A0A093HU62_STRCA 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 A0A093HU62, Species STRCA (Struthio camelus australis), Gene n/a, Length 745 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	58.3	Low	74.8	Confident	192 Å²	192	117.5 Å²	117.5	95%	0.946	62%	0.615	S	S	*	*				0	-48.8	0	-117.6	-174.9	-75	0	0	110.9	E3 T4 D5	M1-E3 PolarHBondContact O-N 2.94Å; M1-T4 WeakPolarHBondContact CA-OG1 3.33Å; M1-T4 PolarHBondContact O-OG1 2.77Å; M1-D5 WeakPolarHBondContact O-CB 3.47Å; M1-D5 PolarHBondContact O-N 3.39Å
2	E	69.5	Low	75.2	Confident	148 Å²	148	111.8 Å²	111.8	69%	0.692	60%	0.598	S	S	*	*	H	α-helix	trans	-64	-36.8	179.3	-67.5	-172.1	161.1	0	0	114.7	R6	E2-R6 WeakPolarHBondContact O-CG 3.48Å; E2-R6 PolarHBondContact O-N 2.8Å; E2-R6 VanDerWaalsContact O-N 3.1Å
3	E	70.1	Confident	75.7	Confident	162 Å²	162	110.5 Å²	110.5	76%	0.757	60%	0.596	S	S	*	*	H	α-helix	trans	-72.2	-42.9	-179.9	-163.8	166.7	-157.6	0	0	112.2	M1 D5 R6 E7	M1-E3 PolarHBondContact O-N 2.94Å; E3-D5 VanDerWaalsContact C-N 3.34Å; E3-D5 PolarHBondContact O-N 2.74Å; E3-R6 PolarHBondContact O-N 3.12Å; E3-E7 PolarHBondContact O-N 3.36Å
4	T	71.8	Confident	76	Confident	83 Å²	83	113.2 Å²	113.2	51%	0.509	60%	0.603	S	S	.	*	H	α-helix	trans	-65.3	-34.8	174.4	48.5	0	0	0	0	112.6	M1 A8	M1-T4 WeakPolarHBondContact CA-OG1 3.33Å; M1-T4 PolarHBondContact O-OG1 2.77Å; T4-A8 VanDerWaalsContact O-CB 3.3Å; T4-A8 WeakPolarHBondContact O-CB 3.46Å; T4-A8 PolarHBondContact O-N 3.36Å
5	D	75.9	Confident	76.2	Confident	100 Å²	100	114.7 Å²	114.7	54%	0.535	60%	0.597	S	S	.	*	H	α-helix	trans	-68.9	-41.7	175	-82.5	-12.3	0	0	0	111.3	M1 E3 E7 A8 V9	M1-D5 WeakPolarHBondContact O-CB 3.47Å; M1-D5 PolarHBondContact O-N 3.39Å; E3-D5 VanDerWaalsContact C-N 3.34Å; E3-D5 PolarHBondContact O-N 2.74Å; D5-E7 VanDerWaalsContact C-N 3.33Å; D5-E7 PolarHBondContact O-N 3.45Å; D5-A8 PolarHBondContact O-N 2.99Å; D5-V9 WeakPolarHBondContact O-CB 3.24Å; D5-V9 VanDerWaalsContact O-CG2 3.23Å; D5-V9 WeakPolarHBondContact O-CG2 3.43Å; D5-V9 PolarHBondContact O-N 3.35Å
6	R	79	Confident	76.4	Confident	185 Å²	185	112.9 Å²	112.9	70%	0.698	59%	0.592	S	S	*	*	H	α-helix	trans	-61.3	-42.3	174.8	-76.4	-178.7	-167	163.7	7.5	111.9	E2 E3 V9 A10	E2-R6 WeakPolarHBondContact O-CG 3.48Å; E2-R6 PolarHBondContact O-N 2.8Å; E2-R6 VanDerWaalsContact O-N 3.1Å; E3-R6 PolarHBondContact O-N 3.12Å; R6-V9 PolarHBondContact O-N 2.98Å; R6-A10 WeakPolarHBondContact O-CB 3.45Å; R6-A10 PolarHBondContact O-N 3.44Å
7	E	78.4	Confident	76.5	Confident	135 Å²	135	110 Å²	110	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-68.5	-40	179.4	-156.2	176.2	-159.3	0	0	112.1	E3 D5 A10 T11	E3-E7 PolarHBondContact O-N 3.36Å; D5-E7 VanDerWaalsContact C-N 3.33Å; D5-E7 PolarHBondContact O-N 3.45Å; E7-A10 PolarHBondContact O-N 3.17Å; E7-T11 WeakPolarHBondContact O-CB 3.29Å; E7-T11 PolarHBondContact O-N 3.25Å; E7-T11 PolarHBondContact O-OG1 3.18Å
8	A	78.4	Confident	76.5	Confident	58 Å²	58	106.3 Å²	106.3	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-41	174.1	0	0	0	0	0	112.2	T4 D5 A12	T4-A8 VanDerWaalsContact O-CB 3.3Å; T4-A8 WeakPolarHBondContact O-CB 3.46Å; T4-A8 PolarHBondContact O-N 3.36Å; D5-A8 PolarHBondContact O-N 2.99Å; A8-A12 VanDerWaalsContact O-CB 3.3Å; A8-A12 WeakPolarHBondContact O-CB 3.27Å; A8-A12 PolarHBondContact O-N 3.41Å
9	V	81.4	Confident	76.5	Confident	92 Å²	92	103.5 Å²	103.5	56%	0.558	56%	0.564	S	S	*	*	H	α-helix	trans	-65.6	-46.4	175.1	171.2	0	0	0	0	110.8	D5 R6 T11 A12 V13	D5-V9 WeakPolarHBondContact O-CB 3.24Å; D5-V9 VanDerWaalsContact O-CG2 3.23Å; D5-V9 WeakPolarHBondContact O-CG2 3.43Å; D5-V9 PolarHBondContact O-N 3.35Å; R6-V9 PolarHBondContact O-N 2.98Å; V9-T11 VanDerWaalsContact C-N 3.32Å; V9-T11 PolarHBondContact O-N 3.48Å; V9-A12 PolarHBondContact O-N 2.93Å; V9-V13 HydrophobicContact CG1-CG2 4.39Å; V9-V13 VanDerWaalsContact O-CG2 3.28Å; V9-V13 WeakPolarHBondContact O-CG2 3.29Å; V9-V13 PolarHBondContact O-N 3.4Å
10	A	79.9	Confident	76.5	Confident	56 Å²	56	101.6 Å²	101.6	46%	0.463	55%	0.552	S	S	.	*	H	α-helix	trans	-59.2	-42.4	177.3	0	0	0	0	0	112.1	R6 E7 V13 Q14	R6-A10 WeakPolarHBondContact O-CB 3.45Å; R6-A10 PolarHBondContact O-N 3.44Å; E7-A10 PolarHBondContact O-N 3.17Å; A10-V13 PolarHBondContact O-N 2.9Å; A10-Q14 PolarHBondContact O-N 3.46Å
11	T	79.8	Confident	76.5	Confident	81 Å²	81	104 Å²	104	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-66.8	-40.6	176.4	-53.6	0	0	0	0	111.9	E7 V9 Q14 R15	E7-T11 WeakPolarHBondContact O-CB 3.29Å; E7-T11 PolarHBondContact O-N 3.25Å; E7-T11 PolarHBondContact O-OG1 3.18Å; V9-T11 VanDerWaalsContact C-N 3.32Å; V9-T11 PolarHBondContact O-N 3.48Å; T11-Q14 PolarHBondContact O-N 2.88Å; T11-R15 VanDerWaalsContact O-CB 3.3Å; T11-R15 WeakPolarHBondContact O-CB 3.45Å; T11-R15 PolarHBondContact O-N 3.16Å
12	A	80.4	Confident	77.4	Confident	50 Å²	50	103.1 Å²	103.1	41%	0.413	55%	0.546	S	S	.	.	H	α-helix	trans	-63.9	-40.9	175.8	0	0	0	0	0	111.6	A8 V9 R15 V16	A8-A12 VanDerWaalsContact O-CB 3.3Å; A8-A12 WeakPolarHBondContact O-CB 3.27Å; A8-A12 PolarHBondContact O-N 3.41Å; V9-A12 PolarHBondContact O-N 2.93Å; A12-R15 PolarHBondContact O-N 3.41Å; A12-V16 VanDerWaalsContact O-CG2 3.31Å; A12-V16 WeakPolarHBondContact O-CG2 3.33Å; A12-V16 PolarHBondContact O-N 3.21Å
13	V	81	Confident	77.5	Confident	94 Å²	94	101.3 Å²	101.3	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-62.1	-48.5	175.5	170.5	0	0	0	0	111	V9 A10 R15 V16 A17	V9-V13 HydrophobicContact CG1-CG2 4.39Å; V9-V13 VanDerWaalsContact O-CG2 3.28Å; V9-V13 WeakPolarHBondContact O-CG2 3.29Å; V9-V13 PolarHBondContact O-N 3.4Å; A10-V13 PolarHBondContact O-N 2.9Å; V13-R15 VanDerWaalsContact C-N 3.29Å; V13-R15 PolarHBondContact O-N 2.93Å; V13-V16 PolarHBondContact O-N 3.19Å; V13-A17 WeakPolarHBondContact O-CB 3.47Å; V13-A17 PolarHBondContact O-N 3.28Å
14	Q	79.9	Confident	77.7	Confident	149 Å²	149	98.4 Å²	98.4	70%	0.696	54%	0.537	S	S	*	.	H	α-helix	trans	-58.5	-41.1	174.6	-83.4	-174.2	-14.3	0	0	112.3	A10 T11 A17 G18	A10-Q14 PolarHBondContact O-N 3.46Å; T11-Q14 PolarHBondContact O-N 2.88Å; Q14-A17 PolarHBondContact O-N 3.36Å; Q14-G18 PolarHBondContact O-N 3.22Å
15	R	79.2	Confident	77.8	Confident	136 Å²	136	96.7 Å²	96.7	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-66	-41.5	179.6	-170.3	-178.8	-167.6	175.2	11.1	112.3	T11 A12 V13 G18 M19	T11-R15 VanDerWaalsContact O-CB 3.3Å; T11-R15 WeakPolarHBondContact O-CB 3.45Å; T11-R15 PolarHBondContact O-N 3.16Å; A12-R15 PolarHBondContact O-N 3.41Å; V13-R15 VanDerWaalsContact C-N 3.29Å; V13-R15 PolarHBondContact O-N 2.93Å; R15-G18 PolarHBondContact O-N 3.36Å; R15-M19 HydrophobicContact CG-CE 3.69Å; R15-M19 VanDerWaalsContact O-CG 3.29Å; R15-M19 WeakPolarHBondContact O-CG 3.24Å; R15-M19 PolarHBondContact O-N 2.94Å
16	V	79.9	Confident	77.8	Confident	85 Å²	85	97 Å²	97	52%	0.515	52%	0.524	S	S	.	.	H	α-helix	trans	-68	-42.4	176.3	172.1	0	0	0	0	110.6	A12 V13 G18 M19 L20	A12-V16 VanDerWaalsContact O-CG2 3.31Å; A12-V16 WeakPolarHBondContact O-CG2 3.33Å; A12-V16 PolarHBondContact O-N 3.21Å; V13-V16 PolarHBondContact O-N 3.19Å; V16-G18 VanDerWaalsContact C-N 3.29Å; V16-G18 PolarHBondContact O-N 2.72Å; V16-M19 PolarHBondContact O-N 2.97Å; V16-L20 HydrophobicContact CG1-CD1 4.13Å; V16-L20 PolarHBondContact O-N 3.16Å
17	A	77.5	Confident	77.6	Confident	64 Å²	64	95.2 Å²	95.2	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-59.5	-38.4	174.6	0	0	0	0	0	112.2	V13 Q14 M19	V13-A17 WeakPolarHBondContact O-CB 3.47Å; V13-A17 PolarHBondContact O-N 3.28Å; Q14-A17 PolarHBondContact O-N 3.36Å; A17-M19 VanDerWaalsContact C-N 3.32Å; A17-M19 PolarHBondContact O-N 3.22Å
18	G	76.4	Confident	77.6	Confident	43 Å²	43	93.7 Å²	93.7	44%	0.443	52%	0.52	S	S	.	.	H	α-helix	trans	-69.4	-22.2	174.5	0	0	0	0	0	115	Q14 R15 V16	Q14-G18 PolarHBondContact O-N 3.22Å; R15-G18 PolarHBondContact O-N 3.36Å; V16-G18 VanDerWaalsContact C-N 3.29Å; V16-G18 PolarHBondContact O-N 2.72Å
19	M	76.2	Confident	77.7	Confident	54 Å²	54	93.8 Å²	93.8	27%	0.266	51%	0.514	S	S	.	.	H	α-helix	trans	-88.3	-15.5	-179.2	-72.7	175.7	-178	0	0	114	R15 V16 A17 Q25 Y32	R15-M19 HydrophobicContact CG-CE 3.69Å; R15-M19 VanDerWaalsContact O-CG 3.29Å; R15-M19 WeakPolarHBondContact O-CG 3.24Å; R15-M19 PolarHBondContact O-N 2.94Å; V16-M19 PolarHBondContact O-N 2.97Å; A17-M19 VanDerWaalsContact C-N 3.32Å; A17-M19 PolarHBondContact O-N 3.22Å; M19-Q25 PolarHBondContact O-OE1 2.94Å; M19-Y32 HydrophobicContact CB-CE2 4.5Å
20	L	77.9	Confident	77.7	Confident	64 Å²	64	94.3 Å²	94.3	34%	0.335	51%	0.511	S	S	.	.			trans	-128.6	57.8	-172	-62.7	174.3	0	0	0	111.1	V16 Q25 L26 V29	V16-L20 HydrophobicContact CG1-CD1 4.13Å; V16-L20 PolarHBondContact O-N 3.16Å; L20-Q25 HydrophobicContact CD2-CB 4.4Å; L20-L26 HydrophobicContact CD2-CD2 4.5Å; L20-V29 HydrophobicContact CD1-CG2 4.32Å; L20-V29 HydrophobicContact CD2-CG2 3.68Å
21	Q	75.9	Confident	77.8	Confident	153 Å²	153	97.9 Å²	97.9	72%	0.715	52%	0.518	S	S	*	.			trans	-88.5	-19.7	-177.4	-67.5	-170.2	-9.9	0	0	113.9
22	R	75.9	Confident	77.9	Confident	173 Å²	173	97.1 Å²	97.1	65%	0.653	51%	0.506	S	S	*	.	S	Bend	trans	-130.4	150	179.7	-60.9	-176.8	-179.5	176.1	-0.8	112	D24 Q25	R22-D24 VanDerWaalsContact C-N 3.31Å; R22-D24 WeakPolarHBondContact CB-OD1 3.32Å; R22-D24 PolarHBondContact O-N 3.18Å; R22-Q25 HydrophobicContact CB-CG 4.32Å; R22-Q25 WeakPolarHBondContact O-CB 3.31Å; R22-Q25 PolarHBondContact O-N 3.11Å
23	P	72.7	Confident	78	Confident	111 Å²	111	103.1 Å²	103.1	72%	0.721	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-59.9	-33.8	-174.6	-23.3	33.3	0	0	0	114.7	Q25 L26	P23-Q25 PolarHBondContact O-N 3.29Å; P23-L26 WeakPolarHBondContact O-CB 3.39Å; P23-L26 PolarHBondContact O-N 3.37Å
24	D	73.4	Confident	78.2	Confident	100 Å²	100	105.3 Å²	105.3	54%	0.535	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-65.6	-14.1	177.4	61	-54	0	0	0	113.6	R22 L26	R22-D24 VanDerWaalsContact C-N 3.31Å; R22-D24 WeakPolarHBondContact CB-OD1 3.32Å; R22-D24 PolarHBondContact O-N 3.18Å; D24-L26 VanDerWaalsContact C-N 3.34Å
25	Q	74.9	Confident	78.3	Confident	48 Å²	48	105 Å²	105	22%	0.224	51%	0.509	C	S	.	.	G	3₁₀ helix	trans	-84.2	-10.8	178.7	-58.5	178.4	-29.2	0	0	112.8	M19 L20 R22 P23 D27 K28	M19-Q25 PolarHBondContact O-OE1 2.94Å; L20-Q25 HydrophobicContact CD2-CB 4.4Å; R22-Q25 HydrophobicContact CB-CG 4.32Å; R22-Q25 WeakPolarHBondContact O-CB 3.31Å; R22-Q25 PolarHBondContact O-N 3.11Å; P23-Q25 PolarHBondContact O-N 3.29Å; Q25-D27 VanDerWaalsContact C-N 3.29Å; Q25-D27 PolarHBondContact O-N 2.98Å; Q25-K28 PolarHBondContact O-N 3.28Å
26	L	75.1	Confident	78.6	Confident	106 Å²	106	102 Å²	102	56%	0.555	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-64.8	-31.8	175.6	-72	169.3	0	0	0	112.3	L20 P23 D24 K28 V29	L20-L26 HydrophobicContact CD2-CD2 4.5Å; P23-L26 WeakPolarHBondContact O-CB 3.39Å; P23-L26 PolarHBondContact O-N 3.37Å; D24-L26 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 2.83Å; L26-K28 VanDerWaalsContact O-N 3.15Å; L26-V29 HydrophobicContact CD2-CG2 4.16Å; L26-V29 VanDerWaalsContact O-CB 3.28Å; L26-V29 WeakPolarHBondContact O-CB 3.48Å; L26-V29 WeakPolarHBondContact O-CG2 3.5Å; L26-V29 PolarHBondContact O-N 3.45Å
27	D	75.9	Confident	78.9	Confident	147 Å²	147	100.6 Å²	100.6	79%	0.786	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-62.6	-22.9	175.8	-67.4	-22	0	0	0	112.5	Q25	Q25-D27 VanDerWaalsContact C-N 3.29Å; Q25-D27 PolarHBondContact O-N 2.98Å
28	K	76.8	Confident	79.3	Confident	104 Å²	104	106.4 Å²	106.4	45%	0.452	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-90	-4.2	178.9	-62.8	179.5	-177.3	171.5	0	113.6	Q25 L26 E30 Q31 Y32	Q25-K28 PolarHBondContact O-N 3.28Å; L26-K28 PolarHBondContact O-N 2.83Å; L26-K28 VanDerWaalsContact O-N 3.15Å; K28-E30 VanDerWaalsContact C-N 3.28Å; K28-E30 PolarHBondContact O-N 3.32Å; K28-Q31 WeakPolarHBondContact O-CB 3.23Å; K28-Q31 PolarHBondContact O-N 3Å; K28-Y32 HydrophobicContact CB-CD2 4.32Å; K28-Y32 HydrophobicContact CB-CE2 3.86Å; K28-Y32 WeakPolarHBondContact O-CD2 3.32Å; K28-Y32 PolarHBondContact O-N 3.45Å
29	V	81.8	Confident	79.7	Confident	60 Å²	60	107.5 Å²	107.5	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-57.4	-40.9	-178.3	170	0	0	0	0	111.6	L20 L26 Q31 Y32 R33	L20-V29 HydrophobicContact CD1-CG2 4.32Å; L20-V29 HydrophobicContact CD2-CG2 3.68Å; L26-V29 HydrophobicContact CD2-CG2 4.16Å; L26-V29 VanDerWaalsContact O-CB 3.28Å; L26-V29 WeakPolarHBondContact O-CB 3.48Å; L26-V29 WeakPolarHBondContact O-CG2 3.5Å; L26-V29 PolarHBondContact O-N 3.45Å; V29-Q31 VanDerWaalsContact C-N 3.31Å; V29-Q31 PolarHBondContact O-N 3.1Å; V29-Y32 PolarHBondContact O-N 3.11Å; V29-R33 WeakPolarHBondContact O-CB 3.23Å; V29-R33 PolarHBondContact O-N 3.24Å
30	E	81.5	Confident	80.2	Confident	102 Å²	102	111.4 Å²	111.4	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-34	-180	-160.1	174	157.8	0	0	112	K28 R33 R34	K28-E30 VanDerWaalsContact C-N 3.28Å; K28-E30 PolarHBondContact O-N 3.32Å; E30-R33 PolarHBondContact O-N 2.59Å; E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.12Å; E30-R34 PolarHBondContact O-N 3.45Å; E30-R34 IonicContact OE1-CZ 3.2Å; E30-R34 IonicContact OE1-NE 2.75Å; E30-R34 IonicContact OE1-NH2 2.98Å; E30-R34 PolarHBondContact OE1-NH2 3.04Å
31	Q	81.5	Confident	80.6	Confident	132 Å²	132	110.9 Å²	110.9	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-41.8	172.6	-164.5	-178.5	15.2	0	0	111.4	K28 V29 R34 R35	K28-Q31 WeakPolarHBondContact O-CB 3.23Å; K28-Q31 PolarHBondContact O-N 3Å; V29-Q31 VanDerWaalsContact C-N 3.31Å; V29-Q31 PolarHBondContact O-N 3.1Å; Q31-R34 PolarHBondContact O-N 3.12Å; Q31-R35 WeakPolarHBondContact O-CB 3.28Å; Q31-R35 PolarHBondContact O-N 2.81Å
32	Y	82.1	Confident	81.2	Confident	65 Å²	65	105.9 Å²	105.9	26%	0.255	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-40.8	174.4	-63.8	-39.2	0	0	0	112.3	M19 K28 V29 R34 R35 E36	M19-Y32 HydrophobicContact CB-CE2 4.5Å; K28-Y32 HydrophobicContact CB-CD2 4.32Å; K28-Y32 HydrophobicContact CB-CE2 3.86Å; K28-Y32 WeakPolarHBondContact O-CD2 3.32Å; K28-Y32 PolarHBondContact O-N 3.45Å; V29-Y32 PolarHBondContact O-N 3.11Å; Y32-R34 VanDerWaalsContact C-N 3.35Å; Y32-R34 PolarHBondContact O-N 3.5Å; Y32-R35 WeakPolarHBondContact O-CB 3.45Å; Y32-R35 PolarHBondContact O-N 3.31Å; Y32-R35 VanDerWaalsContact O-N 3.12Å; Y32-E36 PolarHBondContact O-N 3.38Å
33	R	82.7	Confident	81.7	Confident	175 Å²	175	101.4 Å²	101.4	66%	0.66	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-44.4	174.6	-164.2	-179.1	79.4	-179.5	1.9	111.1	V29 E30 R35 A37	V29-R33 WeakPolarHBondContact O-CB 3.23Å; V29-R33 PolarHBondContact O-N 3.24Å; E30-R33 PolarHBondContact O-N 2.59Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R33-R35 PolarHBondContact O-N 2.79Å; R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3Å
34	R	84.3	Confident	82.5	Confident	140 Å²	140	100.5 Å²	100.5	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-38.4	174.2	-71.5	176	-167.2	-174.5	5.7	111.6	E30 Q31 Y32 R38	E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.12Å; E30-R34 PolarHBondContact O-N 3.45Å; E30-R34 IonicContact OE1-CZ 3.2Å; E30-R34 IonicContact OE1-NE 2.75Å; E30-R34 IonicContact OE1-NH2 2.98Å; E30-R34 PolarHBondContact OE1-NH2 3.04Å; Q31-R34 PolarHBondContact O-N 3.12Å; Y32-R34 VanDerWaalsContact C-N 3.35Å; Y32-R34 PolarHBondContact O-N 3.5Å; R34-R38 WeakPolarHBondContact O-CB 3.21Å; R34-R38 VanDerWaalsContact O-CG 3.27Å; R34-R38 WeakPolarHBondContact O-CG 3.41Å; R34-R38 PolarHBondContact O-N 3.06Å
35	R	83.3	Confident	83.1	Confident	142 Å²	142	98.5 Å²	98.5	54%	0.536	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-47.1	177.1	-171.9	-178.9	-175.6	-174	1.7	112.2	Q31 Y32 R33 R38 K39	Q31-R35 WeakPolarHBondContact O-CB 3.28Å; Q31-R35 PolarHBondContact O-N 2.81Å; Y32-R35 WeakPolarHBondContact O-CB 3.45Å; Y32-R35 PolarHBondContact O-N 3.31Å; Y32-R35 VanDerWaalsContact O-N 3.12Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R33-R35 PolarHBondContact O-N 2.79Å; R35-R38 PolarHBondContact O-N 3.46Å; R35-K39 WeakPolarHBondContact O-CG 3.08Å; R35-K39 PolarHBondContact O-N 2.97Å
36	E	84.8	Confident	83.7	Confident	73 Å²	73	104.5 Å²	104.5	34%	0.341	50%	0.497	S	S	.	.	H	α-helix	trans	-70.1	-35.6	177.9	-68.5	-52.9	132.1	0	0	111.7	Y32 R38 K39 K40	Y32-E36 PolarHBondContact O-N 3.38Å; E36-R38 PolarHBondContact O-N 3.03Å; E36-K39 PolarHBondContact O-N 3.34Å; E36-K39 IonicContact OE1-NZ 3.17Å; E36-K39 PolarHBondContact OE1-NZ 3.48Å; E36-K40 WeakPolarHBondContact O-CB 3.5Å; E36-K40 PolarHBondContact O-N 3.43Å
37	A	86.2	Confident	84.3	Confident	57 Å²	57	104.1 Å²	104.1	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-42	171	0	0	0	0	0	112.2	R33 K40 A41	R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3Å; A37-K40 PolarHBondContact O-N 3.31Å; A37-A41 WeakPolarHBondContact O-CB 3.38Å; A37-A41 PolarHBondContact O-N 3.2Å
38	R	85.9	Confident	84.9	Confident	186 Å²	186	104.2 Å²	104.2	70%	0.702	49%	0.489	S	S	*	.	H	α-helix	trans	-65.1	-41.1	174.1	-73.6	176.5	-162.1	176.7	4	112.3	R34 R35 E36 A41 S42	R34-R38 WeakPolarHBondContact O-CB 3.21Å; R34-R38 VanDerWaalsContact O-CG 3.27Å; R34-R38 WeakPolarHBondContact O-CG 3.41Å; R34-R38 PolarHBondContact O-N 3.06Å; R35-R38 PolarHBondContact O-N 3.46Å; E36-R38 PolarHBondContact O-N 3.03Å; R38-A41 PolarHBondContact O-N 3.02Å; R38-S42 WeakPolarHBondContact O-CB 3.3Å; R38-S42 PolarHBondContact O-N 2.98Å
39	K	84.6	Confident	85.5	Confident	66 Å²	66	102.2 Å²	102.2	29%	0.287	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-46.1	175.3	-75.2	-179.9	-172.5	164.6	0	111.4	R35 E36 S42 V43	R35-K39 WeakPolarHBondContact O-CG 3.08Å; R35-K39 PolarHBondContact O-N 2.97Å; E36-K39 PolarHBondContact O-N 3.34Å; E36-K39 IonicContact OE1-NZ 3.17Å; E36-K39 PolarHBondContact OE1-NZ 3.48Å; K39-S42 PolarHBondContact O-N 3.5Å; K39-V43 WeakPolarHBondContact O-CG2 3.49Å; K39-V43 PolarHBondContact O-N 3.06Å
40	K	87.5	Confident	85.8	Confident	135 Å²	135	102 Å²	102	59%	0.587	50%	0.496	S	S	*	.	H	α-helix	trans	-56.9	-50.5	174.9	-179.8	176.6	172.6	176.6	0	110.8	E36 A37 S42 V43 E44	E36-K40 WeakPolarHBondContact O-CB 3.5Å; E36-K40 PolarHBondContact O-N 3.43Å; A37-K40 PolarHBondContact O-N 3.31Å; K40-S42 VanDerWaalsContact C-N 3.31Å; K40-S42 PolarHBondContact O-N 3.26Å; K40-V43 PolarHBondContact O-N 3.24Å; K40-E44 WeakPolarHBondContact CE-OE1 3.5Å; K40-E44 HydrophobicContact CG-CG 4.38Å; K40-E44 IonicContact NZ-OE1 3.02Å; K40-E44 WeakPolarHBondContact O-CB 3.47Å; K40-E44 WeakPolarHBondContact O-CG 3.34Å; K40-E44 PolarHBondContact O-N 3.49Å
41	A	86.7	Confident	86.1	Confident	54 Å²	54	101.3 Å²	101.3	45%	0.446	50%	0.495	S	S	.	.	H	α-helix	trans	-60.3	-38.9	177.2	0	0	0	0	0	112.6	A37 R38 A45	A37-A41 WeakPolarHBondContact O-CB 3.38Å; A37-A41 PolarHBondContact O-N 3.2Å; R38-A41 PolarHBondContact O-N 3.02Å; A41-A45 VanDerWaalsContact O-CB 3.27Å; A41-A45 WeakPolarHBondContact O-CB 3.3Å; A41-A45 PolarHBondContact O-N 3.24Å
42	S	87.8	Confident	86.5	Confident	48 Å²	48	99.8 Å²	99.8	34%	0.336	49%	0.488	S	S	.	.	H	α-helix	trans	-67	-42.4	175.4	-178.3	0	0	0	0	112.4	R38 K39 K40 A45 R46	R38-S42 WeakPolarHBondContact O-CB 3.3Å; R38-S42 PolarHBondContact O-N 2.98Å; K39-S42 PolarHBondContact O-N 3.5Å; K40-S42 VanDerWaalsContact C-N 3.31Å; K40-S42 PolarHBondContact O-N 3.26Å; S42-A45 PolarHBondContact O-N 2.73Å; S42-R46 WeakPolarHBondContact O-CG 3.29Å; S42-R46 PolarHBondContact O-N 3.06Å; S42-R46 PolarHBondContact OG-NH2 2.82Å
43	V	87.3	Confident	86.8	Confident	78 Å²	78	100.4 Å²	100.4	47%	0.473	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-47.2	176.4	172.2	0	0	0	0	109.9	K39 K40 A45 R46 L47	K39-V43 WeakPolarHBondContact O-CG2 3.49Å; K39-V43 PolarHBondContact O-N 3.06Å; K40-V43 PolarHBondContact O-N 3.24Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 2.84Å; V43-R46 PolarHBondContact O-N 3.21Å; V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 WeakPolarHBondContact O-CB 3.27Å; V43-L47 PolarHBondContact O-N 3.5Å
44	E	88	Confident	87.1	Confident	93 Å²	93	98.6 Å²	98.6	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-59.3	-41	175.8	-76.2	178.4	176.7	0	0	112.3	K40 L47 K48	K40-E44 WeakPolarHBondContact CE-OE1 3.5Å; K40-E44 HydrophobicContact CG-CG 4.38Å; K40-E44 IonicContact NZ-OE1 3.02Å; K40-E44 WeakPolarHBondContact O-CB 3.47Å; K40-E44 WeakPolarHBondContact O-CG 3.34Å; K40-E44 PolarHBondContact O-N 3.49Å; E44-L47 PolarHBondContact O-N 3.3Å; E44-K48 WeakPolarHBondContact O-CB 3.43Å; E44-K48 WeakPolarHBondContact O-CG 3.49Å; E44-K48 PolarHBondContact O-N 3.5Å
45	A	87.4	Confident	87.3	Confident	58 Å²	58	96.7 Å²	96.7	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-43.6	175.6	0	0	0	0	0	111.9	A41 S42 V43 K48 A49	A41-A45 VanDerWaalsContact O-CB 3.27Å; A41-A45 WeakPolarHBondContact O-CB 3.3Å; A41-A45 PolarHBondContact O-N 3.24Å; S42-A45 PolarHBondContact O-N 2.73Å; V43-A45 VanDerWaalsContact C-N 3.33Å; V43-A45 PolarHBondContact O-N 2.84Å; A45-K48 PolarHBondContact O-N 3.23Å; A45-A49 WeakPolarHBondContact O-CB 3.24Å; A45-A49 PolarHBondContact O-N 3.23Å
46	R	87.3	Confident	87.6	Confident	173 Å²	173	93 Å²	93	65%	0.653	49%	0.491	S	S	*	.	H	α-helix	trans	-64.6	-40.9	174.6	-73.2	-175.3	-136.4	161.8	5.5	112	S42 V43 A49 A50	S42-R46 WeakPolarHBondContact O-CG 3.29Å; S42-R46 PolarHBondContact O-N 3.06Å; S42-R46 PolarHBondContact OG-NH2 2.82Å; V43-R46 PolarHBondContact O-N 3.21Å; R46-A49 PolarHBondContact O-N 3.43Å; R46-A50 VanDerWaalsContact O-CB 3.28Å; R46-A50 WeakPolarHBondContact O-CB 3.33Å; R46-A50 PolarHBondContact O-N 2.87Å
47	L	87.8	Confident	87.9	Confident	98 Å²	98	91.6 Å²	91.6	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-66.1	-42.8	178.9	-125.4	147.7	0	0	0	110.8	V43 E44 A50 I51	V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 WeakPolarHBondContact O-CB 3.27Å; V43-L47 PolarHBondContact O-N 3.5Å; E44-L47 PolarHBondContact O-N 3.3Å; L47-A50 PolarHBondContact O-N 3.4Å; L47-I51 HydrophobicContact CD2-CD1 3.57Å; L47-I51 HydrophobicContact CD2-CG1 4.16Å; L47-I51 WeakPolarHBondContact O-CB 3.3Å; L47-I51 VanDerWaalsContact O-CG1 3.25Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.87Å
48	K	88.8	Confident	88	Confident	149 Å²	149	92.9 Å²	92.9	65%	0.648	50%	0.498	S	S	*	.	H	α-helix	trans	-61.1	-45.9	172.6	-78.2	-180	178.9	-179.7	0	111.9	E44 A45 I51 Q52	E44-K48 WeakPolarHBondContact O-CB 3.43Å; E44-K48 WeakPolarHBondContact O-CG 3.49Å; E44-K48 PolarHBondContact O-N 3.5Å; A45-K48 PolarHBondContact O-N 3.23Å; K48-I51 PolarHBondContact O-N 3.26Å; K48-Q52 WeakPolarHBondContact O-CB 3.34Å; K48-Q52 PolarHBondContact O-N 2.86Å
49	A	88.1	Confident	88.3	Confident	63 Å²	63	92.9 Å²	92.9	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-41.1	177.1	0	0	0	0	0	112.1	A45 R46 Q52 S53	A45-A49 WeakPolarHBondContact O-CB 3.24Å; A45-A49 PolarHBondContact O-N 3.23Å; R46-A49 PolarHBondContact O-N 3.43Å; A49-Q52 PolarHBondContact O-N 2.99Å; A49-S53 WeakPolarHBondContact O-CB 3.36Å; A49-S53 PolarHBondContact O-N 3.07Å
50	A	87.4	Confident	88.5	Confident	54 Å²	54	93.4 Å²	93.4	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-67	-45.1	177.1	0	0	0	0	0	112.1	R46 L47 Q52 S53 Q54	R46-A50 VanDerWaalsContact O-CB 3.28Å; R46-A50 WeakPolarHBondContact O-CB 3.33Å; R46-A50 PolarHBondContact O-N 2.87Å; L47-A50 PolarHBondContact O-N 3.4Å; A50-Q52 VanDerWaalsContact C-N 3.35Å; A50-S53 PolarHBondContact O-N 3.45Å; A50-Q54 WeakPolarHBondContact O-CB 3.36Å; A50-Q54 WeakPolarHBondContact O-CG 3.4Å; A50-Q54 PolarHBondContact O-N 2.78Å
51	I	88.5	Confident	88.6	Confident	89 Å²	89	88.4 Å²	88.4	46%	0.456	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-43.8	175.7	-72.4	169.7	0	0	0	110.3	L47 K48 Q54 L55	L47-I51 HydrophobicContact CD2-CD1 3.57Å; L47-I51 HydrophobicContact CD2-CG1 4.16Å; L47-I51 WeakPolarHBondContact O-CB 3.3Å; L47-I51 VanDerWaalsContact O-CG1 3.25Å; L47-I51 WeakPolarHBondContact O-CG1 3.45Å; L47-I51 PolarHBondContact O-N 2.87Å; K48-I51 PolarHBondContact O-N 3.26Å; I51-Q54 PolarHBondContact O-N 2.84Å; I51-L55 HydrophobicContact CG2-CD1 3.73Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 WeakPolarHBondContact O-CB 3.43Å; I51-L55 WeakPolarHBondContact O-CG 3.19Å; I51-L55 PolarHBondContact O-N 3.36Å
52	Q	89.3	Confident	88.8	Confident	100 Å²	100	91.4 Å²	91.4	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-45.8	177.1	-173.6	61.1	37.6	0	0	111	K48 A49 A50 Q54 L55 D56	K48-Q52 WeakPolarHBondContact O-CB 3.34Å; K48-Q52 PolarHBondContact O-N 2.86Å; A49-Q52 PolarHBondContact O-N 2.99Å; A50-Q52 VanDerWaalsContact C-N 3.35Å; Q52-Q54 VanDerWaalsContact C-N 3.32Å; Q52-Q54 PolarHBondContact O-N 2.9Å; Q52-L55 PolarHBondContact O-N 3.48Å; Q52-D56 PolarHBondContact NE2-OD1 2.76Å; Q52-D56 VanDerWaalsContact NE2-OD1 3.12Å; Q52-D56 PolarHBondContact NE2-OD2 3.03Å; Q52-D56 WeakPolarHBondContact O-CB 3.38Å; Q52-D56 VanDerWaalsContact O-CG 3.29Å; Q52-D56 PolarHBondContact O-N 3.4Å
53	S	88.8	Confident	89	Confident	78 Å²	78	92.1 Å²	92.1	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-38.7	176	-179.4	0	0	0	0	112.7	A49 A50 G57	A49-S53 WeakPolarHBondContact O-CB 3.36Å; A49-S53 PolarHBondContact O-N 3.07Å; A50-S53 PolarHBondContact O-N 3.45Å; S53-G57 PolarHBondContact O-N 2.79Å
54	Q	88.5	Confident	89.2	Confident	137 Å²	137	94.6 Å²	94.6	64%	0.64	51%	0.513	S	S	*	.	H	α-helix	trans	-69.7	-42.6	176.3	-72.7	-66.4	-24.2	0	0	111.4	A50 I51 Q52 G57 V58	A50-Q54 WeakPolarHBondContact O-CB 3.36Å; A50-Q54 WeakPolarHBondContact O-CG 3.4Å; A50-Q54 PolarHBondContact O-N 2.78Å; I51-Q54 PolarHBondContact O-N 2.84Å; Q52-Q54 VanDerWaalsContact C-N 3.32Å; Q52-Q54 PolarHBondContact O-N 2.9Å; Q54-G57 PolarHBondContact O-N 2.94Å; Q54-V58 WeakPolarHBondContact O-CB 3.29Å; Q54-V58 VanDerWaalsContact O-CG2 3.3Å; Q54-V58 WeakPolarHBondContact O-CG2 3.32Å; Q54-V58 PolarHBondContact O-N 3.44Å
55	L	90.4	Very high	89.3	Confident	99 Å²	99	96.2 Å²	96.2	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-42.9	175	-83.2	165	0	0	0	112	I51 Q52 G57 V58 R59	I51-L55 HydrophobicContact CG2-CD1 3.73Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 WeakPolarHBondContact O-CB 3.43Å; I51-L55 WeakPolarHBondContact O-CG 3.19Å; I51-L55 PolarHBondContact O-N 3.36Å; Q52-L55 PolarHBondContact O-N 3.48Å; L55-G57 VanDerWaalsContact C-N 3.33Å; L55-V58 PolarHBondContact O-N 3.49Å; L55-R59 WeakPolarHBondContact O-CB 3.35Å; L55-R59 PolarHBondContact O-N 2.77Å
56	D	89.7	Confident	89.6	Confident	65 Å²	65	98.6 Å²	98.6	35%	0.348	53%	0.525	S	S	.	.	H	α-helix	trans	-67.5	-36.1	176.5	-71.4	-28.7	0	0	0	111.3	Q52 T60	Q52-D56 PolarHBondContact NE2-OD1 2.76Å; Q52-D56 VanDerWaalsContact NE2-OD1 3.12Å; Q52-D56 PolarHBondContact NE2-OD2 3.03Å; Q52-D56 WeakPolarHBondContact O-CB 3.38Å; Q52-D56 VanDerWaalsContact O-CG 3.29Å; Q52-D56 PolarHBondContact O-N 3.4Å; D56-T60 VanDerWaalsContact O-CB 3.26Å; D56-T60 WeakPolarHBondContact O-CB 3.46Å; D56-T60 PolarHBondContact O-N 2.95Å; D56-T60 PolarHBondContact O-OG1 3.41Å
57	G	89.6	Confident	89.8	Confident	44 Å²	44	94.3 Å²	94.3	45%	0.454	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-48.4	171	0	0	0	0	0	112.5	S53 Q54 L55 T60 G61	S53-G57 PolarHBondContact O-N 2.79Å; Q54-G57 PolarHBondContact O-N 2.94Å; L55-G57 VanDerWaalsContact C-N 3.33Å; G57-T60 PolarHBondContact O-N 3.49Å; G57-G61 PolarHBondContact O-N 3.11Å
58	V	89.2	Confident	89.9	Confident	83 Å²	83	92 Å²	92	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-42.3	177.5	170.4	0	0	0	0	111.3	Q54 L55 G61 L62	Q54-V58 WeakPolarHBondContact O-CB 3.29Å; Q54-V58 VanDerWaalsContact O-CG2 3.3Å; Q54-V58 WeakPolarHBondContact O-CG2 3.32Å; Q54-V58 PolarHBondContact O-N 3.44Å; L55-V58 PolarHBondContact O-N 3.49Å; V58-G61 PolarHBondContact O-N 3.02Å; V58-L62 HydrophobicContact CG1-CD1 3.94Å; V58-L62 WeakPolarHBondContact O-CB 3.14Å; V58-L62 PolarHBondContact O-N 3.32Å
59	R	91	Very high	90.1	Very high	187 Å²	187	89 Å²	89	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-46.3	177.5	177	-179	155.5	-178.4	-5.6	111.3	L55 G61 L62 S63	L55-R59 WeakPolarHBondContact O-CB 3.35Å; L55-R59 PolarHBondContact O-N 2.77Å; R59-G61 VanDerWaalsContact C-N 3.34Å; R59-L62 PolarHBondContact O-N 3.11Å; R59-S63 WeakPolarHBondContact O-CB 3.23Å; R59-S63 PolarHBondContact O-N 3.31Å
60	T	89.7	Confident	90.3	Very high	76 Å²	76	88.6 Å²	88.6	47%	0.466	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-44.6	175.2	-57.1	0	0	0	0	110.5	D56 G57 S63 Q64	D56-T60 VanDerWaalsContact O-CB 3.26Å; D56-T60 WeakPolarHBondContact O-CB 3.46Å; D56-T60 PolarHBondContact O-N 2.95Å; D56-T60 PolarHBondContact O-OG1 3.41Å; G57-T60 PolarHBondContact O-N 3.49Å; T60-S63 PolarHBondContact O-N 2.9Å; T60-Q64 HydrophobicContact CG2-CG 4.42Å; T60-Q64 WeakPolarHBondContact O-CB 3.44Å; T60-Q64 WeakPolarHBondContact O-CG 3.41Å; T60-Q64 PolarHBondContact O-N 3.37Å
61	G	89.8	Confident	90.4	Very high	31 Å²	31	90.4 Å²	90.4	32%	0.32	49%	0.492	S	S	.	.	H	α-helix	trans	-59.8	-46.7	176.6	0	0	0	0	0	112.8	G57 V58 R59 S63 Q64 L65	G57-G61 PolarHBondContact O-N 3.11Å; V58-G61 PolarHBondContact O-N 3.02Å; R59-G61 VanDerWaalsContact C-N 3.34Å; G61-S63 PolarHBondContact O-N 2.8Å; G61-Q64 PolarHBondContact O-N 3.42Å; G61-L65 VanDerWaalsContact O-CB 3.31Å; G61-L65 WeakPolarHBondContact O-CB 3.48Å; G61-L65 PolarHBondContact O-N 3.37Å
62	L	91.3	Very high	90.5	Very high	116 Å²	116	90.4 Å²	90.4	61%	0.607	50%	0.496	S	S	*	.	H	α-helix	trans	-62.7	-41.8	175.2	-83.6	165.3	0	0	0	112.2	V58 R59 L65 H66	V58-L62 HydrophobicContact CG1-CD1 3.94Å; V58-L62 WeakPolarHBondContact O-CB 3.14Å; V58-L62 PolarHBondContact O-N 3.32Å; R59-L62 PolarHBondContact O-N 3.11Å; L62-L65 PolarHBondContact O-N 3.49Å; L62-H66 VanDerWaalsContact O-CB 3.3Å; L62-H66 WeakPolarHBondContact O-CB 3.45Å; L62-H66 PolarHBondContact O-N 2.8Å
63	S	92.2	Very high	90.6	Very high	63 Å²	63	91.2 Å²	91.2	44%	0.441	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-42.9	176.6	-170.7	0	0	0	0	111.6	R59 T60 G61 H66 N67	R59-S63 WeakPolarHBondContact O-CB 3.23Å; R59-S63 PolarHBondContact O-N 3.31Å; T60-S63 PolarHBondContact O-N 2.9Å; G61-S63 PolarHBondContact O-N 2.8Å; S63-H66 PolarHBondContact O-N 2.84Å; S63-N67 WeakPolarHBondContact O-CB 3.35Å; S63-N67 PolarHBondContact O-N 3.09Å; S63-N67 PolarHBondContact O-ND2 3.43Å; S63-N67 PolarHBondContact O-OD1 3.46Å
64	Q	90.7	Very high	90.8	Very high	131 Å²	131	92.4 Å²	92.4	61%	0.612	50%	0.498	S	S	*	.	H	α-helix	trans	-64.9	-40.7	176.4	-74.7	177	-9.6	0	0	111.5	T60 G61 N67 A68	T60-Q64 HydrophobicContact CG2-CG 4.42Å; T60-Q64 WeakPolarHBondContact O-CB 3.44Å; T60-Q64 WeakPolarHBondContact O-CG 3.41Å; T60-Q64 PolarHBondContact O-N 3.37Å; G61-Q64 PolarHBondContact O-N 3.42Å; Q64-N67 PolarHBondContact O-N 3.38Å; Q64-A68 WeakPolarHBondContact O-CB 3.46Å; Q64-A68 PolarHBondContact O-N 3.15Å
65	L	90.6	Very high	90.8	Very high	126 Å²	126	90.9 Å²	90.9	66%	0.66	49%	0.493	S	S	*	.	H	α-helix	trans	-69.4	-37.1	179.5	-150.1	147.8	0	0	0	111.4	G61 L62 L69	G61-L65 VanDerWaalsContact O-CB 3.31Å; G61-L65 WeakPolarHBondContact O-CB 3.48Å; G61-L65 PolarHBondContact O-N 3.37Å; L62-L65 PolarHBondContact O-N 3.49Å; L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 PolarHBondContact O-N 3.48Å
