 4.46Å; R310-L314 VanDerWaalsContact O-CG 3.28Å; R310-L314 WeakPolarHBondContact O-CG 3.17Å; R310-L314 PolarHBondContact O-N 3.44Å; F311-L314 PolarHBondContact O-N 2.96Å; L314-N317 PolarHBondContact O-N 2.81Å; L314-A318 WeakPolarHBondContact O-CB 3.45Å; L314-A318 PolarHBondContact O-N 2.9Å
315	Y	92.6	Very high	91.5	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-42.5	176	-85.6	-71.6	0	0	0	111.7	M199 V256 I260 V286 D289 L290 F311 F312 N317 A318 V319	M199-Y315 HydrophobicContact CE-CE2 4.06Å; M199-Y315 WeakPolarHBondContact CE-OH 3.42Å; V256-Y315 HydrophobicContact CG1-CD1 3.58Å; V256-Y315 HydrophobicContact CG1-CD2 4.26Å; V256-Y315 HydrophobicContact CG1-CE1 3.67Å; V256-Y315 HydrophobicContact CG1-CE2 4.33Å; V256-Y315 HydrophobicContact CG1-CG 3.89Å; V256-Y315 HydrophobicContact CG2-CD2 4.4Å; V256-Y315 HydrophobicContact CG2-CE1 4.41Å; V256-Y315 HydrophobicContact CG2-CE2 3.95Å; I260-Y315 HydrophobicContact CD1-CD1 4.24Å; I260-Y315 HydrophobicContact CD1-CE1 4.36Å; V286-Y315 HydrophobicContact CB-CD1 4.47Å; V286-Y315 HydrophobicContact CG1-CD1 4.13Å; V286-Y315 HydrophobicContact CG1-CG 4.3Å; V286-Y315 HydrophobicContact CG2-CD1 4Å; V286-Y315 HydrophobicContact CG2-CE1 4.47Å; D289-Y315 HydrophobicContact CB-CE1 4.41Å; D289-Y315 HydrophobicContact CB-CE2 4.21Å; D289-Y315 VanDerWaalsContact CB-OH 3.3Å; D289-Y315 WeakPolarHBondContact CB-OH 3.43Å; D289-Y315 PolarHBondContact OD2-OH 2.86Å; L290-Y315 HydrophobicContact CD2-CD2 3.65Å; L290-Y315 HydrophobicContact CD2-CE2 4.29Å; L290-Y315 HydrophobicContact CD2-CG 4.35Å; L290-Y315 HydrophobicContact CG-CD2 4.19Å; F311-Y315 HydrophobicContact CD1-CE2 4.14Å; F311-Y315 VanDerWaalsContact O-CD2 3.26Å; F311-Y315 WeakPolarHBondContact O-CD2 3.33Å; F311-Y315 PolarHBondContact O-N 3.26Å; F312-Y315 PolarHBondContact O-N 3.11Å; Y315-N317 PolarHBondContact O-N 2.88Å; Y315-A318 PolarHBondContact O-N 3.49Å; Y315-V319 WeakPolarHBondContact O-CB 3.39Å; Y315-V319 VanDerWaalsContact O-CG2 3.22Å; Y315-V319 WeakPolarHBondContact O-CG2 3.37Å; Y315-V319 PolarHBondContact O-N 3.08Å
316	H	92.5	Very high	91.5	Very high	17 Å²	17	35.2 Å²	35.2	8%	0.079	18%	0.18	C	C	.	.	H	α-helix	trans	-57.6	-48.6	174.4	173.6	60.2	0	0	0	111.8	F312 S313 V319 S320 Y347 M353 L367 E368	F312-H316 WeakPolarHBondContact O-CB 3.47Å; F312-H316 PolarHBondContact O-N 2.85Å; S313-H316 PolarHBondContact O-N 2.96Å; H316-V319 PolarHBondContact O-N 3.34Å; H316-S320 WeakPolarHBondContact O-CB 3.41Å; H316-S320 PolarHBondContact O-N 3.16Å; H316-Y347 AromaticContact ND1-CZ 3.68Å; H316-Y347 PolarHBondContact ND1-OH 2.83Å; H316-M353 HydrophobicContact CB-CE 4.47Å; H316-L367 HydrophobicContact CB-CD2 4.36Å; H316-E368 PolarHBondContact CE1-O 3.11Å; H316-E368 VanDerWaalsContact CE1-O 3.23Å
317	N	91.9	Very high	91.6	Very high	82 Å²	82	31.6 Å²	31.6	44%	0.439	16%	0.162	S	C	.	.	H	α-helix	trans	-63.9	-45	179.5	-71.2	-11.9	0	0	0	111.8	S313 L314 Y315 V319 S320 T321	S313-N317 WeakPolarHBondContact O-CB 3.44Å; S313-N317 PolarHBondContact O-N 3.21Å; S313-N317 PolarHBondContact O-ND2 3.12Å; L314-N317 PolarHBondContact O-N 2.81Å; Y315-N317 PolarHBondContact O-N 2.88Å; N317-V319 PolarHBondContact O-N 2.98Å; N317-S320 PolarHBondContact O-N 3.03Å; N317-T321 PolarHBondContact O-N 3.44Å; N317-T321 PolarHBondContact O-OG1 2.81Å
318	A	92.4	Very high	91.6	Very high	11 Å²	11	38.7 Å²	38.7	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-42.9	178.2	0	0	0	0	0	112	V256 I260 L314 Y315 R322	V256-A318 HydrophobicContact CG1-CB 4Å; I260-A318 HydrophobicContact CG1-CB 3.97Å; L314-A318 WeakPolarHBondContact O-CB 3.45Å; L314-A318 PolarHBondContact O-N 2.9Å; Y315-A318 PolarHBondContact O-N 3.49Å; A318-R322 WeakPolarHBondContact O-CB 3.45Å; A318-R322 PolarHBondContact O-N 3.33Å
319	V	93.4	Very high	91.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-43.2	175	172.7	0	0	0	0	110.9	I260 T282 V286 Y315 H316 N317 R322 V323 W342 Y347 L370	I260-V319 HydrophobicContact CD1-CG2 4.23Å; T282-V319 HydrophobicContact CG2-CG2 4.31Å; V286-V319 HydrophobicContact CG2-CG2 3.93Å; Y315-V319 WeakPolarHBondContact O-CB 3.39Å; Y315-V319 VanDerWaalsContact O-CG2 3.22Å; Y315-V319 WeakPolarHBondContact O-CG2 3.37Å; Y315-V319 PolarHBondContact O-N 3.08Å; H316-V319 PolarHBondContact O-N 3.34Å; N317-V319 PolarHBondContact O-N 2.98Å; V319-R322 PolarHBondContact O-N 3.26Å; V319-V323 HydrophobicContact CG1-CG2 4.16Å; V319-V323 WeakPolarHBondContact O-CB 3.42Å; V319-V323 VanDerWaalsContact O-CG2 3.27Å; V319-V323 WeakPolarHBondContact O-CG2 3.12Å; V319-V323 PolarHBondContact O-N 3.47Å; V319-W342 HydrophobicContact CG1-CH2 3.76Å; V319-W342 HydrophobicContact CG1-CZ3 4.04Å; V319-Y347 HydrophobicContact CG1-CE2 4.27Å; V319-L370 HydrophobicContact CB-CD2 4.41Å; V319-L370 HydrophobicContact CG1-CD1 4.06Å; V319-L370 HydrophobicContact CG1-CD2 3.92Å
320	S	93.6	Very high	91.3	Very high	7 Å²	7	45.8 Å²	45.8	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-47.2	177.5	178	0	0	0	0	111.5	H316 N317 R322 V323 K324 L370	H316-S320 WeakPolarHBondContact O-CB 3.41Å; H316-S320 PolarHBondContact O-N 3.16Å; N317-S320 PolarHBondContact O-N 3.03Å; S320-R322 VanDerWaalsContact C-N 3.32Å; S320-R322 PolarHBondContact O-N 2.81Å; S320-V323 PolarHBondContact O-N 3.2Å; S320-K324 WeakPolarHBondContact O-CB 3.41Å; S320-K324 VanDerWaalsContact O-CG 3.25Å; S320-K324 WeakPolarHBondContact O-CG 3.4Å; S320-K324 PolarHBondContact O-N 2.88Å; S320-K324 WeakPolarHBondContact OG-CE 3.24Å; S320-K324 PolarHBondContact OG-NZ 3.43Å; S320-L370 PolarHBondContact OG-O 3.37Å
321	T	92.1	Very high	91.3	Very high	78 Å²	78	41.2 Å²	41.2	48%	0.479	22%	0.218	S	C	.	.	H	α-helix	trans	-57.6	-47.3	175.8	-60.5	0	0	0	0	110.7	N317 V323 K324 E325	N317-T321 PolarHBondContact O-N 3.44Å; N317-T321 PolarHBondContact O-OG1 2.81Å; T321-V323 PolarHBondContact O-N 2.74Å; T321-K324 WeakPolarHBondContact O-CB 3.25Å; T321-K324 PolarHBondContact O-N 3.5Å; T321-E325 WeakPolarHBondContact O-CG 3.49Å; T321-E325 PolarHBondContact O-N 3.47Å
322	R	90.1	Very high	91.2	Very high	32 Å²	32	45.7 Å²	45.7	12%	0.121	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-42	-179.4	-176.2	59.3	-172.5	144	7.4	113	I260 A318 V319 S320 K324 E325 L326	I260-R322 HydrophobicContact CG2-CB 4.05Å; I260-R322 HydrophobicContact CG2-CG 4.2Å; A318-R322 WeakPolarHBondContact O-CB 3.45Å; A318-R322 PolarHBondContact O-N 3.33Å; V319-R322 PolarHBondContact O-N 3.26Å; S320-R322 VanDerWaalsContact C-N 3.32Å; S320-R322 PolarHBondContact O-N 2.81Å; R322-K324 VanDerWaalsContact C-N 3.31Å; R322-K324 PolarHBondContact O-N 2.86Å; R322-E325 WeakPolarHBondContact CD-OE2 3.48Å; R322-E325 IonicContact CZ-OE2 2.61Å; R322-E325 IonicContact NH1-OE2 3.2Å; R322-E325 PolarHBondContact NH1-OE2 3.13Å; R322-E325 WeakPolarHBondContact O-CB 3.13Å; R322-E325 PolarHBondContact O-N 2.81Å; R322-L326 HydrophobicContact CG-CD1 4.47Å; R322-L326 WeakPolarHBondContact O-CG 3.47Å; R322-L326 PolarHBondContact O-N 3.23Å
323	V	92.9	Very high	91	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-36.2	177.4	168.8	0	0	0	0	111	V319 S320 T321 L326 A327 L339 W342 V343 L370 L371	V319-V323 HydrophobicContact CG1-CG2 4.16Å; V319-V323 WeakPolarHBondContact O-CB 3.42Å; V319-V323 VanDerWaalsContact O-CG2 3.27Å; V319-V323 WeakPolarHBondContact O-CG2 3.12Å; V319-V323 PolarHBondContact O-N 3.47Å; S320-V323 PolarHBondContact O-N 3.2Å; T321-V323 PolarHBondContact O-N 2.74Å; V323-L326 PolarHBondContact O-N 3.02Å; V323-A327 WeakPolarHBondContact O-CB 3.37Å; V323-A327 PolarHBondContact O-N 3.4Å; V323-L339 HydrophobicContact CG1-CD1 4.18Å; V323-W342 HydrophobicContact CG2-CZ3 3.94Å; V323-V343 HydrophobicContact CG1-CG2 3.56Å; V323-L370 HydrophobicContact CG2-CD1 4.42Å; V323-L371 HydrophobicContact CG1-CD1 3.87Å; V323-L371 HydrophobicContact CG1-CD2 3.82Å; V323-L371 HydrophobicContact CG1-CG 3.66Å
324	K	92.6	Very high	90.9	Very high	86 Å²	86	47.6 Å²	47.6	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-42.6	173.1	-74.8	166.2	177.8	155.8	0	112	S320 T321 R322 A327 L328 L370 L371	S320-K324 WeakPolarHBondContact O-CB 3.41Å; S320-K324 VanDerWaalsContact O-CG 3.25Å; S320-K324 WeakPolarHBondContact O-CG 3.4Å; S320-K324 PolarHBondContact O-N 2.88Å; S320-K324 WeakPolarHBondContact OG-CE 3.24Å; S320-K324 PolarHBondContact OG-NZ 3.43Å; T321-K324 WeakPolarHBondContact O-CB 3.25Å; T321-K324 PolarHBondContact O-N 3.5Å; R322-K324 VanDerWaalsContact C-N 3.31Å; R322-K324 PolarHBondContact O-N 2.86Å; K324-A327 PolarHBondContact O-N 3.48Å; K324-L328 WeakPolarHBondContact O-CG 3.34Å; K324-L328 PolarHBondContact O-N 2.96Å; K324-L328 VanDerWaalsContact O-N 3.16Å; K324-L370 WeakPolarHBondContact CE-O 3.46Å; K324-L371 HydrophobicContact CB-CD2 4.46Å; K324-L371 HydrophobicContact CG-CD2 3.76Å
325	E	91.2	Very high	90.9	Very high	83 Å²	83	47 Å²	47	39%	0.388	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-47.6	173.7	-69.9	168.6	-177	0	0	111.6	T321 R322 A327 L328 E329	T321-E325 WeakPolarHBondContact O-CG 3.49Å; T321-E325 PolarHBondContact O-N 3.47Å; R322-E325 WeakPolarHBondContact CD-OE2 3.48Å; R322-E325 IonicContact CZ-OE2 2.61Å; R322-E325 IonicContact NH1-OE2 3.2Å; R322-E325 PolarHBondContact NH1-OE2 3.13Å; R322-E325 WeakPolarHBondContact O-CB 3.13Å; R322-E325 PolarHBondContact O-N 2.81Å; E325-A327 VanDerWaalsContact C-N 3.29Å; E325-A327 PolarHBondContact O-N 3.13Å; E325-L328 WeakPolarHBondContact O-CB 3.44Å; E325-L328 PolarHBondContact O-N 3.33Å; E325-L328 VanDerWaalsContact O-N 3.11Å; E325-E329 PolarHBondContact O-N 3.08Å
326	L	91.3	Very high	90.8	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-37.4	177.4	-69.8	170.5	0	0	0	112.1	W274 L275 L278 R322 V323 L328 E329 L331	W274-L326 HydrophobicContact CH2-CD2 3.84Å; W274-L326 HydrophobicContact CZ3-CD2 4Å; L275-L326 HydrophobicContact CD1-CD1 4.02Å; L275-L326 HydrophobicContact CD1-CD2 4.25Å; L278-L326 HydrophobicContact CD2-CD1 4.14Å; L278-L326 HydrophobicContact CD2-CD2 4.19Å; R322-L326 HydrophobicContact CG-CD1 4.47Å; R322-L326 WeakPolarHBondContact O-CG 3.47Å; R322-L326 PolarHBondContact O-N 3.23Å; V323-L326 PolarHBondContact O-N 3.02Å; L326-L328 VanDerWaalsContact C-N 3.27Å; L326-L328 PolarHBondContact O-N 3.1Å; L326-E329 WeakPolarHBondContact O-CB 3.42Å; L326-E329 PolarHBondContact O-N 3.49Å; L326-L331 WeakPolarHBondContact O-CD1 3.31Å
327	A	91.8	Very high	90.7	Very high	12 Å²	12	46.9 Å²	46.9	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-68.4	-24.6	177.3	0	0	0	0	0	113.4	V323 K324 E325 E329 L339 L371 V375 L379	V323-A327 WeakPolarHBondContact O-CB 3.37Å; V323-A327 PolarHBondContact O-N 3.4Å; K324-A327 PolarHBondContact O-N 3.48Å; E325-A327 VanDerWaalsContact C-N 3.29Å; E325-A327 PolarHBondContact O-N 3.13Å; A327-E329 VanDerWaalsContact C-N 3.35Å; A327-L339 HydrophobicContact CB-CD2 4.21Å; A327-L371 HydrophobicContact CB-CD1 4.48Å; A327-L371 HydrophobicContact CB-CD2 4.08Å; A327-V375 HydrophobicContact CB-CG1 3.91Å; A327-L379 HydrophobicContact CB-CD1 4.06Å
328	L	89.9	Confident	90.7	Very high	156 Å²	156	44.5 Å²	44.5	82%	0.817	24%	0.235	S	C	*	.	H	α-helix	trans	-80.2	-16.8	175.8	-69.5	169.6	0	0	0	112.9	K324 E325 L326	K324-L328 WeakPolarHBondContact O-CG 3.34Å; K324-L328 PolarHBondContact O-N 2.96Å; K324-L328 VanDerWaalsContact O-N 3.16Å; E325-L328 WeakPolarHBondContact O-CB 3.44Å; E325-L328 PolarHBondContact O-N 3.33Å; E325-L328 VanDerWaalsContact O-N 3.11Å; L326-L328 VanDerWaalsContact C-N 3.27Å; L326-L328 PolarHBondContact O-N 3.1Å
329	E	88.1	Confident	90.8	Very high	78 Å²	78	44 Å²	44	36%	0.364	23%	0.231	S	C	.	.	S	Bend	trans	-70.9	159.5	175.1	-64.8	179.1	-162.1	0	0	111.7	E325 L326 A327 L331	E325-E329 PolarHBondContact O-N 3.08Å; L326-E329 WeakPolarHBondContact O-CB 3.42Å; L326-E329 PolarHBondContact O-N 3.49Å; A327-E329 VanDerWaalsContact C-N 3.35Å; E329-L331 VanDerWaalsContact C-N 3.28Å; E329-L331 HydrophobicContact CB-CD2 4.29Å; E329-L331 PolarHBondContact O-N 3.41Å
330	D	87.3	Confident	90.7	Very high	124 Å²	124	44 Å²	44	66%	0.663	23%	0.23	S	C	*	.			trans	-78.5	79.6	176	-165.6	22.7	0	0	0	110.9	R268 K382	R268-D330 PolarHBondContact NH1-O 3.15Å; D330-K382 WeakPolarHBondContact OD1-CE 3.41Å; D330-K382 IonicContact OD1-NZ 3.31Å; D330-K382 PolarHBondContact OD1-NZ 3.34Å
331	L	89.6	Confident	90.6	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	24%	0.237	C	C	.	.			trans	-74.7	137.5	-179.7	-59	-179.1	0	0	0	112.3	L275 L326 E329 E335 I336 L339 L379 K382	L275-L331 HydrophobicContact CD2-CD2 4.44Å; L326-L331 WeakPolarHBondContact O-CD1 3.31Å; E329-L331 VanDerWaalsContact C-N 3.28Å; E329-L331 HydrophobicContact CB-CD2 4.29Å; E329-L331 PolarHBondContact O-N 3.41Å; L331-E335 WeakPolarHBondContact CA-OE2 2.85Å; L331-E335 HydrophobicContact CB-CB 4.09Å; L331-E335 HydrophobicContact CD2-CB 4.23Å; L331-I336 HydrophobicContact CB-CG1 3.74Å; L331-I336 HydrophobicContact CD1-CG1 4.48Å; L331-L339 HydrophobicContact CD1-CD2 3.65Å; L331-L379 HydrophobicContact CD1-CD2 4.43Å; L331-K382 PolarHBondContact O-NZ 2.97Å
332	E	89.3	Confident	90.7	Very high	100 Å²	100	42.1 Å²	42.1	47%	0.467	22%	0.217	S	C	.	.			trans	-73.1	163.9	168.8	-74.4	172.8	-152.8	0	0	112.1	R268 N334 E335 I336	R268-E332 IonicContact CZ-OE1 3.15Å; R268-E332 VanDerWaalsContact NH2-CD 3.33Å; R268-E332 VanDerWaalsContact NH2-CG 3.35Å; R268-E332 IonicContact NH2-OE1 3.19Å; R268-E332 PolarHBondContact NH2-OE1 3.39Å; E332-N334 VanDerWaalsContact C-N 3.34Å; E332-N334 WeakPolarHBondContact CB-OD1 3.38Å; E332-N334 PolarHBondContact O-N 3.19Å; E332-E335 HydrophobicContact CB-CB 4.49Å; E332-E335 HydrophobicContact CB-CG 4.16Å; E332-E335 PolarHBondContact N-OE2 3.25Å; E332-E335 WeakPolarHBondContact O-CB 3.44Å; E332-E335 PolarHBondContact O-N 3.12Å; E332-I336 WeakPolarHBondContact O-CG1 3.48Å; E332-I336 PolarHBondContact O-N 3.45Å
333	A	86.8	Confident	90.9	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-41.8	-176.1	0	0	0	0	0	113.6	V337 Y383 T386	A333-V337 WeakPolarHBondContact O-CG2 3.43Å; A333-V337 PolarHBondContact O-N 3.44Å; A333-V337 VanDerWaalsContact O-N 3.13Å; A333-Y383 HydrophobicContact CB-CD2 3.94Å; A333-Y383 HydrophobicContact CB-CE2 4.18Å; A333-Y383 WeakPolarHBondContact O-CD2 3.33Å; A333-T386 HydrophobicContact CB-CG2 4.11Å
334	N	87.4	Confident	90.7	Very high	77 Å²	77	43.8 Å²	43.8	41%	0.412	23%	0.228	S	C	.	.	H	α-helix	trans	-68.6	-32.7	175.4	57.2	-57.2	0	0	0	112.9	E332 S338	E332-N334 VanDerWaalsContact C-N 3.34Å; E332-N334 WeakPolarHBondContact CB-OD1 3.38Å; E332-N334 PolarHBondContact O-N 3.19Å; N334-S338 WeakPolarHBondContact O-CB 3.22Å; N334-S338 PolarHBondContact O-N 3.26Å; N334-S338 PolarHBondContact O-OG 2.9Å
335	E	91.6	Very high	90.5	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-70.9	-42	176.4	-64	175.2	151.9	0	0	110.5	R268 W274 L275 L331 E332 V337 S338 L339	R268-E335 IonicContact CZ-OE1 2.73Å; R268-E335 IonicContact CZ-OE2 2.94Å; R268-E335 IonicContact NE-OE1 3.76Å; R268-E335 PolarHBondContact NE-OE1 2.98Å; R268-E335 IonicContact NH1-OE2 3.24Å; R268-E335 IonicContact NH2-OE2 3.93Å; W274-E335 PolarHBondContact NE1-OE1 3.44Å; L275-E335 HydrophobicContact CD2-CB 3.78Å; L275-E335 HydrophobicContact CD2-CG 4.4Å; L275-E335 WeakPolarHBondContact CD2-O 3.39Å; L331-E335 WeakPolarHBondContact CA-OE2 2.85Å; L331-E335 HydrophobicContact CB-CB 4.09Å; L331-E335 HydrophobicContact CD2-CB 4.23Å; E332-E335 HydrophobicContact CB-CB 4.49Å; E332-E335 HydrophobicContact CB-CG 4.16Å; E332-E335 PolarHBondContact N-OE2 3.25Å; E332-E335 WeakPolarHBondContact O-CB 3.44Å; E332-E335 PolarHBondContact O-N 3.12Å; E335-V337 PolarHBondContact O-N 3.34Å; E335-S338 PolarHBondContact O-N 3.44Å; E335-L339 WeakPolarHBondContact O-CB 3.46Å; E335-L339 PolarHBondContact O-N 2.98Å
336	I	91.8	Very high	90.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-48.3	173.4	-65.5	167.8	0	0	0	110.6	L331 E332 S338 L339 L340 L379 K382	L331-I336 HydrophobicContact CB-CG1 3.74Å; L331-I336 HydrophobicContact CD1-CG1 4.48Å; E332-I336 WeakPolarHBondContact O-CG1 3.48Å; E332-I336 PolarHBondContact O-N 3.45Å; I336-S338 VanDerWaalsContact C-N 3.3Å; I336-S338 PolarHBondContact O-N 3.24Å; I336-L339 PolarHBondContact O-N 3.43Å; I336-L340 HydrophobicContact CG2-CD1 3.72Å; I336-L340 HydrophobicContact CG2-CG 4.22Å; I336-L340 WeakPolarHBondContact O-CB 3.3Å; I336-L340 WeakPolarHBondContact O-CG 3.47Å; I336-L340 PolarHBondContact O-N 3.1Å; I336-L379 HydrophobicContact CG1-CD2 4.31Å; I336-L379 HydrophobicContact CG2-CB 4.08Å; I336-K382 HydrophobicContact CD1-CB 4.28Å; I336-K382 HydrophobicContact CD1-CD 3.95Å; I336-K382 HydrophobicContact CD1-CG 4.11Å
337	V	90	Very high	90.5	Very high	16 Å²	16	40.5 Å²	40.5	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-57	-45.8	176.4	170	0	0	0	0	110.9	A333 E335 T341 Y383 V438 I442	A333-V337 WeakPolarHBondContact O-CG2 3.43Å; A333-V337 PolarHBondContact O-N 3.44Å; A333-V337 VanDerWaalsContact O-N 3.13Å; E335-V337 PolarHBondContact O-N 3.34Å; V337-T341 WeakPolarHBondContact O-CB 3.49Å; V337-T341 PolarHBondContact O-N 3.04Å; V337-T341 PolarHBondContact O-OG1 3.37Å; V337-Y383 HydrophobicContact CG2-CD2 3.81Å; V337-Y383 HydrophobicContact CG2-CE2 3.34Å; V337-V438 HydrophobicContact CB-CG1 4.23Å; V337-V438 HydrophobicContact CG1-CG1 3.51Å; V337-V438 HydrophobicContact CG2-CG1 3.64Å; V337-I442 HydrophobicContact CB-CD1 4.16Å; V337-I442 HydrophobicContact CG1-CD1 4.1Å; V337-I442 HydrophobicContact CG1-CG1 4.2Å; V337-I442 HydrophobicContact CG2-CD1 3.9Å
338	S	91.7	Very high	90.4	Very high	33 Å²	33	44 Å²	44	23%	0.231	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-44.5	-177.5	-58.7	0	0	0	0	111.2	V276 N334 E335 I336 W342	V276-S338 WeakPolarHBondContact CG2-OG 3.4Å; N334-S338 WeakPolarHBondContact O-CB 3.22Å; N334-S338 PolarHBondContact O-N 3.26Å; N334-S338 PolarHBondContact O-OG 2.9Å; E335-S338 PolarHBondContact O-N 3.44Å; I336-S338 VanDerWaalsContact C-N 3.3Å; I336-S338 PolarHBondContact O-N 3.24Å; S338-W342 WeakPolarHBondContact O-CB 3.38Å; S338-W342 PolarHBondContact O-N 2.92Å; S338-W342 VanDerWaalsContact O-N 3.12Å
339	L	93.9	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-50.5	178.2	-172.7	63.4	0	0	0	111.6	L275 L279 V323 A327 L331 E335 I336 W342 V343 L379	L275-L339 HydrophobicContact CD2-CB 4.3Å; L279-L339 HydrophobicContact CD1-CD1 4.34Å; L279-L339 HydrophobicContact CD2-CD1 4.19Å; V323-L339 HydrophobicContact CG1-CD1 4.18Å; A327-L339 HydrophobicContact CB-CD2 4.21Å; L331-L339 HydrophobicContact CD1-CD2 3.65Å; E335-L339 WeakPolarHBondContact O-CB 3.46Å; E335-L339 PolarHBondContact O-N 2.98Å; I336-L339 PolarHBondContact O-N 3.43Å; L339-W342 PolarHBondContact O-N 3.49Å; L339-V343 HydrophobicContact CD1-CG2 4.37Å; L339-V343 HydrophobicContact CG-CG2 4.46Å; L339-V343 WeakPolarHBondContact O-CB 3.47Å; L339-V343 VanDerWaalsContact O-CG2 3.29Å; L339-V343 WeakPolarHBondContact O-CG2 3.44Å; L339-V343 PolarHBondContact O-N 3.3Å; L339-L379 HydrophobicContact CD2-CD1 4.29Å
340	L	92.4	Very high	90.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.5	-42.1	-176.8	-68.4	-179.8	0	0	0	112.1	I336 W342 V343 L344 V376 L379 L380 I442	I336-L340 HydrophobicContact CG2-CD1 3.72Å; I336-L340 HydrophobicContact CG2-CG 4.22Å; I336-L340 WeakPolarHBondContact O-CB 3.3Å; I336-L340 WeakPolarHBondContact O-CG 3.47Å; I336-L340 PolarHBondContact O-N 3.1Å; L340-W342 VanDerWaalsContact C-N 3.26Å; L340-W342 PolarHBondContact O-N 2.91Å; L340-V343 PolarHBondContact O-N 3.33Å; L340-L344 VanDerWaalsContact O-CB 3.31Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 WeakPolarHBondContact O-CG 3.45Å; L340-L344 PolarHBondContact O-N 3.27Å; L340-V376 HydrophobicContact CD2-CG1 4.12Å; L340-V376 HydrophobicContact CD2-CG2 4.38Å; L340-L379 HydrophobicContact CD1-CB 4.18Å; L340-L379 HydrophobicContact CD2-CB 4.42Å; L340-L379 HydrophobicContact CD2-CD1 3.95Å; L340-L380 HydrophobicContact CD1-CD2 3.38Å; L340-L380 HydrophobicContact CD1-CG 3.81Å; L340-I442 HydrophobicContact CB-CG2 3.75Å; L340-I442 HydrophobicContact CD1-CG2 4.37Å
341	T	91.6	Very high	90.4	Very high	31 Å²	31	38.3 Å²	38.3	19%	0.19	21%	0.207	C	C	.	.	H	α-helix	trans	-57	-43.5	173	-57.9	0	0	0	0	110.7	V337 N345 T346	V337-T341 WeakPolarHBondContact O-CB 3.49Å; V337-T341 PolarHBondContact O-N 3.04Å; V337-T341 PolarHBondContact O-OG1 3.37Å; T341-N345 WeakPolarHBondContact O-CA 3.23Å; T341-N345 VanDerWaalsContact O-CB 3.27Å; T341-N345 WeakPolarHBondContact O-CB 3.39Å; T341-N345 PolarHBondContact O-N 3.29Å; T341-T346 PolarHBondContact O-N 3.49Å
342	W	94.1	Very high	90.5	Very high	15 Å²	15	38.1 Å²	38.1	6%	0.057	21%	0.206	C	C	.	.	I	π-helix	trans	-67.9	-44.1	179.8	-170.6	90.5	0	0	0	112.5	L279 R283 V319 V323 S338 L339 L340 T346 Y347 M352 L370	L279-W342 HydrophobicContact CB-CD2 4.22Å; L279-W342 HydrophobicContact CB-CG 3.97Å; L279-W342 HydrophobicContact CD1-CB 3.84Å; L279-W342 HydrophobicContact CD1-CG 4.02Å; L279-W342 HydrophobicContact CD2-CD2 3.84Å; L279-W342 HydrophobicContact CD2-CE3 3.92Å; L279-W342 HydrophobicContact CD2-CG 4.17Å; L279-W342 HydrophobicContact CD2-CZ3 4.36Å; L279-W342 HydrophobicContact CG-CD2 4.41Å; L279-W342 HydrophobicContact CG-CG 4.27Å; L279-W342 PolarHBondContact O-NE1 3.47Å; R283-W342 HydrophobicContact CB-CZ2 4.34Å; V319-W342 HydrophobicContact CG1-CH2 3.76Å; V319-W342 HydrophobicContact CG1-CZ3 4.04Å; V323-W342 HydrophobicContact CG2-CZ3 3.94Å; S338-W342 WeakPolarHBondContact O-CB 3.38Å; S338-W342 PolarHBondContact O-N 2.92Å; S338-W342 VanDerWaalsContact O-N 3.12Å; L339-W342 PolarHBondContact O-N 3.49Å; L340-W342 VanDerWaalsContact C-N 3.26Å; L340-W342 PolarHBondContact O-N 2.91Å; W342-T346 CarbonylContact O-C 3.59Å; W342-T346 WeakPolarHBondContact O-CA 3.4Å; W342-T346 WeakPolarHBondContact O-CB 3.43Å; W342-T346 PolarHBondContact O-N 2.92Å; W342-T346 VanDerWaalsContact O-N 3.11Å; W342-Y347 HydrophobicContact CH2-CD2 4.11Å; W342-Y347 HydrophobicContact CZ3-CD2 4.27Å; W342-Y347 PolarHBondContact O-N 2.91Å; W342-M352 HydrophobicContact CH2-CE 4Å; W342-M352 HydrophobicContact CH2-SD 3.96Å; W342-M352 HydrophobicContact CZ2-CE 3.94Å; W342-M352 HydrophobicContact CZ2-SD 3.56Å; W342-M352 VanDerWaalsContact CZ2-SD 3.56Å; W342-L370 HydrophobicContact CE3-CD1 4.42Å; W342-L370 HydrophobicContact CZ3-CD1 3.68Å
343	V	92.8	Very high	90.4	Very high	11 Å²	11	33.5 Å²	33.5	7%	0.067	18%	0.184	C	C	.	.	I	π-helix	trans	-66.5	-44.6	-179.3	168.7	0	0	0	0	112.1	V323 L339 L340 L370 L371	V323-V343 HydrophobicContact CG1-CG2 3.56Å; L339-V343 HydrophobicContact CD1-CG2 4.37Å; L339-V343 HydrophobicContact CG-CG2 4.46Å; L339-V343 WeakPolarHBondContact O-CB 3.47Å; L339-V343 VanDerWaalsContact O-CG2 3.29Å; L339-V343 WeakPolarHBondContact O-CG2 3.44Å; L339-V343 PolarHBondContact O-N 3.3Å; L340-V343 PolarHBondContact O-N 3.33Å; V343-L370 HydrophobicContact CG1-CB 4.15Å; V343-L370 HydrophobicContact CG1-CD1 4.49Å; V343-L370 HydrophobicContact CG2-CD1 4.32Å; V343-L371 HydrophobicContact CG1-CD1 4.31Å; V343-L371 HydrophobicContact CG1-CG 4.43Å; V343-L371 HydrophobicContact CG2-CD1 4.19Å
344	L	89.1	Confident	90.4	Very high	60 Å²	60	32.7 Å²	32.7	31%	0.314	18%	0.178	S	C	.	.	I	π-helix	trans	-84	-40.6	-174.3	-61.2	176.7	0	0	0	112	L340 I442 D443	L340-L344 VanDerWaalsContact O-CB 3.31Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 WeakPolarHBondContact O-CG 3.45Å; L340-L344 PolarHBondContact O-N 3.27Å; L344-I442 HydrophobicContact CD1-CG2 4Å; L344-D443 HydrophobicContact CD1-CB 4.38Å
345	N	89.1	Confident	90.5	Very high	79 Å²	79	31.3 Å²	31.3	42%	0.422	17%	0.169	S	C	.	.	I	π-helix	trans	-109.3	-38	-169.9	-57.7	-45	0	0	0	113.7	T341 S349 Q441 I442	T341-N345 WeakPolarHBondContact O-CA 3.23Å; T341-N345 VanDerWaalsContact O-CB 3.27Å; T341-N345 WeakPolarHBondContact O-CB 3.39Å; T341-N345 PolarHBondContact O-N 3.29Å; N345-S349 VanDerWaalsContact O-CB 3.25Å; N345-S349 WeakPolarHBondContact O-CB 3.49Å; N345-Q441 PolarHBondContact ND2-O 2.82Å; N345-I442 PolarHBondContact ND2-O 3.35Å
346	T	90.8	Very high	90.3	Very high	24 Å²	24	35 Å²	35	15%	0.147	19%	0.194	C	C	.	.	I	π-helix	trans	-84.5	-40.4	-177.2	-52.8	0	0	0	0	112.9	T341 W342 K348 S349	T341-T346 PolarHBondContact O-N 3.49Å; W342-T346 CarbonylContact O-C 3.59Å; W342-T346 WeakPolarHBondContact O-CA 3.4Å; W342-T346 WeakPolarHBondContact O-CB 3.43Å; W342-T346 PolarHBondContact O-N 2.92Å; W342-T346 VanDerWaalsContact O-N 3.11Å; T346-K348 PolarHBondContact O-N 3.49Å; T346-S349 PolarHBondContact O-N 3.48Å; T346-S349 PolarHBondContact O-OG 3.27Å
347	Y	92.1	Very high	90	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-45.9	-171.2	177.9	-108.2	0	0	0	113.3	H316 V319 W342 M352 M353 L367 L370	H316-Y347 AromaticContact ND1-CZ 3.68Å; H316-Y347 PolarHBondContact ND1-OH 2.83Å; V319-Y347 HydrophobicContact CG1-CE2 4.27Å; W342-Y347 HydrophobicContact CH2-CD2 4.11Å; W342-Y347 HydrophobicContact CZ3-CD2 4.27Å; W342-Y347 PolarHBondContact O-N 2.91Å; Y347-M352 HydrophobicContact CD2-CE 3.97Å; Y347-M352 HydrophobicContact CD2-SD 3.67Å; Y347-M352 HydrophobicContact CE2-CE 4.07Å; Y347-M352 HydrophobicContact CE2-SD 4.31Å; Y347-M353 HydrophobicContact CD2-CG 3.93Å; Y347-M353 HydrophobicContact CE1-CG 4.15Å; Y347-M353 HydrophobicContact CE2-CE 4.02Å; Y347-M353 HydrophobicContact CE2-CG 3.44Å; Y347-M353 VanDerWaalsContact CE2-CG 3.44Å; Y347-M353 HydrophobicContact CE2-SD 4.23Å; Y347-M353 HydrophobicContact CG-CG 4.47Å; Y347-M353 VanDerWaalsContact O-CB 3.27Å; Y347-M353 WeakPolarHBondContact O-CB 3.48Å; Y347-M353 WeakPolarHBondContact O-CG 3.45Å; Y347-M353 PolarHBondContact O-N 3.09Å; Y347-M353 VanDerWaalsContact O-N 3.08Å; Y347-M353 WeakPolarHBondContact OH-CE 3.47Å; Y347-L367 HydrophobicContact CE1-CD1 4.15Å; Y347-L370 HydrophobicContact CD1-CD1 3.7Å; Y347-L370 HydrophobicContact CD1-CD2 4.37Å; Y347-L370 HydrophobicContact CD1-CG 3.74Å; Y347-L370 HydrophobicContact CD2-CD1 3.54Å; Y347-L370 HydrophobicContact CD2-CD2 4.42Å; Y347-L370 HydrophobicContact CD2-CG 4.24Å; Y347-L370 HydrophobicContact CE1-CD1 4.07Å; Y347-L370 HydrophobicContact CE1-CD2 3.88Å; Y347-L370 HydrophobicContact CE1-CG 3.72Å; Y347-L370 HydrophobicContact CE2-CD1 3.9Å; Y347-L370 HydrophobicContact CE2-CD2 3.92Å; Y347-L370 HydrophobicContact CE2-CG 4.19Å; Y347-L370 HydrophobicContact CG-CD1 3.44Å; Y347-L370 VanDerWaalsContact CG-CD1 3.44Å; Y347-L370 HydrophobicContact CG-CG 4.02Å
348	K	88.8	Confident	89.8	Confident	84 Å²	84	38.2 Å²	38.2	37%	0.365	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.1	179.1	-64.4	-169.2	174.9	-167.5	0	113.8	T346 I364 L367	T346-K348 PolarHBondContact O-N 3.49Å; K348-I364 HydrophobicContact CB-CG2 4.2Å; K348-I364 HydrophobicContact CG-CG2 4.42Å; K348-L367 PolarHBondContact NZ-O 3.19Å
349	S	89.8	Confident	89.1	Confident	31 Å²	31	39.2 Å²	39.2	22%	0.217	22%	0.217	C	C	.	.	S	Bend	trans	-79	173.8	-177.2	77.3	0	0	0	0	113.1	N345 T346 E351 M352 G354	N345-S349 VanDerWaalsContact O-CB 3.25Å; N345-S349 WeakPolarHBondContact O-CB 3.49Å; T346-S349 PolarHBondContact O-N 3.48Å; T346-S349 PolarHBondContact O-OG 3.27Å; S349-E351 PolarHBondContact O-N 2.84Å; S349-E351 VanDerWaalsContact O-N 3.11Å; S349-E351 WeakPolarHBondContact OG-CB 3.29Å; S349-E351 PolarHBondContact OG-N 2.77Å; S349-E351 VanDerWaalsContact OG-N 3.12Å; S349-M352 PolarHBondContact O-N 3.26Å; S349-M352 VanDerWaalsContact O-N 3.13Å; S349-G354 CarbonylContact O-C 3.58Å; S349-G354 WeakPolarHBondContact O-CA 3.45Å; S349-G354 PolarHBondContact O-N 3.1Å
350	V	88.6	Confident	88.2	Confident	101 Å²	101	43 Å²	43	61%	0.612	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16	171	-61.6	0	0	0	0	113.8	M352 G354 H355	V350-M352 VanDerWaalsContact C-N 3.32Å; V350-G354 WeakPolarHBondContact CA-O 3.44Å; V350-H355 WeakPolarHBondContact O-CA 3.49Å; V350-H355 PolarHBondContact O-CD2 3.41Å; V350-H355 VanDerWaalsContact O-CD2 3.31Å
351	E	87.6	Confident	87.4	Confident	107 Å²	107	47.8 Å²	47.8	50%	0.5	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.2	179.4	-56.4	-177.3	161.3	0	0	112.8	R283 S349	R283-E351 PolarHBondContact NH1-O 2.92Å; S349-E351 PolarHBondContact O-N 2.84Å; S349-E351 VanDerWaalsContact O-N 3.11Å; S349-E351 WeakPolarHBondContact OG-CB 3.29Å; S349-E351 PolarHBondContact OG-N 2.77Å; S349-E351 VanDerWaalsContact OG-N 3.12Å
352	M	90.4	Very high	86.7	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.1	-104.8	-178.2	-165.1	180	177.3	0	0	112.5	R283 V286 W342 Y347 S349 V350 G354 H355	R283-M352 HydrophobicContact CB-SD 4.25Å; R283-M352 HydrophobicContact CG-CB 3.86Å; R283-M352 HydrophobicContact CG-CG 3.84Å; R283-M352 HydrophobicContact CG-SD 3.88Å; V286-M352 HydrophobicContact CB-CE 3.85Å; V286-M352 HydrophobicContact CG1-CE 3.82Å; V286-M352 HydrophobicContact CG2-CE 4.23Å; W342-M352 HydrophobicContact CH2-CE 4Å; W342-M352 HydrophobicContact CH2-SD 3.96Å; W342-M352 HydrophobicContact CZ2-CE 3.94Å; W342-M352 HydrophobicContact CZ2-SD 3.56Å; W342-M352 VanDerWaalsContact CZ2-SD 3.56Å; Y347-M352 HydrophobicContact CD2-CE 3.97Å; Y347-M352 HydrophobicContact CD2-SD 3.67Å; Y347-M352 HydrophobicContact CE2-CE 4.07Å; Y347-M352 HydrophobicContact CE2-SD 4.31Å; S349-M352 PolarHBondContact O-N 3.26Å; S349-M352 VanDerWaalsContact O-N 3.13Å; V350-M352 VanDerWaalsContact C-N 3.32Å; M352-G354 PolarHBondContact O-N 3.49Å; M352-H355 WeakPolarHBondContact O-CB 3.4Å; M352-H355 PolarHBondContact O-N 3.12Å; M352-H355 VanDerWaalsContact O-N 3.14Å
353	M	89.1	Confident	85.9	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.015	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.3	-171.9	-60.3	-58.2	-116.2	0	0	112.8	V286 L290 F312 H316 Y347 H355 L367	V286-M353 HydrophobicContact CG1-SD 4.37Å; L290-M353 HydrophobicContact CD1-CE 4.21Å; L290-M353 HydrophobicContact CD1-SD 3.83Å; F312-M353 HydrophobicContact CD2-CE 4.34Å; F312-M353 HydrophobicContact CE2-CE 3.87Å; F312-M353 HydrophobicContact CE2-SD 4.12Å; F312-M353 HydrophobicContact CZ-CE 4Å; H316-M353 HydrophobicContact CB-CE 4.47Å; Y347-M353 HydrophobicContact CD2-CG 3.93Å; Y347-M353 HydrophobicContact CE1-CG 4.15Å; Y347-M353 HydrophobicContact CE2-CE 4.02Å; Y347-M353 HydrophobicContact CE2-CG 3.44Å; Y347-M353 VanDerWaalsContact CE2-CG 3.44Å; Y347-M353 HydrophobicContact CE2-SD 4.23Å; Y347-M353 HydrophobicContact CG-CG 4.47Å; Y347-M353 VanDerWaalsContact O-CB 3.27Å; Y347-M353 WeakPolarHBondContact O-CB 3.48Å; Y347-M353 WeakPolarHBondContact O-CG 3.45Å; Y347-M353 PolarHBondContact O-N 3.09Å; Y347-M353 VanDerWaalsContact O-N 3.08Å; Y347-M353 WeakPolarHBondContact OH-CE 3.47Å; M353-H355 VanDerWaalsContact C-N 3.32Å; M353-L367 HydrophobicContact CB-CD1 3.85Å; M353-L367 HydrophobicContact CG-CD1 4.26Å
354	G	86.4	Confident	85.2	Confident	5 Å²	5	52 Å²	52	5%	0.052	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	15.6	172.9	0	0	0	0	0	114.9	S349 V350 M352 C359	S349-G354 CarbonylContact O-C 3.58Å; S349-G354 WeakPolarHBondContact O-CA 3.45Å; S349-G354 PolarHBondContact O-N 3.1Å; V350-G354 WeakPolarHBondContact CA-O 3.44Å; M352-G354 PolarHBondContact O-N 3.49Å; G354-C359 PolarHBondContact O-SG 3.31Å
355	H	89.6	Confident	84.6	Confident	47 Å²	47	55.9 Å²	55.9	22%	0.218	31%	0.307	C	S	.	.			trans	-61.2	137.8	178.9	-169.9	-91.2	0	0	0	111.2	L287 V350 M352 M353 D357 L358 C359	L287-H355 HydrophobicContact CD1-CB 3.73Å; V350-H355 WeakPolarHBondContact O-CA 3.49Å; V350-H355 PolarHBondContact O-CD2 3.41Å; V350-H355 VanDerWaalsContact O-CD2 3.31Å; M352-H355 WeakPolarHBondContact O-CB 3.4Å; M352-H355 PolarHBondContact O-N 3.12Å; M352-H355 VanDerWaalsContact O-N 3.14Å; M353-H355 VanDerWaalsContact C-N 3.32Å; H355-D357 IonicContact CE1-OD2 3.19Å; H355-D357 PolarHBondContact CE1-OD2 3.41Å; H355-D357 VanDerWaalsContact CE1-OD2 3.29Å; H355-D357 WeakPolarHBondContact ND1-CB 3.32Å; H355-D357 PolarHBondContact ND1-N 3.24Å; H355-D357 IonicContact ND1-OD2 2.84Å; H355-D357 PolarHBondContact O-N 2.86Å; H355-L358 HydrophobicContact CB-CD1 4.46Å; H355-L358 HydrophobicContact CB-CG 4.38Å; H355-L358 PolarHBondContact O-N 3.5Å; H355-C359 PolarHBondContact O-N 2.85Å; H355-C359 VanDerWaalsContact O-N 3.11Å; H355-C359 PolarHBondContact O-SG 3.04Å
356	P	87	Confident	84.3	Confident	87 Å²	87	58.5 Å²	58.5	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-53.3	-34.8	-176.1	-28.6	35.2	0	0	0	114.4	L358	P356-L358 PolarHBondContact O-N 2.88Å
357	D	85.1	Confident	83.9	Confident	81 Å²	81	57.9 Å²	57.9	43%	0.433	31%	0.312	S	S	.	.	H	α-helix	trans	-68.9	-19	177.4	-65.7	-20.8	0	0	0	113.4	K294 H355	K294-D357 WeakPolarHBondContact CD-O 3.37Å; K294-D357 WeakPolarHBondContact CE-O 3.3Å; K294-D357 PolarHBondContact NZ-O 3.05Å; H355-D357 IonicContact CE1-OD2 3.19Å; H355-D357 PolarHBondContact CE1-OD2 3.41Å; H355-D357 VanDerWaalsContact CE1-OD2 3.29Å; H355-D357 WeakPolarHBondContact ND1-CB 3.32Å; H355-D357 PolarHBondContact ND1-N 3.24Å; H355-D357 IonicContact ND1-OD2 2.84Å; H355-D357 PolarHBondContact O-N 2.86Å
358	L	85.5	Confident	83.7	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-99	-33.6	178.1	-55.9	-177.1	0	0	0	112.1	L287 L290 I291 F308 H355 P356 S360 E361 F362	L287-L358 HydrophobicContact CD1-CD1 3.77Å; L287-L358 HydrophobicContact CD1-CG 4.29Å; L290-L358 HydrophobicContact CB-CD1 4.18Å; L290-L358 HydrophobicContact CB-CD2 3.86Å; L290-L358 HydrophobicContact CD1-CD1 3.99Å; I291-L358 HydrophobicContact CG1-CD2 4.34Å; F308-L358 HydrophobicContact CE2-CD2 4.16Å; F308-L358 HydrophobicContact CZ-CD2 4.02Å; H355-L358 HydrophobicContact CB-CD1 4.46Å; H355-L358 HydrophobicContact CB-CG 4.38Å; H355-L358 PolarHBondContact O-N 3.5Å; P356-L358 PolarHBondContact O-N 2.88Å; L358-S360 PolarHBondContact O-N 3.33Å; L358-E361 PolarHBondContact O-N 2.9Å; L358-F362 PolarHBondContact O-N 3.22Å
359	C	76.7	Confident	83.7	Confident	54 Å²	54	65.1 Å²	65.1	37%	0.365	36%	0.356	S	S	.	.	H	α-helix	trans	-60.1	-19	-176.4	-65	0	0	0	0	115.4	G354 H355 E361	G354-C359 PolarHBondContact O-SG 3.31Å; H355-C359 PolarHBondContact O-N 2.85Å; H355-C359 VanDerWaalsContact O-N 3.11Å; H355-C359 PolarHBondContact O-SG 3.04Å; C359-E361 VanDerWaalsContact C-N 3.26Å
360	S	76.6	Confident	83.8	Confident	81 Å²	81	63.8 Å²	63.8	57%	0.566	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-22.7	175.5	31.5	0	0	0	0	113	K294 L358	K294-S360 PolarHBondContact NZ-OG 3.25Å; L358-S360 PolarHBondContact O-N 3.33Å
361	E	74.3	Confident	84	Confident	100 Å²	100	59.2 Å²	59.2	47%	0.467	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-24.9	-173.9	-57.8	-64.2	155.4	0	0	112.7	K294 F308 L358 C359	K294-E361 HydrophobicContact CD-CG 3.99Å; K294-E361 WeakPolarHBondContact CE-OE1 3.43Å; K294-E361 HydrophobicContact CG-CG 4.24Å; F308-E361 HydrophobicContact CD1-CB 3.56Å; F308-E361 HydrophobicContact CD1-CG 4.26Å; F308-E361 HydrophobicContact CE1-CB 3.38Å; F308-E361 HydrophobicContact CE1-CG 4.19Å; F308-E361 HydrophobicContact CG-CB 4.39Å; F308-E361 HydrophobicContact CZ-CB 4.08Å; L358-E361 PolarHBondContact O-N 2.9Å; C359-E361 VanDerWaalsContact C-N 3.26Å
362	F	76.8	Confident	84.3	Confident	35 Å²	35	57 Å²	57	15%	0.154	31%	0.313	C	S	.	.			trans	-142.8	140.2	-175.4	-167.1	-89	0	0	0	112.8	F308 F312 L358 Q366 L367	F308-F362 HydrophobicContact CE1-CB 4.29Å; F312-F362 HydrophobicContact CD1-CD1 4.18Å; F312-F362 HydrophobicContact CD1-CD2 4.08Å; F312-F362 HydrophobicContact CD1-CE1 4.25Å; F312-F362 HydrophobicContact CD1-CE2 4.13Å; F312-F362 HydrophobicContact CD1-CG 4.1Å; F312-F362 HydrophobicContact CD1-CZ 4.22Å; F312-F362 AromaticContact CE1-CD1 3.37Å; F312-F362 HydrophobicContact CE1-CD1 3.37Å; F312-F362 HydrophobicContact CE1-CD2 4.08Å; F312-F362 AromaticContact CE1-CE1 3.4Å; F312-F362 HydrophobicContact CE1-CE1 3.4Å; F312-F362 VanDerWaalsContact CE1-CE1 3.4Å; F312-F362 HydrophobicContact CE1-CE2 4.09Å; F312-F362 AromaticContact CE1-CG 3.74Å; F312-F362 HydrophobicContact CE1-CG 3.74Å; F312-F362 AromaticContact CE1-CZ 3.77Å; F312-F362 HydrophobicContact CE1-CZ 3.77Å; F312-F362 HydrophobicContact CE2-CD1 4.44Å; F312-F362 HydrophobicContact CZ-CB 4.46Å; F312-F362 AromaticContact CZ-CD1 3.53Å; F312-F362 HydrophobicContact CZ-CD1 3.53Å; F312-F362 AromaticContact CZ-CE1 3.94Å; F312-F362 HydrophobicContact CZ-CE1 3.94Å; F312-F362 AromaticContact CZ-CG 4Å; F312-F362 HydrophobicContact CZ-CG 4Å; L358-F362 PolarHBondContact O-N 3.22Å; F362-Q366 HydrophobicContact CE1-CB 4.09Å; F362-Q366 HydrophobicContact CZ-CB 3.88Å; F362-L367 HydrophobicContact CE1-CD2 4.4Å; F362-L367 HydrophobicContact CE1-CG 3.98Å
363	D	78.5	Confident	84.3	Confident	71 Å²	71	62.8 Å²	62.8	38%	0.38	34%	0.34	S	S	.	.			trans	-86.8	110.9	174.3	178.2	12.9	0	0	0	110.7	N365 Q366	D363-N365 PolarHBondContact O-N 2.88Å; D363-N365 WeakPolarHBondContact OD1-CB 3.48Å; D363-N365 PolarHBondContact OD1-N 3.23Å; D363-N365 VanDerWaalsContact OD1-N 3.1Å; D363-N365 PolarHBondContact OD1-ND2 3.01Å; D363-Q366 HydrophobicContact CB-CG 4.2Å; D363-Q366 WeakPolarHBondContact O-CB 3.24Å; D363-Q366 PolarHBondContact O-N 2.97Å
364	I	77.6	Confident	84.5	Confident	40 Å²	40	70 Å²	70	21%	0.205	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-53.8	-28.9	-178.9	-51.2	157.3	0	0	0	111.7	K348 Q366 L367	K348-I364 HydrophobicContact CB-CG2 4.2Å; K348-I364 HydrophobicContact CG-CG2 4.42Å; I364-Q366 PolarHBondContact O-N 2.76Å; I364-L367 HydrophobicContact CG2-CD1 4.2Å; I364-L367 VanDerWaalsContact O-CB 3.32Å; I364-L367 WeakPolarHBondContact O-CB 3.31Å; I364-L367 PolarHBondContact O-N 2.93Å
365	N	77.1	Confident	84.8	Confident	141 Å²	141	71.9 Å²	71.9	75%	0.754	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-68.3	-16.7	-178.5	-59.8	-59.2	0	0	0	113.2	D363 L367	D363-N365 PolarHBondContact O-N 2.88Å; D363-N365 WeakPolarHBondContact OD1-CB 3.48Å; D363-N365 PolarHBondContact OD1-N 3.23Å; D363-N365 VanDerWaalsContact OD1-N 3.1Å; D363-N365 PolarHBondContact OD1-ND2 3.01Å; N365-L367 VanDerWaalsContact C-N 3.31Å
366	Q	82.3	Confident	84.9	Confident	133 Å²	133	70 Å²	70	62%	0.621	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-84	-7.1	175	-59.2	179	17	0	0	112.6	F362 D363 I364 E368	F362-Q366 HydrophobicContact CE1-CB 4.09Å; F362-Q366 HydrophobicContact CZ-CB 3.88Å; D363-Q366 HydrophobicContact CB-CG 4.2Å; D363-Q366 WeakPolarHBondContact O-CB 3.24Å; D363-Q366 PolarHBondContact O-N 2.97Å; I364-Q366 PolarHBondContact O-N 2.76Å; Q366-E368 PolarHBondContact O-N 3.41Å
367	L	81.9	Confident	85.1	Confident	11 Å²	11	69.6 Å²	69.6	6%	0.058	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-72.5	120.2	175.8	-80.6	171	0	0	0	111.4	F312 H316 Y347 K348 M353 F362 I364 N365	F312-L367 HydrophobicContact CD1-CD2 4.47Å; F312-L367 HydrophobicContact CE1-CD1 4.29Å; F312-L367 HydrophobicContact CE1-CD2 3.46Å; F312-L367 VanDerWaalsContact CE1-CD2 3.46Å; F312-L367 HydrophobicContact CE1-CG 3.97Å; F312-L367 HydrophobicContact CZ-CD1 3.92Å; F312-L367 HydrophobicContact CZ-CD2 3.93Å; F312-L367 HydrophobicContact CZ-CG 4.1Å; H316-L367 HydrophobicContact CB-CD2 4.36Å; Y347-L367 HydrophobicContact CE1-CD1 4.15Å; K348-L367 PolarHBondContact NZ-O 3.19Å; M353-L367 HydrophobicContact CB-CD1 3.85Å; M353-L367 HydrophobicContact CG-CD1 4.26Å; F362-L367 HydrophobicContact CE1-CD2 4.4Å; F362-L367 HydrophobicContact CE1-CG 3.98Å; I364-L367 HydrophobicContact CG2-CD1 4.2Å; I364-L367 VanDerWaalsContact O-CB 3.32Å; I364-L367 WeakPolarHBondContact O-CB 3.31Å; I364-L367 PolarHBondContact O-N 2.93Å; N365-L367 VanDerWaalsContact C-N 3.31Å
368	E	87.7	Confident	85.4	Confident	145 Å²	145	71.4 Å²	71.4	68%	0.678	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-60.4	150.2	166.2	-65.2	-174.6	179.2	0	0	110.9	H316 Q366	H316-E368 PolarHBondContact CE1-O 3.11Å; H316-E368 VanDerWaalsContact CE1-O 3.23Å; Q366-E368 PolarHBondContact O-N 3.41Å
369	P	89.1	Confident	85.8	Confident	93 Å²	93	71.8 Å²	71.8	60%	0.604	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-59.1	141.1	172.8	-23.1	34.5	0	0	0	112	L371	P369-L371 VanDerWaalsContact C-N 3.29Å; P369-L371 WeakPolarHBondContact CB-O 3.49Å; P369-L371 PolarHBondContact O-N 3.01Å
370	L	92.6	Very high	86.5	Confident	3 Å²	3	70 Å²	70	2%	0.016	37%	0.368	C	S	.	.	S	Bend	trans	-64.1	-35.8	177.2	-71.8	176.5	0	0	0	112.7	V319 S320 V323 K324 W342 V343 Y347	V319-L370 HydrophobicContact CB-CD2 4.41Å; V319-L370 HydrophobicContact CG1-CD1 4.06Å; V319-L370 HydrophobicContact CG1-CD2 3.92Å; S320-L370 PolarHBondContact OG-O 3.37Å; V323-L370 HydrophobicContact CG2-CD1 4.42Å; K324-L370 WeakPolarHBondContact CE-O 3.46Å; W342-L370 HydrophobicContact CE3-CD1 4.42Å; W342-L370 HydrophobicContact CZ3-CD1 3.68Å; V343-L370 HydrophobicContact CG1-CB 4.15Å; V343-L370 HydrophobicContact CG1-CD1 4.49Å; V343-L370 HydrophobicContact CG2-CD1 4.32Å; Y347-L370 HydrophobicContact CD1-CD1 3.7Å; Y347-L370 HydrophobicContact CD1-CD2 4.37Å; Y347-L370 HydrophobicContact CD1-CG 3.74Å; Y347-L370 HydrophobicContact CD2-CD1 3.54Å; Y347-L370 HydrophobicContact CD2-CD2 4.42Å; Y347-L370 HydrophobicContact CD2-CG 4.24Å; Y347-L370 HydrophobicContact CE1-CD1 4.07Å; Y347-L370 HydrophobicContact CE1-CD2 3.88Å; Y347-L370 HydrophobicContact CE1-CG 3.72Å; Y347-L370 HydrophobicContact CE2-CD1 3.9Å; Y347-L370 HydrophobicContact CE2-CD2 3.92Å; Y347-L370 HydrophobicContact CE2-CG 4.19Å; Y347-L370 HydrophobicContact CG-CD1 3.44Å; Y347-L370 VanDerWaalsContact CG-CD1 3.44Å; Y347-L370 HydrophobicContact CG-CG 4.02Å
371	L	93.1	Very high	87.1	Confident	4 Å²	4	69.9 Å²	69.9	2%	0.021	37%	0.367	C	S	.	.	S	Bend	trans	-115.7	139.4	177.9	-72	175.9	0	0	0	109.7	V323 K324 A327 V343 P369 V375 V376 L379	V323-L371 HydrophobicContact CG1-CD1 3.87Å; V323-L371 HydrophobicContact CG1-CD2 3.82Å; V323-L371 HydrophobicContact CG1-CG 3.66Å; K324-L371 HydrophobicContact CB-CD2 4.46Å; K324-L371 HydrophobicContact CG-CD2 3.76Å; A327-L371 HydrophobicContact CB-CD1 4.48Å; A327-L371 HydrophobicContact CB-CD2 4.08Å; V343-L371 HydrophobicContact CG1-CD1 4.31Å; V343-L371 HydrophobicContact CG1-CG 4.43Å; V343-L371 HydrophobicContact CG2-CD1 4.19Å; P369-L371 VanDerWaalsContact C-N 3.29Å; P369-L371 WeakPolarHBondContact CB-O 3.49Å; P369-L371 PolarHBondContact O-N 3.01Å; L371-V375 HydrophobicContact CD2-CG1 4.18Å; L371-V376 HydrophobicContact CB-CG2 3.89Å; L371-V376 HydrophobicContact CD1-CG2 4.42Å; L371-L379 HydrophobicContact CD1-CD1 4.38Å
372	P	92.7	Very high	88	Confident	62 Å²	62	68.4 Å²	68.4	40%	0.403	36%	0.359	S	S	.	.			trans	-59.2	147.1	166.5	-19	31.5	0	0	0	110.9	E374 V375 V376	P372-E374 PolarHBondContact O-N 3.44Å; P372-V375 HydrophobicContact CB-CG2 4.29Å; P372-V375 HydrophobicContact CG-CG2 4.17Å; P372-V375 PolarHBondContact O-N 3.03Å; P372-V376 PolarHBondContact O-N 2.99Å
373	Q	90.8	Very high	88.6	Confident	120 Å²	120	67.2 Å²	67.2	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-57.5	-37.2	-179.9	-171.2	60.9	41.3	0	0	112.2	V375 V376 D377	Q373-V375 VanDerWaalsContact C-N 3.29Å; Q373-V375 PolarHBondContact O-N 3.48Å; Q373-V376 WeakPolarHBondContact O-CB 3.43Å; Q373-V376 PolarHBondContact O-N 3.23Å; Q373-V376 VanDerWaalsContact O-N 3.1Å; Q373-D377 PolarHBondContact NE2-OD1 3.43Å; Q373-D377 VanDerWaalsContact O-CG 3.25Å; Q373-D377 PolarHBondContact O-N 3.22Å
374	E	92.5	Very high	89.2	Confident	154 Å²	154	65.1 Å²	65.1	72%	0.72	34%	0.343	S	S	*	.	H	α-helix	trans	-56.6	-42	176.8	-61.7	176.8	179.3	0	0	112.3	P372 D377 D378	P372-E374 PolarHBondContact O-N 3.44Å; E374-D377 PolarHBondContact O-N 3.06Å; E374-D378 WeakPolarHBondContact O-CB 3.31Å; E374-D378 PolarHBondContact O-N 2.86Å
375	V	92.8	Very high	89.9	Confident	46 Å²	46	71 Å²	71	28%	0.279	37%	0.367	S	S	.	.	H	α-helix	trans	-70.7	-36.6	178.7	-178.8	0	0	0	0	110.9	A327 L371 P372 Q373 L379	A327-V375 HydrophobicContact CB-CG1 3.91Å; L371-V375 HydrophobicContact CD2-CG1 4.18Å; P372-V375 HydrophobicContact CB-CG2 4.29Å; P372-V375 HydrophobicContact CG-CG2 4.17Å; P372-V375 PolarHBondContact O-N 3.03Å; Q373-V375 VanDerWaalsContact C-N 3.29Å; Q373-V375 PolarHBondContact O-N 3.48Å; V375-L379 HydrophobicContact CG1-CD1 4.38Å; V375-L379 VanDerWaalsContact O-CG 3.32Å; V375-L379 WeakPolarHBondContact O-CG 3.32Å; V375-L379 PolarHBondContact O-N 3.43Å
376	V	91.8	Very high	90.5	Very high	6 Å²	6	66.8 Å²	66.8	4%	0.036	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-47.4	174.8	174.9	0	0	0	0	110.2	L340 L371 P372 Q373 D378 L379 L380	L340-V376 HydrophobicContact CD2-CG1 4.12Å; L340-V376 HydrophobicContact CD2-CG2 4.38Å; L371-V376 HydrophobicContact CB-CG2 3.89Å; L371-V376 HydrophobicContact CD1-CG2 4.42Å; P372-V376 PolarHBondContact O-N 2.99Å; Q373-V376 WeakPolarHBondContact O-CB 3.43Å; Q373-V376 PolarHBondContact O-N 3.23Å; Q373-V376 VanDerWaalsContact O-N 3.1Å; V376-D378 VanDerWaalsContact C-N 3.33Å; V376-D378 PolarHBondContact O-N 3.1Å; V376-L379 PolarHBondContact O-N 2.9Å; V376-L380 HydrophobicContact CG1-CD1 3.97Å; V376-L380 HydrophobicContact CG1-CG 4.35Å; V376-L380 WeakPolarHBondContact O-CB 3.44Å; V376-L380 VanDerWaalsContact O-CG 3.31Å; V376-L380 WeakPolarHBondContact O-CG 3.13Å; V376-L380 PolarHBondContact O-N 3.3Å
377	D	91.3	Very high	90.9	Very high	80 Å²	80	60.7 Å²	60.7	43%	0.428	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-39.4	179.7	-65.5	-16.7	0	0	0	111.5	Q373 E374 L380 S381	Q373-D377 PolarHBondContact NE2-OD1 3.43Å; Q373-D377 VanDerWaalsContact O-CG 3.25Å; Q373-D377 PolarHBondContact O-N 3.22Å; E374-D377 PolarHBondContact O-N 3.06Å; D377-L380 PolarHBondContact O-N 3.34Å; D377-S381 VanDerWaalsContact O-CB 3.25Å; D377-S381 WeakPolarHBondContact O-CB 3.35Å; D377-S381 PolarHBondContact O-N 3.49Å
378	D	92.2	Very high	91.4	Very high	118 Å²	118	61.9 Å²	61.9	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-63.5	-44.7	175	-81.8	-13.3	0	0	0	112.3	E374 V376 S381 K382	E374-D378 WeakPolarHBondContact O-CB 3.31Å; E374-D378 PolarHBondContact O-N 2.86Å; V376-D378 VanDerWaalsContact C-N 3.33Å; V376-D378 PolarHBondContact O-N 3.1Å; D378-S381 PolarHBondContact O-N 3.31Å; D378-K382 WeakPolarHBondContact O-CB 3.41Å; D378-K382 PolarHBondContact O-N 2.83Å
379	L	92.6	Very high	91.6	Very high	10 Å²	10	58.9 Å²	58.9	5%	0.052	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-43.8	175.8	-73.4	174.1	0	0	0	111.6	A327 L331 I336 L339 L340 L371 V375 V376 K382 Y383	A327-L379 HydrophobicContact CB-CD1 4.06Å; L331-L379 HydrophobicContact CD1-CD2 4.43Å; I336-L379 HydrophobicContact CG1-CD2 4.31Å; I336-L379 HydrophobicContact CG2-CB 4.08Å; L339-L379 HydrophobicContact CD2-CD1 4.29Å; L340-L379 HydrophobicContact CD1-CB 4.18Å; L340-L379 HydrophobicContact CD2-CB 4.42Å; L340-L379 HydrophobicContact CD2-CD1 3.95Å; L371-L379 HydrophobicContact CD1-CD1 4.38Å; V375-L379 HydrophobicContact CG1-CD1 4.38Å; V375-L379 VanDerWaalsContact O-CG 3.32Å; V375-L379 WeakPolarHBondContact O-CG 3.32Å; V375-L379 PolarHBondContact O-N 3.43Å; V376-L379 PolarHBondContact O-N 2.9Å; L379-K382 PolarHBondContact O-N 2.98Å; L379-Y383 PolarHBondContact O-N 3.04Å
380	L	91.4	Very high	91.7	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.089	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.5	-71	176.2	0	0	0	111.2	L340 V376 D377 K382 Y383 V384 I442 F446	L340-L380 HydrophobicContact CD1-CD2 3.38Å; L340-L380 HydrophobicContact CD1-CG 3.81Å; V376-L380 HydrophobicContact CG1-CD1 3.97Å; V376-L380 HydrophobicContact CG1-CG 4.35Å; V376-L380 WeakPolarHBondContact O-CB 3.44Å; V376-L380 VanDerWaalsContact O-CG 3.31Å; V376-L380 WeakPolarHBondContact O-CG 3.13Å; V376-L380 PolarHBondContact O-N 3.3Å; D377-L380 PolarHBondContact O-N 3.34Å; L380-K382 PolarHBondContact O-N 3.41Å; L380-Y383 WeakPolarHBondContact O-CB 3.46Å; L380-Y383 PolarHBondContact O-N 3.32Å; L380-V384 WeakPolarHBondContact O-CB 3.49Å; L380-V384 VanDerWaalsContact O-CG2 3.24Å; L380-V384 WeakPolarHBondContact O-CG2 3.34Å; L380-V384 PolarHBondContact O-N 2.85Å; L380-I442 HydrophobicContact CD2-CG2 4.3Å; L380-F446 HydrophobicContact CB-CD2 4.34Å; L380-F446 HydrophobicContact CB-CE2 4.08Å; L380-F446 HydrophobicContact CD1-CD2 4.09Å; L380-F446 HydrophobicContact CD1-CG 4.48Å; L380-F446 HydrophobicContact CD2-CD1 4.01Å; L380-F446 HydrophobicContact CD2-CD2 3.67Å; L380-F446 HydrophobicContact CD2-CE1 4Å; L380-F446 HydrophobicContact CD2-CE2 3.66Å; L380-F446 HydrophobicContact CD2-CG 3.84Å; L380-F446 HydrophobicContact CD2-CZ 3.83Å; L380-F446 HydrophobicContact CG-CD2 4.25Å; L380-F446 HydrophobicContact CG-CE2 4.32Å
381	S	91.1	Very high	91.7	Very high	79 Å²	79	58.6 Å²	58.6	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-60.5	-44.7	175.5	-177.3	0	0	0	0	111.8	D377 D378 Y383 V384 K385	D377-S381 VanDerWaalsContact O-CB 3.25Å; D377-S381 WeakPolarHBondContact O-CB 3.35Å; D377-S381 PolarHBondContact O-N 3.49Å; D378-S381 PolarHBondContact O-N 3.31Å; S381-Y383 PolarHBondContact O-N 3.38Å; S381-V384 PolarHBondContact O-N 3.39Å; S381-K385 WeakPolarHBondContact O-CB 3.25Å; S381-K385 PolarHBondContact O-N 3.17Å
382	K	91.4	Very high	91.7	Very high	68 Å²	68	59.8 Å²	59.8	30%	0.296	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-43.5	175.2	-173	-177.1	-179.6	-163.1	0	111.9	D330 L331 I336 D378 L379 L380 K385 T386	D330-K382 WeakPolarHBondContact OD1-CE 3.41Å; D330-K382 IonicContact OD1-NZ 3.31Å; D330-K382 PolarHBondContact OD1-NZ 3.34Å; L331-K382 PolarHBondContact O-NZ 2.97Å; I336-K382 HydrophobicContact CD1-CB 4.28Å; I336-K382 HydrophobicContact CD1-CD 3.95Å; I336-K382 HydrophobicContact CD1-CG 4.11Å; D378-K382 WeakPolarHBondContact O-CB 3.41Å; D378-K382 PolarHBondContact O-N 2.83Å; L379-K382 PolarHBondContact O-N 2.98Å; L380-K382 PolarHBondContact O-N 3.41Å; K382-K385 PolarHBondContact O-N 3.08Å; K382-T386 PolarHBondContact O-N 3.27Å; K382-T386 VanDerWaalsContact O-N 3.09Å; K382-T386 PolarHBondContact O-OG1 2.97Å
383	Y	91.1	Very high	91.8	Very high	11 Å²	11	58.1 Å²	58.1	4%	0.043	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-50.9	173.5	173.8	-85	0	0	0	111	A333 V337 L379 L380 S381 K385 T386 F387 F446	A333-Y383 HydrophobicContact CB-CD2 3.94Å; A333-Y383 HydrophobicContact CB-CE2 4.18Å; A333-Y383 WeakPolarHBondContact O-CD2 3.33Å; V337-Y383 HydrophobicContact CG2-CD2 3.81Å; V337-Y383 HydrophobicContact CG2-CE2 3.34Å; L379-Y383 PolarHBondContact O-N 3.04Å; L380-Y383 WeakPolarHBondContact O-CB 3.46Å; L380-Y383 PolarHBondContact O-N 3.32Å; S381-Y383 PolarHBondContact O-N 3.38Å; Y383-K385 VanDerWaalsContact C-N 3.28Å; Y383-K385 PolarHBondContact O-N 3.4Å; Y383-T386 PolarHBondContact O-N 2.9Å; Y383-T386 VanDerWaalsContact O-N 3.12Å; Y383-F387 HydrophobicContact CD1-CB 4.29Å; Y383-F387 HydrophobicContact CE1-CB 4.04Å; Y383-F387 HydrophobicContact CE1-CG 4.34Å; Y383-F387 VanDerWaalsContact O-CB 3.23Å; Y383-F387 WeakPolarHBondContact O-CB 3.3Å; Y383-F387 PolarHBondContact O-N 3.04Å; Y383-F446 HydrophobicContact CD1-CE1 4.14Å; Y383-F446 AromaticContact CD1-CZ 3.53Å; Y383-F446 HydrophobicContact CD1-CZ 3.53Å; Y383-F446 HydrophobicContact CE1-CE1 4.02Å; Y383-F446 AromaticContact CE1-CZ 3.77Å; Y383-F446 HydrophobicContact CE1-CZ 3.77Å; Y383-F446 HydrophobicContact CG-CZ 4.49Å
384	V	91.3	Very high	92	Very high	27 Å²	27	60 Å²	60	16%	0.164	32%	0.318	C	S	.	.	H	α-helix	trans	-58.7	-40.7	-178.4	168.3	0	0	0	0	111	L380 S381 T388 F446 L453	L380-V384 WeakPolarHBondContact O-CB 3.49Å; L380-V384 VanDerWaalsContact O-CG2 3.24Å; L380-V384 WeakPolarHBondContact O-CG2 3.34Å; L380-V384 PolarHBondContact O-N 2.85Å; S381-V384 PolarHBondContact O-N 3.39Å; V384-T388 WeakPolarHBondContact O-CB 3.3Å; V384-T388 PolarHBondContact O-N 3.14Å; V384-T388 PolarHBondContact O-OG1 3.26Å; V384-F446 HydrophobicContact CG2-CE2 3.55Å; V384-F446 HydrophobicContact CG2-CZ 3.92Å; V384-L453 HydrophobicContact CG1-CD2 3.87Å
385	K	91.6	Very high	92.2	Very high	163 Å²	163	52.9 Å²	52.9	71%	0.709	29%	0.285	S	S	*	.	H	α-helix	trans	-62.8	-47.5	176	-173.9	179.2	179.6	-178	0	111.8	S381 K382 Y383 T388 S389	S381-K385 WeakPolarHBondContact O-CB 3.25Å; S381-K385 PolarHBondContact O-N 3.17Å; K382-K385 PolarHBondContact O-N 3.08Å; Y383-K385 VanDerWaalsContact C-N 3.28Å; Y383-K385 PolarHBondContact O-N 3.4Å; K385-T388 PolarHBondContact O-N 3.15Å; K385-S389 PolarHBondContact O-N 3.34Å; K385-S389 VanDerWaalsContact O-N 3.1Å
386	T	90.3	Very high	92.3	Very high	52 Å²	52	57 Å²	57	32%	0.319	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-45.1	179.2	-54.2	0	0	0	0	111.1	A333 K382 Y383 T388 S389 N390	A333-T386 HydrophobicContact CB-CG2 4.11Å; K382-T386 PolarHBondContact O-N 3.27Å; K382-T386 VanDerWaalsContact O-N 3.09Å; K382-T386 PolarHBondContact O-OG1 2.97Å; Y383-T386 PolarHBondContact O-N 2.9Å; Y383-T386 VanDerWaalsContact O-N 3.12Å; T386-T388 PolarHBondContact O-N 3.42Å; T386-S389 PolarHBondContact O-N 3.39Å; T386-N390 WeakPolarHBondContact O-CB 3.37Å; T386-N390 VanDerWaalsContact O-CG 3.23Å; T386-N390 PolarHBondContact O-N 2.95Å
387	F	89.7	Confident	92.5	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-57.8	-47	174.6	169.2	-105.7	0	0	0	111.8	Y383 S389 N390 I391 N435 V450 L453	Y383-F387 HydrophobicContact CD1-CB 4.29Å; Y383-F387 HydrophobicContact CE1-CB 4.04Å; Y383-F387 HydrophobicContact CE1-CG 4.34Å; Y383-F387 VanDerWaalsContact O-CB 3.23Å; Y383-F387 WeakPolarHBondContact O-CB 3.3Å; Y383-F387 PolarHBondContact O-N 3.04Å; F387-S389 VanDerWaalsContact C-N 3.34Å; F387-S389 PolarHBondContact O-N 2.93Å; F387-N390 PolarHBondContact O-N 2.94Å; F387-I391 HydrophobicContact CE1-CD1 4.35Å; F387-I391 HydrophobicContact CE2-CB 4.38Å; F387-I391 HydrophobicContact CE2-CD1 3.65Å; F387-I391 HydrophobicContact CZ-CB 4.44Å; F387-I391 HydrophobicContact CZ-CD1 3.41Å; F387-I391 VanDerWaalsContact CZ-CD1 3.41Å; F387-I391 WeakPolarHBondContact O-CB 3.21Å; F387-I391 WeakPolarHBondContact O-CG2 3.33Å; F387-I391 PolarHBondContact O-N 2.83Å; F387-N435 HydrophobicContact CD2-CB 4.25Å; F387-N435 HydrophobicContact CE2-CB 3.43Å; F387-N435 VanDerWaalsContact CE2-CB 3.43Å; F387-N435 VanDerWaalsContact CE2-CG 3.43Å; F387-N435 WeakPolarHBondContact CE2-OD1 3.4Å; F387-N435 HydrophobicContact CZ-CB 4.1Å; F387-V450 HydrophobicContact CE1-CG1 3.89Å; F387-V450 HydrophobicContact CZ-CG1 4.02Å; F387-L453 HydrophobicContact CD1-CD2 3.49Å; F387-L453 VanDerWaalsContact CD1-CD2 3.49Å; F387-L453 HydrophobicContact CE1-CD2 3.62Å; F387-L453 HydrophobicContact CE1-CG 4.22Å
388	T	91.9	Very high	92.7	Very high	35 Å²	35	60 Å²	60	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-47.3	176.5	-56.3	0	0	0	0	111	V384 K385 T386 N390 I391 T392 L453	V384-T388 WeakPolarHBondContact O-CB 3.3Å; V384-T388 PolarHBondContact O-N 3.14Å; V384-T388 PolarHBondContact O-OG1 3.26Å; K385-T388 PolarHBondContact O-N 3.15Å; T386-T388 PolarHBondContact O-N 3.42Å; T388-N390 PolarHBondContact O-N 3.16Å; T388-I391 WeakPolarHBondContact O-CG2 3.38Å; T388-I391 PolarHBondContact O-N 3.31Å; T388-T392 WeakPolarHBondContact O-CB 3.38Å; T388-T392 PolarHBondContact O-N 3.12Å; T388-T392 PolarHBondContact O-OG1 2.85Å; T388-L453 HydrophobicContact CG2-CD1 4.31Å; T388-L453 WeakPolarHBondContact OG1-CD2 3.48Å
389	S	92	Very high	93	Very high	82 Å²	82	54.9 Å²	54.9	57%	0.573	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-46.3	178.2	-177.9	0	0	0	0	111.8	K385 T386 F387 G393	K385-S389 PolarHBondContact O-N 3.34Å; K385-S389 VanDerWaalsContact O-N 3.1Å; T386-S389 PolarHBondContact O-N 3.39Å; F387-S389 VanDerWaalsContact C-N 3.34Å; F387-S389 PolarHBondContact O-N 2.93Å; S389-G393 PolarHBondContact O-N 3.44Å; S389-G393 VanDerWaalsContact O-N 3.08Å
390	N	90.8	Very high	93.1	Very high	86 Å²	86	59 Å²	59	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-45.7	-179.3	-71.2	-11.8	0	0	0	111.5	T386 F387 T388 G393 W394	T386-N390 WeakPolarHBondContact O-CB 3.37Å; T386-N390 VanDerWaalsContact O-CG 3.23Å; T386-N390 PolarHBondContact O-N 2.95Å; F387-N390 PolarHBondContact O-N 2.94Å; T388-N390 PolarHBondContact O-N 3.16Å; N390-G393 PolarHBondContact O-N 2.82Å; N390-W394 PolarHBondContact O-N 3.42Å
391	I	93.7	Very high	93.3	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-69.9	-38.9	-177	-155.9	150.8	0	0	0	112.2	F387 T388 G393 W394 L395 M431 F432 Q457	F387-I391 HydrophobicContact CE1-CD1 4.35Å; F387-I391 HydrophobicContact CE2-CB 4.38Å; F387-I391 HydrophobicContact CE2-CD1 3.65Å; F387-I391 HydrophobicContact CZ-CB 4.44Å; F387-I391 HydrophobicContact CZ-CD1 3.41Å; F387-I391 VanDerWaalsContact CZ-CD1 3.41Å; F387-I391 WeakPolarHBondContact O-CB 3.21Å; F387-I391 WeakPolarHBondContact O-CG2 3.33Å; F387-I391 PolarHBondContact O-N 2.83Å; T388-I391 WeakPolarHBondContact O-CG2 3.38Å; T388-I391 PolarHBondContact O-N 3.31Å; I391-G393 VanDerWaalsContact C-N 3.29Å; I391-G393 PolarHBondContact O-N 3.27Å; I391-W394 PolarHBondContact O-N 3.31Å; I391-L395 HydrophobicContact CG1-CD1 4.26Å; I391-L395 HydrophobicContact CG1-CG 4.41Å; I391-L395 WeakPolarHBondContact O-CB 3.38Å; I391-L395 VanDerWaalsContact O-CG 3.25Å; I391-L395 WeakPolarHBondContact O-CG 3.36Å; I391-L395 PolarHBondContact O-N 2.94Å; I391-M431 HydrophobicContact CD1-CE 3.77Å; I391-M431 HydrophobicContact CD1-SD 4.38Å; I391-M431 HydrophobicContact CG1-CE 3.48Å; I391-M431 VanDerWaalsContact CG1-CE 3.48Å; I391-M431 HydrophobicContact CG1-SD 3.85Å; I391-F432 HydrophobicContact CD1-CD1 3.37Å; I391-F432 HydrophobicContact CD1-CE1 3.29Å; I391-F432 HydrophobicContact CG1-CD1 4.34Å; I391-F432 HydrophobicContact CG1-CE1 3.88Å; I391-Q457 HydrophobicContact CG2-CB 4.34Å; I391-Q457 HydrophobicContact CG2-CG 3.83Å
392	T	93.7	Very high	93.5	Very high	30 Å²	30	58.2 Å²	58.2	18%	0.184	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-40.3	173.2	-57.3	0	0	0	0	111.2	T388 R396 Q457	T388-T392 WeakPolarHBondContact O-CB 3.38Å; T388-T392 PolarHBondContact O-N 3.12Å; T388-T392 PolarHBondContact O-OG1 2.85Å; T392-R396 WeakPolarHBondContact O-CB 3.32Å; T392-R396 PolarHBondContact O-N 3.41Å; T392-Q457 PolarHBondContact OG1-OE1 2.79Å
393	G	93.9	Very high	93.7	Very high	26 Å²	26	58.1 Å²	58.1	27%	0.268	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-42.4	176.5	0	0	0	0	0	113.1	S389 N390 I391 R396 K397	S389-G393 PolarHBondContact O-N 3.44Å; S389-G393 VanDerWaalsContact O-N 3.08Å; N390-G393 PolarHBondContact O-N 2.82Å; I391-G393 VanDerWaalsContact C-N 3.29Å; I391-G393 PolarHBondContact O-N 3.27Å; G393-R396 PolarHBondContact O-N 2.84Å; G393-K397 WeakPolarHBondContact O-CG 3.38Å; G393-K397 PolarHBondContact O-N 3.35Å; G393-K397 VanDerWaalsContact O-N 3.15Å
394	W	94.5	Very high	93.8	Very high	160 Å²	160	64.5 Å²	64.5	61%	0.606	32%	0.318	S	S	*	.	H	α-helix	trans	-66.2	-47.4	177	-93.4	85.6	0	0	0	112.7	N390 I391 R396 K397 A398 M431	N390-W394 PolarHBondContact O-N 3.42Å; I391-W394 PolarHBondContact O-N 3.31Å; W394-R396 PolarHBondContact O-N 2.85Å; W394-K397 PolarHBondContact O-N 2.87Å; W394-K397 VanDerWaalsContact O-N 3.12Å; W394-A398 WeakPolarHBondContact O-CB 3.25Å; W394-A398 PolarHBondContact O-N 3.41Å; W394-M431 HydrophobicContact CB-SD 3.57Å; W394-M431 VanDerWaalsContact CB-SD 3.57Å; W394-M431 HydrophobicContact CG-SD 4.3Å
395	L	96.4	Very high	93.9	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-38.7	176.8	-73.9	171.6	0	0	0	111.9	I391 L399 V428 M431 F432 Q457 F461	I391-L395 HydrophobicContact CG1-CD1 4.26Å; I391-L395 HydrophobicContact CG1-CG 4.41Å; I391-L395 WeakPolarHBondContact O-CB 3.38Å; I391-L395 VanDerWaalsContact O-CG 3.25Å; I391-L395 WeakPolarHBondContact O-CG 3.36Å; I391-L395 PolarHBondContact O-N 2.94Å; L395-L399 PolarHBondContact O-N 2.86Å; L395-V428 HydrophobicContact CD2-CB 4.42Å; L395-V428 HydrophobicContact CD2-CG1 3.86Å; L395-V428 HydrophobicContact CD2-CG2 3.88Å; L395-M431 HydrophobicContact CD1-CE 4.47Å; L395-M431 HydrophobicContact CD2-CE 3.48Å; L395-M431 VanDerWaalsContact CD2-CE 3.48Å; L395-M431 HydrophobicContact CG-CE 3.77Å; L395-F432 HydrophobicContact CD1-CE1 4.45Å; L395-F432 HydrophobicContact CD1-CZ 4.1Å; L395-F432 HydrophobicContact CD2-CZ 4.26Å; L395-Q457 HydrophobicContact CD1-CB 4.13Å; L395-F461 HydrophobicContact CB-CD2 3.88Å; L395-F461 HydrophobicContact CB-CG 4.5Å; L395-F461 HydrophobicContact CD1-CB 4.12Å; L395-F461 HydrophobicContact CD2-CD2 4.05Å; L395-F461 HydrophobicContact CD2-CE2 4.36Å; L395-F461 HydrophobicContact CD2-CG 4.2Å; L395-F461 HydrophobicContact CG-CD2 4.44Å
396	R	95.7	Very high	94	Very high	131 Å²	131	57.1 Å²	57.1	49%	0.494	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-49.3	174.5	-171.8	-170.9	-56.9	159.4	3.5	111.6	T392 G393 W394 A398 L399 E400	T392-R396 WeakPolarHBondContact O-CB 3.32Å; T392-R396 PolarHBondContact O-N 3.41Å; G393-R396 PolarHBondContact O-N 2.84Å; W394-R396 PolarHBondContact O-N 2.85Å; R396-A398 VanDerWaalsContact C-N 3.33Å; R396-A398 PolarHBondContact O-N 3.45Å; R396-L399 PolarHBondContact O-N 3.38Å; R396-E400 WeakPolarHBondContact CG-OE1 3.28Å; R396-E400 WeakPolarHBondContact O-CG 3.5Å; R396-E400 PolarHBondContact O-N 3.37Å
397	K	95.8	Very high	94.1	Very high	137 Å²	137	59.9 Å²	59.9	60%	0.596	30%	0.297	S	S	*	.	H	α-helix	trans	-63.5	-38.2	178.9	-72.6	179.2	178.8	-178.2	0	112.5	G393 W394 E400 T401	G393-K397 WeakPolarHBondContact O-CG 3.38Å; G393-K397 PolarHBondContact O-N 3.35Å; G393-K397 VanDerWaalsContact O-N 3.15Å; W394-K397 PolarHBondContact O-N 2.87Å; W394-K397 VanDerWaalsContact O-N 3.12Å; K397-E400 PolarHBondContact O-N 3.38Å; K397-T401 WeakPolarHBondContact O-CB 3.36Å; K397-T401 PolarHBondContact O-N 2.82Å; K397-T401 PolarHBondContact O-OG1 3.49Å
398	A	96.5	Very high	94.2	Very high	13 Å²	13	64.3 Å²	64.3	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-46.5	175.3	0	0	0	0	0	110.6	W394 R396 T401 D402 L424 I427	W394-A398 WeakPolarHBondContact O-CB 3.25Å; W394-A398 PolarHBondContact O-N 3.41Å; R396-A398 VanDerWaalsContact C-N 3.33Å; R396-A398 PolarHBondContact O-N 3.45Å; A398-T401 WeakPolarHBondContact O-CB 3.36Å; A398-T401 PolarHBondContact O-N 3.2Å; A398-D402 PolarHBondContact O-N 2.93Å; A398-L424 HydrophobicContact CB-CD1 3.8Å; A398-I427 HydrophobicContact CB-CG2 4.29Å
399	L	96.9	Very high	94.1	Very high	11 Å²	11	70.1 Å²	70.1	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-45.4	175.5	-177.4	50.6	0	0	0	112.7	L395 R396 T401 D402 K403 W406 L424 F461 R464 Y465 E468	L395-L399 PolarHBondContact O-N 2.86Å; R396-L399 PolarHBondContact O-N 3.38Å; L399-T401 PolarHBondContact O-N 3.04Å; L399-D402 PolarHBondContact O-N 3.48Å; L399-K403 HydrophobicContact CD1-CG 4.29Å; L399-K403 HydrophobicContact CG-CD 4.48Å; L399-K403 WeakPolarHBondContact O-CG 3.32Å; L399-K403 PolarHBondContact O-N 2.85Å; L399-W406 HydrophobicContact CD1-CH2 4.47Å; L399-L424 HydrophobicContact CD1-CD2 4.45Å; L399-F461 HydrophobicContact CB-CE2 4Å; L399-R464 HydrophobicContact CD2-CB 4.18Å; L399-Y465 HydrophobicContact CD1-CD2 3.56Å; L399-Y465 HydrophobicContact CD1-CE2 4.09Å; L399-E468 HydrophobicContact CD2-CG 4.16Å
400	E	95.9	Very high	94.2	Very high	97 Å²	97	70.4 Å²	70.4	45%	0.453	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-30.5	176.7	-75	170.8	-171.4	0	0	112.6	R396 K397 K404	R396-E400 WeakPolarHBondContact CG-OE1 3.28Å; R396-E400 WeakPolarHBondContact O-CG 3.5Å; R396-E400 PolarHBondContact O-N 3.37Å; K397-E400 PolarHBondContact O-N 3.38Å; E400-K404 WeakPolarHBondContact O-CG 3.14Å; E400-K404 PolarHBondContact O-N 2.89Å
401	T	95.3	Very high	94.3	Very high	75 Å²	75	71.5 Å²	71.5	46%	0.46	34%	0.342	S	S	.	.	H	α-helix	trans	-75.5	-45.9	176.8	-55.5	0	0	0	0	110.4	K397 A398 L399 K403 K404 D405	K397-T401 WeakPolarHBondContact O-CB 3.36Å; K397-T401 PolarHBondContact O-N 2.82Å; K397-T401 PolarHBondContact O-OG1 3.49Å; A398-T401 WeakPolarHBondContact O-CB 3.36Å; A398-T401 PolarHBondContact O-N 3.2Å; L399-T401 PolarHBondContact O-N 3.04Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.98Å; T401-K404 WeakPolarHBondContact O-CB 3.33Å; T401-K404 PolarHBondContact O-N 2.87Å; T401-K404 VanDerWaalsContact O-N 3.1Å; T401-D405 PolarHBondContact O-N 3.49Å
402	D	95.7	Very high	94.3	Very high	3 Å²	3	71.8 Å²	71.8	2%	0.016	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-43.2	176	-160.1	57.7	0	0	0	111.8	A398 L399 K404 D405 W406 T422 L424	A398-D402 PolarHBondContact O-N 2.93Å; L399-D402 PolarHBondContact O-N 3.48Å; D402-K404 VanDerWaalsContact C-N 3.25Å; D402-K404 PolarHBondContact O-N 3.23Å; D402-D405 WeakPolarHBondContact O-CA 3.48Å; D402-D405 VanDerWaalsContact O-CB 3.29Å; D402-D405 WeakPolarHBondContact O-CB 3.45Å; D402-D405 PolarHBondContact O-N 2.9Å; D402-W406 PolarHBondContact O-N 3.41Å; D402-W406 VanDerWaalsContact O-N 3.11Å; D402-W406 PolarHBondContact O-NE1 2.94Å; D402-W406 VanDerWaalsContact OD2-CE2 3.31Å; D402-W406 VanDerWaalsContact OD2-CZ2 3.3Å; D402-W406 WeakPolarHBondContact OD2-CZ2 3.42Å; D402-W406 PolarHBondContact OD2-NE1 2.74Å; D402-T422 WeakPolarHBondContact OD1-CB 3.44Å; D402-T422 WeakPolarHBondContact OD1-CG2 3.5Å; D402-T422 PolarHBondContact OD1-OG1 3.1Å; D402-L424 HydrophobicContact CB-CB 4.02Å; D402-L424 HydrophobicContact CB-CD1 4.25Å; D402-L424 HydrophobicContact CB-CD2 3.84Å; D402-L424 HydrophobicContact CB-CG 4.25Å; D402-L424 WeakPolarHBondContact OD1-CB 3.3Å; D402-L424 VanDerWaalsContact OD2-CD2 3.27Å; D402-L424 WeakPolarHBondContact OD2-CD2 3.48Å
403	K	95	Very high	94.2	Very high	67 Å²	67	77 Å²	77	29%	0.291	37%	0.366	S	S	.	.	H	α-helix	trans	-57.2	-36.2	174.6	-77.3	-178.5	68.7	-176.7	0	113.6	L399 T401 D405 W406 E468	L399-K403 HydrophobicContact CD1-CG 4.29Å; L399-K403 HydrophobicContact CG-CD 4.48Å; L399-K403 WeakPolarHBondContact O-CG 3.32Å; L399-K403 PolarHBondContact O-N 2.85Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.98Å; K403-D405 VanDerWaalsContact C-N 3.29Å; K403-W406 HydrophobicContact CB-CE3 4.48Å; K403-W406 HydrophobicContact CG-CE3 4.09Å; K403-W406 HydrophobicContact CG-CH2 3.95Å; K403-W406 HydrophobicContact CG-CZ2 4.4Å; K403-W406 HydrophobicContact CG-CZ3 3.78Å; K403-W406 PolarHBondContact O-N 3.5Å; K403-E468 HydrophobicContact CD-CB 4.06Å; K403-E468 HydrophobicContact CD-CG 3.88Å; K403-E468 WeakPolarHBondContact CE-OE2 3.27Å; K403-E468 IonicContact NZ-OE1 2.69Å; K403-E468 PolarHBondContact NZ-OE1 3.27Å; K403-E468 IonicContact NZ-OE2 3.43Å; K403-E468 PolarHBondContact NZ-OE2 3.43Å
404	K	93.9	Very high	94	Very high	145 Å²	145	78.3 Å²	78.3	63%	0.63	38%	0.375	S	S	*	.	H	α-helix	trans	-70	-32.6	176	-72	172.3	-177.2	176.1	0	111	E400 T401 D402 W406 L407	E400-K404 WeakPolarHBondContact O-CG 3.14Å; E400-K404 PolarHBondContact O-N 2.89Å; T401-K404 WeakPolarHBondContact O-CB 3.33Å; T401-K404 PolarHBondContact O-N 2.87Å; T401-K404 VanDerWaalsContact O-N 3.1Å; D402-K404 VanDerWaalsContact C-N 3.25Å; D402-K404 PolarHBondContact O-N 3.23Å; K404-W406 VanDerWaalsContact C-N 3.32Å; K404-L407 PolarHBondContact O-N 2.9Å
405	D	92.6	Very high	93.8	Very high	32 Å²	32	72.6 Å²	72.6	17%	0.171	36%	0.356	C	S	.	.	H	α-helix	trans	-65.2	-38.6	175.4	-67.2	-19.6	0	0	0	110.9	T401 D402 K403 L407 K408 Y489	T401-D405 PolarHBondContact O-N 3.49Å; D402-D405 WeakPolarHBondContact O-CA 3.48Å; D402-D405 VanDerWaalsContact O-CB 3.29Å; D402-D405 WeakPolarHBondContact O-CB 3.45Å; D402-D405 PolarHBondContact O-N 2.9Å; K403-D405 VanDerWaalsContact C-N 3.29Å; D405-L407 PolarHBondContact O-N 2.65Å; D405-K408 HydrophobicContact CB-CD 4.42Å; D405-K408 VanDerWaalsContact O-CB 3.32Å; D405-K408 WeakPolarHBondContact O-CB 3.36Å; D405-K408 WeakPolarHBondContact O-CG 3.48Å; D405-K408 PolarHBondContact O-N 2.99Å; D405-K408 WeakPolarHBondContact OD1-CE 3.16Å; D405-K408 IonicContact OD1-NZ 3.11Å; D405-K408 PolarHBondContact OD1-NZ 2.99Å; D405-Y489 HydrophobicContact CB-CE1 4.27Å; D405-Y489 WeakPolarHBondContact O-CE1 3.35Å; D405-Y489 WeakPolarHBondContact O-CE2 3.5Å; D405-Y489 PolarHBondContact O-OH 3.37Å
406	W	94.8	Very high	93.3	Very high	2 Å²	2	82.1 Å²	82.1	1%	0.008	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.7	178.2	-49.8	-14.1	0	0	0	114.8	L399 D402 K403 K404 Y465 E468 V469 Y472 Y489 I493	L399-W406 HydrophobicContact CD1-CH2 4.47Å; D402-W406 PolarHBondContact O-N 3.41Å; D402-W406 VanDerWaalsContact O-N 3.11Å; D402-W406 PolarHBondContact O-NE1 2.94Å; D402-W406 VanDerWaalsContact OD2-CE2 3.31Å; D402-W406 VanDerWaalsContact OD2-CZ2 3.3Å; D402-W406 WeakPolarHBondContact OD2-CZ2 3.42Å; D402-W406 PolarHBondContact OD2-NE1 2.74Å; K403-W406 HydrophobicContact CB-CE3 4.48Å; K403-W406 HydrophobicContact CG-CE3 4.09Å; K403-W406 HydrophobicContact CG-CH2 3.95Å; K403-W406 HydrophobicContact CG-CZ2 4.4Å; K403-W406 HydrophobicContact CG-CZ3 3.78Å; K403-W406 PolarHBondContact O-N 3.5Å; K404-W406 VanDerWaalsContact C-N 3.32Å; W406-Y465 HydrophobicContact CH2-CD2 4.49Å; W406-Y465 HydrophobicContact CH2-CE2 4.08Å; W406-Y465 HydrophobicContact CZ2-CD2 4.42Å; W406-Y465 AromaticContact CZ2-CE2 3.64Å; W406-Y465 HydrophobicContact CZ2-CE2 3.64Å; W406-E468 HydrophobicContact CH2-CB 4.22Å; W406-E468 HydrophobicContact CZ3-CB 4.23Å; W406-V469 HydrophobicContact CH2-CG2 4.09Å; W406-Y472 HydrophobicContact CB-CD2 4.2Å; W406-Y472 HydrophobicContact CB-CE2 3.57Å; W406-Y472 HydrophobicContact CE3-CD1 4.5Å; W406-Y472 AromaticContact CE3-CD2 3.88Å; W406-Y472 HydrophobicContact CE3-CD2 3.88Å; W406-Y472 HydrophobicContact CE3-CE2 4.39Å; W406-Y472 AromaticContact CE3-CG 3.92Å; W406-Y472 HydrophobicContact CE3-CG 3.92Å; W406-Y472 HydrophobicContact CZ3-CG 4.47Å; W406-Y472 PolarHBondContact O-OH 3.29Å; W406-Y489 HydrophobicContact CB-CD1 4.33Å; W406-Y489 HydrophobicContact CB-CG 4.3Å; W406-Y489 AromaticContact CD1-CD1 3.68Å; W406-Y489 HydrophobicContact CG-CD1 4.32Å; W406-I493 HydrophobicContact CD2-CD1 4Å; W406-I493 HydrophobicContact CE3-CD1 4.26Å; W406-I493 HydrophobicContact CH2-CD1 4.32Å; W406-I493 HydrophobicContact CZ2-CD1 4.06Å; W406-I493 HydrophobicContact CZ2-CG1 4.13Å; W406-I493 HydrophobicContact CZ3-CD1 4.41Å
407	L	92.4	Very high	93	Very high	110 Å²	110	82.2 Å²	82.2	58%	0.576	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	1.4	179.4	-58.8	177.1	0	0	0	112.8	K404 D405 Y472 P483	K404-L407 PolarHBondContact O-N 2.9Å; D405-L407 PolarHBondContact O-N 2.65Å; L407-Y472 HydrophobicContact CD2-CE2 4.2Å; L407-P483 HydrophobicContact CD2-CB 4.46Å; L407-P483 HydrophobicContact CD2-CG 3.64Å
408	K	90.6	Very high	92.7	Very high	99 Å²	99	76.8 Å²	76.8	43%	0.43	39%	0.394	S	S	.	.			trans	-73.1	151.9	177.5	-70.1	174.4	172.8	167.8	0	111.1	D405 T410	D405-K408 HydrophobicContact CB-CD 4.42Å; D405-K408 VanDerWaalsContact O-CB 3.32Å; D405-K408 WeakPolarHBondContact O-CB 3.36Å; D405-K408 WeakPolarHBondContact O-CG 3.48Å; D405-K408 PolarHBondContact O-N 2.99Å; D405-K408 WeakPolarHBondContact OD1-CE 3.16Å; D405-K408 IonicContact OD1-NZ 3.11Å; D405-K408 PolarHBondContact OD1-NZ 2.99Å; K408-T410 PolarHBondContact O-N 2.87Å
409	E	90.3	Very high	92.6	Very high	157 Å²	157	77.9 Å²	77.9	73%	0.734	40%	0.396	S	S	*	.	S	Bend	trans	-82.2	1.7	174	-62.2	178.8	177.4	0	0	112.8	C485	E409-C485 PolarHBondContact O-SG 3.32Å
410	T	93.6	Very high	92.5	Very high	88 Å²	88	78.4 Å²	78.4	54%	0.54	40%	0.398	S	S	.	.	S	Bend	trans	-104.8	142.5	179.2	55.6	0	0	0	0	110.5	K408 Y489	K408-T410 PolarHBondContact O-N 2.87Å; T410-Y489 VanDerWaalsContact O-CE2 3.3Å; T410-Y489 WeakPolarHBondContact O-CE2 3.22Å; T410-Y489 PolarHBondContact O-OH 2.91Å
411	E	92.5	Very high	92.4	Very high	109 Å²	109	75.4 Å²	75.4	51%	0.509	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-58.6	148.1	173.7	-62.2	-173.7	177.3	0	0	112.1	Y420 Q488	E411-Y420 HydrophobicContact CB-CE1 4.44Å; E411-Y420 VanDerWaalsContact CD-OH 3.3Å; E411-Y420 PolarHBondContact OE2-OH 2.88Å; E411-Q488 HydrophobicContact CG-CG 4.16Å
412	P	93.7	Very high	92.3	Very high	11 Å²	11	72.3 Å²	72.3	7%	0.071	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-63	157.2	172.2	27.3	-33.5	0	0	0	111.5	Y420 Q488 Y489 A492	P412-Y420 HydrophobicContact CG-CD1 3.82Å; P412-Y420 HydrophobicContact CG-CD2 4.25Å; P412-Y420 HydrophobicContact CG-CE1 4.42Å; P412-Y420 HydrophobicContact CG-CG 3.74Å; P412-Y420 WeakPolarHBondContact O-CD1 3.46Å; P412-Q488 VanDerWaalsContact CD-CB 3.49Å; P412-Q488 HydrophobicContact CG-CB 3.97Å; P412-Q488 WeakPolarHBondContact CG-O 3.48Å; P412-Y489 HydrophobicContact CB-CD1 4.1Å; P412-Y489 HydrophobicContact CB-CE1 3.83Å; P412-Y489 HydrophobicContact CG-CD1 4.41Å; P412-Y489 HydrophobicContact CG-CE1 4.49Å; P412-A492 HydrophobicContact CB-CB 4.02Å; P412-A492 HydrophobicContact CG-CB 4.03Å
413	E	91.7	Very high	92.2	Very high	139 Å²	139	74.9 Å²	74.9	65%	0.65	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-62.7	156.1	174.1	-63.7	-179.8	-179.8	0	0	110.9	Y420 Q421	E413-Y420 CarbonylContact O-C 3.53Å; E413-Y420 WeakPolarHBondContact O-CA 3.31Å; E413-Q421 PolarHBondContact O-N 3Å
414	A	91.3	Very high	92.3	Very high	54 Å²	54	71.7 Å²	71.7	45%	0.446	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-109.9	145.7	174.9	0	0	0	0	0	110.7	F419 Y420	A414-F419 CarbonylContact C-O 3.58Å; A414-F419 VanDerWaalsContact CA-O 3.24Å; A414-F419 WeakPolarHBondContact CA-O 3.33Å; A414-Y420 HydrophobicContact CB-CD1 4.5Å
415	D	88.9	Confident	92.3	Very high	40 Å²	40	64.8 Å²	64.8	21%	0.214	34%	0.337	C	S	.	.			trans	-70.8	-178.8	173.1	70.6	12.7	0	0	0	112	D417 G418 F419 K584	D415-D417 PolarHBondContact O-N 2.65Å; D415-D417 VanDerWaalsContact O-N 3.16Å; D415-D417 WeakPolarHBondContact OD1-CA 3.41Å; D415-D417 PolarHBondContact OD1-N 2.8Å; D415-G418 PolarHBondContact O-N 2.96Å; D415-G418 PolarHBondContact OD1-N 3.41Å; D415-F419 PolarHBondContact N-O 3.31Å; D415-F419 PolarHBondContact OD1-N 3.36Å; D415-K584 IonicContact OD2-NZ 2.82Å
416	Q	86.6	Confident	92.3	Very high	204 Å²	204	65.9 Å²	65.9	95%	0.953	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.2	-178.2	-63.4	178.8	18.1	0	0	113
417	D	88.1	Confident	92.3	Very high	133 Å²	133	68.9 Å²	68.9	71%	0.711	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	0.1	178.5	-64.3	-45.6	0	0	0	112	D415 F419	D415-D417 PolarHBondContact O-N 2.65Å; D415-D417 VanDerWaalsContact O-N 3.16Å; D415-D417 WeakPolarHBondContact OD1-CA 3.41Å; D415-D417 PolarHBondContact OD1-N 2.8Å; D417-F419 HydrophobicContact CB-CD2 3.66Å; D417-F419 HydrophobicContact CB-CE2 3.6Å
418	G	90.3	Very high	92.5	Very high	23 Å²	23	63.8 Å²	63.8	24%	0.237	34%	0.339	C	S	.	.	S	Bend	trans	84.9	15.6	175.5	0	0	0	0	0	115	D415 K582	D415-G418 PolarHBondContact O-N 2.96Å; D415-G418 PolarHBondContact OD1-N 3.41Å; G418-K582 WeakPolarHBondContact O-CD 3.35Å; G418-K582 PolarHBondContact O-NZ 3.48Å; G418-K582 VanDerWaalsContact O-NZ 3.12Å
419	F	94	Very high	92.6	Very high	36 Å²	36	61 Å²	61	16%	0.158	33%	0.327	C	S	.	.			trans	-88.4	139.2	174.7	-59	-72.5	0	0	0	111.2	A414 D415 D417 Q421 K582 V583 K584 K585	A414-F419 CarbonylContact C-O 3.58Å; A414-F419 VanDerWaalsContact CA-O 3.24Å; A414-F419 WeakPolarHBondContact CA-O 3.33Å; D415-F419 PolarHBondContact N-O 3.31Å; D415-F419 PolarHBondContact OD1-N 3.36Å; D417-F419 HydrophobicContact CB-CD2 3.66Å; D417-F419 HydrophobicContact CB-CE2 3.6Å; F419-Q421 PolarHBondContact O-N 3.37Å; F419-K582 WeakPolarHBondContact CD1-O 3.28Å; F419-V583 WeakPolarHBondContact CE1-O 3.5Å; F419-K584 HydrophobicContact CB-CG 4.17Å; F419-K584 HydrophobicContact CD1-CG 4.24Å; F419-K584 HydrophobicContact CD2-CG 4.11Å; F419-K584 HydrophobicContact CG-CG 3.92Å; F419-K585 HydrophobicContact CZ-CG 4.47Å
420	Y	95.1	Very high	92.8	Very high	23 Å²	23	58.7 Å²	58.7	9%	0.09	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-63.9	136.9	-179.5	-68.2	-44.9	0	0	0	111.8	E411 P412 E413 A414 Q488 I491 N495 K582	E411-Y420 HydrophobicContact CB-CE1 4.44Å; E411-Y420 VanDerWaalsContact CD-OH 3.3Å; E411-Y420 PolarHBondContact OE2-OH 2.88Å; P412-Y420 HydrophobicContact CG-CD1 3.82Å; P412-Y420 HydrophobicContact CG-CD2 4.25Å; P412-Y420 HydrophobicContact CG-CE1 4.42Å; P412-Y420 HydrophobicContact CG-CG 3.74Å; P412-Y420 WeakPolarHBondContact O-CD1 3.46Å; E413-Y420 CarbonylContact O-C 3.53Å; E413-Y420 WeakPolarHBondContact O-CA 3.31Å; A414-Y420 HydrophobicContact CB-CD1 4.5Å; Y420-Q488 HydrophobicContact CD2-CB 4.09Å; Y420-Q488 HydrophobicContact CD2-CG 4.45Å; Y420-Q488 HydrophobicContact CE2-CB 3.8Å; Y420-Q488 HydrophobicContact CE2-CG 3.67Å; Y420-I491 HydrophobicContact CD2-CB 4.29Å; Y420-I491 HydrophobicContact CD2-CD1 4.45Å; Y420-I491 HydrophobicContact CD2-CG2 4.02Å; Y420-N495 WeakPolarHBondContact O-CB 3.29Å; Y420-N495 PolarHBondContact O-ND2 3.45Å; Y420-K582 HydrophobicContact CD2-CB 3.36Å; Y420-K582 HydrophobicContact CD2-CG 3.76Å; Y420-K582 HydrophobicContact CE1-CG 4.42Å; Y420-K582 HydrophobicContact CE2-CB 3.6Å; Y420-K582 HydrophobicContact CE2-CD 4.43Å; Y420-K582 HydrophobicContact CE2-CG 3.44Å; Y420-K582 VanDerWaalsContact CE2-CG 3.44Å; Y420-K582 HydrophobicContact CG-CB 3.95Å; Y420-K582 HydrophobicContact CG-CG 4.35Å; Y420-K582 PolarHBondContact N-O 3.25Å
421	Q	93.6	Very high	92.8	Very high	33 Å²	33	55.5 Å²	55.5	15%	0.154	30%	0.295	C	S	.	.			trans	-151.4	148.8	177.3	-156.2	-170	-72.2	0	0	110.6	E413 F419 N496 T499	E413-Q421 PolarHBondContact O-N 3Å; F419-Q421 PolarHBondContact O-N 3.37Å; Q421-N496 WeakPolarHBondContact CG-OD1 3.42Å; Q421-T499 PolarHBondContact OE1-OG1 3.31Å
422	T	94.6	Very high	92.9	Very high	10 Å²	10	50.5 Å²	50.5	6%	0.061	27%	0.272	C	S	.	.			trans	-90.1	169.7	167.8	69.6	0	0	0	0	111.3	D402 L424 P425 A492 N496	D402-T422 WeakPolarHBondContact OD1-CB 3.44Å; D402-T422 WeakPolarHBondContact OD1-CG2 3.5Å; D402-T422 PolarHBondContact OD1-OG1 3.1Å; T422-L424 VanDerWaalsContact C-N 3.28Å; T422-L424 PolarHBondContact O-N 3.34Å; T422-L424 PolarHBondContact OG1-N 3.16Å; T422-P425 WeakPolarHBondContact O-CD 3.43Å; T422-A492 HydrophobicContact CG2-CB 4.04Å; T422-N496 PolarHBondContact N-OD1 3.42Å; T422-N496 VanDerWaalsContact N-OD1 3.1Å; T422-N496 VanDerWaalsContact OG1-CG 3.23Å; T422-N496 PolarHBondContact OG1-ND2 2.96Å; T422-N496 PolarHBondContact OG1-OD1 3.36Å
423	T	93.7	Very high	92.8	Very high	57 Å²	57	52.4 Å²	52.4	35%	0.35	28%	0.28	S	S	.	.	S	Bend	trans	-78.1	-12.1	174.2	60.7	0	0	0	0	113.2	A426 I427	T423-A426 PolarHBondContact O-N 2.99Å; T423-A426 VanDerWaalsContact O-N 3.14Å; T423-I427 WeakPolarHBondContact O-CG1 3.32Å; T423-I427 PolarHBondContact O-N 3.37Å
424	L	95.7	Very high	92.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-55.9	-47.6	-174	176.6	68.4	0	0	0	114	A398 L399 D402 T422 A426 I427 V428 F461 Y465 F500	A398-L424 HydrophobicContact CB-CD1 3.8Å; L399-L424 HydrophobicContact CD1-CD2 4.45Å; D402-L424 HydrophobicContact CB-CB 4.02Å; D402-L424 HydrophobicContact CB-CD1 4.25Å; D402-L424 HydrophobicContact CB-CD2 3.84Å; D402-L424 HydrophobicContact CB-CG 4.25Å; D402-L424 WeakPolarHBondContact OD1-CB 3.3Å; D402-L424 VanDerWaalsContact OD2-CD2 3.27Å; D402-L424 WeakPolarHBondContact OD2-CD2 3.48Å; T422-L424 VanDerWaalsContact C-N 3.28Å; T422-L424 PolarHBondContact O-N 3.34Å; T422-L424 PolarHBondContact OG1-N 3.16Å; L424-A426 VanDerWaalsContact C-N 3.3Å; L424-A426 PolarHBondContact O-N 3.43Å; L424-I427 PolarHBondContact O-N 3.36Å; L424-V428 HydrophobicContact CD1-CG2 3.92Å; L424-V428 HydrophobicContact CG-CG2 4.38Å; L424-V428 VanDerWaalsContact O-CG2 3.32Å; L424-V428 WeakPolarHBondContact O-CG2 3.44Å; L424-V428 PolarHBondContact O-N 3.23Å; L424-F461 HydrophobicContact CD1-CE2 4.42Å; L424-F461 HydrophobicContact CD1-CZ 4.01Å; L424-F461 HydrophobicContact CD2-CZ 3.95Å; L424-F461 HydrophobicContact CG-CZ 4.16Å; L424-Y465 HydrophobicContact CD2-CD2 3.98Å; L424-Y465 HydrophobicContact CD2-CE2 3.46Å; L424-Y465 VanDerWaalsContact CD2-CE2 3.46Å; L424-F500 HydrophobicContact CD2-CZ 4.09Å; L424-F500 HydrophobicContact CG-CZ 4Å