66	H	92.4	Very high	90.7	Very high	109 Å²	109	92 Å²	92	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-65.4	-44.7	172.4	-172.6	75.2	0	0	0	111.9	L62 S63 L69 N70	L62-H66 VanDerWaalsContact O-CB 3.3Å; L62-H66 WeakPolarHBondContact O-CB 3.45Å; L62-H66 PolarHBondContact O-N 2.8Å; S63-H66 PolarHBondContact O-N 2.84Å; H66-L69 WeakPolarHBondContact O-CB 3.43Å; H66-L69 PolarHBondContact O-N 2.92Å; H66-N70 PolarHBondContact CD2-ND2 3.25Å; H66-N70 PolarHBondContact NE2-ND2 3.49Å; H66-N70 VanDerWaalsContact NE2-ND2 3.17Å; H66-N70 PolarHBondContact O-N 3.46Å; H66-N70 PolarHBondContact O-ND2 3.16Å
67	N	91.9	Very high	90.8	Very high	83 Å²	83	93.5 Å²	93.5	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-46.9	175.9	-69.4	-8.9	0	0	0	111.1	S63 Q64 L69 N70 D71	S63-N67 WeakPolarHBondContact O-CB 3.35Å; S63-N67 PolarHBondContact O-N 3.09Å; S63-N67 PolarHBondContact O-ND2 3.43Å; S63-N67 PolarHBondContact O-OD1 3.46Å; Q64-N67 PolarHBondContact O-N 3.38Å; N67-L69 VanDerWaalsContact C-N 3.28Å; N67-L69 PolarHBondContact O-N 3.26Å; N67-N70 PolarHBondContact O-N 3.27Å; N67-D71 VanDerWaalsContact O-CG 3.26Å; N67-D71 PolarHBondContact O-N 2.8Å
68	A	90	Very high	90.8	Very high	48 Å²	48	94.6 Å²	94.6	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-36.9	176.7	0	0	0	0	0	112.5	Q64 D71 V72	Q64-A68 WeakPolarHBondContact O-CB 3.46Å; Q64-A68 PolarHBondContact O-N 3.15Å; A68-D71 PolarHBondContact O-N 3.36Å; A68-V72 WeakPolarHBondContact O-CB 3.27Å; A68-V72 WeakPolarHBondContact O-CG2 3.41Å; A68-V72 PolarHBondContact O-N 2.91Å
69	L	92.6	Very high	90.6	Very high	87 Å²	87	96.3 Å²	96.3	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-42.2	174.1	-171.6	98.5	0	0	0	111.6	L65 H66 N67 K73	L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 PolarHBondContact O-N 3.48Å; H66-L69 WeakPolarHBondContact O-CB 3.43Å; H66-L69 PolarHBondContact O-N 2.92Å; N67-L69 VanDerWaalsContact C-N 3.28Å; N67-L69 PolarHBondContact O-N 3.26Å; L69-K73 WeakPolarHBondContact O-CG 3.38Å; L69-K73 PolarHBondContact O-N 3.43Å; L69-K73 VanDerWaalsContact O-N 3.09Å
70	N	92.1	Very high	90.5	Very high	54 Å²	54	91.5 Å²	91.5	29%	0.289	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-45.1	177	-67.2	-23.4	0	0	0	110.8	H66 N67 V72 K73 D74	H66-N70 PolarHBondContact CD2-ND2 3.25Å; H66-N70 PolarHBondContact NE2-ND2 3.49Å; H66-N70 VanDerWaalsContact NE2-ND2 3.17Å; H66-N70 PolarHBondContact O-N 3.46Å; H66-N70 PolarHBondContact O-ND2 3.16Å; N67-N70 PolarHBondContact O-N 3.27Å; N70-V72 VanDerWaalsContact C-N 3.28Å; N70-V72 PolarHBondContact O-N 3.48Å; N70-K73 WeakPolarHBondContact O-CB 3.48Å; N70-K73 PolarHBondContact O-N 3.21Å; N70-D74 PolarHBondContact O-N 3.46Å
71	D	91.2	Very high	90.5	Very high	92 Å²	92	91.2 Å²	91.2	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-57.5	-41.9	175.5	-65.1	-19.7	0	0	0	111.3	N67 A68 K73 D74 I75	N67-D71 VanDerWaalsContact O-CG 3.26Å; N67-D71 PolarHBondContact O-N 2.8Å; A68-D71 PolarHBondContact O-N 3.36Å; D71-K73 PolarHBondContact O-N 3.31Å; D71-D74 PolarHBondContact O-N 3.09Å; D71-I75 WeakPolarHBondContact O-CB 3.39Å; D71-I75 WeakPolarHBondContact O-CG1 3.5Å; D71-I75 PolarHBondContact O-N 3.1Å
72	V	89.9	Confident	90.2	Very high	90 Å²	90	94.2 Å²	94.2	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-40	176.1	167.9	0	0	0	0	111.6	A68 N70 Q76	A68-V72 WeakPolarHBondContact O-CB 3.27Å; A68-V72 WeakPolarHBondContact O-CG2 3.41Å; A68-V72 PolarHBondContact O-N 2.91Å; N70-V72 VanDerWaalsContact C-N 3.28Å; N70-V72 PolarHBondContact O-N 3.48Å; V72-Q76 VanDerWaalsContact O-CB 3.3Å; V72-Q76 WeakPolarHBondContact O-CB 3.48Å; V72-Q76 PolarHBondContact O-N 3.06Å
73	K	91.6	Very high	89.8	Confident	116 Å²	116	92.4 Å²	92.4	50%	0.504	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-41.8	175.2	-74.7	175.7	-180	175.9	0	111.6	L69 N70 D71 Q76 Q77	L69-K73 WeakPolarHBondContact O-CG 3.38Å; L69-K73 PolarHBondContact O-N 3.43Å; L69-K73 VanDerWaalsContact O-N 3.09Å; N70-K73 WeakPolarHBondContact O-CB 3.48Å; N70-K73 PolarHBondContact O-N 3.21Å; D71-K73 PolarHBondContact O-N 3.31Å; K73-Q76 PolarHBondContact O-N 3.4Å; K73-Q77 WeakPolarHBondContact O-CB 3.3Å; K73-Q77 PolarHBondContact O-N 2.94Å
74	D	91.9	Very high	89.5	Confident	104 Å²	104	95.3 Å²	95.3	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-66.7	-41	178.2	-70.3	-13.1	0	0	0	111.4	N70 D71 Q76 Q77 S78	N70-D74 PolarHBondContact O-N 3.46Å; D71-D74 PolarHBondContact O-N 3.09Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; D74-Q77 PolarHBondContact O-N 3.35Å; D74-S78 WeakPolarHBondContact O-CB 3.29Å; D74-S78 PolarHBondContact O-N 3.47Å; D74-S78 PolarHBondContact O-OG 3.19Å
75	I	88.6	Confident	89.1	Confident	105 Å²	105	93.3 Å²	93.3	54%	0.538	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-44.1	172.1	-70	165.4	0	0	0	110.1	D71 Q77 S78 L79	D71-I75 WeakPolarHBondContact O-CB 3.39Å; D71-I75 WeakPolarHBondContact O-CG1 3.5Å; D71-I75 PolarHBondContact O-N 3.1Å; I75-Q77 VanDerWaalsContact C-N 3.34Å; I75-Q77 PolarHBondContact O-N 3.49Å; I75-S78 PolarHBondContact O-N 3.25Å; I75-L79 WeakPolarHBondContact O-CB 3.36Å; I75-L79 PolarHBondContact O-N 3.21Å
76	Q	89.5	Confident	88.4	Confident	122 Å²	122	95 Å²	95	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-62.4	-42.9	179.2	-173.2	177.6	1.4	0	0	111.4	V72 K73 D74 L79 I80	V72-Q76 VanDerWaalsContact O-CB 3.3Å; V72-Q76 WeakPolarHBondContact O-CB 3.48Å; V72-Q76 PolarHBondContact O-N 3.06Å; K73-Q76 PolarHBondContact O-N 3.4Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; Q76-L79 PolarHBondContact O-N 2.98Å; Q76-I80 HydrophobicContact CG-CD1 4.42Å; Q76-I80 VanDerWaalsContact O-CG1 3.31Å; Q76-I80 WeakPolarHBondContact O-CG1 3.46Å; Q76-I80 PolarHBondContact O-N 3.42Å
77	Q	91.1	Very high	87.7	Confident	97 Å²	97	97.7 Å²	97.7	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-45.5	175.8	-171.3	57.6	46.9	0	0	111.2	K73 D74 I75 L79 I80 D81	K73-Q77 WeakPolarHBondContact O-CB 3.3Å; K73-Q77 PolarHBondContact O-N 2.94Å; D74-Q77 PolarHBondContact O-N 3.35Å; I75-Q77 VanDerWaalsContact C-N 3.34Å; I75-Q77 PolarHBondContact O-N 3.49Å; Q77-L79 PolarHBondContact O-N 3.43Å; Q77-I80 WeakPolarHBondContact O-CB 3.44Å; Q77-I80 PolarHBondContact O-N 3.14Å; Q77-I80 VanDerWaalsContact O-N 3.08Å; Q77-D81 PolarHBondContact NE2-OD1 3.37Å; Q77-D81 PolarHBondContact O-N 3.01Å
78	S	88.7	Confident	86.9	Confident	67 Å²	67	99.5 Å²	99.5	47%	0.469	50%	0.501	S	S	.	.	H	α-helix	trans	-58.7	-37.6	174.9	-58.6	0	0	0	0	111.8	D74 I75 D81 V82	D74-S78 WeakPolarHBondContact O-CB 3.29Å; D74-S78 PolarHBondContact O-N 3.47Å; D74-S78 PolarHBondContact O-OG 3.19Å; I75-S78 PolarHBondContact O-N 3.25Å; S78-D81 PolarHBondContact O-N 3.12Å; S78-V82 WeakPolarHBondContact O-CB 3.38Å; S78-V82 VanDerWaalsContact O-CG2 3.24Å; S78-V82 WeakPolarHBondContact O-CG2 3.4Å; S78-V82 PolarHBondContact O-N 2.69Å
79	L	86.3	Confident	85.8	Confident	119 Å²	119	99.7 Å²	99.7	62%	0.623	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-38	176.7	-136.7	97.4	0	0	0	112	I75 Q76 Q77 N83	I75-L79 WeakPolarHBondContact O-CB 3.36Å; I75-L79 PolarHBondContact O-N 3.21Å; Q76-L79 PolarHBondContact O-N 2.98Å; Q77-L79 PolarHBondContact O-N 3.43Å; L79-N83 VanDerWaalsContact O-CB 3.25Å; L79-N83 WeakPolarHBondContact O-CB 3.48Å; L79-N83 PolarHBondContact O-N 3.33Å
80	I	88.9	Confident	84.4	Confident	86 Å²	86	98.6 Å²	98.6	44%	0.441	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-44.7	174.5	-69.1	164.7	0	0	0	109.8	Q76 Q77 N83 K84	Q76-I80 HydrophobicContact CG-CD1 4.42Å; Q76-I80 VanDerWaalsContact O-CG1 3.31Å; Q76-I80 WeakPolarHBondContact O-CG1 3.46Å; Q76-I80 PolarHBondContact O-N 3.42Å; Q77-I80 WeakPolarHBondContact O-CB 3.44Å; Q77-I80 PolarHBondContact O-N 3.14Å; Q77-I80 VanDerWaalsContact O-N 3.08Å; I80-N83 PolarHBondContact O-N 2.98Å; I80-K84 WeakPolarHBondContact O-CB 3.43Å; I80-K84 PolarHBondContact O-N 3.37Å
81	D	88.4	Confident	83	Confident	70 Å²	70	101.4 Å²	101.4	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-46.2	178.9	-65.3	-23.4	0	0	0	110.9	Q77 S78 N83 K84 D85	Q77-D81 PolarHBondContact NE2-OD1 3.37Å; Q77-D81 PolarHBondContact O-N 3.01Å; S78-D81 PolarHBondContact O-N 3.12Å; D81-N83 VanDerWaalsContact C-N 3.33Å; D81-N83 PolarHBondContact O-N 3.48Å; D81-K84 WeakPolarHBondContact O-CB 3.36Å; D81-K84 PolarHBondContact O-N 3.38Å; D81-K84 VanDerWaalsContact O-N 3.11Å; D81-D85 WeakPolarHBondContact O-CB 3.49Å; D81-D85 PolarHBondContact O-N 2.88Å
82	V	85	Confident	81.7	Confident	94 Å²	94	100.7 Å²	100.7	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-58.8	-42.4	173.3	168.9	0	0	0	0	111.6	S78 K84 D85 W86	S78-V82 WeakPolarHBondContact O-CB 3.38Å; S78-V82 VanDerWaalsContact O-CG2 3.24Å; S78-V82 WeakPolarHBondContact O-CG2 3.4Å; S78-V82 PolarHBondContact O-N 2.69Å; V82-K84 VanDerWaalsContact C-N 3.32Å; V82-K84 PolarHBondContact O-N 3.45Å; V82-D85 PolarHBondContact O-N 3.03Å; V82-W86 WeakPolarHBondContact O-CB 3.47Å; V82-W86 PolarHBondContact O-N 3.11Å
83	N	82.7	Confident	80.3	Confident	77 Å²	77	101 Å²	101	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-36.2	177.4	-174.8	26.4	0	0	0	111.8	L79 I80 D81 R87	L79-N83 VanDerWaalsContact O-CB 3.25Å; L79-N83 WeakPolarHBondContact O-CB 3.48Å; L79-N83 PolarHBondContact O-N 3.33Å; I80-N83 PolarHBondContact O-N 2.98Å; D81-N83 VanDerWaalsContact C-N 3.33Å; D81-N83 PolarHBondContact O-N 3.48Å; N83-R87 WeakPolarHBondContact O-CB 3.47Å; N83-R87 VanDerWaalsContact O-CG 3.28Å; N83-R87 WeakPolarHBondContact O-CG 3.43Å; N83-R87 PolarHBondContact O-N 2.98Å
84	K	85.2	Confident	78.9	Confident	125 Å²	125	102.6 Å²	102.6	54%	0.543	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-46.6	174.3	-176.9	-175.7	174.1	-171.2	0	111.2	I80 D81 V82 W86 R87 Q88	I80-K84 WeakPolarHBondContact O-CB 3.43Å; I80-K84 PolarHBondContact O-N 3.37Å; D81-K84 WeakPolarHBondContact O-CB 3.36Å; D81-K84 PolarHBondContact O-N 3.38Å; D81-K84 VanDerWaalsContact O-N 3.11Å; V82-K84 VanDerWaalsContact C-N 3.32Å; V82-K84 PolarHBondContact O-N 3.45Å; K84-W86 VanDerWaalsContact C-N 3.32Å; K84-W86 PolarHBondContact O-N 3Å; K84-R87 PolarHBondContact O-N 2.7Å; K84-Q88 PolarHBondContact O-N 2.8Å
85	D	82.8	Confident	77.6	Confident	89 Å²	89	104 Å²	104	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-38.8	176.3	-71.3	-9.4	0	0	0	111.3	D81 V82 Q88 S89	D81-D85 WeakPolarHBondContact O-CB 3.49Å; D81-D85 PolarHBondContact O-N 2.88Å; V82-D85 PolarHBondContact O-N 3.03Å; D85-Q88 PolarHBondContact O-N 3.4Å; D85-S89 VanDerWaalsContact O-CB 3.26Å; D85-S89 WeakPolarHBondContact O-CB 3.31Å; D85-S89 PolarHBondContact O-N 2.79Å; D85-S89 PolarHBondContact O-OG 3.38Å
86	W	76.4	Confident	76.5	Confident	161 Å²	161	103.2 Å²	103.2	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-65.5	-42.9	175.5	-164.1	74.9	0	0	0	111.5	V82 K84 S89 I90	V82-W86 WeakPolarHBondContact O-CB 3.47Å; V82-W86 PolarHBondContact O-N 3.11Å; K84-W86 VanDerWaalsContact C-N 3.32Å; K84-W86 PolarHBondContact O-N 3Å; W86-S89 CarbonylContact O-C 3.54Å; W86-S89 WeakPolarHBondContact O-CB 3.24Å; W86-S89 PolarHBondContact O-N 3.04Å; W86-S89 VanDerWaalsContact O-N 3.17Å; W86-I90 HydrophobicContact CD2-CD1 4.22Å; W86-I90 HydrophobicContact CE3-CD1 3.66Å; W86-I90 HydrophobicContact CE3-CG1 4.5Å; W86-I90 HydrophobicContact CH2-CD1 3.93Å; W86-I90 HydrophobicContact CZ2-CD1 4.45Å; W86-I90 HydrophobicContact CZ3-CD1 3.52Å; W86-I90 WeakPolarHBondContact O-CG1 3.27Å; W86-I90 PolarHBondContact O-N 2.86Å
87	R	76.4	Confident	75.6	Confident	165 Å²	165	103.9 Å²	103.9	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-39.5	173.6	-75.2	177.2	-178.7	-146	-1.4	112.8	N83 K84 S89 I90	N83-R87 WeakPolarHBondContact O-CB 3.47Å; N83-R87 VanDerWaalsContact O-CG 3.28Å; N83-R87 WeakPolarHBondContact O-CG 3.43Å; N83-R87 PolarHBondContact O-N 2.98Å; K84-R87 PolarHBondContact O-N 2.7Å; R87-S89 VanDerWaalsContact C-N 3.32Å; R87-I90 PolarHBondContact O-N 3.5Å
88	Q	75.9	Confident	74.7	Confident	122 Å²	122	105.5 Å²	105.5	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-66	-37.2	172	-78.4	-174.3	-19.3	0	0	111.7	K84 D85 I90 N91 T92	K84-Q88 PolarHBondContact O-N 2.8Å; D85-Q88 PolarHBondContact O-N 3.4Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 3.35Å; Q88-N91 PolarHBondContact O-N 2.96Å; Q88-T92 PolarHBondContact O-OG1 3.11Å
89	S	65.8	Low	74	Confident	52 Å²	52	106.2 Å²	106.2	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-67.5	-29.6	177.6	-62	0	0	0	0	112.9	D85 W86 R87 N91 T92 I93	D85-S89 VanDerWaalsContact O-CB 3.26Å; D85-S89 WeakPolarHBondContact O-CB 3.31Å; D85-S89 PolarHBondContact O-N 2.79Å; D85-S89 PolarHBondContact O-OG 3.38Å; W86-S89 CarbonylContact O-C 3.54Å; W86-S89 WeakPolarHBondContact O-CB 3.24Å; W86-S89 PolarHBondContact O-N 3.04Å; W86-S89 VanDerWaalsContact O-N 3.17Å; R87-S89 VanDerWaalsContact C-N 3.32Å; S89-N91 VanDerWaalsContact C-N 3.3Å; S89-N91 PolarHBondContact O-N 2.95Å; S89-T92 VanDerWaalsContact CA-OG1 3.26Å; S89-T92 WeakPolarHBondContact CA-OG1 3.44Å; S89-T92 CarbonylContact O-C 3.59Å; S89-T92 PolarHBondContact O-N 3.23Å; S89-T92 VanDerWaalsContact O-N 3.13Å; S89-T92 PolarHBondContact O-OG1 3.38Å; S89-I93 WeakPolarHBondContact O-CG1 3.5Å; S89-I93 PolarHBondContact O-N 2.91Å
90	I	64.1	Low	73.3	Confident	64 Å²	64	107.4 Å²	107.4	33%	0.328	53%	0.532	S	S	.	.	H	α-helix	trans	-59.6	-41	173.7	-73.8	168.1	0	0	0	111.3	W86 R87 Q88 T92 I93 E94	W86-I90 HydrophobicContact CD2-CD1 4.22Å; W86-I90 HydrophobicContact CE3-CD1 3.66Å; W86-I90 HydrophobicContact CE3-CG1 4.5Å; W86-I90 HydrophobicContact CH2-CD1 3.93Å; W86-I90 HydrophobicContact CZ2-CD1 4.45Å; W86-I90 HydrophobicContact CZ3-CD1 3.52Å; W86-I90 WeakPolarHBondContact O-CG1 3.27Å; W86-I90 PolarHBondContact O-N 2.86Å; R87-I90 PolarHBondContact O-N 3.5Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 3.35Å; I90-T92 VanDerWaalsContact C-N 3.28Å; I90-T92 PolarHBondContact O-N 3.22Å; I90-I93 PolarHBondContact O-N 2.99Å; I90-E94 PolarHBondContact O-N 3.45Å
91	N	63.6	Low	72.6	Confident	113 Å²	113	106.7 Å²	106.7	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-66.5	-28.3	176.4	-80	-3.1	0	0	0	112.7	Q88 S89	Q88-N91 PolarHBondContact O-N 2.96Å; S89-N91 VanDerWaalsContact C-N 3.3Å; S89-N91 PolarHBondContact O-N 2.95Å
92	T	62.2	Low	72.1	Confident	77 Å²	77	105.9 Å²	105.9	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-82.2	-26.6	171.8	24.5	0	0	0	0	113.2	Q88 S89 I90 E94 N95 L96	Q88-T92 PolarHBondContact O-OG1 3.11Å; S89-T92 VanDerWaalsContact CA-OG1 3.26Å; S89-T92 WeakPolarHBondContact CA-OG1 3.44Å; S89-T92 CarbonylContact O-C 3.59Å; S89-T92 PolarHBondContact O-N 3.23Å; S89-T92 VanDerWaalsContact O-N 3.13Å; S89-T92 PolarHBondContact O-OG1 3.38Å; I90-T92 VanDerWaalsContact C-N 3.28Å; I90-T92 PolarHBondContact O-N 3.22Å; T92-E94 VanDerWaalsContact C-N 3.33Å; T92-N95 WeakPolarHBondContact O-CB 3.34Å; T92-N95 PolarHBondContact O-N 2.94Å; T92-L96 PolarHBondContact O-N 3.5Å
93	I	61	Low	71.8	Confident	97 Å²	97	105.8 Å²	105.8	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-66.4	-33.8	175.2	-72.4	162.6	0	0	0	111.4	S89 I90 N95 L96	S89-I93 WeakPolarHBondContact O-CG1 3.5Å; S89-I93 PolarHBondContact O-N 2.91Å; I90-I93 PolarHBondContact O-N 2.99Å; I93-N95 VanDerWaalsContact C-N 3.25Å; I93-N95 PolarHBondContact O-N 3.29Å; I93-L96 PolarHBondContact O-N 3.19Å
94	E	62.3	Low	71.4	Confident	149 Å²	149	104.1 Å²	104.1	70%	0.696	52%	0.524	S	S	*	.	H	α-helix	trans	-60.6	-35.9	171.6	-76.8	-170.8	155	0	0	112.3	I90 T92 L96	I90-E94 PolarHBondContact O-N 3.45Å; T92-E94 VanDerWaalsContact C-N 3.33Å; E94-L96 VanDerWaalsContact C-N 3.26Å; E94-L96 PolarHBondContact O-N 3.48Å
95	N	65.4	Low	70.9	Confident	132 Å²	132	103.9 Å²	103.9	71%	0.706	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.2	175.8	-63.2	-31.4	0	0	0	113.6	T92 I93	T92-N95 WeakPolarHBondContact O-CB 3.34Å; T92-N95 PolarHBondContact O-N 2.94Å; I93-N95 VanDerWaalsContact C-N 3.25Å; I93-N95 PolarHBondContact O-N 3.29Å
96	L	66.1	Low	70.8	Confident	89 Å²	89	106.1 Å²	106.1	47%	0.466	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	12.9	179.2	-72	169.1	0	0	0	113.1	T92 I93 E94 D98 V99 K100	T92-L96 PolarHBondContact O-N 3.5Å; I93-L96 PolarHBondContact O-N 3.19Å; E94-L96 VanDerWaalsContact C-N 3.26Å; E94-L96 PolarHBondContact O-N 3.48Å; L96-D98 VanDerWaalsContact C-N 3.27Å; L96-D98 PolarHBondContact O-N 3.2Å; L96-V99 HydrophobicContact CD2-CB 4.22Å; L96-V99 HydrophobicContact CD2-CG2 3.85Å; L96-V99 PolarHBondContact O-N 2.95Å; L96-V99 VanDerWaalsContact O-N 3.08Å; L96-K100 PolarHBondContact O-N 2.93Å
97	K	69.9	Low	70.7	Confident	137 Å²	137	100.4 Å²	100.4	60%	0.596	52%	0.516	S	S	*	.	H	α-helix	trans	-54	-43.6	178.8	-170.4	178.1	177.4	-175.5	0	112.2	V99 K100 D101	K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 3.37Å; K97-K100 WeakPolarHBondContact O-CB 3.33Å; K97-K100 PolarHBondContact O-N 3.27Å; K97-D101 VanDerWaalsContact O-CG 3.31Å; K97-D101 PolarHBondContact O-N 3.44Å
98	D	72.7	Confident	70.3	Confident	130 Å²	130	96.1 Å²	96.1	70%	0.695	50%	0.504	S	S	*	.	H	α-helix	trans	-64.2	-36	178.8	-60.1	-25.2	0	0	0	112.4	L96 A102	L96-D98 VanDerWaalsContact C-N 3.27Å; L96-D98 PolarHBondContact O-N 3.2Å; D98-A102 WeakPolarHBondContact O-CB 3.4Å; D98-A102 PolarHBondContact O-N 3.05Å
99	V	73.8	Confident	70.2	Confident	82 Å²	82	95.8 Å²	95.8	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-70.4	-40.3	175.6	179.8	0	0	0	0	110.6	L96 K97 A102 V103	L96-V99 HydrophobicContact CD2-CB 4.22Å; L96-V99 HydrophobicContact CD2-CG2 3.85Å; L96-V99 PolarHBondContact O-N 2.95Å; L96-V99 VanDerWaalsContact O-N 3.08Å; K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 3.37Å; V99-A102 PolarHBondContact O-N 3.13Å; V99-V103 HydrophobicContact CG1-CG2 4.36Å; V99-V103 WeakPolarHBondContact O-CB 3.35Å; V99-V103 VanDerWaalsContact O-CG2 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.37Å; V99-V103 PolarHBondContact O-N 3.2Å
100	K	70.5	Confident	70.7	Confident	145 Å²	145	95.3 Å²	95.3	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-61.6	-45.2	174.6	-177.8	-175	173.8	-174.2	0	111	L96 K97 A102 V103 V104	L96-K100 PolarHBondContact O-N 2.93Å; K97-K100 WeakPolarHBondContact O-CB 3.33Å; K97-K100 PolarHBondContact O-N 3.27Å; K100-A102 VanDerWaalsContact C-N 3.35Å; K100-V103 PolarHBondContact O-N 2.98Å; K100-V104 WeakPolarHBondContact O-CB 3.3Å; K100-V104 VanDerWaalsContact O-CG2 3.27Å; K100-V104 WeakPolarHBondContact O-CG2 3.43Å; K100-V104 PolarHBondContact O-N 3.13Å
101	D	75.3	Confident	70.8	Confident	71 Å²	71	93.1 Å²	93.1	38%	0.38	50%	0.496	S	S	.	.	H	α-helix	trans	-65.2	-39.2	178.8	-68.6	-14.1	0	0	0	111	K97 V104 Q105	K97-D101 VanDerWaalsContact O-CG 3.31Å; K97-D101 PolarHBondContact O-N 3.44Å; D101-V104 WeakPolarHBondContact O-CB 3.44Å; D101-V104 PolarHBondContact O-N 3.18Å; D101-Q105 WeakPolarHBondContact O-CG 3.4Å; D101-Q105 PolarHBondContact O-N 3.24Å
102	A	78.1	Confident	70.9	Confident	53 Å²	53	89.3 Å²	89.3	44%	0.438	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-41.1	173.4	0	0	0	0	0	113.1	D98 V99 K100 V104 Q105 H106	D98-A102 WeakPolarHBondContact O-CB 3.4Å; D98-A102 PolarHBondContact O-N 3.05Å; V99-A102 PolarHBondContact O-N 3.13Å; K100-A102 VanDerWaalsContact C-N 3.35Å; A102-V104 VanDerWaalsContact C-N 3.33Å; A102-Q105 PolarHBondContact O-N 3.46Å; A102-H106 VanDerWaalsContact O-CB 3.32Å; A102-H106 WeakPolarHBondContact O-CB 3.43Å; A102-H106 PolarHBondContact O-N 2.98Å
103	V	78.4	Confident	71.5	Confident	91 Å²	91	90.4 Å²	90.4	55%	0.552	49%	0.486	S	S	*	.	H	α-helix	trans	-66.4	-37.7	176	168.7	0	0	0	0	111	V99 K100 H106 S107	V99-V103 HydrophobicContact CG1-CG2 4.36Å; V99-V103 WeakPolarHBondContact O-CB 3.35Å; V99-V103 VanDerWaalsContact O-CG2 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.37Å; V99-V103 PolarHBondContact O-N 3.2Å; K100-V103 PolarHBondContact O-N 2.98Å; V103-H106 PolarHBondContact O-N 3.33Å; V103-S107 VanDerWaalsContact O-CB 3.24Å; V103-S107 WeakPolarHBondContact O-CB 3.35Å; V103-S107 PolarHBondContact O-N 2.88Å
104	V	74.3	Confident	71.8	Confident	42 Å²	42	93.4 Å²	93.4	26%	0.255	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-51.7	172.5	152.2	0	0	0	0	110.6	K100 D101 A102 H106 S107 Q108 M162	K100-V104 WeakPolarHBondContact O-CB 3.3Å; K100-V104 VanDerWaalsContact O-CG2 3.27Å; K100-V104 WeakPolarHBondContact O-CG2 3.43Å; K100-V104 PolarHBondContact O-N 3.13Å; D101-V104 WeakPolarHBondContact O-CB 3.44Å; D101-V104 PolarHBondContact O-N 3.18Å; A102-V104 VanDerWaalsContact C-N 3.33Å; V104-H106 VanDerWaalsContact C-N 3.34Å; V104-H106 PolarHBondContact O-N 2.99Å; V104-S107 PolarHBondContact O-N 3.44Å; V104-Q108 WeakPolarHBondContact O-CG 3.41Å; V104-Q108 PolarHBondContact O-N 3.33Å; V104-M162 HydrophobicContact CB-CE 4.06Å; V104-M162 HydrophobicContact CB-SD 4.29Å; V104-M162 HydrophobicContact CG1-CE 3.5Å; V104-M162 HydrophobicContact CG1-SD 3.23Å; V104-M162 WeakPolarHBondContact CG1-SD 3.21Å; V104-M162 HydrophobicContact CG2-CE 3.97Å; V104-M162 HydrophobicContact CG2-SD 4.3Å
105	Q	75.3	Confident	71.9	Confident	121 Å²	121	87 Å²	87	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-62.2	-41.6	177.3	-72.6	178.1	2.8	0	0	111.9	D101 A102 Q108 L109	D101-Q105 WeakPolarHBondContact O-CG 3.4Å; D101-Q105 PolarHBondContact O-N 3.24Å; A102-Q105 PolarHBondContact O-N 3.46Å; Q105-Q108 PolarHBondContact O-N 2.98Å; Q105-L109 WeakPolarHBondContact O-CB 3.39Å; Q105-L109 WeakPolarHBondContact O-CG 3.36Å; Q105-L109 PolarHBondContact O-N 2.96Å
106	H	78.7	Confident	72	Confident	135 Å²	135	84.4 Å²	84.4	63%	0.625	46%	0.455	S	S	*	.	H	α-helix	trans	-65.3	-41.6	177.2	-173	72.7	0	0	0	112.1	A102 V103 V104 L109 A110	A102-H106 VanDerWaalsContact O-CB 3.32Å; A102-H106 WeakPolarHBondContact O-CB 3.43Å; A102-H106 PolarHBondContact O-N 2.98Å; V103-H106 PolarHBondContact O-N 3.33Å; V104-H106 VanDerWaalsContact C-N 3.34Å; V104-H106 PolarHBondContact O-N 2.99Å; H106-L109 PolarHBondContact O-N 3.38Å; H106-A110 WeakPolarHBondContact O-CB 3.49Å; H106-A110 PolarHBondContact O-N 2.71Å
107	S	74.9	Confident	71.9	Confident	41 Å²	41	88.5 Å²	88.5	29%	0.287	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175.9	-175.2	0	0	0	0	111.6	V103 V104 A111	V103-S107 VanDerWaalsContact O-CB 3.24Å; V103-S107 WeakPolarHBondContact O-CB 3.35Å; V103-S107 PolarHBondContact O-N 2.88Å; V104-S107 PolarHBondContact O-N 3.44Å; S107-A111 VanDerWaalsContact O-CB 3.3Å; S107-A111 WeakPolarHBondContact O-CB 3.48Å; S107-A111 PolarHBondContact O-N 2.97Å
108	Q	68.8	Low	71.4	Confident	75 Å²	75	84.7 Å²	84.7	35%	0.35	46%	0.455	S	S	.	.	H	α-helix	trans	-63.2	-49.6	175.3	-72.5	175.9	-4.2	0	0	111.6	V104 Q105 A110 A111 A112 M162	V104-Q108 WeakPolarHBondContact O-CG 3.41Å; V104-Q108 PolarHBondContact O-N 3.33Å; Q105-Q108 PolarHBondContact O-N 2.98Å; Q108-A110 VanDerWaalsContact C-N 3.33Å; Q108-A110 PolarHBondContact O-N 3.46Å; Q108-A111 PolarHBondContact O-N 2.98Å; Q108-A112 VanDerWaalsContact O-CB 3.3Å; Q108-A112 WeakPolarHBondContact O-CB 3.39Å; Q108-A112 PolarHBondContact O-N 3.08Å; Q108-M162 HydrophobicContact CG-CE 4.06Å; Q108-M162 HydrophobicContact CG-CG 4.48Å; Q108-M162 HydrophobicContact CG-SD 4.48Å; Q108-M162 PolarHBondContact NE2-SD 2.86Å
109	L	73.9	Confident	71	Confident	115 Å²	115	80.4 Å²	80.4	60%	0.602	43%	0.431	S	S	*	.	H	α-helix	trans	-64.8	-39.5	179.5	-72.4	171.2	0	0	0	111.1	Q105 H106 A112 V113	Q105-L109 WeakPolarHBondContact O-CB 3.39Å; Q105-L109 WeakPolarHBondContact O-CG 3.36Å; Q105-L109 PolarHBondContact O-N 2.96Å; H106-L109 PolarHBondContact O-N 3.38Å; L109-A112 PolarHBondContact O-N 2.88Å; L109-V113 VanDerWaalsContact O-CB 3.23Å; L109-V113 WeakPolarHBondContact O-CB 3.13Å; L109-V113 WeakPolarHBondContact O-CG2 3.49Å; L109-V113 PolarHBondContact O-N 3.21Å
110	A	75.2	Confident	70.8	Confident	43 Å²	43	84 Å²	84	36%	0.355	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-47	175.2	0	0	0	0	0	111.4	H106 Q108 A112 V113 E114	H106-A110 WeakPolarHBondContact O-CB 3.49Å; H106-A110 PolarHBondContact O-N 2.71Å; Q108-A110 VanDerWaalsContact C-N 3.33Å; Q108-A110 PolarHBondContact O-N 3.46Å; A110-A112 VanDerWaalsContact C-N 3.34Å; A110-A112 PolarHBondContact O-N 3.45Å; A110-V113 PolarHBondContact O-N 3.23Å; A110-E114 VanDerWaalsContact O-CB 3.23Å; A110-E114 WeakPolarHBondContact O-CB 3.35Å; A110-E114 PolarHBondContact O-N 2.92Å
111	A	65.8	Low	71.1	Confident	18 Å²	18	79.1 Å²	79.1	15%	0.149	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-41.2	175.6	0	0	0	0	0	111.8	S107 Q108 N115 E158	S107-A111 VanDerWaalsContact O-CB 3.3Å; S107-A111 WeakPolarHBondContact O-CB 3.48Å; S107-A111 PolarHBondContact O-N 2.97Å; Q108-A111 PolarHBondContact O-N 2.98Å; A111-N115 WeakPolarHBondContact O-CB 3.29Å; A111-N115 PolarHBondContact O-N 3.3Å; A111-N115 PolarHBondContact O-ND2 3.26Å; A111-E158 HydrophobicContact CB-CG 4.31Å
112	A	67.5	Low	71.2	Confident	33 Å²	33	76.1 Å²	76.1	27%	0.273	41%	0.409	S	S	.	.	H	α-helix	trans	-65.7	-42.8	176	0	0	0	0	0	111.8	Q108 L109 A110 N115 L116	Q108-A112 VanDerWaalsContact O-CB 3.3Å; Q108-A112 WeakPolarHBondContact O-CB 3.39Å; Q108-A112 PolarHBondContact O-N 3.08Å; L109-A112 PolarHBondContact O-N 2.88Å; A110-A112 VanDerWaalsContact C-N 3.34Å; A110-A112 PolarHBondContact O-N 3.45Å; A112-N115 CarbonylContact O-C 3.18Å; A112-N115 PolarHBondContact O-N 2.95Å; A112-L116 VanDerWaalsContact O-CA 3.31Å; A112-L116 WeakPolarHBondContact O-CA 3.28Å; A112-L116 VanDerWaalsContact O-CB 3.24Å; A112-L116 WeakPolarHBondContact O-CB 3.31Å; A112-L116 WeakPolarHBondContact O-CD1 3.43Å; A112-L116 PolarHBondContact O-N 3.08Å
113	V	72.8	Confident	71.4	Confident	99 Å²	99	77.8 Å²	77.8	60%	0.6	42%	0.415	S	S	*	.	H	α-helix	trans	-68.1	-41	178.5	169.1	0	0	0	0	111.8	L109 A110 N115 L116	L109-V113 VanDerWaalsContact O-CB 3.23Å; L109-V113 WeakPolarHBondContact O-CB 3.13Å; L109-V113 WeakPolarHBondContact O-CG2 3.49Å; L109-V113 PolarHBondContact O-N 3.21Å; A110-V113 PolarHBondContact O-N 3.23Å; V113-N115 VanDerWaalsContact C-N 3.33Å; V113-L116 HydrophobicContact CG2-CD1 4.26Å; V113-L116 WeakPolarHBondContact O-CB 3.09Å; V113-L116 PolarHBondContact O-N 2.91Å
114	E	68.5	Low	71.7	Confident	161 Å²	161	78.6 Å²	78.6	75%	0.752	41%	0.413	S	S	*	.	H	α-helix	trans	-66.1	-37.4	176.7	-167.9	176.7	-172.2	0	0	111.3	A110	A110-E114 VanDerWaalsContact O-CB 3.23Å; A110-E114 WeakPolarHBondContact O-CB 3.35Å; A110-E114 PolarHBondContact O-N 2.92Å
115	N	64.3	Low	72.2	Confident	15 Å²	15	77.9 Å²	77.9	8%	0.08	41%	0.408	C	S	.	.	H	α-helix	trans	-88.1	-5.3	176.6	-69.8	-75.9	0	0	0	114.1	A111 A112 V113 K117 N118 I119 S151	A111-N115 WeakPolarHBondContact O-CB 3.29Å; A111-N115 PolarHBondContact O-N 3.3Å; A111-N115 PolarHBondContact O-ND2 3.26Å; A112-N115 CarbonylContact O-C 3.18Å; A112-N115 PolarHBondContact O-N 2.95Å; V113-N115 VanDerWaalsContact C-N 3.33Å; N115-K117 VanDerWaalsContact C-N 3.33Å; N115-K117 PolarHBondContact O-N 3.18Å; N115-N118 PolarHBondContact O-N 3.08Å; N115-I119 HydrophobicContact CB-CD1 4.1Å; N115-I119 HydrophobicContact CB-CG1 4.43Å; N115-I119 WeakPolarHBondContact O-CG1 3.48Å; N115-I119 PolarHBondContact O-N 2.72Å; N115-S151 WeakPolarHBondContact OD1-CA 3.14Å; N115-S151 WeakPolarHBondContact OD1-CB 3.5Å; N115-S151 PolarHBondContact OD1-OG 3.32Å
116	L	68.1	Low	72.7	Confident	76 Å²	76	72.8 Å²	72.8	40%	0.398	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-41.6	-170.6	-138.8	127	0	0	0	111.9	A112 V113 N118 I119 F120	A112-L116 VanDerWaalsContact O-CA 3.31Å; A112-L116 WeakPolarHBondContact O-CA 3.28Å; A112-L116 VanDerWaalsContact O-CB 3.24Å; A112-L116 WeakPolarHBondContact O-CB 3.31Å; A112-L116 WeakPolarHBondContact O-CD1 3.43Å; A112-L116 PolarHBondContact O-N 3.08Å; V113-L116 HydrophobicContact CG2-CD1 4.26Å; V113-L116 WeakPolarHBondContact O-CB 3.09Å; V113-L116 PolarHBondContact O-N 2.91Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.3Å; L116-I119 PolarHBondContact O-N 2.91Å; L116-F120 HydrophobicContact CD2-CD2 3.93Å; L116-F120 HydrophobicContact CD2-CE2 3.5Å; L116-F120 VanDerWaalsContact CD2-CE2 3.5Å; L116-F120 HydrophobicContact CG-CD2 4.4Å; L116-F120 HydrophobicContact CG-CE2 3.98Å; L116-F120 VanDerWaalsContact O-CD2 3.27Å; L116-F120 WeakPolarHBondContact O-CD2 3.03Å; L116-F120 PolarHBondContact O-N 2.96Å
117	K	63.3	Low	73.1	Confident	176 Å²	176	73.1 Å²	73.1	77%	0.765	38%	0.381	S	S	*	.	H	α-helix	trans	-60.7	-36.9	175.6	-76.1	-174.3	177.2	-179.8	0	112.9	N115 S121	N115-K117 VanDerWaalsContact C-N 3.33Å; N115-K117 PolarHBondContact O-N 3.18Å; K117-S121 WeakPolarHBondContact O-CB 3.45Å; K117-S121 PolarHBondContact O-OG 3.29Å
118	N	59.5	Low	73.8	Confident	56 Å²	56	74.3 Å²	74.3	30%	0.299	38%	0.382	S	S	.	.	H	α-helix	trans	-78	-35.1	179.6	-68.5	-12.1	0	0	0	111.3	N115 L116 S121 V122 S151	N115-N118 PolarHBondContact O-N 3.08Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.3Å; N118-S121 PolarHBondContact O-N 3.28Å; N118-V122 WeakPolarHBondContact O-CG2 3.37Å; N118-V122 PolarHBondContact O-N 2.85Å; N118-S151 PolarHBondContact ND2-OG 3.38Å; N118-S151 VanDerWaalsContact ND2-OG 3.12Å
119	I	64.8	Low	74.8	Confident	40 Å²	40	70.8 Å²	70.8	21%	0.205	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-49	179.2	-66	164.3	0	0	0	110.7	N115 L116 S121 V122 L155 Y176	N115-I119 HydrophobicContact CB-CD1 4.1Å; N115-I119 HydrophobicContact CB-CG1 4.43Å; N115-I119 WeakPolarHBondContact O-CG1 3.48Å; N115-I119 PolarHBondContact O-N 2.72Å; L116-I119 PolarHBondContact O-N 2.91Å; I119-S121 VanDerWaalsContact C-N 3.25Å; I119-S121 PolarHBondContact O-N 3.29Å; I119-V122 WeakPolarHBondContact O-CG2 3.41Å; I119-L155 HydrophobicContact CD1-CD1 3.95Å; I119-L155 HydrophobicContact CD1-CD2 4.5Å; I119-L155 HydrophobicContact CG1-CD1 4.19Å; I119-Y176 HydrophobicContact CG2-CE1 4.18Å; I119-Y176 PolarHBondContact O-OH 3.28Å
120	F	68.6	Low	75.6	Confident	157 Å²	157	69.6 Å²	69.6	69%	0.689	36%	0.356	S	S	*	.	H	α-helix	trans	-70.3	-20.6	180	-73.3	-77.8	0	0	0	114.2	L116	L116-F120 HydrophobicContact CD2-CD2 3.93Å; L116-F120 HydrophobicContact CD2-CE2 3.5Å; L116-F120 VanDerWaalsContact CD2-CE2 3.5Å; L116-F120 HydrophobicContact CG-CD2 4.4Å; L116-F120 HydrophobicContact CG-CE2 3.98Å; L116-F120 VanDerWaalsContact O-CD2 3.27Å; L116-F120 WeakPolarHBondContact O-CD2 3.03Å; L116-F120 PolarHBondContact O-N 2.96Å
121	S	76.2	Confident	76.4	Confident	44 Å²	44	70.1 Å²	70.1	31%	0.308	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	3.3	-175.5	-45.3	0	0	0	0	113.4	K117 N118 I119 E124 I125	K117-S121 WeakPolarHBondContact O-CB 3.45Å; K117-S121 PolarHBondContact O-OG 3.29Å; N118-S121 PolarHBondContact O-N 3.28Å; I119-S121 VanDerWaalsContact C-N 3.25Å; I119-S121 PolarHBondContact O-N 3.29Å; S121-E124 PolarHBondContact O-N 3.4Å; S121-I125 VanDerWaalsContact O-CG1 3.29Å; S121-I125 WeakPolarHBondContact O-CG1 3.42Å; S121-I125 PolarHBondContact O-N 3.02Å