425	P	95.1	Very high	92.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-40.7	176.9	-25.7	35.1	0	0	0	113.7	T422 F429 N496 T499 F500	T422-P425 WeakPolarHBondContact O-CD 3.43Å; P425-F429 VanDerWaalsContact O-CB 3.3Å; P425-F429 WeakPolarHBondContact O-CB 3.26Å; P425-F429 PolarHBondContact O-N 2.81Å; P425-N496 HydrophobicContact CG-CB 3.7Å; P425-N496 WeakPolarHBondContact CG-OD1 3.49Å; P425-T499 HydrophobicContact CB-CG2 3.68Å; P425-T499 HydrophobicContact CG-CG2 4.39Å; P425-F500 VanDerWaalsContact CA-CE1 3.49Å; P425-F500 HydrophobicContact CB-CD1 3.97Å; P425-F500 HydrophobicContact CB-CE1 3.94Å; P425-F500 HydrophobicContact CB-CG 4.41Å; P425-F500 HydrophobicContact CB-CZ 4.31Å; P425-F500 HydrophobicContact CG-CD1 4.35Å; P425-F500 HydrophobicContact CG-CD2 4.37Å; P425-F500 HydrophobicContact CG-CE1 4.12Å; P425-F500 HydrophobicContact CG-CE2 4.09Å; P425-F500 HydrophobicContact CG-CZ 3.96Å
426	A	93.1	Very high	92.9	Very high	54 Å²	54	48.6 Å²	48.6	45%	0.446	25%	0.253	S	S	.	.	H	α-helix	trans	-67.1	-44.1	179.5	0	0	0	0	0	111.5	T423 L424 F429 Q430	T423-A426 PolarHBondContact O-N 2.99Å; T423-A426 VanDerWaalsContact O-N 3.14Å; L424-A426 VanDerWaalsContact C-N 3.3Å; L424-A426 PolarHBondContact O-N 3.43Å; A426-F429 PolarHBondContact O-N 2.72Å; A426-Q430 WeakPolarHBondContact O-CB 3.43Å; A426-Q430 PolarHBondContact O-N 2.87Å
427	I	94.1	Very high	93.1	Very high	66 Å²	66	43.9 Å²	43.9	34%	0.338	23%	0.231	S	C	.	.	H	α-helix	trans	-60.9	-47.6	177.3	-66.3	167.8	0	0	0	110.7	A398 T423 L424 M431	A398-I427 HydrophobicContact CB-CG2 4.29Å; T423-I427 WeakPolarHBondContact O-CG1 3.32Å; T423-I427 PolarHBondContact O-N 3.37Å; L424-I427 PolarHBondContact O-N 3.36Å; I427-M431 VanDerWaalsContact O-CB 3.31Å; I427-M431 WeakPolarHBondContact O-CB 3.39Å; I427-M431 PolarHBondContact O-N 3.02Å
428	V	95.5	Very high	93.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-44.2	179.5	171.8	0	0	0	0	111.1	L395 L424 F432 M458 F461 F500	L395-V428 HydrophobicContact CD2-CB 4.42Å; L395-V428 HydrophobicContact CD2-CG1 3.86Å; L395-V428 HydrophobicContact CD2-CG2 3.88Å; L424-V428 HydrophobicContact CD1-CG2 3.92Å; L424-V428 HydrophobicContact CG-CG2 4.38Å; L424-V428 VanDerWaalsContact O-CG2 3.32Å; L424-V428 WeakPolarHBondContact O-CG2 3.44Å; L424-V428 PolarHBondContact O-N 3.23Å; V428-F432 HydrophobicContact CG1-CD2 3.82Å; V428-F432 HydrophobicContact CG1-CE2 3.44Å; V428-F432 VanDerWaalsContact CG1-CE2 3.44Å; V428-F432 HydrophobicContact CG1-CZ 4.26Å; V428-F432 WeakPolarHBondContact O-CD2 3.49Å; V428-F432 PolarHBondContact O-N 3.05Å; V428-F432 VanDerWaalsContact O-N 3.08Å; V428-M458 HydrophobicContact CG1-CE 4Å; V428-M458 HydrophobicContact CG1-SD 4Å; V428-F461 HydrophobicContact CG2-CE1 4.32Å; V428-F461 HydrophobicContact CG2-CE2 4.47Å; V428-F461 HydrophobicContact CG2-CZ 3.96Å; V428-F500 HydrophobicContact CB-CE1 4.1Å; V428-F500 HydrophobicContact CG1-CE1 4.28Å; V428-F500 HydrophobicContact CG2-CE1 4.22Å
429	F	94.2	Very high	93.1	Very high	42 Å²	42	38.7 Å²	38.7	18%	0.184	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-50.2	177.9	175	-98.2	0	0	0	112.1	P425 A426 M431 F432 E433 S503 L507	P425-F429 VanDerWaalsContact O-CB 3.3Å; P425-F429 WeakPolarHBondContact O-CB 3.26Å; P425-F429 PolarHBondContact O-N 2.81Å; A426-F429 PolarHBondContact O-N 2.72Å; F429-M431 VanDerWaalsContact C-N 3.27Å; F429-M431 PolarHBondContact O-N 3.38Å; F429-F432 PolarHBondContact O-N 2.97Å; F429-F432 VanDerWaalsContact O-N 3.17Å; F429-E433 VanDerWaalsContact CE1-OE2 3.25Å; F429-E433 WeakPolarHBondContact CE1-OE2 3.46Å; F429-E433 WeakPolarHBondContact O-CB 3.49Å; F429-E433 PolarHBondContact O-N 3.1Å; F429-S503 VanDerWaalsContact CD2-CB 3.48Å; F429-S503 WeakPolarHBondContact CE2-O 3.18Å; F429-L507 HydrophobicContact CD2-CD1 4.07Å; F429-L507 HydrophobicContact CD2-CD2 3.97Å; F429-L507 HydrophobicContact CD2-CG 3.78Å; F429-L507 HydrophobicContact CE2-CD1 4.34Å; F429-L507 HydrophobicContact CE2-CD2 3.52Å; F429-L507 HydrophobicContact CE2-CG 3.54Å; F429-L507 HydrophobicContact CZ-CD2 4.14Å
430	Q	93.9	Very high	92.8	Very high	108 Å²	108	39.1 Å²	39.1	51%	0.505	21%	0.21	S	C	.	.	H	α-helix	trans	-59.4	-41.2	-179.6	-174	179.7	13.4	0	0	111.3	A426 E433 Q434	A426-Q430 WeakPolarHBondContact O-CB 3.43Å; A426-Q430 PolarHBondContact O-N 2.87Å; Q430-E433 PolarHBondContact O-N 3.02Å; Q430-Q434 WeakPolarHBondContact O-CB 3.37Å; Q430-Q434 VanDerWaalsContact O-CG 3.3Å; Q430-Q434 WeakPolarHBondContact O-CG 3.35Å; Q430-Q434 PolarHBondContact O-N 3.48Å
431	M	93.3	Very high	92.4	Very high	20 Å²	20	43 Å²	43	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-47.5	176	-179.3	-158.8	61.7	0	0	111.7	I391 W394 L395 I427 F429 N435	I391-M431 HydrophobicContact CD1-CE 3.77Å; I391-M431 HydrophobicContact CD1-SD 4.38Å; I391-M431 HydrophobicContact CG1-CE 3.48Å; I391-M431 VanDerWaalsContact CG1-CE 3.48Å; I391-M431 HydrophobicContact CG1-SD 3.85Å; W394-M431 HydrophobicContact CB-SD 3.57Å; W394-M431 VanDerWaalsContact CB-SD 3.57Å; W394-M431 HydrophobicContact CG-SD 4.3Å; L395-M431 HydrophobicContact CD1-CE 4.47Å; L395-M431 HydrophobicContact CD2-CE 3.48Å; L395-M431 VanDerWaalsContact CD2-CE 3.48Å; L395-M431 HydrophobicContact CG-CE 3.77Å; I427-M431 VanDerWaalsContact O-CB 3.31Å; I427-M431 WeakPolarHBondContact O-CB 3.39Å; I427-M431 PolarHBondContact O-N 3.02Å; F429-M431 VanDerWaalsContact C-N 3.27Å; F429-M431 PolarHBondContact O-N 3.38Å; M431-N435 PolarHBondContact O-N 2.63Å; M431-N435 PolarHBondContact O-ND2 3.49Å
432	F	94.1	Very high	91.9	Very high	5 Å²	5	41.5 Å²	41.5	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-43.6	176	-73.3	-43.9	0	0	0	112.1	I391 L395 V428 F429 N435 L436 C454 M458 L507	I391-F432 HydrophobicContact CD1-CD1 3.37Å; I391-F432 HydrophobicContact CD1-CE1 3.29Å; I391-F432 HydrophobicContact CG1-CD1 4.34Å; I391-F432 HydrophobicContact CG1-CE1 3.88Å; L395-F432 HydrophobicContact CD1-CE1 4.45Å; L395-F432 HydrophobicContact CD1-CZ 4.1Å; L395-F432 HydrophobicContact CD2-CZ 4.26Å; V428-F432 HydrophobicContact CG1-CD2 3.82Å; V428-F432 HydrophobicContact CG1-CE2 3.44Å; V428-F432 VanDerWaalsContact CG1-CE2 3.44Å; V428-F432 HydrophobicContact CG1-CZ 4.26Å; V428-F432 WeakPolarHBondContact O-CD2 3.49Å; V428-F432 PolarHBondContact O-N 3.05Å; V428-F432 VanDerWaalsContact O-N 3.08Å; F429-F432 PolarHBondContact O-N 2.97Å; F429-F432 VanDerWaalsContact O-N 3.17Å; F432-N435 PolarHBondContact O-N 3.2Å; F432-L436 WeakPolarHBondContact O-CB 3.19Å; F432-L436 WeakPolarHBondContact O-CG 3.46Å; F432-L436 PolarHBondContact O-N 3.08Å; F432-C454 HydrophobicContact CD1-CB 3.67Å; F432-C454 VanDerWaalsContact CD1-SG 3.55Å; F432-C454 HydrophobicContact CE1-CB 3.86Å; F432-C454 HydrophobicContact CG-CB 4.28Å; F432-M458 HydrophobicContact CE2-CB 4.1Å; F432-M458 HydrophobicContact CE2-CE 4.43Å; F432-M458 HydrophobicContact CE2-CG 4.39Å; F432-M458 HydrophobicContact CE2-SD 3.85Å; F432-M458 HydrophobicContact CZ-CB 4.12Å; F432-M458 HydrophobicContact CZ-SD 4.44Å; F432-L507 HydrophobicContact CB-CD1 3.7Å; F432-L507 HydrophobicContact CD2-CD1 4.18Å; F432-L507 HydrophobicContact CG-CD1 4.32Å
433	E	93.1	Very high	91.3	Very high	51 Å²	51	43.9 Å²	43.9	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-45.8	-178.1	-174.5	172.9	-151	0	0	112.3	F429 Q430 N435 L436 Q437 L507 K510 Y511	F429-E433 VanDerWaalsContact CE1-OE2 3.25Å; F429-E433 WeakPolarHBondContact CE1-OE2 3.46Å; F429-E433 WeakPolarHBondContact O-CB 3.49Å; F429-E433 PolarHBondContact O-N 3.1Å; Q430-E433 PolarHBondContact O-N 3.02Å; E433-N435 PolarHBondContact O-N 3.21Å; E433-L436 PolarHBondContact O-N 3.06Å; E433-Q437 WeakPolarHBondContact O-CB 3.43Å; E433-Q437 PolarHBondContact O-N 3.25Å; E433-L507 HydrophobicContact CB-CD2 4.07Å; E433-K510 IonicContact OE1-NZ 3.01Å; E433-K510 PolarHBondContact OE1-NZ 2.86Å; E433-Y511 HydrophobicContact CG-CE2 4.47Å
434	Q	91.7	Very high	90.6	Very high	105 Å²	105	43.2 Å²	43.2	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-44.3	178.4	-74.9	174.7	-8.1	0	0	112	Q430 Q437 V438	Q430-Q434 WeakPolarHBondContact O-CB 3.37Å; Q430-Q434 VanDerWaalsContact O-CG 3.3Å; Q430-Q434 WeakPolarHBondContact O-CG 3.35Å; Q430-Q434 PolarHBondContact O-N 3.48Å; Q434-Q437 WeakPolarHBondContact O-CB 3.31Å; Q434-Q437 PolarHBondContact O-N 3.06Å; Q434-V438 WeakPolarHBondContact O-CG2 3.34Å; Q434-V438 PolarHBondContact O-N 3.27Å; Q434-V438 VanDerWaalsContact O-N 3.16Å
435	N	89.6	Confident	89.9	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.251	27%	0.271	S	S	.	.	H	α-helix	trans	-70.9	-35.9	179.9	-75	-84.3	0	0	0	112.4	F387 M431 F432 E433 Q437 V438 A439	F387-N435 HydrophobicContact CD2-CB 4.25Å; F387-N435 HydrophobicContact CE2-CB 3.43Å; F387-N435 VanDerWaalsContact CE2-CB 3.43Å; F387-N435 VanDerWaalsContact CE2-CG 3.43Å; F387-N435 WeakPolarHBondContact CE2-OD1 3.4Å; F387-N435 HydrophobicContact CZ-CB 4.1Å; M431-N435 PolarHBondContact O-N 2.63Å; M431-N435 PolarHBondContact O-ND2 3.49Å; F432-N435 PolarHBondContact O-N 3.2Å; E433-N435 PolarHBondContact O-N 3.21Å; N435-Q437 VanDerWaalsContact C-N 3.34Å; N435-V438 PolarHBondContact O-N 3.03Å; N435-A439 PolarHBondContact O-N 2.9Å
436	L	91.6	Very high	89.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-34.6	173.8	-77	166.5	0	0	0	112.3	F432 E433 V438 A439 A440 V450 L451 L507 Y511	F432-L436 WeakPolarHBondContact O-CB 3.19Å; F432-L436 WeakPolarHBondContact O-CG 3.46Å; F432-L436 PolarHBondContact O-N 3.08Å; E433-L436 PolarHBondContact O-N 3.06Å; L436-V438 VanDerWaalsContact C-N 3.33Å; L436-A439 PolarHBondContact O-N 3.26Å; L436-A440 WeakPolarHBondContact O-CB 3.2Å; L436-A440 PolarHBondContact O-N 3.44Å; L436-V450 HydrophobicContact CD2-CB 4.2Å; L436-V450 HydrophobicContact CD2-CG1 3.85Å; L436-L451 HydrophobicContact CD1-CD1 3.89Å; L436-L451 HydrophobicContact CD2-CB 3.84Å; L436-L451 HydrophobicContact CD2-CD1 4.36Å; L436-L507 HydrophobicContact CD1-CD2 4.1Å; L436-Y511 HydrophobicContact CB-CD1 3.85Å; L436-Y511 HydrophobicContact CB-CD2 4.15Å; L436-Y511 HydrophobicContact CB-CE1 3.7Å; L436-Y511 HydrophobicContact CB-CE2 3.99Å; L436-Y511 HydrophobicContact CB-CG 4.11Å; L436-Y511 HydrophobicContact CD1-CD2 3.94Å; L436-Y511 HydrophobicContact CD1-CE2 4.27Å; L436-Y511 HydrophobicContact CD1-CG 4.26Å
437	Q	90.9	Very high	89.3	Confident	106 Å²	106	48.9 Å²	48.9	50%	0.495	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-41.5	173.1	-174.8	176.4	2.6	0	0	111.5	E433 Q434 N435 A440 Q441	E433-Q437 WeakPolarHBondContact O-CB 3.43Å; E433-Q437 PolarHBondContact O-N 3.25Å; Q434-Q437 WeakPolarHBondContact O-CB 3.31Å; Q434-Q437 PolarHBondContact O-N 3.06Å; N435-Q437 VanDerWaalsContact C-N 3.34Å; Q437-A440 PolarHBondContact O-N 2.89Å; Q437-Q441 WeakPolarHBondContact O-CG 3.26Å; Q437-Q441 PolarHBondContact O-N 2.88Å
438	V	89.1	Confident	89	Confident	46 Å²	46	48.4 Å²	48.4	28%	0.279	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-45.7	174.5	173.9	0	0	0	0	111.2	V337 Q434 N435 L436 A440 Q441	V337-V438 HydrophobicContact CB-CG1 4.23Å; V337-V438 HydrophobicContact CG1-CG1 3.51Å; V337-V438 HydrophobicContact CG2-CG1 3.64Å; Q434-V438 WeakPolarHBondContact O-CG2 3.34Å; Q434-V438 PolarHBondContact O-N 3.27Å; Q434-V438 VanDerWaalsContact O-N 3.16Å; N435-V438 PolarHBondContact O-N 3.03Å; L436-V438 VanDerWaalsContact C-N 3.33Å; V438-A440 VanDerWaalsContact C-N 3.3Å; V438-A440 PolarHBondContact O-N 2.86Å; V438-Q441 WeakPolarHBondContact O-CB 3.24Å; V438-Q441 PolarHBondContact O-N 3.42Å; V438-Q441 VanDerWaalsContact O-N 3.1Å
439	A	88.8	Confident	88.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-38.9	177.8	0	0	0	0	0	112.5	N435 L436 Q441 I442 D443 F446 K447 V450	N435-A439 PolarHBondContact O-N 2.9Å; L436-A439 PolarHBondContact O-N 3.26Å; A439-Q441 PolarHBondContact O-N 2.93Å; A439-I442 PolarHBondContact O-N 3.44Å; A439-I442 VanDerWaalsContact O-N 3.12Å; A439-D443 PolarHBondContact O-N 3.01Å; A439-F446 HydrophobicContact CB-CD1 4.04Å; A439-F446 HydrophobicContact CB-CE1 3.97Å; A439-K447 HydrophobicContact CB-CB 4.49Å; A439-V450 HydrophobicContact CB-CB 3.97Å; A439-V450 HydrophobicContact CB-CG1 4.16Å; A439-V450 HydrophobicContact CB-CG2 3.77Å
440	A	88.4	Confident	88.6	Confident	46 Å²	46	51.2 Å²	51.2	38%	0.38	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-19.7	177	0	0	0	0	0	114.1	L436 Q437 V438 K447 Y511	L436-A440 WeakPolarHBondContact O-CB 3.2Å; L436-A440 PolarHBondContact O-N 3.44Å; Q437-A440 PolarHBondContact O-N 2.89Å; V438-A440 VanDerWaalsContact C-N 3.3Å; V438-A440 PolarHBondContact O-N 2.86Å; A440-K447 HydrophobicContact CB-CB 4.43Å; A440-K447 HydrophobicContact CB-CD 3.7Å; A440-K447 HydrophobicContact CB-CG 3.95Å; A440-Y511 HydrophobicContact CB-CE1 4.38Å
441	Q	85.4	Confident	88.5	Confident	104 Å²	104	46.1 Å²	46.1	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-80.8	-17.7	174.8	-70	175.9	-1.4	0	0	113.2	N345 Q437 V438 A439	N345-Q441 PolarHBondContact ND2-O 2.82Å; Q437-Q441 WeakPolarHBondContact O-CG 3.26Å; Q437-Q441 PolarHBondContact O-N 2.88Å; V438-Q441 WeakPolarHBondContact O-CB 3.24Å; V438-Q441 PolarHBondContact O-N 3.42Å; V438-Q441 VanDerWaalsContact O-N 3.1Å; A439-Q441 PolarHBondContact O-N 2.93Å
442	I	83.8	Confident	88.5	Confident	2 Å²	2	50 Å²	50	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-90.1	-61.7	-178.1	-60.7	166.2	0	0	0	109.7	V337 L340 L344 N345 L380 A439 F446	V337-I442 HydrophobicContact CB-CD1 4.16Å; V337-I442 HydrophobicContact CG1-CD1 4.1Å; V337-I442 HydrophobicContact CG1-CG1 4.2Å; V337-I442 HydrophobicContact CG2-CD1 3.9Å; L340-I442 HydrophobicContact CB-CG2 3.75Å; L340-I442 HydrophobicContact CD1-CG2 4.37Å; L344-I442 HydrophobicContact CD1-CG2 4Å; N345-I442 PolarHBondContact ND2-O 3.35Å; L380-I442 HydrophobicContact CD2-CG2 4.3Å; A439-I442 PolarHBondContact O-N 3.44Å; A439-I442 VanDerWaalsContact O-N 3.12Å; I442-F446 HydrophobicContact CB-CD1 4.36Å; I442-F446 HydrophobicContact CD1-CD1 4.24Å; I442-F446 HydrophobicContact CD1-CE1 3.99Å
443	D	81.5	Confident	88.4	Confident	60 Å²	60	51.1 Å²	51.1	32%	0.321	27%	0.267	S	S	.	.			trans	-156.9	146.6	-172.7	176.1	78.6	0	0	0	111.2	L344 A439 D445 F446 K447	L344-D443 HydrophobicContact CD1-CB 4.38Å; A439-D443 PolarHBondContact O-N 3.01Å; D443-D445 WeakPolarHBondContact OD2-CA 3.37Å; D443-D445 WeakPolarHBondContact OD2-CB 3.4Å; D443-D445 PolarHBondContact OD2-N 3.46Å; D443-F446 HydrophobicContact CB-CB 3.8Å; D443-F446 PolarHBondContact OD2-N 3.25Å; D443-K447 WeakPolarHBondContact O-CB 3.47Å; D443-K447 PolarHBondContact O-N 2.86Å; D443-K447 VanDerWaalsContact O-N 3.15Å
444	G	79.6	Confident	88.4	Confident	43 Å²	43	48.8 Å²	48.8	44%	0.443	26%	0.257	S	S	.	.	H	α-helix	trans	-68.5	-40.8	-176	0	0	0	0	0	113.9	K447	G444-K447 WeakPolarHBondContact O-CE 3.48Å
445	D	82.2	Confident	88.5	Confident	130 Å²	130	44 Å²	44	70%	0.695	24%	0.235	S	C	*	.	H	α-helix	trans	-77.1	-38.3	-179.7	-65.9	-21.2	0	0	0	110.2	D443 K447 E448 Q449	D443-D445 WeakPolarHBondContact OD2-CA 3.37Å; D443-D445 WeakPolarHBondContact OD2-CB 3.4Å; D443-D445 PolarHBondContact OD2-N 3.46Å; D445-K447 VanDerWaalsContact C-N 3.32Å; D445-K447 PolarHBondContact O-N 2.68Å; D445-E448 WeakPolarHBondContact O-CB 3.47Å; D445-E448 PolarHBondContact O-N 2.94Å; D445-E448 VanDerWaalsContact O-N 3.08Å; D445-Q449 PolarHBondContact O-N 2.69Å; D445-Q449 VanDerWaalsContact O-N 3.12Å
446	F	85.1	Confident	88.7	Confident	4 Å²	4	48 Å²	48	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-59.1	-41.7	175	-178	-114.8	0	0	0	112.7	L380 Y383 V384 A439 I442 D443 E448 Q449 V450	L380-F446 HydrophobicContact CB-CD2 4.34Å; L380-F446 HydrophobicContact CB-CE2 4.08Å; L380-F446 HydrophobicContact CD1-CD2 4.09Å; L380-F446 HydrophobicContact CD1-CG 4.48Å; L380-F446 HydrophobicContact CD2-CD1 4.01Å; L380-F446 HydrophobicContact CD2-CD2 3.67Å; L380-F446 HydrophobicContact CD2-CE1 4Å; L380-F446 HydrophobicContact CD2-CE2 3.66Å; L380-F446 HydrophobicContact CD2-CG 3.84Å; L380-F446 HydrophobicContact CD2-CZ 3.83Å; L380-F446 HydrophobicContact CG-CD2 4.25Å; L380-F446 HydrophobicContact CG-CE2 4.32Å; Y383-F446 HydrophobicContact CD1-CE1 4.14Å; Y383-F446 AromaticContact CD1-CZ 3.53Å; Y383-F446 HydrophobicContact CD1-CZ 3.53Å; Y383-F446 HydrophobicContact CE1-CE1 4.02Å; Y383-F446 AromaticContact CE1-CZ 3.77Å; Y383-F446 HydrophobicContact CE1-CZ 3.77Å; Y383-F446 HydrophobicContact CG-CZ 4.49Å; V384-F446 HydrophobicContact CG2-CE2 3.55Å; V384-F446 HydrophobicContact CG2-CZ 3.92Å; A439-F446 HydrophobicContact CB-CD1 4.04Å; A439-F446 HydrophobicContact CB-CE1 3.97Å; I442-F446 HydrophobicContact CB-CD1 4.36Å; I442-F446 HydrophobicContact CD1-CD1 4.24Å; I442-F446 HydrophobicContact CD1-CE1 3.99Å; D443-F446 HydrophobicContact CB-CB 3.8Å; D443-F446 PolarHBondContact OD2-N 3.25Å; F446-E448 VanDerWaalsContact C-N 3.25Å; F446-E448 PolarHBondContact O-N 3.43Å; F446-Q449 WeakPolarHBondContact O-CB 3.33Å; F446-Q449 PolarHBondContact O-N 3.45Å; F446-Q449 VanDerWaalsContact O-N 3.11Å; F446-V450 HydrophobicContact CD1-CG2 4.24Å; F446-V450 HydrophobicContact CD2-CG2 4.5Å; F446-V450 HydrophobicContact CE1-CG2 3.7Å; F446-V450 HydrophobicContact CE2-CG2 3.99Å; F446-V450 HydrophobicContact CZ-CG2 3.55Å; F446-V450 WeakPolarHBondContact O-CG2 3.38Å; F446-V450 PolarHBondContact O-N 3.47Å
447	K	89.6	Confident	88.8	Confident	40 Å²	40	49.1 Å²	49.1	17%	0.174	26%	0.255	C	S	.	.	H	α-helix	trans	-54.9	-40.7	173.5	172.8	-159.2	69.9	172.8	0	112.2	A439 A440 D443 G444 D445 V450 L451 Y511	A439-K447 HydrophobicContact CB-CB 4.49Å; A440-K447 HydrophobicContact CB-CB 4.43Å; A440-K447 HydrophobicContact CB-CD 3.7Å; A440-K447 HydrophobicContact CB-CG 3.95Å; D443-K447 WeakPolarHBondContact O-CB 3.47Å; D443-K447 PolarHBondContact O-N 2.86Å; D443-K447 VanDerWaalsContact O-N 3.15Å; G444-K447 WeakPolarHBondContact O-CE 3.48Å; D445-K447 VanDerWaalsContact C-N 3.32Å; D445-K447 PolarHBondContact O-N 2.68Å; K447-V450 PolarHBondContact O-N 2.86Å; K447-L451 PolarHBondContact O-N 2.91Å; K447-Y511 HydrophobicContact CD-CD1 3.92Å; K447-Y511 WeakPolarHBondContact CE-O 3.42Å; K447-Y511 HydrophobicContact CG-CD1 3.98Å; K447-Y511 PolarHBondContact NZ-O 2.84Å
448	E	88.6	Confident	89	Confident	56 Å²	56	44.3 Å²	44.3	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-37.4	177.7	-162	-173.4	132.2	0	0	111.7	D445 F446 L451 K452	D445-E448 WeakPolarHBondContact O-CB 3.47Å; D445-E448 PolarHBondContact O-N 2.94Å; D445-E448 VanDerWaalsContact O-N 3.08Å; F446-E448 VanDerWaalsContact C-N 3.25Å; F446-E448 PolarHBondContact O-N 3.43Å; E448-L451 WeakPolarHBondContact O-CB 3.43Å; E448-L451 PolarHBondContact O-N 3.11Å; E448-K452 WeakPolarHBondContact O-CG 3.25Å; E448-K452 PolarHBondContact O-N 3Å; E448-K452 WeakPolarHBondContact OE1-CE 3.42Å; E448-K452 IonicContact OE1-NZ 3.34Å; E448-K452 PolarHBondContact OE1-NZ 3.42Å
449	Q	89.1	Confident	89.3	Confident	103 Å²	103	43.9 Å²	43.9	48%	0.481	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-43.8	173.3	-169.8	-174.8	18.5	0	0	111.9	D445 F446 L451 K452 L453	D445-Q449 PolarHBondContact O-N 2.69Å; D445-Q449 VanDerWaalsContact O-N 3.12Å; F446-Q449 WeakPolarHBondContact O-CB 3.33Å; F446-Q449 PolarHBondContact O-N 3.45Å; F446-Q449 VanDerWaalsContact O-N 3.11Å; Q449-L451 VanDerWaalsContact C-N 3.34Å; Q449-K452 PolarHBondContact O-N 2.89Å; Q449-L453 PolarHBondContact O-N 2.89Å; Q449-L453 VanDerWaalsContact O-N 3.1Å
450	V	91.6	Very high	89.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-39.4	175.8	175.8	0	0	0	0	111	F387 L436 A439 F446 K447 L453 C454	F387-V450 HydrophobicContact CE1-CG1 3.89Å; F387-V450 HydrophobicContact CZ-CG1 4.02Å; L436-V450 HydrophobicContact CD2-CB 4.2Å; L436-V450 HydrophobicContact CD2-CG1 3.85Å; A439-V450 HydrophobicContact CB-CB 3.97Å; A439-V450 HydrophobicContact CB-CG1 4.16Å; A439-V450 HydrophobicContact CB-CG2 3.77Å; F446-V450 HydrophobicContact CD1-CG2 4.24Å; F446-V450 HydrophobicContact CD2-CG2 4.5Å; F446-V450 HydrophobicContact CE1-CG2 3.7Å; F446-V450 HydrophobicContact CE2-CG2 3.99Å; F446-V450 HydrophobicContact CZ-CG2 3.55Å; F446-V450 WeakPolarHBondContact O-CG2 3.38Å; F446-V450 PolarHBondContact O-N 3.47Å; K447-V450 PolarHBondContact O-N 2.86Å; V450-L453 WeakPolarHBondContact O-CB 3.47Å; V450-L453 PolarHBondContact O-N 3.02Å; V450-C454 PolarHBondContact O-N 3.16Å; V450-C454 PolarHBondContact O-SG 2.81Å
451	L	92.5	Very high	89.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-47.4	175	179.6	63.7	0	0	0	111.9	L436 K447 E448 Q449 L453 C454 L455 L507 F518	L436-L451 HydrophobicContact CD1-CD1 3.89Å; L436-L451 HydrophobicContact CD2-CB 3.84Å; L436-L451 HydrophobicContact CD2-CD1 4.36Å; K447-L451 PolarHBondContact O-N 2.91Å; E448-L451 WeakPolarHBondContact O-CB 3.43Å; E448-L451 PolarHBondContact O-N 3.11Å; Q449-L451 VanDerWaalsContact C-N 3.34Å; L451-L453 PolarHBondContact O-N 3.31Å; L451-C454 WeakPolarHBondContact O-CB 3.39Å; L451-C454 PolarHBondContact O-N 3.29Å; L451-C454 VanDerWaalsContact O-N 3.14Å; L451-L455 HydrophobicContact CD1-CG 4.47Å; L451-L455 HydrophobicContact CG-CD1 4.47Å; L451-L455 WeakPolarHBondContact O-CG 3.5Å; L451-L455 PolarHBondContact O-N 3.42Å; L451-L507 HydrophobicContact CD1-CB 4.45Å; L451-F518 HydrophobicContact CD2-CE2 4.32Å; L451-F518 HydrophobicContact CD2-CZ 3.92Å
452	K	91.3	Very high	90.5	Very high	102 Å²	102	39.3 Å²	39.3	44%	0.443	20%	0.204	S	C	.	.	H	α-helix	trans	-55.7	-42.3	175.6	-73.6	171.5	-174.9	164.9	0	111.3	E448 Q449 L455 K456 F518	E448-K452 WeakPolarHBondContact O-CG 3.25Å; E448-K452 PolarHBondContact O-N 3Å; E448-K452 WeakPolarHBondContact OE1-CE 3.42Å; E448-K452 IonicContact OE1-NZ 3.34Å; E448-K452 PolarHBondContact OE1-NZ 3.42Å; Q449-K452 PolarHBondContact O-N 2.89Å; K452-L455 PolarHBondContact O-N 3.28Å; K452-K456 PolarHBondContact O-N 3.11Å; K452-F518 HydrophobicContact CD-CD1 4.46Å; K452-F518 HydrophobicContact CD-CE1 4.32Å; K452-F518 HydrophobicContact CG-CD1 3.7Å; K452-F518 HydrophobicContact CG-CE1 3.64Å
453	L	91.9	Very high	91.1	Very high	28 Å²	28	42.6 Å²	42.6	15%	0.147	22%	0.221	C	C	.	.	H	α-helix	trans	-66.4	-44	176.3	179.7	64.3	0	0	0	112.4	V384 F387 T388 Q449 V450 L451 L455 K456 Q457	V384-L453 HydrophobicContact CG1-CD2 3.87Å; F387-L453 HydrophobicContact CD1-CD2 3.49Å; F387-L453 VanDerWaalsContact CD1-CD2 3.49Å; F387-L453 HydrophobicContact CE1-CD2 3.62Å; F387-L453 HydrophobicContact CE1-CG 4.22Å; T388-L453 HydrophobicContact CG2-CD1 4.31Å; T388-L453 WeakPolarHBondContact OG1-CD2 3.48Å; Q449-L453 PolarHBondContact O-N 2.89Å; Q449-L453 VanDerWaalsContact O-N 3.1Å; V450-L453 WeakPolarHBondContact O-CB 3.47Å; V450-L453 PolarHBondContact O-N 3.02Å; L451-L453 PolarHBondContact O-N 3.31Å; L453-L455 VanDerWaalsContact C-N 3.32Å; L453-L455 PolarHBondContact O-N 2.99Å; L453-K456 WeakPolarHBondContact O-CB 3.41Å; L453-K456 PolarHBondContact O-N 3.37Å; L453-Q457 HydrophobicContact CD1-CG 4.27Å; L453-Q457 HydrophobicContact CG-CG 4.45Å; L453-Q457 WeakPolarHBondContact O-CG 3.48Å; L453-Q457 PolarHBondContact O-N 2.87Å
454	C	94.1	Very high	91.8	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-56.5	-45.9	175.4	-70.6	0	0	0	0	111.4	F432 V450 L451 K456 Q457 M458	F432-C454 HydrophobicContact CD1-CB 3.67Å; F432-C454 VanDerWaalsContact CD1-SG 3.55Å; F432-C454 HydrophobicContact CE1-CB 3.86Å; F432-C454 HydrophobicContact CG-CB 4.28Å; V450-C454 PolarHBondContact O-N 3.16Å; V450-C454 PolarHBondContact O-SG 2.81Å; L451-C454 WeakPolarHBondContact O-CB 3.39Å; L451-C454 PolarHBondContact O-N 3.29Å; L451-C454 VanDerWaalsContact O-N 3.14Å; C454-K456 PolarHBondContact O-N 2.94Å; C454-Q457 PolarHBondContact O-N 3.02Å; C454-M458 WeakPolarHBondContact O-CB 3.34Å; C454-M458 PolarHBondContact O-N 2.88Å
455	L	93.8	Very high	92.7	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-41.3	177.4	-64.1	177.6	0	0	0	111.9	L451 K452 L453 Q457 M458 N459 I504 K508 F518 I524	L451-L455 HydrophobicContact CD1-CG 4.47Å; L451-L455 HydrophobicContact CG-CD1 4.47Å; L451-L455 WeakPolarHBondContact O-CG 3.5Å; L451-L455 PolarHBondContact O-N 3.42Å; K452-L455 PolarHBondContact O-N 3.28Å; L453-L455 VanDerWaalsContact C-N 3.32Å; L453-L455 PolarHBondContact O-N 2.99Å; L455-Q457 PolarHBondContact O-N 3.27Å; L455-M458 WeakPolarHBondContact O-CB 3.29Å; L455-M458 PolarHBondContact O-N 2.92Å; L455-N459 PolarHBondContact O-N 3.49Å; L455-I504 HydrophobicContact CD2-CG2 3.73Å; L455-K508 HydrophobicContact CD1-CD 4.15Å; L455-K508 HydrophobicContact CD1-CG 4.3Å; L455-K508 HydrophobicContact CD2-CG 4.5Å; L455-F518 HydrophobicContact CD1-CB 3.96Å; L455-F518 HydrophobicContact CD1-CD1 4.26Å; L455-F518 HydrophobicContact CD1-CD2 3.61Å; L455-F518 HydrophobicContact CD1-CE2 4.14Å; L455-F518 HydrophobicContact CD1-CG 3.67Å; L455-I524 HydrophobicContact CB-CD1 4.26Å; L455-I524 HydrophobicContact CD2-CD1 4.29Å
456	K	93.6	Very high	93.4	Very high	131 Å²	131	39.1 Å²	39.1	57%	0.57	18%	0.18	S	C	*	.	H	α-helix	trans	-61.2	-44	174.2	-176.8	178.1	179.7	177.5	0	112.1	K452 L453 C454 M458 N459 S460	K452-K456 PolarHBondContact O-N 3.11Å; L453-K456 WeakPolarHBondContact O-CB 3.41Å; L453-K456 PolarHBondContact O-N 3.37Å; C454-K456 PolarHBondContact O-N 2.94Å; K456-M458 VanDerWaalsContact C-N 3.35Å; K456-N459 PolarHBondContact O-N 3.26Å; K456-S460 PolarHBondContact O-N 2.91Å
457	Q	94.4	Very high	94	Very high	23 Å²	23	44.9 Å²	44.9	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-67.7	-36.5	177.3	-67	-58.7	-41.9	0	0	111.8	I391 T392 L395 L453 C454 L455 S460 F461	I391-Q457 HydrophobicContact CG2-CB 4.34Å; I391-Q457 HydrophobicContact CG2-CG 3.83Å; T392-Q457 PolarHBondContact OG1-OE1 2.79Å; L395-Q457 HydrophobicContact CD1-CB 4.13Å; L453-Q457 HydrophobicContact CD1-CG 4.27Å; L453-Q457 HydrophobicContact CG-CG 4.45Å; L453-Q457 WeakPolarHBondContact O-CG 3.48Å; L453-Q457 PolarHBondContact O-N 2.87Å; C454-Q457 PolarHBondContact O-N 3.02Å; L455-Q457 PolarHBondContact O-N 3.27Å; Q457-S460 PolarHBondContact O-N 3.39Å; Q457-F461 WeakPolarHBondContact O-CB 3.38Å; Q457-F461 PolarHBondContact O-N 3.13Å
458	M	95.1	Very high	94.4	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-46.3	173.8	-174.9	58.3	145	0	0	111.4	V428 F432 C454 L455 K456 S460 F461 L462 F500 I504 I524	V428-M458 HydrophobicContact CG1-CE 4Å; V428-M458 HydrophobicContact CG1-SD 4Å; F432-M458 HydrophobicContact CE2-CB 4.1Å; F432-M458 HydrophobicContact CE2-CE 4.43Å; F432-M458 HydrophobicContact CE2-CG 4.39Å; F432-M458 HydrophobicContact CE2-SD 3.85Å; F432-M458 HydrophobicContact CZ-CB 4.12Å; F432-M458 HydrophobicContact CZ-SD 4.44Å; C454-M458 WeakPolarHBondContact O-CB 3.34Å; C454-M458 PolarHBondContact O-N 2.88Å; L455-M458 WeakPolarHBondContact O-CB 3.29Å; L455-M458 PolarHBondContact O-N 2.92Å; K456-M458 VanDerWaalsContact C-N 3.35Å; M458-S460 PolarHBondContact O-N 3.46Å; M458-F461 WeakPolarHBondContact O-CB 3.48Å; M458-F461 PolarHBondContact O-N 3.17Å; M458-F461 VanDerWaalsContact O-N 3.17Å; M458-F461 HydrophobicContact SD-CD1 3.88Å; M458-F461 HydrophobicContact SD-CE1 4.42Å; M458-L462 HydrophobicContact CG-CD1 4.05Å; M458-L462 HydrophobicContact CG-CG 4.42Å; M458-L462 VanDerWaalsContact O-CG 3.31Å; M458-L462 WeakPolarHBondContact O-CG 3.2Å; M458-L462 PolarHBondContact O-N 3.49Å; M458-L462 HydrophobicContact SD-CD1 4.44Å; M458-L462 HydrophobicContact SD-CG 4.28Å; M458-F500 HydrophobicContact CE-CB 4.18Å; M458-F500 HydrophobicContact CE-CD1 3.35Å; M458-F500 HydrophobicContact CE-CE1 3.93Å; M458-F500 HydrophobicContact CE-CG 4.03Å; M458-I504 HydrophobicContact CE-CD1 3.68Å; M458-I504 HydrophobicContact CE-CG1 3.86Å; M458-I504 HydrophobicContact CG-CD1 3.85Å; M458-I504 HydrophobicContact CG-CG1 4.27Å; M458-I524 HydrophobicContact CB-CD1 4.47Å; M458-I524 HydrophobicContact CG-CD1 4.49Å
459	N	94.4	Very high	94.8	Very high	37 Å²	37	43 Å²	43	20%	0.198	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-46.2	175.8	-171.2	60.1	0	0	0	111.9	L455 K456 F461 L462 M463 A523 I524	L455-N459 PolarHBondContact O-N 3.49Å; K456-N459 PolarHBondContact O-N 3.26Å; N459-F461 VanDerWaalsContact C-N 3.27Å; N459-F461 PolarHBondContact O-N 2.78Å; N459-L462 PolarHBondContact O-N 3.37Å; N459-M463 WeakPolarHBondContact O-CG 3.4Å; N459-M463 PolarHBondContact O-N 3.43Å; N459-M463 VanDerWaalsContact O-N 3.08Å; N459-A523 VanDerWaalsContact OD1-C 3.28Å; N459-A523 WeakPolarHBondContact OD1-CB 3.29Å; N459-A523 PolarHBondContact OD1-O 3.35Å; N459-I524 HydrophobicContact CB-CG1 3.79Å; N459-I524 PolarHBondContact OD1-N 2.9Å
460	S	94.8	Very high	95.2	Very high	46 Å²	46	40.4 Å²	40.4	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-62.4	-34.9	176.6	-178	0	0	0	0	112.8	K456 Q457 M458 R464	K456-S460 PolarHBondContact O-N 2.91Å; Q457-S460 PolarHBondContact O-N 3.39Å; M458-S460 PolarHBondContact O-N 3.46Å; S460-R464 PolarHBondContact O-N 2.92Å
461	F	96.8	Very high	95.4	Very high	7 Å²	7	42.8 Å²	42.8	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-45	175.9	161.9	-94.4	0	0	0	111.5	L395 L399 L424 V428 Q457 M458 N459 M463 R464 Y465 F500	L395-F461 HydrophobicContact CB-CD2 3.88Å; L395-F461 HydrophobicContact CB-CG 4.5Å; L395-F461 HydrophobicContact CD1-CB 4.12Å; L395-F461 HydrophobicContact CD2-CD2 4.05Å; L395-F461 HydrophobicContact CD2-CE2 4.36Å; L395-F461 HydrophobicContact CD2-CG 4.2Å; L395-F461 HydrophobicContact CG-CD2 4.44Å; L399-F461 HydrophobicContact CB-CE2 4Å; L424-F461 HydrophobicContact CD1-CE2 4.42Å; L424-F461 HydrophobicContact CD1-CZ 4.01Å; L424-F461 HydrophobicContact CD2-CZ 3.95Å; L424-F461 HydrophobicContact CG-CZ 4.16Å; V428-F461 HydrophobicContact CG2-CE1 4.32Å; V428-F461 HydrophobicContact CG2-CE2 4.47Å; V428-F461 HydrophobicContact CG2-CZ 3.96Å; Q457-F461 WeakPolarHBondContact O-CB 3.38Å; Q457-F461 PolarHBondContact O-N 3.13Å; M458-F461 WeakPolarHBondContact O-CB 3.48Å; M458-F461 PolarHBondContact O-N 3.17Å; M458-F461 VanDerWaalsContact O-N 3.17Å; M458-F461 HydrophobicContact SD-CD1 3.88Å; M458-F461 HydrophobicContact SD-CE1 4.42Å; N459-F461 VanDerWaalsContact C-N 3.27Å; N459-F461 PolarHBondContact O-N 2.78Å; F461-M463 VanDerWaalsContact C-N 3.31Å; F461-M463 PolarHBondContact O-N 3.23Å; F461-R464 CarbonylContact O-C 3.19Å; F461-R464 WeakPolarHBondContact O-CB 3.48Å; F461-R464 PolarHBondContact O-N 2.7Å; F461-R464 VanDerWaalsContact O-N 3.14Å; F461-Y465 PolarHBondContact O-N 3.06Å; F461-F500 HydrophobicContact CE1-CE1 4.03Å; F461-F500 HydrophobicContact CE1-CE2 4.45Å; F461-F500 AromaticContact CE1-CZ 3.73Å; F461-F500 HydrophobicContact CE1-CZ 3.73Å; F461-F500 HydrophobicContact CZ-CZ 4.13Å
462	L	96.8	Very high	95.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-33.8	179.8	-70	171.6	0	0	0	112.7	M458 N459 Y465 R466 F500 I524 T527 L528	M458-L462 HydrophobicContact CG-CD1 4.05Å; M458-L462 HydrophobicContact CG-CG 4.42Å; M458-L462 VanDerWaalsContact O-CG 3.31Å; M458-L462 WeakPolarHBondContact O-CG 3.2Å; M458-L462 PolarHBondContact O-N 3.49Å; M458-L462 HydrophobicContact SD-CD1 4.44Å; M458-L462 HydrophobicContact SD-CG 4.28Å; N459-L462 PolarHBondContact O-N 3.37Å; L462-Y465 WeakPolarHBondContact O-CB 3.34Å; L462-Y465 PolarHBondContact O-N 2.8Å; L462-R466 PolarHBondContact O-N 2.89Å; L462-F500 HydrophobicContact CD2-CD2 4.11Å; L462-F500 HydrophobicContact CD2-CE2 4.3Å; L462-F500 HydrophobicContact CD2-CG 4.46Å; L462-I524 HydrophobicContact CD1-CB 4.42Å; L462-I524 HydrophobicContact CD1-CG2 3.56Å; L462-T527 HydrophobicContact CB-CG2 3.78Å; L462-L528 HydrophobicContact CD1-CD1 4.39Å; L462-L528 HydrophobicContact CD1-CD2 3.86Å; L462-L528 HydrophobicContact CD1-CG 3.88Å; L462-L528 HydrophobicContact CD2-CD2 3.66Å; L462-L528 HydrophobicContact CG-CD2 4.38Å
463	M	96.2	Very high	95.7	Very high	72 Å²	72	40 Å²	40	36%	0.355	20%	0.197	S	C	.	.	H	α-helix	trans	-61.7	-44.6	172.3	-70.2	-63.8	-67.2	0	0	111.5	N459 F461 R466 E467 T527	N459-M463 WeakPolarHBondContact O-CG 3.4Å; N459-M463 PolarHBondContact O-N 3.43Å; N459-M463 VanDerWaalsContact O-N 3.08Å; F461-M463 VanDerWaalsContact C-N 3.31Å; F461-M463 PolarHBondContact O-N 3.23Å; M463-R466 WeakPolarHBondContact O-CB 3.17Å; M463-R466 PolarHBondContact O-N 3.12Å; M463-E467 WeakPolarHBondContact O-CG 3.4Å; M463-E467 PolarHBondContact O-N 3.41Å; M463-E467 VanDerWaalsContact O-N 3.14Å; M463-T527 HydrophobicContact CG-CG2 4.24Å; M463-T527 HydrophobicContact SD-CG2 3.64Å
464	R	96.9	Very high	95.9	Very high	96 Å²	96	42.9 Å²	42.9	36%	0.362	21%	0.21	S	C	.	.	H	α-helix	trans	-67	-38.6	174.1	-67.6	179	-177.1	159.5	6	111.9	L399 S460 F461 R466 E467 E468	L399-R464 HydrophobicContact CD2-CB 4.18Å; S460-R464 PolarHBondContact O-N 2.92Å; F461-R464 CarbonylContact O-C 3.19Å; F461-R464 WeakPolarHBondContact O-CB 3.48Å; F461-R464 PolarHBondContact O-N 2.7Å; F461-R464 VanDerWaalsContact O-N 3.14Å; R464-R466 VanDerWaalsContact C-N 3.29Å; R464-R466 PolarHBondContact O-N 2.75Å; R464-E467 PolarHBondContact O-N 3.08Å; R464-E468 VanDerWaalsContact O-CG 3.26Å; R464-E468 WeakPolarHBondContact O-CG 3.39Å; R464-E468 PolarHBondContact O-N 2.94Å
465	Y	97.6	Very high	95.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.9	-49.1	175.3	-172	-116.4	0	0	0	110.3	L399 W406 L424 F461 L462 E467 E468 V469 I493 N496 F500 V531	L399-Y465 HydrophobicContact CD1-CD2 3.56Å; L399-Y465 HydrophobicContact CD1-CE2 4.09Å; W406-Y465 HydrophobicContact CH2-CD2 4.49Å; W406-Y465 HydrophobicContact CH2-CE2 4.08Å; W406-Y465 HydrophobicContact CZ2-CD2 4.42Å; W406-Y465 AromaticContact CZ2-CE2 3.64Å; W406-Y465 HydrophobicContact CZ2-CE2 3.64Å; L424-Y465 HydrophobicContact CD2-CD2 3.98Å; L424-Y465 HydrophobicContact CD2-CE2 3.46Å; L424-Y465 VanDerWaalsContact CD2-CE2 3.46Å; F461-Y465 PolarHBondContact O-N 3.06Å; L462-Y465 WeakPolarHBondContact O-CB 3.34Å; L462-Y465 PolarHBondContact O-N 2.8Å; Y465-E467 PolarHBondContact O-N 3.07Å; Y465-E468 PolarHBondContact O-N 3.49Å; Y465-V469 HydrophobicContact CD1-CG2 4.39Å; Y465-V469 HydrophobicContact CE1-CG2 4.23Å; Y465-V469 VanDerWaalsContact O-CG2 3.29Å; Y465-V469 WeakPolarHBondContact O-CG2 3.27Å; Y465-V469 PolarHBondContact O-N 2.83Å; Y465-I493 HydrophobicContact CE1-CG2 4Å; Y465-N496 PolarHBondContact OH-ND2 3.1Å; Y465-F500 HydrophobicContact CE1-CE2 4.36Å; Y465-V531 HydrophobicContact CD1-CG1 4.3Å; Y465-V531 HydrophobicContact CE1-CG1 4.23Å
466	R	97.6	Very high	95.9	Very high	63 Å²	63	47.8 Å²	47.8	24%	0.238	23%	0.232	C	C	.	.	H	α-helix	trans	-58	-49	175.6	-175.3	179.9	163.8	-151.7	6.4	112.9	L462 M463 R464 E468 V469 V470 E530 V531 E534	L462-R466 PolarHBondContact O-N 2.89Å; M463-R466 WeakPolarHBondContact O-CB 3.17Å; M463-R466 PolarHBondContact O-N 3.12Å; R464-R466 VanDerWaalsContact C-N 3.29Å; R464-R466 PolarHBondContact O-N 2.75Å; R466-E468 PolarHBondContact O-N 3Å; R466-V469 PolarHBondContact O-N 3.11Å; R466-V469 VanDerWaalsContact O-N 3.12Å; R466-V470 WeakPolarHBondContact O-CG2 3.25Å; R466-V470 PolarHBondContact O-N 2.84Å; R466-E530 IonicContact CZ-OE2 2.76Å; R466-E530 VanDerWaalsContact CZ-OE2 3.24Å; R466-E530 IonicContact NE-OE2 2.89Å; R466-E530 IonicContact NH1-OE2 2.81Å; R466-E530 PolarHBondContact NH1-OE2 3.35Å; R466-E530 IonicContact NH2-OE2 3.79Å; R466-V531 HydrophobicContact CB-CG2 3.54Å; R466-V531 HydrophobicContact CG-CG2 3.82Å; R466-E534 WeakPolarHBondContact CG-OE2 3.49Å; R466-E534 IonicContact CZ-OE1 3.55Å; R466-E534 VanDerWaalsContact CZ-OE1 3.31Å; R466-E534 IonicContact CZ-OE2 2.81Å; R466-E534 IonicContact NE-OE1 3Å; R466-E534 PolarHBondContact NE-OE1 3.26Å; R466-E534 IonicContact NE-OE2 3.78Å; R466-E534 PolarHBondContact NE-OE2 2.89Å; R466-E534 IonicContact NH2-OE1 3.72Å; R466-E534 PolarHBondContact NH2-OE1 3.21Å; R466-E534 IonicContact NH2-OE2 3.41Å
467	E	97.4	Very high	95.8	Very high	125 Å²	125	44.8 Å²	44.8	58%	0.584	22%	0.222	S	C	*	.	H	α-helix	trans	-54.8	-40.1	178	-71.4	168.7	-179.8	0	0	111.5	M463 R464 Y465 V470 A471	M463-E467 WeakPolarHBondContact O-CG 3.4Å; M463-E467 PolarHBondContact O-N 3.41Å; M463-E467 VanDerWaalsContact O-N 3.14Å; R464-E467 PolarHBondContact O-N 3.08Å; Y465-E467 PolarHBondContact O-N 3.07Å; E467-V470 PolarHBondContact O-N 3.33Å; E467-A471 WeakPolarHBondContact O-CB 3.48Å; E467-A471 PolarHBondContact O-N 3.47Å
468	E	97.3	Very high	95.8	Very high	58 Å²	58	52.5 Å²	52.5	27%	0.271	25%	0.25	S	C	.	.	H	α-helix	trans	-73.6	-33.8	179	-63.8	-67.7	-165.9	0	0	113.3	L399 K403 W406 R464 Y465 R466 A471 Y472	L399-E468 HydrophobicContact CD2-CG 4.16Å; K403-E468 HydrophobicContact CD-CB 4.06Å; K403-E468 HydrophobicContact CD-CG 3.88Å; K403-E468 WeakPolarHBondContact CE-OE2 3.27Å; K403-E468 IonicContact NZ-OE1 2.69Å; K403-E468 PolarHBondContact NZ-OE1 3.27Å; K403-E468 IonicContact NZ-OE2 3.43Å; K403-E468 PolarHBondContact NZ-OE2 3.43Å; W406-E468 HydrophobicContact CH2-CB 4.22Å; W406-E468 HydrophobicContact CZ3-CB 4.23Å; R464-E468 VanDerWaalsContact O-CG 3.26Å; R464-E468 WeakPolarHBondContact O-CG 3.39Å; R464-E468 PolarHBondContact O-N 2.94Å; Y465-E468 PolarHBondContact O-N 3.49Å; R466-E468 PolarHBondContact O-N 3Å; E468-A471 PolarHBondContact O-N 3.39Å; E468-Y472 WeakPolarHBondContact O-CB 3.31Å; E468-Y472 PolarHBondContact O-N 2.91Å
469	V	97.4	Very high	95.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-41.3	172.5	173.9	0	0	0	0	110.9	W406 Y465 R466 Y472 K473 M490 I493 V531 F538	W406-V469 HydrophobicContact CH2-CG2 4.09Å; Y465-V469 HydrophobicContact CD1-CG2 4.39Å; Y465-V469 HydrophobicContact CE1-CG2 4.23Å; Y465-V469 VanDerWaalsContact O-CG2 3.29Å; Y465-V469 WeakPolarHBondContact O-CG2 3.27Å; Y465-V469 PolarHBondContact O-N 2.83Å; R466-V469 PolarHBondContact O-N 3.11Å; R466-V469 VanDerWaalsContact O-N 3.12Å; V469-Y472 WeakPolarHBondContact O-CB 3.5Å; V469-Y472 PolarHBondContact O-N 3.5Å; V469-K473 PolarHBondContact O-N 2.85Å; V469-K473 VanDerWaalsContact O-N 3.12Å; V469-M490 HydrophobicContact CG1-CE 4.25Å; V469-M490 HydrophobicContact CG1-SD 4.03Å; V469-I493 HydrophobicContact CB-CG2 4.4Å; V469-I493 HydrophobicContact CG1-CG2 3.98Å; V469-I493 HydrophobicContact CG2-CD1 4.23Å; V469-I493 HydrophobicContact CG2-CG2 3.45Å; V469-I493 VanDerWaalsContact CG2-CG2 3.45Å; V469-V531 HydrophobicContact CG2-CG1 4.5Å; V469-F538 HydrophobicContact CG1-CE2 4.33Å
470	V	96.9	Very high	95.6	Very high	48 Å²	48	58.7 Å²	58.7	29%	0.291	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-46.6	174	174.9	0	0	0	0	110.3	R466 E467 Y472 K473 E474 F538	R466-V470 WeakPolarHBondContact O-CG2 3.25Å; R466-V470 PolarHBondContact O-N 2.84Å; E467-V470 PolarHBondContact O-N 3.33Å; V470-Y472 VanDerWaalsContact C-N 3.27Å; V470-Y472 PolarHBondContact O-N 2.98Å; V470-K473 PolarHBondContact O-N 3.28Å; V470-E474 HydrophobicContact CG1-CG 4.45Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 3.35Å; V470-F538 HydrophobicContact CG2-CE2 4.41Å; V470-F538 HydrophobicContact CG2-CZ 4.21Å