122	V	79.3	Confident	77.6	Confident	7 Å²	7	70 Å²	70	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-53.6	-50.1	-175.6	174.7	0	0	0	0	112.8	N118 I119 E124 I125 V126 L148 Y176 F177 M180	N118-V122 WeakPolarHBondContact O-CG2 3.37Å; N118-V122 PolarHBondContact O-N 2.85Å; I119-V122 WeakPolarHBondContact O-CG2 3.41Å; V122-E124 VanDerWaalsContact C-N 3.31Å; V122-E124 PolarHBondContact O-N 3Å; V122-I125 PolarHBondContact O-N 3.24Å; V122-V126 HydrophobicContact CG1-CG2 4.13Å; V122-V126 WeakPolarHBondContact O-CB 3.31Å; V122-V126 WeakPolarHBondContact O-CG2 3.23Å; V122-V126 PolarHBondContact O-N 2.96Å; V122-L148 HydrophobicContact CG2-CD2 4.05Å; V122-Y176 HydrophobicContact CB-CE1 4.09Å; V122-Y176 HydrophobicContact CG2-CE1 3.82Å; V122-F177 HydrophobicContact CG2-CE1 4.22Å; V122-F177 HydrophobicContact CG2-CZ 4.41Å; V122-M180 HydrophobicContact CG1-CE 3.4Å; V122-M180 VanDerWaalsContact CG1-CE 3.4Å
123	P	80.7	Confident	78.8	Confident	88 Å²	88	68.7 Å²	68.7	57%	0.571	34%	0.339	S	S	*	.	H	α-helix	trans	-63.6	-36.5	-177.8	-22.2	34.8	0	0	0	113.1	R127	P123-R127 PolarHBondContact O-N 3.5Å; P123-R127 VanDerWaalsContact O-N 3.12Å
124	E	84.6	Confident	79.6	Confident	108 Å²	108	70.7 Å²	70.7	51%	0.505	34%	0.342	S	S	.	.	H	α-helix	trans	-71	-45.7	179.1	-173.3	170.9	-156.2	0	0	111.4	S121 V122 V126 R127 E128	S121-E124 PolarHBondContact O-N 3.4Å; V122-E124 VanDerWaalsContact C-N 3.31Å; V122-E124 PolarHBondContact O-N 3Å; E124-V126 VanDerWaalsContact C-N 3.3Å; E124-V126 PolarHBondContact O-N 3.44Å; E124-R127 PolarHBondContact O-N 3.17Å; E124-E128 WeakPolarHBondContact O-CG 3.37Å; E124-E128 PolarHBondContact O-N 3.48Å
125	I	84.7	Confident	80.6	Confident	27 Å²	27	70.5 Å²	70.5	14%	0.138	33%	0.334	C	S	.	.	H	α-helix	trans	-63.2	-38.1	176.7	-63.8	167.8	0	0	0	110.9	S121 V122 E128 A129 K144 L148	S121-I125 VanDerWaalsContact O-CG1 3.29Å; S121-I125 WeakPolarHBondContact O-CG1 3.42Å; S121-I125 PolarHBondContact O-N 3.02Å; V122-I125 PolarHBondContact O-N 3.24Å; I125-E128 PolarHBondContact O-N 3.26Å; I125-A129 VanDerWaalsContact O-CB 3.24Å; I125-A129 WeakPolarHBondContact O-CB 3.27Å; I125-A129 PolarHBondContact O-N 3.49Å; I125-K144 HydrophobicContact CG2-CB 4.06Å; I125-K144 HydrophobicContact CG2-CD 4.12Å; I125-L148 HydrophobicContact CB-CD1 4.18Å; I125-L148 HydrophobicContact CB-CD2 4.3Å; I125-L148 HydrophobicContact CD1-CD2 4.1Å; I125-L148 HydrophobicContact CG2-CD1 3.62Å; I125-L148 HydrophobicContact CG2-CD2 4.1Å; I125-L148 HydrophobicContact CG2-CG 3.84Å
126	V	86.5	Confident	81.5	Confident	15 Å²	15	71.6 Å²	71.6	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-43.8	175.3	168.2	0	0	0	0	110.8	V122 E124 A129 Q130 L148 N179 M180 L183	V122-V126 HydrophobicContact CG1-CG2 4.13Å; V122-V126 WeakPolarHBondContact O-CB 3.31Å; V122-V126 WeakPolarHBondContact O-CG2 3.23Å; V122-V126 PolarHBondContact O-N 2.96Å; E124-V126 VanDerWaalsContact C-N 3.3Å; E124-V126 PolarHBondContact O-N 3.44Å; V126-A129 PolarHBondContact O-N 2.97Å; V126-Q130 WeakPolarHBondContact O-CB 3.47Å; V126-Q130 PolarHBondContact O-N 3.33Å; V126-L148 HydrophobicContact CG2-CD1 3.84Å; V126-N179 HydrophobicContact CG1-CB 4.35Å; V126-M180 HydrophobicContact CG2-CG 4.26Å; V126-L183 HydrophobicContact CG1-CD2 4.41Å
127	R	87.3	Confident	82.6	Confident	142 Å²	142	71.8 Å²	71.8	54%	0.536	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-47.2	176.5	-172.7	-178.1	66	91.5	-0.1	111.9	P123 E124 A129 Q130 D131	P123-R127 PolarHBondContact O-N 3.5Å; P123-R127 VanDerWaalsContact O-N 3.12Å; E124-R127 PolarHBondContact O-N 3.17Å; R127-A129 VanDerWaalsContact C-N 3.32Å; R127-A129 PolarHBondContact O-N 2.83Å; R127-Q130 WeakPolarHBondContact O-CB 3.17Å; R127-Q130 PolarHBondContact O-N 3.19Å; R127-Q130 VanDerWaalsContact O-N 3.16Å; R127-D131 IonicContact NH1-OD2 3.9Å; R127-D131 PolarHBondContact O-N 3.3Å
128	E	89.7	Confident	84.1	Confident	66 Å²	66	63.7 Å²	63.7	31%	0.308	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-44.8	175.6	-74.6	-176.9	178.4	0	0	112	E124 I125 Q130 D131 L132 K144	E124-E128 WeakPolarHBondContact O-CG 3.37Å; E124-E128 PolarHBondContact O-N 3.48Å; I125-E128 PolarHBondContact O-N 3.26Å; E128-Q130 VanDerWaalsContact C-N 3.29Å; E128-Q130 PolarHBondContact O-N 3.25Å; E128-D131 PolarHBondContact O-N 3.32Å; E128-L132 VanDerWaalsContact O-CG 3.29Å; E128-L132 WeakPolarHBondContact O-CG 3.33Å; E128-L132 PolarHBondContact O-N 2.93Å; E128-K144 IonicContact OE2-NZ 2.8Å; E128-K144 PolarHBondContact OE2-NZ 3.35Å
129	A	89.5	Confident	85.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-35.9	178.8	0	0	0	0	0	111.5	I125 V126 R127 L132 I133 K144 L183	I125-A129 VanDerWaalsContact O-CB 3.24Å; I125-A129 WeakPolarHBondContact O-CB 3.27Å; I125-A129 PolarHBondContact O-N 3.49Å; V126-A129 PolarHBondContact O-N 2.97Å; R127-A129 VanDerWaalsContact C-N 3.32Å; R127-A129 PolarHBondContact O-N 2.83Å; A129-L132 PolarHBondContact O-N 3.4Å; A129-I133 VanDerWaalsContact O-CG1 3.28Å; A129-I133 WeakPolarHBondContact O-CG1 3.45Å; A129-I133 PolarHBondContact O-N 3.01Å; A129-K144 HydrophobicContact CB-CB 4.07Å; A129-L183 HydrophobicContact CB-CD1 4.24Å; A129-L183 HydrophobicContact CB-CD2 3.59Å; A129-L183 HydrophobicContact CB-CG 4.44Å
130	Q	90.8	Very high	86.9	Confident	90 Å²	90	66 Å²	66	42%	0.421	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-46.9	174	-169.5	171.8	-16.3	0	0	111.7	V126 R127 E128 L132 I133 E134 L183	V126-Q130 WeakPolarHBondContact O-CB 3.47Å; V126-Q130 PolarHBondContact O-N 3.33Å; R127-Q130 WeakPolarHBondContact O-CB 3.17Å; R127-Q130 PolarHBondContact O-N 3.19Å; R127-Q130 VanDerWaalsContact O-N 3.16Å; E128-Q130 VanDerWaalsContact C-N 3.29Å; E128-Q130 PolarHBondContact O-N 3.25Å; Q130-L132 PolarHBondContact O-N 3.36Å; Q130-I133 WeakPolarHBondContact O-CB 3.3Å; Q130-I133 PolarHBondContact O-N 2.72Å; Q130-E134 PolarHBondContact O-N 2.74Å; Q130-L183 HydrophobicContact CB-CD1 4.03Å
131	D	91.4	Very high	88	Confident	55 Å²	55	58.5 Å²	58.5	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-32.9	175.7	-64.3	-16.1	0	0	0	112	R127 E128 R135	R127-D131 IonicContact NH1-OD2 3.9Å; R127-D131 PolarHBondContact O-N 3.3Å; E128-D131 PolarHBondContact O-N 3.32Å; D131-R135 WeakPolarHBondContact O-CB 3.5Å; D131-R135 WeakPolarHBondContact O-CG 3.36Å; D131-R135 PolarHBondContact O-N 2.75Å; D131-R135 VanDerWaalsContact O-N 3.17Å; D131-R135 PolarHBondContact O-NE 2.87Å
132	L	92.1	Very high	88.9	Confident	15 Å²	15	56.4 Å²	56.4	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-72.1	-35.9	175.2	-72.1	169.2	0	0	0	112.4	E128 A129 Q130 R135 G136 E137 Q140 A141	E128-L132 VanDerWaalsContact O-CG 3.29Å; E128-L132 WeakPolarHBondContact O-CG 3.33Å; E128-L132 PolarHBondContact O-N 2.93Å; A129-L132 PolarHBondContact O-N 3.4Å; Q130-L132 PolarHBondContact O-N 3.36Å; L132-R135 PolarHBondContact O-N 2.75Å; L132-G136 PolarHBondContact O-N 3.19Å; L132-E137 HydrophobicContact CD2-CB 4.02Å; L132-E137 PolarHBondContact O-N 2.65Å; L132-Q140 HydrophobicContact CD1-CB 3.99Å; L132-Q140 HydrophobicContact CD2-CB 4.44Å; L132-A141 HydrophobicContact CB-CB 3.9Å
133	I	91.3	Very high	89.5	Confident	6 Å²	6	64 Å²	64	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-45.6	173.7	-68.4	168.1	0	0	0	109.9	A129 Q130 R135 G136 A141 L183 E186 L187 Q190	A129-I133 VanDerWaalsContact O-CG1 3.28Å; A129-I133 WeakPolarHBondContact O-CG1 3.45Å; A129-I133 PolarHBondContact O-N 3.01Å; Q130-I133 WeakPolarHBondContact O-CB 3.3Å; Q130-I133 PolarHBondContact O-N 2.72Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 3.17Å; I133-G136 PolarHBondContact O-N 3.17Å; I133-A141 HydrophobicContact CD1-CB 4.44Å; I133-A141 HydrophobicContact CG1-CB 3.6Å; I133-L183 HydrophobicContact CD1-CD1 3.46Å; I133-L183 VanDerWaalsContact CD1-CD1 3.46Å; I133-L183 HydrophobicContact CD1-CG 4.18Å; I133-E186 HydrophobicContact CG2-CG 4.34Å; I133-L187 HydrophobicContact CD1-CB 3.87Å; I133-L187 HydrophobicContact CD1-CD1 4.41Å; I133-L187 HydrophobicContact CG1-CB 4.45Å; I133-L187 HydrophobicContact CG1-CD1 4.1Å; I133-Q190 HydrophobicContact CG2-CG 3.56Å
134	E	90.1	Very high	89.9	Confident	141 Å²	141	63.3 Å²	63.3	66%	0.659	29%	0.29	S	S	*	.	H	α-helix	trans	-63.1	-33.3	179.1	-70.1	178	-169.2	0	0	112.5	Q130 G136	Q130-E134 PolarHBondContact O-N 2.74Å; E134-G136 VanDerWaalsContact C-N 3.31Å
135	R	89	Confident	90.2	Very high	157 Å²	157	58.2 Å²	58.2	59%	0.592	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-6.5	174.3	-73.7	179.1	-76.8	-166.5	-0.5	114.5	D131 L132 I133 E137	D131-R135 WeakPolarHBondContact O-CB 3.5Å; D131-R135 WeakPolarHBondContact O-CG 3.36Å; D131-R135 PolarHBondContact O-N 2.75Å; D131-R135 VanDerWaalsContact O-N 3.17Å; D131-R135 PolarHBondContact O-NE 2.87Å; L132-R135 PolarHBondContact O-N 2.75Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 3.17Å; R135-E137 VanDerWaalsContact C-N 3.33Å
136	G	84.8	Confident	90.5	Very high	38 Å²	38	59.7 Å²	59.7	39%	0.392	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	11	-178.2	0	0	0	0	0	114.9	L132 I133 E134 L138	L132-G136 PolarHBondContact O-N 3.19Å; I133-G136 PolarHBondContact O-N 3.17Å; E134-G136 VanDerWaalsContact C-N 3.31Å; G136-L138 PolarHBondContact O-N 2.85Å
137	E	91.5	Very high	90.5	Very high	79 Å²	79	62.2 Å²	62.2	37%	0.369	29%	0.287	S	S	.	.			trans	-83.4	59	177.7	-67.1	-172.4	-143.2	0	0	111.6	L132 R135 L139 Q140 A141	L132-E137 HydrophobicContact CD2-CB 4.02Å; L132-E137 PolarHBondContact O-N 2.65Å; R135-E137 VanDerWaalsContact C-N 3.33Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 2.72Å; E137-Q140 PolarHBondContact O-N 2.94Å; E137-Q140 VanDerWaalsContact O-N 3.11Å; E137-Q140 PolarHBondContact OE2-NE2 2.92Å; E137-Q140 PolarHBondContact OE2-OE1 3.22Å; E137-A141 PolarHBondContact O-N 3.37Å; E137-A141 VanDerWaalsContact O-N 3.16Å
138	L	93	Very high	90.5	Very high	7 Å²	7	55.6 Å²	55.6	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-34.2	-165.2	-54.7	179.7	0	0	0	114.1	G136 H142 L187 Q190 L191 V194 L208 V212 I215	G136-L138 PolarHBondContact O-N 2.85Å; L138-H142 VanDerWaalsContact O-CB 3.24Å; L138-H142 WeakPolarHBondContact O-CB 3.41Å; L138-H142 PolarHBondContact O-N 3.47Å; L138-L187 HydrophobicContact CB-CD1 4.31Å; L138-L187 HydrophobicContact CD2-CD1 4.06Å; L138-Q190 HydrophobicContact CD2-CB 3.94Å; L138-L191 HydrophobicContact CD1-CD2 4Å; L138-V194 HydrophobicContact CD1-CG2 4.44Å; L138-L208 HydrophobicContact CD1-CD1 4.12Å; L138-V212 HydrophobicContact CD1-CG2 3.94Å; L138-I215 HydrophobicContact CB-CD1 3.84Å; L138-I215 WeakPolarHBondContact O-CD1 3.43Å
139	L	92.3	Very high	90.4	Very high	37 Å²	37	52.6 Å²	52.6	19%	0.194	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-37.4	179.1	-90.7	165.2	0	0	0	112.7	E137 R143 S211 R214 I215	E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 2.72Å; L139-R143 PolarHBondContact O-N 3.49Å; L139-R143 VanDerWaalsContact O-N 3.1Å; L139-S211 WeakPolarHBondContact CD1-OG 3.42Å; L139-R214 HydrophobicContact CD2-CB 4.39Å; L139-I215 HydrophobicContact CD2-CG1 3.95Å; L139-I215 HydrophobicContact CG-CD1 4.42Å; L139-I215 HydrophobicContact CG-CG1 4.39Å
140	Q	91.3	Very high	90.2	Very high	106 Å²	106	55.7 Å²	55.7	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-75.1	-43.2	179.5	-62.8	-175.3	38.7	0	0	110.2	L132 E137 H142 R143 K144	L132-Q140 HydrophobicContact CD1-CB 3.99Å; L132-Q140 HydrophobicContact CD2-CB 4.44Å; E137-Q140 PolarHBondContact O-N 2.94Å; E137-Q140 VanDerWaalsContact O-N 3.11Å; E137-Q140 PolarHBondContact OE2-NE2 2.92Å; E137-Q140 PolarHBondContact OE2-OE1 3.22Å; Q140-H142 VanDerWaalsContact C-N 3.33Å; Q140-H142 PolarHBondContact O-N 3.12Å; Q140-R143 PolarHBondContact O-N 3.33Å; Q140-K144 WeakPolarHBondContact O-CG 3.48Å; Q140-K144 PolarHBondContact O-N 2.93Å; Q140-K144 VanDerWaalsContact O-N 3.11Å
141	A	92.8	Very high	89.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-56.6	-46.5	171.7	0	0	0	0	0	111.8	L132 I133 E137 R143 K144 L145 L187	L132-A141 HydrophobicContact CB-CB 3.9Å; I133-A141 HydrophobicContact CD1-CB 4.44Å; I133-A141 HydrophobicContact CG1-CB 3.6Å; E137-A141 PolarHBondContact O-N 3.37Å; E137-A141 VanDerWaalsContact O-N 3.16Å; A141-R143 PolarHBondContact O-N 3.02Å; A141-K144 PolarHBondContact O-N 3.39Å; A141-L145 WeakPolarHBondContact O-CB 3.25Å; A141-L145 PolarHBondContact O-N 3.08Å; A141-L187 HydrophobicContact CB-CD1 4.41Å
142	H	94.6	Very high	89.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-43	176.9	177.1	-106	0	0	0	112.5	L138 Q140 K144 L145 M146 L187 I215 E219	L138-H142 VanDerWaalsContact O-CB 3.24Å; L138-H142 WeakPolarHBondContact O-CB 3.41Å; L138-H142 PolarHBondContact O-N 3.47Å; Q140-H142 VanDerWaalsContact C-N 3.33Å; Q140-H142 PolarHBondContact O-N 3.12Å; H142-K144 PolarHBondContact O-N 3.27Å; H142-L145 PolarHBondContact O-N 3.38Å; H142-M146 VanDerWaalsContact O-CB 3.29Å; H142-M146 WeakPolarHBondContact O-CB 3.38Å; H142-M146 PolarHBondContact O-N 3.31Å; H142-L187 HydrophobicContact CB-CD2 4.01Å; H142-I215 HydrophobicContact CB-CD1 3.98Å; H142-I215 HydrophobicContact CB-CG1 3.88Å; H142-I215 HydrophobicContact CB-CG2 4.24Å; H142-E219 IonicContact CD2-OE1 2.71Å; H142-E219 IonicContact CE1-OE1 3.37Å; H142-E219 IonicContact NE2-OE1 3.9Å; H142-E219 PolarHBondContact NE2-OE1 3.31Å
143	R	92.1	Very high	89.4	Confident	166 Å²	166	48.9 Å²	48.9	63%	0.626	24%	0.235	S	C	*	.	H	α-helix	trans	-59.7	-48.3	177.5	-177.6	179.6	-179.8	175.9	1.2	111.6	L139 Q140 A141 L145 M146 D147	L139-R143 PolarHBondContact O-N 3.49Å; L139-R143 VanDerWaalsContact O-N 3.1Å; Q140-R143 PolarHBondContact O-N 3.33Å; A141-R143 PolarHBondContact O-N 3.02Å; R143-L145 VanDerWaalsContact C-N 3.34Å; R143-L145 PolarHBondContact O-N 3.04Å; R143-M146 PolarHBondContact O-N 3.4Å; R143-D147 VanDerWaalsContact O-CG 3.28Å; R143-D147 PolarHBondContact O-N 3.42Å
144	K	89.4	Confident	89	Confident	73 Å²	73	51.2 Å²	51.2	32%	0.317	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-43.5	178.3	-66.2	-74.4	-171.3	140.1	0	111.2	I125 E128 A129 Q140 A141 H142 D147 L148	I125-K144 HydrophobicContact CG2-CB 4.06Å; I125-K144 HydrophobicContact CG2-CD 4.12Å; E128-K144 IonicContact OE2-NZ 2.8Å; E128-K144 PolarHBondContact OE2-NZ 3.35Å; A129-K144 HydrophobicContact CB-CB 4.07Å; Q140-K144 WeakPolarHBondContact O-CG 3.48Å; Q140-K144 PolarHBondContact O-N 2.93Å; Q140-K144 VanDerWaalsContact O-N 3.11Å; A141-K144 PolarHBondContact O-N 3.39Å; H142-K144 PolarHBondContact O-N 3.27Å; K144-D147 PolarHBondContact O-N 3.41Å; K144-L148 WeakPolarHBondContact O-CG 3.4Å; K144-L148 PolarHBondContact O-N 2.92Å
145	L	90.6	Very high	88.6	Confident	1 Å²	1	46 Å²	46	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-43.7	175.4	178.7	66.4	0	0	0	112.2	A141 H142 R143 D147 L148 E149 M180 L183 L187	A141-L145 WeakPolarHBondContact O-CB 3.25Å; A141-L145 PolarHBondContact O-N 3.08Å; H142-L145 PolarHBondContact O-N 3.38Å; R143-L145 VanDerWaalsContact C-N 3.34Å; R143-L145 PolarHBondContact O-N 3.04Å; L145-D147 PolarHBondContact O-N 3.19Å; L145-L148 PolarHBondContact O-N 2.75Å; L145-E149 HydrophobicContact CD1-CG 4.35Å; L145-E149 HydrophobicContact CG-CG 4.44Å; L145-E149 WeakPolarHBondContact O-CG 3.49Å; L145-E149 PolarHBondContact O-N 2.81Å; L145-M180 HydrophobicContact CD1-CB 4.26Å; L145-M180 HydrophobicContact CD1-CG 4.24Å; L145-L183 HydrophobicContact CD1-CB 4.42Å; L145-L183 HydrophobicContact CD1-CD2 3.98Å; L145-L183 HydrophobicContact CD1-CG 4.31Å; L145-L187 HydrophobicContact CD2-CD2 3.84Å
146	M	89.5	Confident	88.4	Confident	58 Å²	58	39 Å²	39	29%	0.286	20%	0.197	S	C	.	.	H	α-helix	trans	-63	-42	179.5	-175.3	-167.4	75.8	0	0	111.9	H142 R143 L148 E149 C150 I222	H142-M146 VanDerWaalsContact O-CB 3.29Å; H142-M146 WeakPolarHBondContact O-CB 3.38Å; H142-M146 PolarHBondContact O-N 3.31Å; R143-M146 PolarHBondContact O-N 3.4Å; M146-L148 VanDerWaalsContact C-N 3.32Å; M146-L148 PolarHBondContact O-N 3.46Å; M146-E149 PolarHBondContact O-N 3.35Å; M146-C150 VanDerWaalsContact O-CB 3.27Å; M146-C150 WeakPolarHBondContact O-CB 3.44Å; M146-C150 PolarHBondContact O-N 2.94Å; M146-I222 HydrophobicContact CG-CD1 3.88Å; M146-I222 HydrophobicContact SD-CD1 3.89Å
147	D	87.3	Confident	88.3	Confident	69 Å²	69	38.6 Å²	38.6	37%	0.369	18%	0.184	S	C	.	.	H	α-helix	trans	-62.9	-41.8	177.6	-67.2	-21.3	0	0	0	110.6	R143 K144 L145 C150 S151	R143-D147 VanDerWaalsContact O-CG 3.28Å; R143-D147 PolarHBondContact O-N 3.42Å; K144-D147 PolarHBondContact O-N 3.41Å; L145-D147 PolarHBondContact O-N 3.19Å; D147-C150 PolarHBondContact O-N 2.86Å; D147-S151 PolarHBondContact O-N 3.2Å; D147-S151 PolarHBondContact O-OG 2.91Å
148	L	86.8	Confident	87.8	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-66.7	-43.9	175.3	-69.4	179.1	0	0	0	113.1	V122 I125 V126 K144 L145 M146 C150 S151 R152 M180	V122-L148 HydrophobicContact CG2-CD2 4.05Å; I125-L148 HydrophobicContact CB-CD1 4.18Å; I125-L148 HydrophobicContact CB-CD2 4.3Å; I125-L148 HydrophobicContact CD1-CD2 4.1Å; I125-L148 HydrophobicContact CG2-CD1 3.62Å; I125-L148 HydrophobicContact CG2-CD2 4.1Å; I125-L148 HydrophobicContact CG2-CG 3.84Å; V126-L148 HydrophobicContact CG2-CD1 3.84Å; K144-L148 WeakPolarHBondContact O-CG 3.4Å; K144-L148 PolarHBondContact O-N 2.92Å; L145-L148 PolarHBondContact O-N 2.75Å; M146-L148 VanDerWaalsContact C-N 3.32Å; M146-L148 PolarHBondContact O-N 3.46Å; L148-C150 VanDerWaalsContact C-N 3.32Å; L148-C150 PolarHBondContact O-N 2.91Å; L148-S151 PolarHBondContact O-N 2.94Å; L148-R152 PolarHBondContact O-N 2.89Å; L148-M180 HydrophobicContact CB-CG 4.19Å; L148-M180 HydrophobicContact CB-SD 3.53Å; L148-M180 VanDerWaalsContact CB-SD 3.53Å; L148-M180 HydrophobicContact CD1-CG 3.99Å; L148-M180 HydrophobicContact CD1-SD 4.1Å; L148-M180 HydrophobicContact CG-SD 4.35Å
149	E	88.1	Confident	87.2	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-40.2	175.2	-76.4	-174	174.3	0	0	111.4	L145 M146 R152 D153 R240 K242	L145-E149 HydrophobicContact CD1-CG 4.35Å; L145-E149 HydrophobicContact CG-CG 4.44Å; L145-E149 WeakPolarHBondContact O-CG 3.49Å; L145-E149 PolarHBondContact O-N 2.81Å; M146-E149 PolarHBondContact O-N 3.35Å; E149-R152 WeakPolarHBondContact O-CB 3.36Å; E149-R152 PolarHBondContact O-N 3.44Å; E149-D153 VanDerWaalsContact O-CB 3.29Å; E149-D153 WeakPolarHBondContact O-CB 3.44Å; E149-D153 PolarHBondContact O-N 3.42Å; E149-R240 IonicContact OE2-CZ 2.99Å; E149-R240 IonicContact OE2-NH2 2.66Å; E149-R240 PolarHBondContact OE2-NH2 3.37Å; E149-K242 WeakPolarHBondContact OE1-CE 3.42Å; E149-K242 IonicContact OE1-NZ 2.79Å; E149-K242 PolarHBondContact OE1-NZ 3.25Å; E149-K242 IonicContact OE2-NZ 2.81Å; E149-K242 PolarHBondContact OE2-NZ 2.54Å
150	C	86.3	Confident	86.7	Confident	64 Å²	64	39.5 Å²	39.5	43%	0.432	19%	0.185	S	C	.	.	H	α-helix	trans	-62.2	-46.4	176.6	-171.4	0	0	0	0	111.5	M146 D147 L148 R152 D153 N154	M146-C150 VanDerWaalsContact O-CB 3.27Å; M146-C150 WeakPolarHBondContact O-CB 3.44Å; M146-C150 PolarHBondContact O-N 2.94Å; D147-C150 PolarHBondContact O-N 2.86Å; L148-C150 VanDerWaalsContact C-N 3.32Å; L148-C150 PolarHBondContact O-N 2.91Å; C150-R152 PolarHBondContact O-N 3.3Å; C150-D153 PolarHBondContact O-N 3.39Å; C150-N154 WeakPolarHBondContact O-CB 3.49Å; C150-N154 VanDerWaalsContact O-CG 3.24Å; C150-N154 PolarHBondContact O-N 2.98Å; C150-N154 PolarHBondContact O-ND2 3.14Å
151	S	84.4	Confident	86.2	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-45.4	175.4	-75.6	0	0	0	0	111.7	N115 N118 D147 L148 L155	N115-S151 WeakPolarHBondContact OD1-CA 3.14Å; N115-S151 WeakPolarHBondContact OD1-CB 3.5Å; N115-S151 PolarHBondContact OD1-OG 3.32Å; N118-S151 PolarHBondContact ND2-OG 3.38Å; N118-S151 VanDerWaalsContact ND2-OG 3.12Å; D147-S151 PolarHBondContact O-N 3.2Å; D147-S151 PolarHBondContact O-OG 2.91Å; L148-S151 PolarHBondContact O-N 2.94Å; S151-L155 VanDerWaalsContact O-CG 3.27Å; S151-L155 WeakPolarHBondContact O-CG 3.35Å; S151-L155 PolarHBondContact O-N 3.14Å; S151-L155 VanDerWaalsContact O-N 3.11Å
152	R	86.1	Confident	85.1	Confident	12 Å²	12	44 Å²	44	5%	0.045	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-53.5	174.8	-172.8	-167.2	64.5	-173.7	-0.1	111.7	L148 E149 C150 N154 L155 M156 I173 F177 P238	L148-R152 PolarHBondContact O-N 2.89Å; E149-R152 WeakPolarHBondContact O-CB 3.36Å; E149-R152 PolarHBondContact O-N 3.44Å; C150-R152 PolarHBondContact O-N 3.3Å; R152-N154 VanDerWaalsContact C-N 3.29Å; R152-N154 PolarHBondContact O-N 2.87Å; R152-L155 PolarHBondContact O-N 3Å; R152-M156 HydrophobicContact CG-CG 4.4Å; R152-M156 HydrophobicContact CG-SD 4.03Å; R152-M156 VanDerWaalsContact O-CG 3.31Å; R152-M156 WeakPolarHBondContact O-CG 3.43Å; R152-M156 PolarHBondContact O-N 2.94Å; R152-I173 HydrophobicContact CG-CG2 4.25Å; R152-F177 HydrophobicContact CB-CB 4.42Å; R152-F177 HydrophobicContact CB-CD1 3.43Å; R152-F177 VanDerWaalsContact CB-CD1 3.43Å; R152-F177 HydrophobicContact CB-CD2 4.44Å; R152-F177 HydrophobicContact CB-CE1 3.8Å; R152-F177 HydrophobicContact CB-CG 3.88Å; R152-F177 HydrophobicContact CB-CZ 4.41Å; R152-F177 HydrophobicContact CG-CB 3.83Å; R152-F177 HydrophobicContact CG-CD1 3.78Å; R152-F177 HydrophobicContact CG-CD2 4.11Å; R152-F177 HydrophobicContact CG-CE1 4.47Å; R152-F177 HydrophobicContact CG-CG 3.66Å; R152-P238 PolarHBondContact NH2-O 3.27Å
153	D	86.6	Confident	84.1	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.011	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-33.5	-172.3	-68.5	-0.7	0	0	0	111.4	E149 C150 Y157 M226 P237	E149-D153 VanDerWaalsContact O-CB 3.29Å; E149-D153 WeakPolarHBondContact O-CB 3.44Å; E149-D153 PolarHBondContact O-N 3.42Å; C150-D153 PolarHBondContact O-N 3.39Å; D153-Y157 VanDerWaalsContact O-CB 3.27Å; D153-Y157 WeakPolarHBondContact O-CB 3.19Å; D153-Y157 PolarHBondContact O-N 2.61Å; D153-M226 HydrophobicContact CB-CE 4.28Å; D153-P237 HydrophobicContact CB-CB 4.11Å; D153-P237 HydrophobicContact CB-CG 3.87Å; D153-P237 WeakPolarHBondContact OD1-CB 3.37Å; D153-P237 WeakPolarHBondContact OD2-CB 3.19Å; D153-P237 WeakPolarHBondContact OD2-CG 3.36Å
154	N	83	Confident	83.1	Confident	55 Å²	55	43.2 Å²	43.2	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-68.4	-44.8	173.4	-73.5	-25.7	0	0	0	112.2	C150 R152 M156 Y157 E158	C150-N154 WeakPolarHBondContact O-CB 3.49Å; C150-N154 VanDerWaalsContact O-CG 3.24Å; C150-N154 PolarHBondContact O-N 2.98Å; C150-N154 PolarHBondContact O-ND2 3.14Å; R152-N154 VanDerWaalsContact C-N 3.29Å; R152-N154 PolarHBondContact O-N 2.87Å; N154-M156 PolarHBondContact O-N 3.17Å; N154-Y157 PolarHBondContact O-N 3.48Å; N154-E158 PolarHBondContact O-N 3.19Å
155	L	82.1	Confident	82.2	Confident	30 Å²	30	48 Å²	48	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-44.3	175.6	-69.1	169.6	0	0	0	111.4	I119 S151 R152 Y157 E158 Q159 I173 F177	I119-L155 HydrophobicContact CD1-CD1 3.95Å; I119-L155 HydrophobicContact CD1-CD2 4.5Å; I119-L155 HydrophobicContact CG1-CD1 4.19Å; S151-L155 VanDerWaalsContact O-CG 3.27Å; S151-L155 WeakPolarHBondContact O-CG 3.35Å; S151-L155 PolarHBondContact O-N 3.14Å; S151-L155 VanDerWaalsContact O-N 3.11Å; R152-L155 PolarHBondContact O-N 3Å; L155-Y157 VanDerWaalsContact C-N 3.34Å; L155-Y157 PolarHBondContact O-N 3.37Å; L155-E158 PolarHBondContact O-N 2.72Å; L155-Q159 WeakPolarHBondContact O-CB 3.42Å; L155-Q159 PolarHBondContact O-N 2.74Å; L155-I173 HydrophobicContact CB-CD1 4.29Å; L155-I173 HydrophobicContact CB-CG2 4.49Å; L155-F177 HydrophobicContact CD1-CE2 4.1Å; L155-F177 HydrophobicContact CD1-CZ 4.01Å
156	M	83.8	Confident	81.5	Confident	10 Å²	10	50 Å²	50	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-37.4	177.3	-67.5	-173.7	80.8	0	0	112.2	R152 N154 Y160 M170 I173 F235 P238	R152-M156 HydrophobicContact CG-CG 4.4Å; R152-M156 HydrophobicContact CG-SD 4.03Å; R152-M156 VanDerWaalsContact O-CG 3.31Å; R152-M156 WeakPolarHBondContact O-CG 3.43Å; R152-M156 PolarHBondContact O-N 2.94Å; N154-M156 PolarHBondContact O-N 3.17Å; M156-Y160 VanDerWaalsContact O-CB 3.31Å; M156-Y160 WeakPolarHBondContact O-CB 3.36Å; M156-Y160 PolarHBondContact O-N 3.39Å; M156-M170 HydrophobicContact CB-CE 4.15Å; M156-M170 HydrophobicContact CB-SD 4.19Å; M156-M170 HydrophobicContact CE-CE 3.7Å; M156-M170 HydrophobicContact CE-SD 4.29Å; M156-M170 HydrophobicContact CG-SD 4.49Å; M156-I173 HydrophobicContact CG-CB 4.27Å; M156-I173 HydrophobicContact CG-CG2 3.58Å; M156-I173 HydrophobicContact SD-CG2 4.41Å; M156-F235 HydrophobicContact CB-CE1 4.43Å; M156-F235 HydrophobicContact CB-CZ 3.73Å; M156-P238 HydrophobicContact CE-CG 3.89Å; M156-P238 HydrophobicContact SD-CG 3.82Å
157	Y	83.4	Confident	80.8	Confident	31 Å²	31	52 Å²	52	12%	0.122	26%	0.261	C	S	.	.	H	α-helix	trans	-68.1	-43.9	176.8	176.2	-102.6	0	0	0	112.6	D153 N154 L155 Q159 Y160 R161 T233 F235	D153-Y157 VanDerWaalsContact O-CB 3.27Å; D153-Y157 WeakPolarHBondContact O-CB 3.19Å; D153-Y157 PolarHBondContact O-N 2.61Å; N154-Y157 PolarHBondContact O-N 3.48Å; L155-Y157 VanDerWaalsContact C-N 3.34Å; L155-Y157 PolarHBondContact O-N 3.37Å; Y157-Q159 VanDerWaalsContact C-N 3.31Å; Y157-Q159 PolarHBondContact O-N 2.96Å; Y157-Y160 PolarHBondContact O-N 3.17Å; Y157-R161 HydrophobicContact CD1-CG 4.26Å; Y157-R161 HydrophobicContact CE1-CG 3.87Å; Y157-R161 HydrophobicContact CE2-CG 4.2Å; Y157-R161 WeakPolarHBondContact O-CG 3.37Å; Y157-R161 PolarHBondContact O-N 3.18Å; Y157-T233 HydrophobicContact CE2-CG2 3.85Å; Y157-T233 WeakPolarHBondContact OH-CG2 2.97Å; Y157-F235 HydrophobicContact CD2-CB 3.91Å; Y157-F235 AromaticContact CD2-CD1 3.57Å; Y157-F235 HydrophobicContact CD2-CD1 3.57Å; Y157-F235 HydrophobicContact CD2-CE1 4.37Å; Y157-F235 AromaticContact CD2-CG 3.92Å; Y157-F235 HydrophobicContact CD2-CG 3.92Å; Y157-F235 HydrophobicContact CE2-CB 4.24Å; Y157-F235 HydrophobicContact CG-CD1 4.24Å
158	E	80.4	Confident	80.3	Confident	30 Å²	30	54.7 Å²	54.7	14%	0.14	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-39.7	176.6	-72.5	-56.5	133	0	0	110.9	A111 N154 L155 Y160 R161 M162	A111-E158 HydrophobicContact CB-CG 4.31Å; N154-E158 PolarHBondContact O-N 3.19Å; L155-E158 PolarHBondContact O-N 2.72Å; E158-Y160 PolarHBondContact O-N 3.25Å; E158-R161 PolarHBondContact O-N 3.33Å; E158-R161 IonicContact OE1-NH1 3.59Å; E158-R161 PolarHBondContact OE1-NH1 3.26Å; E158-R161 IonicContact OE2-NH1 3.45Å; E158-R161 PolarHBondContact OE2-NH1 3.23Å; E158-M162 WeakPolarHBondContact O-CG 3.49Å; E158-M162 PolarHBondContact O-N 2.84Å
159	Q	80.6	Confident	79.9	Confident	37 Å²	37	57.3 Å²	57.3	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-45.4	171.9	-174.3	63.8	14.2	0	0	111.9	L155 Y157 R161 M162 D163 N166 D169 M170 I173	L155-Q159 WeakPolarHBondContact O-CB 3.42Å; L155-Q159 PolarHBondContact O-N 2.74Å; Y157-Q159 VanDerWaalsContact C-N 3.31Å; Y157-Q159 PolarHBondContact O-N 2.96Å; Q159-R161 VanDerWaalsContact C-N 3.32Å; Q159-R161 PolarHBondContact O-N 3.03Å; Q159-M162 PolarHBondContact O-N 3.23Å; Q159-M162 VanDerWaalsContact O-N 3.12Å; Q159-D163 PolarHBondContact O-N 3.07Å; Q159-N166 PolarHBondContact NE2-ND2 3.33Å; Q159-N166 VanDerWaalsContact NE2-ND2 3.17Å; Q159-D169 HydrophobicContact CG-CB 4.15Å; Q159-D169 VanDerWaalsContact NE2-CB 3.28Å; Q159-D169 PolarHBondContact NE2-OD2 3.12Å; Q159-M170 HydrophobicContact CB-SD 3.88Å; Q159-M170 HydrophobicContact CG-CG 4.06Å; Q159-M170 HydrophobicContact CG-SD 3.84Å; Q159-I173 HydrophobicContact CB-CD1 4.36Å
160	Y	82.6	Confident	79.4	Confident	75 Å²	75	58.7 Å²	58.7	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-36.9	178.3	176.5	-92.3	0	0	0	113	M156 Y157 E158 M162 S164 F235	M156-Y160 VanDerWaalsContact O-CB 3.31Å; M156-Y160 WeakPolarHBondContact O-CB 3.36Å; M156-Y160 PolarHBondContact O-N 3.39Å; Y157-Y160 PolarHBondContact O-N 3.17Å; E158-Y160 PolarHBondContact O-N 3.25Å; Y160-M162 PolarHBondContact O-N 2.97Å; Y160-S164 PolarHBondContact O-N 3.42Å; Y160-F235 HydrophobicContact CD1-CB 3.65Å; Y160-F235 AromaticContact CD1-CD2 3.88Å; Y160-F235 HydrophobicContact CD1-CD2 3.88Å; Y160-F235 HydrophobicContact CD1-CG 4.01Å; Y160-F235 AromaticContact CD2-CD2 3.65Å; Y160-F235 HydrophobicContact CD2-CD2 3.65Å; Y160-F235 HydrophobicContact CD2-CE2 4.31Å; Y160-F235 HydrophobicContact CE1-CB 3.73Å; Y160-F235 HydrophobicContact CE1-CD2 4.43Å; Y160-F235 HydrophobicContact CE1-CG 4.5Å; Y160-F235 HydrophobicContact CE2-CD2 4.22Å; Y160-F235 HydrophobicContact CG-CB 4.14Å; Y160-F235 AromaticContact CG-CD2 3.44Å; Y160-F235 HydrophobicContact CG-CD2 3.44Å; Y160-F235 VanDerWaalsContact CG-CD2 3.44Å; Y160-F235 HydrophobicContact CG-CE2 4.17Å; Y160-F235 HydrophobicContact CG-CG 4.03Å
161	R	79.4	Confident	79.2	Confident	140 Å²	140	60.3 Å²	60.3	53%	0.528	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-29.3	175.5	-79.9	-179.3	66.1	-169.3	8.4	113.1	Y157 E158 Q159	Y157-R161 HydrophobicContact CD1-CG 4.26Å; Y157-R161 HydrophobicContact CE1-CG 3.87Å; Y157-R161 HydrophobicContact CE2-CG 4.2Å; Y157-R161 WeakPolarHBondContact O-CG 3.37Å; Y157-R161 PolarHBondContact O-N 3.18Å; E158-R161 PolarHBondContact O-N 3.33Å; E158-R161 IonicContact OE1-NH1 3.59Å; E158-R161 PolarHBondContact OE1-NH1 3.26Å; E158-R161 IonicContact OE2-NH1 3.45Å; E158-R161 PolarHBondContact OE2-NH1 3.23Å; Q159-R161 VanDerWaalsContact C-N 3.32Å; Q159-R161 PolarHBondContact O-N 3.03Å
162	M	70.8	Confident	79.1	Confident	60 Å²	60	64.8 Å²	64.8	30%	0.296	32%	0.32	S	S	.	.	H	α-helix	trans	-86.3	-53.5	-175.1	-63.6	-69.3	158.1	0	0	110.9	V104 Q108 E158 Q159 Y160	V104-M162 HydrophobicContact CB-CE 4.06Å; V104-M162 HydrophobicContact CB-SD 4.29Å; V104-M162 HydrophobicContact CG1-CE 3.5Å; V104-M162 HydrophobicContact CG1-SD 3.23Å; V104-M162 WeakPolarHBondContact CG1-SD 3.21Å; V104-M162 HydrophobicContact CG2-CE 3.97Å; V104-M162 HydrophobicContact CG2-SD 4.3Å; Q108-M162 HydrophobicContact CG-CE 4.06Å; Q108-M162 HydrophobicContact CG-CG 4.48Å; Q108-M162 HydrophobicContact CG-SD 4.48Å; Q108-M162 PolarHBondContact NE2-SD 2.86Å; E158-M162 WeakPolarHBondContact O-CG 3.49Å; E158-M162 PolarHBondContact O-N 2.84Å; Q159-M162 PolarHBondContact O-N 3.23Å; Q159-M162 VanDerWaalsContact O-N 3.12Å; Y160-M162 PolarHBondContact O-N 2.97Å
163	D	73.1	Confident	78.8	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	33%	0.326	S	S	.	.			trans	-145.8	95.6	175.7	-172.8	-0.3	0	0	0	110.8	Q159 K165 N166	Q159-D163 PolarHBondContact O-N 3.07Å; D163-K165 PolarHBondContact O-N 3.46Å; D163-K165 WeakPolarHBondContact OD1-CB 3.46Å; D163-K165 PolarHBondContact OD1-N 3.13Å; D163-N166 HydrophobicContact CB-CB 3.84Å; D163-N166 PolarHBondContact O-N 2.73Å; D163-N166 VanDerWaalsContact O-N 3.08Å; D163-N166 PolarHBondContact OD1-N 2.79Å
164	S	70.6	Confident	78.5	Confident	77 Å²	77	70.1 Å²	70.1	54%	0.538	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-17	174.4	62.5	0	0	0	0	114.5	Y160	Y160-S164 PolarHBondContact O-N 3.42Å
165	K	71.2	Confident	78.5	Confident	174 Å²	174	72.7 Å²	72.7	76%	0.757	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-9.8	-179.9	-62	-178.4	-179.3	178.1	0	113.3	D163 T167	D163-K165 PolarHBondContact O-N 3.46Å; D163-K165 WeakPolarHBondContact OD1-CB 3.46Å; D163-K165 PolarHBondContact OD1-N 3.13Å; K165-T167 VanDerWaalsContact C-N 3.32Å; K165-T167 PolarHBondContact O-N 3.37Å
166	N	75.5	Confident	78.5	Confident	42 Å²	42	76.4 Å²	76.4	23%	0.225	38%	0.377	C	S	.	.			trans	-75.4	85.2	179.5	-172.6	-15.4	0	0	0	111	Q159 D163 H168 D169 M170	Q159-N166 PolarHBondContact NE2-ND2 3.33Å; Q159-N166 VanDerWaalsContact NE2-ND2 3.17Å; D163-N166 HydrophobicContact CB-CB 3.84Å; D163-N166 PolarHBondContact O-N 2.73Å; D163-N166 VanDerWaalsContact O-N 3.08Å; D163-N166 PolarHBondContact OD1-N 2.79Å; N166-H168 PolarHBondContact OD1-N 2.78Å; N166-D169 PolarHBondContact ND2-OD2 3.03Å; N166-D169 PolarHBondContact OD1-N 2.8Å; N166-M170 VanDerWaalsContact O-CG 3.25Å; N166-M170 WeakPolarHBondContact O-CG 3.45Å
167	T	74.1	Confident	78.4	Confident	100 Å²	100	76.3 Å²	76.3	61%	0.613	38%	0.376	S	S	*	.	H	α-helix	trans	-74.2	-24	179.5	36.2	0	0	0	0	113	K165 N171	K165-T167 VanDerWaalsContact C-N 3.32Å; K165-T167 PolarHBondContact O-N 3.37Å; T167-N171 VanDerWaalsContact O-CB 3.28Å; T167-N171 WeakPolarHBondContact O-CB 3.26Å; T167-N171 PolarHBondContact O-N 3.33Å; T167-N171 PolarHBondContact O-ND2 3.22Å; T167-N171 VanDerWaalsContact O-ND2 3.12Å
168	H	78.3	Confident	78.3	Confident	126 Å²	126	76.1 Å²	76.1	58%	0.583	38%	0.383	S	S	*	.	H	α-helix	trans	-66.9	-52.4	-179.1	-174.7	72.8	0	0	0	111.6	N166 M170 N171 L172	N166-H168 PolarHBondContact OD1-N 2.78Å; H168-M170 PolarHBondContact O-N 3.47Å; H168-N171 PolarHBondContact O-N 3Å; H168-L172 WeakPolarHBondContact NE2-CD1 3.24Å; H168-L172 PolarHBondContact O-N 3.26Å
169	D	76.6	Confident	78.4	Confident	58 Å²	58	79.3 Å²	79.3	31%	0.31	40%	0.401	S	S	.	.	H	α-helix	trans	-69.1	-36.2	-178.5	-67.1	-17.3	0	0	0	111.8	Q159 N166 N171 L172 I173	Q159-D169 HydrophobicContact CG-CB 4.15Å; Q159-D169 VanDerWaalsContact NE2-CB 3.28Å; Q159-D169 PolarHBondContact NE2-OD2 3.12Å; N166-D169 PolarHBondContact ND2-OD2 3.03Å; N166-D169 PolarHBondContact OD1-N 2.8Å; D169-N171 VanDerWaalsContact C-N 3.31Å; D169-N171 PolarHBondContact O-N 2.92Å; D169-L172 WeakPolarHBondContact O-CB 3.26Å; D169-L172 PolarHBondContact O-N 3Å; D169-I173 WeakPolarHBondContact O-CG1 3.39Å; D169-I173 PolarHBondContact O-N 3.49Å
170	M	78.8	Confident	78.5	Confident	32 Å²	32	77.5 Å²	77.5	16%	0.158	39%	0.393	C	S	.	.	H	α-helix	trans	-61	-40	172.6	-71	-67.6	-84.3	0	0	111.8	M156 Q159 N166 H168 H174 F235	M156-M170 HydrophobicContact CB-CE 4.15Å; M156-M170 HydrophobicContact CB-SD 4.19Å; M156-M170 HydrophobicContact CE-CE 3.7Å; M156-M170 HydrophobicContact CE-SD 4.29Å; M156-M170 HydrophobicContact CG-SD 4.49Å; Q159-M170 HydrophobicContact CB-SD 3.88Å; Q159-M170 HydrophobicContact CG-CG 4.06Å; Q159-M170 HydrophobicContact CG-SD 3.84Å; N166-M170 VanDerWaalsContact O-CG 3.25Å; N166-M170 WeakPolarHBondContact O-CG 3.45Å; H168-M170 PolarHBondContact O-N 3.47Å; M170-H174 WeakPolarHBondContact O-CB 3.49Å; M170-H174 PolarHBondContact O-N 3.48Å; M170-F235 HydrophobicContact CE-CE2 3.72Å; M170-F235 HydrophobicContact CE-CZ 4.27Å
171	N	81.1	Confident	78.7	Confident	98 Å²	98	77.9 Å²	77.9	52%	0.524	40%	0.397	S	S	.	.	H	α-helix	trans	-71.4	-33.6	176	-74.4	-21	0	0	0	112.6	T167 H168 D169 H174 T175	T167-N171 VanDerWaalsContact O-CB 3.28Å; T167-N171 WeakPolarHBondContact O-CB 3.26Å; T167-N171 PolarHBondContact O-N 3.33Å; T167-N171 PolarHBondContact O-ND2 3.22Å; T167-N171 VanDerWaalsContact O-ND2 3.12Å; H168-N171 PolarHBondContact O-N 3Å; D169-N171 VanDerWaalsContact C-N 3.31Å; D169-N171 PolarHBondContact O-N 2.92Å; N171-H174 PolarHBondContact O-N 3.08Å; N171-T175 WeakPolarHBondContact O-CB 3.28Å; N171-T175 PolarHBondContact O-N 2.7Å; N171-T175 PolarHBondContact O-OG1 2.99Å
172	L	82.7	Confident	79	Confident	98 Å²	98	77.9 Å²	77.9	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-63.5	-48	175	-114.6	141.3	0	0	0	111.3	H168 D169 H174 T175 Y176	H168-L172 WeakPolarHBondContact NE2-CD1 3.24Å; H168-L172 PolarHBondContact O-N 3.26Å; D169-L172 WeakPolarHBondContact O-CB 3.26Å; D169-L172 PolarHBondContact O-N 3Å; L172-H174 VanDerWaalsContact C-N 3.34Å; L172-H174 PolarHBondContact O-N 2.97Å; L172-T175 PolarHBondContact O-N 3.45Å; L172-Y176 WeakPolarHBondContact O-CB 3.21Å; L172-Y176 PolarHBondContact O-N 3.38Å
173	I	80.8	Confident	79.9	Confident	32 Å²	32	75.3 Å²	75.3	16%	0.164	39%	0.388	C	S	.	.	H	α-helix	trans	-61.3	-45.7	174.3	-62.3	165.2	0	0	0	109.8	R152 L155 M156 Q159 D169 T175 Y176 F177	R152-I173 HydrophobicContact CG-CG2 4.25Å; L155-I173 HydrophobicContact CB-CD1 4.29Å; L155-I173 HydrophobicContact CB-CG2 4.49Å; M156-I173 HydrophobicContact CG-CB 4.27Å; M156-I173 HydrophobicContact CG-CG2 3.58Å; M156-I173 HydrophobicContact SD-CG2 4.41Å; Q159-I173 HydrophobicContact CB-CD1 4.36Å; D169-I173 WeakPolarHBondContact O-CG1 3.39Å; D169-I173 PolarHBondContact O-N 3.49Å; I173-T175 VanDerWaalsContact C-N 3.32Å; I173-T175 PolarHBondContact O-N 2.88Å; I173-Y176 PolarHBondContact O-N 2.95Å; I173-F177 HydrophobicContact CG2-CD2 3.96Å; I173-F177 HydrophobicContact CG2-CE2 4.18Å; I173-F177 VanDerWaalsContact O-CD2 3.25Å; I173-F177 WeakPolarHBondContact O-CD2 3.46Å; I173-F177 PolarHBondContact O-N 3.48Å
174	H	80.9	Confident	80.8	Confident	95 Å²	95	72.2 Å²	72.2	44%	0.44	37%	0.373	S	S	.	.	H	α-helix	trans	-58.7	-42.7	177.5	-175.8	-84	0	0	0	112.6	M170 N171 L172 F177 G178	M170-H174 WeakPolarHBondContact O-CB 3.49Å; M170-H174 PolarHBondContact O-N 3.48Å; N171-H174 PolarHBondContact O-N 3.08Å; L172-H174 VanDerWaalsContact C-N 3.34Å; L172-H174 PolarHBondContact O-N 2.97Å; H174-F177 CarbonylContact O-C 3.59Å; H174-F177 PolarHBondContact O-N 3.37Å; H174-G178 PolarHBondContact O-N 2.98Å; H174-G178 VanDerWaalsContact O-N 3.1Å
175	T	82.4	Confident	81.8	Confident	109 Å²	109	73 Å²	73	67%	0.669	37%	0.368	S	S	*	.	H	α-helix	trans	-69.4	-43.6	-178.8	-54.9	0	0	0	0	111.5	N171 L172 I173 F177 G178	N171-T175 WeakPolarHBondContact O-CB 3.28Å; N171-T175 PolarHBondContact O-N 2.7Å; N171-T175 PolarHBondContact O-OG1 2.99Å; L172-T175 PolarHBondContact O-N 3.45Å; I173-T175 VanDerWaalsContact C-N 3.32Å; I173-T175 PolarHBondContact O-N 2.88Å; T175-F177 VanDerWaalsContact C-N 3.28Å; T175-F177 PolarHBondContact O-N 3.08Å; T175-G178 PolarHBondContact O-N 3.32Å; T175-G178 VanDerWaalsContact O-N 3.09Å
176	Y	81.9	Confident	82.7	Confident	108 Å²	108	67.8 Å²	67.8	42%	0.424	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-40.7	177.3	-172.2	-97.6	0	0	0	111.8	I119 V122 L172 I173 G178	I119-Y176 HydrophobicContact CG2-CE1 4.18Å; I119-Y176 PolarHBondContact O-OH 3.28Å; V122-Y176 HydrophobicContact CB-CE1 4.09Å; V122-Y176 HydrophobicContact CG2-CE1 3.82Å; L172-Y176 WeakPolarHBondContact O-CB 3.21Å; L172-Y176 PolarHBondContact O-N 3.38Å; I173-Y176 PolarHBondContact O-N 2.95Å; Y176-G178 VanDerWaalsContact C-N 3.31Å; Y176-G178 PolarHBondContact O-N 2.97Å
177	F	82.3	Confident	83.6	Confident	8 Å²	8	65.9 Å²	65.9	4%	0.035	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	8.9	178.6	-70	-106.9	0	0	0	113.5	V122 R152 L155 I173 H174 T175 N179 M180	V122-F177 HydrophobicContact CG2-CE1 4.22Å; V122-F177 HydrophobicContact CG2-CZ 4.41Å; R152-F177 HydrophobicContact CB-CB 4.42Å; R152-F177 HydrophobicContact CB-CD1 3.43Å; R152-F177 VanDerWaalsContact CB-CD1 3.43Å; R152-F177 HydrophobicContact CB-CD2 4.44Å; R152-F177 HydrophobicContact CB-CE1 3.8Å; R152-F177 HydrophobicContact CB-CG 3.88Å; R152-F177 HydrophobicContact CB-CZ 4.41Å; R152-F177 HydrophobicContact CG-CB 3.83Å; R152-F177 HydrophobicContact CG-CD1 3.78Å; R152-F177 HydrophobicContact CG-CD2 4.11Å; R152-F177 HydrophobicContact CG-CE1 4.47Å; R152-F177 HydrophobicContact CG-CG 3.66Å; L155-F177 HydrophobicContact CD1-CE2 4.1Å; L155-F177 HydrophobicContact CD1-CZ 4.01Å; I173-F177 HydrophobicContact CG2-CD2 3.96Å; I173-F177 HydrophobicContact CG2-CE2 4.18Å; I173-F177 VanDerWaalsContact O-CD2 3.25Å; I173-F177 WeakPolarHBondContact O-CD2 3.46Å; I173-F177 PolarHBondContact O-N 3.48Å; H174-F177 CarbonylContact O-C 3.59Å; H174-F177 PolarHBondContact O-N 3.37Å; T175-F177 VanDerWaalsContact C-N 3.28Å; T175-F177 PolarHBondContact O-N 3.08Å; F177-N179 VanDerWaalsContact C-N 3.31Å; F177-N179 PolarHBondContact O-N 3.18Å; F177-M180 HydrophobicContact CB-CE 3.46Å; F177-M180 VanDerWaalsContact CB-CE 3.46Å; F177-M180 HydrophobicContact CB-SD 4.07Å; F177-M180 HydrophobicContact CD1-CE 3.16Å; F177-M180 HydrophobicContact CD1-SD 3.38Å; F177-M180 WeakPolarHBondContact CD1-SD 2.96Å; F177-M180 HydrophobicContact CE1-CE 4.04Å; F177-M180 HydrophobicContact CE1-SD 4.23Å; F177-M180 HydrophobicContact CG-CE 3.57Å; F177-M180 HydrophobicContact CG-SD 4.17Å; F177-M180 WeakPolarHBondContact O-CB 3.37Å; F177-M180 WeakPolarHBondContact O-CE 3.29Å; F177-M180 PolarHBondContact O-N 3.33Å; F177-M180 VanDerWaalsContact O-N 3.09Å
178	G	79.8	Confident	84.5	Confident	27 Å²	27	61.6 Å²	61.6	28%	0.278	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-31.4	-171.7	0	0	0	0	0	115.1	H174 T175 Y176 M180 Q181	H174-G178 PolarHBondContact O-N 2.98Å; H174-G178 VanDerWaalsContact O-N 3.1Å; T175-G178 PolarHBondContact O-N 3.32Å; T175-G178 VanDerWaalsContact O-N 3.09Å; Y176-G178 VanDerWaalsContact C-N 3.31Å; Y176-G178 PolarHBondContact O-N 2.97Å; G178-M180 PolarHBondContact O-N 2.93Å; G178-Q181 PolarHBondContact O-N 2.94Å
179	N	82.4	Confident	85.2	Confident	96 Å²	96	60.9 Å²	60.9	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-21	178.2	-71.9	-24.8	0	0	0	113.4	V126 F177 Q181 K182 L183	V126-N179 HydrophobicContact CG1-CB 4.35Å; F177-N179 VanDerWaalsContact C-N 3.31Å; F177-N179 PolarHBondContact O-N 3.18Å; N179-Q181 VanDerWaalsContact C-N 3.32Å; N179-Q181 PolarHBondContact O-N 2.66Å; N179-K182 PolarHBondContact O-N 3.14Å; N179-L183 PolarHBondContact O-N 3.41Å; N179-L183 VanDerWaalsContact O-N 3.16Å
180	M	84.4	Confident	86.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.6	-30.5	175.4	-83.7	152.1	-99.3	0	0	113.3	V122 V126 L145 L148 F177 G178 K182 L183 S184	V122-M180 HydrophobicContact CG1-CE 3.4Å; V122-M180 VanDerWaalsContact CG1-CE 3.4Å; V126-M180 HydrophobicContact CG2-CG 4.26Å; L145-M180 HydrophobicContact CD1-CB 4.26Å; L145-M180 HydrophobicContact CD1-CG 4.24Å; L148-M180 HydrophobicContact CB-CG 4.19Å; L148-M180 HydrophobicContact CB-SD 3.53Å; L148-M180 VanDerWaalsContact CB-SD 3.53Å; L148-M180 HydrophobicContact CD1-CG 3.99Å; L148-M180 HydrophobicContact CD1-SD 4.1Å; L148-M180 HydrophobicContact CG-SD 4.35Å; F177-M180 HydrophobicContact CB-CE 3.46Å; F177-M180 VanDerWaalsContact CB-CE 3.46Å; F177-M180 HydrophobicContact CB-SD 4.07Å; F177-M180 HydrophobicContact CD1-CE 3.16Å; F177-M180 HydrophobicContact CD1-SD 3.38Å; F177-M180 WeakPolarHBondContact CD1-SD 2.96Å; F177-M180 HydrophobicContact CE1-CE 4.04Å; F177-M180 HydrophobicContact CE1-SD 4.23Å; F177-M180 HydrophobicContact CG-CE 3.57Å; F177-M180 HydrophobicContact CG-SD 4.17Å; F177-M180 WeakPolarHBondContact O-CB 3.37Å; F177-M180 WeakPolarHBondContact O-CE 3.29Å; F177-M180 PolarHBondContact O-N 3.33Å; F177-M180 VanDerWaalsContact O-N 3.09Å; G178-M180 PolarHBondContact O-N 2.93Å; M180-K182 VanDerWaalsContact C-N 3.32Å; M180-K182 PolarHBondContact O-N 3.48Å; M180-L183 PolarHBondContact O-N 2.92Å; M180-S184 WeakPolarHBondContact O-CB 3.25Å; M180-S184 PolarHBondContact O-N 2.87Å
181	Q	84.9	Confident	86.8	Confident	82 Å²	82	59.2 Å²	59.2	38%	0.383	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-45.7	177.3	-177.4	59.7	30.1	0	0	110.2	G178 N179 L183 S184 E185	G178-Q181 PolarHBondContact O-N 2.94Å; N179-Q181 VanDerWaalsContact C-N 3.32Å; N179-Q181 PolarHBondContact O-N 2.66Å; Q181-L183 VanDerWaalsContact C-N 3.35Å; Q181-L183 PolarHBondContact O-N 3.49Å; Q181-S184 PolarHBondContact O-N 3.24Å; Q181-E185 WeakPolarHBondContact CG-OE1 3.33Å; Q181-E185 PolarHBondContact NE2-OE1 3.17Å; Q181-E185 WeakPolarHBondContact O-CG 3.47Å; Q181-E185 PolarHBondContact O-N 3.36Å
182	K	87.4	Confident	87.5	Confident	140 Å²	140	56.7 Å²	56.7	61%	0.609	28%	0.279	S	S	*	.	H	α-helix	trans	-60.4	-43.8	174.6	-64	178.4	-179	173.1	0	111.8	N179 M180 E185 E186	N179-K182 PolarHBondContact O-N 3.14Å; M180-K182 VanDerWaalsContact C-N 3.32Å; M180-K182 PolarHBondContact O-N 3.48Å; K182-E185 PolarHBondContact O-N 3.21Å; K182-E186 PolarHBondContact O-N 3.46Å
183	L	89.4	Confident	88	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-41.3	177.7	-174.6	68.6	0	0	0	112.1	V126 A129 Q130 I133 L145 N179 M180 Q181 E185 E186 L187	V126-L183 HydrophobicContact CG1-CD2 4.41Å; A129-L183 HydrophobicContact CB-CD1 4.24Å; A129-L183 HydrophobicContact CB-CD2 3.59Å; A129-L183 HydrophobicContact CB-CG 4.44Å; Q130-L183 HydrophobicContact CB-CD1 4.03Å; I133-L183 HydrophobicContact CD1-CD1 3.46Å; I133-L183 VanDerWaalsContact CD1-CD1 3.46Å; I133-L183 HydrophobicContact CD1-CG 4.18Å; L145-L183 HydrophobicContact CD1-CB 4.42Å; L145-L183 HydrophobicContact CD1-CD2 3.98Å; L145-L183 HydrophobicContact CD1-CG 4.31Å; N179-L183 PolarHBondContact O-N 3.41Å; N179-L183 VanDerWaalsContact O-N 3.16Å; M180-L183 PolarHBondContact O-N 2.92Å; Q181-L183 VanDerWaalsContact C-N 3.35Å; Q181-L183 PolarHBondContact O-N 3.49Å; L183-E185 VanDerWaalsContact C-N 3.31Å; L183-E185 PolarHBondContact O-N 3.28Å; L183-E186 PolarHBondContact O-N 3.41Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 PolarHBondContact O-N 3.02Å
184	S	90.8	Very high	88.7	Confident	8 Å²	8	54.9 Å²	54.9	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-36.6	174.6	-176.9	0	0	0	0	112	M180 Q181 A188 K242	M180-S184 WeakPolarHBondContact O-CB 3.25Å; M180-S184 PolarHBondContact O-N 2.87Å; Q181-S184 PolarHBondContact O-N 3.24Å; S184-A188 VanDerWaalsContact O-CB 3.28Å; S184-A188 WeakPolarHBondContact O-CB 3.36Å; S184-A188 PolarHBondContact O-N 3.03Å; S184-K242 PolarHBondContact OG-NZ 3.42Å
185	E	91.6	Very high	89.3	Confident	93 Å²	93	50.5 Å²	50.5	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-41.5	175.6	-74.4	166.2	-166.3	0	0	111.5	Q181 K182 L183 A188 K189	Q181-E185 WeakPolarHBondContact CG-OE1 3.33Å; Q181-E185 PolarHBondContact NE2-OE1 3.17Å; Q181-E185 WeakPolarHBondContact O-CG 3.47Å; Q181-E185 PolarHBondContact O-N 3.36Å; K182-E185 PolarHBondContact O-N 3.21Å; L183-E185 VanDerWaalsContact C-N 3.31Å; L183-E185 PolarHBondContact O-N 3.28Å; E185-A188 PolarHBondContact O-N 2.87Å; E185-K189 WeakPolarHBondContact O-CG 3.43Å; E185-K189 PolarHBondContact O-N 3.5Å
186	E	91.4	Very high	89.8	Confident	66 Å²	66	50.4 Å²	50.4	31%	0.308	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-42.8	177.9	-162.2	54.9	-137.1	0	0	111.9	I133 K182 L183 A188 K189 Q190	I133-E186 HydrophobicContact CG2-CG 4.34Å; K182-E186 PolarHBondContact O-N 3.46Å; L183-E186 PolarHBondContact O-N 3.41Å; E186-A188 VanDerWaalsContact C-N 3.32Å; E186-A188 PolarHBondContact O-N 2.77Å; E186-K189 PolarHBondContact O-N 3.21Å; E186-K189 IonicContact OE2-NZ 2.64Å; E186-K189 PolarHBondContact OE2-NZ 3.28Å; E186-Q190 PolarHBondContact O-N 3.36Å; E186-Q190 VanDerWaalsContact O-N 3.15Å
187	L	93.6	Very high	90.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-57.4	-48.4	170.9	-179.8	64.7	0	0	0	110.2	I133 L138 A141 H142 L145 L183 K189 Q190 L191 W244	I133-L187 HydrophobicContact CD1-CB 3.87Å; I133-L187 HydrophobicContact CD1-CD1 4.41Å; I133-L187 HydrophobicContact CG1-CB 4.45Å; I133-L187 HydrophobicContact CG1-CD1 4.1Å; L138-L187 HydrophobicContact CB-CD1 4.31Å; L138-L187 HydrophobicContact CD2-CD1 4.06Å; A141-L187 HydrophobicContact CB-CD1 4.41Å; H142-L187 HydrophobicContact CB-CD2 4.01Å; L145-L187 HydrophobicContact CD2-CD2 3.84Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 PolarHBondContact O-N 3.02Å; L187-K189 VanDerWaalsContact C-N 3.32Å; L187-K189 PolarHBondContact O-N 2.89Å; L187-Q190 PolarHBondContact O-N 3.36Å; L187-Q190 VanDerWaalsContact O-N 3.14Å; L187-L191 HydrophobicContact CG-CD1 4.42Å; L187-L191 HydrophobicContact CG-CG 4.47Å; L187-L191 WeakPolarHBondContact O-CG 3.21Å; L187-L191 PolarHBondContact O-N 3.46Å; L187-W244 HydrophobicContact CD2-CH2 4.37Å
188	A	93.4	Very high	90.8	Very high	10 Å²	10	52.7 Å²	52.7	8%	0.083	25%	0.25	C	C	.	.	H	α-helix	trans	-58.8	-41.9	179.3	0	0	0	0	0	112.1	S184 E185 E186 Q190 L191 W192 W244	S184-A188 VanDerWaalsContact O-CB 3.28Å; S184-A188 WeakPolarHBondContact O-CB 3.36Å; S184-A188 PolarHBondContact O-N 3.03Å; E185-A188 PolarHBondContact O-N 2.87Å; E186-A188 VanDerWaalsContact C-N 3.32Å; E186-A188 PolarHBondContact O-N 2.77Å; A188-Q190 VanDerWaalsContact C-N 3.34Å; A188-Q190 PolarHBondContact O-N 2.83Å; A188-L191 WeakPolarHBondContact O-CB 3.37Å; A188-L191 PolarHBondContact O-N 3.29Å; A188-W192 HydrophobicContact CB-CZ2 4.41Å; A188-W192 PolarHBondContact O-N 3.17Å; A188-W192 PolarHBondContact O-NE1 2.97Å; A188-W244 HydrophobicContact CB-CZ2 4.18Å
189	K	93.8	Very high	91.3	Very high	112 Å²	112	52 Å²	52	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-57.6	-44.8	174.7	-71.3	175.7	-161.2	161	0	112.1	E185 E186 L187 W192 M193	E185-K189 WeakPolarHBondContact O-CG 3.43Å; E185-K189 PolarHBondContact O-N 3.5Å; E186-K189 PolarHBondContact O-N 3.21Å; E186-K189 IonicContact OE2-NZ 2.64Å; E186-K189 PolarHBondContact OE2-NZ 3.28Å; L187-K189 VanDerWaalsContact C-N 3.32Å; L187-K189 PolarHBondContact O-N 2.89Å; K189-W192 PolarHBondContact O-N 3.32Å; K189-M193 PolarHBondContact O-N 2.99Å
190	Q	93.8	Very high	91.7	Very high	54 Å²	54	50.8 Å²	50.8	25%	0.252	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-41.9	176.8	-64	-55.4	-37.2	0	0	111.8	I133 L138 E186 L187 A188 W192 M193 V194	I133-Q190 HydrophobicContact CG2-CG 3.56Å; L138-Q190 HydrophobicContact CD2-CB 3.94Å; E186-Q190 PolarHBondContact O-N 3.36Å; E186-Q190 VanDerWaalsContact O-N 3.15Å; L187-Q190 PolarHBondContact O-N 3.36Å; L187-Q190 VanDerWaalsContact O-N 3.14Å; A188-Q190 VanDerWaalsContact C-N 3.34Å; A188-Q190 PolarHBondContact O-N 2.83Å; Q190-W192 VanDerWaalsContact C-N 3.34Å; Q190-W192 PolarHBondContact O-N 2.77Å; Q190-M193 PolarHBondContact O-N 3.16Å; Q190-V194 WeakPolarHBondContact O-CG2 3.32Å; Q190-V194 PolarHBondContact O-N 3.15Å; Q190-V194 VanDerWaalsContact O-N 3.12Å
191	L	94.8	Very high	92.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.8	-46.7	174.3	-59.7	177.3	0	0	0	111.1	L138 L187 A188 M193 V194 V195 V212 I215 W244	L138-L191 HydrophobicContact CD1-CD2 4Å; L187-L191 HydrophobicContact CG-CD1 4.42Å; L187-L191 HydrophobicContact CG-CG 4.47Å; L187-L191 WeakPolarHBondContact O-CG 3.21Å; L187-L191 PolarHBondContact O-N 3.46Å; A188-L191 WeakPolarHBondContact O-CB 3.37Å; A188-L191 PolarHBondContact O-N 3.29Å; L191-M193 PolarHBondContact O-N 3.43Å; L191-V194 PolarHBondContact O-N 3.18Å; L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.45Å; L191-V195 PolarHBondContact O-N 3.25Å; L191-V212 HydrophobicContact CB-CG1 4.12Å; L191-V212 HydrophobicContact CD2-CB 4.13Å; L191-V212 HydrophobicContact CD2-CG1 3.9Å; L191-V212 HydrophobicContact CD2-CG2 3.72Å; L191-I215 HydrophobicContact CD1-CG2 3.89Å; L191-I215 HydrophobicContact CD2-CD1 3.83Å; L191-I215 HydrophobicContact CD2-CG2 4.43Å; L191-W244 HydrophobicContact CD1-CE3 3.76Å; L191-W244 HydrophobicContact CD1-CH2 4.17Å; L191-W244 HydrophobicContact CD1-CZ3 3.46Å; L191-W244 VanDerWaalsContact CD1-CZ3 3.46Å
192	W	95.6	Very high	92.4	Very high	46 Å²	46	47.9 Å²	47.9	17%	0.174	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-36	-179.7	-51.8	143.1	0	0	0	113	A188 K189 Q190 V194 V195 Q196 I216 W244 K247 M248 V251	A188-W192 HydrophobicContact CB-CZ2 4.41Å; A188-W192 PolarHBondContact O-N 3.17Å; A188-W192 PolarHBondContact O-NE1 2.97Å; K189-W192 PolarHBondContact O-N 3.32Å; Q190-W192 VanDerWaalsContact C-N 3.34Å; Q190-W192 PolarHBondContact O-N 2.77Å; W192-V194 VanDerWaalsContact C-N 3.33Å; W192-V194 PolarHBondContact O-N 3.41Å; W192-V195 HydrophobicContact CE3-CG2 4.47Å; W192-V195 PolarHBondContact O-N 3.38Å; W192-Q196 VanDerWaalsContact O-CB 3.29Å; W192-Q196 WeakPolarHBondContact O-CB 3.27Å; W192-Q196 PolarHBondContact O-N 2.85Å; W192-I216 HydrophobicContact CZ3-CD1 4.28Å; W192-W244 HydrophobicContact CH2-CB 3.98Å; W192-W244 HydrophobicContact CH2-CD2 4.47Å; W192-W244 HydrophobicContact CH2-CG 4.01Å; W192-W244 HydrophobicContact CZ2-CG 4.21Å; W192-K247 HydrophobicContact CH2-CB 3.81Å; W192-K247 HydrophobicContact CZ2-CB 3.82Å; W192-K247 HydrophobicContact CZ2-CD 4.1Å; W192-K247 HydrophobicContact CZ3-CB 4.48Å; W192-M248 HydrophobicContact CZ3-CB 4.02Å; W192-V251 HydrophobicContact CB-CG2 4.25Å; W192-V251 HydrophobicContact CD2-CG2 4.24Å; W192-V251 HydrophobicContact CE3-CG2 4.28Å; W192-V251 HydrophobicContact CG-CG2 4.2Å
193	M	93.6	Very high	92.6	Very high	73 Å²	73	46.3 Å²	46.3	36%	0.36	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-42.4	172.6	-106.4	-164.9	-71.9	0	0	112.2	K189 Q190 L191 R197	K189-M193 PolarHBondContact O-N 2.99Å; Q190-M193 PolarHBondContact O-N 3.16Å; L191-M193 PolarHBondContact O-N 3.43Å; M193-R197 PolarHBondContact O-N 3.16Å
194	V	93.6	Very high	92.7	Very high	18 Å²	18	56.4 Å²	56.4	11%	0.109	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-42.6	177.2	174.2	0	0	0	0	111	L138 Q190 L191 W192 R197 S198 T201 L208 L209 V212	L138-V194 HydrophobicContact CD1-CG2 4.44Å; Q190-V194 WeakPolarHBondContact O-CG2 3.32Å; Q190-V194 PolarHBondContact O-N 3.15Å; Q190-V194 VanDerWaalsContact O-N 3.12Å; L191-V194 PolarHBondContact O-N 3.18Å; W192-V194 VanDerWaalsContact C-N 3.33Å; W192-V194 PolarHBondContact O-N 3.41Å; V194-R197 CarbonylContact O-C 3.58Å; V194-R197 PolarHBondContact O-N 3.15Å; V194-S198 WeakPolarHBondContact O-CA 3.34Å; V194-S198 PolarHBondContact O-N 2.83Å; V194-T201 HydrophobicContact CG1-CG2 4.16Å; V194-L208 HydrophobicContact CG1-CD2 4.34Å; V194-L208 HydrophobicContact CG1-CG 4.09Å; V194-L208 HydrophobicContact CG2-CD2 3.98Å; V194-L208 HydrophobicContact CG2-CG 4.18Å; V194-L209 HydrophobicContact CG1-CD1 4.33Å; V194-V212 HydrophobicContact CB-CG2 3.95Å; V194-V212 HydrophobicContact CG1-CG2 3.72Å; V194-V212 HydrophobicContact CG2-CG2 4.32Å
195	V	94	Very high	92.7	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-42.4	177.7	174.1	0	0	0	0	111.5	L191 W192 R197 S198 V212 M248 V251 L252	L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.45Å; L191-V195 PolarHBondContact O-N 3.25Å; W192-V195 HydrophobicContact CE3-CG2 4.47Å; W192-V195 PolarHBondContact O-N 3.38Å; V195-R197 PolarHBondContact O-N 3.46Å; V195-S198 WeakPolarHBondContact O-CB 3.23Å; V195-S198 PolarHBondContact O-N 3.13Å; V195-S198 PolarHBondContact O-OG 3.4Å; V195-V212 HydrophobicContact CG2-CG1 3.84Å; V195-M248 HydrophobicContact CG1-CG 3.91Å; V195-M248 HydrophobicContact CG2-CG 4.04Å; V195-V251 HydrophobicContact CB-CG1 4.22Å; V195-V251 HydrophobicContact CG1-CB 4.24Å; V195-V251 HydrophobicContact CG1-CG1 3.89Å; V195-L252 HydrophobicContact CG1-CD1 4.47Å; V195-L252 HydrophobicContact CG1-CD2 3.61Å; V195-L252 HydrophobicContact CG1-CG 3.65Å
196	Q	93.8	Very high	92.6	Very high	107 Å²	107	57.3 Å²	57.3	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-29.2	176	-174.9	177.5	9.6	0	0	112	W192 V251 T255	W192-Q196 VanDerWaalsContact O-CB 3.29Å; W192-Q196 WeakPolarHBondContact O-CB 3.27Å; W192-Q196 PolarHBondContact O-N 2.85Å; Q196-V251 HydrophobicContact CB-CG1 4.23Å; Q196-T255 WeakPolarHBondContact CA-OG1 3.36Å; Q196-T255 HydrophobicContact CG-CG2 4.2Å; Q196-T255 WeakPolarHBondContact O-CG2 3.43Å
197	R	92.2	Very high	92.6	Very high	158 Å²	158	58.6 Å²	58.6	60%	0.596	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	14.4	175.8	-63.5	179	-178.5	173	1.8	112.8	M193 V194 V195 L199 V200 T201	M193-R197 PolarHBondContact O-N 3.16Å; V194-R197 CarbonylContact O-C 3.58Å; V194-R197 PolarHBondContact O-N 3.15Å; V195-R197 PolarHBondContact O-N 3.46Å; R197-L199 VanDerWaalsContact C-N 3.3Å; R197-L199 PolarHBondContact O-N 3.23Å; R197-L199 VanDerWaalsContact O-N 3.11Å; R197-V200 CarbonylContact O-C 3.37Å; R197-V200 WeakPolarHBondContact O-CA 3.37Å; R197-V200 PolarHBondContact O-N 2.85Å; R197-T201 PolarHBondContact O-N 3.03Å; R197-T201 PolarHBondContact O-OG1 3.12Å
198	S	92.4	Very high	92.5	Very high	6 Å²	6	60.8 Å²	60.8	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-48.2	-45.3	-169.7	49.2	0	0	0	0	114.2	V194 V195 V200 T201 V202	V194-S198 WeakPolarHBondContact O-CA 3.34Å; V194-S198 PolarHBondContact O-N 2.83Å; V195-S198 WeakPolarHBondContact O-CB 3.23Å; V195-S198 PolarHBondContact O-N 3.13Å; V195-S198 PolarHBondContact O-OG 3.4Å; S198-V200 PolarHBondContact O-N 3.39Å; S198-T201 PolarHBondContact O-N 3.31Å; S198-V202 WeakPolarHBondContact O-CB 3.34Å; S198-V202 PolarHBondContact O-N 3.25Å
199	L	90.6	Very high	92.5	Very high	13 Å²	13	60.3 Å²	60.3	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-67.3	-31.3	179	-65.8	170.6	0	0	0	113.7	R197 R203 D289 V292 A293 L297 Y315	R197-L199 VanDerWaalsContact C-N 3.3Å; R197-L199 PolarHBondContact O-N 3.23Å; R197-L199 VanDerWaalsContact O-N 3.11Å; L199-R203 WeakPolarHBondContact O-CG 3.42Å; L199-D289 HydrophobicContact CD1-CB 3.8Å; L199-V292 HydrophobicContact CD2-CG1 4.32Å; L199-A293 HydrophobicContact CD2-CB 4.34Å; L199-L297 HydrophobicContact CD2-CD2 4.2Å; L199-Y315 WeakPolarHBondContact CD1-OH 3.44Å
200	V	91.8	Very high	92.5	Very high	69 Å²	69	57.3 Å²	57.3	42%	0.418	27%	0.273	S	S	.	.	H	α-helix	trans	-81.6	-41.5	174.7	-179.3	0	0	0	0	110.4	R197 S198 V202 R203 R204	R197-V200 CarbonylContact O-C 3.37Å; R197-V200 WeakPolarHBondContact O-CA 3.37Å; R197-V200 PolarHBondContact O-N 2.85Å; S198-V200 PolarHBondContact O-N 3.39Å; V200-V202 VanDerWaalsContact C-N 3.35Å; V200-V202 PolarHBondContact O-N 3.34Å; V200-R203 PolarHBondContact O-N 3Å; V200-R204 PolarHBondContact O-N 3.31Å
201	T	91.3	Very high	92.5	Very high	19 Å²	19	56 Å²	56	12%	0.117	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-45.1	178	-56.2	0	0	0	0	110.4	V194 R197 S198 R203 R204 D205 L208 L209	V194-T201 HydrophobicContact CG1-CG2 4.16Å; R197-T201 PolarHBondContact O-N 3.03Å; R197-T201 PolarHBondContact O-OG1 3.12Å; S198-T201 PolarHBondContact O-N 3.31Å; T201-R203 PolarHBondContact O-N 2.9Å; T201-R204 PolarHBondContact O-N 2.87Å; T201-D205 WeakPolarHBondContact CG2-O 3.23Å; T201-D205 CarbonylContact O-C 3.57Å; T201-D205 WeakPolarHBondContact O-CA 3.41Å; T201-D205 PolarHBondContact O-N 3.43Å; T201-L208 HydrophobicContact CG2-CB 4.27Å; T201-L208 HydrophobicContact CG2-CD2 4.15Å; T201-L208 HydrophobicContact CG2-CG 4.45Å; T201-L209 HydrophobicContact CG2-CB 4.39Å
202	V	92.4	Very high	92.5	Very high	3 Å²	3	56 Å²	56	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-26.6	-179.5	81.4	0	0	0	0	113	S198 V200 P206 L209 V292 L296 L297 C300	S198-V202 WeakPolarHBondContact O-CB 3.34Å; S198-V202 PolarHBondContact O-N 3.25Å; V200-V202 VanDerWaalsContact C-N 3.35Å; V200-V202 PolarHBondContact O-N 3.34Å; V202-P206 HydrophobicContact CG2-CB 4.31Å; V202-P206 WeakPolarHBondContact O-CG 3.38Å; V202-L209 HydrophobicContact CB-CD2 4.29Å; V202-L209 HydrophobicContact CG2-CD2 4.4Å; V202-V292 HydrophobicContact CG1-CG1 3.78Å; V202-L296 HydrophobicContact CB-CB 4.46Å; V202-L296 HydrophobicContact CG1-CB 3.9Å; V202-L296 HydrophobicContact CG1-CD1 4.44Å; V202-L296 HydrophobicContact CG2-CB 3.75Å; V202-L297 HydrophobicContact CB-CD1 4.39Å; V202-L297 HydrophobicContact CG1-CD1 4.47Å; V202-C300 VanDerWaalsContact CG2-SG 3.56Å
203	R	90.9	Very high	92.4	Very high	106 Å²	106	54 Å²	54	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-74.4	-31.4	174.1	-68.8	173.1	-177.8	173.8	-3.4	112.8	L199 V200 T201 D288 V292 L296	L199-R203 WeakPolarHBondContact O-CG 3.42Å; V200-R203 PolarHBondContact O-N 3Å; T201-R203 PolarHBondContact O-N 2.9Å; R203-D288 IonicContact CZ-OD2 2.8Å; R203-D288 IonicContact NH1-OD2 2.69Å; R203-D288 PolarHBondContact NH1-OD2 3.49Å; R203-D288 IonicContact NH2-OD1 2.91Å; R203-D288 PolarHBondContact NH2-OD1 3.3Å; R203-D288 IonicContact NH2-OD2 2.92Å; R203-D288 PolarHBondContact NH2-OD2 2.86Å; R203-V292 HydrophobicContact CG-CG1 4.06Å; R203-L296 HydrophobicContact CG-CD1 4.18Å
204	R	91.6	Very high	92.5	Very high	218 Å²	218	56.5 Å²	56.5	82%	0.823	27%	0.268	S	S	*	.	H	α-helix	trans	-97.8	-47.3	-174.6	-68.3	-173.9	176.6	-168	-0.4	113.2	V200 T201	V200-R204 PolarHBondContact O-N 3.31Å; T201-R204 PolarHBondContact O-N 2.87Å
205	D	89.6	Confident	92.6	Very high	65 Å²	65	55.6 Å²	55.6	35%	0.348	26%	0.262	S	S	.	.			trans	-150.4	88.4	-177.7	-178.1	8.5	0	0	0	111.2	T201 T207 L208	T201-D205 WeakPolarHBondContact CG2-O 3.23Å; T201-D205 CarbonylContact O-C 3.57Å; T201-D205 WeakPolarHBondContact O-CA 3.41Å; T201-D205 PolarHBondContact O-N 3.43Å; D205-T207 PolarHBondContact O-N 3.41Å; D205-T207 WeakPolarHBondContact OD1-CB 3.36Å; D205-T207 PolarHBondContact OD1-N 2.8Å; D205-T207 PolarHBondContact OD1-OG1 2.71Å; D205-L208 PolarHBondContact OD1-N 2.86Å; D205-L208 WeakPolarHBondContact OD2-CB 3.31Å
206	P	90.8	Very high	92.6	Very high	56 Å²	56	55.4 Å²	55.4	36%	0.364	26%	0.261	S	S	.	.	H	α-helix	trans	-58.7	-27.6	173.7	-19.2	26.8	0	0	0	113.7	V202 L208 L209 V210	V202-P206 HydrophobicContact CG2-CB 4.31Å; V202-P206 WeakPolarHBondContact O-CG 3.38Å; P206-L208 VanDerWaalsContact C-N 3.33Å; P206-L208 PolarHBondContact O-N 3.32Å; P206-L209 PolarHBondContact O-N 3.27Å; P206-V210 WeakPolarHBondContact O-CG2 3.43Å; P206-V210 PolarHBondContact O-N 3.38Å
207	T	90.9	Very high	92.7	Very high	92 Å²	92	53.1 Å²	53.1	56%	0.564	25%	0.25	S	S	*	.	H	α-helix	trans	-70	-33.2	-172.2	72.2	0	0	0	0	112	D205 S211	D205-T207 PolarHBondContact O-N 3.41Å; D205-T207 WeakPolarHBondContact OD1-CB 3.36Å; D205-T207 PolarHBondContact OD1-N 2.8Å; D205-T207 PolarHBondContact OD1-OG1 2.71Å; T207-S211 WeakPolarHBondContact O-CB 3.29Å; T207-S211 PolarHBondContact O-N 3.41Å; T207-S211 PolarHBondContact O-OG 3.19Å
208	L	91.6	Very high	92.7	Very high	47 Å²	47	50.3 Å²	50.3	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-44.8	173	-178.3	61.1	0	0	0	111.2	L138 V194 T201 D205 P206 S211 V212	L138-L208 HydrophobicContact CD1-CD1 4.12Å; V194-L208 HydrophobicContact CG1-CD2 4.34Å; V194-L208 HydrophobicContact CG1-CG 4.09Å; V194-L208 HydrophobicContact CG2-CD2 3.98Å; V194-L208 HydrophobicContact CG2-CG 4.18Å; T201-L208 HydrophobicContact CG2-CB 4.27Å; T201-L208 HydrophobicContact CG2-CD2 4.15Å; T201-L208 HydrophobicContact CG2-CG 4.45Å; D205-L208 PolarHBondContact OD1-N 2.86Å; D205-L208 WeakPolarHBondContact OD2-CB 3.31Å; P206-L208 VanDerWaalsContact C-N 3.33Å; P206-L208 PolarHBondContact O-N 3.32Å; L208-S211 WeakPolarHBondContact O-CB 3.48Å; L208-S211 PolarHBondContact O-N 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.46Å
209	L	93.3	Very high	92.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-44.7	178.5	-176.5	63.3	0	0	0	111.7	V194 T201 V202 P206 S211 V212 V213 L297 C300 F301	V194-L209 HydrophobicContact CG1-CD1 4.33Å; T201-L209 HydrophobicContact CG2-CB 4.39Å; V202-L209 HydrophobicContact CB-CD2 4.29Å; V202-L209 HydrophobicContact CG2-CD2 4.4Å; P206-L209 PolarHBondContact O-N 3.27Å; L209-S211 PolarHBondContact O-N 3.46Å; L209-V212 WeakPolarHBondContact O-CB 3.4Å; L209-V212 PolarHBondContact O-N 2.96Å; L209-V212 VanDerWaalsContact O-N 3.11Å; L209-V213 WeakPolarHBondContact O-CG2 3.46Å; L209-V213 PolarHBondContact O-N 3.01Å; L209-L297 HydrophobicContact CD2-CD1 3.41Å; L209-L297 VanDerWaalsContact CD2-CD1 3.41Å; L209-C300 HydrophobicContact CD2-CB 4.04Å; L209-C300 HydrophobicContact CG-CB 4.41Å; L209-F301 HydrophobicContact CD2-CE2 4.11Å