471	A	96.2	Very high	95.3	Very high	49 Å²	49	64.2 Å²	64.2	41%	0.405	30%	0.296	S	S	.	.	H	α-helix	trans	-60.2	-37.6	176.9	0	0	0	0	0	112.5	E467 E468 E474 E475	E467-A471 WeakPolarHBondContact O-CB 3.48Å; E467-A471 PolarHBondContact O-N 3.47Å; E468-A471 PolarHBondContact O-N 3.39Å; A471-E474 PolarHBondContact O-N 2.92Å; A471-E475 PolarHBondContact O-N 3.47Å
472	Y	96.1	Very high	95	Very high	13 Å²	13	68.8 Å²	68.8	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-45.9	176	-177.3	-113.3	0	0	0	112.2	W406 L407 E468 V469 V470 E475 H476 P483 Y486 M490 I493	W406-Y472 HydrophobicContact CB-CD2 4.2Å; W406-Y472 HydrophobicContact CB-CE2 3.57Å; W406-Y472 HydrophobicContact CE3-CD1 4.5Å; W406-Y472 AromaticContact CE3-CD2 3.88Å; W406-Y472 HydrophobicContact CE3-CD2 3.88Å; W406-Y472 HydrophobicContact CE3-CE2 4.39Å; W406-Y472 AromaticContact CE3-CG 3.92Å; W406-Y472 HydrophobicContact CE3-CG 3.92Å; W406-Y472 HydrophobicContact CZ3-CG 4.47Å; W406-Y472 PolarHBondContact O-OH 3.29Å; L407-Y472 HydrophobicContact CD2-CE2 4.2Å; E468-Y472 WeakPolarHBondContact O-CB 3.31Å; E468-Y472 PolarHBondContact O-N 2.91Å; V469-Y472 WeakPolarHBondContact O-CB 3.5Å; V469-Y472 PolarHBondContact O-N 3.5Å; V470-Y472 VanDerWaalsContact C-N 3.27Å; V470-Y472 PolarHBondContact O-N 2.98Å; Y472-E475 PolarHBondContact O-N 3.31Å; Y472-H476 PolarHBondContact O-N 2.79Å; Y472-H476 VanDerWaalsContact O-N 3.09Å; Y472-P483 HydrophobicContact CE2-CG 3.69Å; Y472-Y486 AromaticContact CD1-CD2 3.89Å; Y472-Y486 HydrophobicContact CD1-CD2 3.89Å; Y472-Y486 AromaticContact CD1-CE2 3.69Å; Y472-Y486 HydrophobicContact CD1-CE2 3.69Å; Y472-Y486 AromaticContact CE1-CD2 3.28Å; Y472-Y486 HydrophobicContact CE1-CD2 3.28Å; Y472-Y486 AromaticContact CE1-CE2 3.57Å; Y472-Y486 HydrophobicContact CE1-CE2 3.57Å; Y472-Y486 HydrophobicContact CE1-CG 4.35Å; Y472-Y486 AromaticContact CZ-CD2 3.79Å; Y472-M490 HydrophobicContact CD1-CE 3.91Å; Y472-M490 HydrophobicContact CE1-CE 4.42Å; Y472-I493 HydrophobicContact CD1-CD1 4.43Å
473	K	95.3	Very high	94.6	Very high	31 Å²	31	69.5 Å²	69.5	14%	0.135	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-45.5	172.9	173.3	-87.1	-163.4	-175.5	0	112	V469 V470 E475 H476 L477 Y486 M490 F538	V469-K473 PolarHBondContact O-N 2.85Å; V469-K473 VanDerWaalsContact O-N 3.12Å; V470-K473 PolarHBondContact O-N 3.28Å; K473-E475 VanDerWaalsContact C-N 3.28Å; K473-E475 PolarHBondContact O-N 2.88Å; K473-H476 PolarHBondContact O-N 3.47Å; K473-L477 HydrophobicContact CD-CD1 3.86Å; K473-L477 HydrophobicContact CD-CG 4.23Å; K473-L477 WeakPolarHBondContact O-CG 3.2Å; K473-L477 PolarHBondContact O-N 2.82Å; K473-Y486 WeakPolarHBondContact CG-OH 3.3Å; K473-M490 HydrophobicContact CB-CE 4.37Å; K473-F538 HydrophobicContact CB-CD2 3.83Å; K473-F538 HydrophobicContact CB-CE2 4.06Å; K473-F538 HydrophobicContact CB-CG 4.13Å; K473-F538 HydrophobicContact CD-CD1 4.26Å; K473-F538 HydrophobicContact CD-CE1 4.28Å; K473-F538 HydrophobicContact CG-CB 4.12Å; K473-F538 HydrophobicContact CG-CD1 3.87Å; K473-F538 HydrophobicContact CG-CD2 3.95Å; K473-F538 HydrophobicContact CG-CE1 4.25Å; K473-F538 HydrophobicContact CG-CE2 4.32Å; K473-F538 HydrophobicContact CG-CG 3.71Å; K473-F538 HydrophobicContact CG-CZ 4.46Å
474	E	94.8	Very high	94.3	Very high	88 Å²	88	72.2 Å²	72.2	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-33.3	-179.7	-68.2	-57.8	134.9	0	0	112.4	V470 A471	V470-E474 HydrophobicContact CG1-CG 4.45Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 3.35Å; A471-E474 PolarHBondContact O-N 2.92Å
475	E	93.2	Very high	94.1	Very high	102 Å²	102	68 Å²	68	48%	0.477	32%	0.323	S	S	.	.	H	α-helix	trans	-68.5	-43.7	173.5	-163.3	64.4	-137.3	0	0	111.4	A471 Y472 K473 L477 R478	A471-E475 PolarHBondContact O-N 3.47Å; Y472-E475 PolarHBondContact O-N 3.31Å; K473-E475 VanDerWaalsContact C-N 3.28Å; K473-E475 PolarHBondContact O-N 2.88Å; E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 2.82Å; E475-R478 VanDerWaalsContact CD-NH1 3.31Å; E475-R478 WeakPolarHBondContact O-CB 3.34Å; E475-R478 PolarHBondContact O-N 3.32Å; E475-R478 VanDerWaalsContact O-N 3.08Å; E475-R478 IonicContact OE1-NH1 3.83Å; E475-R478 PolarHBondContact OE1-NH1 2.83Å; E475-R478 IonicContact OE2-CZ 2.73Å; E475-R478 IonicContact OE2-NH1 3.35Å; E475-R478 PolarHBondContact OE2-NH1 2.72Å
476	H	94.3	Very high	94	Very high	9 Å²	9	68.2 Å²	68.2	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-38.4	175.9	-178.2	61.6	0	0	0	112.7	Y472 K473 R478 D479 R480 L482 Y486 E542	Y472-H476 PolarHBondContact O-N 2.79Å; Y472-H476 VanDerWaalsContact O-N 3.09Å; K473-H476 PolarHBondContact O-N 3.47Å; H476-R478 PolarHBondContact O-N 2.92Å; H476-D479 CarbonylContact O-C 3.57Å; H476-D479 PolarHBondContact O-N 3.39Å; H476-D479 VanDerWaalsContact O-N 3.16Å; H476-R480 PolarHBondContact CE1-O 3.03Å; H476-R480 WeakPolarHBondContact O-CA 3.39Å; H476-R480 PolarHBondContact O-N 2.89Å; H476-R480 VanDerWaalsContact O-N 3.15Å; H476-L482 WeakPolarHBondContact CA-O 3.44Å; H476-L482 PolarHBondContact ND1-O 3.28Å; H476-Y486 HydrophobicContact CB-CD2 3.59Å; H476-Y486 HydrophobicContact CB-CE2 3.56Å; H476-Y486 HydrophobicContact CB-CG 4.17Å; H476-Y486 AromaticContact CD2-CD1 3.36Å; H476-Y486 WeakPolarHBondContact CD2-CD1 3.4Å; H476-Y486 AromaticContact CD2-CD2 3.87Å; H476-Y486 AromaticContact CD2-CE1 3.37Å; H476-Y486 WeakPolarHBondContact CD2-CE1 3.29Å; H476-Y486 AromaticContact CD2-CE2 3.89Å; H476-Y486 AromaticContact CD2-CG 3.61Å; H476-Y486 AromaticContact CD2-CZ 3.63Å; H476-Y486 AromaticContact CE1-CD1 3.82Å; H476-Y486 AromaticContact CE1-CG 3.75Å; H476-Y486 AromaticContact CG-CD1 3.83Å; H476-Y486 AromaticContact CG-CD2 3.52Å; H476-Y486 AromaticContact CG-CE2 3.76Å; H476-Y486 AromaticContact CG-CG 3.56Å; H476-Y486 AromaticContact ND1-CD2 3.95Å; H476-Y486 AromaticContact ND1-CG 3.67Å; H476-Y486 AromaticContact NE2-CD1 3.35Å; H476-Y486 WeakPolarHBondContact NE2-CD1 3.39Å; H476-Y486 AromaticContact NE2-CE1 3.76Å; H476-Y486 AromaticContact NE2-CG 3.73Å; H476-E542 IonicContact CD2-OE1 3.04Å; H476-E542 PolarHBondContact CD2-OE1 3.3Å; H476-E542 IonicContact NE2-OE1 2.7Å; H476-E542 IonicContact NE2-OE2 2.79Å
477	L	92.8	Very high	93.8	Very high	68 Å²	68	66.7 Å²	66.7	36%	0.356	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-17.9	177.3	-71.7	-173	0	0	0	114.2	K473 E475 L545	K473-L477 HydrophobicContact CD-CD1 3.86Å; K473-L477 HydrophobicContact CD-CG 4.23Å; K473-L477 WeakPolarHBondContact O-CG 3.2Å; K473-L477 PolarHBondContact O-N 2.82Å; E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 2.82Å; L477-L545 HydrophobicContact CD2-CD1 4.1Å
478	R	93.5	Very high	93.8	Very high	185 Å²	185	62.5 Å²	62.5	70%	0.698	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-35.6	173.6	-65.4	178	-176.9	158.5	8.1	111.8	E475 H476	E475-R478 VanDerWaalsContact CD-NH1 3.31Å; E475-R478 WeakPolarHBondContact O-CB 3.34Å; E475-R478 PolarHBondContact O-N 3.32Å; E475-R478 VanDerWaalsContact O-N 3.08Å; E475-R478 IonicContact OE1-NH1 3.83Å; E475-R478 PolarHBondContact OE1-NH1 2.83Å; E475-R478 IonicContact OE2-CZ 2.73Å; E475-R478 IonicContact OE2-NH1 3.35Å; E475-R478 PolarHBondContact OE2-NH1 2.72Å; H476-R478 PolarHBondContact O-N 2.92Å
479	D	92.4	Very high	93.7	Very high	72 Å²	72	60.2 Å²	60.2	39%	0.385	29%	0.289	S	S	.	.			trans	-146.1	99.5	174.3	-175.9	-3.6	0	0	0	109.6	H476 Q481 L482	H476-D479 CarbonylContact O-C 3.57Å; H476-D479 PolarHBondContact O-N 3.39Å; H476-D479 VanDerWaalsContact O-N 3.16Å; D479-Q481 PolarHBondContact O-N 3.48Å; D479-Q481 WeakPolarHBondContact OD1-CB 3.41Å; D479-Q481 PolarHBondContact OD1-N 3.4Å; D479-Q481 VanDerWaalsContact OD1-N 3.08Å; D479-L482 PolarHBondContact O-N 2.85Å
480	R	92.8	Very high	93.7	Very high	100 Å²	100	60.2 Å²	60.2	38%	0.377	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-4.6	-176.8	-65.9	179.5	67.3	-144.9	-4.3	113.9	H476 E542 D546	H476-R480 PolarHBondContact CE1-O 3.03Å; H476-R480 WeakPolarHBondContact O-CA 3.39Å; H476-R480 PolarHBondContact O-N 2.89Å; H476-R480 VanDerWaalsContact O-N 3.15Å; R480-E542 IonicContact CZ-OE2 3.92Å; R480-E542 VanDerWaalsContact CZ-OE2 3.28Å; R480-E542 IonicContact NE-OE1 3.58Å; R480-E542 IonicContact NE-OE2 3.45Å; R480-E542 PolarHBondContact NE-OE2 2.78Å; R480-E542 IonicContact NH2-OE2 2.84Å; R480-E542 PolarHBondContact NH2-OE2 3.37Å; R480-D546 IonicContact CZ-OD1 2.93Å; R480-D546 VanDerWaalsContact CZ-OD1 3.32Å; R480-D546 IonicContact NH1-OD1 3.92Å; R480-D546 PolarHBondContact NH1-OD1 3.04Å; R480-D546 IonicContact NH2-OD1 3.67Å; R480-D546 PolarHBondContact NH2-OD1 3.05Å; R480-D546 IonicContact NH2-OD2 3.65Å
481	Q	89.8	Confident	93.7	Very high	162 Å²	162	58 Å²	58	76%	0.757	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-14.6	172.1	-59.4	-176.1	6.2	0	0	112.7	D479	D479-Q481 PolarHBondContact O-N 3.48Å; D479-Q481 WeakPolarHBondContact OD1-CB 3.41Å; D479-Q481 PolarHBondContact OD1-N 3.4Å; D479-Q481 VanDerWaalsContact OD1-N 3.08Å
482	L	89.4	Confident	93.7	Very high	103 Å²	103	55.7 Å²	55.7	54%	0.539	26%	0.256	S	S	.	.			trans	-128.1	141.4	-175.3	-65.9	175.3	0	0	0	111	H476 D479	H476-L482 WeakPolarHBondContact CA-O 3.44Å; H476-L482 PolarHBondContact ND1-O 3.28Å; D479-L482 PolarHBondContact O-N 2.85Å
483	P	88.4	Confident	93.8	Very high	15 Å²	15	55 Å²	55	10%	0.097	25%	0.254	C	S	.	.	S	Bend	cis	-68.1	150.9	-12.3	-18.2	34.2	0	0	0	111.8	L407 Y472 C485 Y486	L407-P483 HydrophobicContact CD2-CB 4.46Å; L407-P483 HydrophobicContact CD2-CG 3.64Å; Y472-P483 HydrophobicContact CE2-CG 3.69Å; P483-C485 VanDerWaalsContact C-N 3.26Å; P483-C485 PolarHBondContact O-N 3.47Å; P483-Y486 WeakPolarHBondContact O-CB 3.48Å; P483-Y486 PolarHBondContact O-N 2.95Å; P483-Y486 VanDerWaalsContact O-N 3.13Å
484	Q	89.5	Confident	93.9	Very high	130 Å²	130	53.6 Å²	53.6	61%	0.607	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-34.8	-174.2	-171.2	175.3	10.3	0	0	113.5
485	C	93.4	Very high	93.9	Very high	8 Å²	8	49.4 Å²	49.4	5%	0.054	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	30.8	-179.9	-63.8	0	0	0	0	113.1	E409 P483 I487 Q488 Y489	E409-C485 PolarHBondContact O-SG 3.32Å; P483-C485 VanDerWaalsContact C-N 3.26Å; P483-C485 PolarHBondContact O-N 3.47Å; C485-I487 PolarHBondContact O-N 3.27Å; C485-Q488 VanDerWaalsContact C-OE1 3.26Å; C485-Q488 VanDerWaalsContact CA-OE1 3.22Å; C485-Q488 PolarHBondContact O-N 2.87Å; C485-Q488 PolarHBondContact O-OE1 3.28Å; C485-Y489 HydrophobicContact CB-CD2 3.83Å; C485-Y489 HydrophobicContact CB-CE2 4.05Å; C485-Y489 WeakPolarHBondContact O-CD2 3.41Å; C485-Y489 PolarHBondContact O-N 3.21Å
486	Y	95.1	Very high	94.1	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-52.2	-49.7	-176.5	172.3	-101.8	0	0	0	113	Y472 K473 H476 P483 Q488 Y489 M490 E542	Y472-Y486 AromaticContact CD1-CD2 3.89Å; Y472-Y486 HydrophobicContact CD1-CD2 3.89Å; Y472-Y486 AromaticContact CD1-CE2 3.69Å; Y472-Y486 HydrophobicContact CD1-CE2 3.69Å; Y472-Y486 AromaticContact CE1-CD2 3.28Å; Y472-Y486 HydrophobicContact CE1-CD2 3.28Å; Y472-Y486 AromaticContact CE1-CE2 3.57Å; Y472-Y486 HydrophobicContact CE1-CE2 3.57Å; Y472-Y486 HydrophobicContact CE1-CG 4.35Å; Y472-Y486 AromaticContact CZ-CD2 3.79Å; K473-Y486 WeakPolarHBondContact CG-OH 3.3Å; H476-Y486 HydrophobicContact CB-CD2 3.59Å; H476-Y486 HydrophobicContact CB-CE2 3.56Å; H476-Y486 HydrophobicContact CB-CG 4.17Å; H476-Y486 AromaticContact CD2-CD1 3.36Å; H476-Y486 WeakPolarHBondContact CD2-CD1 3.4Å; H476-Y486 AromaticContact CD2-CD2 3.87Å; H476-Y486 AromaticContact CD2-CE1 3.37Å; H476-Y486 WeakPolarHBondContact CD2-CE1 3.29Å; H476-Y486 AromaticContact CD2-CE2 3.89Å; H476-Y486 AromaticContact CD2-CG 3.61Å; H476-Y486 AromaticContact CD2-CZ 3.63Å; H476-Y486 AromaticContact CE1-CD1 3.82Å; H476-Y486 AromaticContact CE1-CG 3.75Å; H476-Y486 AromaticContact CG-CD1 3.83Å; H476-Y486 AromaticContact CG-CD2 3.52Å; H476-Y486 AromaticContact CG-CE2 3.76Å; H476-Y486 AromaticContact CG-CG 3.56Å; H476-Y486 AromaticContact ND1-CD2 3.95Å; H476-Y486 AromaticContact ND1-CG 3.67Å; H476-Y486 AromaticContact NE2-CD1 3.35Å; H476-Y486 WeakPolarHBondContact NE2-CD1 3.39Å; H476-Y486 AromaticContact NE2-CE1 3.76Å; H476-Y486 AromaticContact NE2-CG 3.73Å; P483-Y486 WeakPolarHBondContact O-CB 3.48Å; P483-Y486 PolarHBondContact O-N 2.95Å; P483-Y486 VanDerWaalsContact O-N 3.13Å; Y486-Q488 PolarHBondContact O-N 3.48Å; Y486-Y489 PolarHBondContact O-N 3.29Å; Y486-M490 HydrophobicContact CE2-CE 3.8Å; Y486-M490 VanDerWaalsContact O-CB 3.31Å; Y486-M490 WeakPolarHBondContact O-CB 3.47Å; Y486-M490 PolarHBondContact O-N 3.24Å; Y486-M490 WeakPolarHBondContact OH-CE 3.38Å; Y486-E542 HydrophobicContact CD1-CG 4.36Å; Y486-E542 HydrophobicContact CE1-CG 3.85Å
487	I	94.8	Very high	94.2	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.159	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-49.3	-178.9	-67.6	170.2	0	0	0	110.4	C485 Y489 M490 I491 L539 Y576 F580	C485-I487 PolarHBondContact O-N 3.27Å; I487-Y489 PolarHBondContact O-N 3.4Å; I487-M490 PolarHBondContact O-N 3.42Å; I487-I491 HydrophobicContact CG2-CD1 3.86Å; I487-I491 HydrophobicContact CG2-CG1 4.47Å; I487-I491 VanDerWaalsContact O-CG1 3.25Å; I487-I491 WeakPolarHBondContact O-CG1 3.27Å; I487-I491 PolarHBondContact O-N 3.48Å; I487-L539 HydrophobicContact CB-CD2 4.5Å; I487-L539 HydrophobicContact CG2-CD2 4.08Å; I487-Y576 HydrophobicContact CD1-CD1 4.21Å; I487-Y576 HydrophobicContact CD1-CE1 3.69Å; I487-F580 HydrophobicContact CG2-CD1 4.09Å; I487-F580 HydrophobicContact CG2-CE1 3.68Å
488	Q	96	Very high	94.3	Very high	38 Å²	38	43.3 Å²	43.3	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-42.1	-176.2	-61.3	83.1	-10.6	0	0	111.4	E411 P412 Y420 C485 Y486 I491 A492	E411-Q488 HydrophobicContact CG-CG 4.16Å; P412-Q488 VanDerWaalsContact CD-CB 3.49Å; P412-Q488 HydrophobicContact CG-CB 3.97Å; P412-Q488 WeakPolarHBondContact CG-O 3.48Å; Y420-Q488 HydrophobicContact CD2-CB 4.09Å; Y420-Q488 HydrophobicContact CD2-CG 4.45Å; Y420-Q488 HydrophobicContact CE2-CB 3.8Å; Y420-Q488 HydrophobicContact CE2-CG 3.67Å; C485-Q488 VanDerWaalsContact C-OE1 3.26Å; C485-Q488 VanDerWaalsContact CA-OE1 3.22Å; C485-Q488 PolarHBondContact O-N 2.87Å; C485-Q488 PolarHBondContact O-OE1 3.28Å; Y486-Q488 PolarHBondContact O-N 3.48Å; Q488-I491 WeakPolarHBondContact O-CB 3.46Å; Q488-I491 PolarHBondContact O-N 3.43Å; Q488-A492 PolarHBondContact O-N 2.91Å
489	Y	96.7	Very high	94.3	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.039	17%	0.17	C	C	.	.	H	α-helix	trans	-71	-35.5	176.2	-84.4	-74	0	0	0	113	D405 W406 T410 P412 C485 Y486 I487 I491 A492 I493	D405-Y489 HydrophobicContact CB-CE1 4.27Å; D405-Y489 WeakPolarHBondContact O-CE1 3.35Å; D405-Y489 WeakPolarHBondContact O-CE2 3.5Å; D405-Y489 PolarHBondContact O-OH 3.37Å; W406-Y489 HydrophobicContact CB-CD1 4.33Å; W406-Y489 HydrophobicContact CB-CG 4.3Å; W406-Y489 AromaticContact CD1-CD1 3.68Å; W406-Y489 HydrophobicContact CG-CD1 4.32Å; T410-Y489 VanDerWaalsContact O-CE2 3.3Å; T410-Y489 WeakPolarHBondContact O-CE2 3.22Å; T410-Y489 PolarHBondContact O-OH 2.91Å; P412-Y489 HydrophobicContact CB-CD1 4.1Å; P412-Y489 HydrophobicContact CB-CE1 3.83Å; P412-Y489 HydrophobicContact CG-CD1 4.41Å; P412-Y489 HydrophobicContact CG-CE1 4.49Å; C485-Y489 HydrophobicContact CB-CD2 3.83Å; C485-Y489 HydrophobicContact CB-CE2 4.05Å; C485-Y489 WeakPolarHBondContact O-CD2 3.41Å; C485-Y489 PolarHBondContact O-N 3.21Å; Y486-Y489 PolarHBondContact O-N 3.29Å; I487-Y489 PolarHBondContact O-N 3.4Å; Y489-I491 VanDerWaalsContact C-N 3.32Å; Y489-I491 PolarHBondContact O-N 2.82Å; Y489-A492 WeakPolarHBondContact O-CB 3.34Å; Y489-A492 PolarHBondContact O-N 3.41Å; Y489-A492 VanDerWaalsContact O-N 3.17Å; Y489-I493 WeakPolarHBondContact O-CD1 3.41Å; Y489-I493 VanDerWaalsContact O-CG1 3.27Å; Y489-I493 WeakPolarHBondContact O-CG1 3.43Å; Y489-I493 PolarHBondContact O-N 2.83Å
490	M	97.1	Very high	94.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-39.3	172.9	-172.7	60.9	72.1	0	0	111.5	V469 Y472 K473 Y486 I487 I493 V494 F538 L539	V469-M490 HydrophobicContact CG1-CE 4.25Å; V469-M490 HydrophobicContact CG1-SD 4.03Å; Y472-M490 HydrophobicContact CD1-CE 3.91Å; Y472-M490 HydrophobicContact CE1-CE 4.42Å; K473-M490 HydrophobicContact CB-CE 4.37Å; Y486-M490 HydrophobicContact CE2-CE 3.8Å; Y486-M490 VanDerWaalsContact O-CB 3.31Å; Y486-M490 WeakPolarHBondContact O-CB 3.47Å; Y486-M490 PolarHBondContact O-N 3.24Å; Y486-M490 WeakPolarHBondContact OH-CE 3.38Å; I487-M490 PolarHBondContact O-N 3.42Å; M490-I493 PolarHBondContact O-N 2.92Å; M490-V494 WeakPolarHBondContact O-CG2 3.46Å; M490-V494 PolarHBondContact O-N 3.3Å; M490-F538 HydrophobicContact CE-CB 4.27Å; M490-F538 HydrophobicContact CE-CD2 3.87Å; M490-F538 HydrophobicContact SD-CD2 4.24Å; M490-L539 HydrophobicContact CB-CD2 3.8Å; M490-L539 HydrophobicContact CB-CG 4.29Å; M490-L539 HydrophobicContact CG-CD1 4.32Å; M490-L539 HydrophobicContact CG-CD2 3.77Å; M490-L539 HydrophobicContact CG-CG 3.71Å
491	I	96.7	Very high	94.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-45.7	171	-66.7	167.8	0	0	0	110.8	Y420 I487 Q488 Y489 I493 V494 N495 L539 F580 K582 V583	Y420-I491 HydrophobicContact CD2-CB 4.29Å; Y420-I491 HydrophobicContact CD2-CD1 4.45Å; Y420-I491 HydrophobicContact CD2-CG2 4.02Å; I487-I491 HydrophobicContact CG2-CD1 3.86Å; I487-I491 HydrophobicContact CG2-CG1 4.47Å; I487-I491 VanDerWaalsContact O-CG1 3.25Å; I487-I491 WeakPolarHBondContact O-CG1 3.27Å; I487-I491 PolarHBondContact O-N 3.48Å; Q488-I491 WeakPolarHBondContact O-CB 3.46Å; Q488-I491 PolarHBondContact O-N 3.43Å; Y489-I491 VanDerWaalsContact C-N 3.32Å; Y489-I491 PolarHBondContact O-N 2.82Å; I491-I493 VanDerWaalsContact C-N 3.32Å; I491-I493 PolarHBondContact O-N 2.92Å; I491-V494 PolarHBondContact O-N 3.43Å; I491-N495 WeakPolarHBondContact O-CB 3.2Å; I491-N495 VanDerWaalsContact O-CG 3.29Å; I491-N495 PolarHBondContact O-N 3.49Å; I491-L539 HydrophobicContact CG1-CD1 3.87Å; I491-L539 HydrophobicContact CG1-CD2 4.3Å; I491-F580 HydrophobicContact CD1-CD1 4.01Å; I491-K582 HydrophobicContact CG2-CB 4.08Å; I491-K582 WeakPolarHBondContact CG2-O 3.37Å; I491-V583 HydrophobicContact CB-CG2 4.16Å; I491-V583 HydrophobicContact CD1-CG2 4.19Å; I491-V583 HydrophobicContact CG1-CG2 3.68Å; I491-V583 HydrophobicContact CG2-CB 4.35Å; I491-V583 HydrophobicContact CG2-CG2 3.63Å
492	A	96.8	Very high	94.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.6	-40.7	178.2	0	0	0	0	0	112.1	P412 T422 Q488 Y489 N495 N496	P412-A492 HydrophobicContact CB-CB 4.02Å; P412-A492 HydrophobicContact CG-CB 4.03Å; T422-A492 HydrophobicContact CG2-CB 4.04Å; Q488-A492 PolarHBondContact O-N 2.91Å; Y489-A492 WeakPolarHBondContact O-CB 3.34Å; Y489-A492 PolarHBondContact O-N 3.41Å; Y489-A492 VanDerWaalsContact O-N 3.17Å; A492-N495 PolarHBondContact O-N 2.81Å; A492-N496 WeakPolarHBondContact O-CB 3.2Å; A492-N496 PolarHBondContact O-N 3.43Å; A492-N496 PolarHBondContact O-ND2 2.79Å; A492-N496 PolarHBondContact O-OD1 3.13Å
493	I	97.1	Very high	94.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.7	-46	175.4	-72.2	160.6	0	0	0	111.3	W406 Y465 V469 Y472 Y489 M490 I491 N496 C497 V531	W406-I493 HydrophobicContact CD2-CD1 4Å; W406-I493 HydrophobicContact CE3-CD1 4.26Å; W406-I493 HydrophobicContact CH2-CD1 4.32Å; W406-I493 HydrophobicContact CZ2-CD1 4.06Å; W406-I493 HydrophobicContact CZ2-CG1 4.13Å; W406-I493 HydrophobicContact CZ3-CD1 4.41Å; Y465-I493 HydrophobicContact CE1-CG2 4Å; V469-I493 HydrophobicContact CB-CG2 4.4Å; V469-I493 HydrophobicContact CG1-CG2 3.98Å; V469-I493 HydrophobicContact CG2-CD1 4.23Å; V469-I493 HydrophobicContact CG2-CG2 3.45Å; V469-I493 VanDerWaalsContact CG2-CG2 3.45Å; Y472-I493 HydrophobicContact CD1-CD1 4.43Å; Y489-I493 WeakPolarHBondContact O-CD1 3.41Å; Y489-I493 VanDerWaalsContact O-CG1 3.27Å; Y489-I493 WeakPolarHBondContact O-CG1 3.43Å; Y489-I493 PolarHBondContact O-N 2.83Å; M490-I493 PolarHBondContact O-N 2.92Å; I491-I493 VanDerWaalsContact C-N 3.32Å; I491-I493 PolarHBondContact O-N 2.92Å; I493-N496 WeakPolarHBondContact O-CB 3.42Å; I493-N496 PolarHBondContact O-N 3.2Å; I493-C497 PolarHBondContact O-SG 2.77Å; I493-V531 HydrophobicContact CG2-CG1 4.14Å
494	V	97.1	Very high	95.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.8	-46.5	176.1	170.1	0	0	0	0	110.4	M490 I491 N496 C497 V532 V583 F587	M490-V494 WeakPolarHBondContact O-CG2 3.46Å; M490-V494 PolarHBondContact O-N 3.3Å; I491-V494 PolarHBondContact O-N 3.43Å; V494-N496 PolarHBondContact O-N 2.94Å; V494-C497 WeakPolarHBondContact O-CB 3.42Å; V494-C497 PolarHBondContact O-N 3.32Å; V494-V532 HydrophobicContact CG1-CG1 4.25Å; V494-V532 HydrophobicContact CG1-CG2 4.47Å; V494-V583 HydrophobicContact CG1-CG1 4.48Å; V494-F587 HydrophobicContact CG1-CB 4.11Å; V494-F587 HydrophobicContact CG1-CD2 3.7Å; V494-F587 HydrophobicContact CG1-CE2 4.38Å; V494-F587 HydrophobicContact CG1-CG 4.08Å
495	N	96.3	Very high	95.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.5	-35.7	-179.9	-71.8	-16.1	0	0	0	113.2	Y420 I491 A492 C497 Q498 T499 K582 K584	Y420-N495 WeakPolarHBondContact O-CB 3.29Å; Y420-N495 PolarHBondContact O-ND2 3.45Å; I491-N495 WeakPolarHBondContact O-CB 3.2Å; I491-N495 VanDerWaalsContact O-CG 3.29Å; I491-N495 PolarHBondContact O-N 3.49Å; A492-N495 PolarHBondContact O-N 2.81Å; N495-C497 PolarHBondContact O-N 3.19Å; N495-Q498 PolarHBondContact O-N 3.3Å; N495-Q498 VanDerWaalsContact O-N 3.14Å; N495-T499 PolarHBondContact O-N 2.94Å; N495-K582 PolarHBondContact ND2-O 2.87Å; N495-K584 HydrophobicContact CB-CD 4.36Å; N495-K584 HydrophobicContact CB-CG 4.33Å; N495-K584 WeakPolarHBondContact OD1-CG 3.47Å; N495-K584 PolarHBondContact OD1-N 2.9Å
496	N	96.2	Very high	95.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-54.7	-34.7	175	-75.3	-22.3	0	0	0	111.5	Q421 T422 P425 Y465 A492 I493 V494 Q498 T499 F500	Q421-N496 WeakPolarHBondContact CG-OD1 3.42Å; T422-N496 PolarHBondContact N-OD1 3.42Å; T422-N496 VanDerWaalsContact N-OD1 3.1Å; T422-N496 VanDerWaalsContact OG1-CG 3.23Å; T422-N496 PolarHBondContact OG1-ND2 2.96Å; T422-N496 PolarHBondContact OG1-OD1 3.36Å; P425-N496 HydrophobicContact CG-CB 3.7Å; P425-N496 WeakPolarHBondContact CG-OD1 3.49Å; Y465-N496 PolarHBondContact OH-ND2 3.1Å; A492-N496 WeakPolarHBondContact O-CB 3.2Å; A492-N496 PolarHBondContact O-N 3.43Å; A492-N496 PolarHBondContact O-ND2 2.79Å; A492-N496 PolarHBondContact O-OD1 3.13Å; I493-N496 WeakPolarHBondContact O-CB 3.42Å; I493-N496 PolarHBondContact O-N 3.2Å; V494-N496 PolarHBondContact O-N 2.94Å; N496-Q498 VanDerWaalsContact C-N 3.31Å; N496-Q498 PolarHBondContact O-N 3.34Å; N496-T499 PolarHBondContact O-N 3.3Å; N496-T499 VanDerWaalsContact O-N 3.13Å; N496-F500 HydrophobicContact CB-CD2 4.33Å; N496-F500 HydrophobicContact CB-CE2 4.13Å; N496-F500 WeakPolarHBondContact O-CD2 3.45Å; N496-F500 WeakPolarHBondContact O-CG 3.37Å; N496-F500 PolarHBondContact O-N 2.9Å
497	C	96.2	Very high	95	Very high	3 Å²	3	23 Å²	23	2%	0.02	12%	0.118	C	C	.	.	H	α-helix	trans	-62.7	-36.8	-179	-65.6	0	0	0	0	112.6	I493 V494 N495 K501 L528 V531 V532	I493-C497 PolarHBondContact O-SG 2.77Å; V494-C497 WeakPolarHBondContact O-CB 3.42Å; V494-C497 PolarHBondContact O-N 3.32Å; N495-C497 PolarHBondContact O-N 3.19Å; C497-K501 PolarHBondContact O-N 3Å; C497-L528 HydrophobicContact CB-CD2 3.96Å; C497-V531 VanDerWaalsContact SG-CG1 3.53Å; C497-V532 HydrophobicContact CB-CG2 3.48Å; C497-V532 VanDerWaalsContact CB-CG2 3.48Å
498	Q	94.3	Very high	94.8	Very high	48 Å²	48	23.2 Å²	23.2	22%	0.224	12%	0.117	C	C	.	.	H	α-helix	trans	-66.8	-44.8	172.5	-179.3	171.8	-19.8	0	0	111	N495 N496 F500 K501 E502 K584 F587	N495-Q498 PolarHBondContact O-N 3.3Å; N495-Q498 VanDerWaalsContact O-N 3.14Å; N496-Q498 VanDerWaalsContact C-N 3.31Å; N496-Q498 PolarHBondContact O-N 3.34Å; Q498-F500 VanDerWaalsContact C-N 3.32Å; Q498-F500 PolarHBondContact O-N 3.14Å; Q498-K501 WeakPolarHBondContact O-CB 3.47Å; Q498-K501 PolarHBondContact O-N 3.12Å; Q498-K501 VanDerWaalsContact O-N 3.1Å; Q498-E502 HydrophobicContact CG-CG 4.47Å; Q498-E502 VanDerWaalsContact CG-OE1 3.31Å; Q498-E502 WeakPolarHBondContact CG-OE1 3.19Å; Q498-E502 PolarHBondContact NE2-OE1 2.72Å; Q498-E502 WeakPolarHBondContact O-CG 3.24Å; Q498-E502 PolarHBondContact O-N 2.91Å; Q498-K584 HydrophobicContact CB-CD 4.05Å; Q498-K584 HydrophobicContact CG-CD 4.2Å; Q498-F587 HydrophobicContact CB-CE2 3.8Å; Q498-F587 HydrophobicContact CB-CZ 3.89Å
499	T	94.3	Very high	94.5	Very high	19 Å²	19	30.9 Å²	30.9	12%	0.117	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-41.1	179.1	-51.2	0	0	0	0	110.9	Q421 P425 N495 N496 K501 E502 S503 K584	Q421-T499 PolarHBondContact OE1-OG1 3.31Å; P425-T499 HydrophobicContact CB-CG2 3.68Å; P425-T499 HydrophobicContact CG-CG2 4.39Å; N495-T499 PolarHBondContact O-N 2.94Å; N496-T499 PolarHBondContact O-N 3.3Å; N496-T499 VanDerWaalsContact O-N 3.13Å; T499-K501 PolarHBondContact O-N 2.93Å; T499-E502 PolarHBondContact O-N 3.25Å; T499-S503 VanDerWaalsContact O-CB 3.25Å; T499-S503 WeakPolarHBondContact O-CB 3.43Å; T499-S503 PolarHBondContact O-N 2.79Å; T499-S503 PolarHBondContact O-OG 3.46Å; T499-S503 VanDerWaalsContact O-OG 3.11Å; T499-K584 PolarHBondContact OG1-NZ 2.91Å; T499-K584 VanDerWaalsContact OG1-NZ 3.16Å
500	F	95.9	Very high	94.2	Very high	1 Å²	1	36 Å²	36	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-46.2	171.4	-76.1	-53.2	0	0	0	112.3	L424 P425 V428 M458 F461 L462 Y465 N496 Q498 E502 S503 I504 L528	L424-F500 HydrophobicContact CD2-CZ 4.09Å; L424-F500 HydrophobicContact CG-CZ 4Å; P425-F500 VanDerWaalsContact CA-CE1 3.49Å; P425-F500 HydrophobicContact CB-CD1 3.97Å; P425-F500 HydrophobicContact CB-CE1 3.94Å; P425-F500 HydrophobicContact CB-CG 4.41Å; P425-F500 HydrophobicContact CB-CZ 4.31Å; P425-F500 HydrophobicContact CG-CD1 4.35Å; P425-F500 HydrophobicContact CG-CD2 4.37Å; P425-F500 HydrophobicContact CG-CE1 4.12Å; P425-F500 HydrophobicContact CG-CE2 4.09Å; P425-F500 HydrophobicContact CG-CZ 3.96Å; V428-F500 HydrophobicContact CB-CE1 4.1Å; V428-F500 HydrophobicContact CG1-CE1 4.28Å; V428-F500 HydrophobicContact CG2-CE1 4.22Å; M458-F500 HydrophobicContact CE-CB 4.18Å; M458-F500 HydrophobicContact CE-CD1 3.35Å; M458-F500 HydrophobicContact CE-CE1 3.93Å; M458-F500 HydrophobicContact CE-CG 4.03Å; F461-F500 HydrophobicContact CE1-CE1 4.03Å; F461-F500 HydrophobicContact CE1-CE2 4.45Å; F461-F500 AromaticContact CE1-CZ 3.73Å; F461-F500 HydrophobicContact CE1-CZ 3.73Å; F461-F500 HydrophobicContact CZ-CZ 4.13Å; L462-F500 HydrophobicContact CD2-CD2 4.11Å; L462-F500 HydrophobicContact CD2-CE2 4.3Å; L462-F500 HydrophobicContact CD2-CG 4.46Å; Y465-F500 HydrophobicContact CE1-CE2 4.36Å; N496-F500 HydrophobicContact CB-CD2 4.33Å; N496-F500 HydrophobicContact CB-CE2 4.13Å; N496-F500 WeakPolarHBondContact O-CD2 3.45Å; N496-F500 WeakPolarHBondContact O-CG 3.37Å; N496-F500 PolarHBondContact O-N 2.9Å; Q498-F500 VanDerWaalsContact C-N 3.32Å; Q498-F500 PolarHBondContact O-N 3.14Å; F500-E502 PolarHBondContact O-N 3.47Å; F500-S503 PolarHBondContact O-N 3.13Å; F500-I504 WeakPolarHBondContact O-CB 3.44Å; F500-I504 WeakPolarHBondContact O-CD1 3.43Å; F500-I504 WeakPolarHBondContact O-CG1 3.29Å; F500-I504 PolarHBondContact O-N 3.11Å; F500-L528 HydrophobicContact CB-CD2 4.01Å; F500-L528 HydrophobicContact CD2-CD2 4.31Å
501	K	94.4	Very high	93.8	Very high	91 Å²	91	36.7 Å²	36.7	40%	0.396	17%	0.17	S	C	.	.	H	α-helix	trans	-58.9	-46.8	177.9	-173.1	174.4	-172.8	165.8	0	111.6	C497 Q498 T499 N505 E525 L528	C497-K501 PolarHBondContact O-N 3Å; Q498-K501 WeakPolarHBondContact O-CB 3.47Å; Q498-K501 PolarHBondContact O-N 3.12Å; Q498-K501 VanDerWaalsContact O-N 3.1Å; T499-K501 PolarHBondContact O-N 2.93Å; K501-N505 WeakPolarHBondContact O-CB 3.31Å; K501-N505 VanDerWaalsContact O-CG 3.29Å; K501-N505 PolarHBondContact O-N 3.23Å; K501-N505 PolarHBondContact O-ND2 3.37Å; K501-E525 WeakPolarHBondContact CE-OE1 3.12Å; K501-E525 IonicContact NZ-OE1 3.01Å; K501-E525 PolarHBondContact NZ-OE1 2.93Å; K501-L528 HydrophobicContact CB-CD1 4.15Å
502	E	93.2	Very high	93.3	Very high	98 Å²	98	37.3 Å²	37.3	46%	0.458	17%	0.174	S	C	.	.	H	α-helix	trans	-64.5	-45.8	178.6	-71	169.7	-171.8	0	0	111.8	Q498 T499 F500 N505 S506	Q498-E502 HydrophobicContact CG-CG 4.47Å; Q498-E502 VanDerWaalsContact CG-OE1 3.31Å; Q498-E502 WeakPolarHBondContact CG-OE1 3.19Å; Q498-E502 PolarHBondContact NE2-OE1 2.72Å; Q498-E502 WeakPolarHBondContact O-CG 3.24Å; Q498-E502 PolarHBondContact O-N 2.91Å; T499-E502 PolarHBondContact O-N 3.25Å; F500-E502 PolarHBondContact O-N 3.47Å; E502-N505 PolarHBondContact O-N 3.18Å; E502-S506 WeakPolarHBondContact O-CB 3.33Å; E502-S506 PolarHBondContact O-N 2.81Å
503	S	93.6	Very high	92.2	Very high	20 Å²	20	45.9 Å²	45.9	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-58.1	-47.1	175.5	-76	0	0	0	0	112.3	F429 T499 F500 N505 S506 L507	F429-S503 VanDerWaalsContact CD2-CB 3.48Å; F429-S503 WeakPolarHBondContact CE2-O 3.18Å; T499-S503 VanDerWaalsContact O-CB 3.25Å; T499-S503 WeakPolarHBondContact O-CB 3.43Å; T499-S503 PolarHBondContact O-N 2.79Å; T499-S503 PolarHBondContact O-OG 3.46Å; T499-S503 VanDerWaalsContact O-OG 3.11Å; F500-S503 PolarHBondContact O-N 3.13Å; S503-N505 PolarHBondContact O-N 3.11Å; S503-S506 WeakPolarHBondContact O-CB 3.27Å; S503-S506 PolarHBondContact O-N 3.43Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.31Å
504	I	92.9	Very high	91.1	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-45.6	177.5	-69.8	159.9	0	0	0	110.8	L455 M458 F500 S506 L507 K508 I524	L455-I504 HydrophobicContact CD2-CG2 3.73Å; M458-I504 HydrophobicContact CE-CD1 3.68Å; M458-I504 HydrophobicContact CE-CG1 3.86Å; M458-I504 HydrophobicContact CG-CD1 3.85Å; M458-I504 HydrophobicContact CG-CG1 4.27Å; F500-I504 WeakPolarHBondContact O-CB 3.44Å; F500-I504 WeakPolarHBondContact O-CD1 3.43Å; F500-I504 WeakPolarHBondContact O-CG1 3.29Å; F500-I504 PolarHBondContact O-N 3.11Å; I504-S506 VanDerWaalsContact C-N 3.28Å; I504-S506 PolarHBondContact O-N 3.39Å; I504-L507 PolarHBondContact O-N 2.99Å; I504-K508 HydrophobicContact CG2-CD 4.39Å; I504-K508 WeakPolarHBondContact O-CG 3.36Å; I504-K508 PolarHBondContact O-N 3.05Å; I504-I524 HydrophobicContact CD1-CG2 3.6Å
505	N	91.8	Very high	89.5	Confident	65 Å²	65	55.1 Å²	55.1	35%	0.348	27%	0.273	S	S	.	.	H	α-helix	trans	-65.2	-33.5	178.2	-72.8	-23.5	0	0	0	112.3	K501 E502 S503 K508 R509	K501-N505 WeakPolarHBondContact O-CB 3.31Å; K501-N505 VanDerWaalsContact O-CG 3.29Å; K501-N505 PolarHBondContact O-N 3.23Å; K501-N505 PolarHBondContact O-ND2 3.37Å; E502-N505 PolarHBondContact O-N 3.18Å; S503-N505 PolarHBondContact O-N 3.11Å; N505-K508 WeakPolarHBondContact OD1-CE 3.31Å; N505-R509 WeakPolarHBondContact O-CG 3.21Å; N505-R509 PolarHBondContact O-N 2.82Å; N505-R509 VanDerWaalsContact O-N 3.11Å; N505-R509 PolarHBondContact O-NE 3.06Å
506	S	92.6	Very high	88.4	Confident	45 Å²	45	61 Å²	61	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-64	-48.1	172.1	-169.6	0	0	0	0	111.7	E502 S503 I504 K508 R509 K510	E502-S506 WeakPolarHBondContact O-CB 3.33Å; E502-S506 PolarHBondContact O-N 2.81Å; S503-S506 WeakPolarHBondContact O-CB 3.27Å; S503-S506 PolarHBondContact O-N 3.43Å; I504-S506 VanDerWaalsContact C-N 3.28Å; I504-S506 PolarHBondContact O-N 3.39Å; S506-K508 PolarHBondContact O-N 3.28Å; S506-R509 PolarHBondContact O-N 3.15Å; S506-K510 WeakPolarHBondContact O-CB 3.2Å; S506-K510 PolarHBondContact O-N 3.26Å; S506-K510 VanDerWaalsContact O-N 3.08Å
507	L	91.7	Very high	87.3	Confident	5 Å²	5	66 Å²	66	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.4	-69.8	176.8	0	0	0	111.8	F429 F432 E433 L436 L451 S503 I504 R509 K510 Y511	F429-L507 HydrophobicContact CD2-CD1 4.07Å; F429-L507 HydrophobicContact CD2-CD2 3.97Å; F429-L507 HydrophobicContact CD2-CG 3.78Å; F429-L507 HydrophobicContact CE2-CD1 4.34Å; F429-L507 HydrophobicContact CE2-CD2 3.52Å; F429-L507 HydrophobicContact CE2-CG 3.54Å; F429-L507 HydrophobicContact CZ-CD2 4.14Å; F432-L507 HydrophobicContact CB-CD1 3.7Å; F432-L507 HydrophobicContact CD2-CD1 4.18Å; F432-L507 HydrophobicContact CG-CD1 4.32Å; E433-L507 HydrophobicContact CB-CD2 4.07Å; L436-L507 HydrophobicContact CD1-CD2 4.1Å; L451-L507 HydrophobicContact CD1-CB 4.45Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.31Å; I504-L507 PolarHBondContact O-N 2.99Å; L507-R509 PolarHBondContact O-N 2.83Å; L507-K510 PolarHBondContact O-N 2.77Å; L507-Y511 HydrophobicContact CD2-CD2 4.36Å; L507-Y511 HydrophobicContact CD2-CE2 4.17Å; L507-Y511 WeakPolarHBondContact O-CD2 3.4Å; L507-Y511 PolarHBondContact O-N 2.83Å
508	K	90.8	Very high	86.6	Confident	35 Å²	35	67 Å²	67	15%	0.152	34%	0.341	C	S	.	.	H	α-helix	trans	-59.5	-47.3	179.1	-71.7	-170.4	-63.2	-173.2	0	111.8	L455 I504 N505 S506 K510 Y511 S512 F518 D521	L455-K508 HydrophobicContact CD1-CD 4.15Å; L455-K508 HydrophobicContact CD1-CG 4.3Å; L455-K508 HydrophobicContact CD2-CG 4.5Å; I504-K508 HydrophobicContact CG2-CD 4.39Å; I504-K508 WeakPolarHBondContact O-CG 3.36Å; I504-K508 PolarHBondContact O-N 3.05Å; N505-K508 WeakPolarHBondContact OD1-CE 3.31Å; S506-K508 PolarHBondContact O-N 3.28Å; K508-K510 VanDerWaalsContact C-N 3.27Å; K508-K510 PolarHBondContact O-N 3.22Å; K508-Y511 PolarHBondContact O-N 3.39Å; K508-S512 WeakPolarHBondContact O-CA 3.36Å; K508-S512 VanDerWaalsContact O-CB 3.26Å; K508-S512 WeakPolarHBondContact O-CB 3.48Å; K508-S512 PolarHBondContact O-N 3.42Å; K508-F518 HydrophobicContact CD-CD2 3.76Å; K508-F518 HydrophobicContact CD-CE2 3.94Å; K508-F518 HydrophobicContact CG-CD2 4.39Å; K508-F518 HydrophobicContact CG-CE2 4.12Å; K508-D521 IonicContact NZ-OD1 3.76Å; K508-D521 PolarHBondContact NZ-OD1 3.16Å; K508-D521 IonicContact NZ-OD2 2.7Å; K508-D521 PolarHBondContact NZ-OD2 3.1Å
509	R	89.7	Confident	85.9	Confident	200 Å²	200	72.7 Å²	72.7	76%	0.755	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-33.2	177.7	-75.7	-174	-66.2	166	-1.3	113.4	N505 S506 L507	N505-R509 WeakPolarHBondContact O-CG 3.21Å; N505-R509 PolarHBondContact O-N 2.82Å; N505-R509 VanDerWaalsContact O-N 3.11Å; N505-R509 PolarHBondContact O-NE 3.06Å; S506-R509 PolarHBondContact O-N 3.15Å; L507-R509 PolarHBondContact O-N 2.83Å
510	K	89.8	Confident	85.5	Confident	116 Å²	116	73 Å²	73	50%	0.504	38%	0.376	S	S	.	.	H	α-helix	trans	-81.6	-36.3	-177.3	-170.1	176	178.9	-157.3	0	112.8	E433 S506 L507 K508	E433-K510 IonicContact OE1-NZ 3.01Å; E433-K510 PolarHBondContact OE1-NZ 2.86Å; S506-K510 WeakPolarHBondContact O-CB 3.2Å; S506-K510 PolarHBondContact O-N 3.26Å; S506-K510 VanDerWaalsContact O-N 3.08Å; L507-K510 PolarHBondContact O-N 2.77Å; K508-K510 VanDerWaalsContact C-N 3.27Å; K508-K510 PolarHBondContact O-N 3.22Å
511	Y	88.3	Confident	85	Confident	15 Å²	15	74.1 Å²	74.1	6%	0.059	38%	0.382	C	S	.	.	H	α-helix	trans	-113.1	-10	-169.6	-64.9	-84.6	0	0	0	114.9	E433 L436 A440 K447 L507 K508	E433-Y511 HydrophobicContact CG-CE2 4.47Å; L436-Y511 HydrophobicContact CB-CD1 3.85Å; L436-Y511 HydrophobicContact CB-CD2 4.15Å; L436-Y511 HydrophobicContact CB-CE1 3.7Å; L436-Y511 HydrophobicContact CB-CE2 3.99Å; L436-Y511 HydrophobicContact CB-CG 4.11Å; L436-Y511 HydrophobicContact CD1-CD2 3.94Å; L436-Y511 HydrophobicContact CD1-CE2 4.27Å; L436-Y511 HydrophobicContact CD1-CG 4.26Å; A440-Y511 HydrophobicContact CB-CE1 4.38Å; K447-Y511 HydrophobicContact CD-CD1 3.92Å; K447-Y511 WeakPolarHBondContact CE-O 3.42Å; K447-Y511 HydrophobicContact CG-CD1 3.98Å; K447-Y511 PolarHBondContact NZ-O 2.84Å; L507-Y511 HydrophobicContact CD2-CD2 4.36Å; L507-Y511 HydrophobicContact CD2-CE2 4.17Å; L507-Y511 WeakPolarHBondContact O-CD2 3.4Å; L507-Y511 PolarHBondContact O-N 2.83Å; K508-Y511 PolarHBondContact O-N 3.39Å
512	S	85.8	Confident	84.8	Confident	15 Å²	15	72.7 Å²	72.7	11%	0.105	39%	0.387	C	S	.	.			trans	-113.1	140.5	173.2	-173.6	0	0	0	0	111.4	K508 S514	K508-S512 WeakPolarHBondContact O-CA 3.36Å; K508-S512 VanDerWaalsContact O-CB 3.26Å; K508-S512 WeakPolarHBondContact O-CB 3.48Å; K508-S512 PolarHBondContact O-N 3.42Å; S512-S514 PolarHBondContact OG-N 2.95Å; S512-S514 PolarHBondContact OG-O 2.94Å
513	Q	74.6	Confident	84.8	Confident	180 Å²	180	68.9 Å²	68.9	84%	0.841	37%	0.372	S	S	*	.			trans	-96.8	-15	168.3	-66.6	179.4	-1.6	0	0	112.3
514	S	72.9	Confident	84.8	Confident	53 Å²	53	68.2 Å²	68.2	37%	0.371	37%	0.367	S	S	.	.			trans	-75.3	137.6	177.3	-177.1	0	0	0	0	110.9	S512 D516	S512-S514 PolarHBondContact OG-N 2.95Å; S512-S514 PolarHBondContact OG-O 2.94Å; S514-D516 VanDerWaalsContact C-N 3.33Å; S514-D516 WeakPolarHBondContact OG-CB 3.48Å; S514-D516 PolarHBondContact OG-N 3.45Å
515	V	64.7	Low	84.9	Confident	141 Å²	141	73.1 Å²	73.1	86%	0.855	39%	0.39	S	S	*	.			trans	-85.6	-14.2	171.4	-173.7	0	0	0	0	110.7
516	D	72.9	Confident	85	Confident	122 Å²	122	76.6 Å²	76.6	65%	0.652	40%	0.398	S	S	*	.	S	Bend	trans	-69.8	137.9	-176.1	-65.7	-33.6	0	0	0	111.3	S514	S514-D516 VanDerWaalsContact C-N 3.33Å; S514-D516 WeakPolarHBondContact OG-CB 3.48Å; S514-D516 PolarHBondContact OG-N 3.45Å
517	P	74.1	Confident	85.2	Confident	106 Å²	106	74.6 Å²	74.6	69%	0.688	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-61.2	139.8	175.8	-18.4	29.7	0	0	0	111.3
518	F	80.3	Confident	85.4	Confident	25 Å²	25	74.9 Å²	74.9	11%	0.11	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-76.1	151	170.5	-66.6	-85.7	0	0	0	110.4	L451 K452 L455 K508 S520 D521	L451-F518 HydrophobicContact CD2-CE2 4.32Å; L451-F518 HydrophobicContact CD2-CZ 3.92Å; K452-F518 HydrophobicContact CD-CD1 4.46Å; K452-F518 HydrophobicContact CD-CE1 4.32Å; K452-F518 HydrophobicContact CG-CD1 3.7Å; K452-F518 HydrophobicContact CG-CE1 3.64Å; L455-F518 HydrophobicContact CD1-CB 3.96Å; L455-F518 HydrophobicContact CD1-CD1 4.26Å; L455-F518 HydrophobicContact CD1-CD2 3.61Å; L455-F518 HydrophobicContact CD1-CE2 4.14Å; L455-F518 HydrophobicContact CD1-CG 3.67Å; K508-F518 HydrophobicContact CD-CD2 3.76Å; K508-F518 HydrophobicContact CD-CE2 3.94Å; K508-F518 HydrophobicContact CG-CD2 4.39Å; K508-F518 HydrophobicContact CG-CE2 4.12Å; F518-S520 PolarHBondContact O-N 3.28Å; F518-D521 PolarHBondContact N-OD2 2.92Å; F518-D521 VanDerWaalsContact O-CB 3.29Å; F518-D521 WeakPolarHBondContact O-CB 3.44Å; F518-D521 PolarHBondContact O-N 3.37Å
519	D	80.2	Confident	85.7	Confident	166 Å²	166	75 Å²	75	89%	0.888	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-31.8	177.5	-64.1	-28.7	0	0	0	113.4
520	S	84.9	Confident	86	Confident	26 Å²	26	68.3 Å²	68.3	18%	0.182	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-13.2	179.8	-60.7	0	0	0	0	113.9	F518 A523 I524	F518-S520 PolarHBondContact O-N 3.28Å; S520-A523 PolarHBondContact O-N 3.17Å; S520-I524 VanDerWaalsContact O-CG1 3.28Å; S520-I524 WeakPolarHBondContact O-CG1 3.4Å; S520-I524 PolarHBondContact O-N 2.6Å
521	D	86.9	Confident	86.4	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.134	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-49.9	-173.5	-79.8	-19.2	0	0	0	111.8	K508 F518 A523 I524 E525	K508-D521 IonicContact NZ-OD1 3.76Å; K508-D521 PolarHBondContact NZ-OD1 3.16Å; K508-D521 IonicContact NZ-OD2 2.7Å; K508-D521 PolarHBondContact NZ-OD2 3.1Å; F518-D521 PolarHBondContact N-OD2 2.92Å; F518-D521 VanDerWaalsContact O-CB 3.29Å; F518-D521 WeakPolarHBondContact O-CB 3.44Å; F518-D521 PolarHBondContact O-N 3.37Å; D521-A523 PolarHBondContact O-N 3.39Å; D521-I524 PolarHBondContact O-N 3.28Å; D521-E525 WeakPolarHBondContact O-CB 3.48Å; D521-E525 PolarHBondContact O-N 2.99Å