210	V	94.1	Very high	93	Very high	49 Å²	49	51.2 Å²	51.2	30%	0.297	24%	0.243	S	C	.	.	H	α-helix	trans	-57.8	-39.5	174.1	172.1	0	0	0	0	110.8	P206 V212 V213 R214 C300	P206-V210 WeakPolarHBondContact O-CG2 3.43Å; P206-V210 PolarHBondContact O-N 3.38Å; V210-V212 PolarHBondContact O-N 3.28Å; V210-V213 PolarHBondContact O-N 3.4Å; V210-R214 HydrophobicContact CG1-CG 4.27Å; V210-R214 WeakPolarHBondContact O-CB 3.49Å; V210-R214 WeakPolarHBondContact O-CG 3.46Å; V210-R214 PolarHBondContact O-N 2.93Å; V210-C300 HydrophobicContact CG2-CB 3.85Å
211	S	93.3	Very high	93	Very high	26 Å²	26	53.8 Å²	53.8	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-42.9	176.6	-62.3	0	0	0	0	112	L139 T207 L208 L209 R214 I215	L139-S211 WeakPolarHBondContact CD1-OG 3.42Å; T207-S211 WeakPolarHBondContact O-CB 3.29Å; T207-S211 PolarHBondContact O-N 3.41Å; T207-S211 PolarHBondContact O-OG 3.19Å; L208-S211 WeakPolarHBondContact O-CB 3.48Å; L208-S211 PolarHBondContact O-N 3.28Å; L209-S211 PolarHBondContact O-N 3.46Å; S211-R214 PolarHBondContact O-N 3.45Å; S211-I215 VanDerWaalsContact O-CG1 3.3Å; S211-I215 WeakPolarHBondContact O-CG1 3.21Å; S211-I215 PolarHBondContact O-N 3.29Å; S211-I215 VanDerWaalsContact O-N 3.11Å
212	V	94.8	Very high	93.1	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-48.1	174.6	171.9	0	0	0	0	111.8	L138 L191 V194 V195 L208 L209 V210 R214 I215 I216	L138-V212 HydrophobicContact CD1-CG2 3.94Å; L191-V212 HydrophobicContact CB-CG1 4.12Å; L191-V212 HydrophobicContact CD2-CB 4.13Å; L191-V212 HydrophobicContact CD2-CG1 3.9Å; L191-V212 HydrophobicContact CD2-CG2 3.72Å; V194-V212 HydrophobicContact CB-CG2 3.95Å; V194-V212 HydrophobicContact CG1-CG2 3.72Å; V194-V212 HydrophobicContact CG2-CG2 4.32Å; V195-V212 HydrophobicContact CG2-CG1 3.84Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.46Å; L209-V212 WeakPolarHBondContact O-CB 3.4Å; L209-V212 PolarHBondContact O-N 2.96Å; L209-V212 VanDerWaalsContact O-N 3.11Å; V210-V212 PolarHBondContact O-N 3.28Å; V212-R214 VanDerWaalsContact C-N 3.3Å; V212-R214 PolarHBondContact O-N 3.41Å; V212-I215 WeakPolarHBondContact O-CB 3.4Å; V212-I215 PolarHBondContact O-N 3.17Å; V212-I215 VanDerWaalsContact O-N 3.13Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 WeakPolarHBondContact O-CG1 3.47Å; V212-I216 PolarHBondContact O-N 2.8Å
213	V	94.5	Very high	93.1	Very high	5 Å²	5	54 Å²	54	3%	0.03	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-39.2	179.1	177.1	0	0	0	0	111.2	L209 V210 I215 I216 E217 F301	L209-V213 WeakPolarHBondContact O-CG2 3.46Å; L209-V213 PolarHBondContact O-N 3.01Å; V210-V213 PolarHBondContact O-N 3.4Å; V213-I215 VanDerWaalsContact C-N 3.33Å; V213-I215 PolarHBondContact O-N 3.48Å; V213-I216 PolarHBondContact O-N 2.91Å; V213-E217 PolarHBondContact O-N 2.92Å; V213-F301 HydrophobicContact CG1-CD1 4.07Å; V213-F301 HydrophobicContact CG1-CE1 4.41Å; V213-F301 HydrophobicContact CG2-CD1 3.87Å; V213-F301 HydrophobicContact CG2-CE1 3.51Å; V213-F301 HydrophobicContact CG2-CE2 4.25Å; V213-F301 HydrophobicContact CG2-CG 4.39Å; V213-F301 HydrophobicContact CG2-CZ 3.72Å
214	R	94.7	Very high	93.2	Very high	124 Å²	124	57.1 Å²	57.1	47%	0.468	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-37.8	175	-74.8	173.4	73	-174.7	7.1	112.8	L139 V210 S211 V212 R218	L139-R214 HydrophobicContact CD2-CB 4.39Å; V210-R214 HydrophobicContact CG1-CG 4.27Å; V210-R214 WeakPolarHBondContact O-CB 3.49Å; V210-R214 WeakPolarHBondContact O-CG 3.46Å; V210-R214 PolarHBondContact O-N 2.93Å; S211-R214 PolarHBondContact O-N 3.45Å; V212-R214 VanDerWaalsContact C-N 3.3Å; V212-R214 PolarHBondContact O-N 3.41Å; R214-R218 VanDerWaalsContact O-CG 3.29Å; R214-R218 WeakPolarHBondContact O-CG 3.28Å; R214-R218 PolarHBondContact O-N 2.82Å; R214-R218 VanDerWaalsContact O-N 3.13Å
215	I	95.2	Very high	93.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.6	-47.2	175.3	-69.9	164.1	0	0	0	109.7	L138 L139 H142 L191 S211 V212 V213 E217 R218 E219 W244	L138-I215 HydrophobicContact CB-CD1 3.84Å; L138-I215 WeakPolarHBondContact O-CD1 3.43Å; L139-I215 HydrophobicContact CD2-CG1 3.95Å; L139-I215 HydrophobicContact CG-CD1 4.42Å; L139-I215 HydrophobicContact CG-CG1 4.39Å; H142-I215 HydrophobicContact CB-CD1 3.98Å; H142-I215 HydrophobicContact CB-CG1 3.88Å; H142-I215 HydrophobicContact CB-CG2 4.24Å; L191-I215 HydrophobicContact CD1-CG2 3.89Å; L191-I215 HydrophobicContact CD2-CD1 3.83Å; L191-I215 HydrophobicContact CD2-CG2 4.43Å; S211-I215 VanDerWaalsContact O-CG1 3.3Å; S211-I215 WeakPolarHBondContact O-CG1 3.21Å; S211-I215 PolarHBondContact O-N 3.29Å; S211-I215 VanDerWaalsContact O-N 3.11Å; V212-I215 WeakPolarHBondContact O-CB 3.4Å; V212-I215 PolarHBondContact O-N 3.17Å; V212-I215 VanDerWaalsContact O-N 3.13Å; V213-I215 VanDerWaalsContact C-N 3.33Å; V213-I215 PolarHBondContact O-N 3.48Å; I215-E217 PolarHBondContact O-N 3.32Å; I215-R218 WeakPolarHBondContact O-CB 3.29Å; I215-R218 PolarHBondContact O-N 3.49Å; I215-E219 HydrophobicContact CG2-CG 4.48Å; I215-E219 WeakPolarHBondContact O-CG 3.03Å; I215-E219 PolarHBondContact O-N 3.11Å; I215-W244 HydrophobicContact CG2-CE3 4.25Å; I215-W244 HydrophobicContact CG2-CZ3 3.75Å
216	I	95.3	Very high	93.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-47.2	178.8	-65.2	166	0	0	0	111.1	W192 V212 V213 R218 E219 E220 W244 K245 M248	W192-I216 HydrophobicContact CZ3-CD1 4.28Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 WeakPolarHBondContact O-CG1 3.47Å; V212-I216 PolarHBondContact O-N 2.8Å; V213-I216 PolarHBondContact O-N 2.91Å; I216-R218 VanDerWaalsContact C-N 3.3Å; I216-R218 PolarHBondContact O-N 2.88Å; I216-E219 PolarHBondContact O-N 2.82Å; I216-E220 HydrophobicContact CG2-CG 4.46Å; I216-E220 WeakPolarHBondContact O-CG 3.5Å; I216-E220 PolarHBondContact O-N 3.36Å; I216-W244 HydrophobicContact CG1-CB 4.42Å; I216-W244 HydrophobicContact CG2-CB 4.28Å; I216-K245 HydrophobicContact CG2-CB 4.04Å; I216-M248 HydrophobicContact CD1-CB 3.97Å; I216-M248 HydrophobicContact CD1-CG 3.87Å; I216-M248 HydrophobicContact CD1-SD 3.6Å; I216-M248 VanDerWaalsContact CD1-SD 3.6Å
217	E	94.6	Very high	93.1	Very high	58 Å²	58	53.2 Å²	53.2	27%	0.271	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-38.3	177	-84.2	-68.9	102.9	0	0	113.1	V213 I215 K221 P302 H304 Y305	V213-E217 PolarHBondContact O-N 2.92Å; I215-E217 PolarHBondContact O-N 3.32Å; E217-K221 WeakPolarHBondContact O-CB 3.25Å; E217-K221 PolarHBondContact O-N 2.85Å; E217-K221 VanDerWaalsContact O-N 3.08Å; E217-P302 HydrophobicContact CG-CG 4.41Å; E217-H304 IonicContact OE1-NE2 2.6Å; E217-H304 IonicContact OE2-CE1 3.31Å; E217-H304 IonicContact OE2-NE2 2.93Å; E217-Y305 HydrophobicContact CG-CE2 4.21Å; E217-Y305 WeakPolarHBondContact OE1-CE2 3.48Å; E217-Y305 VanDerWaalsContact OE1-CZ 3.25Å; E217-Y305 PolarHBondContact OE1-OH 2.86Å
218	R	93.9	Very high	93.1	Very high	100 Å²	100	52.1 Å²	52.1	38%	0.377	23%	0.231	S	C	.	.	H	α-helix	trans	-65.8	-44.3	175.8	-76.8	173	176.2	177.3	-1.2	111.4	R214 I215 I216 K221 I222	R214-R218 VanDerWaalsContact O-CG 3.29Å; R214-R218 WeakPolarHBondContact O-CG 3.28Å; R214-R218 PolarHBondContact O-N 2.82Å; R214-R218 VanDerWaalsContact O-N 3.13Å; I215-R218 WeakPolarHBondContact O-CB 3.29Å; I215-R218 PolarHBondContact O-N 3.49Å; I216-R218 VanDerWaalsContact C-N 3.3Å; I216-R218 PolarHBondContact O-N 2.88Å; R218-K221 WeakPolarHBondContact O-CB 3.4Å; R218-K221 PolarHBondContact O-N 3.03Å; R218-I222 VanDerWaalsContact O-CG1 3.31Å; R218-I222 WeakPolarHBondContact O-CG1 3.2Å; R218-I222 PolarHBondContact O-N 3.08Å
219	E	94.3	Very high	92.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-42.3	178.9	-73.3	-72.4	157.5	0	0	112	H142 I215 I216 K221 I222 D223 R240 K242 W244	H142-E219 IonicContact CD2-OE1 2.71Å; H142-E219 IonicContact CE1-OE1 3.37Å; H142-E219 IonicContact NE2-OE1 3.9Å; H142-E219 PolarHBondContact NE2-OE1 3.31Å; I215-E219 HydrophobicContact CG2-CG 4.48Å; I215-E219 WeakPolarHBondContact O-CG 3.03Å; I215-E219 PolarHBondContact O-N 3.11Å; I216-E219 PolarHBondContact O-N 2.82Å; E219-K221 VanDerWaalsContact C-N 3.31Å; E219-K221 PolarHBondContact O-N 3.31Å; E219-I222 PolarHBondContact O-N 3.3Å; E219-D223 PolarHBondContact O-N 3.39Å; E219-R240 IonicContact OE1-NH2 2.68Å; E219-R240 IonicContact OE2-CZ 2.88Å; E219-R240 IonicContact OE2-NH1 3.63Å; E219-R240 PolarHBondContact OE2-NH1 2.85Å; E219-R240 IonicContact OE2-NH2 3.4Å; E219-R240 PolarHBondContact OE2-NH2 3.47Å; E219-K242 IonicContact OE1-NZ 3.7Å; E219-K242 WeakPolarHBondContact OE2-CD 3.2Å; E219-K242 IonicContact OE2-NZ 3.74Å; E219-W244 HydrophobicContact CB-CD2 4.43Å; E219-W244 HydrophobicContact CB-CE3 4.05Å; E219-W244 HydrophobicContact CG-CD2 4.29Å; E219-W244 HydrophobicContact CG-CE3 3.6Å; E219-W244 HydrophobicContact CG-CH2 4.39Å; E219-W244 HydrophobicContact CG-CZ3 3.65Å
220	E	93.7	Very high	92.6	Very high	38 Å²	38	56.8 Å²	56.8	18%	0.178	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-36	174	-70.1	-61	146.4	0	0	112.5	I216 D223 R224 K243 W244 K245	I216-E220 HydrophobicContact CG2-CG 4.46Å; I216-E220 WeakPolarHBondContact O-CG 3.5Å; I216-E220 PolarHBondContact O-N 3.36Å; E220-D223 PolarHBondContact O-N 2.87Å; E220-R224 WeakPolarHBondContact O-CB 3.45Å; E220-R224 PolarHBondContact O-N 3.25Å; E220-K243 VanDerWaalsContact OE1-C 3.29Å; E220-K243 WeakPolarHBondContact OE1-CA 3.42Å; E220-W244 PolarHBondContact OE1-N 2.89Å; E220-K245 HydrophobicContact CG-CB 3.68Å; E220-K245 WeakPolarHBondContact OE1-CB 3.41Å; E220-K245 PolarHBondContact OE1-N 2.8Å
221	K	93.2	Very high	92.4	Very high	123 Å²	123	62.3 Å²	62.3	54%	0.535	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-37.2	174.5	-169.6	175.1	-175.2	174.7	0	111.8	E217 R218 E219 R225	E217-K221 WeakPolarHBondContact O-CB 3.25Å; E217-K221 PolarHBondContact O-N 2.85Å; E217-K221 VanDerWaalsContact O-N 3.08Å; R218-K221 WeakPolarHBondContact O-CB 3.4Å; R218-K221 PolarHBondContact O-N 3.03Å; E219-K221 VanDerWaalsContact C-N 3.31Å; E219-K221 PolarHBondContact O-N 3.31Å; K221-R225 WeakPolarHBondContact O-CG 3.41Å; K221-R225 PolarHBondContact O-N 3.4Å
222	I	91.8	Very high	92.1	Very high	24 Å²	24	69 Å²	69	12%	0.123	30%	0.296	C	S	.	.	H	α-helix	trans	-67	-47.2	174.2	-65.9	162.7	0	0	0	109.8	M146 R218 E219 R224 R225 M226	M146-I222 HydrophobicContact CG-CD1 3.88Å; M146-I222 HydrophobicContact SD-CD1 3.89Å; R218-I222 VanDerWaalsContact O-CG1 3.31Å; R218-I222 WeakPolarHBondContact O-CG1 3.2Å; R218-I222 PolarHBondContact O-N 3.08Å; E219-I222 PolarHBondContact O-N 3.3Å; I222-R224 VanDerWaalsContact C-N 3.29Å; I222-R224 PolarHBondContact O-N 2.84Å; I222-R225 PolarHBondContact O-N 2.88Å; I222-R225 VanDerWaalsContact O-N 3.14Å; I222-M226 HydrophobicContact CG2-CE 4.41Å; I222-M226 HydrophobicContact CG2-CG 4.23Å; I222-M226 WeakPolarHBondContact O-CG 3.33Å; I222-M226 PolarHBondContact O-N 2.9Å
223	D	93.5	Very high	91.6	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-56	-43.9	177.3	-79.7	-7.6	0	0	0	111.4	E219 E220 M226 L227 R240 P241 K242 K243	E219-D223 PolarHBondContact O-N 3.39Å; E220-D223 PolarHBondContact O-N 2.87Å; D223-M226 PolarHBondContact O-N 3.5Å; D223-L227 WeakPolarHBondContact O-CB 3.43Å; D223-L227 VanDerWaalsContact O-CG 3.29Å; D223-L227 WeakPolarHBondContact O-CG 3.4Å; D223-L227 PolarHBondContact O-N 3.25Å; D223-R240 WeakPolarHBondContact OD1-CD 3.44Å; D223-R240 IonicContact OD1-CZ 3.75Å; D223-R240 IonicContact OD1-NE 3.59Å; D223-R240 IonicContact OD1-NH1 3.82Å; D223-R240 PolarHBondContact OD1-NH1 3.33Å; D223-P241 HydrophobicContact CB-CB 3.94Å; D223-P241 WeakPolarHBondContact OD1-CA 3.39Å; D223-P241 WeakPolarHBondContact OD2-CB 3.41Å; D223-K242 VanDerWaalsContact CG-N 3.35Å; D223-K242 PolarHBondContact OD1-N 3.5Å; D223-K242 PolarHBondContact OD2-N 2.94Å; D223-K243 PolarHBondContact OD2-N 2.75Å
224	R	92.2	Very high	91.1	Very high	170 Å²	170	72.8 Å²	72.8	64%	0.642	33%	0.328	S	S	*	.	H	α-helix	trans	-60.6	-47	176.2	-165.2	178.6	-56.7	164.2	6.3	112.4	E220 I222 M226 L227 D228	E220-R224 WeakPolarHBondContact O-CB 3.45Å; E220-R224 PolarHBondContact O-N 3.25Å; I222-R224 VanDerWaalsContact C-N 3.29Å; I222-R224 PolarHBondContact O-N 2.84Å; R224-M226 VanDerWaalsContact C-N 3.32Å; R224-M226 PolarHBondContact O-N 3.31Å; R224-L227 PolarHBondContact O-N 3.5Å; R224-D228 PolarHBondContact O-N 3.33Å
225	R	90.2	Very high	90.7	Very high	160 Å²	160	67.4 Å²	67.4	60%	0.604	31%	0.308	S	S	*	.	H	α-helix	trans	-60.6	-41.8	176.7	-71.2	172.6	-178.3	178.9	-3	111.8	K221 I222 D228 R229	K221-R225 WeakPolarHBondContact O-CG 3.41Å; K221-R225 PolarHBondContact O-N 3.4Å; I222-R225 PolarHBondContact O-N 2.88Å; I222-R225 VanDerWaalsContact O-N 3.14Å; R225-D228 PolarHBondContact O-N 2.87Å; R225-R229 WeakPolarHBondContact O-CB 3.33Å; R225-R229 PolarHBondContact O-N 2.92Å
226	M	88.9	Confident	90.3	Very high	27 Å²	27	70 Å²	70	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-37.2	179.3	-67.3	-56.8	-172.3	0	0	112.1	D153 I222 D223 R224 R229 K230 P237	D153-M226 HydrophobicContact CB-CE 4.28Å; I222-M226 HydrophobicContact CG2-CE 4.41Å; I222-M226 HydrophobicContact CG2-CG 4.23Å; I222-M226 WeakPolarHBondContact O-CG 3.33Å; I222-M226 PolarHBondContact O-N 2.9Å; D223-M226 PolarHBondContact O-N 3.5Å; R224-M226 VanDerWaalsContact C-N 3.32Å; R224-M226 PolarHBondContact O-N 3.31Å; M226-R229 PolarHBondContact O-N 3.05Å; M226-K230 WeakPolarHBondContact O-CB 3.43Å; M226-K230 PolarHBondContact O-N 3.06Å; M226-P237 HydrophobicContact CE-CG 4.33Å; M226-P237 HydrophobicContact SD-CG 4.13Å
227	L	91.3	Very high	89.8	Confident	70 Å²	70	70.2 Å²	70.2	37%	0.366	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-41.4	173.8	-73.8	169.4	0	0	0	112	D223 R224 K230 K231 M236	D223-L227 WeakPolarHBondContact O-CB 3.43Å; D223-L227 VanDerWaalsContact O-CG 3.29Å; D223-L227 WeakPolarHBondContact O-CG 3.4Å; D223-L227 PolarHBondContact O-N 3.25Å; R224-L227 PolarHBondContact O-N 3.5Å; L227-K230 WeakPolarHBondContact O-CB 3.34Å; L227-K230 PolarHBondContact O-N 3.3Å; L227-K231 WeakPolarHBondContact O-CG 3.2Å; L227-K231 PolarHBondContact O-N 3.37Å; L227-K231 VanDerWaalsContact O-N 3.12Å; L227-M236 HydrophobicContact CD2-CE 3.69Å
228	D	90.6	Very high	89.3	Confident	70 Å²	70	69.4 Å²	69.4	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-68.5	-39.2	176.4	-68.9	-27.5	0	0	0	111.6	R224 R225 K230 K231 Q232	R224-D228 PolarHBondContact O-N 3.33Å; R225-D228 PolarHBondContact O-N 2.87Å; D228-K230 VanDerWaalsContact C-N 3.32Å; D228-K230 PolarHBondContact O-N 2.85Å; D228-K231 WeakPolarHBondContact O-CB 3.5Å; D228-K231 PolarHBondContact O-N 2.93Å; D228-K231 IonicContact OD1-NZ 3.28Å; D228-K231 PolarHBondContact OD1-NZ 2.82Å; D228-Q232 PolarHBondContact O-N 2.89Å
229	R	86.4	Confident	88.7	Confident	58 Å²	58	67.1 Å²	67.1	22%	0.219	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-39.7	171.4	-169.5	-176.5	-170.6	168.6	11.6	111.9	R225 M226 K231 Q232 T233	R225-R229 WeakPolarHBondContact O-CB 3.33Å; R225-R229 PolarHBondContact O-N 2.92Å; M226-R229 PolarHBondContact O-N 3.05Å; R229-K231 PolarHBondContact O-N 3.36Å; R229-Q232 PolarHBondContact O-N 3.47Å; R229-T233 HydrophobicContact CG-CG2 4.17Å; R229-T233 WeakPolarHBondContact O-CB 3.47Å; R229-T233 WeakPolarHBondContact O-CG2 3.42Å; R229-T233 PolarHBondContact O-N 3.45Å; R229-T233 PolarHBondContact O-OG1 3.4Å
230	K	89.1	Confident	88.4	Confident	88 Å²	88	67.8 Å²	67.8	38%	0.383	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-41.5	176.2	-176.9	-179.1	-175.1	173.5	0	111.8	M226 L227 D228 Q232 T233 G234 F235 M236	M226-K230 WeakPolarHBondContact O-CB 3.43Å; M226-K230 PolarHBondContact O-N 3.06Å; L227-K230 WeakPolarHBondContact O-CB 3.34Å; L227-K230 PolarHBondContact O-N 3.3Å; D228-K230 VanDerWaalsContact C-N 3.32Å; D228-K230 PolarHBondContact O-N 2.85Å; K230-Q232 PolarHBondContact O-N 3.4Å; K230-T233 PolarHBondContact O-N 3.17Å; K230-G234 VanDerWaalsContact O-CA 3.28Å; K230-G234 WeakPolarHBondContact O-CA 3.46Å; K230-G234 PolarHBondContact O-N 3.46Å; K230-F235 WeakPolarHBondContact CA-O 3.26Å; K230-F235 WeakPolarHBondContact CB-O 3.41Å; K230-M236 HydrophobicContact CD-CB 3.98Å; K230-M236 HydrophobicContact CD-CE 3.63Å; K230-M236 HydrophobicContact CD-CG 4.24Å; K230-M236 HydrophobicContact CD-SD 3.94Å; K230-M236 HydrophobicContact CG-CB 4.46Å; K230-M236 PolarHBondContact NZ-SD 2.87Å
231	K	89.8	Confident	88.3	Confident	164 Å²	164	68 Å²	68	71%	0.713	34%	0.337	S	S	*	.	H	α-helix	trans	-59.9	-35.3	176.1	-68	170.8	-170.6	159.4	0	112	L227 D228 R229	L227-K231 WeakPolarHBondContact O-CG 3.2Å; L227-K231 PolarHBondContact O-N 3.37Å; L227-K231 VanDerWaalsContact O-N 3.12Å; D228-K231 WeakPolarHBondContact O-CB 3.5Å; D228-K231 PolarHBondContact O-N 2.93Å; D228-K231 IonicContact OD1-NZ 3.28Å; D228-K231 PolarHBondContact OD1-NZ 2.82Å; R229-K231 PolarHBondContact O-N 3.36Å
232	Q	86.6	Confident	88.1	Confident	166 Å²	166	63.1 Å²	63.1	78%	0.776	32%	0.316	S	S	*	.	H	α-helix	trans	-82.9	-34.7	-179.4	-66.4	174.7	-1.5	0	0	113.4	D228 R229 K230	D228-Q232 PolarHBondContact O-N 2.89Å; R229-Q232 PolarHBondContact O-N 3.47Å; K230-Q232 PolarHBondContact O-N 3.4Å
233	T	84.4	Confident	88.2	Confident	40 Å²	40	67 Å²	67	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-121.3	-11.5	-164.8	67.1	0	0	0	0	114.5	Y157 R229 K230 F235	Y157-T233 HydrophobicContact CE2-CG2 3.85Å; Y157-T233 WeakPolarHBondContact OH-CG2 2.97Å; R229-T233 HydrophobicContact CG-CG2 4.17Å; R229-T233 WeakPolarHBondContact O-CB 3.47Å; R229-T233 WeakPolarHBondContact O-CG2 3.42Å; R229-T233 PolarHBondContact O-N 3.45Å; R229-T233 PolarHBondContact O-OG1 3.4Å; K230-T233 PolarHBondContact O-N 3.17Å; T233-F235 PolarHBondContact O-N 2.84Å; T233-F235 VanDerWaalsContact O-N 3.16Å; T233-F235 PolarHBondContact OG1-N 3.34Å
234	G	84.4	Confident	88.3	Confident	46 Å²	46	67.1 Å²	67.1	47%	0.474	33%	0.332	S	S	.	.	S	Bend	trans	75.1	-14.7	-173.5	0	0	0	0	0	115	K230	K230-G234 VanDerWaalsContact O-CA 3.28Å; K230-G234 WeakPolarHBondContact O-CA 3.46Å; K230-G234 PolarHBondContact O-N 3.46Å
235	F	85.5	Confident	88.4	Confident	11 Å²	11	61.5 Å²	61.5	5%	0.048	31%	0.312	C	S	.	.			trans	-84.7	143.8	-176.2	-176.9	-108.8	0	0	0	113.3	M156 Y157 Y160 M170 K230 T233 P237	M156-F235 HydrophobicContact CB-CE1 4.43Å; M156-F235 HydrophobicContact CB-CZ 3.73Å; Y157-F235 HydrophobicContact CD2-CB 3.91Å; Y157-F235 AromaticContact CD2-CD1 3.57Å; Y157-F235 HydrophobicContact CD2-CD1 3.57Å; Y157-F235 HydrophobicContact CD2-CE1 4.37Å; Y157-F235 AromaticContact CD2-CG 3.92Å; Y157-F235 HydrophobicContact CD2-CG 3.92Å; Y157-F235 HydrophobicContact CE2-CB 4.24Å; Y157-F235 HydrophobicContact CG-CD1 4.24Å; Y160-F235 HydrophobicContact CD1-CB 3.65Å; Y160-F235 AromaticContact CD1-CD2 3.88Å; Y160-F235 HydrophobicContact CD1-CD2 3.88Å; Y160-F235 HydrophobicContact CD1-CG 4.01Å; Y160-F235 AromaticContact CD2-CD2 3.65Å; Y160-F235 HydrophobicContact CD2-CD2 3.65Å; Y160-F235 HydrophobicContact CD2-CE2 4.31Å; Y160-F235 HydrophobicContact CE1-CB 3.73Å; Y160-F235 HydrophobicContact CE1-CD2 4.43Å; Y160-F235 HydrophobicContact CE1-CG 4.5Å; Y160-F235 HydrophobicContact CE2-CD2 4.22Å; Y160-F235 HydrophobicContact CG-CB 4.14Å; Y160-F235 AromaticContact CG-CD2 3.44Å; Y160-F235 HydrophobicContact CG-CD2 3.44Å; Y160-F235 VanDerWaalsContact CG-CD2 3.44Å; Y160-F235 HydrophobicContact CG-CE2 4.17Å; Y160-F235 HydrophobicContact CG-CG 4.03Å; M170-F235 HydrophobicContact CE-CE2 3.72Å; M170-F235 HydrophobicContact CE-CZ 4.27Å; K230-F235 WeakPolarHBondContact CA-O 3.26Å; K230-F235 WeakPolarHBondContact CB-O 3.41Å; T233-F235 PolarHBondContact O-N 2.84Å; T233-F235 VanDerWaalsContact O-N 3.16Å; T233-F235 PolarHBondContact OG1-N 3.34Å; F235-P237 HydrophobicContact CE1-CB 4.48Å; F235-P237 HydrophobicContact CE1-CG 3.93Å
236	M	86.9	Confident	88.6	Confident	53 Å²	53	58.8 Å²	58.8	26%	0.261	31%	0.306	S	S	.	.			trans	-140.9	124.3	173.9	-168.8	179.1	-122.1	0	0	109.2	L227 K230 R240	L227-M236 HydrophobicContact CD2-CE 3.69Å; K230-M236 HydrophobicContact CD-CB 3.98Å; K230-M236 HydrophobicContact CD-CE 3.63Å; K230-M236 HydrophobicContact CD-CG 4.24Å; K230-M236 HydrophobicContact CD-SD 3.94Å; K230-M236 HydrophobicContact CG-CB 4.46Å; K230-M236 PolarHBondContact NZ-SD 2.87Å; M236-R240 VanDerWaalsContact SD-O 3.33Å
237	P	85.2	Confident	88.8	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.032	32%	0.32	C	S	.	.			trans	-62.9	149.9	175.4	-20	30.5	0	0	0	112.4	D153 M226 F235 G239 R240	D153-P237 HydrophobicContact CB-CB 4.11Å; D153-P237 HydrophobicContact CB-CG 3.87Å; D153-P237 WeakPolarHBondContact OD1-CB 3.37Å; D153-P237 WeakPolarHBondContact OD2-CB 3.19Å; D153-P237 WeakPolarHBondContact OD2-CG 3.36Å; M226-P237 HydrophobicContact CE-CG 4.33Å; M226-P237 HydrophobicContact SD-CG 4.13Å; F235-P237 HydrophobicContact CE1-CB 4.48Å; F235-P237 HydrophobicContact CE1-CG 3.93Å; P237-G239 PolarHBondContact O-N 3.46Å; P237-R240 HydrophobicContact CB-CG 4.4Å; P237-R240 PolarHBondContact O-N 2.93Å
238	P	82.4	Confident	89	Confident	42 Å²	42	58.8 Å²	58.8	27%	0.273	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	136.6	176.8	27.8	-34.6	0	0	0	110.8	R152 M156	R152-P238 PolarHBondContact NH2-O 3.27Å; M156-P238 HydrophobicContact CE-CG 3.89Å; M156-P238 HydrophobicContact SD-CG 3.82Å
239	G	82.6	Confident	89.2	Confident	52 Å²	52	57.2 Å²	57.2	54%	0.536	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	3.7	-179.9	0	0	0	0	0	115.6	P237 K242	P237-G239 PolarHBondContact O-N 3.46Å; G239-K242 WeakPolarHBondContact O-CG 3.39Å
240	R	87.9	Confident	89.6	Confident	14 Å²	14	57.2 Å²	57.2	5%	0.053	30%	0.297	C	S	.	.			trans	-110.1	144.2	175.7	-67.5	-76.8	179.9	-173.6	-5.2	111.5	E149 E219 D223 M236 P237	E149-R240 IonicContact OE2-CZ 2.99Å; E149-R240 IonicContact OE2-NH2 2.66Å; E149-R240 PolarHBondContact OE2-NH2 3.37Å; E219-R240 IonicContact OE1-NH2 2.68Å; E219-R240 IonicContact OE2-CZ 2.88Å; E219-R240 IonicContact OE2-NH1 3.63Å; E219-R240 PolarHBondContact OE2-NH1 2.85Å; E219-R240 IonicContact OE2-NH2 3.4Å; E219-R240 PolarHBondContact OE2-NH2 3.47Å; D223-R240 WeakPolarHBondContact OD1-CD 3.44Å; D223-R240 IonicContact OD1-CZ 3.75Å; D223-R240 IonicContact OD1-NE 3.59Å; D223-R240 IonicContact OD1-NH1 3.82Å; D223-R240 PolarHBondContact OD1-NH1 3.33Å; M236-R240 VanDerWaalsContact SD-O 3.33Å; P237-R240 HydrophobicContact CB-CG 4.4Å; P237-R240 PolarHBondContact O-N 2.93Å
241	P	90.3	Very high	89.9	Confident	42 Å²	42	54.1 Å²	54.1	27%	0.273	29%	0.286	S	S	.	.			cis	-73.3	145.6	-5.4	32.3	-35.5	0	0	0	111.9	D223 K243	D223-P241 HydrophobicContact CB-CB 3.94Å; D223-P241 WeakPolarHBondContact OD1-CA 3.39Å; D223-P241 WeakPolarHBondContact OD2-CB 3.41Å; P241-K243 HydrophobicContact CB-CG 4.14Å; P241-K243 HydrophobicContact CG-CG 4.13Å
242	K	90.6	Very high	90.2	Very high	21 Å²	21	46.5 Å²	46.5	9%	0.091	25%	0.253	C	S	.	.			trans	-78.6	-28.6	178.4	-69.8	-169.5	-170.9	173.3	0	112.9	E149 S184 E219 D223 G239 W244	E149-K242 WeakPolarHBondContact OE1-CE 3.42Å; E149-K242 IonicContact OE1-NZ 2.79Å; E149-K242 PolarHBondContact OE1-NZ 3.25Å; E149-K242 IonicContact OE2-NZ 2.81Å; E149-K242 PolarHBondContact OE2-NZ 2.54Å; S184-K242 PolarHBondContact OG-NZ 3.42Å; E219-K242 IonicContact OE1-NZ 3.7Å; E219-K242 WeakPolarHBondContact OE2-CD 3.2Å; E219-K242 IonicContact OE2-NZ 3.74Å; D223-K242 VanDerWaalsContact CG-N 3.35Å; D223-K242 PolarHBondContact OD1-N 3.5Å; D223-K242 PolarHBondContact OD2-N 2.94Å; G239-K242 WeakPolarHBondContact O-CG 3.39Å; K242-W244 HydrophobicContact CB-CG 4.26Å; K242-W244 HydrophobicContact CD-CD2 4.49Å; K242-W244 HydrophobicContact CD-CZ2 3.72Å; K242-W244 PolarHBondContact O-N 3.3Å
243	K	93.5	Very high	90.5	Very high	104 Å²	104	41.9 Å²	41.9	45%	0.452	23%	0.231	S	C	.	.			trans	52	47.8	179.7	-53.6	-171	-178.1	-176.8	0	113.6	E220 D223 P241 K245 E246 K247	E220-K243 VanDerWaalsContact OE1-C 3.29Å; E220-K243 WeakPolarHBondContact OE1-CA 3.42Å; D223-K243 PolarHBondContact OD2-N 2.75Å; P241-K243 HydrophobicContact CB-CG 4.14Å; P241-K243 HydrophobicContact CG-CG 4.13Å; K243-K245 VanDerWaalsContact C-N 3.27Å; K243-K245 PolarHBondContact O-N 3.37Å; K243-E246 HydrophobicContact CB-CB 4.27Å; K243-E246 VanDerWaalsContact CD-OE2 3.29Å; K243-E246 WeakPolarHBondContact CD-OE2 3.27Å; K243-E246 IonicContact NZ-OE2 3.88Å; K243-E246 PolarHBondContact O-N 2.92Å; K243-K247 PolarHBondContact O-N 3.28Å; K243-K247 VanDerWaalsContact O-N 3.17Å
244	W	94.8	Very high	91	Very high	6 Å²	6	48.3 Å²	48.3	2%	0.023	25%	0.251	C	S	.	.	H	α-helix	trans	-68.7	-25.3	-175.7	-79.3	8.9	0	0	0	113.3	L187 A188 L191 W192 I215 I216 E219 E220 K242 K247 M248	L187-W244 HydrophobicContact CD2-CH2 4.37Å; A188-W244 HydrophobicContact CB-CZ2 4.18Å; L191-W244 HydrophobicContact CD1-CE3 3.76Å; L191-W244 HydrophobicContact CD1-CH2 4.17Å; L191-W244 HydrophobicContact CD1-CZ3 3.46Å; L191-W244 VanDerWaalsContact CD1-CZ3 3.46Å; W192-W244 HydrophobicContact CH2-CB 3.98Å; W192-W244 HydrophobicContact CH2-CD2 4.47Å; W192-W244 HydrophobicContact CH2-CG 4.01Å; W192-W244 HydrophobicContact CZ2-CG 4.21Å; I215-W244 HydrophobicContact CG2-CE3 4.25Å; I215-W244 HydrophobicContact CG2-CZ3 3.75Å; I216-W244 HydrophobicContact CG1-CB 4.42Å; I216-W244 HydrophobicContact CG2-CB 4.28Å; E219-W244 HydrophobicContact CB-CD2 4.43Å; E219-W244 HydrophobicContact CB-CE3 4.05Å; E219-W244 HydrophobicContact CG-CD2 4.29Å; E219-W244 HydrophobicContact CG-CE3 3.6Å; E219-W244 HydrophobicContact CG-CH2 4.39Å; E219-W244 HydrophobicContact CG-CZ3 3.65Å; E220-W244 PolarHBondContact OE1-N 2.89Å; K242-W244 HydrophobicContact CB-CG 4.26Å; K242-W244 HydrophobicContact CD-CD2 4.49Å; K242-W244 HydrophobicContact CD-CZ2 3.72Å; K242-W244 PolarHBondContact O-N 3.3Å; W244-K247 PolarHBondContact O-N 3.4Å; W244-M248 WeakPolarHBondContact O-CB 3.35Å; W244-M248 PolarHBondContact O-N 3.35Å
245	K	94.1	Very high	91.4	Very high	52 Å²	52	47.4 Å²	47.4	23%	0.226	24%	0.236	C	C	.	.	H	α-helix	trans	-65.5	-44.1	172.6	-179.1	173.2	-175.6	161.5	0	112	I216 E220 K243 M248 F249 Y305	I216-K245 HydrophobicContact CG2-CB 4.04Å; E220-K245 HydrophobicContact CG-CB 3.68Å; E220-K245 WeakPolarHBondContact OE1-CB 3.41Å; E220-K245 PolarHBondContact OE1-N 2.8Å; K243-K245 VanDerWaalsContact C-N 3.27Å; K243-K245 PolarHBondContact O-N 3.37Å; K245-M248 WeakPolarHBondContact O-CB 3.37Å; K245-M248 PolarHBondContact O-N 3.49Å; K245-F249 HydrophobicContact CD-CE2 4.45Å; K245-F249 HydrophobicContact CG-CD2 4.1Å; K245-F249 HydrophobicContact CG-CE2 3.82Å; K245-F249 VanDerWaalsContact O-CD2 3.23Å; K245-F249 WeakPolarHBondContact O-CD2 3.35Å; K245-F249 PolarHBondContact O-N 3.28Å; K245-F249 VanDerWaalsContact O-N 3.17Å; K245-Y305 HydrophobicContact CD-CE1 4.01Å; K245-Y305 WeakPolarHBondContact CD-OH 3.35Å; K245-Y305 HydrophobicContact CG-CE1 4.03Å
246	E	94.4	Very high	91.8	Very high	103 Å²	103	47.1 Å²	47.1	48%	0.481	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-46.1	175.2	-170.1	-174.2	148.6	0	0	110.5	K243 M248 F249 N250	K243-E246 HydrophobicContact CB-CB 4.27Å; K243-E246 VanDerWaalsContact CD-OE2 3.29Å; K243-E246 WeakPolarHBondContact CD-OE2 3.27Å; K243-E246 IonicContact NZ-OE2 3.88Å; K243-E246 PolarHBondContact O-N 2.92Å; E246-M248 PolarHBondContact O-N 2.82Å; E246-F249 PolarHBondContact O-N 2.85Å; E246-N250 VanDerWaalsContact O-CG 3.26Å; E246-N250 PolarHBondContact O-N 2.83Å; E246-N250 PolarHBondContact O-ND2 3.19Å; E246-N250 PolarHBondContact O-OD1 3Å
247	K	94.4	Very high	92	Very high	98 Å²	98	46.1 Å²	46.1	43%	0.426	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-40.4	176.6	-68.4	-178.7	-177	177.4	0	112.9	W192 K243 W244 F249 N250 V251	W192-K247 HydrophobicContact CH2-CB 3.81Å; W192-K247 HydrophobicContact CZ2-CB 3.82Å; W192-K247 HydrophobicContact CZ2-CD 4.1Å; W192-K247 HydrophobicContact CZ3-CB 4.48Å; K243-K247 PolarHBondContact O-N 3.28Å; K243-K247 VanDerWaalsContact O-N 3.17Å; W244-K247 PolarHBondContact O-N 3.4Å; K247-F249 PolarHBondContact O-N 2.9Å; K247-N250 PolarHBondContact O-N 3.37Å; K247-V251 WeakPolarHBondContact O-CG2 3.46Å; K247-V251 PolarHBondContact O-N 3.49Å
248	M	95.3	Very high	92.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-47.9	176.4	-177	-163.5	73.9	0	0	111.2	W192 V195 I216 W244 K245 E246 N250 V251 L252 F301 Y305	W192-M248 HydrophobicContact CZ3-CB 4.02Å; V195-M248 HydrophobicContact CG1-CG 3.91Å; V195-M248 HydrophobicContact CG2-CG 4.04Å; I216-M248 HydrophobicContact CD1-CB 3.97Å; I216-M248 HydrophobicContact CD1-CG 3.87Å; I216-M248 HydrophobicContact CD1-SD 3.6Å; I216-M248 VanDerWaalsContact CD1-SD 3.6Å; W244-M248 WeakPolarHBondContact O-CB 3.35Å; W244-M248 PolarHBondContact O-N 3.35Å; K245-M248 WeakPolarHBondContact O-CB 3.37Å; K245-M248 PolarHBondContact O-N 3.49Å; E246-M248 PolarHBondContact O-N 2.82Å; M248-N250 VanDerWaalsContact C-N 3.35Å; M248-N250 PolarHBondContact O-N 3.12Å; M248-V251 PolarHBondContact O-N 2.94Å; M248-L252 HydrophobicContact CE-CD1 4.38Å; M248-L252 HydrophobicContact CG-CD1 4.45Å; M248-L252 WeakPolarHBondContact O-CG 3.5Å; M248-L252 PolarHBondContact O-N 3.26Å; M248-F301 HydrophobicContact CE-CE1 3.92Å; M248-F301 HydrophobicContact SD-CE1 3.85Å; M248-Y305 HydrophobicContact CE-CD1 4.03Å; M248-Y305 HydrophobicContact CE-CE1 3.72Å
249	F	95.2	Very high	92.5	Very high	36 Å²	36	51.6 Å²	51.6	16%	0.158	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-38.7	177.8	-75.2	-59.4	0	0	0	112.3	K245 E246 K247 V251 L252 E253 Y305 I307 K310 M314	K245-F249 HydrophobicContact CD-CE2 4.45Å; K245-F249 HydrophobicContact CG-CD2 4.1Å; K245-F249 HydrophobicContact CG-CE2 3.82Å; K245-F249 VanDerWaalsContact O-CD2 3.23Å; K245-F249 WeakPolarHBondContact O-CD2 3.35Å; K245-F249 PolarHBondContact O-N 3.28Å; K245-F249 VanDerWaalsContact O-N 3.17Å; E246-F249 PolarHBondContact O-N 2.85Å; K247-F249 PolarHBondContact O-N 2.9Å; F249-V251 VanDerWaalsContact C-N 3.3Å; F249-V251 PolarHBondContact O-N 3.36Å; F249-L252 HydrophobicContact CD1-CD1 4.21Å; F249-L252 PolarHBondContact O-N 2.85Å; F249-E253 WeakPolarHBondContact O-CB 3.27Å; F249-E253 PolarHBondContact O-N 3.45Å; F249-Y305 HydrophobicContact CE2-CD1 4.23Å; F249-Y305 HydrophobicContact CE2-CE1 4.34Å; F249-Y305 AromaticContact CZ-CD1 3.72Å; F249-Y305 HydrophobicContact CZ-CD1 3.72Å; F249-Y305 HydrophobicContact CZ-CE1 4.26Å; F249-I307 HydrophobicContact CE1-CD1 3.82Å; F249-K310 HydrophobicContact CE1-CB 4.24Å; F249-K310 HydrophobicContact CE1-CG 4.34Å; F249-M314 HydrophobicContact CB-CE 4.26Å; F249-M314 HydrophobicContact CD1-CE 3.83Å; F249-M314 HydrophobicContact CG-CE 4.46Å
250	N	95	Very high	92.8	Very high	58 Å²	58	49.5 Å²	49.5	31%	0.31	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-35.7	173.9	-64.9	-15.7	0	0	0	112.4	E246 K247 M248 R254	E246-N250 VanDerWaalsContact O-CG 3.26Å; E246-N250 PolarHBondContact O-N 2.83Å; E246-N250 PolarHBondContact O-ND2 3.19Å; E246-N250 PolarHBondContact O-OD1 3Å; K247-N250 PolarHBondContact O-N 3.37Å; M248-N250 VanDerWaalsContact C-N 3.35Å; M248-N250 PolarHBondContact O-N 3.12Å; N250-R254 VanDerWaalsContact O-CG 3.31Å; N250-R254 WeakPolarHBondContact O-CG 3.2Å; N250-R254 PolarHBondContact O-N 2.9Å; N250-R254 VanDerWaalsContact O-N 3.11Å