522	A	89.8	Confident	86.8	Confident	60 Å²	60	63 Å²	63	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-30.6	178.1	0	0	0	0	0	112.3	R526	A522-R526 VanDerWaalsContact O-CB 3.25Å; A522-R526 WeakPolarHBondContact O-CB 3.37Å; A522-R526 PolarHBondContact O-N 3.32Å; A522-R526 VanDerWaalsContact O-N 3.14Å
523	A	92.7	Very high	87.2	Confident	19 Å²	19	69.5 Å²	69.5	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-72.9	-43.2	177.3	0	0	0	0	0	112.3	N459 S520 D521 T527	N459-A523 VanDerWaalsContact OD1-C 3.28Å; N459-A523 WeakPolarHBondContact OD1-CB 3.29Å; N459-A523 PolarHBondContact OD1-O 3.35Å; S520-A523 PolarHBondContact O-N 3.17Å; D521-A523 PolarHBondContact O-N 3.39Å; A523-T527 WeakPolarHBondContact O-CB 3.28Å; A523-T527 PolarHBondContact O-N 3.04Å; A523-T527 PolarHBondContact O-OG1 3.08Å
524	I	94.6	Very high	88.3	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.026	35%	0.348	C	S	.	.	H	α-helix	trans	-65.6	-46.9	177	-66	163.6	0	0	0	110.3	L455 M458 N459 L462 I504 S520 D521 R526 T527 L528	L455-I524 HydrophobicContact CB-CD1 4.26Å; L455-I524 HydrophobicContact CD2-CD1 4.29Å; M458-I524 HydrophobicContact CB-CD1 4.47Å; M458-I524 HydrophobicContact CG-CD1 4.49Å; N459-I524 HydrophobicContact CB-CG1 3.79Å; N459-I524 PolarHBondContact OD1-N 2.9Å; L462-I524 HydrophobicContact CD1-CB 4.42Å; L462-I524 HydrophobicContact CD1-CG2 3.56Å; I504-I524 HydrophobicContact CD1-CG2 3.6Å; S520-I524 VanDerWaalsContact O-CG1 3.28Å; S520-I524 WeakPolarHBondContact O-CG1 3.4Å; S520-I524 PolarHBondContact O-N 2.6Å; D521-I524 PolarHBondContact O-N 3.28Å; I524-R526 VanDerWaalsContact C-N 3.32Å; I524-R526 PolarHBondContact O-N 3.38Å; I524-T527 PolarHBondContact O-N 2.89Å; I524-L528 HydrophobicContact CG2-CD1 3.76Å; I524-L528 HydrophobicContact CG2-CG 4.23Å; I524-L528 WeakPolarHBondContact O-CB 3.5Å; I524-L528 WeakPolarHBondContact O-CG 3.45Å; I524-L528 PolarHBondContact O-N 3.47Å
525	E	94	Very high	89.4	Confident	112 Å²	112	60.2 Å²	60.2	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-40.5	-179.9	-174.9	158.7	-143	0	0	111.9	K501 D521 G529	K501-E525 WeakPolarHBondContact CE-OE1 3.12Å; K501-E525 IonicContact NZ-OE1 3.01Å; K501-E525 PolarHBondContact NZ-OE1 2.93Å; D521-E525 WeakPolarHBondContact O-CB 3.48Å; D521-E525 PolarHBondContact O-N 2.99Å; E525-G529 PolarHBondContact O-N 2.83Å
526	R	94.9	Very high	91	Very high	137 Å²	137	54.2 Å²	54.2	52%	0.517	29%	0.294	S	S	.	.	H	α-helix	trans	-61	-49.7	172.8	-172	-171.1	-48.6	99.6	9.8	111.9	A522 I524 L528 G529 E530	A522-R526 VanDerWaalsContact O-CB 3.25Å; A522-R526 WeakPolarHBondContact O-CB 3.37Å; A522-R526 PolarHBondContact O-N 3.32Å; A522-R526 VanDerWaalsContact O-N 3.14Å; I524-R526 VanDerWaalsContact C-N 3.32Å; I524-R526 PolarHBondContact O-N 3.38Å; R526-L528 PolarHBondContact O-N 3.34Å; R526-G529 PolarHBondContact O-N 3.18Å; R526-E530 WeakPolarHBondContact CG-OE1 3.38Å; R526-E530 WeakPolarHBondContact O-CG 3.48Å; R526-E530 PolarHBondContact O-N 3.37Å
527	T	95.8	Very high	92.1	Very high	4 Å²	4	52.9 Å²	52.9	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-43	-177	-50.6	0	0	0	0	111.5	L462 M463 A523 I524 G529 E530 V531	L462-T527 HydrophobicContact CB-CG2 3.78Å; M463-T527 HydrophobicContact CG-CG2 4.24Å; M463-T527 HydrophobicContact SD-CG2 3.64Å; A523-T527 WeakPolarHBondContact O-CB 3.28Å; A523-T527 PolarHBondContact O-N 3.04Å; A523-T527 PolarHBondContact O-OG1 3.08Å; I524-T527 PolarHBondContact O-N 2.89Å; T527-G529 VanDerWaalsContact C-N 3.35Å; T527-G529 PolarHBondContact O-N 2.84Å; T527-E530 PolarHBondContact O-N 2.87Å; T527-V531 WeakPolarHBondContact O-CG2 3.37Å; T527-V531 PolarHBondContact O-N 3.42Å
528	L	96.7	Very high	93.1	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-43.5	174.1	-70.8	171.8	0	0	0	111.4	L462 C497 F500 K501 I524 R526 E530 V531 V532	L462-L528 HydrophobicContact CD1-CD1 4.39Å; L462-L528 HydrophobicContact CD1-CD2 3.86Å; L462-L528 HydrophobicContact CD1-CG 3.88Å; L462-L528 HydrophobicContact CD2-CD2 3.66Å; L462-L528 HydrophobicContact CG-CD2 4.38Å; C497-L528 HydrophobicContact CB-CD2 3.96Å; F500-L528 HydrophobicContact CB-CD2 4.01Å; F500-L528 HydrophobicContact CD2-CD2 4.31Å; K501-L528 HydrophobicContact CB-CD1 4.15Å; I524-L528 HydrophobicContact CG2-CD1 3.76Å; I524-L528 HydrophobicContact CG2-CG 4.23Å; I524-L528 WeakPolarHBondContact O-CB 3.5Å; I524-L528 WeakPolarHBondContact O-CG 3.45Å; I524-L528 PolarHBondContact O-N 3.47Å; R526-L528 PolarHBondContact O-N 3.34Å; L528-E530 VanDerWaalsContact C-N 3.33Å; L528-E530 PolarHBondContact O-N 3.38Å; L528-V531 PolarHBondContact O-N 3.24Å; L528-V532 WeakPolarHBondContact O-CG2 3.48Å; L528-V532 PolarHBondContact O-N 3.22Å
529	G	95.9	Very high	93.9	Very high	38 Å²	38	47.6 Å²	47.6	39%	0.392	25%	0.25	S	C	.	.	H	α-helix	trans	-62.2	-38.7	176.2	0	0	0	0	0	113	E525 R526 T527 K533	E525-G529 PolarHBondContact O-N 2.83Å; R526-G529 PolarHBondContact O-N 3.18Å; T527-G529 VanDerWaalsContact C-N 3.35Å; T527-G529 PolarHBondContact O-N 2.84Å; G529-K533 VanDerWaalsContact O-CB 3.27Å; G529-K533 WeakPolarHBondContact O-CB 3.2Å; G529-K533 PolarHBondContact O-N 3.2Å
530	E	96.7	Very high	94.7	Very high	59 Å²	59	39.9 Å²	39.9	28%	0.276	21%	0.209	S	C	.	.	H	α-helix	trans	-63.9	-45.8	174.8	-74.2	172.2	-171.6	0	0	111.6	R466 R526 T527 L528 V532 K533 E534	R466-E530 IonicContact CZ-OE2 2.76Å; R466-E530 VanDerWaalsContact CZ-OE2 3.24Å; R466-E530 IonicContact NE-OE2 2.89Å; R466-E530 IonicContact NH1-OE2 2.81Å; R466-E530 PolarHBondContact NH1-OE2 3.35Å; R466-E530 IonicContact NH2-OE2 3.79Å; R526-E530 WeakPolarHBondContact CG-OE1 3.38Å; R526-E530 WeakPolarHBondContact O-CG 3.48Å; R526-E530 PolarHBondContact O-N 3.37Å; T527-E530 PolarHBondContact O-N 2.87Å; L528-E530 VanDerWaalsContact C-N 3.33Å; L528-E530 PolarHBondContact O-N 3.38Å; E530-V532 PolarHBondContact O-N 2.89Å; E530-K533 PolarHBondContact O-N 3.31Å; E530-E534 WeakPolarHBondContact O-CB 3.38Å; E530-E534 VanDerWaalsContact O-CG 3.31Å; E530-E534 WeakPolarHBondContact O-CG 3.38Å; E530-E534 PolarHBondContact O-N 2.9Å
531	V	97.1	Very high	95.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-44.4	176.9	177	0	0	0	0	111.5	Y465 R466 V469 I493 C497 T527 L528 G535	Y465-V531 HydrophobicContact CD1-CG1 4.3Å; Y465-V531 HydrophobicContact CE1-CG1 4.23Å; R466-V531 HydrophobicContact CB-CG2 3.54Å; R466-V531 HydrophobicContact CG-CG2 3.82Å; V469-V531 HydrophobicContact CG2-CG1 4.5Å; I493-V531 HydrophobicContact CG2-CG1 4.14Å; C497-V531 VanDerWaalsContact SG-CG1 3.53Å; T527-V531 WeakPolarHBondContact O-CG2 3.37Å; T527-V531 PolarHBondContact O-N 3.42Å; L528-V531 PolarHBondContact O-N 3.24Å; V531-G535 PolarHBondContact O-N 3.21Å
532	V	97	Very high	95.5	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-48.7	176.8	168	0	0	0	0	110.6	V494 C497 L528 E530 E534 G535 C536 F587	V494-V532 HydrophobicContact CG1-CG1 4.25Å; V494-V532 HydrophobicContact CG1-CG2 4.47Å; C497-V532 HydrophobicContact CB-CG2 3.48Å; C497-V532 VanDerWaalsContact CB-CG2 3.48Å; L528-V532 WeakPolarHBondContact O-CG2 3.48Å; L528-V532 PolarHBondContact O-N 3.22Å; E530-V532 PolarHBondContact O-N 2.89Å; V532-E534 PolarHBondContact O-N 3.33Å; V532-G535 PolarHBondContact O-N 3.23Å; V532-C536 WeakPolarHBondContact O-CB 3.34Å; V532-C536 PolarHBondContact O-N 3.45Å; V532-C536 PolarHBondContact O-SG 3.04Å; V532-C536 VanDerWaalsContact O-SG 3.4Å; V532-F587 HydrophobicContact CG1-CB 4.43Å; V532-F587 HydrophobicContact CG1-CD1 3.54Å; V532-F587 HydrophobicContact CG1-CE1 3.83Å; V532-F587 HydrophobicContact CG1-CG 3.94Å; V532-F587 HydrophobicContact CG1-CZ 4.44Å; V532-F587 HydrophobicContact CG2-CE1 4.17Å; V532-F587 HydrophobicContact CG2-CE2 4.44Å; V532-F587 HydrophobicContact CG2-CZ 4.07Å
533	K	95.7	Very high	95.8	Very high	151 Å²	151	36.8 Å²	36.8	66%	0.657	18%	0.182	S	C	*	.	H	α-helix	trans	-61.2	-46.9	-179.3	-176.8	-177.6	176.8	-175.7	0	111.6	G529 E530 Q537	G529-K533 VanDerWaalsContact O-CB 3.27Å; G529-K533 WeakPolarHBondContact O-CB 3.2Å; G529-K533 PolarHBondContact O-N 3.2Å; E530-K533 PolarHBondContact O-N 3.31Å; K533-Q537 VanDerWaalsContact O-CB 3.32Å; K533-Q537 WeakPolarHBondContact O-CB 3.36Å; K533-Q537 PolarHBondContact O-N 2.86Å
534	E	96.7	Very high	96	Very high	38 Å²	38	36.4 Å²	36.4	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-46.2	178.3	-74	174.7	174.2	0	0	111.4	R466 E530 V532 C536 Q537 F538	R466-E534 WeakPolarHBondContact CG-OE2 3.49Å; R466-E534 IonicContact CZ-OE1 3.55Å; R466-E534 VanDerWaalsContact CZ-OE1 3.31Å; R466-E534 IonicContact CZ-OE2 2.81Å; R466-E534 IonicContact NE-OE1 3Å; R466-E534 PolarHBondContact NE-OE1 3.26Å; R466-E534 IonicContact NE-OE2 3.78Å; R466-E534 PolarHBondContact NE-OE2 2.89Å; R466-E534 IonicContact NH2-OE1 3.72Å; R466-E534 PolarHBondContact NH2-OE1 3.21Å; R466-E534 IonicContact NH2-OE2 3.41Å; E530-E534 WeakPolarHBondContact O-CB 3.38Å; E530-E534 VanDerWaalsContact O-CG 3.31Å; E530-E534 WeakPolarHBondContact O-CG 3.38Å; E530-E534 PolarHBondContact O-N 2.9Å; V532-E534 PolarHBondContact O-N 3.33Å; E534-C536 PolarHBondContact O-N 3.41Å; E534-Q537 CarbonylContact O-C 3.55Å; E534-Q537 WeakPolarHBondContact O-CB 3.26Å; E534-Q537 PolarHBondContact O-N 3.38Å; E534-Q537 VanDerWaalsContact O-N 3.13Å; E534-F538 HydrophobicContact CB-CE1 4.44Å; E534-F538 HydrophobicContact CB-CE2 3.93Å; E534-F538 HydrophobicContact CB-CZ 3.83Å; E534-F538 HydrophobicContact CG-CZ 4.44Å; E534-F538 WeakPolarHBondContact O-CD1 3.3Å; E534-F538 VanDerWaalsContact O-CD2 3.28Å; E534-F538 WeakPolarHBondContact O-CD2 3.44Å; E534-F538 WeakPolarHBondContact O-CG 3.25Å; E534-F538 PolarHBondContact O-N 3.5Å
535	G	96.8	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-45.9	177.8	0	0	0	0	0	113	V531 V532 Q537 F538 L539	V531-G535 PolarHBondContact O-N 3.21Å; V532-G535 PolarHBondContact O-N 3.23Å; G535-Q537 VanDerWaalsContact C-N 3.32Å; G535-Q537 PolarHBondContact O-N 3.42Å; G535-F538 PolarHBondContact O-N 2.91Å; G535-L539 WeakPolarHBondContact O-CG 3.45Å; G535-L539 PolarHBondContact O-N 2.77Å
536	C	96.5	Very high	96	Very high	14 Å²	14	37 Å²	37	10%	0.095	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-39.5	173.1	-72.4	0	0	0	0	111.9	V532 E534 L539 L540 M591	V532-C536 WeakPolarHBondContact O-CB 3.34Å; V532-C536 PolarHBondContact O-N 3.45Å; V532-C536 PolarHBondContact O-SG 3.04Å; V532-C536 VanDerWaalsContact O-SG 3.4Å; E534-C536 PolarHBondContact O-N 3.41Å; C536-L539 PolarHBondContact O-N 2.91Å; C536-L540 WeakPolarHBondContact O-CG 3.43Å; C536-L540 PolarHBondContact O-N 3.5Å; C536-M591 HydrophobicContact CB-CB 4.38Å; C536-M591 HydrophobicContact CB-CG 4.26Å; C536-M591 HydrophobicContact CB-SD 4.1Å
537	Q	96.1	Very high	96	Very high	95 Å²	95	30.4 Å²	30.4	44%	0.444	16%	0.158	S	C	.	.	H	α-helix	trans	-64	-42	175.6	-176.6	177.9	-11.9	0	0	111.7	K533 E534 G535 L540 D541	K533-Q537 VanDerWaalsContact O-CB 3.32Å; K533-Q537 WeakPolarHBondContact O-CB 3.36Å; K533-Q537 PolarHBondContact O-N 2.86Å; E534-Q537 CarbonylContact O-C 3.55Å; E534-Q537 WeakPolarHBondContact O-CB 3.26Å; E534-Q537 PolarHBondContact O-N 3.38Å; E534-Q537 VanDerWaalsContact O-N 3.13Å; G535-Q537 VanDerWaalsContact C-N 3.32Å; G535-Q537 PolarHBondContact O-N 3.42Å; Q537-L540 PolarHBondContact O-N 3.08Å; Q537-D541 VanDerWaalsContact O-CG 3.26Å; Q537-D541 PolarHBondContact O-N 3.33Å
538	F	96.6	Very high	96	Very high	18 Å²	18	35.5 Å²	35.5	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-39.1	178	-58.3	-24.9	0	0	0	112.2	V469 V470 K473 M490 E534 G535 D541 E542	V469-F538 HydrophobicContact CG1-CE2 4.33Å; V470-F538 HydrophobicContact CG2-CE2 4.41Å; V470-F538 HydrophobicContact CG2-CZ 4.21Å; K473-F538 HydrophobicContact CB-CD2 3.83Å; K473-F538 HydrophobicContact CB-CE2 4.06Å; K473-F538 HydrophobicContact CB-CG 4.13Å; K473-F538 HydrophobicContact CD-CD1 4.26Å; K473-F538 HydrophobicContact CD-CE1 4.28Å; K473-F538 HydrophobicContact CG-CB 4.12Å; K473-F538 HydrophobicContact CG-CD1 3.87Å; K473-F538 HydrophobicContact CG-CD2 3.95Å; K473-F538 HydrophobicContact CG-CE1 4.25Å; K473-F538 HydrophobicContact CG-CE2 4.32Å; K473-F538 HydrophobicContact CG-CG 3.71Å; K473-F538 HydrophobicContact CG-CZ 4.46Å; M490-F538 HydrophobicContact CE-CB 4.27Å; M490-F538 HydrophobicContact CE-CD2 3.87Å; M490-F538 HydrophobicContact SD-CD2 4.24Å; E534-F538 HydrophobicContact CB-CE1 4.44Å; E534-F538 HydrophobicContact CB-CE2 3.93Å; E534-F538 HydrophobicContact CB-CZ 3.83Å; E534-F538 HydrophobicContact CG-CZ 4.44Å; E534-F538 WeakPolarHBondContact O-CD1 3.3Å; E534-F538 VanDerWaalsContact O-CD2 3.28Å; E534-F538 WeakPolarHBondContact O-CD2 3.44Å; E534-F538 WeakPolarHBondContact O-CG 3.25Å; E534-F538 PolarHBondContact O-N 3.5Å; G535-F538 PolarHBondContact O-N 2.91Å; F538-D541 PolarHBondContact O-N 3.4Å; F538-E542 PolarHBondContact O-N 3.01Å
539	L	96.5	Very high	95.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-45.5	172.1	-72.2	173.9	0	0	0	111.5	I487 M490 I491 G535 C536 E542 V543 F580 M591	I487-L539 HydrophobicContact CB-CD2 4.5Å; I487-L539 HydrophobicContact CG2-CD2 4.08Å; M490-L539 HydrophobicContact CB-CD2 3.8Å; M490-L539 HydrophobicContact CB-CG 4.29Å; M490-L539 HydrophobicContact CG-CD1 4.32Å; M490-L539 HydrophobicContact CG-CD2 3.77Å; M490-L539 HydrophobicContact CG-CG 3.71Å; I491-L539 HydrophobicContact CG1-CD1 3.87Å; I491-L539 HydrophobicContact CG1-CD2 4.3Å; G535-L539 WeakPolarHBondContact O-CG 3.45Å; G535-L539 PolarHBondContact O-N 2.77Å; C536-L539 PolarHBondContact O-N 2.91Å; L539-E542 PolarHBondContact O-N 2.99Å; L539-V543 PolarHBondContact O-N 3.48Å; L539-F580 HydrophobicContact CB-CE1 4.31Å; L539-F580 HydrophobicContact CB-CE2 4.4Å; L539-F580 HydrophobicContact CB-CZ 3.93Å; L539-F580 HydrophobicContact CD2-CE1 3.98Å; L539-F580 HydrophobicContact CD2-CZ 4.38Å; L539-M591 HydrophobicContact CB-SD 4.14Å; L539-M591 HydrophobicContact CD1-SD 4.08Å
540	L	96.4	Very high	95.7	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-38	176.2	-68.9	-179.3	0	0	0	112.2	C536 Q537 E542 V543 F544 F577 M591 E594 A595	C536-L540 WeakPolarHBondContact O-CG 3.43Å; C536-L540 PolarHBondContact O-N 3.5Å; Q537-L540 PolarHBondContact O-N 3.08Å; L540-E542 VanDerWaalsContact C-N 3.26Å; L540-E542 PolarHBondContact O-N 3.07Å; L540-V543 WeakPolarHBondContact O-CB 3.35Å; L540-V543 PolarHBondContact O-N 3.4Å; L540-V543 VanDerWaalsContact O-N 3.1Å; L540-F544 VanDerWaalsContact O-CD2 3.28Å; L540-F544 WeakPolarHBondContact O-CD2 3.17Å; L540-F544 PolarHBondContact O-N 3.16Å; L540-F577 HydrophobicContact CD2-CE2 4.3Å; L540-F577 HydrophobicContact CD2-CZ 4.06Å; L540-M591 HydrophobicContact CD1-CG 3.98Å; L540-M591 HydrophobicContact CD2-CG 3.77Å; L540-M591 HydrophobicContact CG-CG 3.78Å; L540-M591 HydrophobicContact CG-SD 4.47Å; L540-E594 HydrophobicContact CD1-CB 4Å; L540-E594 HydrophobicContact CD1-CG 3.99Å; L540-A595 HydrophobicContact CD2-CB 3.72Å
541	D	95.5	Very high	95.5	Very high	35 Å²	35	37.3 Å²	37.3	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-58.2	-39.2	178	-75	-23.9	0	0	0	111.8	Q537 F538 V543 F544 L545 R598	Q537-D541 VanDerWaalsContact O-CG 3.26Å; Q537-D541 PolarHBondContact O-N 3.33Å; F538-D541 PolarHBondContact O-N 3.4Å; D541-V543 PolarHBondContact O-N 3.47Å; D541-F544 PolarHBondContact O-N 2.9Å; D541-L545 WeakPolarHBondContact O-CB 3.25Å; D541-L545 VanDerWaalsContact O-CG 3.24Å; D541-L545 WeakPolarHBondContact O-CG 3.26Å; D541-L545 PolarHBondContact O-N 3.13Å; D541-R598 IonicContact OD1-CZ 3.71Å; D541-R598 VanDerWaalsContact OD1-CZ 3.31Å; D541-R598 IonicContact OD1-NH1 3.16Å; D541-R598 PolarHBondContact OD1-NH1 3.43Å; D541-R598 IonicContact OD1-NH2 2.78Å; D541-R598 PolarHBondContact OD1-NH2 3.27Å
542	E	94.7	Very high	95.3	Very high	8 Å²	8	41 Å²	41	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-45	172.9	-74.4	-53.2	130.8	0	0	112.6	H476 R480 Y486 F538 L539 L540 F544 L545 D546	H476-E542 IonicContact CD2-OE1 3.04Å; H476-E542 PolarHBondContact CD2-OE1 3.3Å; H476-E542 IonicContact NE2-OE1 2.7Å; H476-E542 IonicContact NE2-OE2 2.79Å; R480-E542 IonicContact CZ-OE2 3.92Å; R480-E542 VanDerWaalsContact CZ-OE2 3.28Å; R480-E542 IonicContact NE-OE1 3.58Å; R480-E542 IonicContact NE-OE2 3.45Å; R480-E542 PolarHBondContact NE-OE2 2.78Å; R480-E542 IonicContact NH2-OE2 2.84Å; R480-E542 PolarHBondContact NH2-OE2 3.37Å; Y486-E542 HydrophobicContact CD1-CG 4.36Å; Y486-E542 HydrophobicContact CE1-CG 3.85Å; F538-E542 PolarHBondContact O-N 3.01Å; L539-E542 PolarHBondContact O-N 2.99Å; L540-E542 VanDerWaalsContact C-N 3.26Å; L540-E542 PolarHBondContact O-N 3.07Å; E542-F544 VanDerWaalsContact C-N 3.33Å; E542-F544 PolarHBondContact O-N 3.3Å; E542-L545 PolarHBondContact O-N 3.18Å; E542-D546 PolarHBondContact O-N 3.39Å
543	V	95.7	Very high	95	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-48.6	175.7	-172.6	0	0	0	0	110.2	L539 L540 D541 L545 D546 L547 V573 Y576 F580	L539-V543 PolarHBondContact O-N 3.48Å; L540-V543 WeakPolarHBondContact O-CB 3.35Å; L540-V543 PolarHBondContact O-N 3.4Å; L540-V543 VanDerWaalsContact O-N 3.1Å; D541-V543 PolarHBondContact O-N 3.47Å; V543-L545 PolarHBondContact O-N 2.96Å; V543-D546 PolarHBondContact O-N 3.13Å; V543-L547 HydrophobicContact CG1-CD1 3.86Å; V543-L547 HydrophobicContact CG1-CG 4.36Å; V543-L547 VanDerWaalsContact O-CG 3.25Å; V543-L547 WeakPolarHBondContact O-CG 3.4Å; V543-L547 PolarHBondContact O-N 3.41Å; V543-L547 VanDerWaalsContact O-N 3.12Å; V543-V573 HydrophobicContact CG1-CG2 4.22Å; V543-Y576 HydrophobicContact CB-CD2 4.28Å; V543-Y576 HydrophobicContact CB-CG 4.43Å; V543-Y576 HydrophobicContact CG1-CD2 3.96Å; V543-Y576 HydrophobicContact CG1-CG 4.35Å; V543-Y576 HydrophobicContact CG2-CD1 3.87Å; V543-Y576 HydrophobicContact CG2-CD2 3.98Å; V543-Y576 HydrophobicContact CG2-CE1 4.4Å; V543-Y576 HydrophobicContact CG2-CG 3.63Å; V543-F580 HydrophobicContact CG2-CE2 3.83Å; V543-F580 HydrophobicContact CG2-CZ 3.82Å
544	F	95.7	Very high	94.9	Very high	12 Å²	12	34.5 Å²	34.5	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-74.8	-24	-174.3	-81.7	-89.5	0	0	0	114.2	L540 D541 E542 D546 L547 E548 L551 R598 V599	L540-F544 VanDerWaalsContact O-CD2 3.28Å; L540-F544 WeakPolarHBondContact O-CD2 3.17Å; L540-F544 PolarHBondContact O-N 3.16Å; D541-F544 PolarHBondContact O-N 2.9Å; E542-F544 VanDerWaalsContact C-N 3.33Å; E542-F544 PolarHBondContact O-N 3.3Å; F544-D546 VanDerWaalsContact C-N 3.34Å; F544-L547 HydrophobicContact CD1-CD1 4.49Å; F544-L547 PolarHBondContact O-N 2.93Å; F544-E548 PolarHBondContact O-N 3.48Å; F544-E548 VanDerWaalsContact O-N 3.07Å; F544-L551 HydrophobicContact CD1-CD1 3.79Å; F544-L551 HydrophobicContact CE1-CD1 4.15Å; F544-R598 HydrophobicContact CD1-CG 3.96Å; F544-R598 HydrophobicContact CD2-CG 4.27Å; F544-R598 HydrophobicContact CE1-CB 3.97Å; F544-R598 HydrophobicContact CE1-CG 3.48Å; F544-R598 VanDerWaalsContact CE1-CG 3.48Å; F544-R598 HydrophobicContact CE2-CB 3.94Å; F544-R598 VanDerWaalsContact CE2-CD 3.44Å; F544-R598 HydrophobicContact CE2-CG 3.85Å; F544-R598 HydrophobicContact CG-CG 4.33Å; F544-R598 VanDerWaalsContact CG-NE 3.32Å; F544-R598 HydrophobicContact CZ-CB 3.44Å; F544-R598 VanDerWaalsContact CZ-CB 3.44Å; F544-R598 HydrophobicContact CZ-CG 3.42Å; F544-R598 VanDerWaalsContact CZ-CG 3.42Å; F544-V599 HydrophobicContact CE1-CG2 4.04Å; F544-V599 HydrophobicContact CZ-CG2 3.68Å
545	L	94.6	Very high	94.7	Very high	68 Å²	68	32.7 Å²	32.7	36%	0.356	17%	0.17	S	C	.	.	H	α-helix	trans	-62.9	-41.3	169.7	-75.7	168.9	0	0	0	111.1	L477 D541 E542 V543	L477-L545 HydrophobicContact CD2-CD1 4.1Å; D541-L545 WeakPolarHBondContact O-CB 3.25Å; D541-L545 VanDerWaalsContact O-CG 3.24Å; D541-L545 WeakPolarHBondContact O-CG 3.26Å; D541-L545 PolarHBondContact O-N 3.13Å; E542-L545 PolarHBondContact O-N 3.18Å; V543-L545 PolarHBondContact O-N 2.96Å
546	D	94.9	Very high	94.5	Very high	60 Å²	60	34.6 Å²	34.6	32%	0.321	18%	0.182	S	C	.	.	H	α-helix	trans	-75	-29.2	178	-68.7	-11.6	0	0	0	112.7	R480 E542 V543 F544 Y576	R480-D546 IonicContact CZ-OD1 2.93Å; R480-D546 VanDerWaalsContact CZ-OD1 3.32Å; R480-D546 IonicContact NH1-OD1 3.92Å; R480-D546 PolarHBondContact NH1-OD1 3.04Å; R480-D546 IonicContact NH2-OD1 3.67Å; R480-D546 PolarHBondContact NH2-OD1 3.05Å; R480-D546 IonicContact NH2-OD2 3.65Å; E542-D546 PolarHBondContact O-N 3.39Å; V543-D546 PolarHBondContact O-N 3.13Å; F544-D546 VanDerWaalsContact C-N 3.34Å; D546-Y576 PolarHBondContact OD2-OH 3.39Å
547	L	95.5	Very high	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-79.5	-15.2	177.1	-64.9	179	0	0	0	114	V543 F544 S549 H550 L551 I569 T572 V573	V543-L547 HydrophobicContact CG1-CD1 3.86Å; V543-L547 HydrophobicContact CG1-CG 4.36Å; V543-L547 VanDerWaalsContact O-CG 3.25Å; V543-L547 WeakPolarHBondContact O-CG 3.4Å; V543-L547 PolarHBondContact O-N 3.41Å; V543-L547 VanDerWaalsContact O-N 3.12Å; F544-L547 HydrophobicContact CD1-CD1 4.49Å; F544-L547 PolarHBondContact O-N 2.93Å; L547-S549 VanDerWaalsContact C-N 3.3Å; L547-S549 PolarHBondContact O-N 2.97Å; L547-H550 PolarHBondContact O-N 3.42Å; L547-L551 HydrophobicContact CB-CD1 3.8Å; L547-L551 HydrophobicContact CB-CG 4.14Å; L547-L551 WeakPolarHBondContact O-CG 3.22Å; L547-L551 PolarHBondContact O-N 3.09Å; L547-I569 HydrophobicContact CD1-CG2 4.24Å; L547-I569 HydrophobicContact CD2-CB 4.19Å; L547-I569 HydrophobicContact CD2-CG1 4.02Å; L547-I569 HydrophobicContact CD2-CG2 4.26Å; L547-T572 HydrophobicContact CD2-CG2 3.75Å; L547-T572 HydrophobicContact CG-CG2 4.4Å; L547-V573 HydrophobicContact CD1-CG2 3.72Å
548	E	93.9	Very high	93.9	Very high	110 Å²	110	40.8 Å²	40.8	51%	0.514	20%	0.203	S	C	.	.	H	α-helix	trans	-53.9	-43.3	-169.3	-176	177.9	-171.3	0	0	113.1	F544 H550 N552	F544-E548 PolarHBondContact O-N 3.48Å; F544-E548 VanDerWaalsContact O-N 3.07Å; E548-H550 PolarHBondContact O-N 3.37Å; E548-N552 VanDerWaalsContact O-CB 3.3Å; E548-N552 WeakPolarHBondContact O-CB 3.46Å; E548-N552 PolarHBondContact O-N 2.79Å; E548-N552 PolarHBondContact O-ND2 2.71Å
549	S	92.9	Very high	93.7	Very high	77 Å²	77	39.9 Å²	39.9	54%	0.538	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-40.4	-179.8	61.1	0	0	0	0	112.7	L547 E553	L547-S549 VanDerWaalsContact C-N 3.3Å; L547-S549 PolarHBondContact O-N 2.97Å; S549-E553 PolarHBondContact O-N 2.86Å
550	H	94.1	Very high	93.4	Very high	54 Å²	54	40.5 Å²	40.5	25%	0.25	20%	0.202	C	C	.	.	H	α-helix	trans	-75.3	-40.5	179.8	-61.1	91.1	0	0	0	111.7	L547 E548 N552 E553 A565 I569	L547-H550 PolarHBondContact O-N 3.42Å; E548-H550 PolarHBondContact O-N 3.37Å; H550-N552 VanDerWaalsContact C-N 3.26Å; H550-N552 PolarHBondContact O-N 3.43Å; H550-E553 WeakPolarHBondContact O-CB 3.36Å; H550-E553 PolarHBondContact O-N 3.01Å; H550-E553 VanDerWaalsContact O-N 3.14Å; H550-A565 HydrophobicContact CB-CB 4.3Å; H550-I569 HydrophobicContact CB-CD1 4.18Å; H550-I569 HydrophobicContact CB-CG1 3.89Å
551	L	93.1	Very high	93	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-38.2	173	-69.9	169.3	0	0	0	111.1	F544 L547 E553 L554 I569 E602	F544-L551 HydrophobicContact CD1-CD1 3.79Å; F544-L551 HydrophobicContact CE1-CD1 4.15Å; L547-L551 HydrophobicContact CB-CD1 3.8Å; L547-L551 HydrophobicContact CB-CG 4.14Å; L547-L551 WeakPolarHBondContact O-CG 3.22Å; L547-L551 PolarHBondContact O-N 3.09Å; L551-E553 VanDerWaalsContact C-N 3.26Å; L551-E553 PolarHBondContact O-N 2.84Å; L551-L554 HydrophobicContact CD2-CD1 4.01Å; L551-L554 WeakPolarHBondContact O-CB 3.46Å; L551-L554 WeakPolarHBondContact O-CG 3.11Å; L551-L554 PolarHBondContact O-N 3.02Å; L551-I569 HydrophobicContact CD2-CD1 3.77Å; L551-I569 HydrophobicContact CD2-CG1 4.47Å; L551-I569 HydrophobicContact CG-CD1 4.25Å; L551-E602 HydrophobicContact CD1-CB 4.36Å; L551-E602 HydrophobicContact CD1-CG 4.32Å; L551-E602 HydrophobicContact CD2-CB 4.01Å
552	N	91.7	Very high	92.6	Very high	79 Å²	79	44.8 Å²	44.8	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-69.4	-20.7	177.4	-88.1	-50.9	0	0	0	114.8	E548 H550 K610	E548-N552 VanDerWaalsContact O-CB 3.3Å; E548-N552 WeakPolarHBondContact O-CB 3.46Å; E548-N552 PolarHBondContact O-N 2.79Å; E548-N552 PolarHBondContact O-ND2 2.71Å; H550-N552 VanDerWaalsContact C-N 3.26Å; H550-N552 PolarHBondContact O-N 3.43Å; N552-K610 PolarHBondContact O-NZ 2.9Å; N552-K610 PolarHBondContact OD1-NZ 2.71Å
553	E	92.2	Very high	92.4	Very high	32 Å²	32	45 Å²	45	15%	0.15	25%	0.249	C	C	.	.	H	α-helix	trans	-78.2	-21.6	176.4	-172.9	166.4	154.9	0	0	112.6	S549 H550 L551 T556 K558 W559 S563 A565	S549-E553 PolarHBondContact O-N 2.86Å; H550-E553 WeakPolarHBondContact O-CB 3.36Å; H550-E553 PolarHBondContact O-N 3.01Å; H550-E553 VanDerWaalsContact O-N 3.14Å; L551-E553 VanDerWaalsContact C-N 3.26Å; L551-E553 PolarHBondContact O-N 2.84Å; E553-T556 WeakPolarHBondContact O-CB 3.48Å; E553-T556 VanDerWaalsContact O-CG2 3.23Å; E553-T556 WeakPolarHBondContact O-CG2 3.46Å; E553-T556 PolarHBondContact O-N 3.48Å; E553-T556 PolarHBondContact O-OG1 2.66Å; E553-K558 VanDerWaalsContact CD-NZ 3.28Å; E553-K558 HydrophobicContact CG-CD 4.24Å; E553-K558 WeakPolarHBondContact OE1-CD 3.48Å; E553-K558 WeakPolarHBondContact OE1-CE 3.17Å; E553-K558 WeakPolarHBondContact OE1-CG 3.25Å; E553-K558 IonicContact OE1-NZ 3.63Å; E553-K558 PolarHBondContact OE1-NZ 3.18Å; E553-K558 VanDerWaalsContact OE1-NZ 3.15Å; E553-K558 IonicContact OE2-NZ 3.29Å; E553-K558 PolarHBondContact OE2-NZ 3.14Å; E553-W559 VanDerWaalsContact O-CB 3.31Å; E553-W559 WeakPolarHBondContact O-CB 3.39Å; E553-S563 VanDerWaalsContact CD-OG 3.26Å; E553-S563 WeakPolarHBondContact OE1-CB 3.45Å; E553-S563 PolarHBondContact OE1-OG 3.31Å; E553-A565 HydrophobicContact CB-CB 4.29Å; E553-A565 HydrophobicContact CG-CB 4.48Å
554	L	92.9	Very high	92.2	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	141.2	177.6	-59.7	176.6	0	0	0	111.5	L551 T556 A565 V566 I569 Y603 A606	L551-L554 HydrophobicContact CD2-CD1 4.01Å; L551-L554 WeakPolarHBondContact O-CB 3.46Å; L551-L554 WeakPolarHBondContact O-CG 3.11Å; L551-L554 PolarHBondContact O-N 3.02Å; L554-T556 PolarHBondContact O-N 3.3Å; L554-T556 VanDerWaalsContact O-N 3.14Å; L554-A565 HydrophobicContact CD2-CB 4.37Å; L554-V566 HydrophobicContact CD2-CG2 3.65Å; L554-I569 HydrophobicContact CD1-CD1 4.43Å; L554-I569 HydrophobicContact CD2-CD1 4.48Å; L554-Y603 HydrophobicContact CD1-CD2 3.67Å; L554-Y603 HydrophobicContact CD1-CE2 4.3Å; L554-Y603 HydrophobicContact CD1-CG 4.3Å; L554-Y603 HydrophobicContact CD2-CD2 4.26Å; L554-Y603 HydrophobicContact CD2-CE2 4.08Å; L554-A606 HydrophobicContact CB-CB 3.73Å
555	L	91.7	Very high	92.1	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	31.6	179	-77.3	-70.5	0	0	0	113.5	W559 Y603 A606 V607 K610 I612	L555-W559 HydrophobicContact CD1-CE3 4.3Å; L555-W559 HydrophobicContact CD1-CH2 3.99Å; L555-W559 HydrophobicContact CD1-CZ3 3.85Å; L555-W559 HydrophobicContact CD2-CD2 4.5Å; L555-W559 HydrophobicContact CD2-CH2 4.49Å; L555-W559 HydrophobicContact CD2-CZ2 4.23Å; L555-Y603 HydrophobicContact CD2-CE1 4.04Å; L555-A606 HydrophobicContact CB-CB 4.23Å; L555-A606 HydrophobicContact CD2-CB 4.48Å; L555-V607 HydrophobicContact CD1-CG2 4.2Å; L555-V607 HydrophobicContact CD2-CG2 3.94Å; L555-V607 HydrophobicContact CG-CB 4.42Å; L555-V607 HydrophobicContact CG-CG2 3.81Å; L555-K610 HydrophobicContact CB-CB 4.35Å; L555-K610 HydrophobicContact CB-CG 4.49Å; L555-I612 HydrophobicContact CB-CG2 4.29Å; L555-I612 HydrophobicContact CD1-CG2 4.32Å; L555-I612 WeakPolarHBondContact O-CB 3.39Å; L555-I612 WeakPolarHBondContact O-CG2 3.34Å
556	T	92.3	Very high	92.1	Very high	40 Å²	40	47.3 Å²	47.3	25%	0.245	26%	0.258	C	S	.	.	S	Bend	trans	-100.5	171.5	167.9	68.2	0	0	0	0	111.5	E553 L554 K558 W559 L560	E553-T556 WeakPolarHBondContact O-CB 3.48Å; E553-T556 VanDerWaalsContact O-CG2 3.23Å; E553-T556 WeakPolarHBondContact O-CG2 3.46Å; E553-T556 PolarHBondContact O-N 3.48Å; E553-T556 PolarHBondContact O-OG1 2.66Å; L554-T556 PolarHBondContact O-N 3.3Å; L554-T556 VanDerWaalsContact O-N 3.14Å; T556-K558 PolarHBondContact O-N 2.91Å; T556-K558 PolarHBondContact OG1-N 3.49Å; T556-W559 WeakPolarHBondContact O-CB 3.36Å; T556-W559 PolarHBondContact O-N 2.76Å; T556-W559 PolarHBondContact OG1-N 2.91Å; T556-L560 PolarHBondContact O-N 3.14Å
557	R	89.8	Confident	92.1	Very high	105 Å²	105	47.4 Å²	47.4	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-62.2	-30.9	172.2	-72.7	-68.4	-176.8	-171.6	-7.8	112.6	L560 A561 T613 E619	R557-L560 PolarHBondContact O-N 3.34Å; R557-A561 WeakPolarHBondContact O-CB 3.11Å; R557-A561 PolarHBondContact O-N 3.3Å; R557-T613 PolarHBondContact NH2-O 3.28Å; R557-E619 IonicContact NH1-OE1 3.55Å; R557-E619 PolarHBondContact NH1-OE1 3.29Å; R557-E619 IonicContact NH1-OE2 2.98Å; R557-E619 PolarHBondContact NH1-OE2 3.37Å
558	K	90.6	Very high	92.1	Very high	133 Å²	133	49.8 Å²	49.8	58%	0.578	27%	0.273	S	S	*	.	H	α-helix	trans	-68.7	-39.7	175.1	-171.2	-178.2	169.7	-152.4	0	111.2	E553 T556 A561 S563	E553-K558 VanDerWaalsContact CD-NZ 3.28Å; E553-K558 HydrophobicContact CG-CD 4.24Å; E553-K558 WeakPolarHBondContact OE1-CD 3.48Å; E553-K558 WeakPolarHBondContact OE1-CE 3.17Å; E553-K558 WeakPolarHBondContact OE1-CG 3.25Å; E553-K558 IonicContact OE1-NZ 3.63Å; E553-K558 PolarHBondContact OE1-NZ 3.18Å; E553-K558 VanDerWaalsContact OE1-NZ 3.15Å; E553-K558 IonicContact OE2-NZ 3.29Å; E553-K558 PolarHBondContact OE2-NZ 3.14Å; T556-K558 PolarHBondContact O-N 2.91Å; T556-K558 PolarHBondContact OG1-N 3.49Å; K558-A561 PolarHBondContact O-N 3.16Å; K558-S563 PolarHBondContact O-N 3.02Å
559	W	93.9	Very high	92.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58	-49.9	170.7	169.3	88.2	0	0	0	111.6	E553 L555 T556 A561 G562 F614 R626 M627 E630	E553-W559 VanDerWaalsContact O-CB 3.31Å; E553-W559 WeakPolarHBondContact O-CB 3.39Å; L555-W559 HydrophobicContact CD1-CE3 4.3Å; L555-W559 HydrophobicContact CD1-CH2 3.99Å; L555-W559 HydrophobicContact CD1-CZ3 3.85Å; L555-W559 HydrophobicContact CD2-CD2 4.5Å; L555-W559 HydrophobicContact CD2-CH2 4.49Å; L555-W559 HydrophobicContact CD2-CZ2 4.23Å; T556-W559 WeakPolarHBondContact O-CB 3.36Å; T556-W559 PolarHBondContact O-N 2.76Å; T556-W559 PolarHBondContact OG1-N 2.91Å; W559-A561 VanDerWaalsContact C-N 3.26Å; W559-A561 PolarHBondContact O-N 3.28Å; W559-G562 PolarHBondContact O-N 2.93Å; W559-F614 HydrophobicContact CZ3-CE1 4.38Å; W559-F614 HydrophobicContact CZ3-CZ 4.36Å; W559-R626 HydrophobicContact CZ2-CB 4.25Å; W559-R626 HydrophobicContact CZ2-CG 3.83Å; W559-R626 VanDerWaalsContact NE1-NE 3.18Å; W559-R626 PolarHBondContact O-NH1 3.21Å; W559-M627 HydrophobicContact CH2-CG 3.93Å; W559-M627 HydrophobicContact CZ2-CG 3.86Å; W559-E630 PolarHBondContact NE1-OE1 2.98Å; W559-E630 PolarHBondContact NE1-OE2 3.07Å
560	L	89.6	Confident	92.3	Very high	14 Å²	14	41.7 Å²	41.7	7%	0.073	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-35.9	178.8	-171.3	60.8	0	0	0	112.2	T556 R557 G562 I612 F614 E619	T556-L560 PolarHBondContact O-N 3.14Å; R557-L560 PolarHBondContact O-N 3.34Å; L560-G562 PolarHBondContact O-N 2.77Å; L560-I612 HydrophobicContact CB-CD1 4.34Å; L560-I612 HydrophobicContact CD2-CD1 4.46Å; L560-F614 HydrophobicContact CD1-CE1 4.02Å; L560-F614 HydrophobicContact CD2-CD1 4.28Å; L560-F614 HydrophobicContact CD2-CE1 4.33Å; L560-E619 HydrophobicContact CD2-CB 4.36Å; L560-E619 HydrophobicContact CD2-CG 4.15Å
561	A	88.3	Confident	92.4	Very high	89 Å²	89	42.9 Å²	42.9	74%	0.736	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	7.2	-179.7	0	0	0	0	0	115.3	R557 K558 W559	R557-A561 WeakPolarHBondContact O-CB 3.11Å; R557-A561 PolarHBondContact O-N 3.3Å; K558-A561 PolarHBondContact O-N 3.16Å; W559-A561 VanDerWaalsContact C-N 3.26Å; W559-A561 PolarHBondContact O-N 3.28Å
562	G	86.1	Confident	92.5	Very high	40 Å²	40	43.7 Å²	43.7	41%	0.412	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	109.8	29.8	175	0	0	0	0	0	116.5	W559 L560	W559-G562 PolarHBondContact O-N 2.93Å; L560-G562 PolarHBondContact O-N 2.77Å
563	S	90.2	Very high	92.8	Very high	12 Å²	12	40 Å²	40	8%	0.084	23%	0.226	C	C	.	.			trans	-55.8	156.5	176.3	179.6	0	0	0	0	114	E553 K558 A565 R626	E553-S563 VanDerWaalsContact CD-OG 3.26Å; E553-S563 WeakPolarHBondContact OE1-CB 3.45Å; E553-S563 PolarHBondContact OE1-OG 3.31Å; K558-S563 PolarHBondContact O-N 3.02Å; S563-A565 WeakPolarHBondContact OG-CB 3.45Å; S563-A565 PolarHBondContact OG-N 3.28Å; S563-R626 PolarHBondContact O-NH2 2.98Å
564	H	91.8	Very high	92.9	Very high	129 Å²	129	40.9 Å²	40.9	60%	0.597	23%	0.23	S	C	*	.			trans	-103.6	15.7	169.7	-66.1	-65.3	0	0	0	113.4	V566 D567 T568	H564-V566 VanDerWaalsContact C-N 3.32Å; H564-V566 PolarHBondContact O-N 3.37Å; H564-D567 IonicContact CG-OD2 3.74Å; H564-D567 IonicContact ND1-OD2 3.67Å; H564-D567 PolarHBondContact ND1-OD2 3.27Å; H564-D567 WeakPolarHBondContact O-CB 3.47Å; H564-D567 PolarHBondContact O-N 3.2Å; H564-D567 VanDerWaalsContact O-N 3.09Å; H564-T568 PolarHBondContact O-N 2.92Å; H564-T568 PolarHBondContact O-OG1 3.39Å
565	A	93.1	Very high	93	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-53.6	-43.5	-174.1	0	0	0	0	0	113.7	H550 E553 L554 S563 T568 I569	H550-A565 HydrophobicContact CB-CB 4.3Å; E553-A565 HydrophobicContact CB-CB 4.29Å; E553-A565 HydrophobicContact CG-CB 4.48Å; L554-A565 HydrophobicContact CD2-CB 4.37Å; S563-A565 WeakPolarHBondContact OG-CB 3.45Å; S563-A565 PolarHBondContact OG-N 3.28Å; A565-T568 PolarHBondContact O-N 2.76Å; A565-I569 WeakPolarHBondContact O-CD1 3.49Å; A565-I569 WeakPolarHBondContact O-CG1 3.36Å; A565-I569 PolarHBondContact O-N 3.35Å
566	V	94.9	Very high	93.2	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-36.5	179.2	174.9	0	0	0	0	112.6	L554 H564 T568 I569 C570 Y603 E630 Q633 F634	L554-V566 HydrophobicContact CD2-CG2 3.65Å; H564-V566 VanDerWaalsContact C-N 3.32Å; H564-V566 PolarHBondContact O-N 3.37Å; V566-T568 VanDerWaalsContact C-N 3.34Å; V566-I569 PolarHBondContact O-N 3.1Å; V566-C570 PolarHBondContact O-N 3.43Å; V566-C570 PolarHBondContact O-SG 3.3Å; V566-Y603 HydrophobicContact CG2-CE2 4.23Å; V566-E630 HydrophobicContact CB-CB 4.42Å; V566-E630 HydrophobicContact CB-CG 3.91Å; V566-E630 HydrophobicContact CG1-CB 4.02Å; V566-E630 HydrophobicContact CG1-CG 3.98Å; V566-E630 HydrophobicContact CG2-CB 4.08Å; V566-E630 HydrophobicContact CG2-CG 3.71Å; V566-Q633 HydrophobicContact CG1-CB 4.48Å; V566-Q633 VanDerWaalsContact CG1-OE1 3.27Å; V566-F634 HydrophobicContact CB-CZ 4.43Å; V566-F634 HydrophobicContact CG1-CD1 4.43Å; V566-F634 HydrophobicContact CG1-CE1 3.73Å; V566-F634 HydrophobicContact CG1-CE2 4.31Å; V566-F634 HydrophobicContact CG1-CZ 3.66Å; V566-F634 HydrophobicContact CG2-CZ 4.07Å
567	D	94.9	Very high	93.3	Very high	62 Å²	62	45.4 Å²	45.4	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-46.6	175.2	-57.7	-54.5	0	0	0	109.7	H564 C570 V571 Q633	H564-D567 IonicContact CG-OD2 3.74Å; H564-D567 IonicContact ND1-OD2 3.67Å; H564-D567 PolarHBondContact ND1-OD2 3.27Å; H564-D567 WeakPolarHBondContact O-CB 3.47Å; H564-D567 PolarHBondContact O-N 3.2Å; H564-D567 VanDerWaalsContact O-N 3.09Å; D567-C570 PolarHBondContact O-N 3.2Å; D567-V571 WeakPolarHBondContact O-CG2 3.39Å; D567-V571 PolarHBondContact O-N 3.01Å; D567-Q633 PolarHBondContact OD1-NE2 2.94Å
568	T	95.6	Very high	93.4	Very high	50 Å²	50	44 Å²	44	31%	0.307	25%	0.25	S	S	.	.	H	α-helix	trans	-63	-43.7	175.5	-53.7	0	0	0	0	112.1	H564 A565 V566 C570 V571 T572	H564-T568 PolarHBondContact O-N 2.92Å; H564-T568 PolarHBondContact O-OG1 3.39Å; A565-T568 PolarHBondContact O-N 2.76Å; V566-T568 VanDerWaalsContact C-N 3.34Å; T568-C570 VanDerWaalsContact C-N 3.29Å; T568-C570 PolarHBondContact O-N 3.25Å; T568-V571 PolarHBondContact O-N 2.95Å; T568-T572 WeakPolarHBondContact O-CB 3.46Å; T568-T572 PolarHBondContact O-N 3.05Å; T568-T572 PolarHBondContact O-OG1 2.89Å; T568-T572 VanDerWaalsContact O-OG1 3.08Å
569	I	96.1	Very high	93.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-55.9	-46.5	175.4	-70.7	158.7	0	0	0	110.5	L547 H550 L551 L554 A565 V566 V573 V599 F634	L547-I569 HydrophobicContact CD1-CG2 4.24Å; L547-I569 HydrophobicContact CD2-CB 4.19Å; L547-I569 HydrophobicContact CD2-CG1 4.02Å; L547-I569 HydrophobicContact CD2-CG2 4.26Å; H550-I569 HydrophobicContact CB-CD1 4.18Å; H550-I569 HydrophobicContact CB-CG1 3.89Å; L551-I569 HydrophobicContact CD2-CD1 3.77Å; L551-I569 HydrophobicContact CD2-CG1 4.47Å; L551-I569 HydrophobicContact CG-CD1 4.25Å; L554-I569 HydrophobicContact CD1-CD1 4.43Å; L554-I569 HydrophobicContact CD2-CD1 4.48Å; A565-I569 WeakPolarHBondContact O-CD1 3.49Å; A565-I569 WeakPolarHBondContact O-CG1 3.36Å; A565-I569 PolarHBondContact O-N 3.35Å; V566-I569 PolarHBondContact O-N 3.1Å; I569-V573 HydrophobicContact CG2-CG2 4.38Å; I569-V573 WeakPolarHBondContact O-CB 3.41Å; I569-V573 VanDerWaalsContact O-CG2 3.26Å; I569-V573 WeakPolarHBondContact O-CG2 3.07Å; I569-V573 PolarHBondContact O-N 3.04Å; I569-V599 HydrophobicContact CG2-CG1 4.47Å; I569-F634 HydrophobicContact CG2-CE1 3.94Å
570	C	96.1	Very high	93.3	Very high	16 Å²	16	42 Å²	42	11%	0.108	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-45.1	-178.8	-68.3	0	0	0	0	112.2	V566 D567 T568 E574 L637	V566-C570 PolarHBondContact O-N 3.43Å; V566-C570 PolarHBondContact O-SG 3.3Å; D567-C570 PolarHBondContact O-N 3.2Å; T568-C570 VanDerWaalsContact C-N 3.29Å; T568-C570 PolarHBondContact O-N 3.25Å; C570-E574 VanDerWaalsContact O-CB 3.3Å; C570-E574 WeakPolarHBondContact O-CB 3.38Å; C570-E574 PolarHBondContact O-N 2.86Å; C570-L637 HydrophobicContact CB-CD2 3.9Å
571	V	96.1	Very high	93.3	Very high	80 Å²	80	45.6 Å²	45.6	49%	0.485	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-47.8	178.6	173.1	0	0	0	0	111	D567 T568 V573 E574 D575	D567-V571 WeakPolarHBondContact O-CG2 3.39Å; D567-V571 PolarHBondContact O-N 3.01Å; T568-V571 PolarHBondContact O-N 2.95Å; V571-V573 PolarHBondContact O-N 3.06Å; V571-E574 WeakPolarHBondContact O-CB 3.31Å; V571-E574 PolarHBondContact O-N 3.45Å; V571-D575 VanDerWaalsContact O-CG 3.31Å; V571-D575 PolarHBondContact O-N 3.24Å
572	T	95.6	Very high	93.6	Very high	32 Å²	32	44.4 Å²	44.4	20%	0.196	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-44	179.7	-59.6	0	0	0	0	111.8	L547 T568 E574 D575 Y576	L547-T572 HydrophobicContact CD2-CG2 3.75Å; L547-T572 HydrophobicContact CG-CG2 4.4Å; T568-T572 WeakPolarHBondContact O-CB 3.46Å; T568-T572 PolarHBondContact O-N 3.05Å; T568-T572 PolarHBondContact O-OG1 2.89Å; T568-T572 VanDerWaalsContact O-OG1 3.08Å; T572-E574 VanDerWaalsContact C-N 3.33Å; T572-E574 PolarHBondContact O-N 3.4Å; T572-D575 PolarHBondContact O-N 3.29Å; T572-Y576 HydrophobicContact CG2-CD2 3.86Å; T572-Y576 HydrophobicContact CG2-CE2 3.87Å; T572-Y576 VanDerWaalsContact O-CD2 3.31Å; T572-Y576 WeakPolarHBondContact O-CD2 3.41Å; T572-Y576 PolarHBondContact O-N 3.16Å; T572-Y576 VanDerWaalsContact O-N 3.11Å
573	V	96.1	Very high	94	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-60.7	-44.9	174.2	171	0	0	0	0	110.5	V543 L547 I569 V571 D575 Y576 F577 L637 F638 L641	V543-V573 HydrophobicContact CG1-CG2 4.22Å; L547-V573 HydrophobicContact CD1-CG2 3.72Å; I569-V573 HydrophobicContact CG2-CG2 4.38Å; I569-V573 WeakPolarHBondContact O-CB 3.41Å; I569-V573 VanDerWaalsContact O-CG2 3.26Å; I569-V573 WeakPolarHBondContact O-CG2 3.07Å; I569-V573 PolarHBondContact O-N 3.04Å; V571-V573 PolarHBondContact O-N 3.06Å; V573-D575 PolarHBondContact O-N 2.86Å; V573-Y576 PolarHBondContact O-N 2.98Å; V573-F577 HydrophobicContact CG1-CD2 3.74Å; V573-F577 HydrophobicContact CG1-CE2 3.99Å; V573-F577 WeakPolarHBondContact O-CB 3.35Å; V573-F577 VanDerWaalsContact O-CD2 3.26Å; V573-F577 WeakPolarHBondContact O-CD2 3.17Å; V573-F577 PolarHBondContact O-N 3.27Å; V573-L637 HydrophobicContact CB-CD2 4.1Å; V573-L637 HydrophobicContact CG1-CD2 4Å; V573-F638 HydrophobicContact CG1-CE1 4.23Å; V573-F638 HydrophobicContact CG1-CZ 3.98Å; V573-L641 HydrophobicContact CG1-CD1 4.12Å