251	V	95.4	Very high	92.6	Very high	24 Å²	24	53.8 Å²	53.8	15%	0.145	26%	0.255	C	S	.	.	H	α-helix	trans	-68.5	-43.1	174.7	171.8	0	0	0	0	110.6	W192 V195 Q196 K247 M248 F249 T255	W192-V251 HydrophobicContact CB-CG2 4.25Å; W192-V251 HydrophobicContact CD2-CG2 4.24Å; W192-V251 HydrophobicContact CE3-CG2 4.28Å; W192-V251 HydrophobicContact CG-CG2 4.2Å; V195-V251 HydrophobicContact CB-CG1 4.22Å; V195-V251 HydrophobicContact CG1-CB 4.24Å; V195-V251 HydrophobicContact CG1-CG1 3.89Å; Q196-V251 HydrophobicContact CB-CG1 4.23Å; K247-V251 WeakPolarHBondContact O-CG2 3.46Å; K247-V251 PolarHBondContact O-N 3.49Å; M248-V251 PolarHBondContact O-N 2.94Å; F249-V251 VanDerWaalsContact C-N 3.3Å; F249-V251 PolarHBondContact O-N 3.36Å; V251-T255 WeakPolarHBondContact O-CB 3.36Å; V251-T255 PolarHBondContact O-N 2.97Å; V251-T255 PolarHBondContact O-OG1 3.36Å
252	L	94.7	Very high	92.1	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-46.8	176	-72.1	172.4	0	0	0	111.7	V195 M248 F249 R254 T255 V256 I307 M314	V195-L252 HydrophobicContact CG1-CD1 4.47Å; V195-L252 HydrophobicContact CG1-CD2 3.61Å; V195-L252 HydrophobicContact CG1-CG 3.65Å; M248-L252 HydrophobicContact CE-CD1 4.38Å; M248-L252 HydrophobicContact CG-CD1 4.45Å; M248-L252 WeakPolarHBondContact O-CG 3.5Å; M248-L252 PolarHBondContact O-N 3.26Å; F249-L252 HydrophobicContact CD1-CD1 4.21Å; F249-L252 PolarHBondContact O-N 2.85Å; L252-R254 PolarHBondContact O-N 3.2Å; L252-T255 WeakPolarHBondContact O-CB 3.3Å; L252-T255 PolarHBondContact O-N 2.91Å; L252-T255 VanDerWaalsContact O-N 3.14Å; L252-V256 WeakPolarHBondContact O-CG2 3.46Å; L252-V256 PolarHBondContact O-N 3.21Å; L252-I307 HydrophobicContact CD1-CD1 4Å; L252-M314 HydrophobicContact CB-SD 4.14Å
253	E	94	Very high	91.5	Very high	69 Å²	69	54.6 Å²	54.6	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-58.2	-50	177.9	-174.7	178.6	-168.5	0	0	111.3	F249 T255 V256 S257 M314	F249-E253 WeakPolarHBondContact O-CB 3.27Å; F249-E253 PolarHBondContact O-N 3.45Å; E253-T255 VanDerWaalsContact C-N 3.28Å; E253-T255 PolarHBondContact O-N 3.49Å; E253-V256 PolarHBondContact O-N 2.9Å; E253-S257 PolarHBondContact O-N 3.35Å; E253-S257 PolarHBondContact O-OG 2.93Å; E253-M314 HydrophobicContact CB-CG 4.33Å; E253-M314 HydrophobicContact CB-SD 4.24Å; E253-M314 HydrophobicContact CG-CG 4.43Å
254	R	93.6	Very high	90.6	Very high	174 Å²	174	53.2 Å²	53.2	66%	0.657	27%	0.269	S	S	*	.	H	α-helix	trans	-59.9	-39	175.2	-72.7	176.4	-169.5	165.5	2.7	112.7	N250 L252 V256 S257 T258	N250-R254 VanDerWaalsContact O-CG 3.31Å; N250-R254 WeakPolarHBondContact O-CG 3.2Å; N250-R254 PolarHBondContact O-N 2.9Å; N250-R254 VanDerWaalsContact O-N 3.11Å; L252-R254 PolarHBondContact O-N 3.2Å; R254-V256 VanDerWaalsContact C-N 3.31Å; R254-V256 PolarHBondContact O-N 3.4Å; R254-S257 PolarHBondContact O-N 3.25Å; R254-T258 WeakPolarHBondContact O-CB 3.34Å; R254-T258 PolarHBondContact O-N 3.49Å; R254-T258 PolarHBondContact O-OG1 2.99Å
255	T	92.8	Very high	89.2	Confident	28 Å²	28	56.7 Å²	56.7	17%	0.172	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-43.6	178.4	-58.5	0	0	0	0	110.7	Q196 V251 L252 E253 R259	Q196-T255 WeakPolarHBondContact CA-OG1 3.36Å; Q196-T255 HydrophobicContact CG-CG2 4.2Å; Q196-T255 WeakPolarHBondContact O-CG2 3.43Å; V251-T255 WeakPolarHBondContact O-CB 3.36Å; V251-T255 PolarHBondContact O-N 2.97Å; V251-T255 PolarHBondContact O-OG1 3.36Å; L252-T255 WeakPolarHBondContact O-CB 3.3Å; L252-T255 PolarHBondContact O-N 2.91Å; L252-T255 VanDerWaalsContact O-N 3.14Å; E253-T255 VanDerWaalsContact C-N 3.28Å; E253-T255 PolarHBondContact O-N 3.49Å; T255-R259 WeakPolarHBondContact O-CB 3.41Å; T255-R259 PolarHBondContact O-N 3.41Å
256	V	93.8	Very high	88.3	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.024	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-48.1	176.7	171.7	0	0	0	0	110.7	L252 E253 R254 R259 I260 L311 M314 Y315 A318	L252-V256 WeakPolarHBondContact O-CG2 3.46Å; L252-V256 PolarHBondContact O-N 3.21Å; E253-V256 PolarHBondContact O-N 2.9Å; R254-V256 VanDerWaalsContact C-N 3.31Å; R254-V256 PolarHBondContact O-N 3.4Å; V256-R259 PolarHBondContact O-N 2.98Å; V256-I260 HydrophobicContact CG1-CD1 4.27Å; V256-I260 PolarHBondContact O-N 3.06Å; V256-L311 HydrophobicContact CG2-CD1 3.93Å; V256-M314 HydrophobicContact CG2-CB 4.44Å; V256-Y315 HydrophobicContact CB-CE1 4.48Å; V256-Y315 HydrophobicContact CG1-CD1 3.53Å; V256-Y315 HydrophobicContact CG1-CD2 4.23Å; V256-Y315 HydrophobicContact CG1-CE1 3.68Å; V256-Y315 HydrophobicContact CG1-CE2 4.38Å; V256-Y315 HydrophobicContact CG1-CG 3.8Å; V256-Y315 HydrophobicContact CG2-CD2 4.23Å; V256-Y315 HydrophobicContact CG2-CE1 4.28Å; V256-Y315 HydrophobicContact CG2-CE2 3.83Å; V256-A318 HydrophobicContact CG1-CB 3.94Å
257	S	91.4	Very high	87.3	Confident	32 Å²	32	54.5 Å²	54.5	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-52.5	178	-60	0	0	0	0	112.5	E253 R254 R259 I260 E261	E253-S257 PolarHBondContact O-N 3.35Å; E253-S257 PolarHBondContact O-OG 2.93Å; R254-S257 PolarHBondContact O-N 3.25Å; S257-R259 PolarHBondContact O-N 3.42Å; S257-I260 PolarHBondContact O-N 3.12Å; S257-I260 VanDerWaalsContact O-N 3.12Å; S257-E261 WeakPolarHBondContact O-CG 3.29Å; S257-E261 PolarHBondContact O-N 2.83Å
258	T	90.3	Very high	86.5	Confident	85 Å²	85	54.7 Å²	54.7	52%	0.521	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-32.7	178.7	-57.6	0	0	0	0	111.9	R254 G262	R254-T258 WeakPolarHBondContact O-CB 3.34Å; R254-T258 PolarHBondContact O-N 3.49Å; R254-T258 PolarHBondContact O-OG1 2.99Å; T258-G262 PolarHBondContact O-N 3.28Å
259	R	88.6	Confident	85.6	Confident	77 Å²	77	63.7 Å²	63.7	29%	0.291	34%	0.336	S	S	.	.	H	α-helix	trans	-68.8	-42.8	176.8	-170.6	168.3	-169.6	179.7	-12	111.9	T255 V256 S257 T263 D289	T255-R259 WeakPolarHBondContact O-CB 3.41Å; T255-R259 PolarHBondContact O-N 3.41Å; V256-R259 PolarHBondContact O-N 2.98Å; S257-R259 PolarHBondContact O-N 3.42Å; R259-T263 WeakPolarHBondContact O-CG2 3.4Å; R259-D289 WeakPolarHBondContact CD-OD2 3.42Å; R259-D289 IonicContact CZ-OD1 3.27Å; R259-D289 IonicContact CZ-OD2 3.38Å; R259-D289 IonicContact NE-OD2 3.54Å; R259-D289 PolarHBondContact NE-OD2 3.07Å; R259-D289 IonicContact NH1-OD1 2.75Å; R259-D289 PolarHBondContact NH1-OD1 2.81Å; R259-D289 IonicContact NH1-OD2 2.7Å; R259-D289 PolarHBondContact NH1-OD2 3.48Å; R259-D289 VanDerWaalsContact NH2-CG 3.35Å; R259-D289 IonicContact NH2-OD1 2.88Å; R259-D289 PolarHBondContact NH2-OD1 3.38Å; R259-D289 IonicContact NH2-OD2 3.53Å; R259-D289 PolarHBondContact NH2-OD2 3.46Å; R259-D289 VanDerWaalsContact NH2-OD2 3.17Å
260	I	88.4	Confident	84.8	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.041	35%	0.353	C	S	.	.	H	α-helix	trans	-66.9	-46.4	176.7	-66.5	175.5	0	0	0	110.3	V256 S257 G262 T263 I282 Y315 A318 L319 R322	V256-I260 HydrophobicContact CG1-CD1 4.27Å; V256-I260 PolarHBondContact O-N 3.06Å; S257-I260 PolarHBondContact O-N 3.12Å; S257-I260 VanDerWaalsContact O-N 3.12Å; I260-G262 VanDerWaalsContact C-N 3.33Å; I260-G262 PolarHBondContact O-N 2.95Å; I260-T263 PolarHBondContact O-N 3.37Å; I260-T263 PolarHBondContact O-OG1 3.41Å; I260-I282 HydrophobicContact CG2-CD1 4.3Å; I260-Y315 HydrophobicContact CD1-CD1 4.26Å; I260-A318 HydrophobicContact CD1-CB 3.6Å; I260-L319 HydrophobicContact CD1-CD2 3.96Å; I260-L319 HydrophobicContact CD1-CG 3.95Å; I260-R322 HydrophobicContact CG2-CB 4.01Å; I260-R322 HydrophobicContact CG2-CG 3.93Å
261	E	83.8	Confident	84	Confident	105 Å²	105	65.4 Å²	65.4	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-58.6	-44	176.5	-70.6	165.3	-157.8	0	0	111.9	S257 T263 Q264	S257-E261 WeakPolarHBondContact O-CG 3.29Å; S257-E261 PolarHBondContact O-N 2.83Å; E261-T263 PolarHBondContact O-N 3.39Å; E261-T263 VanDerWaalsContact O-N 3.11Å; E261-Q264 PolarHBondContact O-N 3.05Å
262	G	80.2	Confident	83.2	Confident	65 Å²	65	73.1 Å²	73.1	67%	0.67	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-3.1	-179.1	0	0	0	0	0	115.6	T258 I260 Q264	T258-G262 PolarHBondContact O-N 3.28Å; I260-G262 VanDerWaalsContact C-N 3.33Å; I260-G262 PolarHBondContact O-N 2.95Å; G262-Q264 VanDerWaalsContact C-N 3.35Å
263	T	78.9	Confident	82.7	Confident	14 Å²	14	78 Å²	78	9%	0.086	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.9	176.5	56.4	0	0	0	0	114.3	R259 I260 E261 A265 H278 I281 I282 Y285	R259-T263 WeakPolarHBondContact O-CG2 3.4Å; I260-T263 PolarHBondContact O-N 3.37Å; I260-T263 PolarHBondContact O-OG1 3.41Å; E261-T263 PolarHBondContact O-N 3.39Å; E261-T263 VanDerWaalsContact O-N 3.11Å; T263-A265 PolarHBondContact O-N 3.43Å; T263-H278 PolarHBondContact O-ND1 3.31Å; T263-H278 PolarHBondContact OG1-CE1 3Å; T263-I281 HydrophobicContact CG2-CG2 3.96Å; T263-I282 WeakPolarHBondContact OG1-CG1 3.31Å; T263-Y285 HydrophobicContact CG2-CD2 3.42Å; T263-Y285 VanDerWaalsContact CG2-CD2 3.42Å; T263-Y285 HydrophobicContact CG2-CE2 3.74Å
264	Q	72.7	Confident	82.5	Confident	75 Å²	75	75 Å²	75	35%	0.35	39%	0.394	S	S	.	.			trans	-77.1	93.4	175.7	-168.1	172.6	8	0	0	110.2	E261 G262	E261-Q264 PolarHBondContact O-N 3.05Å; G262-Q264 VanDerWaalsContact C-N 3.35Å
265	A	66.3	Low	82.3	Confident	80 Å²	80	66.9 Å²	66.9	66%	0.661	36%	0.363	S	S	*	.			trans	-86.2	-35.4	178	0	0	0	0	0	112.9	T263	T263-A265 PolarHBondContact O-N 3.43Å
266	D	74.5	Confident	82.2	Confident	39 Å²	39	68.3 Å²	68.3	21%	0.209	37%	0.372	C	S	.	.			trans	-113.9	144.3	-172.8	-59.3	-48.2	0	0	0	110.6	W274 R277	D266-W274 HydrophobicContact CB-CB 4.21Å; D266-R277 VanDerWaalsContact OD2-CD 3.29Å; D266-R277 WeakPolarHBondContact OD2-CD 3.43Å; D266-R277 IonicContact OD2-CZ 3.77Å; D266-R277 IonicContact OD2-NE 2.82Å; D266-R277 PolarHBondContact OD2-NE 3.49Å; D266-R277 IonicContact OD2-NH1 3.33Å
267	T	74.8	Confident	81.9	Confident	70 Å²	70	74.4 Å²	74.4	43%	0.429	39%	0.394	S	S	.	.			trans	-101.6	164.2	172.3	65.6	0	0	0	0	110.4	E269 S270 D271	T267-E269 PolarHBondContact O-N 3.23Å; T267-E269 VanDerWaalsContact O-N 3.13Å; T267-S270 PolarHBondContact N-OG 2.9Å; T267-S270 PolarHBondContact O-N 3.4Å; T267-S270 PolarHBondContact O-OG 2.94Å; T267-D271 PolarHBondContact O-N 3.12Å
268	R	77.7	Confident	81.9	Confident	102 Å²	102	73.1 Å²	73.1	39%	0.385	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.1	176	-174.5	164.5	171.2	178.9	-20.8	113.7	W274 D330 E332 E335	R268-W274 VanDerWaalsContact CA-CD1 3.47Å; R268-W274 HydrophobicContact CB-CG 4.39Å; R268-D330 PolarHBondContact NH1-O 2.61Å; R268-E332 IonicContact CZ-OE1 2.74Å; R268-E332 IonicContact NE-OE1 2.78Å; R268-E332 IonicContact NH2-OE1 2.94Å; R268-E332 PolarHBondContact NH2-OE1 2.95Å; R268-E335 WeakPolarHBondContact CD-OE1 3.34Å; R268-E335 IonicContact CZ-OE1 3.19Å; R268-E335 IonicContact CZ-OE2 2.87Å; R268-E335 IonicContact NE-OE1 2.72Å; R268-E335 PolarHBondContact NE-OE1 3.41Å; R268-E335 IonicContact NE-OE2 3.1Å; R268-E335 IonicContact NH1-OE1 2.65Å; R268-E335 IonicContact NH1-OE2 3.53Å; R268-E335 PolarHBondContact NH1-OE2 3.11Å
269	E	75.5	Confident	81.9	Confident	188 Å²	188	69.2 Å²	69.2	88%	0.879	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-28.4	179	-64.4	160.6	174.3	0	0	112.5	T267	T267-E269 PolarHBondContact O-N 3.23Å; T267-E269 VanDerWaalsContact O-N 3.13Å
270	S	77.9	Confident	82.1	Confident	76 Å²	76	68.6 Å²	68.6	53%	0.531	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-35.1	-178.8	57.3	0	0	0	0	113.5	T267	T267-S270 PolarHBondContact N-OG 2.9Å; T267-S270 PolarHBondContact O-N 3.4Å; T267-S270 PolarHBondContact O-OG 2.94Å
271	D	79.3	Confident	82.2	Confident	55 Å²	55	70.1 Å²	70.1	29%	0.294	37%	0.369	S	S	.	.			trans	-146.6	131.4	-178	-167.7	-16.8	0	0	0	111.4	T267 M273 W274	T267-D271 PolarHBondContact O-N 3.12Å; D271-M273 PolarHBondContact O-N 2.88Å; D271-M273 PolarHBondContact OD1-N 3.36Å; D271-W274 HydrophobicContact CB-CB 4.47Å; D271-W274 VanDerWaalsContact O-CB 3.3Å; D271-W274 WeakPolarHBondContact O-CB 3.39Å; D271-W274 PolarHBondContact O-N 3Å
272	K	78.1	Confident	82.7	Confident	185 Å²	185	65.2 Å²	65.2	80%	0.804	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.4	175.2	-67.8	-172.9	177.2	-175.6	0	113
273	M	84.8	Confident	83.3	Confident	106 Å²	106	63.7 Å²	63.7	52%	0.522	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	15.9	178.5	-63.1	-64.7	-73.1	0	0	112.6	D271 L275 V276 R277	D271-M273 PolarHBondContact O-N 2.88Å; D271-M273 PolarHBondContact OD1-N 3.36Å; M273-L275 VanDerWaalsContact C-N 3.26Å; M273-L275 PolarHBondContact O-N 3.47Å; M273-V276 HydrophobicContact CE-CB 4.07Å; M273-V276 HydrophobicContact CE-CG1 4.21Å; M273-V276 HydrophobicContact CE-CG2 3.8Å; M273-V276 PolarHBondContact O-N 3.28Å; M273-R277 PolarHBondContact O-N 3.44Å
274	W	89.6	Confident	84	Confident	8 Å²	8	68.6 Å²	68.6	3%	0.03	34%	0.34	C	S	.	.	H	α-helix	trans	-50.2	-44.3	-176.3	75	-81.3	0	0	0	112.6	D266 R268 D271 R277 H278 L326 E335	D266-W274 HydrophobicContact CB-CB 4.21Å; R268-W274 VanDerWaalsContact CA-CD1 3.47Å; R268-W274 HydrophobicContact CB-CG 4.39Å; D271-W274 HydrophobicContact CB-CB 4.47Å; D271-W274 VanDerWaalsContact O-CB 3.3Å; D271-W274 WeakPolarHBondContact O-CB 3.39Å; D271-W274 PolarHBondContact O-N 3Å; W274-R277 PolarHBondContact O-N 3.45Å; W274-H278 VanDerWaalsContact O-CB 3.28Å; W274-H278 WeakPolarHBondContact O-CB 3.43Å; W274-H278 PolarHBondContact O-N 2.91Å; W274-L326 HydrophobicContact CH2-CD2 3.95Å; W274-L326 HydrophobicContact CZ3-CD2 4.31Å; W274-E335 PolarHBondContact NE1-OE1 3.02Å
275	L	89.3	Confident	84.8	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-69.1	-43.7	-176.2	-176.2	60.3	0	0	0	111.7	M273 R277 H278 L279 L326 E335 L339	M273-L275 VanDerWaalsContact C-N 3.26Å; M273-L275 PolarHBondContact O-N 3.47Å; L275-R277 VanDerWaalsContact C-N 3.29Å; L275-R277 PolarHBondContact O-N 2.97Å; L275-H278 PolarHBondContact O-N 3.05Å; L275-L279 HydrophobicContact CD1-CD1 4.16Å; L275-L279 HydrophobicContact CD1-CG 4.12Å; L275-L279 HydrophobicContact CG-CD1 3.96Å; L275-L279 HydrophobicContact CG-CG 4.36Å; L275-L279 WeakPolarHBondContact O-CB 3.19Å; L275-L279 WeakPolarHBondContact O-CG 3.31Å; L275-L279 PolarHBondContact O-N 3.46Å; L275-L326 HydrophobicContact CD1-CD1 4.07Å; L275-L326 HydrophobicContact CD1-CD2 4.22Å; L275-E335 HydrophobicContact CD2-CB 3.75Å; L275-E335 HydrophobicContact CD2-CG 4.31Å; L275-E335 WeakPolarHBondContact CD2-O 3.45Å; L275-L339 HydrophobicContact CD2-CB 4.42Å
276	V	89.7	Confident	86.1	Confident	57 Å²	57	66.8 Å²	66.8	35%	0.345	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-44.9	176.3	175.8	0	0	0	0	110.2	M273 E280 S338	M273-V276 HydrophobicContact CE-CB 4.07Å; M273-V276 HydrophobicContact CE-CG1 4.21Å; M273-V276 HydrophobicContact CE-CG2 3.8Å; M273-V276 PolarHBondContact O-N 3.28Å; V276-E280 WeakPolarHBondContact O-CB 3.34Å; V276-E280 PolarHBondContact O-N 3.43Å; V276-S338 VanDerWaalsContact CG2-OG 3.29Å; V276-S338 WeakPolarHBondContact CG2-OG 3.43Å
277	R	88.7	Confident	87.1	Confident	133 Å²	133	66 Å²	66	50%	0.502	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-42.5	178.4	-174	171.1	179.4	170.2	-1	112	D266 M273 W274 L275 E280 I281	D266-R277 VanDerWaalsContact OD2-CD 3.29Å; D266-R277 WeakPolarHBondContact OD2-CD 3.43Å; D266-R277 IonicContact OD2-CZ 3.77Å; D266-R277 IonicContact OD2-NE 2.82Å; D266-R277 PolarHBondContact OD2-NE 3.49Å; D266-R277 IonicContact OD2-NH1 3.33Å; M273-R277 PolarHBondContact O-N 3.44Å; W274-R277 PolarHBondContact O-N 3.45Å; L275-R277 VanDerWaalsContact C-N 3.29Å; L275-R277 PolarHBondContact O-N 2.97Å; R277-E280 PolarHBondContact O-N 3.15Å; R277-I281 HydrophobicContact CG-CD1 3.91Å; R277-I281 HydrophobicContact CG-CG1 4.5Å; R277-I281 WeakPolarHBondContact O-CB 3.48Å; R277-I281 WeakPolarHBondContact O-CG1 3.29Å; R277-I281 PolarHBondContact O-N 2.93Å
278	H	90.4	Very high	88	Confident	5 Å²	5	65.8 Å²	65.8	2%	0.023	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-48.2	177.2	-178.3	51.7	0	0	0	111.4	T263 W274 L275 E280 I281 I282 R322	T263-H278 PolarHBondContact O-ND1 3.31Å; T263-H278 PolarHBondContact OG1-CE1 3Å; W274-H278 VanDerWaalsContact O-CB 3.28Å; W274-H278 WeakPolarHBondContact O-CB 3.43Å; W274-H278 PolarHBondContact O-N 2.91Å; L275-H278 PolarHBondContact O-N 3.05Å; H278-E280 VanDerWaalsContact C-N 3.34Å; H278-E280 PolarHBondContact O-N 3.48Å; H278-I281 PolarHBondContact O-N 3.37Å; H278-I282 WeakPolarHBondContact O-CG1 3.24Å; H278-I282 PolarHBondContact O-N 3.19Å; H278-R322 PolarHBondContact NE2-NE 3.11Å; H278-R322 PolarHBondContact NE2-NH2 3.48Å; H278-R322 VanDerWaalsContact NE2-NH2 3.13Å
279	L	91.8	Very high	88.7	Confident	3 Å²	3	61 Å²	61	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-38.8	178	-69.4	173.5	0	0	0	112.4	L275 I282 R283 M323 L339 W342	L275-L279 HydrophobicContact CD1-CD1 4.16Å; L275-L279 HydrophobicContact CD1-CG 4.12Å; L275-L279 HydrophobicContact CG-CD1 3.96Å; L275-L279 HydrophobicContact CG-CG 4.36Å; L275-L279 WeakPolarHBondContact O-CB 3.19Å; L275-L279 WeakPolarHBondContact O-CG 3.31Å; L275-L279 PolarHBondContact O-N 3.46Å; L279-I282 PolarHBondContact O-N 3.38Å; L279-R283 WeakPolarHBondContact O-CB 3.28Å; L279-R283 PolarHBondContact O-N 2.9Å; L279-M323 HydrophobicContact CD2-CE 3.73Å; L279-M323 HydrophobicContact CD2-SD 3.74Å; L279-L339 HydrophobicContact CD2-CD1 4.43Å; L279-W342 HydrophobicContact CB-CD2 4.43Å; L279-W342 HydrophobicContact CB-CG 4.01Å; L279-W342 HydrophobicContact CD1-CB 3.88Å; L279-W342 HydrophobicContact CD1-CG 4.1Å; L279-W342 HydrophobicContact CD2-CD2 3.99Å; L279-W342 HydrophobicContact CD2-CE3 4.25Å; L279-W342 HydrophobicContact CD2-CG 4.11Å; L279-W342 HydrophobicContact CG-CG 4.29Å; L279-W342 PolarHBondContact O-NE1 2.87Å; L279-W342 VanDerWaalsContact O-NE1 3.15Å
280	E	91.5	Very high	89.6	Confident	63 Å²	63	52 Å²	52	29%	0.294	25%	0.246	S	C	.	.	H	α-helix	trans	-68.3	-38.2	176.6	176.1	58.7	-168.5	0	0	112.6	V276 R277 H278 R283 K284	V276-E280 WeakPolarHBondContact O-CB 3.34Å; V276-E280 PolarHBondContact O-N 3.43Å; R277-E280 PolarHBondContact O-N 3.15Å; H278-E280 VanDerWaalsContact C-N 3.34Å; H278-E280 PolarHBondContact O-N 3.48Å; E280-R283 PolarHBondContact O-N 3.4Å; E280-R283 IonicContact OE1-CZ 3.58Å; E280-R283 IonicContact OE1-NE 2.9Å; E280-R283 IonicContact OE1-NH2 3.95Å; E280-R283 PolarHBondContact OE1-NH2 2.91Å; E280-R283 IonicContact OE2-CZ 2.74Å; E280-R283 IonicContact OE2-NE 2.75Å; E280-R283 PolarHBondContact OE2-NE 3.31Å; E280-R283 IonicContact OE2-NH2 3.01Å; E280-R283 PolarHBondContact OE2-NH2 2.88Å; E280-K284 PolarHBondContact O-N 2.9Å; E280-K284 VanDerWaalsContact O-N 3.08Å; E280-K284 WeakPolarHBondContact OE1-CE 3.32Å; E280-K284 IonicContact OE1-NZ 3.59Å; E280-K284 PolarHBondContact OE1-NZ 2.96Å
281	I	91.8	Very high	90.4	Very high	41 Å²	41	49.8 Å²	49.8	21%	0.21	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-46.3	174.4	-71.8	168.8	0	0	0	110.2	T263 R277 H278 R283 K284 Y285	T263-I281 HydrophobicContact CG2-CG2 3.96Å; R277-I281 HydrophobicContact CG-CD1 3.91Å; R277-I281 HydrophobicContact CG-CG1 4.5Å; R277-I281 WeakPolarHBondContact O-CB 3.48Å; R277-I281 WeakPolarHBondContact O-CG1 3.29Å; R277-I281 PolarHBondContact O-N 2.93Å; H278-I281 PolarHBondContact O-N 3.37Å; I281-R283 PolarHBondContact O-N 3.33Å; I281-K284 PolarHBondContact O-N 2.66Å; I281-Y285 HydrophobicContact CG2-CD2 3.4Å; I281-Y285 HydrophobicContact CG2-CE2 3.23Å; I281-Y285 VanDerWaalsContact O-CD2 3.29Å; I281-Y285 WeakPolarHBondContact O-CD2 3.37Å; I281-Y285 PolarHBondContact O-N 3Å
282	I	92.8	Very high	91.1	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-57.4	-49.2	175.2	-72	171.8	0	0	0	110.3	I260 T263 H278 L279 K284 Y285 V286 L319 M323 W342	I260-I282 HydrophobicContact CG2-CD1 4.3Å; T263-I282 WeakPolarHBondContact OG1-CG1 3.31Å; H278-I282 WeakPolarHBondContact O-CG1 3.24Å; H278-I282 PolarHBondContact O-N 3.19Å; L279-I282 PolarHBondContact O-N 3.38Å; I282-K284 VanDerWaalsContact C-N 3.35Å; I282-K284 PolarHBondContact O-N 3.15Å; I282-Y285 PolarHBondContact O-N 3.13Å; I282-V286 HydrophobicContact CG2-CG2 4.15Å; I282-V286 WeakPolarHBondContact O-CB 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.45Å; I282-V286 PolarHBondContact O-N 3.47Å; I282-L319 HydrophobicContact CG2-CD2 3.34Å; I282-M323 HydrophobicContact CD1-CE 4.13Å; I282-W342 HydrophobicContact CG2-CH2 4.21Å; I282-W342 HydrophobicContact CG2-CZ2 4.09Å
283	R	93.8	Very high	91.8	Very high	33 Å²	33	39 Å²	39	13%	0.125	18%	0.18	C	C	.	.	H	α-helix	trans	-53.5	-50.8	179.1	-173.3	-166.9	66.4	82.2	-5.3	111.5	L279 E280 I281 L287 W342 T346 E351 M352	L279-R283 WeakPolarHBondContact O-CB 3.28Å; L279-R283 PolarHBondContact O-N 2.9Å; E280-R283 PolarHBondContact O-N 3.4Å; E280-R283 IonicContact OE1-CZ 3.58Å; E280-R283 IonicContact OE1-NE 2.9Å; E280-R283 IonicContact OE1-NH2 3.95Å; E280-R283 PolarHBondContact OE1-NH2 2.91Å; E280-R283 IonicContact OE2-CZ 2.74Å; E280-R283 IonicContact OE2-NE 2.75Å; E280-R283 PolarHBondContact OE2-NE 3.31Å; E280-R283 IonicContact OE2-NH2 3.01Å; E280-R283 PolarHBondContact OE2-NH2 2.88Å; I281-R283 PolarHBondContact O-N 3.33Å; R283-L287 WeakPolarHBondContact O-CB 3.31Å; R283-L287 PolarHBondContact O-N 3.03Å; R283-L287 VanDerWaalsContact O-N 3.16Å; R283-W342 HydrophobicContact CB-CZ2 4.27Å; R283-T346 HydrophobicContact CG-CG2 4.25Å; R283-E351 PolarHBondContact NH1-O 3.03Å; R283-M352 HydrophobicContact CG-CB 4.08Å; R283-M352 HydrophobicContact CG-CG 4.15Å; R283-M352 HydrophobicContact CG-SD 4.17Å
284	K	92.1	Very high	92.1	Very high	117 Å²	117	35.9 Å²	35.9	51%	0.509	16%	0.163	S	C	.	.	H	α-helix	trans	-63.8	-46.4	-179.5	-76.6	179	172.9	149	0	112.6	E280 I281 I282 D288	E280-K284 PolarHBondContact O-N 2.9Å; E280-K284 VanDerWaalsContact O-N 3.08Å; E280-K284 WeakPolarHBondContact OE1-CE 3.32Å; E280-K284 IonicContact OE1-NZ 3.59Å; E280-K284 PolarHBondContact OE1-NZ 2.96Å; I281-K284 PolarHBondContact O-N 2.66Å; I282-K284 VanDerWaalsContact C-N 3.35Å; I282-K284 PolarHBondContact O-N 3.15Å; K284-D288 WeakPolarHBondContact O-CB 3.2Å; K284-D288 PolarHBondContact O-N 3.09Å
285	Y	91.4	Very high	92.2	Very high	114 Å²	114	39.5 Å²	39.5	45%	0.447	19%	0.186	S	C	.	.	H	α-helix	trans	-67.9	-44.7	-177.1	-77.9	-47.3	0	0	0	112.8	T263 I281 I282 L287 D288 D289	T263-Y285 HydrophobicContact CG2-CD2 3.42Å; T263-Y285 VanDerWaalsContact CG2-CD2 3.42Å; T263-Y285 HydrophobicContact CG2-CE2 3.74Å; I281-Y285 HydrophobicContact CG2-CD2 3.4Å; I281-Y285 HydrophobicContact CG2-CE2 3.23Å; I281-Y285 VanDerWaalsContact O-CD2 3.29Å; I281-Y285 WeakPolarHBondContact O-CD2 3.37Å; I281-Y285 PolarHBondContact O-N 3Å; I282-Y285 PolarHBondContact O-N 3.13Å; Y285-L287 VanDerWaalsContact C-N 3.32Å; Y285-L287 PolarHBondContact O-N 3.25Å; Y285-D288 PolarHBondContact O-N 3.04Å; Y285-D289 WeakPolarHBondContact O-CB 3.3Å; Y285-D289 PolarHBondContact O-N 2.82Å
286	V	93.6	Very high	92.4	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-42	179.2	173.5	0	0	0	0	110.5	I282 D289 L290 Y315 L319 M352 M353	I282-V286 HydrophobicContact CG2-CG2 4.15Å; I282-V286 WeakPolarHBondContact O-CB 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.45Å; I282-V286 PolarHBondContact O-N 3.47Å; V286-D289 PolarHBondContact O-N 2.84Å; V286-L290 HydrophobicContact CG1-CD1 3.83Å; V286-L290 HydrophobicContact CG1-CG 4.25Å; V286-L290 WeakPolarHBondContact O-CB 3.49Å; V286-L290 VanDerWaalsContact O-CG 3.27Å; V286-L290 WeakPolarHBondContact O-CG 3.44Å; V286-L290 PolarHBondContact O-N 2.81Å; V286-Y315 HydrophobicContact CB-CD1 4.42Å; V286-Y315 HydrophobicContact CG1-CD1 3.98Å; V286-Y315 HydrophobicContact CG1-CG 4.3Å; V286-Y315 HydrophobicContact CG2-CD1 3.87Å; V286-Y315 HydrophobicContact CG2-CE1 4.16Å; V286-L319 HydrophobicContact CG1-CD1 4.32Å; V286-L319 HydrophobicContact CG2-CD1 4.43Å; V286-L319 HydrophobicContact CG2-CD2 4.28Å; V286-M352 HydrophobicContact CB-CE 3.75Å; V286-M352 HydrophobicContact CG1-CE 3.71Å; V286-M352 HydrophobicContact CG2-CE 4.3Å; V286-M353 HydrophobicContact CG1-CE 4.12Å
287	L	94.1	Very high	92.5	Very high	21 Å²	21	40.1 Å²	40.1	11%	0.11	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-50.5	176.7	-179.2	61.3	0	0	0	111.6	R283 Y285 D289 L290 L291 N355 L358	R283-L287 WeakPolarHBondContact O-CB 3.31Å; R283-L287 PolarHBondContact O-N 3.03Å; R283-L287 VanDerWaalsContact O-N 3.16Å; Y285-L287 VanDerWaalsContact C-N 3.32Å; Y285-L287 PolarHBondContact O-N 3.25Å; L287-D289 VanDerWaalsContact C-N 3.29Å; L287-D289 PolarHBondContact O-N 2.83Å; L287-L290 PolarHBondContact O-N 2.73Å; L287-L291 HydrophobicContact CD1-CD1 4.25Å; L287-L291 HydrophobicContact CD1-CG 4.23Å; L287-L291 HydrophobicContact CG-CD1 4.09Å; L287-L291 HydrophobicContact CG-CG 4.48Å; L287-L291 VanDerWaalsContact O-CG 3.25Å; L287-L291 WeakPolarHBondContact O-CG 3.3Å; L287-L291 PolarHBondContact O-N 2.8Å; L287-N355 HydrophobicContact CD1-CB 3.98Å; L287-L358 HydrophobicContact CD1-CD1 3.89Å; L287-L358 HydrophobicContact CD1-CG 4.37Å
288	D	93.5	Very high	92.7	Very high	66 Å²	66	36.8 Å²	36.8	35%	0.353	18%	0.18	S	C	.	.	H	α-helix	trans	-58.9	-40.5	178.1	-178.4	48.7	0	0	0	112.3	R203 K284 Y285 V292	R203-D288 IonicContact CZ-OD2 2.8Å; R203-D288 IonicContact NH1-OD2 2.69Å; R203-D288 PolarHBondContact NH1-OD2 3.49Å; R203-D288 IonicContact NH2-OD1 2.91Å; R203-D288 PolarHBondContact NH2-OD1 3.3Å; R203-D288 IonicContact NH2-OD2 2.92Å; R203-D288 PolarHBondContact NH2-OD2 2.86Å; K284-D288 WeakPolarHBondContact O-CB 3.2Å; K284-D288 PolarHBondContact O-N 3.09Å; Y285-D288 PolarHBondContact O-N 3.04Å; D288-V292 WeakPolarHBondContact O-CG2 3.33Å; D288-V292 PolarHBondContact O-N 2.98Å; D288-V292 VanDerWaalsContact O-N 3.08Å
289	D	93.6	Very high	92.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-42.2	178.4	-74.5	-25.1	0	0	0	112.6	L199 R259 Y285 V286 L287 V292 A293 Y315	L199-D289 HydrophobicContact CD1-CB 3.8Å; R259-D289 WeakPolarHBondContact CD-OD2 3.42Å; R259-D289 IonicContact CZ-OD1 3.27Å; R259-D289 IonicContact CZ-OD2 3.38Å; R259-D289 IonicContact NE-OD2 3.54Å; R259-D289 PolarHBondContact NE-OD2 3.07Å; R259-D289 IonicContact NH1-OD1 2.75Å; R259-D289 PolarHBondContact NH1-OD1 2.81Å; R259-D289 IonicContact NH1-OD2 2.7Å; R259-D289 PolarHBondContact NH1-OD2 3.48Å; R259-D289 VanDerWaalsContact NH2-CG 3.35Å; R259-D289 IonicContact NH2-OD1 2.88Å; R259-D289 PolarHBondContact NH2-OD1 3.38Å; R259-D289 IonicContact NH2-OD2 3.53Å; R259-D289 PolarHBondContact NH2-OD2 3.46Å; R259-D289 VanDerWaalsContact NH2-OD2 3.17Å; Y285-D289 WeakPolarHBondContact O-CB 3.3Å; Y285-D289 PolarHBondContact O-N 2.82Å; V286-D289 PolarHBondContact O-N 2.84Å; L287-D289 VanDerWaalsContact C-N 3.29Å; L287-D289 PolarHBondContact O-N 2.83Å; D289-V292 PolarHBondContact O-N 3.47Å; D289-A293 VanDerWaalsContact O-CB 3.3Å; D289-A293 WeakPolarHBondContact O-CB 3.43Å; D289-A293 PolarHBondContact O-N 2.83Å; D289-Y315 HydrophobicContact CB-CE2 4.34Å; D289-Y315 WeakPolarHBondContact CB-OH 3.41Å; D289-Y315 PolarHBondContact OD2-OH 2.84Å
290	L	94.3	Very high	92.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-68.3	-38	177.2	-70.8	176.1	0	0	0	111.8	V286 L287 V292 A293 K294 F308 L312 Y315 M353 L358	V286-L290 HydrophobicContact CG1-CD1 3.83Å; V286-L290 HydrophobicContact CG1-CG 4.25Å; V286-L290 WeakPolarHBondContact O-CB 3.49Å; V286-L290 VanDerWaalsContact O-CG 3.27Å; V286-L290 WeakPolarHBondContact O-CG 3.44Å; V286-L290 PolarHBondContact O-N 2.81Å; L287-L290 PolarHBondContact O-N 2.73Å; L290-V292 VanDerWaalsContact C-N 3.32Å; L290-V292 PolarHBondContact O-N 2.85Å; L290-A293 WeakPolarHBondContact O-CB 3.3Å; L290-A293 PolarHBondContact O-N 2.87Å; L290-K294 WeakPolarHBondContact O-CB 3.31Å; L290-K294 PolarHBondContact O-N 3.29Å; L290-F308 HydrophobicContact CD2-CE2 4.46Å; L290-L312 HydrophobicContact CD1-CD1 4Å; L290-L312 HydrophobicContact CD2-CD1 4.16Å; L290-Y315 HydrophobicContact CD2-CD2 3.85Å; L290-Y315 HydrophobicContact CD2-CE2 4.38Å; L290-Y315 HydrophobicContact CD2-CG 4.5Å; L290-Y315 HydrophobicContact CG-CD2 4.49Å; L290-M353 HydrophobicContact CD1-CE 3.92Å; L290-M353 HydrophobicContact CD1-SD 3.8Å; L290-L358 HydrophobicContact CB-CD2 3.92Å
291	L	93.8	Very high	92.8	Very high	29 Å²	29	42.1 Å²	42.1	15%	0.152	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-42.5	174.6	-70	173.9	0	0	0	111.2	L287 K294 T295 E357 L358	L287-L291 HydrophobicContact CD1-CD1 4.25Å; L287-L291 HydrophobicContact CD1-CG 4.23Å; L287-L291 HydrophobicContact CG-CD1 4.09Å; L287-L291 HydrophobicContact CG-CG 4.48Å; L287-L291 VanDerWaalsContact O-CG 3.25Å; L287-L291 WeakPolarHBondContact O-CG 3.3Å; L287-L291 PolarHBondContact O-N 2.8Å; L291-K294 PolarHBondContact O-N 3.46Å; L291-T295 WeakPolarHBondContact O-CB 3.4Å; L291-T295 WeakPolarHBondContact O-CG2 3.49Å; L291-T295 PolarHBondContact O-N 3.45Å; L291-T295 PolarHBondContact O-OG1 3.23Å; L291-E357 HydrophobicContact CD2-CB 3.46Å; L291-E357 VanDerWaalsContact CD2-CB 3.46Å; L291-E357 WeakPolarHBondContact CD2-OE2 3.33Å; L291-L358 HydrophobicContact CD2-CD2 3.81Å; L291-L358 HydrophobicContact CD2-CG 4.21Å; L291-L358 HydrophobicContact CG-CD2 4.37Å
292	V	94	Very high	92.9	Very high	14 Å²	14	41.9 Å²	41.9	9%	0.085	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-32	176.4	168.8	0	0	0	0	112.7	L199 V202 R203 D288 D289 L290 L296 L297	L199-V292 HydrophobicContact CD2-CG1 4.32Å; V202-V292 HydrophobicContact CG1-CG1 3.78Å; R203-V292 HydrophobicContact CG-CG1 4.06Å; D288-V292 WeakPolarHBondContact O-CG2 3.33Å; D288-V292 PolarHBondContact O-N 2.98Å; D288-V292 VanDerWaalsContact O-N 3.08Å; D289-V292 PolarHBondContact O-N 3.47Å; L290-V292 VanDerWaalsContact C-N 3.32Å; L290-V292 PolarHBondContact O-N 2.85Å; V292-L296 HydrophobicContact CG1-CB 4.46Å; V292-L296 HydrophobicContact CG1-CD1 4.26Å; V292-L296 PolarHBondContact O-N 3.07Å; V292-L297 PolarHBondContact O-N 3.46Å; V292-L297 VanDerWaalsContact O-N 3.08Å
293	A	93.4	Very high	92.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-62	-46.7	172.1	0	0	0	0	0	111.5	L199 D289 L290 L297 D298 F308 L311	L199-A293 HydrophobicContact CD2-CB 4.34Å; D289-A293 VanDerWaalsContact O-CB 3.3Å; D289-A293 WeakPolarHBondContact O-CB 3.43Å; D289-A293 PolarHBondContact O-N 2.83Å; L290-A293 WeakPolarHBondContact O-CB 3.3Å; L290-A293 PolarHBondContact O-N 2.87Å; A293-L297 HydrophobicContact CB-CB 4.34Å; A293-L297 HydrophobicContact CB-CD2 4.2Å; A293-L297 VanDerWaalsContact O-CB 3.3Å; A293-L297 WeakPolarHBondContact O-CB 3.38Å; A293-L297 PolarHBondContact O-N 3.18Å; A293-D298 PolarHBondContact O-N 3.07Å; A293-F308 HydrophobicContact CB-CD2 4.05Å; A293-F308 HydrophobicContact CB-CE2 4.39Å; A293-L311 HydrophobicContact CB-CD2 3.43Å; A293-L311 VanDerWaalsContact CB-CD2 3.43Å
294	K	92	Very high	92.6	Very high	39 Å²	39	52 Å²	52	17%	0.17	27%	0.266	C	S	.	.	I	π-helix	trans	-65	-48	178.6	178	175.5	165.9	170.7	0	112.3	L290 L291 F308 E357 S359 E361	L290-K294 WeakPolarHBondContact O-CB 3.31Å; L290-K294 PolarHBondContact O-N 3.29Å; L291-K294 PolarHBondContact O-N 3.46Å; K294-F308 HydrophobicContact CB-CD2 3.89Å; K294-F308 HydrophobicContact CB-CE2 3.64Å; K294-F308 HydrophobicContact CB-CZ 4.36Å; K294-E357 WeakPolarHBondContact CD-O 3.45Å; K294-E357 WeakPolarHBondContact CE-O 3.24Å; K294-E357 PolarHBondContact NZ-O 3.36Å; K294-S359 PolarHBondContact NZ-O 2.94Å; K294-E361 WeakPolarHBondContact CD-OE2 3.49Å; K294-E361 WeakPolarHBondContact CE-OE1 3.28Å; K294-E361 WeakPolarHBondContact CE-OE2 3.5Å; K294-E361 IonicContact NZ-OE1 2.95Å; K294-E361 IonicContact NZ-OE2 2.8Å; K294-E361 PolarHBondContact NZ-OE2 2.8Å