574	E	95.4	Very high	94.1	Very high	50 Å²	50	42.6 Å²	42.6	23%	0.234	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-44.5	178.9	-170.5	172.9	-178.9	0	0	112.4	C570 V571 T572 F577 N578 L637 K640	C570-E574 VanDerWaalsContact O-CB 3.3Å; C570-E574 WeakPolarHBondContact O-CB 3.38Å; C570-E574 PolarHBondContact O-N 2.86Å; V571-E574 WeakPolarHBondContact O-CB 3.31Å; V571-E574 PolarHBondContact O-N 3.45Å; T572-E574 VanDerWaalsContact C-N 3.33Å; T572-E574 PolarHBondContact O-N 3.4Å; E574-F577 PolarHBondContact O-N 3.15Å; E574-N578 PolarHBondContact O-N 3.47Å; E574-N578 PolarHBondContact O-ND2 2.85Å; E574-N578 VanDerWaalsContact O-ND2 3.07Å; E574-L637 HydrophobicContact CB-CD1 3.83Å; E574-L637 HydrophobicContact CG-CD1 4.16Å; E574-K640 WeakPolarHBondContact OE1-CE 3.3Å; E574-K640 IonicContact OE1-NZ 3.92Å; E574-K640 PolarHBondContact OE1-NZ 2.76Å
575	D	95.2	Very high	94	Very high	91 Å²	91	43.7 Å²	43.7	49%	0.487	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-49.5	178.4	-70.3	-21.4	0	0	0	111.4	V571 T572 V573 F577 N578 D579	V571-D575 VanDerWaalsContact O-CG 3.31Å; V571-D575 PolarHBondContact O-N 3.24Å; T572-D575 PolarHBondContact O-N 3.29Å; V573-D575 PolarHBondContact O-N 2.86Å; D575-F577 PolarHBondContact O-N 3.05Å; D575-N578 WeakPolarHBondContact O-CB 3.2Å; D575-N578 PolarHBondContact O-N 2.87Å; D575-D579 PolarHBondContact O-N 2.94Å
576	Y	95.1	Very high	93.8	Very high	35 Å²	35	46.8 Å²	46.8	14%	0.137	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-41.6	176.1	-87.7	-75.2	0	0	0	112.7	I487 V543 D546 T572 V573 N578 D579 F580	I487-Y576 HydrophobicContact CD1-CD1 4.21Å; I487-Y576 HydrophobicContact CD1-CE1 3.69Å; V543-Y576 HydrophobicContact CB-CD2 4.28Å; V543-Y576 HydrophobicContact CB-CG 4.43Å; V543-Y576 HydrophobicContact CG1-CD2 3.96Å; V543-Y576 HydrophobicContact CG1-CG 4.35Å; V543-Y576 HydrophobicContact CG2-CD1 3.87Å; V543-Y576 HydrophobicContact CG2-CD2 3.98Å; V543-Y576 HydrophobicContact CG2-CE1 4.4Å; V543-Y576 HydrophobicContact CG2-CG 3.63Å; D546-Y576 PolarHBondContact OD2-OH 3.39Å; T572-Y576 HydrophobicContact CG2-CD2 3.86Å; T572-Y576 HydrophobicContact CG2-CE2 3.87Å; T572-Y576 VanDerWaalsContact O-CD2 3.31Å; T572-Y576 WeakPolarHBondContact O-CD2 3.41Å; T572-Y576 PolarHBondContact O-N 3.16Å; T572-Y576 VanDerWaalsContact O-N 3.11Å; V573-Y576 PolarHBondContact O-N 2.98Å; Y576-N578 VanDerWaalsContact C-N 3.28Å; Y576-N578 PolarHBondContact O-N 2.7Å; Y576-D579 WeakPolarHBondContact O-CB 3.35Å; Y576-D579 PolarHBondContact O-N 3.03Å; Y576-D579 VanDerWaalsContact O-N 3.09Å; Y576-F580 HydrophobicContact CD1-CE1 4.22Å; Y576-F580 AromaticContact CD1-CZ 3.98Å; Y576-F580 HydrophobicContact CD1-CZ 3.98Å; Y576-F580 VanDerWaalsContact O-CD1 3.31Å; Y576-F580 WeakPolarHBondContact O-CD1 3.49Å; Y576-F580 WeakPolarHBondContact O-CG 3.37Å; Y576-F580 PolarHBondContact O-N 2.97Å
577	F	94.5	Very high	93.7	Very high	10 Å²	10	48.3 Å²	48.3	4%	0.044	25%	0.252	C	S	.	.	H	α-helix	trans	-72.2	-23	179.7	-87.5	-97.6	0	0	0	113.2	L540 V573 E574 D575 F580 N581 M591 T592 A595 L641	L540-F577 HydrophobicContact CD2-CE2 4.3Å; L540-F577 HydrophobicContact CD2-CZ 4.06Å; V573-F577 HydrophobicContact CG1-CD2 3.74Å; V573-F577 HydrophobicContact CG1-CE2 3.99Å; V573-F577 WeakPolarHBondContact O-CB 3.35Å; V573-F577 VanDerWaalsContact O-CD2 3.26Å; V573-F577 WeakPolarHBondContact O-CD2 3.17Å; V573-F577 PolarHBondContact O-N 3.27Å; E574-F577 PolarHBondContact O-N 3.15Å; D575-F577 PolarHBondContact O-N 3.05Å; F577-F580 HydrophobicContact CD1-CD2 4.32Å; F577-F580 HydrophobicContact CD2-CD2 4.17Å; F577-F580 HydrophobicContact CD2-CE2 4.49Å; F577-F580 HydrophobicContact CE1-CD2 4.36Å; F577-F580 HydrophobicContact CE2-CD2 4.26Å; F577-F580 HydrophobicContact CE2-CE2 4.37Å; F577-F580 HydrophobicContact CG-CD2 4.23Å; F577-F580 HydrophobicContact CZ-CD2 4.34Å; F577-F580 PolarHBondContact O-N 3.2Å; F577-N581 PolarHBondContact O-N 2.91Å; F577-M591 HydrophobicContact CE1-CE 4.41Å; F577-T592 HydrophobicContact CE1-CG2 4.13Å; F577-T592 VanDerWaalsContact CE1-OG1 3.22Å; F577-T592 WeakPolarHBondContact CE1-OG1 3.32Å; F577-A595 HydrophobicContact CE2-CB 3.79Å; F577-A595 HydrophobicContact CZ-CB 3.49Å; F577-A595 VanDerWaalsContact CZ-CB 3.49Å; F577-L641 HydrophobicContact CB-CD1 3.92Å; F577-L641 HydrophobicContact CB-CD2 3.78Å; F577-L641 HydrophobicContact CB-CG 4.46Å; F577-L641 HydrophobicContact CD1-CD1 4.22Å; F577-L641 HydrophobicContact CD2-CD1 4.26Å; F577-L641 HydrophobicContact CG-CD1 3.85Å; F577-L641 HydrophobicContact CG-CD2 4.48Å
578	N	92.2	Very high	93.6	Very high	77 Å²	77	46.8 Å²	46.8	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-40.7	166.5	-70	-38.4	0	0	0	110.7	E574 D575 Y576 N581	E574-N578 PolarHBondContact O-N 3.47Å; E574-N578 PolarHBondContact O-ND2 2.85Å; E574-N578 VanDerWaalsContact O-ND2 3.07Å; D575-N578 WeakPolarHBondContact O-CB 3.2Å; D575-N578 PolarHBondContact O-N 2.87Å; Y576-N578 VanDerWaalsContact C-N 3.28Å; Y576-N578 PolarHBondContact O-N 2.7Å; N578-N581 VanDerWaalsContact O-CB 3.23Å; N578-N581 WeakPolarHBondContact O-CB 3.31Å; N578-N581 PolarHBondContact O-N 3.32Å; N578-N581 PolarHBondContact O-ND2 2.81Å
579	D	89.2	Confident	93.4	Very high	89 Å²	89	49.4 Å²	49.4	48%	0.476	25%	0.253	S	S	.	.	H	α-helix	trans	-69	-34.9	174.2	-65.7	-22.5	0	0	0	111.9	D575 Y576 N581	D575-D579 PolarHBondContact O-N 2.94Å; Y576-D579 WeakPolarHBondContact O-CB 3.35Å; Y576-D579 PolarHBondContact O-N 3.03Å; Y576-D579 VanDerWaalsContact O-N 3.09Å; D579-N581 PolarHBondContact O-N 3.06Å
580	F	93.6	Very high	93.1	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-73.2	-0.9	176	-58.4	-14.3	0	0	0	113.8	I487 I491 L539 V543 Y576 F577 K582 V583 N588 M591	I487-F580 HydrophobicContact CG2-CD1 4.09Å; I487-F580 HydrophobicContact CG2-CE1 3.68Å; I491-F580 HydrophobicContact CD1-CD1 4.01Å; L539-F580 HydrophobicContact CB-CE1 4.31Å; L539-F580 HydrophobicContact CB-CE2 4.4Å; L539-F580 HydrophobicContact CB-CZ 3.93Å; L539-F580 HydrophobicContact CD2-CE1 3.98Å; L539-F580 HydrophobicContact CD2-CZ 4.38Å; V543-F580 HydrophobicContact CG2-CE2 3.83Å; V543-F580 HydrophobicContact CG2-CZ 3.82Å; Y576-F580 HydrophobicContact CD1-CE1 4.22Å; Y576-F580 AromaticContact CD1-CZ 3.98Å; Y576-F580 HydrophobicContact CD1-CZ 3.98Å; Y576-F580 VanDerWaalsContact O-CD1 3.31Å; Y576-F580 WeakPolarHBondContact O-CD1 3.49Å; Y576-F580 WeakPolarHBondContact O-CG 3.37Å; Y576-F580 PolarHBondContact O-N 2.97Å; F577-F580 HydrophobicContact CD1-CD2 4.32Å; F577-F580 HydrophobicContact CD2-CD2 4.17Å; F577-F580 HydrophobicContact CD2-CE2 4.49Å; F577-F580 HydrophobicContact CE1-CD2 4.36Å; F577-F580 HydrophobicContact CE2-CD2 4.26Å; F577-F580 HydrophobicContact CE2-CE2 4.37Å; F577-F580 HydrophobicContact CG-CD2 4.23Å; F577-F580 HydrophobicContact CZ-CD2 4.34Å; F577-F580 PolarHBondContact O-N 3.2Å; F580-K582 PolarHBondContact O-N 3.14Å; F580-V583 HydrophobicContact CB-CG2 4.23Å; F580-V583 VanDerWaalsContact O-CB 3.31Å; F580-V583 WeakPolarHBondContact O-CB 3.46Å; F580-V583 WeakPolarHBondContact O-CG2 3.38Å; F580-V583 PolarHBondContact O-N 2.93Å; F580-N588 PolarHBondContact O-ND2 2.89Å; F580-M591 HydrophobicContact CB-CE 3.74Å; F580-M591 HydrophobicContact CD2-CE 3.41Å; F580-M591 VanDerWaalsContact CD2-CE 3.41Å; F580-M591 HydrophobicContact CD2-SD 4.24Å; F580-M591 HydrophobicContact CE2-CE 4.17Å; F580-M591 HydrophobicContact CE2-SD 4.45Å; F580-M591 HydrophobicContact CG-CE 3.75Å
581	N	90.3	Very high	93	Very high	89 Å²	89	54.1 Å²	54.1	48%	0.476	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-58.1	-19.4	175.4	78.2	29.7	0	0	0	112.9	F577 N578 D579 V583	F577-N581 PolarHBondContact O-N 2.91Å; N578-N581 VanDerWaalsContact O-CB 3.23Å; N578-N581 WeakPolarHBondContact O-CB 3.31Å; N578-N581 PolarHBondContact O-N 3.32Å; N578-N581 PolarHBondContact O-ND2 2.81Å; D579-N581 PolarHBondContact O-N 3.06Å; N581-V583 VanDerWaalsContact C-N 3.31Å
582	K	93.2	Very high	92.9	Very high	64 Å²	64	50.3 Å²	50.3	28%	0.278	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-81.5	-4.1	177	-56.8	-61.2	-177.1	-179.7	0	113.9	G418 F419 Y420 I491 N495 F580	G418-K582 WeakPolarHBondContact O-CD 3.35Å; G418-K582 PolarHBondContact O-NZ 3.48Å; G418-K582 VanDerWaalsContact O-NZ 3.12Å; F419-K582 WeakPolarHBondContact CD1-O 3.28Å; Y420-K582 HydrophobicContact CD2-CB 3.36Å; Y420-K582 HydrophobicContact CD2-CG 3.76Å; Y420-K582 HydrophobicContact CE1-CG 4.42Å; Y420-K582 HydrophobicContact CE2-CB 3.6Å; Y420-K582 HydrophobicContact CE2-CD 4.43Å; Y420-K582 HydrophobicContact CE2-CG 3.44Å; Y420-K582 VanDerWaalsContact CE2-CG 3.44Å; Y420-K582 HydrophobicContact CG-CB 3.95Å; Y420-K582 HydrophobicContact CG-CG 4.35Å; Y420-K582 PolarHBondContact N-O 3.25Å; I491-K582 HydrophobicContact CG2-CB 4.08Å; I491-K582 WeakPolarHBondContact CG2-O 3.37Å; N495-K582 PolarHBondContact ND2-O 2.87Å; F580-K582 PolarHBondContact O-N 3.14Å
583	V	94.3	Very high	92.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	26%	0.257	C	S	.	.	S	Bend	trans	-78.5	136.6	170.2	-179.6	0	0	0	0	109.7	F419 I491 V494 F580 N581 F587 N588 M591	F419-V583 WeakPolarHBondContact CE1-O 3.5Å; I491-V583 HydrophobicContact CB-CG2 4.16Å; I491-V583 HydrophobicContact CD1-CG2 4.19Å; I491-V583 HydrophobicContact CG1-CG2 3.68Å; I491-V583 HydrophobicContact CG2-CB 4.35Å; I491-V583 HydrophobicContact CG2-CG2 3.63Å; V494-V583 HydrophobicContact CG1-CG1 4.48Å; F580-V583 HydrophobicContact CB-CG2 4.23Å; F580-V583 VanDerWaalsContact O-CB 3.31Å; F580-V583 WeakPolarHBondContact O-CB 3.46Å; F580-V583 WeakPolarHBondContact O-CG2 3.38Å; F580-V583 PolarHBondContact O-N 2.93Å; N581-V583 VanDerWaalsContact C-N 3.31Å; V583-F587 HydrophobicContact CG1-CB 3.78Å; V583-N588 HydrophobicContact CB-CB 4.09Å; V583-N588 HydrophobicContact CG1-CB 4.02Å; V583-M591 HydrophobicContact CG2-CE 4.07Å
584	K	92.6	Very high	92.5	Very high	14 Å²	14	54.9 Å²	54.9	6%	0.061	27%	0.274	C	S	.	.			trans	-59.1	141.6	176.7	-72.7	-174.8	-178.7	-177.7	0	111.5	D415 F419 N495 Q498 T499 P586 F587 N588	D415-K584 IonicContact OD2-NZ 2.82Å; F419-K584 HydrophobicContact CB-CG 4.17Å; F419-K584 HydrophobicContact CD1-CG 4.24Å; F419-K584 HydrophobicContact CD2-CG 4.11Å; F419-K584 HydrophobicContact CG-CG 3.92Å; N495-K584 HydrophobicContact CB-CD 4.36Å; N495-K584 HydrophobicContact CB-CG 4.33Å; N495-K584 WeakPolarHBondContact OD1-CG 3.47Å; N495-K584 PolarHBondContact OD1-N 2.9Å; Q498-K584 HydrophobicContact CB-CD 4.05Å; Q498-K584 HydrophobicContact CG-CD 4.2Å; T499-K584 PolarHBondContact OG1-NZ 2.91Å; T499-K584 VanDerWaalsContact OG1-NZ 3.16Å; K584-P586 VanDerWaalsContact C-CD 3.49Å; K584-F587 HydrophobicContact CB-CD2 4.09Å; K584-F587 HydrophobicContact CB-CE2 4.39Å; K584-F587 PolarHBondContact O-N 3.43Å; K584-F587 VanDerWaalsContact O-N 3.09Å; K584-N588 PolarHBondContact O-N 3.3Å
585	K	90.2	Very high	92.5	Very high	152 Å²	152	52.5 Å²	52.5	66%	0.661	26%	0.263	S	S	*	.	H	α-helix	trans	-48.6	-47.4	-167.2	-67.3	-179.1	179.1	176.1	0	115.8	F419 F587 N588 Q589	F419-K585 HydrophobicContact CZ-CG 4.47Å; K585-F587 VanDerWaalsContact C-N 3.33Å; K585-F587 PolarHBondContact O-N 3.19Å; K585-N588 PolarHBondContact O-N 3.02Å; K585-Q589 WeakPolarHBondContact O-CG 3.38Å; K585-Q589 PolarHBondContact O-N 3.16Å
586	P	89.8	Confident	92.4	Very high	66 Å²	66	48.2 Å²	48.2	43%	0.429	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-43.4	-178.3	-22.2	34.1	0	0	0	112.1	K584 Q589 D590	K584-P586 VanDerWaalsContact C-CD 3.49Å; P586-Q589 PolarHBondContact O-N 2.84Å; P586-D590 PolarHBondContact O-N 2.7Å
587	F	92.8	Very high	92.3	Very high	33 Å²	33	47.8 Å²	47.8	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-72.2	-37	-179.3	-47.6	-40.4	0	0	0	111.7	V494 Q498 V532 V583 K584 K585 D590 M591	V494-F587 HydrophobicContact CG1-CB 4.11Å; V494-F587 HydrophobicContact CG1-CD2 3.7Å; V494-F587 HydrophobicContact CG1-CE2 4.38Å; V494-F587 HydrophobicContact CG1-CG 4.08Å; Q498-F587 HydrophobicContact CB-CE2 3.8Å; Q498-F587 HydrophobicContact CB-CZ 3.89Å; V532-F587 HydrophobicContact CG1-CB 4.43Å; V532-F587 HydrophobicContact CG1-CD1 3.54Å; V532-F587 HydrophobicContact CG1-CE1 3.83Å; V532-F587 HydrophobicContact CG1-CG 3.94Å; V532-F587 HydrophobicContact CG1-CZ 4.44Å; V532-F587 HydrophobicContact CG2-CE1 4.17Å; V532-F587 HydrophobicContact CG2-CE2 4.44Å; V532-F587 HydrophobicContact CG2-CZ 4.07Å; V583-F587 HydrophobicContact CG1-CB 3.78Å; K584-F587 HydrophobicContact CB-CD2 4.09Å; K584-F587 HydrophobicContact CB-CE2 4.39Å; K584-F587 PolarHBondContact O-N 3.43Å; K584-F587 VanDerWaalsContact O-N 3.09Å; K585-F587 VanDerWaalsContact C-N 3.33Å; K585-F587 PolarHBondContact O-N 3.19Å; F587-D590 PolarHBondContact O-N 2.96Å; F587-M591 WeakPolarHBondContact O-CB 3.44Å; F587-M591 PolarHBondContact O-N 3.48Å
588	N	91.9	Very high	92.2	Very high	29 Å²	29	50.6 Å²	50.6	16%	0.155	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-42.4	176.3	-168.5	-37.1	0	0	0	111.4	F580 V583 K584 K585 M591 T592	F580-N588 PolarHBondContact O-ND2 2.89Å; V583-N588 HydrophobicContact CB-CB 4.09Å; V583-N588 HydrophobicContact CG1-CB 4.02Å; K584-N588 PolarHBondContact O-N 3.3Å; K585-N588 PolarHBondContact O-N 3.02Å; N588-M591 PolarHBondContact O-N 2.93Å; N588-T592 WeakPolarHBondContact O-CB 3.35Å; N588-T592 PolarHBondContact O-N 2.91Å; N588-T592 PolarHBondContact O-OG1 3.09Å; N588-T592 PolarHBondContact OD1-OG1 3.16Å; N588-T592 VanDerWaalsContact OD1-OG1 3.14Å
589	Q	90.6	Very high	92.3	Very high	106 Å²	106	47 Å²	47	50%	0.495	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-49.2	176.1	-75.2	176.9	-12.4	0	0	112.1	K585 P586 M591 T592 N593	K585-Q589 WeakPolarHBondContact O-CG 3.38Å; K585-Q589 PolarHBondContact O-N 3.16Å; P586-Q589 PolarHBondContact O-N 2.84Å; Q589-M591 VanDerWaalsContact C-N 3.34Å; Q589-M591 PolarHBondContact O-N 3.3Å; Q589-T592 PolarHBondContact O-N 3.17Å; Q589-N593 VanDerWaalsContact O-CG 3.3Å; Q589-N593 PolarHBondContact O-N 2.8Å; Q589-N593 PolarHBondContact O-ND2 3.13Å; Q589-N593 VanDerWaalsContact O-ND2 3.16Å
590	D	90.7	Very high	92.6	Very high	111 Å²	111	42.7 Å²	42.7	59%	0.594	21%	0.207	S	C	*	.	H	α-helix	trans	-61.8	-42.8	178.1	-70.9	-18.1	0	0	0	111.6	P586 F587 N593 E594	P586-D590 PolarHBondContact O-N 2.7Å; F587-D590 PolarHBondContact O-N 2.96Å; D590-N593 PolarHBondContact O-N 2.91Å; D590-E594 PolarHBondContact O-N 3.42Å
591	M	93.6	Very high	92.6	Very high	4 Å²	4	43 Å²	43	2%	0.02	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-39.1	177.2	-172.7	173.2	66.8	0	0	112.5	C536 L539 L540 F577 F580 V583 F587 N588 Q589 E594 A595	C536-M591 HydrophobicContact CB-CB 4.38Å; C536-M591 HydrophobicContact CB-CG 4.26Å; C536-M591 HydrophobicContact CB-SD 4.1Å; L539-M591 HydrophobicContact CB-SD 4.14Å; L539-M591 HydrophobicContact CD1-SD 4.08Å; L540-M591 HydrophobicContact CD1-CG 3.98Å; L540-M591 HydrophobicContact CD2-CG 3.77Å; L540-M591 HydrophobicContact CG-CG 3.78Å; L540-M591 HydrophobicContact CG-SD 4.47Å; F577-M591 HydrophobicContact CE1-CE 4.41Å; F580-M591 HydrophobicContact CB-CE 3.74Å; F580-M591 HydrophobicContact CD2-CE 3.41Å; F580-M591 VanDerWaalsContact CD2-CE 3.41Å; F580-M591 HydrophobicContact CD2-SD 4.24Å; F580-M591 HydrophobicContact CE2-CE 4.17Å; F580-M591 HydrophobicContact CE2-SD 4.45Å; F580-M591 HydrophobicContact CG-CE 3.75Å; V583-M591 HydrophobicContact CG2-CE 4.07Å; F587-M591 WeakPolarHBondContact O-CB 3.44Å; F587-M591 PolarHBondContact O-N 3.48Å; N588-M591 PolarHBondContact O-N 2.93Å; Q589-M591 VanDerWaalsContact C-N 3.34Å; Q589-M591 PolarHBondContact O-N 3.3Å; M591-E594 PolarHBondContact O-N 2.97Å; M591-A595 WeakPolarHBondContact O-CB 3.3Å; M591-A595 PolarHBondContact O-N 3.31Å
592	T	93.3	Very high	92.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-43.5	176	-56	0	0	0	0	111.2	F577 N588 Q589 E594 A595 L596 F638 L641 A643	F577-T592 HydrophobicContact CE1-CG2 4.13Å; F577-T592 VanDerWaalsContact CE1-OG1 3.22Å; F577-T592 WeakPolarHBondContact CE1-OG1 3.32Å; N588-T592 WeakPolarHBondContact O-CB 3.35Å; N588-T592 PolarHBondContact O-N 2.91Å; N588-T592 PolarHBondContact O-OG1 3.09Å; N588-T592 PolarHBondContact OD1-OG1 3.16Å; N588-T592 VanDerWaalsContact OD1-OG1 3.14Å; Q589-T592 PolarHBondContact O-N 3.17Å; T592-E594 VanDerWaalsContact C-N 3.35Å; T592-A595 PolarHBondContact O-N 3.24Å; T592-L596 PolarHBondContact O-N 2.9Å; T592-F638 HydrophobicContact CG2-CD1 4.01Å; T592-L641 HydrophobicContact CG2-CB 3.86Å; T592-A643 HydrophobicContact CG2-CB 3.91Å
593	N	91.8	Very high	92.8	Very high	50 Å²	50	38.4 Å²	38.4	27%	0.267	19%	0.185	S	C	.	.	H	α-helix	trans	-63.3	-41.3	177	-70	-32.5	0	0	0	111.7	Q589 D590 L596 R597 G644	Q589-N593 VanDerWaalsContact O-CG 3.3Å; Q589-N593 PolarHBondContact O-N 2.8Å; Q589-N593 PolarHBondContact O-ND2 3.13Å; Q589-N593 VanDerWaalsContact O-ND2 3.16Å; D590-N593 PolarHBondContact O-N 2.91Å; N593-L596 PolarHBondContact O-N 3.43Å; N593-R597 WeakPolarHBondContact O-CB 3.28Å; N593-R597 PolarHBondContact O-N 2.95Å; N593-G644 PolarHBondContact OD1-N 3.15Å
594	E	92.4	Very high	92.7	Very high	79 Å²	79	38.4 Å²	38.4	37%	0.369	19%	0.185	S	C	.	.	H	α-helix	trans	-68.8	-38.2	177	-171.4	57.4	-147.7	0	0	111.9	L540 D590 M591 T592 R597 R598	L540-E594 HydrophobicContact CD1-CB 4Å; L540-E594 HydrophobicContact CD1-CG 3.99Å; D590-E594 PolarHBondContact O-N 3.42Å; M591-E594 PolarHBondContact O-N 2.97Å; T592-E594 VanDerWaalsContact C-N 3.35Å; E594-R597 PolarHBondContact O-N 3.27Å; E594-R598 WeakPolarHBondContact O-CB 3.47Å; E594-R598 PolarHBondContact O-N 3.49Å
595	A	94.4	Very high	92.7	Very high	1 Å²	1	40 Å²	40	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-48.2	173.5	0	0	0	0	0	111.9	L540 F577 M591 T592 R597 R598 V599 F638	L540-A595 HydrophobicContact CD2-CB 3.72Å; F577-A595 HydrophobicContact CE2-CB 3.79Å; F577-A595 HydrophobicContact CZ-CB 3.49Å; F577-A595 VanDerWaalsContact CZ-CB 3.49Å; M591-A595 WeakPolarHBondContact O-CB 3.3Å; M591-A595 PolarHBondContact O-N 3.31Å; T592-A595 PolarHBondContact O-N 3.24Å; A595-R597 VanDerWaalsContact C-N 3.33Å; A595-R597 PolarHBondContact O-N 3.33Å; A595-R598 PolarHBondContact O-N 3.29Å; A595-V599 WeakPolarHBondContact O-CG2 3.39Å; A595-V599 PolarHBondContact O-N 3.02Å; A595-F638 HydrophobicContact CB-CE1 4Å; A595-F638 HydrophobicContact CB-CZ 4.35Å
596	L	94.4	Very high	92.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-54.8	-50.2	174	166.8	65.6	0	0	0	110.9	T592 N593 R598 V599 V600 F638 A643 T647 L650	T592-L596 PolarHBondContact O-N 2.9Å; N593-L596 PolarHBondContact O-N 3.43Å; L596-R598 VanDerWaalsContact C-N 3.32Å; L596-R598 PolarHBondContact O-N 2.71Å; L596-V599 PolarHBondContact O-N 3.32Å; L596-V600 HydrophobicContact CD1-CG2 3.95Å; L596-V600 WeakPolarHBondContact O-CG2 3.47Å; L596-V600 PolarHBondContact O-N 3.46Å; L596-F638 VanDerWaalsContact CA-CZ 3.49Å; L596-F638 HydrophobicContact CB-CB 4.4Å; L596-F638 HydrophobicContact CB-CD1 3.65Å; L596-F638 HydrophobicContact CB-CD2 4.02Å; L596-F638 HydrophobicContact CB-CE1 3.8Å; L596-F638 HydrophobicContact CB-CE2 4.17Å; L596-F638 HydrophobicContact CB-CG 3.76Å; L596-F638 HydrophobicContact CB-CZ 4.07Å; L596-F638 HydrophobicContact CD1-CB 4.02Å; L596-F638 HydrophobicContact CD1-CD1 4.49Å; L596-F638 HydrophobicContact CD1-CD2 3.41Å; L596-F638 VanDerWaalsContact CD1-CD2 3.41Å; L596-F638 HydrophobicContact CD1-CE2 3.96Å; L596-F638 HydrophobicContact CD1-CG 3.72Å; L596-F638 HydrophobicContact CD2-CB 4.43Å; L596-F638 HydrophobicContact CG-CB 4.49Å; L596-F638 HydrophobicContact CG-CD2 4.27Å; L596-F638 HydrophobicContact CG-CG 4.19Å; L596-A643 HydrophobicContact CD2-CB 4.31Å; L596-T647 HydrophobicContact CD2-CG2 4.1Å; L596-L650 HydrophobicContact CD2-CB 4.39Å; L596-L650 HydrophobicContact CD2-CD1 3.68Å; L596-L650 HydrophobicContact CG-CB 4.43Å; L596-L650 HydrophobicContact CG-CD1 3.85Å
597	R	92.5	Very high	92.9	Very high	26 Å²	26	29.8 Å²	29.8	10%	0.098	14%	0.142	C	C	.	.	H	α-helix	trans	-58.2	-46.8	180	-174.5	179.1	-175.3	-85	-2.9	110.8	N593 E594 A595 V600 V601 L650 P723 D727	N593-R597 WeakPolarHBondContact O-CB 3.28Å; N593-R597 PolarHBondContact O-N 2.95Å; E594-R597 PolarHBondContact O-N 3.27Å; A595-R597 VanDerWaalsContact C-N 3.33Å; A595-R597 PolarHBondContact O-N 3.33Å; R597-V600 PolarHBondContact O-N 3.23Å; R597-V601 HydrophobicContact CG-CG2 4.26Å; R597-V601 WeakPolarHBondContact O-CB 3.31Å; R597-V601 WeakPolarHBondContact O-CG2 3.46Å; R597-V601 PolarHBondContact O-N 3.01Å; R597-L650 HydrophobicContact CB-CD1 4.23Å; R597-L650 HydrophobicContact CG-CD2 4.4Å; R597-P723 PolarHBondContact NH2-O 2.65Å; R597-D727 IonicContact CZ-OD2 2.79Å; R597-D727 IonicContact NH1-OD2 3.59Å; R597-D727 IonicContact NH2-OD2 3.55Å; R597-D727 PolarHBondContact NH2-OD2 3.5Å
598	R	93.4	Very high	92.7	Very high	69 Å²	69	28.7 Å²	28.7	26%	0.26	14%	0.137	S	C	.	.	H	α-helix	trans	-65.7	-41.9	-178.8	-168.8	174.5	171.5	176	4.8	111.9	D541 F544 E594 A595 L596 V601 E602	D541-R598 IonicContact OD1-CZ 3.71Å; D541-R598 VanDerWaalsContact OD1-CZ 3.31Å; D541-R598 IonicContact OD1-NH1 3.16Å; D541-R598 PolarHBondContact OD1-NH1 3.43Å; D541-R598 IonicContact OD1-NH2 2.78Å; D541-R598 PolarHBondContact OD1-NH2 3.27Å; F544-R598 HydrophobicContact CD1-CG 3.96Å; F544-R598 HydrophobicContact CD2-CG 4.27Å; F544-R598 HydrophobicContact CE1-CB 3.97Å; F544-R598 HydrophobicContact CE1-CG 3.48Å; F544-R598 VanDerWaalsContact CE1-CG 3.48Å; F544-R598 HydrophobicContact CE2-CB 3.94Å; F544-R598 VanDerWaalsContact CE2-CD 3.44Å; F544-R598 HydrophobicContact CE2-CG 3.85Å; F544-R598 HydrophobicContact CG-CG 4.33Å; F544-R598 VanDerWaalsContact CG-NE 3.32Å; F544-R598 HydrophobicContact CZ-CB 3.44Å; F544-R598 VanDerWaalsContact CZ-CB 3.44Å; F544-R598 HydrophobicContact CZ-CG 3.42Å; F544-R598 VanDerWaalsContact CZ-CG 3.42Å; E594-R598 WeakPolarHBondContact O-CB 3.47Å; E594-R598 PolarHBondContact O-N 3.49Å; A595-R598 PolarHBondContact O-N 3.29Å; L596-R598 VanDerWaalsContact C-N 3.32Å; L596-R598 PolarHBondContact O-N 2.71Å; R598-V601 PolarHBondContact O-N 3.49Å; R598-E602 WeakPolarHBondContact O-CB 3.31Å; R598-E602 WeakPolarHBondContact O-CG 3.4Å; R598-E602 PolarHBondContact O-N 3.39Å
599	V	94.5	Very high	92.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-49.5	173.9	171.4	0	0	0	0	111.1	F544 I569 A595 L596 E602 Y603 F634 F638	F544-V599 HydrophobicContact CE1-CG2 4.04Å; F544-V599 HydrophobicContact CZ-CG2 3.68Å; I569-V599 HydrophobicContact CG2-CG1 4.47Å; A595-V599 WeakPolarHBondContact O-CG2 3.39Å; A595-V599 PolarHBondContact O-N 3.02Å; L596-V599 PolarHBondContact O-N 3.32Å; V599-E602 PolarHBondContact O-N 3.21Å; V599-Y603 PolarHBondContact O-N 3.21Å; V599-F634 HydrophobicContact CG1-CD1 3.81Å; V599-F634 HydrophobicContact CG1-CD2 4.31Å; V599-F634 HydrophobicContact CG1-CE1 3.52Å; V599-F634 HydrophobicContact CG1-CE2 4.06Å; V599-F634 HydrophobicContact CG1-CG 4.21Å; V599-F634 HydrophobicContact CG1-CZ 3.65Å; V599-F638 HydrophobicContact CB-CE2 4.4Å; V599-F638 HydrophobicContact CG2-CE2 4.31Å; V599-F638 HydrophobicContact CG2-CZ 4.13Å
600	V	94.1	Very high	92.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-44.1	-179.8	169.9	0	0	0	0	111.1	L596 R597 E602 Y603 L604 L650 I654	L596-V600 HydrophobicContact CD1-CG2 3.95Å; L596-V600 WeakPolarHBondContact O-CG2 3.47Å; L596-V600 PolarHBondContact O-N 3.46Å; R597-V600 PolarHBondContact O-N 3.23Å; V600-E602 PolarHBondContact O-N 3.29Å; V600-Y603 WeakPolarHBondContact O-CB 3.37Å; V600-Y603 PolarHBondContact O-N 3.07Å; V600-L604 HydrophobicContact CG1-CD1 4Å; V600-L604 HydrophobicContact CG1-CG 4.33Å; V600-L604 VanDerWaalsContact O-CG 3.27Å; V600-L604 WeakPolarHBondContact O-CG 3.28Å; V600-L604 PolarHBondContact O-N 2.99Å; V600-L650 HydrophobicContact CG1-CB 4.43Å; V600-L650 WeakPolarHBondContact CG1-O 3.38Å; V600-L650 HydrophobicContact CG2-CB 4.24Å; V600-I654 HydrophobicContact CG1-CD1 4.32Å; V600-I654 HydrophobicContact CG1-CG1 4.36Å; V600-I654 HydrophobicContact CG2-CD1 4.35Å
601	V	93.4	Very high	91.2	Very high	8 Å²	8	34.8 Å²	34.8	5%	0.048	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-41.8	178.7	167.2	0	0	0	0	111.4	R597 R598 Y603 L604 K605 I724 I728	R597-V601 HydrophobicContact CG-CG2 4.26Å; R597-V601 WeakPolarHBondContact O-CB 3.31Å; R597-V601 WeakPolarHBondContact O-CG2 3.46Å; R597-V601 PolarHBondContact O-N 3.01Å; R598-V601 PolarHBondContact O-N 3.49Å; V601-Y603 VanDerWaalsContact C-N 3.33Å; V601-Y603 PolarHBondContact O-N 3.4Å; V601-L604 PolarHBondContact O-N 3.22Å; V601-K605 HydrophobicContact CG1-CD 4.23Å; V601-K605 HydrophobicContact CG1-CG 4.41Å; V601-K605 WeakPolarHBondContact O-CB 3.44Å; V601-K605 VanDerWaalsContact O-CG 3.31Å; V601-K605 WeakPolarHBondContact O-CG 3.36Å; V601-K605 PolarHBondContact O-N 2.93Å; V601-I724 HydrophobicContact CG2-CG2 4.35Å; V601-I728 HydrophobicContact CG1-CG1 4.2Å
602	E	93	Very high	90.9	Very high	56 Å²	56	35.1 Å²	35.1	26%	0.262	15%	0.151	S	C	.	.	H	α-helix	trans	-64.6	-37.2	174.9	-71.6	-53.7	136.7	0	0	112.1	L551 R598 V599 V600 K605 A606	L551-E602 HydrophobicContact CD1-CB 4.36Å; L551-E602 HydrophobicContact CD1-CG 4.32Å; L551-E602 HydrophobicContact CD2-CB 4.01Å; R598-E602 WeakPolarHBondContact O-CB 3.31Å; R598-E602 WeakPolarHBondContact O-CG 3.4Å; R598-E602 PolarHBondContact O-N 3.39Å; V599-E602 PolarHBondContact O-N 3.21Å; V600-E602 PolarHBondContact O-N 3.29Å; E602-K605 PolarHBondContact O-N 2.87Å; E602-K605 WeakPolarHBondContact OE1-CD 3.5Å; E602-K605 IonicContact OE1-NZ 3.67Å; E602-K605 PolarHBondContact OE1-NZ 3.49Å; E602-A606 PolarHBondContact O-N 2.87Å
603	Y	94.6	Very high	90.6	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-47.8	172.9	-164.1	-76.4	0	0	0	111.8	L554 L555 V566 V599 V600 V601 A606 V607 M627 E630 F634 I654	L554-Y603 HydrophobicContact CD1-CD2 3.67Å; L554-Y603 HydrophobicContact CD1-CE2 4.3Å; L554-Y603 HydrophobicContact CD1-CG 4.3Å; L554-Y603 HydrophobicContact CD2-CD2 4.26Å; L554-Y603 HydrophobicContact CD2-CE2 4.08Å; L555-Y603 HydrophobicContact CD2-CE1 4.04Å; V566-Y603 HydrophobicContact CG2-CE2 4.23Å; V599-Y603 PolarHBondContact O-N 3.21Å; V600-Y603 WeakPolarHBondContact O-CB 3.37Å; V600-Y603 PolarHBondContact O-N 3.07Å; V601-Y603 VanDerWaalsContact C-N 3.33Å; V601-Y603 PolarHBondContact O-N 3.4Å; Y603-A606 WeakPolarHBondContact O-CB 3.37Å; Y603-A606 PolarHBondContact O-N 2.92Å; Y603-A606 VanDerWaalsContact O-N 3.17Å; Y603-V607 HydrophobicContact CD1-CG2 4.31Å; Y603-V607 HydrophobicContact CE1-CG2 4.26Å; Y603-V607 PolarHBondContact O-N 2.69Å; Y603-V607 VanDerWaalsContact O-N 3.11Å; Y603-M627 HydrophobicContact CE1-CE 4.2Å; Y603-M627 HydrophobicContact CE1-CG 4.29Å; Y603-M627 WeakPolarHBondContact OH-CG 3.46Å; Y603-E630 HydrophobicContact CE2-CB 4.27Å; Y603-E630 VanDerWaalsContact CE2-OE2 3.27Å; Y603-E630 WeakPolarHBondContact CE2-OE2 3.42Å; Y603-E630 PolarHBondContact OH-OE2 3.47Å; Y603-F634 AromaticContact CD2-CE2 3.67Å; Y603-F634 HydrophobicContact CD2-CE2 3.67Å; Y603-F634 HydrophobicContact CD2-CZ 4.19Å; Y603-F634 HydrophobicContact CE2-CE2 4.13Å; Y603-F634 HydrophobicContact CG-CE2 4.41Å; Y603-I654 HydrophobicContact CD1-CD1 3.79Å; Y603-I654 HydrophobicContact CD1-CG1 3.92Å; Y603-I654 HydrophobicContact CD1-CG2 3.94Å; Y603-I654 HydrophobicContact CD2-CD1 4.45Å; Y603-I654 HydrophobicContact CE1-CD1 4.38Å; Y603-I654 HydrophobicContact CE1-CG1 4.44Å; Y603-I654 HydrophobicContact CE1-CG2 3.57Å; Y603-I654 HydrophobicContact CG-CD1 3.85Å; Y603-I654 HydrophobicContact CG-CG1 4.44Å
604	L	93.5	Very high	90.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-37.8	178.1	-65.2	174.9	0	0	0	112.1	V600 V601 A606 V607 M608 I654 I657 I724 F725 I728	V600-L604 HydrophobicContact CG1-CD1 4Å; V600-L604 HydrophobicContact CG1-CG 4.33Å; V600-L604 VanDerWaalsContact O-CG 3.27Å; V600-L604 WeakPolarHBondContact O-CG 3.28Å; V600-L604 PolarHBondContact O-N 2.99Å; V601-L604 PolarHBondContact O-N 3.22Å; L604-A606 VanDerWaalsContact C-N 3.29Å; L604-A606 PolarHBondContact O-N 3.17Å; L604-V607 WeakPolarHBondContact O-CB 3.4Å; L604-V607 PolarHBondContact O-N 3.11Å; L604-M608 WeakPolarHBondContact O-CG 3.44Å; L604-M608 PolarHBondContact O-N 3.09Å; L604-I654 HydrophobicContact CD2-CG1 4.06Å; L604-I654 HydrophobicContact CG-CG1 4.49Å; L604-I657 HydrophobicContact CD2-CD1 3.43Å; L604-I657 VanDerWaalsContact CD2-CD1 3.43Å; L604-I724 HydrophobicContact CD1-CG2 3.48Å; L604-I724 VanDerWaalsContact CD1-CG2 3.48Å; L604-F725 HydrophobicContact CD1-CE1 4.04Å; L604-F725 HydrophobicContact CD1-CZ 4.01Å; L604-F725 HydrophobicContact CD2-CE1 4.3Å; L604-F725 HydrophobicContact CD2-CZ 4.33Å; L604-I728 HydrophobicContact CB-CD1 3.46Å; L604-I728 VanDerWaalsContact CB-CD1 3.46Å; L604-I728 HydrophobicContact CD1-CD1 4.05Å; L604-I728 HydrophobicContact CG-CD1 4.44Å
605	K	92.8	Very high	90.3	Very high	47 Å²	47	39.3 Å²	39.3	20%	0.204	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-43.2	170.7	-78.4	173.5	-177	173.8	0	110.7	V601 E602 V607 M608 Q609 I728	V601-K605 HydrophobicContact CG1-CD 4.23Å; V601-K605 HydrophobicContact CG1-CG 4.41Å; V601-K605 WeakPolarHBondContact O-CB 3.44Å; V601-K605 VanDerWaalsContact O-CG 3.31Å; V601-K605 WeakPolarHBondContact O-CG 3.36Å; V601-K605 PolarHBondContact O-N 2.93Å; E602-K605 PolarHBondContact O-N 2.87Å; E602-K605 WeakPolarHBondContact OE1-CD 3.5Å; E602-K605 IonicContact OE1-NZ 3.67Å; E602-K605 PolarHBondContact OE1-NZ 3.49Å; K605-V607 VanDerWaalsContact C-N 3.3Å; K605-V607 PolarHBondContact O-N 3.44Å; K605-M608 PolarHBondContact O-N 3.27Å; K605-M608 VanDerWaalsContact O-N 3.13Å; K605-Q609 WeakPolarHBondContact O-CB 3.32Å; K605-Q609 VanDerWaalsContact O-CG 3.27Å; K605-Q609 WeakPolarHBondContact O-CG 3.28Å; K605-Q609 PolarHBondContact O-N 3.41Å; K605-I728 HydrophobicContact CG-CB 4.49Å; K605-I728 HydrophobicContact CG-CG1 4.17Å; K605-I728 HydrophobicContact CG-CG2 3.97Å
606	A	91.9	Very high	90.1	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.033	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-41.6	176.1	0	0	0	0	0	111.7	L554 L555 E602 Y603 L604 M608 K610	L554-A606 HydrophobicContact CB-CB 3.73Å; L555-A606 HydrophobicContact CB-CB 4.23Å; L555-A606 HydrophobicContact CD2-CB 4.48Å; E602-A606 PolarHBondContact O-N 2.87Å; Y603-A606 WeakPolarHBondContact O-CB 3.37Å; Y603-A606 PolarHBondContact O-N 2.92Å; Y603-A606 VanDerWaalsContact O-N 3.17Å; L604-A606 VanDerWaalsContact C-N 3.29Å; L604-A606 PolarHBondContact O-N 3.17Å; A606-M608 PolarHBondContact O-N 3.43Å; A606-K610 HydrophobicContact CB-CG 4.21Å; A606-K610 WeakPolarHBondContact O-CB 3.36Å; A606-K610 WeakPolarHBondContact O-CG 3.43Å; A606-K610 PolarHBondContact O-N 3.18Å; A606-K610 VanDerWaalsContact O-N 3.14Å
607	V	90.8	Very high	89.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-44.7	173.3	178.7	0	0	0	0	112	L555 Y603 L604 K605 M627 I657 F661 L691 V694	L555-V607 HydrophobicContact CD1-CG2 4.2Å; L555-V607 HydrophobicContact CD2-CG2 3.94Å; L555-V607 HydrophobicContact CG-CB 4.42Å; L555-V607 HydrophobicContact CG-CG2 3.81Å; Y603-V607 HydrophobicContact CD1-CG2 4.31Å; Y603-V607 HydrophobicContact CE1-CG2 4.26Å; Y603-V607 PolarHBondContact O-N 2.69Å; Y603-V607 VanDerWaalsContact O-N 3.11Å; L604-V607 WeakPolarHBondContact O-CB 3.4Å; L604-V607 PolarHBondContact O-N 3.11Å; K605-V607 VanDerWaalsContact C-N 3.3Å; K605-V607 PolarHBondContact O-N 3.44Å; V607-M627 HydrophobicContact CG2-CE 3.89Å; V607-I657 HydrophobicContact CG1-CG2 4.11Å; V607-F661 HydrophobicContact CG1-CE2 4.27Å; V607-F661 HydrophobicContact CG1-CZ 4.07Å; V607-L691 HydrophobicContact CG1-CD1 4.3Å; V607-V694 WeakPolarHBondContact O-CG2 3.47Å
608	M	89.1	Confident	89.6	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-84.6	-26.1	-171.9	-60.6	-58.8	168.3	0	0	114.1	L604 K605 A606 I657 H687 A690 L691 F725 I728 V730	L604-M608 WeakPolarHBondContact O-CG 3.44Å; L604-M608 PolarHBondContact O-N 3.09Å; K605-M608 PolarHBondContact O-N 3.27Å; K605-M608 VanDerWaalsContact O-N 3.13Å; A606-M608 PolarHBondContact O-N 3.43Å; M608-I657 HydrophobicContact CE-CD1 3.74Å; M608-H687 HydrophobicContact SD-CB 4.32Å; M608-H687 VanDerWaalsContact SD-O 3.36Å; M608-A690 HydrophobicContact CB-CB 4.37Å; M608-A690 WeakPolarHBondContact O-CB 3.28Å; M608-A690 HydrophobicContact SD-CB 4.03Å; M608-L691 HydrophobicContact CE-CB 4.38Å; M608-L691 HydrophobicContact CE-CD1 4.48Å; M608-L691 HydrophobicContact SD-CB 4.37Å; M608-F725 HydrophobicContact CE-CE1 4.23Å; M608-I728 HydrophobicContact CB-CG2 4.25Å; M608-I728 HydrophobicContact CG-CG2 4.24Å; M608-V730 HydrophobicContact CB-CG2 4.23Å
609	Q	87.4	Confident	89.5	Confident	71 Å²	71	47.9 Å²	47.9	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-105.2	-27.2	-170.7	-60.5	179.6	-6.1	0	0	113.1	K605 T729	K605-Q609 WeakPolarHBondContact O-CB 3.32Å; K605-Q609 VanDerWaalsContact O-CG 3.27Å; K605-Q609 WeakPolarHBondContact O-CG 3.28Å; K605-Q609 PolarHBondContact O-N 3.41Å; Q609-T729 WeakPolarHBondContact CG-O 3.45Å; Q609-T729 PolarHBondContact NE2-O 3.31Å; Q609-T729 PolarHBondContact NE2-OG1 3.47Å
610	K	81.8	Confident	89.4	Confident	59 Å²	59	48.9 Å²	48.9	26%	0.257	23%	0.233	S	C	.	.	S	Bend	trans	-81.4	136.3	-177.1	-56	-79.7	177.3	167.9	0	109.7	N552 L555 A606 I612	N552-K610 PolarHBondContact O-NZ 2.9Å; N552-K610 PolarHBondContact OD1-NZ 2.71Å; L555-K610 HydrophobicContact CB-CB 4.35Å; L555-K610 HydrophobicContact CB-CG 4.49Å; A606-K610 HydrophobicContact CB-CG 4.21Å; A606-K610 WeakPolarHBondContact O-CB 3.36Å; A606-K610 WeakPolarHBondContact O-CG 3.43Å; A606-K610 PolarHBondContact O-N 3.18Å; A606-K610 VanDerWaalsContact O-N 3.14Å; K610-I612 PolarHBondContact O-N 2.96Å
611	R	73.5	Confident	89.3	Confident	245 Å²	245	54 Å²	54	93%	0.925	26%	0.255	S	S	*	.			trans	-85.3	41.6	-175.7	-62.3	-176.4	178.9	177.4	0.1	113.3
612	I	85.7	Confident	89.2	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.051	28%	0.277	C	S	.	.			trans	-79.9	143.6	170.7	-168.6	171.6	0	0	0	109.2	L555 L560 K610 V694	L555-I612 HydrophobicContact CB-CG2 4.29Å; L555-I612 HydrophobicContact CD1-CG2 4.32Å; L555-I612 WeakPolarHBondContact O-CB 3.39Å; L555-I612 WeakPolarHBondContact O-CG2 3.34Å; L560-I612 HydrophobicContact CB-CD1 4.34Å; L560-I612 HydrophobicContact CD2-CD1 4.46Å; K610-I612 PolarHBondContact O-N 2.96Å; I612-V694 HydrophobicContact CG2-CG1 4.03Å; I612-V694 WeakPolarHBondContact O-CA 3.33Å
613	T	87.9	Confident	89.2	Confident	62 Å²	62	56.1 Å²	56.1	38%	0.38	27%	0.265	S	S	.	.			trans	-134.4	124.3	172.7	-53.9	0	0	0	0	108.5	R557 K615 V694 G696	R557-T613 PolarHBondContact NH2-O 3.28Å; T613-K615 PolarHBondContact O-N 3.39Å; T613-V694 WeakPolarHBondContact CA-O 3.22Å; T613-G696 VanDerWaalsContact CG2-CA 3.42Å
614	F	90.8	Very high	89.2	Confident	3 Å²	3	56.1 Å²	56.1	1%	0.013	27%	0.265	C	S	.	.			trans	-69.6	125.7	174.9	-61.3	-60.7	0	0	0	109.8	W559 L560 E619 R620 F661 V694	W559-F614 HydrophobicContact CZ3-CE1 4.38Å; W559-F614 HydrophobicContact CZ3-CZ 4.36Å; L560-F614 HydrophobicContact CD1-CE1 4.02Å; L560-F614 HydrophobicContact CD2-CD1 4.28Å; L560-F614 HydrophobicContact CD2-CE1 4.33Å; F614-E619 HydrophobicContact CB-CB 4.31Å; F614-E619 HydrophobicContact CD1-CB 4.13Å; F614-E619 WeakPolarHBondContact CD1-O 3.43Å; F614-R620 HydrophobicContact CB-CB 4.34Å; F614-R620 HydrophobicContact CB-CG 3.33Å; F614-R620 HydrophobicContact CD2-CG 3.81Å; F614-R620 HydrophobicContact CG-CB 4.45Å; F614-R620 HydrophobicContact CG-CG 3.76Å; F614-F661 HydrophobicContact CE2-CD1 4.45Å; F614-F661 AromaticContact CE2-CD2 3.82Å; F614-F661 HydrophobicContact CE2-CD2 3.82Å; F614-F661 AromaticContact CE2-CE2 4Å; F614-F661 HydrophobicContact CE2-CE2 4Å; F614-F661 HydrophobicContact CE2-CG 4.05Å; F614-F661 HydrophobicContact CE2-CZ 4.37Å; F614-F661 HydrophobicContact CZ-CD2 4.49Å; F614-V694 HydrophobicContact CD2-CG1 4.1Å; F614-V694 WeakPolarHBondContact CD2-O 3.47Å; F614-V694 HydrophobicContact CE2-CG1 3.78Å; F614-V694 PolarHBondContact N-O 3.49Å
615	K	87.4	Confident	89.2	Confident	153 Å²	153	60.6 Å²	60.6	67%	0.665	29%	0.285	S	S	*	.			trans	-82.6	-28.2	-171.3	-65.9	177.9	-179.7	172.9	0	113.4	T613 E619	T613-K615 PolarHBondContact O-N 3.39Å; K615-E619 PolarHBondContact N-OE2 3.18Å
616	N	89.1	Confident	89.3	Confident	71 Å²	71	60.7 Å²	60.7	38%	0.38	29%	0.285	S	S	.	.	S	Bend	trans	-148.3	174.8	-174.8	59.2	34.1	0	0	0	110.8	D618 E619 R620	N616-D618 VanDerWaalsContact C-N 3.29Å; N616-D618 PolarHBondContact O-N 2.85Å; N616-D618 PolarHBondContact OD1-N 3.33Å; N616-E619 WeakPolarHBondContact OD1-CB 3.29Å; N616-E619 WeakPolarHBondContact OD1-CG 3.45Å; N616-E619 PolarHBondContact OD1-N 2.87Å; N616-R620 PolarHBondContact O-N 3.39Å
617	A	88.3	Confident	89.5	Confident	47 Å²	47	60.5 Å²	60.5	39%	0.388	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-32.7	-178.5	0	0	0	0	0	112.9	R620 K621	A617-R620 PolarHBondContact O-N 2.91Å; A617-K621 WeakPolarHBondContact O-CB 3.32Å; A617-K621 PolarHBondContact O-N 3.19Å
618	D	89.4	Confident	89.7	Confident	121 Å²	121	62.3 Å²	62.3	65%	0.647	29%	0.292	S	S	*	.	H	α-helix	trans	-69.2	-47.4	179.4	-60.6	-37.6	0	0	0	111.4	N616 R620 K621 E622	N616-D618 VanDerWaalsContact C-N 3.29Å; N616-D618 PolarHBondContact O-N 2.85Å; N616-D618 PolarHBondContact OD1-N 3.33Å; D618-R620 VanDerWaalsContact C-N 3.27Å; D618-R620 PolarHBondContact O-N 3.27Å; D618-K621 PolarHBondContact O-N 3.23Å; D618-K621 VanDerWaalsContact O-N 3.16Å; D618-E622 WeakPolarHBondContact O-CB 3.49Å; D618-E622 PolarHBondContact O-N 3.25Å
619	E	91.4	Very high	90	Very high	37 Å²	37	68.4 Å²	68.4	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-39.3	174.5	-79.7	-169.7	-172.1	0	0	111.3	R557 L560 F614 K615 N616 G623	R557-E619 IonicContact NH1-OE1 3.55Å; R557-E619 PolarHBondContact NH1-OE1 3.29Å; R557-E619 IonicContact NH1-OE2 2.98Å; R557-E619 PolarHBondContact NH1-OE2 3.37Å; L560-E619 HydrophobicContact CD2-CB 4.36Å; L560-E619 HydrophobicContact CD2-CG 4.15Å; F614-E619 HydrophobicContact CB-CB 4.31Å; F614-E619 HydrophobicContact CD1-CB 4.13Å; F614-E619 WeakPolarHBondContact CD1-O 3.43Å; K615-E619 PolarHBondContact N-OE2 3.18Å; N616-E619 WeakPolarHBondContact OD1-CB 3.29Å; N616-E619 WeakPolarHBondContact OD1-CG 3.45Å; N616-E619 PolarHBondContact OD1-N 2.87Å; E619-G623 PolarHBondContact O-N 2.75Å
620	R	91.7	Very high	90.4	Very high	22 Å²	22	65.3 Å²	65.3	8%	0.083	30%	0.304	C	S	.	.	H	α-helix	trans	-64.8	-46.1	175.7	-78.2	-163.6	-61.2	-98.8	11.2	112.1	F614 N616 A617 D618 G623 A624 R695 D697	F614-R620 HydrophobicContact CB-CB 4.34Å; F614-R620 HydrophobicContact CB-CG 3.33Å; F614-R620 HydrophobicContact CD2-CG 3.81Å; F614-R620 HydrophobicContact CG-CB 4.45Å; F614-R620 HydrophobicContact CG-CG 3.76Å; N616-R620 PolarHBondContact O-N 3.39Å; A617-R620 PolarHBondContact O-N 2.91Å; D618-R620 VanDerWaalsContact C-N 3.27Å; D618-R620 PolarHBondContact O-N 3.27Å; R620-G623 PolarHBondContact O-N 2.61Å; R620-A624 VanDerWaalsContact O-CB 3.27Å; R620-A624 WeakPolarHBondContact O-CB 3.48Å; R620-A624 PolarHBondContact O-N 2.7Å; R620-R695 WeakPolarHBondContact CD-O 3.45Å; R620-D697 VanDerWaalsContact CZ-CG 3.48Å; R620-D697 IonicContact CZ-OD2 2.74Å; R620-D697 IonicContact NE-OD2 3.7Å; R620-D697 VanDerWaalsContact NH1-CB 3.31Å; R620-D697 IonicContact NH1-OD1 3.79Å; R620-D697 IonicContact NH1-OD2 2.65Å; R620-D697 PolarHBondContact NH1-OD2 3.26Å; R620-D697 VanDerWaalsContact NH1-OD2 3.09Å; R620-D697 IonicContact NH2-OD2 2.65Å; R620-D697 PolarHBondContact NH2-OD2 3.49Å
621	K	91.5	Very high	91.1	Very high	109 Å²	109	62.5 Å²	62.5	47%	0.474	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-47.2	179.9	-177.4	-178.4	170.5	-174.7	0	110.5	A617 D618 A624 E625	A617-K621 WeakPolarHBondContact O-CB 3.32Å; A617-K621 PolarHBondContact O-N 3.19Å; D618-K621 PolarHBondContact O-N 3.23Å; D618-K621 VanDerWaalsContact O-N 3.16Å; K621-A624 PolarHBondContact O-N 3.45Å; K621-E625 WeakPolarHBondContact CE-OE1 3.42Å; K621-E625 HydrophobicContact CG-CG 4.46Å; K621-E625 IonicContact NZ-OE1 3.74Å; K621-E625 WeakPolarHBondContact O-CB 3.29Å; K621-E625 WeakPolarHBondContact O-CG 3.29Å; K621-E625 PolarHBondContact O-N 3.05Å
622	E	92.1	Very high	92.2	Very high	108 Å²	108	55.3 Å²	55.3	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-60.7	-47.5	177.2	-176.6	175.9	-168.9	0	0	111.5	D618 A624 E625 R626	D618-E622 WeakPolarHBondContact O-CB 3.49Å; D618-E622 PolarHBondContact O-N 3.25Å; E622-A624 PolarHBondContact O-N 3.35Å; E622-E625 PolarHBondContact O-N 2.87Å; E622-R626 WeakPolarHBondContact O-CB 3.43Å; E622-R626 PolarHBondContact O-N 2.75Å
623	G	92.8	Very high	92.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-43.2	175.9	0	0	0	0	0	112.8	E619 R620 R626 M627	E619-G623 PolarHBondContact O-N 2.75Å; R620-G623 PolarHBondContact O-N 2.61Å; G623-R626 PolarHBondContact O-N 2.68Å; G623-M627 VanDerWaalsContact O-CG 3.26Å; G623-M627 WeakPolarHBondContact O-CG 3.37Å; G623-M627 PolarHBondContact O-N 3.03Å
624	A	93.8	Very high	93	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-47.6	178.1	0	0	0	0	0	112.7	R620 K621 E622 R626 M627 I628 A658 F661 K662	R620-A624 VanDerWaalsContact O-CB 3.27Å; R620-A624 WeakPolarHBondContact O-CB 3.48Å; R620-A624 PolarHBondContact O-N 2.7Å; K621-A624 PolarHBondContact O-N 3.45Å; E622-A624 PolarHBondContact O-N 3.35Å; A624-R626 PolarHBondContact O-N 2.82Å; A624-M627 PolarHBondContact O-N 3.26Å; A624-I628 VanDerWaalsContact O-CG1 3.32Å; A624-I628 WeakPolarHBondContact O-CG1 3.06Å; A624-I628 PolarHBondContact O-N 3.24Å; A624-A658 HydrophobicContact CB-CB 4.4Å; A624-A658 WeakPolarHBondContact CB-O 3.35Å; A624-F661 HydrophobicContact CB-CB 4.01Å; A624-K662 HydrophobicContact CB-CB 3.78Å; A624-K662 HydrophobicContact CB-CG 4.38Å
625	E	94.3	Very high	93.2	Very high	93 Å²	93	56.4 Å²	56.4	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-38.4	176.7	-74.5	175.4	174.4	0	0	111.2	K621 E622 I628 K629	K621-E625 WeakPolarHBondContact CE-OE1 3.42Å; K621-E625 HydrophobicContact CG-CG 4.46Å; K621-E625 IonicContact NZ-OE1 3.74Å; K621-E625 WeakPolarHBondContact O-CB 3.29Å; K621-E625 WeakPolarHBondContact O-CG 3.29Å; K621-E625 PolarHBondContact O-N 3.05Å; E622-E625 PolarHBondContact O-N 2.87Å; E625-I628 PolarHBondContact O-N 3.28Å; E625-K629 PolarHBondContact O-N 3.1Å
626	R	94.4	Very high	93.6	Very high	50 Å²	50	56.3 Å²	56.3	19%	0.189	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-48.1	174.4	-177	173.6	178.4	119.7	19.2	112.6	W559 S563 E622 G623 A624 I628 K629 E630	W559-R626 HydrophobicContact CZ2-CB 4.25Å; W559-R626 HydrophobicContact CZ2-CG 3.83Å; W559-R626 VanDerWaalsContact NE1-NE 3.18Å; W559-R626 PolarHBondContact O-NH1 3.21Å; S563-R626 PolarHBondContact O-NH2 2.98Å; E622-R626 WeakPolarHBondContact O-CB 3.43Å; E622-R626 PolarHBondContact O-N 2.75Å; G623-R626 PolarHBondContact O-N 2.68Å; A624-R626 PolarHBondContact O-N 2.82Å; R626-I628 VanDerWaalsContact C-N 3.27Å; R626-I628 PolarHBondContact O-N 3.11Å; R626-K629 PolarHBondContact O-N 3.08Å; R626-K629 VanDerWaalsContact O-N 3.16Å; R626-E630 HydrophobicContact CG-CG 4.36Å; R626-E630 IonicContact CZ-OE1 3.43Å; R626-E630 IonicContact NE-OE1 3.57Å; R626-E630 PolarHBondContact NE-OE1 3.06Å; R626-E630 IonicContact NH2-OE1 2.71Å; R626-E630 PolarHBondContact NH2-OE1 3.37Å; R626-E630 WeakPolarHBondContact O-CB 3.41Å; R626-E630 WeakPolarHBondContact O-CG 3.47Å; R626-E630 PolarHBondContact O-N 2.8Å
627	M	95.6	Very high	93.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-40.2	175.9	-71.9	174	68	0	0	112.1	W559 Y603 V607 G623 A624 E630 A631 I654 I657 A658 F661	W559-M627 HydrophobicContact CH2-CG 3.93Å; W559-M627 HydrophobicContact CZ2-CG 3.86Å; Y603-M627 HydrophobicContact CE1-CE 4.2Å; Y603-M627 HydrophobicContact CE1-CG 4.29Å; Y603-M627 WeakPolarHBondContact OH-CG 3.46Å; V607-M627 HydrophobicContact CG2-CE 3.89Å; G623-M627 VanDerWaalsContact O-CG 3.26Å; G623-M627 WeakPolarHBondContact O-CG 3.37Å; G623-M627 PolarHBondContact O-N 3.03Å; A624-M627 PolarHBondContact O-N 3.26Å; M627-E630 PolarHBondContact O-N 3.22Å; M627-A631 WeakPolarHBondContact O-CB 3.44Å; M627-A631 PolarHBondContact O-N 3.46Å; M627-I654 HydrophobicContact CB-CG2 4.17Å; M627-I654 HydrophobicContact CE-CG2 4.19Å; M627-I657 HydrophobicContact CE-CB 4.23Å; M627-I657 HydrophobicContact CE-CG2 3.53Å; M627-A658 HydrophobicContact CB-CB 3.77Å; M627-A658 HydrophobicContact CE-CB 4.4Å; M627-A658 HydrophobicContact SD-CB 4.45Å; M627-F661 HydrophobicContact CE-CD2 4.29Å; M627-F661 HydrophobicContact CE-CE2 4.04Å; M627-F661 HydrophobicContact SD-CD2 3.56Å; M627-F661 VanDerWaalsContact SD-CD2 3.56Å; M627-F661 HydrophobicContact SD-CE2 3.63Å
628	I	96.1	Very high	94.1	Very high	38 Å²	38	51 Å²	51	20%	0.195	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-45.3	176.6	-65.7	168.2	0	0	0	110.6	A624 E625 R626 A631 E632 T655 A658 E659 K662	A624-I628 VanDerWaalsContact O-CG1 3.32Å; A624-I628 WeakPolarHBondContact O-CG1 3.06Å; A624-I628 PolarHBondContact O-N 3.24Å; E625-I628 PolarHBondContact O-N 3.28Å; R626-I628 VanDerWaalsContact C-N 3.27Å; R626-I628 PolarHBondContact O-N 3.11Å; I628-A631 PolarHBondContact O-N 2.84Å; I628-E632 PolarHBondContact O-N 2.94Å; I628-T655 HydrophobicContact CG1-CG2 4.24Å; I628-A658 HydrophobicContact CD1-CB 4.22Å; I628-A658 HydrophobicContact CG1-CB 3.64Å; I628-E659 WeakPolarHBondContact CD1-OE1 3.49Å; I628-K662 HydrophobicContact CD1-CD 4.38Å
629	K	95.4	Very high	94.2	Very high	138 Å²	138	50 Å²	50	60%	0.6	22%	0.224	S	C	*	.	H	α-helix	trans	-62.6	-45.2	177.9	-173.3	-175.3	175.7	-169.5	0	111.8	E625 R626 A631 E632 Q633	E625-K629 PolarHBondContact O-N 3.1Å; R626-K629 PolarHBondContact O-N 3.08Å; R626-K629 VanDerWaalsContact O-N 3.16Å; K629-A631 VanDerWaalsContact C-N 3.34Å; K629-E632 PolarHBondContact O-N 2.97Å; K629-Q633 WeakPolarHBondContact O-CG 3.23Å; K629-Q633 PolarHBondContact O-N 3.08Å
630	E	96.3	Very high	94.2	Very high	5 Å²	5	54.2 Å²	54.2	2%	0.023	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-37.2	178.5	-70.4	175.8	172.9	0	0	111.2	W559 V566 Y603 R626 M627 Q633 F634	W559-E630 PolarHBondContact NE1-OE1 2.98Å; W559-E630 PolarHBondContact NE1-OE2 3.07Å; V566-E630 HydrophobicContact CB-CB 4.42Å; V566-E630 HydrophobicContact CB-CG 3.91Å; V566-E630 HydrophobicContact CG1-CB 4.02Å; V566-E630 HydrophobicContact CG1-CG 3.98Å; V566-E630 HydrophobicContact CG2-CB 4.08Å; V566-E630 HydrophobicContact CG2-CG 3.71Å; Y603-E630 HydrophobicContact CE2-CB 4.27Å; Y603-E630 VanDerWaalsContact CE2-OE2 3.27Å; Y603-E630 WeakPolarHBondContact CE2-OE2 3.42Å; Y603-E630 PolarHBondContact OH-OE2 3.47Å; R626-E630 HydrophobicContact CG-CG 4.36Å; R626-E630 IonicContact CZ-OE1 3.43Å; R626-E630 IonicContact NE-OE1 3.57Å; R626-E630 PolarHBondContact NE-OE1 3.06Å; R626-E630 IonicContact NH2-OE1 2.71Å; R626-E630 PolarHBondContact NH2-OE1 3.37Å; R626-E630 WeakPolarHBondContact O-CB 3.41Å; R626-E630 WeakPolarHBondContact O-CG 3.47Å; R626-E630 PolarHBondContact O-N 2.8Å; M627-E630 PolarHBondContact O-N 3.22Å; E630-Q633 WeakPolarHBondContact O-CB 3.41Å; E630-Q633 PolarHBondContact O-N 3.35Å; E630-F634 VanDerWaalsContact O-CD2 3.31Å; E630-F634 WeakPolarHBondContact O-CD2 3.46Å; E630-F634 PolarHBondContact O-N 3.18Å
631	A	95.8	Very high	94.2	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-40.4	172.6	0	0	0	0	0	112.9	M627 I628 K629 K635 I654	M627-A631 WeakPolarHBondContact O-CB 3.44Å; M627-A631 PolarHBondContact O-N 3.46Å; I628-A631 PolarHBondContact O-N 2.84Å; K629-A631 VanDerWaalsContact C-N 3.34Å; A631-K635 VanDerWaalsContact O-CB 3.28Å; A631-K635 WeakPolarHBondContact O-CB 3.48Å; A631-K635 PolarHBondContact O-N 3.38Å; A631-I654 HydrophobicContact CB-CB 3.92Å; A631-I654 HydrophobicContact CB-CG2 3.94Å
632	E	95.5	Very high	93.7	Very high	93 Å²	93	52.6 Å²	52.6	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-68.8	-32.6	174.6	-76.8	-62.4	156	0	0	112.4	I628 K629 K635 F636	I628-E632 PolarHBondContact O-N 2.94Å; K629-E632 PolarHBondContact O-N 2.97Å; E632-K635 PolarHBondContact O-N 3.36Å; E632-K635 IonicContact OE1-NZ 2.71Å; E632-K635 PolarHBondContact OE1-NZ 3.04Å; E632-K635 WeakPolarHBondContact OE2-CD 3.34Å; E632-F636 WeakPolarHBondContact O-CB 3.43Å; E632-F636 PolarHBondContact O-N 3.14Å
633	Q	95.6	Very high	92.9	Very high	49 Å²	49	48.1 Å²	48.1	23%	0.229	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-50.1	172.1	-74.1	177.4	-37.6	0	0	111.6	V566 D567 K629 E630 K635 F636 L637	V566-Q633 HydrophobicContact CG1-CB 4.48Å; V566-Q633 VanDerWaalsContact CG1-OE1 3.27Å; D567-Q633 PolarHBondContact OD1-NE2 2.94Å; K629-Q633 WeakPolarHBondContact O-CG 3.23Å; K629-Q633 PolarHBondContact O-N 3.08Å; E630-Q633 WeakPolarHBondContact O-CB 3.41Å; E630-Q633 PolarHBondContact O-N 3.35Å; Q633-K635 VanDerWaalsContact C-N 3.32Å; Q633-K635 PolarHBondContact O-N 3.48Å; Q633-F636 PolarHBondContact O-N 3.42Å; Q633-L637 PolarHBondContact O-N 2.82Å
634	F	95.8	Very high	92.1	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-43.8	175.5	-65.5	-42.4	0	0	0	111.7	V566 I569 V599 Y603 E630 F636 L637 F638 I654	V566-F634 HydrophobicContact CB-CZ 4.43Å; V566-F634 HydrophobicContact CG1-CD1 4.43Å; V566-F634 HydrophobicContact CG1-CE1 3.73Å; V566-F634 HydrophobicContact CG1-CE2 4.31Å; V566-F634 HydrophobicContact CG1-CZ 3.66Å; V566-F634 HydrophobicContact CG2-CZ 4.07Å; I569-F634 HydrophobicContact CG2-CE1 3.94Å; V599-F634 HydrophobicContact CG1-CD1 3.81Å; V599-F634 HydrophobicContact CG1-CD2 4.31Å; V599-F634 HydrophobicContact CG1-CE1 3.52Å; V599-F634 HydrophobicContact CG1-CE2 4.06Å; V599-F634 HydrophobicContact CG1-CG 4.21Å; V599-F634 HydrophobicContact CG1-CZ 3.65Å; Y603-F634 AromaticContact CD2-CE2 3.67Å; Y603-F634 HydrophobicContact CD2-CE2 3.67Å; Y603-F634 HydrophobicContact CD2-CZ 4.19Å; Y603-F634 HydrophobicContact CE2-CE2 4.13Å; Y603-F634 HydrophobicContact CG-CE2 4.41Å; E630-F634 VanDerWaalsContact O-CD2 3.31Å; E630-F634 WeakPolarHBondContact O-CD2 3.46Å; E630-F634 PolarHBondContact O-N 3.18Å; F634-F636 VanDerWaalsContact C-N 3.34Å; F634-F636 PolarHBondContact O-N 2.88Å; F634-L637 PolarHBondContact O-N 2.87Å; F634-F638 HydrophobicContact CB-CD2 4.47Å; F634-F638 VanDerWaalsContact O-CD2 3.3Å; F634-F638 WeakPolarHBondContact O-CD2 3.29Å; F634-F638 PolarHBondContact O-N 3.06Å; F634-I654 HydrophobicContact CD2-CD1 4.17Å; F634-I654 HydrophobicContact CE2-CD1 4.39Å
635	K	94.9	Very high	91.1	Very high	48 Å²	48	59 Å²	59	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-43.7	177.2	179.3	174.9	161.2	170.7	0	112.1	A631 E632 Q633 K639 T647 D648 C651	A631-K635 VanDerWaalsContact O-CB 3.28Å; A631-K635 WeakPolarHBondContact O-CB 3.48Å; A631-K635 PolarHBondContact O-N 3.38Å; E632-K635 PolarHBondContact O-N 3.36Å; E632-K635 IonicContact OE1-NZ 2.71Å; E632-K635 PolarHBondContact OE1-NZ 3.04Å; E632-K635 WeakPolarHBondContact OE2-CD 3.34Å; Q633-K635 VanDerWaalsContact C-N 3.32Å; Q633-K635 PolarHBondContact O-N 3.48Å; K635-K639 HydrophobicContact CG-CD 4.25Å; K635-K639 VanDerWaalsContact O-CB 3.27Å; K635-K639 WeakPolarHBondContact O-CB 3.17Å; K635-K639 VanDerWaalsContact O-CG 3.23Å; K635-K639 WeakPolarHBondContact O-CG 3.34Å; K635-K639 PolarHBondContact O-N 3.25Å; K635-T647 HydrophobicContact CG-CG2 4.32Å; K635-D648 WeakPolarHBondContact CE-OD1 3.48Å; K635-D648 IonicContact NZ-OD1 3.71Å; K635-D648 PolarHBondContact NZ-OD1 3.31Å; K635-C651 HydrophobicContact CB-CB 4.02Å
636	F	94.8	Very high	90.5	Very high	152 Å²	152	57.7 Å²	57.7	67%	0.667	29%	0.286	S	S	*	.	H	α-helix	trans	-62.5	-48.9	176.5	177.1	-96.5	0	0	0	111.6	E632 Q633 F634 K639 K640	E632-F636 WeakPolarHBondContact O-CB 3.43Å; E632-F636 PolarHBondContact O-N 3.14Å; Q633-F636 PolarHBondContact O-N 3.42Å; F634-F636 VanDerWaalsContact C-N 3.34Å; F634-F636 PolarHBondContact O-N 2.88Å; F636-K639 PolarHBondContact O-N 2.98Å; F636-K640 WeakPolarHBondContact O-CB 3.26Å; F636-K640 PolarHBondContact O-N 3.31Å
637	L	94.8	Very high	90.2	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-54.7	178.4	173.4	63.4	0	0	0	111.7	C570 V573 E574 Q633 F634 K639 K640 L641	C570-L637 HydrophobicContact CB-CD2 3.9Å; V573-L637 HydrophobicContact CB-CD2 4.1Å; V573-L637 HydrophobicContact CG1-CD2 4Å; E574-L637 HydrophobicContact CB-CD1 3.83Å; E574-L637 HydrophobicContact CG-CD1 4.16Å; Q633-L637 PolarHBondContact O-N 2.82Å; F634-L637 PolarHBondContact O-N 2.87Å; L637-K639 VanDerWaalsContact C-N 3.33Å; L637-K639 PolarHBondContact O-N 2.9Å; L637-K640 CarbonylContact O-C 3.57Å; L637-K640 WeakPolarHBondContact O-CA 3.37Å; L637-K640 VanDerWaalsContact O-CB 3.27Å; L637-K640 WeakPolarHBondContact O-CB 3.49Å; L637-K640 PolarHBondContact O-N 3.44Å; L637-L641 HydrophobicContact CD1-CD1 3.97Å; L637-L641 HydrophobicContact CD1-CG 4.14Å; L637-L641 HydrophobicContact CG-CD1 4.08Å; L637-L641 WeakPolarHBondContact O-CG 3.4Å; L637-L641 PolarHBondContact O-N 3.37Å
638	F	94.1	Very high	89.8	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-71.5	-27.4	-174.8	-76.8	-73.1	0	0	0	112.7	V573 T592 A595 L596 V599 F634 L641 A642 A643 T647	V573-F638 HydrophobicContact CG1-CE1 4.23Å; V573-F638 HydrophobicContact CG1-CZ 3.98Å; T592-F638 HydrophobicContact CG2-CD1 4.01Å; A595-F638 HydrophobicContact CB-CE1 4Å; A595-F638 HydrophobicContact CB-CZ 4.35Å; L596-F638 VanDerWaalsContact CA-CZ 3.49Å; L596-F638 HydrophobicContact CB-CB 4.4Å; L596-F638 HydrophobicContact CB-CD1 3.65Å; L596-F638 HydrophobicContact CB-CD2 4.02Å; L596-F638 HydrophobicContact CB-CE1 3.8Å; L596-F638 HydrophobicContact CB-CE2 4.17Å; L596-F638 HydrophobicContact CB-CG 3.76Å; L596-F638 HydrophobicContact CB-CZ 4.07Å; L596-F638 HydrophobicContact CD1-CB 4.02Å; L596-F638 HydrophobicContact CD1-CD1 4.49Å; L596-F638 HydrophobicContact CD1-CD2 3.41Å; L596-F638 VanDerWaalsContact CD1-CD2 3.41Å; L596-F638 HydrophobicContact CD1-CE2 3.96Å; L596-F638 HydrophobicContact CD1-CG 3.72Å; L596-F638 HydrophobicContact CD2-CB 4.43Å; L596-F638 HydrophobicContact CG-CB 4.49Å; L596-F638 HydrophobicContact CG-CD2 4.27Å; L596-F638 HydrophobicContact CG-CG 4.19Å; V599-F638 HydrophobicContact CB-CE2 4.4Å; V599-F638 HydrophobicContact CG2-CE2 4.31Å; V599-F638 HydrophobicContact CG2-CZ 4.13Å; F634-F638 HydrophobicContact CB-CD2 4.47Å; F634-F638 VanDerWaalsContact O-CD2 3.3Å; F634-F638 WeakPolarHBondContact O-CD2 3.29Å; F634-F638 PolarHBondContact O-N 3.06Å; F638-L641 HydrophobicContact CD1-CD1 4.22Å; F638-L641 HydrophobicContact CE1-CD1 4.33Å; F638-L641 CarbonylContact O-C 3.49Å; F638-L641 PolarHBondContact O-N 3.38Å; F638-A642 PolarHBondContact O-N 3.14Å; F638-A643 HydrophobicContact CB-CB 3.85Å; F638-A643 HydrophobicContact CD1-CB 4.49Å; F638-A643 WeakPolarHBondContact O-CB 3.34Å; F638-A643 PolarHBondContact O-N 3.09Å; F638-T647 HydrophobicContact CB-CG2 4.14Å
639	K	92.1	Very high	89.5	Confident	100 Å²	100	60 Å²	60	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-65.2	-38.2	166.3	-75.4	-172.8	-178.3	-162.8	0	112.1	K635 F636 L637 A642 T647 D648	K635-K639 HydrophobicContact CG-CD 4.25Å; K635-K639 VanDerWaalsContact O-CB 3.27Å; K635-K639 WeakPolarHBondContact O-CB 3.17Å; K635-K639 VanDerWaalsContact O-CG 3.23Å; K635-K639 WeakPolarHBondContact O-CG 3.34Å; K635-K639 PolarHBondContact O-N 3.25Å; F636-K639 PolarHBondContact O-N 2.98Å; L637-K639 VanDerWaalsContact C-N 3.33Å; L637-K639 PolarHBondContact O-N 2.9Å; K639-A642 PolarHBondContact O-N 3.5Å; K639-T647 HydrophobicContact CG-CG2 4.05Å; K639-D648 WeakPolarHBondContact CE-OD1 3.39Å; K639-D648 WeakPolarHBondContact CE-OD2 3.34Å; K639-D648 VanDerWaalsContact NZ-CG 3.28Å; K639-D648 IonicContact NZ-OD1 3.93Å; K639-D648 PolarHBondContact NZ-OD1 3.44Å; K639-D648 IonicContact NZ-OD2 3.89Å; K639-D648 PolarHBondContact NZ-OD2 2.99Å
640	K	91.7	Very high	89.3	Confident	124 Å²	124	53.7 Å²	53.7	54%	0.539	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-38.8	173.9	179.2	-176.6	177	-179.8	0	111.8	E574 F636 L637 A642	E574-K640 WeakPolarHBondContact OE1-CE 3.3Å; E574-K640 IonicContact OE1-NZ 3.92Å; E574-K640 PolarHBondContact OE1-NZ 2.76Å; F636-K640 WeakPolarHBondContact O-CB 3.26Å; F636-K640 PolarHBondContact O-N 3.31Å; L637-K640 CarbonylContact O-C 3.57Å; L637-K640 WeakPolarHBondContact O-CA 3.37Å; L637-K640 VanDerWaalsContact O-CB 3.27Å; L637-K640 WeakPolarHBondContact O-CB 3.49Å; L637-K640 PolarHBondContact O-N 3.44Å; K640-A642 PolarHBondContact O-N 2.72Å
641	L	89.9	Confident	89.2	Confident	29 Å²	29	53.5 Å²	53.5	15%	0.152	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	6.8	175.3	-60.9	178.5	0	0	0	113.6	V573 F577 T592 L637 F638 A643	V573-L641 HydrophobicContact CG1-CD1 4.12Å; F577-L641 HydrophobicContact CB-CD1 3.92Å; F577-L641 HydrophobicContact CB-CD2 3.78Å; F577-L641 HydrophobicContact CB-CG 4.46Å; F577-L641 HydrophobicContact CD1-CD1 4.22Å; F577-L641 HydrophobicContact CD2-CD1 4.26Å; F577-L641 HydrophobicContact CG-CD1 3.85Å; F577-L641 HydrophobicContact CG-CD2 4.48Å; T592-L641 HydrophobicContact CG2-CB 3.86Å; L637-L641 HydrophobicContact CD1-CD1 3.97Å; L637-L641 HydrophobicContact CD1-CG 4.14Å; L637-L641 HydrophobicContact CG-CD1 4.08Å; L637-L641 WeakPolarHBondContact O-CG 3.4Å; L637-L641 PolarHBondContact O-N 3.37Å; F638-L641 HydrophobicContact CD1-CD1 4.22Å; F638-L641 HydrophobicContact CE1-CD1 4.33Å; F638-L641 CarbonylContact O-C 3.49Å; F638-L641 PolarHBondContact O-N 3.38Å; L641-A643 VanDerWaalsContact C-N 3.34Å; L641-A643 PolarHBondContact O-N 3.06Å
642	A	82.9	Confident	89	Confident	68 Å²	68	54 Å²	54	56%	0.562	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	35.5	-179.4	0	0	0	0	0	114.8	F638 K639 K640	F638-A642 PolarHBondContact O-N 3.14Å; K639-A642 PolarHBondContact O-N 3.5Å; K640-A642 PolarHBondContact O-N 2.72Å
643	A	74.6	Confident	88.9	Confident	14 Å²	14	49.6 Å²	49.6	12%	0.116	26%	0.255	C	S	.	.			trans	-60.2	148.9	166.1	0	0	0	0	0	111	T592 L596 F638 L641 T647	T592-A643 HydrophobicContact CG2-CB 3.91Å; L596-A643 HydrophobicContact CD2-CB 4.31Å; F638-A643 HydrophobicContact CB-CB 3.85Å; F638-A643 HydrophobicContact CD1-CB 4.49Å; F638-A643 WeakPolarHBondContact O-CB 3.34Å; F638-A643 PolarHBondContact O-N 3.09Å; L641-A643 VanDerWaalsContact C-N 3.34Å; L641-A643 PolarHBondContact O-N 3.06Å; A643-T647 VanDerWaalsContact CB-OG1 3.29Å; A643-T647 WeakPolarHBondContact CB-OG1 3.39Å
644	G	75.8	Confident	88.9	Confident	34 Å²	34	47.3 Å²	47.3	35%	0.351	24%	0.244	S	C	.	.			trans	-70.2	-174	-173.6	0	0	0	0	0	114.8	N593 D646 T647	N593-G644 PolarHBondContact OD1-N 3.15Å; G644-D646 PolarHBondContact O-N 3.05Å; G644-T647 PolarHBondContact O-N 3.29Å; G644-T647 VanDerWaalsContact O-N 3.09Å; G644-T647 PolarHBondContact O-OG1 3.25Å
645	E	73.2	Confident	88.8	Confident	194 Å²	194	49 Å²	49	91%	0.907	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-22	-177.3	-63.4	-173.7	165.4	0	0	113.7	T647	E645-T647 PolarHBondContact O-N 3.24Å
646	D	80.6	Confident	88.7	Confident	67 Å²	67	47.5 Å²	47.5	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-66.5	-13.3	177.4	-94.1	-41.5	0	0	0	114.4	G644 D648 R649 L650	G644-D646 PolarHBondContact O-N 3.05Å; D646-D648 VanDerWaalsContact C-N 3.33Å; D646-D648 PolarHBondContact O-N 3.28Å; D646-R649 PolarHBondContact O-N 3.19Å; D646-R649 VanDerWaalsContact O-N 3.1Å; D646-R649 IonicContact OD1-CZ 3.7Å; D646-R649 IonicContact OD1-NE 3.09Å; D646-R649 PolarHBondContact OD1-NE 3.17Å; D646-R649 IonicContact OD1-NH2 2.82Å; D646-R649 PolarHBondContact OD1-NH2 3.42Å; D646-R649 IonicContact OD2-NH2 2.96Å; D646-L650 HydrophobicContact CB-CD1 4.21Å; D646-L650 PolarHBondContact O-N 2.81Å
647	T	87.9	Confident	88.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-55.9	-45.4	-179.1	-53	0	0	0	0	113	L596 K635 F638 K639 A643 G644 E645 R649 C651	L596-T647 HydrophobicContact CD2-CG2 4.1Å; K635-T647 HydrophobicContact CG-CG2 4.32Å; F638-T647 HydrophobicContact CB-CG2 4.14Å; K639-T647 HydrophobicContact CG-CG2 4.05Å; A643-T647 VanDerWaalsContact CB-OG1 3.29Å; A643-T647 WeakPolarHBondContact CB-OG1 3.39Å; G644-T647 PolarHBondContact O-N 3.29Å; G644-T647 VanDerWaalsContact O-N 3.09Å; G644-T647 PolarHBondContact O-OG1 3.25Å; E645-T647 PolarHBondContact O-N 3.24Å; T647-R649 VanDerWaalsContact C-N 3.32Å; T647-R649 PolarHBondContact O-N 2.82Å; T647-C651 WeakPolarHBondContact O-CB 3.23Å; T647-C651 PolarHBondContact O-N 3.35Å; T647-C651 VanDerWaalsContact O-N 3.1Å
648	D	88.8	Confident	88.6	Confident	74 Å²	74	40 Å²	40	40%	0.396	22%	0.218	S	C	.	.	H	α-helix	trans	-67.4	-34.5	179.6	-75.6	-55.1	0	0	0	112	K635 K639 D646 G652	K635-D648 WeakPolarHBondContact CE-OD1 3.48Å; K635-D648 IonicContact NZ-OD1 3.71Å; K635-D648 PolarHBondContact NZ-OD1 3.31Å; K639-D648 WeakPolarHBondContact CE-OD1 3.39Å; K639-D648 WeakPolarHBondContact CE-OD2 3.34Å; K639-D648 VanDerWaalsContact NZ-CG 3.28Å; K639-D648 IonicContact NZ-OD1 3.93Å; K639-D648 PolarHBondContact NZ-OD1 3.44Å; K639-D648 IonicContact NZ-OD2 3.89Å; K639-D648 PolarHBondContact NZ-OD2 2.99Å; D646-D648 VanDerWaalsContact C-N 3.33Å; D646-D648 PolarHBondContact O-N 3.28Å; D648-G652 WeakPolarHBondContact O-CA 3.34Å; D648-G652 PolarHBondContact O-N 2.93Å
649	R	89.4	Confident	88.5	Confident	60 Å²	60	43.1 Å²	43.1	23%	0.226	23%	0.233	C	C	.	.	H	α-helix	trans	-73	-45.8	179.6	-174.6	-176.3	66.6	96.5	-0.4	112	D646 T647 S653 Y680 Q722	D646-R649 PolarHBondContact O-N 3.19Å; D646-R649 VanDerWaalsContact O-N 3.1Å; D646-R649 IonicContact OD1-CZ 3.7Å; D646-R649 IonicContact OD1-NE 3.09Å; D646-R649 PolarHBondContact OD1-NE 3.17Å; D646-R649 IonicContact OD1-NH2 2.82Å; D646-R649 PolarHBondContact OD1-NH2 3.42Å; D646-R649 IonicContact OD2-NH2 2.96Å; T647-R649 VanDerWaalsContact C-N 3.32Å; T647-R649 PolarHBondContact O-N 2.82Å; R649-S653 PolarHBondContact O-N 3.29Å; R649-Y680 HydrophobicContact CG-CE1 4.34Å; R649-Y680 PolarHBondContact O-OH 2.87Å; R649-Q722 PolarHBondContact NH1-O 3.4Å; R649-Q722 PolarHBondContact NH2-O 2.96Å
650	L	91.1	Very high	88.4	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-55.5	-178.5	-73.8	169.2	0	0	0	110.6	L596 R597 V600 D646 G652 S653 I724	L596-L650 HydrophobicContact CD2-CB 4.39Å; L596-L650 HydrophobicContact CD2-CD1 3.68Å; L596-L650 HydrophobicContact CG-CB 4.43Å; L596-L650 HydrophobicContact CG-CD1 3.85Å; R597-L650 HydrophobicContact CB-CD1 4.23Å; R597-L650 HydrophobicContact CG-CD2 4.4Å; V600-L650 HydrophobicContact CG1-CB 4.43Å; V600-L650 WeakPolarHBondContact CG1-O 3.38Å; V600-L650 HydrophobicContact CG2-CB 4.24Å; D646-L650 HydrophobicContact CB-CD1 4.21Å; D646-L650 PolarHBondContact O-N 2.81Å; L650-G652 VanDerWaalsContact C-N 3.26Å; L650-G652 PolarHBondContact O-N 3.27Å; L650-S653 WeakPolarHBondContact O-CB 3.32Å; L650-S653 PolarHBondContact O-N 3.01Å; L650-S653 VanDerWaalsContact O-N 3.09Å; L650-S653 PolarHBondContact O-OG 3.36Å; L650-I724 HydrophobicContact CD2-CD1 3.68Å; L650-I724 HydrophobicContact CD2-CG1 3.73Å
651	C	93.3	Very high	88.4	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-35.4	177	-64.1	0	0	0	0	111.9	K635 T647 S653 I654 T655	K635-C651 HydrophobicContact CB-CB 4.02Å; T647-C651 WeakPolarHBondContact O-CB 3.23Å; T647-C651 PolarHBondContact O-N 3.35Å; T647-C651 VanDerWaalsContact O-N 3.1Å; C651-S653 PolarHBondContact O-N 3.43Å; C651-S653 VanDerWaalsContact O-N 3.1Å; C651-I654 WeakPolarHBondContact O-CB 3.47Å; C651-I654 PolarHBondContact O-N 3.46Å; C651-I654 VanDerWaalsContact O-N 3.1Å; C651-T655 PolarHBondContact O-N 2.97Å
652	G	92.4	Very high	88.3	Confident	12 Å²	12	35.2 Å²	35.2	12%	0.124	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-16.1	176.4	0	0	0	0	0	114.7	D648 L650 A656 Y680	D648-G652 WeakPolarHBondContact O-CA 3.34Å; D648-G652 PolarHBondContact O-N 2.93Å; L650-G652 VanDerWaalsContact C-N 3.26Å; L650-G652 PolarHBondContact O-N 3.27Å; G652-A656 WeakPolarHBondContact O-CB 3.42Å; G652-A656 PolarHBondContact O-N 2.89Å; G652-Y680 PolarHBondContact O-OH 3.12Å
653	S	93.6	Very high	88.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-36.7	174.8	70	0	0	0	0	111.8	R649 L650 C651 A656 I657 Y680	R649-S653 PolarHBondContact O-N 3.29Å; L650-S653 WeakPolarHBondContact O-CB 3.32Å; L650-S653 PolarHBondContact O-N 3.01Å; L650-S653 VanDerWaalsContact O-N 3.09Å; L650-S653 PolarHBondContact O-OG 3.36Å; C651-S653 PolarHBondContact O-N 3.43Å; C651-S653 VanDerWaalsContact O-N 3.1Å; S653-A656 PolarHBondContact O-N 3.36Å; S653-I657 WeakPolarHBondContact O-CG1 3.36Å; S653-I657 PolarHBondContact O-N 3.38Å; S653-I657 VanDerWaalsContact O-N 3.13Å; S653-Y680 VanDerWaalsContact CA-OH 3.29Å; S653-Y680 WeakPolarHBondContact CA-OH 3.39Å; S653-Y680 PolarHBondContact N-OH 3.27Å
654	I	95	Very high	89.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-45	173.9	-59.8	171.2	0	0	0	109.3	V600 Y603 L604 M627 A631 F634 C651 A656 I657 A658	V600-I654 HydrophobicContact CG1-CD1 4.32Å; V600-I654 HydrophobicContact CG1-CG1 4.36Å; V600-I654 HydrophobicContact CG2-CD1 4.35Å; Y603-I654 HydrophobicContact CD1-CD1 3.79Å; Y603-I654 HydrophobicContact CD1-CG1 3.92Å; Y603-I654 HydrophobicContact CD1-CG2 3.94Å; Y603-I654 HydrophobicContact CD2-CD1 4.45Å; Y603-I654 HydrophobicContact CE1-CD1 4.38Å; Y603-I654 HydrophobicContact CE1-CG1 4.44Å; Y603-I654 HydrophobicContact CE1-CG2 3.57Å; Y603-I654 HydrophobicContact CG-CD1 3.85Å; Y603-I654 HydrophobicContact CG-CG1 4.44Å; L604-I654 HydrophobicContact CD2-CG1 4.06Å; L604-I654 HydrophobicContact CG-CG1 4.49Å; M627-I654 HydrophobicContact CB-CG2 4.17Å; M627-I654 HydrophobicContact CE-CG2 4.19Å; A631-I654 HydrophobicContact CB-CB 3.92Å; A631-I654 HydrophobicContact CB-CG2 3.94Å; F634-I654 HydrophobicContact CD2-CD1 4.17Å; F634-I654 HydrophobicContact CE2-CD1 4.39Å; C651-I654 WeakPolarHBondContact O-CB 3.47Å; C651-I654 PolarHBondContact O-N 3.46Å; C651-I654 VanDerWaalsContact O-N 3.1Å; I654-A656 PolarHBondContact O-N 3.38Å; I654-I657 PolarHBondContact O-N 2.97Å; I654-A658 WeakPolarHBondContact O-CB 3.47Å; I654-A658 PolarHBondContact O-N 3.18Å
655	T	94.1	Very high	89.6	Confident	36 Å²	36	39.6 Å²	39.6	22%	0.221	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-44.6	175.7	-47.3	0	0	0	0	111.6	I628 C651 I657 A658 E659	I628-T655 HydrophobicContact CG1-CG2 4.24Å; C651-T655 PolarHBondContact O-N 2.97Å; T655-I657 VanDerWaalsContact C-N 3.31Å; T655-I657 PolarHBondContact O-N 3.08Å; T655-A658 WeakPolarHBondContact O-CB 3.48Å; T655-A658 PolarHBondContact O-N 2.97Å; T655-A658 VanDerWaalsContact O-N 3.09Å; T655-E659 PolarHBondContact O-N 3.13Å
656	A	92.8	Very high	90.1	Very high	17 Å²	17	32.3 Å²	32.3	14%	0.14	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-38.1	179.6	0	0	0	0	0	112.3	G652 S653 I654 L676 Y680	G652-A656 WeakPolarHBondContact O-CB 3.42Å; G652-A656 PolarHBondContact O-N 2.89Å; S653-A656 PolarHBondContact O-N 3.36Å; I654-A656 PolarHBondContact O-N 3.38Å; A656-L676 HydrophobicContact CB-CD1 3.55Å; A656-Y680 HydrophobicContact CB-CE2 3.9Å
657	I	93.4	Very high	90.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.3	-41.9	171.8	-73.6	-178.7	0	0	0	111.5	L604 V607 M608 M627 S653 I654 T655 E659 V660 F661 L676 L691 F725	L604-I657 HydrophobicContact CD2-CD1 3.43Å; L604-I657 VanDerWaalsContact CD2-CD1 3.43Å; V607-I657 HydrophobicContact CG1-CG2 4.11Å; M608-I657 HydrophobicContact CE-CD1 3.74Å; M627-I657 HydrophobicContact CE-CB 4.23Å; M627-I657 HydrophobicContact CE-CG2 3.53Å; S653-I657 WeakPolarHBondContact O-CG1 3.36Å; S653-I657 PolarHBondContact O-N 3.38Å; S653-I657 VanDerWaalsContact O-N 3.13Å; I654-I657 PolarHBondContact O-N 2.97Å; T655-I657 VanDerWaalsContact C-N 3.31Å; T655-I657 PolarHBondContact O-N 3.08Å; I657-E659 VanDerWaalsContact C-N 3.28Å; I657-E659 PolarHBondContact O-N 3.5Å; I657-V660 WeakPolarHBondContact O-CB 3.43Å; I657-V660 PolarHBondContact O-N 3.38Å; I657-V660 VanDerWaalsContact O-N 3.1Å; I657-F661 HydrophobicContact CG2-CD2 4.43Å; I657-F661 HydrophobicContact CG2-CE2 3.94Å; I657-F661 HydrophobicContact CG2-CZ 4.22Å; I657-F661 PolarHBondContact O-N 3.49Å; I657-L676 HydrophobicContact CG1-CD1 4.24Å; I657-L676 HydrophobicContact CG1-CD2 4.31Å; I657-L691 HydrophobicContact CG2-CD1 3.58Å; I657-F725 HydrophobicContact CD1-CE1 3.97Å; I657-F725 HydrophobicContact CD1-CZ 4.06Å
658	A	93.3	Very high	90.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-37.1	179.7	0	0	0	0	0	112	A624 M627 I628 I654 T655 V660 F661 K662	A624-A658 HydrophobicContact CB-CB 4.4Å; A624-A658 WeakPolarHBondContact CB-O 3.35Å; M627-A658 HydrophobicContact CB-CB 3.77Å; M627-A658 HydrophobicContact CE-CB 4.4Å; M627-A658 HydrophobicContact SD-CB 4.45Å; I628-A658 HydrophobicContact CD1-CB 4.22Å; I628-A658 HydrophobicContact CG1-CB 3.64Å; I654-A658 WeakPolarHBondContact O-CB 3.47Å; I654-A658 PolarHBondContact O-N 3.18Å; T655-A658 WeakPolarHBondContact O-CB 3.48Å; T655-A658 PolarHBondContact O-N 2.97Å; T655-A658 VanDerWaalsContact O-N 3.09Å; A658-V660 VanDerWaalsContact C-N 3.3Å; A658-V660 PolarHBondContact O-N 3.31Å; A658-F661 WeakPolarHBondContact O-CA 3.22Å; A658-F661 PolarHBondContact O-N 2.83Å; A658-K662 WeakPolarHBondContact O-CB 3.23Å; A658-K662 PolarHBondContact O-N 2.86Å
659	E	91.8	Very high	90.1	Very high	68 Å²	68	34.4 Å²	34.4	32%	0.318	19%	0.19	S	C	.	.	H	α-helix	trans	-61.7	-36.9	174.2	-66.7	-56.9	146.5	0	0	112	I628 T655 I657 F661 K662 L663	I628-E659 WeakPolarHBondContact CD1-OE1 3.49Å; T655-E659 PolarHBondContact O-N 3.13Å; I657-E659 VanDerWaalsContact C-N 3.28Å; I657-E659 PolarHBondContact O-N 3.5Å; E659-F661 PolarHBondContact O-N 3.38Å; E659-K662 PolarHBondContact O-N 3.27Å; E659-K662 IonicContact OE1-NZ 2.83Å; E659-K662 IonicContact OE2-NZ 3.85Å; E659-L663 PolarHBondContact O-N 2.93Å; E659-L663 VanDerWaalsContact O-N 3.14Å
660	V	91.7	Very high	89.9	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-30.9	171.9	-179.3	0	0	0	0	111.8	I657 A658 L669 E672 V673 L676 L691 R695	I657-V660 WeakPolarHBondContact O-CB 3.43Å; I657-V660 PolarHBondContact O-N 3.38Å; I657-V660 VanDerWaalsContact O-N 3.1Å; A658-V660 VanDerWaalsContact C-N 3.3Å; A658-V660 PolarHBondContact O-N 3.31Å; V660-L669 HydrophobicContact CG1-CD2 4.11Å; V660-E672 HydrophobicContact CG2-CB 4.17Å; V660-V673 HydrophobicContact CG1-CG2 4.13Å; V660-L676 HydrophobicContact CG2-CD2 4.19Å; V660-L691 HydrophobicContact CB-CD2 4.27Å; V660-L691 HydrophobicContact CG1-CD2 3.89Å; V660-L691 HydrophobicContact CG1-CG 4.35Å; V660-L691 HydrophobicContact CG2-CD2 4.35Å; V660-R695 PolarHBondContact O-NH1 2.85Å
661	F	90.5	Very high	89.7	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-82.4	-35.7	175.4	-65	-26.6	0	0	0	113.4	V607 F614 A624 M627 I657 A658 E659 L663 L691 V694 R695	V607-F661 HydrophobicContact CG1-CE2 4.27Å; V607-F661 HydrophobicContact CG1-CZ 4.07Å; F614-F661 HydrophobicContact CE2-CD1 4.45Å; F614-F661 AromaticContact CE2-CD2 3.82Å; F614-F661 HydrophobicContact CE2-CD2 3.82Å; F614-F661 AromaticContact CE2-CE2 4Å; F614-F661 HydrophobicContact CE2-CE2 4Å; F614-F661 HydrophobicContact CE2-CG 4.05Å; F614-F661 HydrophobicContact CE2-CZ 4.37Å; F614-F661 HydrophobicContact CZ-CD2 4.49Å; A624-F661 HydrophobicContact CB-CB 4.01Å; M627-F661 HydrophobicContact CE-CD2 4.29Å; M627-F661 HydrophobicContact CE-CE2 4.04Å; M627-F661 HydrophobicContact SD-CD2 3.56Å; M627-F661 VanDerWaalsContact SD-CD2 3.56Å; M627-F661 HydrophobicContact SD-CE2 3.63Å; I657-F661 HydrophobicContact CG2-CD2 4.43Å; I657-F661 HydrophobicContact CG2-CE2 3.94Å; I657-F661 HydrophobicContact CG2-CZ 4.22Å; I657-F661 PolarHBondContact O-N 3.49Å; A658-F661 WeakPolarHBondContact O-CA 3.22Å; A658-F661 PolarHBondContact O-N 2.83Å; E659-F661 PolarHBondContact O-N 3.38Å; F661-L663 VanDerWaalsContact C-N 3.32Å; F661-L663 PolarHBondContact O-N 3.31Å; F661-L691 HydrophobicContact CD1-CD1 4.26Å; F661-L691 HydrophobicContact CE1-CD1 3.32Å; F661-L691 HydrophobicContact CE1-CG 4.04Å; F661-L691 WeakPolarHBondContact CE1-O 3.41Å; F661-L691 HydrophobicContact CE2-CD1 4.26Å; F661-L691 HydrophobicContact CZ-CD1 3.32Å; F661-L691 HydrophobicContact CZ-CG 4.45Å; F661-V694 HydrophobicContact CE1-CB 4.29Å; F661-V694 HydrophobicContact CE1-CG1 4.15Å; F661-V694 HydrophobicContact CE2-CG1 4.21Å; F661-V694 HydrophobicContact CZ-CB 4Å; F661-V694 HydrophobicContact CZ-CG1 3.62Å; F661-R695 HydrophobicContact CD1-CB 4.05Å; F661-R695 HydrophobicContact CD1-CG 4.17Å; F661-R695 HydrophobicContact CE1-CB 4.13Å; F661-R695 PolarHBondContact O-NH1 3.02Å
662	K	89.1	Confident	89.5	Confident	84 Å²	84	42 Å²	42	37%	0.365	23%	0.229	S	C	.	.	H	α-helix	trans	-67.9	-29.6	-177.8	-165.5	-179.5	179.9	-175.6	0	113.1	A624 I628 A658 E659 T664	A624-K662 HydrophobicContact CB-CB 3.78Å; A624-K662 HydrophobicContact CB-CG 4.38Å; I628-K662 HydrophobicContact CD1-CD 4.38Å; A658-K662 WeakPolarHBondContact O-CB 3.23Å; A658-K662 PolarHBondContact O-N 2.86Å; E659-K662 PolarHBondContact O-N 3.27Å; E659-K662 IonicContact OE1-NZ 2.83Å; E659-K662 IonicContact OE2-NZ 3.85Å; K662-T664 PolarHBondContact O-N 3.3Å
663	L	89.7	Confident	89.3	Confident	30 Å²	30	41.5 Å²	41.5	16%	0.157	22%	0.223	C	C	.	.			trans	-53.4	121	179.1	-178.7	71.4	0	0	0	111	E659 F661 D665 L668 L669 E672 R695	E659-L663 PolarHBondContact O-N 2.93Å; E659-L663 VanDerWaalsContact O-N 3.14Å; F661-L663 VanDerWaalsContact C-N 3.32Å; F661-L663 PolarHBondContact O-N 3.31Å; L663-D665 WeakPolarHBondContact CD2-O 3.46Å; L663-D665 WeakPolarHBondContact CG-O 3.36Å; L663-L668 HydrophobicContact CD1-CB 4.18Å; L663-L668 HydrophobicContact CD2-CB 4.01Å; L663-L669 HydrophobicContact CD2-CB 4.45Å; L663-L669 HydrophobicContact CD2-CD2 4.04Å; L663-L669 HydrophobicContact CD2-CG 4.01Å; L663-E672 HydrophobicContact CD1-CG 4.48Å; L663-E672 HydrophobicContact CD2-CG 4Å; L663-R695 VanDerWaalsContact O-CZ 3.25Å; L663-R695 PolarHBondContact O-NH1 3.43Å; L663-R695 PolarHBondContact O-NH2 2.92Å
664	T	84.9	Confident	89	Confident	113 Å²	113	43.7 Å²	43.7	69%	0.693	24%	0.237	S	C	*	.			trans	-81.9	-35.1	-178	32.6	0	0	0	0	113.2	K662 P666	K662-T664 PolarHBondContact O-N 3.3Å; T664-P666 WeakPolarHBondContact O-CD 3.31Å
665	D	85.9	Confident	88.7	Confident	66 Å²	66	47.3 Å²	47.3	35%	0.353	26%	0.259	S	S	.	.			trans	-90	111.1	-179.4	-174.1	-9.9	0	0	0	111.5	L663 T667 L668	L663-D665 WeakPolarHBondContact CD2-O 3.46Å; L663-D665 WeakPolarHBondContact CG-O 3.36Å; D665-T667 PolarHBondContact O-N 2.8Å; D665-T667 WeakPolarHBondContact OD1-CB 3.35Å; D665-T667 WeakPolarHBondContact OD1-CG2 3.31Å; D665-T667 PolarHBondContact OD1-N 3.45Å; D665-T667 PolarHBondContact OD1-OG1 2.86Å; D665-T667 PolarHBondContact OD2-OG1 3.5Å; D665-T667 VanDerWaalsContact OD2-OG1 3.05Å; D665-L668 HydrophobicContact CB-CD1 4.32Å; D665-L668 HydrophobicContact CB-CG 4.41Å; D665-L668 PolarHBondContact O-N 3.45Å
666	P	83.1	Confident	88.5	Confident	40 Å²	40	45.9 Å²	45.9	26%	0.26	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-63.9	-22.2	179.2	-20.8	34.5	0	0	0	113.8	T664 L668 L669 M702	T664-P666 WeakPolarHBondContact O-CD 3.31Å; P666-L668 PolarHBondContact O-N 2.89Å; P666-L669 HydrophobicContact CB-CD1 4.05Å; P666-L669 VanDerWaalsContact O-CB 3.31Å; P666-L669 WeakPolarHBondContact O-CB 3.49Å; P666-L669 WeakPolarHBondContact O-CD1 3.39Å; P666-L669 WeakPolarHBondContact O-CG 3.36Å; P666-L669 PolarHBondContact O-N 2.85Å; P666-M702 HydrophobicContact CB-CE 4.02Å; P666-M702 HydrophobicContact CB-SD 4.02Å; P666-M702 WeakPolarHBondContact O-CE 3.23Å
667	T	83	Confident	88.3	Confident	101 Å²	101	46.5 Å²	46.5	62%	0.62	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-68.9	-23.5	-179.2	68.5	0	0	0	0	112.6	D665	D665-T667 PolarHBondContact O-N 2.8Å; D665-T667 WeakPolarHBondContact OD1-CB 3.35Å; D665-T667 WeakPolarHBondContact OD1-CG2 3.31Å; D665-T667 PolarHBondContact OD1-N 3.45Å; D665-T667 PolarHBondContact OD1-OG1 2.86Å; D665-T667 PolarHBondContact OD2-OG1 3.5Å; D665-T667 VanDerWaalsContact OD2-OG1 3.05Å
668	L	87.4	Confident	88	Confident	86 Å²	86	50.4 Å²	50.4	45%	0.45	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-91.2	-0.1	178.3	-61.2	179.4	0	0	0	113.3	L663 D665 P666 F670 L671	L663-L668 HydrophobicContact CD1-CB 4.18Å; L663-L668 HydrophobicContact CD2-CB 4.01Å; D665-L668 HydrophobicContact CB-CD1 4.32Å; D665-L668 HydrophobicContact CB-CG 4.41Å; D665-L668 PolarHBondContact O-N 3.45Å; P666-L668 PolarHBondContact O-N 2.89Å; L668-F670 PolarHBondContact O-N 3.41Å; L668-F670 VanDerWaalsContact O-N 3.14Å; L668-L671 WeakPolarHBondContact O-CB 3.49Å; L668-L671 PolarHBondContact O-N 2.8Å
669	L	86.3	Confident	87.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-55.6	-35.2	-178.4	-87	167	0	0	0	113.2	V660 L663 P666 L671 E672 V673 L692 A698 M702 I706	V660-L669 HydrophobicContact CG1-CD2 4.11Å; L663-L669 HydrophobicContact CD2-CB 4.45Å; L663-L669 HydrophobicContact CD2-CD2 4.04Å; L663-L669 HydrophobicContact CD2-CG 4.01Å; P666-L669 HydrophobicContact CB-CD1 4.05Å; P666-L669 VanDerWaalsContact O-CB 3.31Å; P666-L669 WeakPolarHBondContact O-CB 3.49Å; P666-L669 WeakPolarHBondContact O-CD1 3.39Å; P666-L669 WeakPolarHBondContact O-CG 3.36Å; P666-L669 PolarHBondContact O-N 2.85Å; L669-L671 VanDerWaalsContact C-N 3.27Å; L669-L671 PolarHBondContact O-N 3.49Å; L669-E672 PolarHBondContact O-N 3.09Å; L669-V673 VanDerWaalsContact O-CG2 3.27Å; L669-V673 WeakPolarHBondContact O-CG2 3.42Å; L669-V673 PolarHBondContact O-N 2.83Å; L669-L692 HydrophobicContact CD2-CD2 4.46Å; L669-A698 HydrophobicContact CD1-CB 4.39Å; L669-M702 HydrophobicContact CD1-SD 3.86Å; L669-I706 HydrophobicContact CB-CD1 3.84Å
670	F	85.6	Confident	87.5	Confident	67 Å²	67	53.4 Å²	53.4	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-56.8	-40.8	176.5	173.1	-104	0	0	0	112.3	L668 T674 I706 T709	L668-F670 PolarHBondContact O-N 3.41Å; L668-F670 VanDerWaalsContact O-N 3.14Å; F670-T674 VanDerWaalsContact O-CB 3.26Å; F670-T674 WeakPolarHBondContact O-CB 3.47Å; F670-T674 PolarHBondContact O-N 2.96Å; F670-T674 PolarHBondContact O-OG1 3.27Å; F670-I706 HydrophobicContact CB-CG1 4.28Å; F670-T709 HydrophobicContact CD2-CG2 4.48Å; F670-T709 HydrophobicContact CE2-CG2 3.46Å; F670-T709 VanDerWaalsContact CE2-CG2 3.46Å; F670-T709 HydrophobicContact CZ-CG2 3.61Å
671	L	86.3	Confident	87.3	Confident	102 Å²	102	55.7 Å²	55.7	53%	0.534	31%	0.306	S	S	.	.	H	α-helix	trans	-68.6	-44.3	-177.3	-174.9	66.3	0	0	0	111.7	L668 L669 T674 T675	L668-L671 WeakPolarHBondContact O-CB 3.49Å; L668-L671 PolarHBondContact O-N 2.8Å; L669-L671 VanDerWaalsContact C-N 3.27Å; L669-L671 PolarHBondContact O-N 3.49Å; L671-T674 PolarHBondContact O-N 3.24Å; L671-T675 WeakPolarHBondContact O-CB 3.46Å; L671-T675 PolarHBondContact O-N 2.97Å; L671-T675 PolarHBondContact O-OG1 3.08Å