295	T	90.8	Very high	92.6	Very high	84 Å²	84	46.8 Å²	46.8	52%	0.515	24%	0.243	S	C	.	.	I	π-helix	trans	-80.5	-40	-170.3	52.4	0	0	0	0	113.5	L291	L291-T295 WeakPolarHBondContact O-CB 3.4Å; L291-T295 WeakPolarHBondContact O-CG2 3.49Å; L291-T295 PolarHBondContact O-N 3.45Å; L291-T295 PolarHBondContact O-OG1 3.23Å
296	L	92.6	Very high	92.6	Very high	71 Å²	71	44.9 Å²	44.9	37%	0.372	24%	0.241	S	C	.	.	I	π-helix	trans	-115.7	-45.3	-171	-58.6	-177.7	0	0	0	112.8	V202 R203 V292 C300	V202-L296 HydrophobicContact CB-CB 4.46Å; V202-L296 HydrophobicContact CG1-CB 3.9Å; V202-L296 HydrophobicContact CG1-CD1 4.44Å; V202-L296 HydrophobicContact CG2-CB 3.75Å; R203-L296 HydrophobicContact CG-CD1 4.18Å; V292-L296 HydrophobicContact CG1-CB 4.46Å; V292-L296 HydrophobicContact CG1-CD1 4.26Å; V292-L296 PolarHBondContact O-N 3.07Å; L296-C300 PolarHBondContact O-SG 3.22Å
297	L	93.1	Very high	92.6	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	24%	0.241	C	C	.	.	I	π-helix	trans	-67.9	-42.5	-173.7	-165.5	73	0	0	0	111.6	L199 V202 L209 V292 A293 Q299 C300 F301 I307 L311	L199-L297 HydrophobicContact CD2-CD2 4.2Å; V202-L297 HydrophobicContact CB-CD1 4.39Å; V202-L297 HydrophobicContact CG1-CD1 4.47Å; L209-L297 HydrophobicContact CD2-CD1 3.41Å; L209-L297 VanDerWaalsContact CD2-CD1 3.41Å; V292-L297 PolarHBondContact O-N 3.46Å; V292-L297 VanDerWaalsContact O-N 3.08Å; A293-L297 HydrophobicContact CB-CB 4.34Å; A293-L297 HydrophobicContact CB-CD2 4.2Å; A293-L297 VanDerWaalsContact O-CB 3.3Å; A293-L297 WeakPolarHBondContact O-CB 3.38Å; A293-L297 PolarHBondContact O-N 3.18Å; L297-Q299 PolarHBondContact O-N 3.15Å; L297-C300 WeakPolarHBondContact O-CB 3.38Å; L297-C300 PolarHBondContact O-N 3.17Å; L297-F301 HydrophobicContact CD1-CE2 3.89Å; L297-F301 HydrophobicContact CG-CD2 4.33Å; L297-F301 HydrophobicContact CG-CE2 3.9Å; L297-F301 WeakPolarHBondContact O-CD2 3.25Å; L297-I307 HydrophobicContact CD2-CG1 4.34Å; L297-L311 HydrophobicContact CD2-CD2 3.94Å
298	D	92.3	Very high	92.6	Very high	64 Å²	64	44.4 Å²	44.4	34%	0.342	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-57.8	-37	-177.4	-162	61.6	0	0	0	112.4	A293 C300 F301 I307	A293-D298 PolarHBondContact O-N 3.07Å; D298-C300 PolarHBondContact O-N 3.44Å; D298-F301 PolarHBondContact O-N 3.22Å; D298-I307 HydrophobicContact CB-CG2 4.46Å; D298-I307 WeakPolarHBondContact OD1-CG2 2.85Å
299	Q	90.8	Very high	92.6	Very high	153 Å²	153	47.6 Å²	47.6	72%	0.715	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-67	-18.5	177.4	-57.3	-59.6	-35.5	0	0	113.7	L297	L297-Q299 PolarHBondContact O-N 3.15Å
300	C	92.2	Very high	92.5	Very high	12 Å²	12	52.8 Å²	52.8	8%	0.081	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-87.5	-14.3	-179.5	-63.4	0	0	0	0	113.3	V202 L209 V210 L296 L297 D298	V202-C300 VanDerWaalsContact CG2-SG 3.56Å; L209-C300 HydrophobicContact CD2-CB 4.04Å; L209-C300 HydrophobicContact CG-CB 4.41Å; V210-C300 HydrophobicContact CG2-CB 3.85Å; L296-C300 PolarHBondContact O-SG 3.22Å; L297-C300 WeakPolarHBondContact O-CB 3.38Å; L297-C300 PolarHBondContact O-N 3.17Å; D298-C300 PolarHBondContact O-N 3.44Å
301	F	93.9	Very high	92.5	Very high	18 Å²	18	53 Å²	53	8%	0.079	27%	0.272	C	S	.	.	S	Bend	trans	-109.7	150.1	-176.7	-73	-101.1	0	0	0	111.6	L209 V213 M248 L297 D298 Y305 I307	L209-F301 HydrophobicContact CD2-CE2 4.11Å; V213-F301 HydrophobicContact CG1-CD1 4.07Å; V213-F301 HydrophobicContact CG1-CE1 4.41Å; V213-F301 HydrophobicContact CG2-CD1 3.87Å; V213-F301 HydrophobicContact CG2-CE1 3.51Å; V213-F301 HydrophobicContact CG2-CE2 4.25Å; V213-F301 HydrophobicContact CG2-CG 4.39Å; V213-F301 HydrophobicContact CG2-CZ 3.72Å; M248-F301 HydrophobicContact CE-CE1 3.92Å; M248-F301 HydrophobicContact SD-CE1 3.85Å; L297-F301 HydrophobicContact CD1-CE2 3.89Å; L297-F301 HydrophobicContact CG-CD2 4.33Å; L297-F301 HydrophobicContact CG-CE2 3.9Å; L297-F301 WeakPolarHBondContact O-CD2 3.25Å; D298-F301 PolarHBondContact O-N 3.22Å; F301-Y305 AromaticContact CD1-CD1 3.92Å; F301-Y305 HydrophobicContact CD1-CD1 3.92Å; F301-Y305 HydrophobicContact CD1-CE1 4.46Å; F301-Y305 HydrophobicContact CD1-CG 4.28Å; F301-Y305 HydrophobicContact CE1-CD1 4.48Å; F301-I307 HydrophobicContact CB-CB 4.09Å; F301-I307 HydrophobicContact CB-CG2 3.8Å; F301-I307 HydrophobicContact CD1-CB 4.28Å; F301-I307 HydrophobicContact CD1-CD1 4.25Å; F301-I307 HydrophobicContact CD1-CG1 4.12Å; F301-I307 HydrophobicContact CD2-CB 4.18Å; F301-I307 HydrophobicContact CD2-CG1 3.89Å; F301-I307 HydrophobicContact CD2-CG2 3.89Å; F301-I307 HydrophobicContact CE1-CD1 4.03Å; F301-I307 HydrophobicContact CE1-CG1 4.19Å; F301-I307 HydrophobicContact CE2-CG1 3.97Å; F301-I307 HydrophobicContact CG-CB 3.93Å; F301-I307 HydrophobicContact CG-CG1 3.97Å; F301-I307 HydrophobicContact CG-CG2 3.91Å; F301-I307 HydrophobicContact CZ-CD1 4.19Å; F301-I307 HydrophobicContact CZ-CG1 4.12Å
302	P	92.6	Very high	92.4	Very high	36 Å²	36	52.5 Å²	52.5	23%	0.234	27%	0.269	C	S	.	.			trans	-62.8	145.2	170	-22.8	33.7	0	0	0	112.1	E217 H304 Y305	E217-P302 HydrophobicContact CG-CG 4.41Å; P302-H304 WeakPolarHBondContact CB-CE1 3.34Å; P302-H304 WeakPolarHBondContact CB-ND1 3.34Å; P302-H304 PolarHBondContact O-N 2.85Å; P302-Y305 HydrophobicContact CB-CD2 4.08Å; P302-Y305 HydrophobicContact CB-CE2 4.48Å; P302-Y305 HydrophobicContact CG-CD2 4.11Å; P302-Y305 HydrophobicContact CG-CE2 4.15Å; P302-Y305 WeakPolarHBondContact O-CB 3.41Å; P302-Y305 PolarHBondContact O-N 2.96Å
303	P	90.4	Very high	92.4	Very high	130 Å²	130	55.1 Å²	55.1	84%	0.844	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-56.6	-30	-175.7	-28.3	34.5	0	0	0	115.1	Y305 D306	P303-Y305 PolarHBondContact O-N 3.04Å; P303-D306 PolarHBondContact O-N 3.28Å
304	H	90.6	Very high	92.5	Very high	117 Å²	117	56.1 Å²	56.1	54%	0.542	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-72.9	-6.2	-180	72.3	-92.7	0	0	0	114.2	E217 P302	E217-H304 IonicContact OE1-NE2 2.6Å; E217-H304 IonicContact OE2-CE1 3.31Å; E217-H304 IonicContact OE2-NE2 2.93Å; P302-H304 WeakPolarHBondContact CB-CE1 3.34Å; P302-H304 WeakPolarHBondContact CB-ND1 3.34Å; P302-H304 PolarHBondContact O-N 2.85Å
305	Y	91.9	Very high	92.6	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.027	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-78.5	-28.2	171.9	-86.5	-115	0	0	0	112.4	E217 K245 M248 F249 F301 P302 P303 I307	E217-Y305 HydrophobicContact CG-CE2 4.21Å; E217-Y305 WeakPolarHBondContact OE1-CE2 3.48Å; E217-Y305 VanDerWaalsContact OE1-CZ 3.25Å; E217-Y305 PolarHBondContact OE1-OH 2.86Å; K245-Y305 HydrophobicContact CD-CE1 4.01Å; K245-Y305 WeakPolarHBondContact CD-OH 3.35Å; K245-Y305 HydrophobicContact CG-CE1 4.03Å; M248-Y305 HydrophobicContact CE-CD1 4.03Å; M248-Y305 HydrophobicContact CE-CE1 3.72Å; F249-Y305 HydrophobicContact CE2-CD1 4.23Å; F249-Y305 HydrophobicContact CE2-CE1 4.34Å; F249-Y305 AromaticContact CZ-CD1 3.72Å; F249-Y305 HydrophobicContact CZ-CD1 3.72Å; F249-Y305 HydrophobicContact CZ-CE1 4.26Å; F301-Y305 AromaticContact CD1-CD1 3.92Å; F301-Y305 HydrophobicContact CD1-CD1 3.92Å; F301-Y305 HydrophobicContact CD1-CE1 4.46Å; F301-Y305 HydrophobicContact CD1-CG 4.28Å; F301-Y305 HydrophobicContact CE1-CD1 4.48Å; P302-Y305 HydrophobicContact CB-CD2 4.08Å; P302-Y305 HydrophobicContact CB-CE2 4.48Å; P302-Y305 HydrophobicContact CG-CD2 4.11Å; P302-Y305 HydrophobicContact CG-CE2 4.15Å; P302-Y305 WeakPolarHBondContact O-CB 3.41Å; P302-Y305 PolarHBondContact O-N 2.96Å; P303-Y305 PolarHBondContact O-N 3.04Å; Y305-I307 PolarHBondContact O-N 3.22Å
306	D	92	Very high	92.7	Very high	75 Å²	75	51.8 Å²	51.8	40%	0.401	27%	0.268	S	S	.	.			trans	48.1	49.2	-173.4	-164.1	11.1	0	0	0	111.1	P303 F308 K309 K310	P303-D306 PolarHBondContact O-N 3.28Å; D306-F308 VanDerWaalsContact C-N 3.32Å; D306-F308 PolarHBondContact O-N 3.18Å; D306-K309 VanDerWaalsContact CG-CB 3.46Å; D306-K309 PolarHBondContact O-N 3.18Å; D306-K309 WeakPolarHBondContact OD1-CB 3.4Å; D306-K309 WeakPolarHBondContact OD2-CB 3.41Å; D306-K309 WeakPolarHBondContact OD2-CD 3.42Å; D306-K310 WeakPolarHBondContact O-CG 3.19Å; D306-K310 PolarHBondContact O-N 3.13Å
307	I	93.4	Very high	92.7	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-39.2	-165.2	-172.1	60.8	0	0	0	111.3	F249 L252 L297 D298 F301 Y305 K310 L311	F249-I307 HydrophobicContact CE1-CD1 3.82Å; L252-I307 HydrophobicContact CD1-CD1 4Å; L297-I307 HydrophobicContact CD2-CG1 4.34Å; D298-I307 HydrophobicContact CB-CG2 4.46Å; D298-I307 WeakPolarHBondContact OD1-CG2 2.85Å; F301-I307 HydrophobicContact CB-CB 4.09Å; F301-I307 HydrophobicContact CB-CG2 3.8Å; F301-I307 HydrophobicContact CD1-CB 4.28Å; F301-I307 HydrophobicContact CD1-CD1 4.25Å; F301-I307 HydrophobicContact CD1-CG1 4.12Å; F301-I307 HydrophobicContact CD2-CB 4.18Å; F301-I307 HydrophobicContact CD2-CG1 3.89Å; F301-I307 HydrophobicContact CD2-CG2 3.89Å; F301-I307 HydrophobicContact CE1-CD1 4.03Å; F301-I307 HydrophobicContact CE1-CG1 4.19Å; F301-I307 HydrophobicContact CE2-CG1 3.97Å; F301-I307 HydrophobicContact CG-CB 3.93Å; F301-I307 HydrophobicContact CG-CG1 3.97Å; F301-I307 HydrophobicContact CG-CG2 3.91Å; F301-I307 HydrophobicContact CZ-CD1 4.19Å; F301-I307 HydrophobicContact CZ-CG1 4.12Å; Y305-I307 PolarHBondContact O-N 3.22Å; I307-K310 PolarHBondContact O-N 3.37Å; I307-L311 VanDerWaalsContact O-CB 3.31Å; I307-L311 WeakPolarHBondContact O-CB 3.28Å; I307-L311 PolarHBondContact O-N 3.03Å
308	F	93.8	Very high	92.8	Very high	12 Å²	12	53.2 Å²	53.2	5%	0.053	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-49.9	177.3	179.6	-98.5	0	0	0	111.2	L290 A293 K294 D306 K310 L311 L312 L358 E361 V362	L290-F308 HydrophobicContact CD2-CE2 4.46Å; A293-F308 HydrophobicContact CB-CD2 4.05Å; A293-F308 HydrophobicContact CB-CE2 4.39Å; K294-F308 HydrophobicContact CB-CD2 3.89Å; K294-F308 HydrophobicContact CB-CE2 3.64Å; K294-F308 HydrophobicContact CB-CZ 4.36Å; D306-F308 VanDerWaalsContact C-N 3.32Å; D306-F308 PolarHBondContact O-N 3.18Å; F308-K310 VanDerWaalsContact C-N 3.32Å; F308-K310 PolarHBondContact O-N 3.48Å; F308-L311 PolarHBondContact O-N 3.48Å; F308-L312 WeakPolarHBondContact O-CB 3.3Å; F308-L312 PolarHBondContact O-N 3.09Å; F308-L358 HydrophobicContact CZ-CD2 4.46Å; F308-E361 HydrophobicContact CD1-CB 3.73Å; F308-E361 HydrophobicContact CD1-CG 4.33Å; F308-E361 HydrophobicContact CE1-CB 3.38Å; F308-E361 HydrophobicContact CE1-CG 4.35Å; F308-E361 HydrophobicContact CZ-CB 4.23Å; F308-V362 HydrophobicContact CE1-CG2 3.88Å; F308-V362 HydrophobicContact CZ-CG2 3.83Å
309	K	92.4	Very high	92.9	Very high	133 Å²	133	50.1 Å²	50.1	58%	0.578	26%	0.258	S	S	*	.	H	α-helix	trans	-63.4	-38.3	178.9	-167.9	-178.2	-170.9	170.6	0	112.3	D306 S313	D306-K309 VanDerWaalsContact CG-CB 3.46Å; D306-K309 PolarHBondContact O-N 3.18Å; D306-K309 WeakPolarHBondContact OD1-CB 3.4Å; D306-K309 WeakPolarHBondContact OD2-CB 3.41Å; D306-K309 WeakPolarHBondContact OD2-CD 3.42Å; K309-S313 PolarHBondContact O-N 2.92Å
310	K	92.5	Very high	93	Very high	110 Å²	110	43.9 Å²	43.9	48%	0.478	23%	0.231	S	C	.	.	H	α-helix	trans	-64.5	-44.8	175.1	-72.1	-66.9	179.1	-175.6	0	111.7	F249 D306 I307 F308 S313 M314	F249-K310 HydrophobicContact CE1-CB 4.24Å; F249-K310 HydrophobicContact CE1-CG 4.34Å; D306-K310 WeakPolarHBondContact O-CG 3.19Å; D306-K310 PolarHBondContact O-N 3.13Å; I307-K310 PolarHBondContact O-N 3.37Å; F308-K310 VanDerWaalsContact C-N 3.32Å; F308-K310 PolarHBondContact O-N 3.48Å; K310-S313 WeakPolarHBondContact O-CB 3.29Å; K310-S313 PolarHBondContact O-N 3.41Å; K310-M314 WeakPolarHBondContact O-CG 3.22Å; K310-M314 PolarHBondContact O-N 3.49Å
311	L	93.3	Very high	93	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-41.3	177.9	-165.9	72.4	0	0	0	111.4	V256 A293 L297 I307 F308 S313 M314 Y315	V256-L311 HydrophobicContact CG2-CD1 3.93Å; A293-L311 HydrophobicContact CB-CD2 3.43Å; A293-L311 VanDerWaalsContact CB-CD2 3.43Å; L297-L311 HydrophobicContact CD2-CD2 3.94Å; I307-L311 VanDerWaalsContact O-CB 3.31Å; I307-L311 WeakPolarHBondContact O-CB 3.28Å; I307-L311 PolarHBondContact O-N 3.03Å; F308-L311 PolarHBondContact O-N 3.48Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 3.27Å; L311-M314 HydrophobicContact CD1-SD 4.45Å; L311-M314 WeakPolarHBondContact O-CB 3.39Å; L311-M314 PolarHBondContact O-N 3.27Å; L311-M314 VanDerWaalsContact O-N 3.13Å; L311-Y315 HydrophobicContact CD1-CD2 4.44Å; L311-Y315 HydrophobicContact CD1-CE2 4.06Å; L311-Y315 HydrophobicContact CD2-CD2 4.45Å; L311-Y315 HydrophobicContact CD2-CE2 3.93Å; L311-Y315 HydrophobicContact CG-CD2 3.87Å; L311-Y315 HydrophobicContact CG-CE2 3.7Å; L311-Y315 WeakPolarHBondContact O-CD2 3.33Å; L311-Y315 PolarHBondContact O-N 3.47Å
312	L	93.4	Very high	92.9	Very high	18 Å²	18	47 Å²	47	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-56	-45.8	173.2	-179.9	67.8	0	0	0	111.4	L290 F308 M314 Y315 H316 M353 V362	L290-L312 HydrophobicContact CD1-CD1 4Å; L290-L312 HydrophobicContact CD2-CD1 4.16Å; F308-L312 WeakPolarHBondContact O-CB 3.3Å; F308-L312 PolarHBondContact O-N 3.09Å; L312-M314 VanDerWaalsContact C-N 3.35Å; L312-M314 PolarHBondContact O-N 3.41Å; L312-Y315 PolarHBondContact O-N 2.96Å; L312-H316 WeakPolarHBondContact O-CB 3.28Å; L312-H316 PolarHBondContact O-N 3.15Å; L312-M353 HydrophobicContact CD1-SD 4.23Å; L312-V362 HydrophobicContact CD1-CG2 4.18Å; L312-V362 HydrophobicContact CD2-CG2 3.98Å
313	S	93.2	Very high	93	Very high	70 Å²	70	45.3 Å²	45.3	49%	0.49	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-38.2	176	-171.8	0	0	0	0	112.7	K309 K310 L311 Q317	K309-S313 PolarHBondContact O-N 2.92Å; K310-S313 WeakPolarHBondContact O-CB 3.29Å; K310-S313 PolarHBondContact O-N 3.41Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 3.27Å; S313-Q317 WeakPolarHBondContact O-CB 3.47Å; S313-Q317 PolarHBondContact O-N 2.87Å
314	M	94.6	Very high	93.1	Very high	21 Å²	21	43.5 Å²	43.5	10%	0.103	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-45.3	176.4	-68.3	165.1	-172.2	0	0	111.5	F249 L252 E253 V256 K310 L311 L312 Q317 A318	F249-M314 HydrophobicContact CB-CE 4.26Å; F249-M314 HydrophobicContact CD1-CE 3.83Å; F249-M314 HydrophobicContact CG-CE 4.46Å; L252-M314 HydrophobicContact CB-SD 4.14Å; E253-M314 HydrophobicContact CB-CG 4.33Å; E253-M314 HydrophobicContact CB-SD 4.24Å; E253-M314 HydrophobicContact CG-CG 4.43Å; V256-M314 HydrophobicContact CG2-CB 4.44Å; K310-M314 WeakPolarHBondContact O-CG 3.22Å; K310-M314 PolarHBondContact O-N 3.49Å; L311-M314 HydrophobicContact CD1-SD 4.45Å; L311-M314 WeakPolarHBondContact O-CB 3.39Å; L311-M314 PolarHBondContact O-N 3.27Å; L311-M314 VanDerWaalsContact O-N 3.13Å; L312-M314 VanDerWaalsContact C-N 3.35Å; L312-M314 PolarHBondContact O-N 3.41Å; M314-Q317 PolarHBondContact O-N 3.24Å; M314-A318 VanDerWaalsContact O-CB 3.31Å; M314-A318 WeakPolarHBondContact O-CB 3.49Å; M314-A318 PolarHBondContact O-N 2.87Å
315	Y	94.3	Very high	93.1	Very high	3 Å²	3	42 Å²	42	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-44.6	174.4	-86	-74	0	0	0	111.4	L199 V256 I260 V286 D289 L290 L311 L312 Q317 A318 L319	L199-Y315 WeakPolarHBondContact CD1-OH 3.44Å; V256-Y315 HydrophobicContact CB-CE1 4.48Å; V256-Y315 HydrophobicContact CG1-CD1 3.53Å; V256-Y315 HydrophobicContact CG1-CD2 4.23Å; V256-Y315 HydrophobicContact CG1-CE1 3.68Å; V256-Y315 HydrophobicContact CG1-CE2 4.38Å; V256-Y315 HydrophobicContact CG1-CG 3.8Å; V256-Y315 HydrophobicContact CG2-CD2 4.23Å; V256-Y315 HydrophobicContact CG2-CE1 4.28Å; V256-Y315 HydrophobicContact CG2-CE2 3.83Å; I260-Y315 HydrophobicContact CD1-CD1 4.26Å; V286-Y315 HydrophobicContact CB-CD1 4.42Å; V286-Y315 HydrophobicContact CG1-CD1 3.98Å; V286-Y315 HydrophobicContact CG1-CG 4.3Å; V286-Y315 HydrophobicContact CG2-CD1 3.87Å; V286-Y315 HydrophobicContact CG2-CE1 4.16Å; D289-Y315 HydrophobicContact CB-CE2 4.34Å; D289-Y315 WeakPolarHBondContact CB-OH 3.41Å; D289-Y315 PolarHBondContact OD2-OH 2.84Å; L290-Y315 HydrophobicContact CD2-CD2 3.85Å; L290-Y315 HydrophobicContact CD2-CE2 4.38Å; L290-Y315 HydrophobicContact CD2-CG 4.5Å; L290-Y315 HydrophobicContact CG-CD2 4.49Å; L311-Y315 HydrophobicContact CD1-CD2 4.44Å; L311-Y315 HydrophobicContact CD1-CE2 4.06Å; L311-Y315 HydrophobicContact CD2-CD2 4.45Å; L311-Y315 HydrophobicContact CD2-CE2 3.93Å; L311-Y315 HydrophobicContact CG-CD2 3.87Å; L311-Y315 HydrophobicContact CG-CE2 3.7Å; L311-Y315 WeakPolarHBondContact O-CD2 3.33Å; L311-Y315 PolarHBondContact O-N 3.47Å; L312-Y315 PolarHBondContact O-N 2.96Å; Y315-Q317 PolarHBondContact O-N 2.96Å; Y315-A318 PolarHBondContact O-N 3.11Å; Y315-L319 VanDerWaalsContact O-CB 3.28Å; Y315-L319 WeakPolarHBondContact O-CB 3.38Å; Y315-L319 WeakPolarHBondContact O-CG 3.36Å; Y315-L319 PolarHBondContact O-N 3.18Å
316	H	93.5	Very high	93	Very high	29 Å²	29	41.7 Å²	41.7	13%	0.134	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-46.8	176.9	177.2	67.9	0	0	0	112.1	L312 L319 S320 Y347 N368	L312-H316 WeakPolarHBondContact O-CB 3.28Å; L312-H316 PolarHBondContact O-N 3.15Å; H316-L319 PolarHBondContact O-N 3.17Å; H316-S320 WeakPolarHBondContact O-CB 3.24Å; H316-S320 PolarHBondContact O-N 3.26Å; H316-Y347 AromaticContact ND1-CZ 3.75Å; H316-Y347 PolarHBondContact ND1-OH 2.91Å; H316-N368 PolarHBondContact CE1-O 2.94Å
317	Q	93.4	Very high	93	Very high	93 Å²	93	38.7 Å²	38.7	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-65.5	-43.9	179.3	-176.1	176.6	-16.6	0	0	112	S313 M314 Y315 S320 I321	S313-Q317 WeakPolarHBondContact O-CB 3.47Å; S313-Q317 PolarHBondContact O-N 2.87Å; M314-Q317 PolarHBondContact O-N 3.24Å; Y315-Q317 PolarHBondContact O-N 2.96Å; Q317-S320 WeakPolarHBondContact O-CB 3.44Å; Q317-S320 PolarHBondContact O-N 3.36Å; Q317-I321 HydrophobicContact CG-CD1 4.2Å; Q317-I321 WeakPolarHBondContact O-CG1 3.24Å; Q317-I321 PolarHBondContact O-N 2.83Å
318	A	93.6	Very high	92.8	Very high	9 Å²	9	42.7 Å²	42.7	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-37.8	179	0	0	0	0	0	111.9	V256 I260 M314 Y315 R322	V256-A318 HydrophobicContact CG1-CB 3.94Å; I260-A318 HydrophobicContact CD1-CB 3.6Å; M314-A318 VanDerWaalsContact O-CB 3.31Å; M314-A318 WeakPolarHBondContact O-CB 3.49Å; M314-A318 PolarHBondContact O-N 2.87Å; Y315-A318 PolarHBondContact O-N 3.11Å; A318-R322 WeakPolarHBondContact O-CB 3.27Å; A318-R322 PolarHBondContact O-N 3.44Å
319	L	94.3	Very high	92.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-44.7	169.7	-74.3	173.2	0	0	0	111.7	I260 I282 V286 Y315 H316 I321 R322 M323 W342 Y347 M352 M353 L370	I260-L319 HydrophobicContact CD1-CD2 3.96Å; I260-L319 HydrophobicContact CD1-CG 3.95Å; I282-L319 HydrophobicContact CG2-CD2 3.34Å; V286-L319 HydrophobicContact CG1-CD1 4.32Å; V286-L319 HydrophobicContact CG2-CD1 4.43Å; V286-L319 HydrophobicContact CG2-CD2 4.28Å; Y315-L319 VanDerWaalsContact O-CB 3.28Å; Y315-L319 WeakPolarHBondContact O-CB 3.38Å; Y315-L319 WeakPolarHBondContact O-CG 3.36Å; Y315-L319 PolarHBondContact O-N 3.18Å; H316-L319 PolarHBondContact O-N 3.17Å; L319-I321 PolarHBondContact O-N 3.43Å; L319-R322 PolarHBondContact O-N 3.07Å; L319-M323 HydrophobicContact CD2-CE 4.46Å; L319-M323 WeakPolarHBondContact O-CB 3.34Å; L319-M323 VanDerWaalsContact O-CG 3.24Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 3.37Å; L319-W342 HydrophobicContact CD2-CH2 4.13Å; L319-Y347 HydrophobicContact CD1-CE2 4.01Å; L319-M352 HydrophobicContact CD1-CE 3.86Å; L319-M353 HydrophobicContact CD1-CE 4.22Å; L319-L370 HydrophobicContact CB-CD2 3.85Å
320	S	94	Very high	92.3	Very high	21 Å²	21	46 Å²	46	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-47.1	179.1	179.7	0	0	0	0	111.7	H316 Q317 R322 M323 Q324 L370	H316-S320 WeakPolarHBondContact O-CB 3.24Å; H316-S320 PolarHBondContact O-N 3.26Å; Q317-S320 WeakPolarHBondContact O-CB 3.44Å; Q317-S320 PolarHBondContact O-N 3.36Å; S320-R322 PolarHBondContact O-N 3.24Å; S320-M323 PolarHBondContact O-N 3.35Å; S320-Q324 WeakPolarHBondContact O-CB 3.31Å; S320-Q324 VanDerWaalsContact O-CG 3.24Å; S320-Q324 WeakPolarHBondContact O-CG 3.34Å; S320-Q324 PolarHBondContact O-N 2.83Å; S320-Q324 PolarHBondContact OG-NE2 3.48Å; S320-L370 WeakPolarHBondContact CA-O 3.41Å; S320-L370 WeakPolarHBondContact CB-O 3.34Å; S320-L370 PolarHBondContact OG-O 3.37Å
321	I	92.5	Very high	92.1	Very high	76 Å²	76	40.9 Å²	40.9	39%	0.39	23%	0.225	S	C	.	.	H	α-helix	trans	-58.3	-50	175.4	-68.1	166	0	0	0	110	Q317 L319 M323 Q324 E325	Q317-I321 HydrophobicContact CG-CD1 4.2Å; Q317-I321 WeakPolarHBondContact O-CG1 3.24Å; Q317-I321 PolarHBondContact O-N 2.83Å; L319-I321 PolarHBondContact O-N 3.43Å; I321-M323 PolarHBondContact O-N 3.27Å; I321-Q324 WeakPolarHBondContact O-CB 3Å; I321-Q324 PolarHBondContact O-N 2.8Å; I321-Q324 VanDerWaalsContact O-N 3.15Å; I321-E325 HydrophobicContact CG2-CG 4.49Å; I321-E325 WeakPolarHBondContact O-CG 3.43Å; I321-E325 PolarHBondContact O-N 3.22Å
322	R	91.8	Very high	91.9	Very high	21 Å²	21	45.3 Å²	45.3	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-42.4	-178.4	-177.2	57.7	178.7	174.6	1.3	113	I260 H278 A318 L319 S320 Q324 E325 L326	I260-R322 HydrophobicContact CG2-CB 4.01Å; I260-R322 HydrophobicContact CG2-CG 3.93Å; H278-R322 PolarHBondContact NE2-NE 3.11Å; H278-R322 PolarHBondContact NE2-NH2 3.48Å; H278-R322 VanDerWaalsContact NE2-NH2 3.13Å; A318-R322 WeakPolarHBondContact O-CB 3.27Å; A318-R322 PolarHBondContact O-N 3.44Å; L319-R322 PolarHBondContact O-N 3.07Å; S320-R322 PolarHBondContact O-N 3.24Å; R322-Q324 VanDerWaalsContact C-N 3.31Å; R322-Q324 PolarHBondContact O-N 3.02Å; R322-E325 IonicContact NH1-OE2 2.83Å; R322-E325 PolarHBondContact NH1-OE2 3.42Å; R322-E325 PolarHBondContact O-N 3.04Å; R322-L326 HydrophobicContact CG-CD1 4.36Å; R322-L326 WeakPolarHBondContact O-CG 3.45Å; R322-L326 PolarHBondContact O-N 3.42Å
323	M	93.5	Very high	91.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-32.6	177.5	-64.8	-53.4	127.5	0	0	111.9	L279 I282 L319 S320 I321 L326 A327 L339 W342 V343 L370 I371	L279-M323 HydrophobicContact CD2-CE 3.73Å; L279-M323 HydrophobicContact CD2-SD 3.74Å; I282-M323 HydrophobicContact CD1-CE 4.13Å; L319-M323 HydrophobicContact CD2-CE 4.46Å; L319-M323 WeakPolarHBondContact O-CB 3.34Å; L319-M323 VanDerWaalsContact O-CG 3.24Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 3.37Å; S320-M323 PolarHBondContact O-N 3.35Å; I321-M323 PolarHBondContact O-N 3.27Å; M323-L326 HydrophobicContact CE-CD1 4.33Å; M323-L326 HydrophobicContact SD-CD1 4.26Å; M323-A327 VanDerWaalsContact O-CB 3.24Å; M323-A327 WeakPolarHBondContact O-CB 3.41Å; M323-A327 PolarHBondContact O-N 3.13Å; M323-L339 HydrophobicContact SD-CD1 3.64Å; M323-W342 HydrophobicContact CE-CE3 4.34Å; M323-W342 HydrophobicContact CE-CH2 4.22Å; M323-W342 HydrophobicContact CE-CZ3 3.86Å; M323-W342 HydrophobicContact CG-CZ3 4.21Å; M323-W342 HydrophobicContact SD-CE3 3.96Å; M323-W342 HydrophobicContact SD-CZ3 3.9Å; M323-V343 HydrophobicContact CB-CG2 4.31Å; M323-V343 HydrophobicContact CG-CG2 3.98Å; M323-V343 HydrophobicContact SD-CG2 4.13Å; M323-L370 HydrophobicContact CG-CB 4.45Å; M323-L370 HydrophobicContact CG-CD1 4.13Å; M323-I371 HydrophobicContact CB-CG2 3.72Å
324	Q	92.1	Very high	91.4	Very high	92 Å²	92	45.9 Å²	45.9	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-69.7	-39.5	173.9	-72.8	174.1	23.3	0	0	112.3	S320 I321 R322 A327 A328 I371	S320-Q324 WeakPolarHBondContact O-CB 3.31Å; S320-Q324 VanDerWaalsContact O-CG 3.24Å; S320-Q324 WeakPolarHBondContact O-CG 3.34Å; S320-Q324 PolarHBondContact O-N 2.83Å; S320-Q324 PolarHBondContact OG-NE2 3.48Å; I321-Q324 WeakPolarHBondContact O-CB 3Å; I321-Q324 PolarHBondContact O-N 2.8Å; I321-Q324 VanDerWaalsContact O-N 3.15Å; R322-Q324 VanDerWaalsContact C-N 3.31Å; R322-Q324 PolarHBondContact O-N 3.02Å; Q324-A327 PolarHBondContact O-N 3.37Å; Q324-A328 WeakPolarHBondContact O-CB 3.36Å; Q324-A328 PolarHBondContact O-N 2.92Å; Q324-I371 HydrophobicContact CG-CG2 4.17Å
325	E	91.2	Very high	91.3	Very high	85 Å²	85	45 Å²	45	40%	0.397	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-50.3	173.1	-71.5	172.1	172.5	0	0	110.9	I321 R322 A327 A328 E329	I321-E325 HydrophobicContact CG2-CG 4.49Å; I321-E325 WeakPolarHBondContact O-CG 3.43Å; I321-E325 PolarHBondContact O-N 3.22Å; R322-E325 IonicContact NH1-OE2 2.83Å; R322-E325 PolarHBondContact NH1-OE2 3.42Å; R322-E325 PolarHBondContact O-N 3.04Å; E325-A327 VanDerWaalsContact C-N 3.29Å; E325-A327 PolarHBondContact O-N 2.91Å; E325-A328 WeakPolarHBondContact O-CB 3.42Å; E325-A328 PolarHBondContact O-N 3.44Å; E325-A328 VanDerWaalsContact O-N 3.08Å; E325-E329 PolarHBondContact O-N 3.49Å
326	L	91.1	Very high	91.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-38.4	177	-68.6	170.8	0	0	0	111.9	W274 L275 R322 M323 A328 E329 L331 L339	W274-L326 HydrophobicContact CH2-CD2 3.95Å; W274-L326 HydrophobicContact CZ3-CD2 4.31Å; L275-L326 HydrophobicContact CD1-CD1 4.07Å; L275-L326 HydrophobicContact CD1-CD2 4.22Å; R322-L326 HydrophobicContact CG-CD1 4.36Å; R322-L326 WeakPolarHBondContact O-CG 3.45Å; R322-L326 PolarHBondContact O-N 3.42Å; M323-L326 HydrophobicContact CE-CD1 4.33Å; M323-L326 HydrophobicContact SD-CD1 4.26Å; L326-A328 VanDerWaalsContact C-N 3.28Å; L326-A328 PolarHBondContact O-N 3.45Å; L326-E329 PolarHBondContact O-N 3.04Å; L326-L331 WeakPolarHBondContact O-CD1 3.36Å; L326-L331 WeakPolarHBondContact O-CG 3.5Å; L326-L339 HydrophobicContact CB-CD1 4.5Å; L326-L339 HydrophobicContact CB-CD2 4.44Å
327	A	91.1	Very high	91	Very high	12 Å²	12	44.3 Å²	44.3	10%	0.099	24%	0.24	C	C	.	.	H	α-helix	trans	-68.9	-24.7	176.6	0	0	0	0	0	113.6	M323 Q324 E325 E329 L339 V375 L379	M323-A327 VanDerWaalsContact O-CB 3.24Å; M323-A327 WeakPolarHBondContact O-CB 3.41Å; M323-A327 PolarHBondContact O-N 3.13Å; Q324-A327 PolarHBondContact O-N 3.37Å; E325-A327 VanDerWaalsContact C-N 3.29Å; E325-A327 PolarHBondContact O-N 2.91Å; A327-E329 VanDerWaalsContact C-N 3.35Å; A327-L339 HydrophobicContact CB-CD2 4.04Å; A327-V375 HydrophobicContact CB-CG1 3.72Å; A327-L379 HydrophobicContact CB-CD1 3.99Å
328	A	89.9	Confident	91	Very high	87 Å²	87	41.3 Å²	41.3	72%	0.719	23%	0.23	S	C	*	.	H	α-helix	trans	-80.7	-16.3	177.7	0	0	0	0	0	113	Q324 E325 L326	Q324-A328 WeakPolarHBondContact O-CB 3.36Å; Q324-A328 PolarHBondContact O-N 2.92Å; E325-A328 WeakPolarHBondContact O-CB 3.42Å; E325-A328 PolarHBondContact O-N 3.44Å; E325-A328 VanDerWaalsContact O-N 3.08Å; L326-A328 VanDerWaalsContact C-N 3.28Å; L326-A328 PolarHBondContact O-N 3.45Å
329	E	88.5	Confident	91	Very high	88 Å²	88	40.9 Å²	40.9	41%	0.411	23%	0.227	S	C	.	.	S	Bend	trans	-72.1	162.4	174.2	-66.3	177.6	-169.9	0	0	112.3	E325 L326 A327 L331	E325-E329 PolarHBondContact O-N 3.49Å; L326-E329 PolarHBondContact O-N 3.04Å; A327-E329 VanDerWaalsContact C-N 3.35Å; E329-L331 VanDerWaalsContact C-N 3.29Å; E329-L331 HydrophobicContact CB-CD2 4.31Å; E329-L331 PolarHBondContact O-N 2.98Å
330	D	87.1	Confident	90.9	Very high	125 Å²	125	40.9 Å²	40.9	67%	0.668	23%	0.227	S	C	*	.			trans	-79.9	77.8	176.7	-166.4	26.1	0	0	0	111.4	R268 K382	R268-D330 PolarHBondContact NH1-O 2.61Å; D330-K382 IonicContact OD1-NZ 2.75Å; D330-K382 PolarHBondContact OD1-NZ 3.38Å
331	L	88.5	Confident	90.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	23%	0.228	C	C	.	.			trans	-72.8	138.1	-178.2	-59.4	-179.3	0	0	0	112.7	L326 E329 E335 I336 L339 L379 K382	L326-L331 WeakPolarHBondContact O-CD1 3.36Å; L326-L331 WeakPolarHBondContact O-CG 3.5Å; E329-L331 VanDerWaalsContact C-N 3.29Å; E329-L331 HydrophobicContact CB-CD2 4.31Å; E329-L331 PolarHBondContact O-N 2.98Å; L331-E335 WeakPolarHBondContact CA-OE2 3.36Å; L331-E335 HydrophobicContact CB-CB 4.09Å; L331-E335 HydrophobicContact CD2-CB 4.18Å; L331-I336 HydrophobicContact CB-CG1 3.69Å; L331-I336 HydrophobicContact CD1-CG1 4.4Å; L331-L339 HydrophobicContact CD1-CD2 3.63Å; L331-L379 HydrophobicContact CD1-CD2 4.39Å; L331-K382 PolarHBondContact O-NZ 3.15Å
332	E	89.4	Confident	90.9	Very high	97 Å²	97	38.2 Å²	38.2	45%	0.453	21%	0.212	S	C	.	.			trans	-72.9	164.3	167.4	-79.9	173.5	-157.2	0	0	112.1	R268 N334 E335 I336	R268-E332 IonicContact CZ-OE1 2.74Å; R268-E332 IonicContact NE-OE1 2.78Å; R268-E332 IonicContact NH2-OE1 2.94Å; R268-E332 PolarHBondContact NH2-OE1 2.95Å; E332-N334 VanDerWaalsContact C-N 3.34Å; E332-N334 VanDerWaalsContact CB-OD1 3.25Å; E332-N334 WeakPolarHBondContact CB-OD1 3.24Å; E332-N334 PolarHBondContact O-N 3.4Å; E332-N334 PolarHBondContact OE2-OD1 2.84Å; E332-E335 HydrophobicContact CB-CG 4.2Å; E332-E335 PolarHBondContact N-OE2 3.1Å; E332-E335 WeakPolarHBondContact O-CB 3.49Å; E332-E335 PolarHBondContact O-N 3.4Å; E332-I336 WeakPolarHBondContact O-CG1 3.42Å; E332-I336 PolarHBondContact O-N 3.17Å
333	A	87.4	Confident	90.9	Very high	26 Å²	26	37.5 Å²	37.5	22%	0.215	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-42.2	-176.5	0	0	0	0	0	113.4	V337 Y383 T386	A333-V337 VanDerWaalsContact O-CG2 3.24Å; A333-V337 WeakPolarHBondContact O-CG2 3.49Å; A333-V337 PolarHBondContact O-N 3.13Å; A333-V337 VanDerWaalsContact O-N 3.1Å; A333-Y383 HydrophobicContact CB-CD2 4.14Å; A333-Y383 HydrophobicContact CB-CE2 4.41Å; A333-T386 HydrophobicContact CB-CG2 4.14Å
334	N	88.1	Confident	90.7	Very high	74 Å²	74	39.7 Å²	39.7	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-67.8	-33.9	175.5	59.2	-51.4	0	0	0	112.7	E332 S338	E332-N334 VanDerWaalsContact C-N 3.34Å; E332-N334 VanDerWaalsContact CB-OD1 3.25Å; E332-N334 WeakPolarHBondContact CB-OD1 3.24Å; E332-N334 PolarHBondContact O-N 3.4Å; E332-N334 PolarHBondContact OE2-OD1 2.84Å; N334-S338 WeakPolarHBondContact O-CB 3.44Å; N334-S338 PolarHBondContact O-N 2.89Å; N334-S338 PolarHBondContact O-OG 2.65Å
335	E	91.4	Very high	90.6	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-70.5	-41.6	176.7	-63.9	177	148.4	0	0	110.8	R268 W274 L275 L331 E332 V337 S338 L339	R268-E335 WeakPolarHBondContact CD-OE1 3.34Å; R268-E335 IonicContact CZ-OE1 3.19Å; R268-E335 IonicContact CZ-OE2 2.87Å; R268-E335 IonicContact NE-OE1 2.72Å; R268-E335 PolarHBondContact NE-OE1 3.41Å; R268-E335 IonicContact NE-OE2 3.1Å; R268-E335 IonicContact NH1-OE1 2.65Å; R268-E335 IonicContact NH1-OE2 3.53Å; R268-E335 PolarHBondContact NH1-OE2 3.11Å; W274-E335 PolarHBondContact NE1-OE1 3.02Å; L275-E335 HydrophobicContact CD2-CB 3.75Å; L275-E335 HydrophobicContact CD2-CG 4.31Å; L275-E335 WeakPolarHBondContact CD2-O 3.45Å; L331-E335 WeakPolarHBondContact CA-OE2 3.36Å; L331-E335 HydrophobicContact CB-CB 4.09Å; L331-E335 HydrophobicContact CD2-CB 4.18Å; E332-E335 HydrophobicContact CB-CG 4.2Å; E332-E335 PolarHBondContact N-OE2 3.1Å; E332-E335 WeakPolarHBondContact O-CB 3.49Å; E332-E335 PolarHBondContact O-N 3.4Å; E335-V337 VanDerWaalsContact C-N 3.33Å; E335-V337 PolarHBondContact O-N 3.47Å; E335-S338 PolarHBondContact O-N 3.38Å; E335-L339 WeakPolarHBondContact O-CB 3.44Å; E335-L339 PolarHBondContact O-N 3.22Å