672	E	88.9	Confident	87.1	Confident	59 Å²	59	56.7 Å²	56.7	28%	0.276	31%	0.312	S	S	.	.	H	α-helix	trans	-68.4	-41.8	179.3	-70	-56.6	147.8	0	0	111.9	V660 L663 L669 T674 T675 L676	V660-E672 HydrophobicContact CG2-CB 4.17Å; L663-E672 HydrophobicContact CD1-CG 4.48Å; L663-E672 HydrophobicContact CD2-CG 4Å; L669-E672 PolarHBondContact O-N 3.09Å; E672-T674 VanDerWaalsContact C-N 3.33Å; E672-T674 PolarHBondContact O-N 3.41Å; E672-T675 PolarHBondContact O-N 2.84Å; E672-L676 WeakPolarHBondContact O-CB 3.38Å; E672-L676 PolarHBondContact O-N 3.43Å
673	V	88.5	Confident	87.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.9	-38.1	175.2	-179.8	0	0	0	0	110.8	V660 L669 T675 L676 V677 I688 I706 L710	V660-V673 HydrophobicContact CG1-CG2 4.13Å; L669-V673 VanDerWaalsContact O-CG2 3.27Å; L669-V673 WeakPolarHBondContact O-CG2 3.42Å; L669-V673 PolarHBondContact O-N 2.83Å; V673-T675 VanDerWaalsContact C-N 3.34Å; V673-T675 PolarHBondContact O-N 3.48Å; V673-L676 WeakPolarHBondContact O-CB 3.24Å; V673-L676 PolarHBondContact O-N 3.2Å; V673-V677 HydrophobicContact CG1-CG2 4.46Å; V673-V677 WeakPolarHBondContact O-CG2 3.39Å; V673-V677 PolarHBondContact O-N 3.06Å; V673-I688 HydrophobicContact CG1-CD1 4.24Å; V673-I688 HydrophobicContact CG1-CG1 4.28Å; V673-I688 HydrophobicContact CG1-CG2 3.91Å; V673-I706 HydrophobicContact CB-CG2 4.21Å; V673-I706 HydrophobicContact CG1-CG2 4.02Å; V673-I706 HydrophobicContact CG2-CG2 4.43Å; V673-L710 HydrophobicContact CB-CD1 4.42Å; V673-L710 HydrophobicContact CG1-CD1 3.47Å; V673-L710 VanDerWaalsContact CG1-CD1 3.47Å
674	T	87.4	Confident	87	Confident	47 Å²	47	56.3 Å²	56.3	29%	0.288	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-41.3	174.3	-59	0	0	0	0	111.3	F670 L671 E672 V677 S678	F670-T674 VanDerWaalsContact O-CB 3.26Å; F670-T674 WeakPolarHBondContact O-CB 3.47Å; F670-T674 PolarHBondContact O-N 2.96Å; F670-T674 PolarHBondContact O-OG1 3.27Å; L671-T674 PolarHBondContact O-N 3.24Å; E672-T674 VanDerWaalsContact C-N 3.33Å; E672-T674 PolarHBondContact O-N 3.41Å; T674-V677 PolarHBondContact O-N 3.27Å; T674-S678 VanDerWaalsContact O-CB 3.3Å; T674-S678 WeakPolarHBondContact O-CB 3.32Å; T674-S678 PolarHBondContact O-N 2.88Å
675	T	88.9	Confident	87.2	Confident	75 Å²	75	55.3 Å²	55.3	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-42	175.8	-58.1	0	0	0	0	111.3	L671 E672 V673 S678 K679	L671-T675 WeakPolarHBondContact O-CB 3.46Å; L671-T675 PolarHBondContact O-N 2.97Å; L671-T675 PolarHBondContact O-OG1 3.08Å; E672-T675 PolarHBondContact O-N 2.84Å; V673-T675 VanDerWaalsContact C-N 3.34Å; V673-T675 PolarHBondContact O-N 3.48Å; T675-S678 PolarHBondContact O-N 3.07Å; T675-K679 WeakPolarHBondContact O-CB 3.39Å; T675-K679 PolarHBondContact O-N 3.24Å
676	L	89.8	Confident	87.3	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-48.1	175.8	179.9	68.4	0	0	0	111.7	A656 I657 V660 E672 V673 K679 Y680 I683 L691	A656-L676 HydrophobicContact CB-CD1 3.55Å; I657-L676 HydrophobicContact CG1-CD1 4.24Å; I657-L676 HydrophobicContact CG1-CD2 4.31Å; V660-L676 HydrophobicContact CG2-CD2 4.19Å; E672-L676 WeakPolarHBondContact O-CB 3.38Å; E672-L676 PolarHBondContact O-N 3.43Å; V673-L676 WeakPolarHBondContact O-CB 3.24Å; V673-L676 PolarHBondContact O-N 3.2Å; L676-K679 PolarHBondContact O-N 3.07Å; L676-Y680 HydrophobicContact CD1-CD2 3.94Å; L676-Y680 HydrophobicContact CD1-CE2 4.46Å; L676-Y680 PolarHBondContact O-N 3.25Å; L676-I683 HydrophobicContact CD1-CD1 4.02Å; L676-I683 HydrophobicContact CD2-CD1 3.89Å; L676-I683 HydrophobicContact CG-CD1 3.57Å; L676-L691 HydrophobicContact CD2-CD2 3.85Å
677	V	88.6	Confident	87.6	Confident	30 Å²	30	52.5 Å²	52.5	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-37.8	178.5	172.7	0	0	0	0	111.6	V673 T674 K679 Y680 P681 I683 I688 L710	V673-V677 HydrophobicContact CG1-CG2 4.46Å; V673-V677 WeakPolarHBondContact O-CG2 3.39Å; V673-V677 PolarHBondContact O-N 3.06Å; T674-V677 PolarHBondContact O-N 3.27Å; V677-K679 VanDerWaalsContact C-N 3.34Å; V677-K679 PolarHBondContact O-N 3.36Å; V677-Y680 CarbonylContact O-C 3.59Å; V677-Y680 PolarHBondContact O-N 3.03Å; V677-P681 VanDerWaalsContact O-CA 3.28Å; V677-P681 WeakPolarHBondContact O-CA 3.43Å; V677-I683 HydrophobicContact CG2-CG2 4.33Å; V677-I688 HydrophobicContact CG2-CD1 3.94Å; V677-L710 HydrophobicContact CG2-CD1 4.5Å; V677-L710 HydrophobicContact CG2-CD2 4.49Å
678	S	86.5	Confident	87.9	Confident	83 Å²	83	48 Å²	48	58%	0.58	25%	0.25	S	C	*	.	H	α-helix	trans	-62.9	-41	175.3	-176.4	0	0	0	0	111.8	T674 T675	T674-S678 VanDerWaalsContact O-CB 3.3Å; T674-S678 WeakPolarHBondContact O-CB 3.32Å; T674-S678 PolarHBondContact O-N 2.88Å; T675-S678 PolarHBondContact O-N 3.07Å
679	K	87.2	Confident	88	Confident	125 Å²	125	47.9 Å²	47.9	54%	0.543	25%	0.247	S	C	.	.	H	α-helix	trans	-76.4	-31.6	179	-166.2	175.3	177.6	-173.7	0	113.1	T675 L676 V677	T675-K679 WeakPolarHBondContact O-CB 3.39Å; T675-K679 PolarHBondContact O-N 3.24Å; L676-K679 PolarHBondContact O-N 3.07Å; V677-K679 VanDerWaalsContact C-N 3.34Å; V677-K679 PolarHBondContact O-N 3.36Å
680	Y	88.7	Confident	88.2	Confident	5 Å²	5	48.5 Å²	48.5	2%	0.02	25%	0.251	C	S	.	.			trans	-131.3	80.8	-179.4	-59	-79.4	0	0	0	110.5	R649 G652 S653 A656 L676 V677 D682 I683 I724 F725	R649-Y680 HydrophobicContact CG-CE1 4.34Å; R649-Y680 PolarHBondContact O-OH 2.87Å; G652-Y680 PolarHBondContact O-OH 3.12Å; S653-Y680 VanDerWaalsContact CA-OH 3.29Å; S653-Y680 WeakPolarHBondContact CA-OH 3.39Å; S653-Y680 PolarHBondContact N-OH 3.27Å; A656-Y680 HydrophobicContact CB-CE2 3.9Å; L676-Y680 HydrophobicContact CD1-CD2 3.94Å; L676-Y680 HydrophobicContact CD1-CE2 4.46Å; L676-Y680 PolarHBondContact O-N 3.25Å; V677-Y680 CarbonylContact O-C 3.59Å; V677-Y680 PolarHBondContact O-N 3.03Å; Y680-D682 PolarHBondContact O-N 2.82Å; Y680-D682 VanDerWaalsContact O-N 3.13Å; Y680-I683 WeakPolarHBondContact O-CB 3.47Å; Y680-I683 WeakPolarHBondContact O-CG1 3.37Å; Y680-I683 PolarHBondContact O-N 3.45Å; Y680-I724 HydrophobicContact CD1-CD1 3.93Å; Y680-I724 HydrophobicContact CE1-CD1 3.71Å; Y680-F725 HydrophobicContact CD1-CE2 4.03Å; Y680-F725 HydrophobicContact CD2-CE2 4.37Å; Y680-F725 HydrophobicContact CG-CD2 4.42Å; Y680-F725 AromaticContact CG-CE2 3.78Å; Y680-F725 HydrophobicContact CG-CE2 3.78Å
681	P	86.1	Confident	88.4	Confident	50 Å²	50	45.3 Å²	45.3	33%	0.325	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-8.5	-172	25.5	-34.2	0	0	0	114.6	V677 I683 Y717	V677-P681 VanDerWaalsContact O-CA 3.28Å; V677-P681 WeakPolarHBondContact O-CA 3.43Å; P681-I683 VanDerWaalsContact C-N 3.32Å; P681-Y717 HydrophobicContact CB-CD2 4.22Å; P681-Y717 HydrophobicContact CG-CD2 3.78Å; P681-Y717 HydrophobicContact CG-CE2 4.12Å
682	D	87.9	Confident	88.6	Confident	22 Å²	22	40.5 Å²	40.5	12%	0.118	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	1.2	175.6	66.4	-41.7	0	0	0	113.8	Y680 Y717 P723 I724 F725 K726	Y680-D682 PolarHBondContact O-N 2.82Å; Y680-D682 VanDerWaalsContact O-N 3.13Å; D682-Y717 HydrophobicContact CB-CE2 4.07Å; D682-P723 HydrophobicContact CB-CB 4.04Å; D682-P723 WeakPolarHBondContact OD2-CA 3.39Å; D682-P723 VanDerWaalsContact OD2-CB 3.24Å; D682-P723 WeakPolarHBondContact OD2-CB 3.43Å; D682-I724 PolarHBondContact OD2-N 2.92Å; D682-F725 WeakPolarHBondContact OD2-CA 3.47Å; D682-F725 PolarHBondContact OD2-N 2.84Å; D682-K726 HydrophobicContact CB-CB 4.48Å; D682-K726 PolarHBondContact OD2-N 3.26Å; D682-K726 VanDerWaalsContact OD2-N 3.14Å
683	I	88.2	Confident	88.6	Confident	18 Å²	18	38.9 Å²	38.9	9%	0.092	21%	0.209	C	C	.	.			trans	-65.8	142.8	167.4	-69.6	175.8	0	0	0	109.9	L676 V677 Y680 P681 H687 I688 F725	L676-I683 HydrophobicContact CD1-CD1 4.02Å; L676-I683 HydrophobicContact CD2-CD1 3.89Å; L676-I683 HydrophobicContact CG-CD1 3.57Å; V677-I683 HydrophobicContact CG2-CG2 4.33Å; Y680-I683 WeakPolarHBondContact O-CB 3.47Å; Y680-I683 WeakPolarHBondContact O-CG1 3.37Å; Y680-I683 PolarHBondContact O-N 3.45Å; P681-I683 VanDerWaalsContact C-N 3.32Å; I683-H687 HydrophobicContact CG2-CB 4.03Å; I683-I688 HydrophobicContact CG2-CD1 4.18Å; I683-I688 HydrophobicContact CG2-CG1 3.75Å; I683-F725 HydrophobicContact CD1-CD1 4.36Å; I683-F725 HydrophobicContact CD1-CD2 3.92Å; I683-F725 HydrophobicContact CD1-CE1 4.16Å; I683-F725 HydrophobicContact CD1-CE2 3.7Å; I683-F725 HydrophobicContact CD1-CG 4.25Å; I683-F725 HydrophobicContact CD1-CZ 3.82Å; I683-F725 HydrophobicContact CG1-CB 3.95Å; I683-F725 HydrophobicContact CG1-CD1 3.79Å; I683-F725 HydrophobicContact CG1-CD2 3.36Å; I683-F725 HydrophobicContact CG1-CE1 4.09Å; I683-F725 HydrophobicContact CG1-CE2 3.7Å; I683-F725 HydrophobicContact CG1-CG 3.41Å; I683-F725 VanDerWaalsContact CG1-CG 3.41Å; I683-F725 HydrophobicContact CG1-CZ 4.05Å
684	R	88.4	Confident	88.6	Confident	88 Å²	88	39.2 Å²	39.2	33%	0.332	21%	0.211	S	C	.	.			trans	-121	164.8	-175.2	-64	-169.9	-51.8	-96.1	-1.5	110	D686 H687 I688 K726 I728	R684-D686 VanDerWaalsContact C-N 3.26Å; R684-D686 WeakPolarHBondContact CB-OD1 3.41Å; R684-D686 IonicContact CZ-OD1 3.39Å; R684-D686 IonicContact CZ-OD2 2.72Å; R684-D686 IonicContact NE-OD1 2.85Å; R684-D686 PolarHBondContact NE-OD1 3Å; R684-D686 IonicContact NE-OD2 3.64Å; R684-D686 PolarHBondContact NE-OD2 3.31Å; R684-D686 IonicContact NH2-OD1 3.68Å; R684-D686 IonicContact NH2-OD2 3.62Å; R684-D686 PolarHBondContact NH2-OD2 3.36Å; R684-D686 PolarHBondContact O-N 3.11Å; R684-H687 PolarHBondContact N-ND1 3.05Å; R684-H687 VanDerWaalsContact N-ND1 3.16Å; R684-H687 PolarHBondContact NH1-CE1 2.78Å; R684-H687 PolarHBondContact NH2-CE1 3.24Å; R684-H687 PolarHBondContact NH2-NE2 3.42Å; R684-H687 WeakPolarHBondContact O-CB 3.32Å; R684-H687 PolarHBondContact O-N 3.24Å; R684-I688 PolarHBondContact O-N 2.93Å; R684-I688 VanDerWaalsContact O-N 3.13Å; R684-K726 PolarHBondContact NH1-O 3.48Å; R684-K726 VanDerWaalsContact NH1-O 3.12Å; R684-I728 PolarHBondContact NH2-O 3.45Å
685	E	87.8	Confident	88.7	Confident	92 Å²	92	37 Å²	37	43%	0.43	20%	0.197	S	C	.	.	H	α-helix	trans	-58.3	-37.2	-178.8	-65	174.8	-163.1	0	0	112.7	I688 Q689 I707	E685-I688 PolarHBondContact O-N 3.2Å; E685-Q689 WeakPolarHBondContact O-CB 3.42Å; E685-Q689 PolarHBondContact O-N 3.01Å; E685-I707 HydrophobicContact CB-CG2 4.24Å; E685-I707 HydrophobicContact CG-CG2 4.03Å
686	D	88.3	Confident	88.5	Confident	45 Å²	45	35 Å²	35	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-39.9	175.3	58.3	-39	0	0	0	112.1	R684 Q689 A690 V730	R684-D686 VanDerWaalsContact C-N 3.26Å; R684-D686 WeakPolarHBondContact CB-OD1 3.41Å; R684-D686 IonicContact CZ-OD1 3.39Å; R684-D686 IonicContact CZ-OD2 2.72Å; R684-D686 IonicContact NE-OD1 2.85Å; R684-D686 PolarHBondContact NE-OD1 3Å; R684-D686 IonicContact NE-OD2 3.64Å; R684-D686 PolarHBondContact NE-OD2 3.31Å; R684-D686 IonicContact NH2-OD1 3.68Å; R684-D686 IonicContact NH2-OD2 3.62Å; R684-D686 PolarHBondContact NH2-OD2 3.36Å; R684-D686 PolarHBondContact O-N 3.11Å; D686-Q689 PolarHBondContact O-N 3.19Å; D686-A690 PolarHBondContact O-N 2.75Å; D686-V730 HydrophobicContact CB-CB 4.05Å; D686-V730 HydrophobicContact CB-CG1 4.49Å; D686-V730 HydrophobicContact CB-CG2 4.28Å
687	H	90.6	Very high	88.3	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-45.8	173.4	-60.7	131.8	0	0	0	111.8	M608 I683 R684 Q689 A690 L691 F725 I728 V730	M608-H687 HydrophobicContact SD-CB 4.32Å; M608-H687 VanDerWaalsContact SD-O 3.36Å; I683-H687 HydrophobicContact CG2-CB 4.03Å; R684-H687 PolarHBondContact N-ND1 3.05Å; R684-H687 VanDerWaalsContact N-ND1 3.16Å; R684-H687 PolarHBondContact NH1-CE1 2.78Å; R684-H687 PolarHBondContact NH2-CE1 3.24Å; R684-H687 PolarHBondContact NH2-NE2 3.42Å; R684-H687 WeakPolarHBondContact O-CB 3.32Å; R684-H687 PolarHBondContact O-N 3.24Å; H687-Q689 VanDerWaalsContact C-N 3.31Å; H687-Q689 PolarHBondContact O-N 3.09Å; H687-A690 PolarHBondContact O-N 3.22Å; H687-L691 WeakPolarHBondContact O-CB 3.24Å; H687-L691 PolarHBondContact O-N 2.91Å; H687-F725 PolarHBondContact CE1-O 3.02Å; H687-F725 PolarHBondContact NE2-O 3.44Å; H687-I728 PolarHBondContact NE2-O 2.95Å; H687-V730 WeakPolarHBondContact CD2-CG2 3.45Å
688	I	89.4	Confident	88.1	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-41	179.1	-61.8	166.2	0	0	0	110.2	V673 V677 I683 R684 E685 L691 L692 I706 I707 L710	V673-I688 HydrophobicContact CG1-CD1 4.24Å; V673-I688 HydrophobicContact CG1-CG1 4.28Å; V673-I688 HydrophobicContact CG1-CG2 3.91Å; V677-I688 HydrophobicContact CG2-CD1 3.94Å; I683-I688 HydrophobicContact CG2-CD1 4.18Å; I683-I688 HydrophobicContact CG2-CG1 3.75Å; R684-I688 PolarHBondContact O-N 2.93Å; R684-I688 VanDerWaalsContact O-N 3.13Å; E685-I688 PolarHBondContact O-N 3.2Å; I688-L691 WeakPolarHBondContact O-CB 3.25Å; I688-L691 PolarHBondContact O-N 3.39Å; I688-L692 HydrophobicContact CG2-CD1 3.96Å; I688-L692 HydrophobicContact CG2-CG 4.32Å; I688-L692 VanDerWaalsContact O-CG 3.31Å; I688-L692 WeakPolarHBondContact O-CG 3.19Å; I688-L692 PolarHBondContact O-N 2.88Å; I688-I706 HydrophobicContact CG2-CG2 4.49Å; I688-I707 HydrophobicContact CG2-CG1 4.32Å; I688-L710 HydrophobicContact CD1-CD1 3.84Å
689	Q	88.4	Confident	88	Confident	83 Å²	83	34.3 Å²	34.3	39%	0.388	19%	0.186	S	C	.	.	H	α-helix	trans	-63.6	-43.1	178	-172.7	175.9	4.1	0	0	112.4	E685 D686 H687 A693 I707	E685-Q689 WeakPolarHBondContact O-CB 3.42Å; E685-Q689 PolarHBondContact O-N 3.01Å; D686-Q689 PolarHBondContact O-N 3.19Å; H687-Q689 VanDerWaalsContact C-N 3.31Å; H687-Q689 PolarHBondContact O-N 3.09Å; Q689-A693 WeakPolarHBondContact O-CB 3.39Å; Q689-A693 PolarHBondContact O-N 3.36Å; Q689-I707 HydrophobicContact CB-CD1 4.29Å
690	A	89.7	Confident	87.8	Confident	12 Å²	12	37 Å²	37	10%	0.099	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-44.9	175	0	0	0	0	0	111.7	M608 D686 H687 L692 A693 V694 V730	M608-A690 HydrophobicContact CB-CB 4.37Å; M608-A690 WeakPolarHBondContact O-CB 3.28Å; M608-A690 HydrophobicContact SD-CB 4.03Å; D686-A690 PolarHBondContact O-N 2.75Å; H687-A690 PolarHBondContact O-N 3.22Å; A690-L692 PolarHBondContact O-N 3.44Å; A690-A693 WeakPolarHBondContact O-CB 3.49Å; A690-A693 PolarHBondContact O-N 2.95Å; A690-A693 VanDerWaalsContact O-N 3.1Å; A690-V694 PolarHBondContact O-N 3.31Å; A690-V730 HydrophobicContact CB-CG1 3.6Å
691	L	91.6	Very high	87.6	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-50.5	176.9	-178.5	67.6	0	0	0	111.9	V607 M608 I657 V660 F661 L676 H687 I688 A693 V694 R695	V607-L691 HydrophobicContact CG1-CD1 4.3Å; M608-L691 HydrophobicContact CE-CB 4.38Å; M608-L691 HydrophobicContact CE-CD1 4.48Å; M608-L691 HydrophobicContact SD-CB 4.37Å; I657-L691 HydrophobicContact CG2-CD1 3.58Å; V660-L691 HydrophobicContact CB-CD2 4.27Å; V660-L691 HydrophobicContact CG1-CD2 3.89Å; V660-L691 HydrophobicContact CG1-CG 4.35Å; V660-L691 HydrophobicContact CG2-CD2 4.35Å; F661-L691 HydrophobicContact CD1-CD1 4.26Å; F661-L691 HydrophobicContact CE1-CD1 3.32Å; F661-L691 HydrophobicContact CE1-CG 4.04Å; F661-L691 WeakPolarHBondContact CE1-O 3.41Å; F661-L691 HydrophobicContact CE2-CD1 4.26Å; F661-L691 HydrophobicContact CZ-CD1 3.32Å; F661-L691 HydrophobicContact CZ-CG 4.45Å; L676-L691 HydrophobicContact CD2-CD2 3.85Å; H687-L691 WeakPolarHBondContact O-CB 3.24Å; H687-L691 PolarHBondContact O-N 2.91Å; I688-L691 WeakPolarHBondContact O-CB 3.25Å; I688-L691 PolarHBondContact O-N 3.39Å; L691-A693 VanDerWaalsContact C-N 3.25Å; L691-A693 PolarHBondContact O-N 2.92Å; L691-V694 PolarHBondContact O-N 3.43Å; L691-R695 PolarHBondContact O-N 2.86Å; L691-R695 VanDerWaalsContact O-N 3.13Å
692	L	89.4	Confident	87.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-27.3	178.3	-65.2	176.8	0	0	0	112.5	L669 I688 A690 G696 A698 R703 I706	L669-L692 HydrophobicContact CD2-CD2 4.46Å; I688-L692 HydrophobicContact CG2-CD1 3.96Å; I688-L692 HydrophobicContact CG2-CG 4.32Å; I688-L692 VanDerWaalsContact O-CG 3.31Å; I688-L692 WeakPolarHBondContact O-CG 3.19Å; I688-L692 PolarHBondContact O-N 2.88Å; A690-L692 PolarHBondContact O-N 3.44Å; L692-G696 PolarHBondContact O-N 3.32Å; L692-A698 HydrophobicContact CB-CB 4.4Å; L692-A698 HydrophobicContact CD2-CB 4.4Å; L692-R703 HydrophobicContact CB-CG 4.13Å; L692-R703 HydrophobicContact CD1-CB 4.32Å; L692-R703 HydrophobicContact CD1-CG 3.93Å; L692-I706 HydrophobicContact CD1-CD1 4.35Å
693	A	88.3	Confident	87.3	Confident	26 Å²	26	44.8 Å²	44.8	22%	0.215	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-39.7	173.8	0	0	0	0	0	112.3	Q689 A690 L691 R695	Q689-A693 WeakPolarHBondContact O-CB 3.39Å; Q689-A693 PolarHBondContact O-N 3.36Å; A690-A693 WeakPolarHBondContact O-CB 3.49Å; A690-A693 PolarHBondContact O-N 2.95Å; A690-A693 VanDerWaalsContact O-N 3.1Å; L691-A693 VanDerWaalsContact C-N 3.25Å; L691-A693 PolarHBondContact O-N 2.92Å; A693-R695 VanDerWaalsContact C-N 3.31Å
694	V	89.4	Confident	87.1	Confident	6 Å²	6	49.6 Å²	49.6	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-38.5	174.2	172.3	0	0	0	0	111.4	V607 I612 T613 F614 F661 A690 L691 G696	V607-V694 WeakPolarHBondContact O-CG2 3.47Å; I612-V694 HydrophobicContact CG2-CG1 4.03Å; I612-V694 WeakPolarHBondContact O-CA 3.33Å; T613-V694 WeakPolarHBondContact CA-O 3.22Å; F614-V694 HydrophobicContact CD2-CG1 4.1Å; F614-V694 WeakPolarHBondContact CD2-O 3.47Å; F614-V694 HydrophobicContact CE2-CG1 3.78Å; F614-V694 PolarHBondContact N-O 3.49Å; F661-V694 HydrophobicContact CE1-CB 4.29Å; F661-V694 HydrophobicContact CE1-CG1 4.15Å; F661-V694 HydrophobicContact CE2-CG1 4.21Å; F661-V694 HydrophobicContact CZ-CB 4Å; F661-V694 HydrophobicContact CZ-CG1 3.62Å; A690-V694 PolarHBondContact O-N 3.31Å; L691-V694 PolarHBondContact O-N 3.43Å; V694-G696 PolarHBondContact O-N 3.4Å
695	R	88.9	Confident	86.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-36.6	-179.9	-165.1	-174.7	150.4	99.2	7.4	113.9	R620 V660 F661 L663 L691 A693 D697	R620-R695 WeakPolarHBondContact CD-O 3.45Å; V660-R695 PolarHBondContact O-NH1 2.85Å; F661-R695 HydrophobicContact CD1-CB 4.05Å; F661-R695 HydrophobicContact CD1-CG 4.17Å; F661-R695 HydrophobicContact CE1-CB 4.13Å; F661-R695 PolarHBondContact O-NH1 3.02Å; L663-R695 VanDerWaalsContact O-CZ 3.25Å; L663-R695 PolarHBondContact O-NH1 3.43Å; L663-R695 PolarHBondContact O-NH2 2.92Å; L691-R695 PolarHBondContact O-N 2.86Å; L691-R695 VanDerWaalsContact O-N 3.13Å; A693-R695 VanDerWaalsContact C-N 3.31Å; R695-D697 WeakPolarHBondContact CD-OD1 3.36Å; R695-D697 WeakPolarHBondContact CG-OD1 3.38Å; R695-D697 IonicContact CZ-OD1 2.63Å; R695-D697 IonicContact CZ-OD2 3.98Å; R695-D697 IonicContact NE-OD1 3.64Å; R695-D697 PolarHBondContact NE-OD1 2.76Å; R695-D697 IonicContact NE-OD2 3.58Å; R695-D697 IonicContact NH2-OD1 3.55Å; R695-D697 IonicContact NH2-OD2 2.74Å; R695-D697 PolarHBondContact NH2-OD2 3.18Å; R695-D697 PolarHBondContact O-N 3.31Å
696	G	85.7	Confident	86.8	Confident	34 Å²	34	47 Å²	47	35%	0.351	24%	0.237	S	C	.	.			trans	84.8	-20.8	167.2	0	0	0	0	0	118	T613 L692 V694	T613-G696 VanDerWaalsContact CG2-CA 3.42Å; L692-G696 PolarHBondContact O-N 3.32Å; V694-G696 PolarHBondContact O-N 3.4Å
697	D	86.3	Confident	86.6	Confident	48 Å²	48	46.2 Å²	46.2	26%	0.257	23%	0.232	S	C	.	.			trans	-103.5	-8.1	-177.4	64.2	-16.5	0	0	0	115.2	R620 R695 S699	R620-D697 VanDerWaalsContact CZ-CG 3.48Å; R620-D697 IonicContact CZ-OD2 2.74Å; R620-D697 IonicContact NE-OD2 3.7Å; R620-D697 VanDerWaalsContact NH1-CB 3.31Å; R620-D697 IonicContact NH1-OD1 3.79Å; R620-D697 IonicContact NH1-OD2 2.65Å; R620-D697 PolarHBondContact NH1-OD2 3.26Å; R620-D697 VanDerWaalsContact NH1-OD2 3.09Å; R620-D697 IonicContact NH2-OD2 2.65Å; R620-D697 PolarHBondContact NH2-OD2 3.49Å; R695-D697 WeakPolarHBondContact CD-OD1 3.36Å; R695-D697 WeakPolarHBondContact CG-OD1 3.38Å; R695-D697 IonicContact CZ-OD1 2.63Å; R695-D697 IonicContact CZ-OD2 3.98Å; R695-D697 IonicContact NE-OD1 3.64Å; R695-D697 PolarHBondContact NE-OD1 2.76Å; R695-D697 IonicContact NE-OD2 3.58Å; R695-D697 IonicContact NH2-OD1 3.55Å; R695-D697 IonicContact NH2-OD2 2.74Å; R695-D697 PolarHBondContact NH2-OD2 3.18Å; R695-D697 PolarHBondContact O-N 3.31Å; D697-S699 PolarHBondContact O-N 3.16Å
698	A	84.1	Confident	86.1	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.041	25%	0.246	C	C	.	.			trans	-74.1	118.7	177	0	0	0	0	0	110.9	L669 L692 M702 R703	L669-A698 HydrophobicContact CD1-CB 4.39Å; L692-A698 HydrophobicContact CB-CB 4.4Å; L692-A698 HydrophobicContact CD2-CB 4.4Å; A698-M702 HydrophobicContact CB-SD 4.44Å; A698-R703 HydrophobicContact CB-CG 3.95Å; A698-R703 PolarHBondContact O-NE 2.87Å; A698-R703 PolarHBondContact O-NH2 3.05Å; A698-R703 VanDerWaalsContact O-NH2 3.12Å
699	S	83.6	Confident	85.5	Confident	52 Å²	52	49 Å²	49	36%	0.364	26%	0.255	S	S	.	.			trans	-64.6	164.1	176	91	0	0	0	0	111.9	D697 E701 M702 R703	D697-S699 PolarHBondContact O-N 3.16Å; S699-E701 VanDerWaalsContact C-N 3.3Å; S699-E701 WeakPolarHBondContact CB-OE2 3.12Å; S699-E701 PolarHBondContact O-N 3.47Å; S699-E701 PolarHBondContact OG-N 2.88Å; S699-E701 PolarHBondContact OG-OE2 3.09Å; S699-M702 PolarHBondContact O-N 3.18Å; S699-M702 PolarHBondContact OG-N 2.94Å; S699-M702 VanDerWaalsContact OG-N 3.17Å; S699-R703 VanDerWaalsContact O-CG 3.29Å; S699-R703 WeakPolarHBondContact O-CG 3.37Å; S699-R703 PolarHBondContact O-N 3.41Å
700	R	83.3	Confident	85	Confident	182 Å²	182	46 Å²	46	69%	0.687	24%	0.242	S	C	*	.	H	α-helix	trans	-61.5	-41.3	179	-173.9	179.7	-179.9	179.5	0.8	111.5	R703 Q704	R700-R703 PolarHBondContact O-N 3.26Å; R700-Q704 WeakPolarHBondContact O-CG 3.25Å; R700-Q704 PolarHBondContact O-N 3.11Å; R700-Q704 VanDerWaalsContact O-N 3.08Å
701	E	83.4	Confident	84.2	Confident	127 Å²	127	47.8 Å²	47.8	59%	0.593	25%	0.254	S	S	*	.	H	α-helix	trans	-66.1	-43.3	179.2	-56.7	70	-147.5	0	0	110.6	S699 Q704 M705	S699-E701 VanDerWaalsContact C-N 3.3Å; S699-E701 WeakPolarHBondContact CB-OE2 3.12Å; S699-E701 PolarHBondContact O-N 3.47Å; S699-E701 PolarHBondContact OG-N 2.88Å; S699-E701 PolarHBondContact OG-OE2 3.09Å; E701-Q704 PolarHBondContact O-N 3.06Å; E701-M705 WeakPolarHBondContact O-CB 3.25Å; E701-M705 PolarHBondContact O-N 3.4Å
702	M	83.6	Confident	82.9	Confident	48 Å²	48	55.3 Å²	55.3	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-42.5	177	-177.1	175.8	-79	0	0	111.9	P666 L669 A698 S699 Q704 M705 I706	P666-M702 HydrophobicContact CB-CE 4.02Å; P666-M702 HydrophobicContact CB-SD 4.02Å; P666-M702 WeakPolarHBondContact O-CE 3.23Å; L669-M702 HydrophobicContact CD1-SD 3.86Å; A698-M702 HydrophobicContact CB-SD 4.44Å; S699-M702 PolarHBondContact O-N 3.18Å; S699-M702 PolarHBondContact OG-N 2.94Å; S699-M702 VanDerWaalsContact OG-N 3.17Å; M702-Q704 PolarHBondContact O-N 3.41Å; M702-M705 PolarHBondContact O-N 3.43Å; M702-I706 HydrophobicContact CG-CD1 3.94Å; M702-I706 VanDerWaalsContact O-CG1 3.29Å; M702-I706 WeakPolarHBondContact O-CG1 3.42Å; M702-I706 PolarHBondContact O-N 3.23Å
703	R	85.2	Confident	81.6	Confident	64 Å²	64	60.3 Å²	60.3	24%	0.242	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-44.9	174.9	-68.5	174.9	-162	-157.8	2	111.6	L692 A698 S699 R700 I707	L692-R703 HydrophobicContact CB-CG 4.13Å; L692-R703 HydrophobicContact CD1-CB 4.32Å; L692-R703 HydrophobicContact CD1-CG 3.93Å; A698-R703 HydrophobicContact CB-CG 3.95Å; A698-R703 PolarHBondContact O-NE 2.87Å; A698-R703 PolarHBondContact O-NH2 3.05Å; A698-R703 VanDerWaalsContact O-NH2 3.12Å; S699-R703 VanDerWaalsContact O-CG 3.29Å; S699-R703 WeakPolarHBondContact O-CG 3.37Å; S699-R703 PolarHBondContact O-N 3.41Å; R700-R703 PolarHBondContact O-N 3.26Å; R703-I707 WeakPolarHBondContact O-CB 3.46Å; R703-I707 WeakPolarHBondContact O-CD1 3.46Å; R703-I707 VanDerWaalsContact O-CG1 3.23Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 2.59Å
704	Q	84.3	Confident	80.2	Confident	120 Å²	120	66.9 Å²	66.9	56%	0.561	34%	0.34	S	S	*	.	H	α-helix	trans	-65.3	-40.6	178.2	-75.2	179.9	-15.4	0	0	112.2	R700 E701 M702 G708	R700-Q704 WeakPolarHBondContact O-CG 3.25Å; R700-Q704 PolarHBondContact O-N 3.11Å; R700-Q704 VanDerWaalsContact O-N 3.08Å; E701-Q704 PolarHBondContact O-N 3.06Å; M702-Q704 PolarHBondContact O-N 3.41Å; Q704-G708 PolarHBondContact O-N 3.36Å
705	M	84.9	Confident	78.8	Confident	121 Å²	121	71 Å²	71	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-63.4	-46.9	177.3	-174.5	-130	-169.3	0	0	111.8	E701 M702 T709	E701-M705 WeakPolarHBondContact O-CB 3.25Å; E701-M705 PolarHBondContact O-N 3.4Å; M702-M705 PolarHBondContact O-N 3.43Å; M705-T709 WeakPolarHBondContact O-CB 3.22Å; M705-T709 PolarHBondContact O-N 3.04Å; M705-T709 PolarHBondContact O-OG1 3.37Å
706	I	84.3	Confident	77.1	Confident	3 Å²	3	76.5 Å²	76.5	2%	0.015	40%	0.403	C	S	.	.	H	α-helix	trans	-61.9	-48.7	178.3	-68	168.7	0	0	0	110.3	L669 F670 V673 I688 L692 M702 L710	L669-I706 HydrophobicContact CB-CD1 3.84Å; F670-I706 HydrophobicContact CB-CG1 4.28Å; V673-I706 HydrophobicContact CB-CG2 4.21Å; V673-I706 HydrophobicContact CG1-CG2 4.02Å; V673-I706 HydrophobicContact CG2-CG2 4.43Å; I688-I706 HydrophobicContact CG2-CG2 4.49Å; L692-I706 HydrophobicContact CD1-CD1 4.35Å; M702-I706 HydrophobicContact CG-CD1 3.94Å; M702-I706 VanDerWaalsContact O-CG1 3.29Å; M702-I706 WeakPolarHBondContact O-CG1 3.42Å; M702-I706 PolarHBondContact O-N 3.23Å; I706-L710 HydrophobicContact CG2-CD1 3.67Å; I706-L710 WeakPolarHBondContact O-CB 3.34Å; I706-L710 WeakPolarHBondContact O-CD1 3.2Å; I706-L710 WeakPolarHBondContact O-CG 3.22Å; I706-L710 PolarHBondContact O-N 3.34Å; I706-L710 VanDerWaalsContact O-N 3.13Å
707	I	83.6	Confident	75.6	Confident	29 Å²	29	79.4 Å²	79.4	15%	0.149	40%	0.404	C	S	.	.	H	α-helix	trans	-64.4	-46.4	-179.2	-67.2	168.5	0	0	0	111.2	E685 I688 Q689 R703 T709 L710 S711	E685-I707 HydrophobicContact CB-CG2 4.24Å; E685-I707 HydrophobicContact CG-CG2 4.03Å; I688-I707 HydrophobicContact CG2-CG1 4.32Å; Q689-I707 HydrophobicContact CB-CD1 4.29Å; R703-I707 WeakPolarHBondContact O-CB 3.46Å; R703-I707 WeakPolarHBondContact O-CD1 3.46Å; R703-I707 VanDerWaalsContact O-CG1 3.23Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 2.59Å; I707-T709 PolarHBondContact O-N 2.91Å; I707-L710 PolarHBondContact O-N 3.33Å; I707-S711 PolarHBondContact O-N 3.28Å
708	G	80.1	Confident	74	Confident	28 Å²	28	81 Å²	81	29%	0.289	42%	0.419	S	S	.	.	H	α-helix	trans	-59.6	-47	179.6	0	0	0	0	0	112.3	Q704 L710 S711 E712	Q704-G708 PolarHBondContact O-N 3.36Å; G708-L710 VanDerWaalsContact C-N 3.32Å; G708-L710 PolarHBondContact O-N 3.26Å; G708-S711 PolarHBondContact O-N 3.27Å; G708-S711 PolarHBondContact O-OG 3.17Å; G708-E712 PolarHBondContact O-N 3.35Å
709	T	77.5	Confident	72.5	Confident	39 Å²	39	84.4 Å²	84.4	24%	0.239	46%	0.455	C	S	.	.	H	α-helix	trans	-67.9	-30.8	-178.9	-47	0	0	0	0	112.6	F670 M705 I707 N713	F670-T709 HydrophobicContact CD2-CG2 4.48Å; F670-T709 HydrophobicContact CE2-CG2 3.46Å; F670-T709 VanDerWaalsContact CE2-CG2 3.46Å; F670-T709 HydrophobicContact CZ-CG2 3.61Å; M705-T709 WeakPolarHBondContact O-CB 3.22Å; M705-T709 PolarHBondContact O-N 3.04Å; M705-T709 PolarHBondContact O-OG1 3.37Å; I707-T709 PolarHBondContact O-N 2.91Å; T709-N713 PolarHBondContact O-ND2 3.47Å
710	L	79.1	Confident	71	Confident	20 Å²	20	87.9 Å²	87.9	11%	0.105	47%	0.473	C	S	.	.	H	α-helix	trans	-76.9	-31.4	175.7	-69.6	167	0	0	0	112.3	V673 V677 I688 I706 I707 G708 E712 N713	V673-L710 HydrophobicContact CB-CD1 4.42Å; V673-L710 HydrophobicContact CG1-CD1 3.47Å; V673-L710 VanDerWaalsContact CG1-CD1 3.47Å; V677-L710 HydrophobicContact CG2-CD1 4.5Å; V677-L710 HydrophobicContact CG2-CD2 4.49Å; I688-L710 HydrophobicContact CD1-CD1 3.84Å; I706-L710 HydrophobicContact CG2-CD1 3.67Å; I706-L710 WeakPolarHBondContact O-CB 3.34Å; I706-L710 WeakPolarHBondContact O-CD1 3.2Å; I706-L710 WeakPolarHBondContact O-CG 3.22Å; I706-L710 PolarHBondContact O-N 3.34Å; I706-L710 VanDerWaalsContact O-N 3.13Å; I707-L710 PolarHBondContact O-N 3.33Å; G708-L710 VanDerWaalsContact C-N 3.32Å; G708-L710 PolarHBondContact O-N 3.26Å; L710-E712 VanDerWaalsContact C-N 3.25Å; L710-E712 PolarHBondContact O-N 3.3Å; L710-N713 PolarHBondContact O-N 2.98Å
711	S	71	Confident	70.1	Confident	51 Å²	51	82.3 Å²	82.3	36%	0.357	46%	0.46	S	S	.	.	H	α-helix	trans	-65.3	-29.7	175.8	76.7	0	0	0	0	112.7	I707 G708	I707-S711 PolarHBondContact O-N 3.28Å; G708-S711 PolarHBondContact O-N 3.27Å; G708-S711 PolarHBondContact O-OG 3.17Å
712	E	65.9	Low	69.7	Low	158 Å²	158	80.9 Å²	80.9	74%	0.738	45%	0.453	S	S	*	.	H	α-helix	trans	-78.5	-23.7	176.3	-67.6	176.5	177.6	0	0	113.2	G708 L710	G708-E712 PolarHBondContact O-N 3.35Å; L710-E712 VanDerWaalsContact C-N 3.25Å; L710-E712 PolarHBondContact O-N 3.3Å
713	N	61.8	Low	69.6	Low	106 Å²	106	80 Å²	80	57%	0.567	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	33	-173.8	-72.9	-56.8	0	0	0	114	T709 L710 V715	T709-N713 PolarHBondContact O-ND2 3.47Å; L710-N713 PolarHBondContact O-N 2.98Å; N713-V715 PolarHBondContact O-N 3.21Å
714	K	58.4	Low	69.7	Low	163 Å²	163	76.9 Å²	76.9	71%	0.709	44%	0.439	S	S	*	.			trans	-59.2	111.2	-177	-82.3	-177	178.7	172.9	0	112.6
715	V	59	Low	69.8	Low	94 Å²	94	71.2 Å²	71.2	57%	0.57	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-73.3	127.8	169	-174.5	0	0	0	0	108.5	N713	N713-V715 PolarHBondContact O-N 3.21Å
716	S	53.6	Low	69.8	Low	114 Å²	114	72 Å²	72	80%	0.797	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-71	129.3	178.6	-70.7	0	0	0	0	111.1	S718	S716-S718 PolarHBondContact O-N 3.07Å
717	Y	54.1	Low	69.4	Low	96 Å²	96	76 Å²	76	38%	0.376	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64.6	116.4	177	-166.6	-93.3	0	0	0	110.7	P681 D682 T721	P681-Y717 HydrophobicContact CB-CD2 4.22Å; P681-Y717 HydrophobicContact CG-CD2 3.78Å; P681-Y717 HydrophobicContact CG-CE2 4.12Å; D682-Y717 HydrophobicContact CB-CE2 4.07Å; Y717-T721 PolarHBondContact OH-O 3.32Å
718	S	53.5	Low	69.6	Low	82 Å²	82	74.6 Å²	74.6	57%	0.573	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-78	122	164.7	57.6	0	0	0	0	108.4	S716 T720	S716-S718 PolarHBondContact O-N 3.07Å; S718-T720 PolarHBondContact O-N 3.38Å; S718-T720 PolarHBondContact OG-OG1 3.1Å
719	G	52.5	Low	69.8	Low	76 Å²	76	77.8 Å²	77.8	78%	0.784	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	20.3	-172.1	0	0	0	0	0	116.7
720	T	52.6	Low	70	Confident	124 Å²	124	77 Å²	77	76%	0.761	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.4	-171.6	19.5	0	0	0	0	114.7	S718	S718-T720 PolarHBondContact O-N 3.38Å; S718-T720 PolarHBondContact OG-OG1 3.1Å
721	T	64.4	Low	69.7	Low	65 Å²	65	79.8 Å²	79.8	40%	0.399	46%	0.455	S	S	.	.	S	Bend	trans	-126.1	149.1	-176.2	-32.4	0	0	0	0	110.9	Y717	Y717-T721 PolarHBondContact OH-O 3.32Å
722	Q	74.1	Confident	68.9	Low	98 Å²	98	83.1 Å²	83.1	46%	0.458	47%	0.473	S	S	.	.			trans	-76	129.7	177.7	-166.6	-177.9	12.3	0	0	109.6	R649	R649-Q722 PolarHBondContact NH1-O 3.4Å; R649-Q722 PolarHBondContact NH2-O 2.96Å
723	P	82.6	Confident	68	Low	28 Å²	28	81.1 Å²	81.1	18%	0.182	47%	0.467	C	S	.	.			trans	-69	150.1	-179	28.2	-33.8	0	0	0	111.5	R597 D682 K726	R597-P723 PolarHBondContact NH2-O 2.65Å; D682-P723 HydrophobicContact CB-CB 4.04Å; D682-P723 WeakPolarHBondContact OD2-CA 3.39Å; D682-P723 VanDerWaalsContact OD2-CB 3.24Å; D682-P723 WeakPolarHBondContact OD2-CB 3.43Å; P723-K726 HydrophobicContact CB-CB 3.62Å; P723-K726 HydrophobicContact CB-CD 4.19Å; P723-K726 HydrophobicContact CG-CB 4.02Å; P723-K726 HydrophobicContact CG-CD 3.84Å
724	I	86.2	Confident	66.6	Low	0 Å²	0	81.4 Å²	81.4	0%	0	47%	0.472	C	S	.	.	S	Bend	trans	-109.4	-49.7	179.9	-58.4	171.8	0	0	0	110.3	V601 L604 L650 Y680 D682	V601-I724 HydrophobicContact CG2-CG2 4.35Å; L604-I724 HydrophobicContact CD1-CG2 3.48Å; L604-I724 VanDerWaalsContact CD1-CG2 3.48Å; L650-I724 HydrophobicContact CD2-CD1 3.68Å; L650-I724 HydrophobicContact CD2-CG1 3.73Å; Y680-I724 HydrophobicContact CD1-CD1 3.93Å; Y680-I724 HydrophobicContact CE1-CD1 3.71Å; D682-I724 PolarHBondContact OD2-N 2.92Å
725	F	86.9	Confident	65.3	Low	0 Å²	0	79.4 Å²	79.4	0%	0	47%	0.474	C	S	.	.	S	Bend	trans	-84.8	-22	-175.9	-67	-86.5	0	0	0	113.1	L604 M608 I657 Y680 D682 I683 H687 D727 I728	L604-F725 HydrophobicContact CD1-CE1 4.04Å; L604-F725 HydrophobicContact CD1-CZ 4.01Å; L604-F725 HydrophobicContact CD2-CE1 4.3Å; L604-F725 HydrophobicContact CD2-CZ 4.33Å; M608-F725 HydrophobicContact CE-CE1 4.23Å; I657-F725 HydrophobicContact CD1-CE1 3.97Å; I657-F725 HydrophobicContact CD1-CZ 4.06Å; Y680-F725 HydrophobicContact CD1-CE2 4.03Å; Y680-F725 HydrophobicContact CD2-CE2 4.37Å; Y680-F725 HydrophobicContact CG-CD2 4.42Å; Y680-F725 AromaticContact CG-CE2 3.78Å; Y680-F725 HydrophobicContact CG-CE2 3.78Å; D682-F725 WeakPolarHBondContact OD2-CA 3.47Å; D682-F725 PolarHBondContact OD2-N 2.84Å; I683-F725 HydrophobicContact CD1-CD1 4.36Å; I683-F725 HydrophobicContact CD1-CD2 3.92Å; I683-F725 HydrophobicContact CD1-CE1 4.16Å; I683-F725 HydrophobicContact CD1-CE2 3.7Å; I683-F725 HydrophobicContact CD1-CG 4.25Å; I683-F725 HydrophobicContact CD1-CZ 3.82Å; I683-F725 HydrophobicContact CG1-CB 3.95Å; I683-F725 HydrophobicContact CG1-CD1 3.79Å; I683-F725 HydrophobicContact CG1-CD2 3.36Å; I683-F725 HydrophobicContact CG1-CE1 4.09Å; I683-F725 HydrophobicContact CG1-CE2 3.7Å; I683-F725 HydrophobicContact CG1-CG 3.41Å; I683-F725 VanDerWaalsContact CG1-CG 3.41Å; I683-F725 HydrophobicContact CG1-CZ 4.05Å; H687-F725 PolarHBondContact CE1-O 3.02Å; H687-F725 PolarHBondContact NE2-O 3.44Å; F725-D727 PolarHBondContact O-N 3.02Å; F725-D727 VanDerWaalsContact O-N 3.15Å; F725-I728 HydrophobicContact CD1-CD1 4.02Å; F725-I728 PolarHBondContact O-N 3.01Å
726	K	84.3	Confident	63.8	Low	139 Å²	139	81.2 Å²	81.2	60%	0.604	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-38.6	179.3	-172.6	-179.5	179.1	-176.9	0	112.9	D682 R684 P723 I728	D682-K726 HydrophobicContact CB-CB 4.48Å; D682-K726 PolarHBondContact OD2-N 3.26Å; D682-K726 VanDerWaalsContact OD2-N 3.14Å; R684-K726 PolarHBondContact NH1-O 3.48Å; R684-K726 VanDerWaalsContact NH1-O 3.12Å; P723-K726 HydrophobicContact CB-CB 3.62Å; P723-K726 HydrophobicContact CB-CD 4.19Å; P723-K726 HydrophobicContact CG-CB 4.02Å; P723-K726 HydrophobicContact CG-CD 3.84Å; K726-I728 VanDerWaalsContact C-N 3.35Å
727	D	77.1	Confident	62.7	Low	85 Å²	85	83.9 Å²	83.9	46%	0.455	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.2	-176.2	-55.3	-29.6	0	0	0	113.3	R597 F725	R597-D727 IonicContact CZ-OD2 2.79Å; R597-D727 IonicContact NH1-OD2 3.59Å; R597-D727 IonicContact NH2-OD2 3.55Å; R597-D727 PolarHBondContact NH2-OD2 3.5Å; F725-D727 PolarHBondContact O-N 3.02Å; F725-D727 VanDerWaalsContact O-N 3.15Å
728	I	87.4	Confident	61.7	Low	0 Å²	0	86.2 Å²	86.2	0%	0	51%	0.512	C	S	.	.			trans	-88.2	126.2	177.2	-58.7	-179.9	0	0	0	108.5	V601 L604 K605 M608 R684 H687 F725 K726	V601-I728 HydrophobicContact CG1-CG1 4.2Å; L604-I728 HydrophobicContact CB-CD1 3.46Å; L604-I728 VanDerWaalsContact CB-CD1 3.46Å; L604-I728 HydrophobicContact CD1-CD1 4.05Å; L604-I728 HydrophobicContact CG-CD1 4.44Å; K605-I728 HydrophobicContact CG-CB 4.49Å; K605-I728 HydrophobicContact CG-CG1 4.17Å; K605-I728 HydrophobicContact CG-CG2 3.97Å; M608-I728 HydrophobicContact CB-CG2 4.25Å; M608-I728 HydrophobicContact CG-CG2 4.24Å; R684-I728 PolarHBondContact NH2-O 3.45Å; H687-I728 PolarHBondContact NE2-O 2.95Å; F725-I728 HydrophobicContact CD1-CD1 4.02Å; F725-I728 PolarHBondContact O-N 3.01Å; K726-I728 VanDerWaalsContact C-N 3.35Å
729	T	83.9	Confident	60.6	Low	96 Å²	96	86.7 Å²	86.7	59%	0.589	52%	0.515	S	S	*	.			trans	-98.5	136.7	175.3	53.4	0	0	0	0	109.9	Q609	Q609-T729 WeakPolarHBondContact CG-O 3.45Å; Q609-T729 PolarHBondContact NE2-O 3.31Å; Q609-T729 PolarHBondContact NE2-OG1 3.47Å
730	V	81.6	Confident	59.5	Low	22 Å²	22	92.1 Å²	92.1	13%	0.133	52%	0.522	C	S	.	.			trans	-111.1	131.2	175.8	-172.2	0	0	0	0	109.3	M608 D686 H687 A690 T732	M608-V730 HydrophobicContact CB-CG2 4.23Å; D686-V730 HydrophobicContact CB-CB 4.05Å; D686-V730 HydrophobicContact CB-CG1 4.49Å; D686-V730 HydrophobicContact CB-CG2 4.28Å; H687-V730 WeakPolarHBondContact CD2-CG2 3.45Å; A690-V730 HydrophobicContact CB-CG1 3.6Å; V730-T732 PolarHBondContact O-N 2.63Å
731	P	72.4	Confident	58.7	Low	78 Å²	78	93 Å²	93	51%	0.506	53%	0.528	S	S	.	.			trans	-64.2	118.7	173.7	-11.6	23.9	0	0	0	109.8	I733	P731-I733 PolarHBondContact O-N 2.98Å
732	T	54.5	Low	57.1	Low	121 Å²	121	94.3 Å²	94.3	74%	0.742	54%	0.54	S	S	*	.			trans	-68.4	121	-179.6	-12.3	0	0	0	0	110	V730 T734	V730-T732 PolarHBondContact O-N 2.63Å; T732-T734 PolarHBondContact O-N 3.01Å
733	I	48.2	Very low	55.1	Low	117 Å²	117	98.8 Å²	98.8	60%	0.6	56%	0.563	S	S	*	*			trans	-75.5	78.6	170.4	-54.7	173.8	0	0	0	107.6	P731 T735	P731-I733 PolarHBondContact O-N 2.98Å; I733-T735 PolarHBondContact O-N 3.47Å
734	T	32.3	Very low	52.7	Low	111 Å²	111	102.2 Å²	102.2	68%	0.681	59%	0.593	S	S	*	*			trans	-71.7	113	165.2	-20.2	0	0	0	0	107	T732 T736	T732-T734 PolarHBondContact O-N 3.01Å; T734-T736 PolarHBondContact O-N 3.48Å
735	T	30.3	Very low	50.1	Low	122 Å²	122	108.8 Å²	108.8	75%	0.748	63%	0.634	S	S	*	*			trans	-60.1	103	170.3	-37.5	0	0	0	0	107.4	I733 M737	I733-T735 PolarHBondContact O-N 3.47Å; T735-M737 VanDerWaalsContact C-N 3.27Å; T735-M737 PolarHBondContact O-N 2.7Å
736	T	26.6	Very low	47.6	Very low	132 Å²	132	113.6 Å²	113.6	81%	0.81	67%	0.673	S	S	*	*			trans	-73	83.2	176.7	37.3	0	0	0	0	109.8	T734	T734-T736 PolarHBondContact O-N 3.48Å
737	M	30.9	Very low	45.3	Very low	169 Å²	169	116.8 Å²	116.8	83%	0.833	69%	0.687	S	S	*	*			trans	-123.3	69.6	157.9	-89.5	-89.6	161.9	0	0	107.1	T735	T735-M737 VanDerWaalsContact C-N 3.27Å; T735-M737 PolarHBondContact O-N 2.7Å
738	T	32.8	Very low	43.3	Very low	145 Å²	145	120.5 Å²	120.5	89%	0.89	71%	0.706	S	S	*	*	S	Bend	trans	156.3	84.5	151.1	44.9	0	0	0	0	109.7
739	S	30.5	Very low	40.9	Very low	93 Å²	93	128.6 Å²	128.6	65%	0.65	75%	0.749	S	S	*	*			trans	-173.4	70.8	147.6	-172.8	0	0	0	0	108.8
740	M	30.6	Very low	38.5	Very low	189 Å²	189	137.6 Å²	137.6	93%	0.931	78%	0.78	S	S	*	*			trans	-109.2	81.5	154.6	-84.3	-156.7	-100.1	0	0	106
741	T	34.3	Very low	36.3	Very low	144 Å²	144	143.4 Å²	143.4	88%	0.883	81%	0.812	S	S	*	*	S	Bend	trans	-166.2	4.6	162	12.8	0	0	0	0	117.9
742	S	32.8	Very low	34.5	Very low	91 Å²	91	146.8 Å²	146.8	64%	0.636	83%	0.828	S	S	*	*	S	Bend	trans	-134.7	15.7	-173.8	75.1	0	0	0	0	119.6
743	M	31.4	Very low	33.3	Very low	193 Å²	193	148.2 Å²	148.2	95%	0.951	83%	0.833	S	S	*	*			trans	-130.5	60.5	173.7	-73.8	-163.8	-169.6	0	0	113.6
744	A	31	Very low	32.5	Very low	99 Å²	99	150.1 Å²	150.1	82%	0.818	85%	0.847	S	S	*	*	S	Bend	trans	-124.1	8.6	168.1	0	0	0	0	0	114.4
745	T	32.7	Very low	32.5	Very low	138 Å²	138	152.5 Å²	152.5	85%	0.847	86%	0.857	S	S	*	*	S	Bend	trans	-130.8	15.6	-171.3	47.5	0	0	0	0	116.6
746	A	33.4	Very low	32.6	Very low	101 Å²	101	154.5 Å²	154.5	84%	0.835	86%	0.864	S	S	*	*	S	Bend	trans	-127.1	39	-179.2	0	0	0	0	0	114.6
747	K	36.3	Very low	33	Very low	206 Å²	206	156.1 Å²	156.1	90%	0.896	87%	0.868	S	S	*	*	S	Bend	trans	-135.9	73.1	161.9	-95.3	-172.2	176.9	179.5	0	109.7
748	L	36.5	Very low	33.2	Very low	163 Å²	163	155.2 Å²	155.2	85%	0.853	87%	0.871	S	S	*	*	S	Bend	trans	-164.6	122.2	157.1	-100.5	152.6	0	0	0	105.8
749	L	35.3	Very low	33.2	Very low	170 Å²	170	156 Å²	156	89%	0.89	87%	0.869	S	S	*	*			trans	92.1	77.2	179.5	-56.9	155.5	0	0	0	117.1
750	K	34.4	Very low	33.5	Very low	285 Å²	285	161.7 Å²	161.7	100%	1.239	89%	0.889	S	S	*	*				174	0	102	-102.4	-176.1	177.3	179.1	0	110.3

Retrieved 750 of 750 residues in 1261.8 ms (Link to these results)

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