336	I	91.8	Very high	90.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-46.1	173.1	-65.2	167.9	0	0	0	110.4	L331 E332 S338 L339 L340 L379 K382	L331-I336 HydrophobicContact CB-CG1 3.69Å; L331-I336 HydrophobicContact CD1-CG1 4.4Å; E332-I336 WeakPolarHBondContact O-CG1 3.42Å; E332-I336 PolarHBondContact O-N 3.17Å; I336-S338 VanDerWaalsContact C-N 3.35Å; I336-S338 PolarHBondContact O-N 2.93Å; I336-L339 PolarHBondContact O-N 2.6Å; I336-L340 HydrophobicContact CG2-CD1 3.69Å; I336-L340 HydrophobicContact CG2-CG 4.18Å; I336-L340 WeakPolarHBondContact O-CB 3.36Å; I336-L340 VanDerWaalsContact O-CG 3.31Å; I336-L340 WeakPolarHBondContact O-CG 3.34Å; I336-L340 PolarHBondContact O-N 3.29Å; I336-L379 HydrophobicContact CG1-CD2 4.38Å; I336-L379 HydrophobicContact CG2-CB 4.08Å; I336-K382 HydrophobicContact CD1-CB 4.38Å; I336-K382 HydrophobicContact CD1-CD 4.01Å; I336-K382 HydrophobicContact CD1-CG 4.2Å
337	V	91.2	Very high	90.6	Very high	16 Å²	16	35.8 Å²	35.8	10%	0.097	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-49.5	176.3	171.5	0	0	0	0	110.6	A333 E335 L339 L340 T341 Y383 V438 I442	A333-V337 VanDerWaalsContact O-CG2 3.24Å; A333-V337 WeakPolarHBondContact O-CG2 3.49Å; A333-V337 PolarHBondContact O-N 3.13Å; A333-V337 VanDerWaalsContact O-N 3.1Å; E335-V337 VanDerWaalsContact C-N 3.33Å; E335-V337 PolarHBondContact O-N 3.47Å; V337-L339 PolarHBondContact O-N 3.16Å; V337-L340 PolarHBondContact O-N 3.35Å; V337-T341 WeakPolarHBondContact O-CB 3.38Å; V337-T341 PolarHBondContact O-N 3.32Å; V337-T341 PolarHBondContact O-OG1 2.96Å; V337-T341 VanDerWaalsContact O-OG1 3.13Å; V337-Y383 HydrophobicContact CG2-CD2 4.07Å; V337-Y383 HydrophobicContact CG2-CE2 3.59Å; V337-V438 HydrophobicContact CB-CG1 4.42Å; V337-V438 HydrophobicContact CG1-CG1 3.77Å; V337-V438 HydrophobicContact CG2-CG1 3.76Å; V337-I442 HydrophobicContact CB-CD1 4.08Å; V337-I442 HydrophobicContact CG1-CD1 3.97Å; V337-I442 HydrophobicContact CG1-CG1 4.14Å; V337-I442 HydrophobicContact CG2-CD1 3.77Å
338	S	92.2	Very high	90.5	Very high	31 Å²	31	38 Å²	38	22%	0.217	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-45.1	-178.3	-57.3	0	0	0	0	112	V276 N334 E335 I336 W342	V276-S338 VanDerWaalsContact CG2-OG 3.29Å; V276-S338 WeakPolarHBondContact CG2-OG 3.43Å; N334-S338 WeakPolarHBondContact O-CB 3.44Å; N334-S338 PolarHBondContact O-N 2.89Å; N334-S338 PolarHBondContact O-OG 2.65Å; E335-S338 PolarHBondContact O-N 3.38Å; I336-S338 VanDerWaalsContact C-N 3.35Å; I336-S338 PolarHBondContact O-N 2.93Å; S338-W342 WeakPolarHBondContact O-CB 3.24Å; S338-W342 PolarHBondContact O-N 3.12Å; S338-W342 VanDerWaalsContact O-N 3.09Å
339	L	93.8	Very high	90.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-47.7	178.6	-177.4	62.8	0	0	0	111.9	L275 L279 M323 L326 A327 L331 E335 I336 V337 W342 V343 L379	L275-L339 HydrophobicContact CD2-CB 4.42Å; L279-L339 HydrophobicContact CD2-CD1 4.43Å; M323-L339 HydrophobicContact SD-CD1 3.64Å; L326-L339 HydrophobicContact CB-CD1 4.5Å; L326-L339 HydrophobicContact CB-CD2 4.44Å; A327-L339 HydrophobicContact CB-CD2 4.04Å; L331-L339 HydrophobicContact CD1-CD2 3.63Å; E335-L339 WeakPolarHBondContact O-CB 3.44Å; E335-L339 PolarHBondContact O-N 3.22Å; I336-L339 PolarHBondContact O-N 2.6Å; V337-L339 PolarHBondContact O-N 3.16Å; L339-W342 PolarHBondContact O-N 2.79Å; L339-V343 HydrophobicContact CD1-CG2 4.11Å; L339-V343 HydrophobicContact CG-CG2 4.5Å; L339-V343 WeakPolarHBondContact O-CG2 3.33Å; L339-V343 PolarHBondContact O-N 2.69Å; L339-L379 HydrophobicContact CD2-CD1 4.19Å
340	L	92.6	Very high	90.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.3	-42.6	-178	-70.5	179.8	0	0	0	112.1	I336 V337 W342 V343 L344 I371 V376 L379 L380 I442	I336-L340 HydrophobicContact CG2-CD1 3.69Å; I336-L340 HydrophobicContact CG2-CG 4.18Å; I336-L340 WeakPolarHBondContact O-CB 3.36Å; I336-L340 VanDerWaalsContact O-CG 3.31Å; I336-L340 WeakPolarHBondContact O-CG 3.34Å; I336-L340 PolarHBondContact O-N 3.29Å; V337-L340 PolarHBondContact O-N 3.35Å; L340-W342 VanDerWaalsContact C-N 3.27Å; L340-W342 PolarHBondContact O-N 2.9Å; L340-V343 PolarHBondContact O-N 2.94Å; L340-L344 VanDerWaalsContact O-CB 3.26Å; L340-L344 WeakPolarHBondContact O-CB 3.29Å; L340-L344 VanDerWaalsContact O-CG 3.32Å; L340-L344 WeakPolarHBondContact O-CG 3.44Å; L340-L344 PolarHBondContact O-N 3.37Å; L340-I371 HydrophobicContact CD2-CD1 4.19Å; L340-V376 HydrophobicContact CD2-CG1 4.15Å; L340-L379 HydrophobicContact CD1-CB 4.31Å; L340-L379 HydrophobicContact CD2-CB 4.42Å; L340-L379 HydrophobicContact CD2-CD1 4.03Å; L340-L380 HydrophobicContact CD1-CD2 3.47Å; L340-L380 VanDerWaalsContact CD1-CD2 3.47Å; L340-L380 HydrophobicContact CD1-CG 3.9Å; L340-I442 HydrophobicContact CB-CG2 3.86Å; L340-I442 HydrophobicContact CD1-CG2 4.38Å
341	T	91.9	Very high	90.6	Very high	30 Å²	30	35.3 Å²	35.3	18%	0.184	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-41.6	173.8	-67	0	0	0	0	110.7	V337 N345 T346 Q441 I442	V337-T341 WeakPolarHBondContact O-CB 3.38Å; V337-T341 PolarHBondContact O-N 3.32Å; V337-T341 PolarHBondContact O-OG1 2.96Å; V337-T341 VanDerWaalsContact O-OG1 3.13Å; T341-N345 WeakPolarHBondContact O-CA 3.49Å; T341-N345 VanDerWaalsContact O-CB 3.27Å; T341-N345 WeakPolarHBondContact O-CB 3.38Å; T341-N345 PolarHBondContact O-N 2.9Å; T341-T346 PolarHBondContact O-N 3.37Å; T341-T346 VanDerWaalsContact O-N 3.11Å; T341-Q441 PolarHBondContact OG1-O 3.42Å; T341-I442 WeakPolarHBondContact OG1-CG1 3.49Å
342	W	94.2	Very high	90.7	Very high	11 Å²	11	35.1 Å²	35.1	4%	0.042	20%	0.197	C	C	.	.	I	π-helix	trans	-66.7	-46.1	179.5	-166.5	93.5	0	0	0	112.5	L279 I282 R283 L319 M323 S338 L339 L340 T346 Y347 M352 L370	L279-W342 HydrophobicContact CB-CD2 4.43Å; L279-W342 HydrophobicContact CB-CG 4.01Å; L279-W342 HydrophobicContact CD1-CB 3.88Å; L279-W342 HydrophobicContact CD1-CG 4.1Å; L279-W342 HydrophobicContact CD2-CD2 3.99Å; L279-W342 HydrophobicContact CD2-CE3 4.25Å; L279-W342 HydrophobicContact CD2-CG 4.11Å; L279-W342 HydrophobicContact CG-CG 4.29Å; L279-W342 PolarHBondContact O-NE1 2.87Å; L279-W342 VanDerWaalsContact O-NE1 3.15Å; I282-W342 HydrophobicContact CG2-CH2 4.21Å; I282-W342 HydrophobicContact CG2-CZ2 4.09Å; R283-W342 HydrophobicContact CB-CZ2 4.27Å; L319-W342 HydrophobicContact CD2-CH2 4.13Å; M323-W342 HydrophobicContact CE-CE3 4.34Å; M323-W342 HydrophobicContact CE-CH2 4.22Å; M323-W342 HydrophobicContact CE-CZ3 3.86Å; M323-W342 HydrophobicContact CG-CZ3 4.21Å; M323-W342 HydrophobicContact SD-CE3 3.96Å; M323-W342 HydrophobicContact SD-CZ3 3.9Å; S338-W342 WeakPolarHBondContact O-CB 3.24Å; S338-W342 PolarHBondContact O-N 3.12Å; S338-W342 VanDerWaalsContact O-N 3.09Å; L339-W342 PolarHBondContact O-N 2.79Å; L340-W342 VanDerWaalsContact C-N 3.27Å; L340-W342 PolarHBondContact O-N 2.9Å; W342-T346 WeakPolarHBondContact O-CB 3.26Å; W342-T346 PolarHBondContact O-N 2.94Å; W342-Y347 HydrophobicContact CH2-CD2 4.46Å; W342-Y347 PolarHBondContact O-N 3.31Å; W342-M352 HydrophobicContact CH2-CE 3.96Å; W342-M352 HydrophobicContact CH2-SD 3.93Å; W342-M352 HydrophobicContact CZ2-CE 3.97Å; W342-M352 HydrophobicContact CZ2-SD 3.73Å; W342-L370 HydrophobicContact CE3-CD1 4.38Å; W342-L370 HydrophobicContact CH2-CD1 4.43Å; W342-L370 HydrophobicContact CZ3-CD1 3.59Å
343	V	92.4	Very high	90.7	Very high	6 Å²	6	30.6 Å²	30.6	4%	0.036	18%	0.176	C	C	.	.	I	π-helix	trans	-71.4	-40.3	-177.1	173.6	0	0	0	0	112.5	M323 L339 L340 L370 I371	M323-V343 HydrophobicContact CB-CG2 4.31Å; M323-V343 HydrophobicContact CG-CG2 3.98Å; M323-V343 HydrophobicContact SD-CG2 4.13Å; L339-V343 HydrophobicContact CD1-CG2 4.11Å; L339-V343 HydrophobicContact CG-CG2 4.5Å; L339-V343 WeakPolarHBondContact O-CG2 3.33Å; L339-V343 PolarHBondContact O-N 2.69Å; L340-V343 PolarHBondContact O-N 2.94Å; V343-L370 HydrophobicContact CG1-CB 3.98Å; V343-L370 HydrophobicContact CG1-CD1 4.44Å; V343-L370 HydrophobicContact CG2-CD1 4.47Å; V343-I371 HydrophobicContact CB-CD1 4.25Å; V343-I371 HydrophobicContact CG1-CD1 3.83Å; V343-I371 HydrophobicContact CG1-CG1 3.78Å; V343-I371 HydrophobicContact CG2-CD1 4.33Å
344	L	88.8	Confident	90.8	Very high	45 Å²	45	30.5 Å²	30.5	24%	0.236	18%	0.178	C	C	.	.	I	π-helix	trans	-85.4	-36	-175.6	-61.8	176.6	0	0	0	112.7	L340 T348 V376 I442	L340-L344 VanDerWaalsContact O-CB 3.26Å; L340-L344 WeakPolarHBondContact O-CB 3.29Å; L340-L344 VanDerWaalsContact O-CG 3.32Å; L340-L344 WeakPolarHBondContact O-CG 3.44Å; L340-L344 PolarHBondContact O-N 3.37Å; L344-T348 PolarHBondContact O-OG1 3.44Å; L344-V376 HydrophobicContact CD1-CG1 4.48Å; L344-I442 HydrophobicContact CD1-CG2 4.12Å
345	N	89.6	Confident	90.9	Very high	68 Å²	68	28.4 Å²	28.4	36%	0.364	17%	0.167	S	C	.	.	I	π-helix	trans	-112.1	-53.1	-171.7	-56.7	-39.9	0	0	0	111.9	T341 S349 Q441 I442	T341-N345 WeakPolarHBondContact O-CA 3.49Å; T341-N345 VanDerWaalsContact O-CB 3.27Å; T341-N345 WeakPolarHBondContact O-CB 3.38Å; T341-N345 PolarHBondContact O-N 2.9Å; N345-S349 VanDerWaalsContact O-CB 3.24Å; N345-S349 WeakPolarHBondContact O-CB 3.32Å; N345-S349 PolarHBondContact O-N 3.21Å; N345-S349 VanDerWaalsContact O-N 3.15Å; N345-Q441 PolarHBondContact ND2-O 3.25Å; N345-I442 PolarHBondContact ND2-O 2.94Å
346	T	90.6	Very high	90.8	Very high	24 Å²	24	33 Å²	33	15%	0.147	20%	0.199	C	C	.	.	I	π-helix	trans	-68.2	-40.9	-174.2	-53	0	0	0	0	112.8	R283 T341 W342 T348 S349	R283-T346 HydrophobicContact CG-CG2 4.25Å; T341-T346 PolarHBondContact O-N 3.37Å; T341-T346 VanDerWaalsContact O-N 3.11Å; W342-T346 WeakPolarHBondContact O-CB 3.26Å; W342-T346 PolarHBondContact O-N 2.94Å; T346-T348 PolarHBondContact O-N 3.42Å; T346-S349 WeakPolarHBondContact O-CB 3.37Å; T346-S349 PolarHBondContact O-N 2.92Å; T346-S349 PolarHBondContact O-OG 3.37Å
347	Y	92.1	Very high	90.6	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.016	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-45.2	-176.8	177.3	-111.5	0	0	0	113.1	H316 L319 W342 M352 M353 L367 L370	H316-Y347 AromaticContact ND1-CZ 3.75Å; H316-Y347 PolarHBondContact ND1-OH 2.91Å; L319-Y347 HydrophobicContact CD1-CE2 4.01Å; W342-Y347 HydrophobicContact CH2-CD2 4.46Å; W342-Y347 PolarHBondContact O-N 3.31Å; Y347-M352 HydrophobicContact CD2-CE 4.36Å; Y347-M352 HydrophobicContact CD2-SD 3.82Å; Y347-M353 HydrophobicContact CD2-CE 4.36Å; Y347-M353 HydrophobicContact CD2-CG 4Å; Y347-M353 HydrophobicContact CE1-CG 4.44Å; Y347-M353 HydrophobicContact CE2-CE 3.47Å; Y347-M353 VanDerWaalsContact CE2-CE 3.47Å; Y347-M353 HydrophobicContact CE2-CG 3.62Å; Y347-M353 HydrophobicContact CE2-SD 4.41Å; Y347-M353 VanDerWaalsContact O-CB 3.24Å; Y347-M353 WeakPolarHBondContact O-CB 3.3Å; Y347-M353 VanDerWaalsContact O-CG 3.32Å; Y347-M353 WeakPolarHBondContact O-CG 3.3Å; Y347-M353 PolarHBondContact O-N 2.84Å; Y347-M353 VanDerWaalsContact O-N 3.15Å; Y347-L367 HydrophobicContact CE1-CB 4.33Å; Y347-L367 HydrophobicContact CE1-CD1 4.1Å; Y347-L370 HydrophobicContact CD1-CD1 4.03Å; Y347-L370 HydrophobicContact CD1-CG 4.03Å; Y347-L370 HydrophobicContact CD2-CD1 3.59Å; Y347-L370 HydrophobicContact CD2-CD2 4.42Å; Y347-L370 HydrophobicContact CD2-CG 4.22Å; Y347-L370 HydrophobicContact CE1-CD1 4.39Å; Y347-L370 HydrophobicContact CE1-CD2 4.2Å; Y347-L370 HydrophobicContact CE1-CG 4.01Å; Y347-L370 HydrophobicContact CE2-CD1 3.95Å; Y347-L370 HydrophobicContact CE2-CD2 3.92Å; Y347-L370 HydrophobicContact CE2-CG 4.17Å; Y347-L370 HydrophobicContact CG-CD1 3.64Å; Y347-L370 HydrophobicContact CG-CG 4.15Å
348	T	89.4	Confident	90.5	Very high	59 Å²	59	38 Å²	38	36%	0.362	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.7	-180	53.4	0	0	0	0	113.4	L344 T346 V364	L344-T348 PolarHBondContact O-OG1 3.44Å; T346-T348 PolarHBondContact O-N 3.42Å; T348-V364 HydrophobicContact CG2-CG1 3.81Å
349	S	90.3	Very high	90.1	Very high	30 Å²	30	40.1 Å²	40.1	21%	0.21	24%	0.236	C	C	.	.	S	Bend	trans	-70.3	168.8	-179.2	74.8	0	0	0	0	113.7	N345 T346 E351 M352 G354	N345-S349 VanDerWaalsContact O-CB 3.24Å; N345-S349 WeakPolarHBondContact O-CB 3.32Å; N345-S349 PolarHBondContact O-N 3.21Å; N345-S349 VanDerWaalsContact O-N 3.15Å; T346-S349 WeakPolarHBondContact O-CB 3.37Å; T346-S349 PolarHBondContact O-N 2.92Å; T346-S349 PolarHBondContact O-OG 3.37Å; S349-E351 PolarHBondContact O-N 3.29Å; S349-E351 WeakPolarHBondContact OG-CB 3.25Å; S349-E351 PolarHBondContact OG-N 3.49Å; S349-E351 VanDerWaalsContact OG-N 3.15Å; S349-M352 PolarHBondContact O-N 2.65Å; S349-M352 VanDerWaalsContact O-N 3.15Å; S349-G354 VanDerWaalsContact O-CA 3.29Å; S349-G354 WeakPolarHBondContact O-CA 3.5Å; S349-G354 PolarHBondContact O-N 2.87Å
350	T	88.3	Confident	89.7	Confident	106 Å²	106	45.2 Å²	45.2	65%	0.65	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.4	170.4	52.9	0	0	0	0	113.6	M352 N355	T350-M352 VanDerWaalsContact C-N 3.26Å; T350-M352 PolarHBondContact O-N 2.84Å; T350-N355 WeakPolarHBondContact O-CA 3.3Å; T350-N355 WeakPolarHBondContact O-CB 3.38Å
351	E	87.8	Confident	89.2	Confident	106 Å²	106	49.7 Å²	49.7	50%	0.495	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-10	177.7	-54.3	-174.8	162.2	0	0	113	R283 S349	R283-E351 PolarHBondContact NH1-O 3.03Å; S349-E351 PolarHBondContact O-N 3.29Å; S349-E351 WeakPolarHBondContact OG-CB 3.25Å; S349-E351 PolarHBondContact OG-N 3.49Å; S349-E351 VanDerWaalsContact OG-N 3.15Å
352	M	90.8	Very high	88.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.4	-103.7	-179.7	-163.6	-179.9	-171.2	0	0	112	R283 V286 L319 W342 Y347 S349 T350 G354 N355	R283-M352 HydrophobicContact CG-CB 4.08Å; R283-M352 HydrophobicContact CG-CG 4.15Å; R283-M352 HydrophobicContact CG-SD 4.17Å; V286-M352 HydrophobicContact CB-CE 3.75Å; V286-M352 HydrophobicContact CG1-CE 3.71Å; V286-M352 HydrophobicContact CG2-CE 4.3Å; L319-M352 HydrophobicContact CD1-CE 3.86Å; W342-M352 HydrophobicContact CH2-CE 3.96Å; W342-M352 HydrophobicContact CH2-SD 3.93Å; W342-M352 HydrophobicContact CZ2-CE 3.97Å; W342-M352 HydrophobicContact CZ2-SD 3.73Å; Y347-M352 HydrophobicContact CD2-CE 4.36Å; Y347-M352 HydrophobicContact CD2-SD 3.82Å; S349-M352 PolarHBondContact O-N 2.65Å; S349-M352 VanDerWaalsContact O-N 3.15Å; T350-M352 VanDerWaalsContact C-N 3.26Å; T350-M352 PolarHBondContact O-N 2.84Å; M352-G354 VanDerWaalsContact C-N 3.33Å; M352-G354 PolarHBondContact O-N 3Å; M352-N355 VanDerWaalsContact O-CB 3.23Å; M352-N355 WeakPolarHBondContact O-CB 3.4Å; M352-N355 PolarHBondContact O-N 3.43Å
353	M	90.3	Very high	88.4	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.3	-171.7	-62.2	-61.1	-176.9	0	0	113.7	V286 L290 L312 L319 Y347 N355 V362 L367	V286-M353 HydrophobicContact CG1-CE 4.12Å; L290-M353 HydrophobicContact CD1-CE 3.92Å; L290-M353 HydrophobicContact CD1-SD 3.8Å; L312-M353 HydrophobicContact CD1-SD 4.23Å; L319-M353 HydrophobicContact CD1-CE 4.22Å; Y347-M353 HydrophobicContact CD2-CE 4.36Å; Y347-M353 HydrophobicContact CD2-CG 4Å; Y347-M353 HydrophobicContact CE1-CG 4.44Å; Y347-M353 HydrophobicContact CE2-CE 3.47Å; Y347-M353 VanDerWaalsContact CE2-CE 3.47Å; Y347-M353 HydrophobicContact CE2-CG 3.62Å; Y347-M353 HydrophobicContact CE2-SD 4.41Å; Y347-M353 VanDerWaalsContact O-CB 3.24Å; Y347-M353 WeakPolarHBondContact O-CB 3.3Å; Y347-M353 VanDerWaalsContact O-CG 3.32Å; Y347-M353 WeakPolarHBondContact O-CG 3.3Å; Y347-M353 PolarHBondContact O-N 2.84Å; Y347-M353 VanDerWaalsContact O-N 3.15Å; M353-N355 VanDerWaalsContact C-N 3.25Å; M353-N355 PolarHBondContact O-N 2.93Å; M353-V362 HydrophobicContact CB-CG1 4.42Å; M353-L367 HydrophobicContact CB-CD1 3.59Å; M353-L367 HydrophobicContact CG-CD1 3.85Å
354	G	88.4	Confident	88	Confident	24 Å²	24	53.8 Å²	53.8	25%	0.247	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	10.9	174	0	0	0	0	0	114.2	S349 M352 S356	S349-G354 VanDerWaalsContact O-CA 3.29Å; S349-G354 WeakPolarHBondContact O-CA 3.5Å; S349-G354 PolarHBondContact O-N 2.87Å; M352-G354 VanDerWaalsContact C-N 3.33Å; M352-G354 PolarHBondContact O-N 3Å; G354-S356 PolarHBondContact O-N 3.44Å
355	N	90.9	Very high	87.6	Confident	30 Å²	30	58.7 Å²	58.7	16%	0.16	34%	0.34	C	S	.	.			trans	-63.2	133.9	179.6	-171.6	-59.6	0	0	0	111	L287 T350 M352 M353 E357 L358	L287-N355 HydrophobicContact CD1-CB 3.98Å; T350-N355 WeakPolarHBondContact O-CA 3.3Å; T350-N355 WeakPolarHBondContact O-CB 3.38Å; M352-N355 VanDerWaalsContact O-CB 3.23Å; M352-N355 WeakPolarHBondContact O-CB 3.4Å; M352-N355 PolarHBondContact O-N 3.43Å; M353-N355 VanDerWaalsContact C-N 3.25Å; M353-N355 PolarHBondContact O-N 2.93Å; N355-E357 PolarHBondContact O-N 3.36Å; N355-E357 WeakPolarHBondContact OD1-CB 3.47Å; N355-E357 PolarHBondContact OD1-N 3.08Å; N355-L358 HydrophobicContact CB-CD1 4.33Å; N355-L358 HydrophobicContact CB-CG 4.41Å; N355-L358 PolarHBondContact O-N 3.1Å
356	S	88.6	Confident	87.2	Confident	100 Å²	100	60.1 Å²	60.1	70%	0.699	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-59.1	-29.8	-177.9	51.1	0	0	0	0	113.6	G354 L358 S359	G354-S356 PolarHBondContact O-N 3.44Å; S356-L358 PolarHBondContact O-N 3.29Å; S356-S359 WeakPolarHBondContact O-CB 3.42Å; S356-S359 PolarHBondContact O-N 3.36Å
357	E	88.9	Confident	86.8	Confident	121 Å²	121	60.7 Å²	60.7	57%	0.565	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-72.2	-15.9	178.7	-64.1	-177.6	-164.4	0	0	112.9	L291 K294 N355	L291-E357 HydrophobicContact CD2-CB 3.46Å; L291-E357 VanDerWaalsContact CD2-CB 3.46Å; L291-E357 WeakPolarHBondContact CD2-OE2 3.33Å; K294-E357 WeakPolarHBondContact CD-O 3.45Å; K294-E357 WeakPolarHBondContact CE-O 3.24Å; K294-E357 PolarHBondContact NZ-O 3.36Å; N355-E357 PolarHBondContact O-N 3.36Å; N355-E357 WeakPolarHBondContact OD1-CB 3.47Å; N355-E357 PolarHBondContact OD1-N 3.08Å
358	L	89.1	Confident	86.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-89.4	-8.9	173.7	-63.9	176.7	0	0	0	113	L287 L290 L291 F308 N355 S356 E361 V362	L287-L358 HydrophobicContact CD1-CD1 3.89Å; L287-L358 HydrophobicContact CD1-CG 4.37Å; L290-L358 HydrophobicContact CB-CD2 3.92Å; L291-L358 HydrophobicContact CD2-CD2 3.81Å; L291-L358 HydrophobicContact CD2-CG 4.21Å; L291-L358 HydrophobicContact CG-CD2 4.37Å; F308-L358 HydrophobicContact CZ-CD2 4.46Å; N355-L358 HydrophobicContact CB-CD1 4.33Å; N355-L358 HydrophobicContact CB-CG 4.41Å; N355-L358 PolarHBondContact O-N 3.1Å; S356-L358 PolarHBondContact O-N 3.29Å; L358-E361 PolarHBondContact O-N 2.87Å; L358-E361 VanDerWaalsContact O-N 3.14Å; L358-V362 HydrophobicContact CB-CB 4.17Å; L358-V362 HydrophobicContact CB-CG2 3.93Å; L358-V362 HydrophobicContact CD1-CG2 4.45Å; L358-V362 PolarHBondContact O-N 3Å
359	S	84.3	Confident	86.4	Confident	74 Å²	74	68.4 Å²	68.4	52%	0.517	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	140.1	176.8	-167.6	0	0	0	0	111.4	K294 S356 E361	K294-S359 PolarHBondContact NZ-O 2.94Å; S356-S359 WeakPolarHBondContact O-CB 3.42Å; S356-S359 PolarHBondContact O-N 3.36Å; S359-E361 VanDerWaalsContact C-OE2 3.26Å
360	P	83.7	Confident	86.4	Confident	108 Å²	108	67 Å²	67	70%	0.701	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.2	2.9	5.9	37.1	-38	0	0	0	116.2	V362	P360-V362 VanDerWaalsContact C-N 3.33Å; P360-V362 PolarHBondContact O-N 3.34Å
361	E	83.2	Confident	86.5	Confident	94 Å²	94	62.2 Å²	62.2	44%	0.439	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.1	-168.9	-61.5	79.2	177.5	0	0	113.4	K294 F308 L358 S359	K294-E361 WeakPolarHBondContact CD-OE2 3.49Å; K294-E361 WeakPolarHBondContact CE-OE1 3.28Å; K294-E361 WeakPolarHBondContact CE-OE2 3.5Å; K294-E361 IonicContact NZ-OE1 2.95Å; K294-E361 IonicContact NZ-OE2 2.8Å; K294-E361 PolarHBondContact NZ-OE2 2.8Å; F308-E361 HydrophobicContact CD1-CB 3.73Å; F308-E361 HydrophobicContact CD1-CG 4.33Å; F308-E361 HydrophobicContact CE1-CB 3.38Å; F308-E361 HydrophobicContact CE1-CG 4.35Å; F308-E361 HydrophobicContact CZ-CB 4.23Å; L358-E361 PolarHBondContact O-N 2.87Å; L358-E361 VanDerWaalsContact O-N 3.14Å; S359-E361 VanDerWaalsContact C-OE2 3.26Å
362	V	85.6	Confident	86.7	Confident	13 Å²	13	59.7 Å²	59.7	8%	0.079	35%	0.349	C	S	.	.			trans	-110.2	118.1	174	-175.8	0	0	0	0	109.9	F308 L312 M353 L358 P360 L367	F308-V362 HydrophobicContact CE1-CG2 3.88Å; F308-V362 HydrophobicContact CZ-CG2 3.83Å; L312-V362 HydrophobicContact CD1-CG2 4.18Å; L312-V362 HydrophobicContact CD2-CG2 3.98Å; M353-V362 HydrophobicContact CB-CG1 4.42Å; L358-V362 HydrophobicContact CB-CB 4.17Å; L358-V362 HydrophobicContact CB-CG2 3.93Å; L358-V362 HydrophobicContact CD1-CG2 4.45Å; L358-V362 PolarHBondContact O-N 3Å; P360-V362 VanDerWaalsContact C-N 3.33Å; P360-V362 PolarHBondContact O-N 3.34Å; V362-L367 HydrophobicContact CG1-CD1 4.35Å
363	D	84.3	Confident	86.6	Confident	79 Å²	79	64.2 Å²	64.2	42%	0.422	37%	0.37	S	S	.	.			trans	-103.2	113.2	167.1	-177	1.1	0	0	0	109.7	N365 C366	D363-N365 PolarHBondContact O-N 3.16Å; D363-N365 WeakPolarHBondContact OD1-CB 3.44Å; D363-N365 PolarHBondContact OD1-N 2.9Å; D363-N365 PolarHBondContact OD1-ND2 3.5Å; D363-C366 HydrophobicContact CB-CB 4.34Å; D363-C366 PolarHBondContact O-N 2.89Å; D363-C366 VanDerWaalsContact O-N 3.13Å
364	V	82.9	Confident	86.6	Confident	40 Å²	40	67.2 Å²	67.2	24%	0.242	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-60.3	-31	-179.5	-176.1	0	0	0	0	111.7	T348 C366 L367	T348-V364 HydrophobicContact CG2-CG1 3.81Å; V364-C366 VanDerWaalsContact C-N 3.25Å; V364-C366 PolarHBondContact O-N 3.42Å; V364-L367 PolarHBondContact O-N 3.46Å
365	N	79.8	Confident	86.7	Confident	148 Å²	148	67.7 Å²	67.7	79%	0.791	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-73.5	-19.2	-178.5	-55.6	-64.4	0	0	0	113	D363	D363-N365 PolarHBondContact O-N 3.16Å; D363-N365 WeakPolarHBondContact OD1-CB 3.44Å; D363-N365 PolarHBondContact OD1-N 2.9Å; D363-N365 PolarHBondContact OD1-ND2 3.5Å
366	C	81.9	Confident	86.7	Confident	98 Å²	98	66.5 Å²	66.5	66%	0.662	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-93.4	-3.8	176.3	-69.5	0	0	0	0	113.1	D363 V364	D363-C366 HydrophobicContact CB-CB 4.34Å; D363-C366 PolarHBondContact O-N 2.89Å; D363-C366 VanDerWaalsContact O-N 3.13Å; V364-C366 VanDerWaalsContact C-N 3.25Å; V364-C366 PolarHBondContact O-N 3.42Å
367	L	83	Confident	86.8	Confident	36 Å²	36	65.3 Å²	65.3	19%	0.188	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-76.5	131	177.8	-65.2	174.7	0	0	0	110.3	Y347 M353 V362 V364	Y347-L367 HydrophobicContact CE1-CB 4.33Å; Y347-L367 HydrophobicContact CE1-CD1 4.1Å; M353-L367 HydrophobicContact CB-CD1 3.59Å; M353-L367 HydrophobicContact CG-CD1 3.85Å; V362-L367 HydrophobicContact CG1-CD1 4.35Å; V364-L367 PolarHBondContact O-N 3.46Å
368	N	84.7	Confident	87	Confident	122 Å²	122	65.9 Å²	65.9	65%	0.652	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-71.1	159.7	171.3	-63.4	-36.8	0	0	0	110.4	H316	H316-N368 PolarHBondContact CE1-O 2.94Å
369	L	86.8	Confident	87.2	Confident	104 Å²	104	66.3 Å²	66.3	55%	0.545	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-66.4	138.1	171.8	-64.6	169.4	0	0	0	110.3	I371	L369-I371 VanDerWaalsContact C-N 3.33Å; L369-I371 WeakPolarHBondContact CB-O 3.24Å
370	L	90.7	Very high	87.5	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	36%	0.355	C	S	.	.	S	Bend	trans	-68.1	-34	178.3	-67.6	176.7	0	0	0	112.6	L319 S320 M323 W342 V343 Y347	L319-L370 HydrophobicContact CB-CD2 3.85Å; S320-L370 WeakPolarHBondContact CA-O 3.41Å; S320-L370 WeakPolarHBondContact CB-O 3.34Å; S320-L370 PolarHBondContact OG-O 3.37Å; M323-L370 HydrophobicContact CG-CB 4.45Å; M323-L370 HydrophobicContact CG-CD1 4.13Å; W342-L370 HydrophobicContact CE3-CD1 4.38Å; W342-L370 HydrophobicContact CH2-CD1 4.43Å; W342-L370 HydrophobicContact CZ3-CD1 3.59Å; V343-L370 HydrophobicContact CG1-CB 3.98Å; V343-L370 HydrophobicContact CG1-CD1 4.44Å; V343-L370 HydrophobicContact CG2-CD1 4.47Å; Y347-L370 HydrophobicContact CD1-CD1 4.03Å; Y347-L370 HydrophobicContact CD1-CG 4.03Å; Y347-L370 HydrophobicContact CD2-CD1 3.59Å; Y347-L370 HydrophobicContact CD2-CD2 4.42Å; Y347-L370 HydrophobicContact CD2-CG 4.22Å; Y347-L370 HydrophobicContact CE1-CD1 4.39Å; Y347-L370 HydrophobicContact CE1-CD2 4.2Å; Y347-L370 HydrophobicContact CE1-CG 4.01Å; Y347-L370 HydrophobicContact CE2-CD1 3.95Å; Y347-L370 HydrophobicContact CE2-CD2 3.92Å; Y347-L370 HydrophobicContact CE2-CG 4.17Å; Y347-L370 HydrophobicContact CG-CD1 3.64Å; Y347-L370 HydrophobicContact CG-CG 4.15Å
371	I	91.4	Very high	87.9	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	35%	0.347	C	S	.	.	S	Bend	trans	-122.7	147.1	175.6	64.5	-171.1	0	0	0	108.7	M323 Q324 L340 V343 L369 V376	M323-I371 HydrophobicContact CB-CG2 3.72Å; Q324-I371 HydrophobicContact CG-CG2 4.17Å; L340-I371 HydrophobicContact CD2-CD1 4.19Å; V343-I371 HydrophobicContact CB-CD1 4.25Å; V343-I371 HydrophobicContact CG1-CD1 3.83Å; V343-I371 HydrophobicContact CG1-CG1 3.78Å; V343-I371 HydrophobicContact CG2-CD1 4.33Å; L369-I371 VanDerWaalsContact C-N 3.33Å; L369-I371 WeakPolarHBondContact CB-O 3.24Å; I371-V376 HydrophobicContact CD1-CG2 3.68Å; I371-V376 HydrophobicContact CG1-CG2 3.62Å
372	S	90.9	Very high	88.3	Confident	54 Å²	54	61.1 Å²	61.1	38%	0.378	34%	0.34	S	S	.	.			trans	-67.3	150.6	179.1	62.9	0	0	0	0	111	S374 V375 V376	S372-S374 PolarHBondContact O-N 3.13Å; S372-S374 VanDerWaalsContact O-N 3.14Å; S372-S374 PolarHBondContact OG-OG 3.35Å; S372-V375 PolarHBondContact O-N 2.99Å; S372-V375 WeakPolarHBondContact OG-CG2 3.15Å; S372-V376 PolarHBondContact O-N 3.23Å; S372-V376 VanDerWaalsContact O-N 3.14Å
373	Q	88.9	Confident	88.7	Confident	96 Å²	96	60.9 Å²	60.9	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-56	-34.1	177.2	-170.7	59.1	44.2	0	0	112.2	V375 V376 D377	Q373-V375 VanDerWaalsContact C-N 3.33Å; Q373-V375 PolarHBondContact O-N 3.35Å; Q373-V376 WeakPolarHBondContact O-CB 3.43Å; Q373-V376 PolarHBondContact O-N 3.47Å; Q373-D377 PolarHBondContact NE2-OD1 3.47Å; Q373-D377 PolarHBondContact O-N 3.32Å
374	S	90.3	Very high	89.1	Confident	65 Å²	65	58.9 Å²	58.9	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-38.9	175.3	56.1	0	0	0	0	113.5	S372 Q378	S372-S374 PolarHBondContact O-N 3.13Å; S372-S374 VanDerWaalsContact O-N 3.14Å; S372-S374 PolarHBondContact OG-OG 3.35Å; S374-Q378 VanDerWaalsContact O-CG 3.26Å; S374-Q378 WeakPolarHBondContact O-CG 3.35Å; S374-Q378 PolarHBondContact O-N 3.49Å; S374-Q378 VanDerWaalsContact O-N 3.1Å
375	V	91.5	Very high	89.6	Confident	34 Å²	34	61 Å²	61	21%	0.206	34%	0.343	C	S	.	.	H	α-helix	trans	-73.4	-39.4	178	173.8	0	0	0	0	110	A327 S372 Q373 D377 Q378 L379	A327-V375 HydrophobicContact CB-CG1 3.72Å; S372-V375 PolarHBondContact O-N 2.99Å; S372-V375 WeakPolarHBondContact OG-CG2 3.15Å; Q373-V375 VanDerWaalsContact C-N 3.33Å; Q373-V375 PolarHBondContact O-N 3.35Å; V375-D377 VanDerWaalsContact C-N 3.33Å; V375-D377 PolarHBondContact O-N 2.9Å; V375-Q378 PolarHBondContact O-N 3.49Å; V375-L379 HydrophobicContact CG1-CD1 4.26Å; V375-L379 HydrophobicContact CG1-CG 4.47Å; V375-L379 WeakPolarHBondContact O-CG 3.48Å; V375-L379 PolarHBondContact O-N 2.98Å
376	V	91	Very high	90.2	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-55.8	-49.9	172	179.4	0	0	0	0	110.4	L340 L344 I371 S372 Q373 Q378 L379 L380	L340-V376 HydrophobicContact CD2-CG1 4.15Å; L344-V376 HydrophobicContact CD1-CG1 4.48Å; I371-V376 HydrophobicContact CD1-CG2 3.68Å; I371-V376 HydrophobicContact CG1-CG2 3.62Å; S372-V376 PolarHBondContact O-N 3.23Å; S372-V376 VanDerWaalsContact O-N 3.14Å; Q373-V376 WeakPolarHBondContact O-CB 3.43Å; Q373-V376 PolarHBondContact O-N 3.47Å; V376-Q378 VanDerWaalsContact C-N 3.31Å; V376-Q378 PolarHBondContact O-N 2.82Å; V376-L379 PolarHBondContact O-N 3.25Å; V376-L380 HydrophobicContact CG1-CD1 3.81Å; V376-L380 HydrophobicContact CG1-CG 4.21Å; V376-L380 WeakPolarHBondContact O-CB 3.31Å; V376-L380 VanDerWaalsContact O-CG 3.3Å; V376-L380 WeakPolarHBondContact O-CG 3.41Å; V376-L380 PolarHBondContact O-N 2.96Å
377	D	90.6	Very high	90.7	Very high	75 Å²	75	52 Å²	52	40%	0.401	29%	0.29	S	S	.	.	H	α-helix	trans	-64.6	-35.8	-177.7	-64.5	-21	0	0	0	112	Q373 V375 S381	Q373-D377 PolarHBondContact NE2-OD1 3.47Å; Q373-D377 PolarHBondContact O-N 3.32Å; V375-D377 VanDerWaalsContact C-N 3.33Å; V375-D377 PolarHBondContact O-N 2.9Å; D377-S381 VanDerWaalsContact O-CB 3.29Å; D377-S381 WeakPolarHBondContact O-CB 3.48Å; D377-S381 PolarHBondContact O-N 3.06Å; D377-S381 PolarHBondContact O-OG 3.31Å
378	Q	92.3	Very high	91.2	Very high	133 Å²	133	51.9 Å²	51.9	62%	0.621	29%	0.291	S	S	*	.	H	α-helix	trans	-65.5	-48	173.9	-74.7	172.8	23.2	0	0	112.1	S374 V375 V376 S381 K382	S374-Q378 VanDerWaalsContact O-CG 3.26Å; S374-Q378 WeakPolarHBondContact O-CG 3.35Å; S374-Q378 PolarHBondContact O-N 3.49Å; S374-Q378 VanDerWaalsContact O-N 3.1Å; V375-Q378 PolarHBondContact O-N 3.49Å; V376-Q378 VanDerWaalsContact C-N 3.31Å; V376-Q378 PolarHBondContact O-N 2.82Å; Q378-S381 PolarHBondContact O-N 2.91Å; Q378-K382 PolarHBondContact O-N 3.49Å
379	L	92.6	Very high	91.7	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-43	177.4	-71.5	176.7	0	0	0	111.5	A327 L331 I336 L339 L340 V375 V376 K382 Y383	A327-L379 HydrophobicContact CB-CD1 3.99Å; L331-L379 HydrophobicContact CD1-CD2 4.39Å; I336-L379 HydrophobicContact CG1-CD2 4.38Å; I336-L379 HydrophobicContact CG2-CB 4.08Å; L339-L379 HydrophobicContact CD2-CD1 4.19Å; L340-L379 HydrophobicContact CD1-CB 4.31Å; L340-L379 HydrophobicContact CD2-CB 4.42Å; L340-L379 HydrophobicContact CD2-CD1 4.03Å; V375-L379 HydrophobicContact CG1-CD1 4.26Å; V375-L379 HydrophobicContact CG1-CG 4.47Å; V375-L379 WeakPolarHBondContact O-CG 3.48Å; V375-L379 PolarHBondContact O-N 2.98Å; V376-L379 PolarHBondContact O-N 3.25Å; L379-K382 PolarHBondContact O-N 3.14Å; L379-Y383 WeakPolarHBondContact O-CB 3.26Å; L379-Y383 PolarHBondContact O-N 3.15Å
380	L	91.8	Very high	92	Very high	21 Å²	21	49.4 Å²	49.4	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-41.7	175.1	-73.9	177.9	0	0	0	111.7	L340 V376 Y383 M384 L446	L340-L380 HydrophobicContact CD1-CD2 3.47Å; L340-L380 VanDerWaalsContact CD1-CD2 3.47Å; L340-L380 HydrophobicContact CD1-CG 3.9Å; V376-L380 HydrophobicContact CG1-CD1 3.81Å; V376-L380 HydrophobicContact CG1-CG 4.21Å; V376-L380 WeakPolarHBondContact O-CB 3.31Å; V376-L380 VanDerWaalsContact O-CG 3.3Å; V376-L380 WeakPolarHBondContact O-CG 3.41Å; V376-L380 PolarHBondContact O-N 2.96Å; L380-Y383 PolarHBondContact O-N 2.82Å; L380-M384 WeakPolarHBondContact O-CB 3.31Å; L380-M384 WeakPolarHBondContact O-CG 3.45Å; L380-M384 PolarHBondContact O-N 3.33Å; L380-L446 HydrophobicContact CD2-CD1 4.01Å; L380-L446 HydrophobicContact CD2-CD2 3.72Å; L380-L446 HydrophobicContact CD2-CG 4.34Å
381	S	91.6	Very high	92.2	Very high	78 Å²	78	49.5 Å²	49.5	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-42.3	176.9	-61.7	0	0	0	0	111.7	D377 Q378 M384 S385	D377-S381 VanDerWaalsContact O-CB 3.29Å; D377-S381 WeakPolarHBondContact O-CB 3.48Å; D377-S381 PolarHBondContact O-N 3.06Å; D377-S381 PolarHBondContact O-OG 3.31Å; Q378-S381 PolarHBondContact O-N 2.91Å; S381-M384 PolarHBondContact O-N 3.04Å; S381-S385 WeakPolarHBondContact O-CB 3.3Å; S381-S385 PolarHBondContact O-N 2.64Å
382	K	92.1	Very high	92.3	Very high	67 Å²	67	51.6 Å²	51.6	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-49.6	174.5	-172.6	-177.6	-179.3	-162.9	0	111	D330 L331 I336 Q378 L379 M384 S385 T386	D330-K382 IonicContact OD1-NZ 2.75Å; D330-K382 PolarHBondContact OD1-NZ 3.38Å; L331-K382 PolarHBondContact O-NZ 3.15Å; I336-K382 HydrophobicContact CD1-CB 4.38Å; I336-K382 HydrophobicContact CD1-CD 4.01Å; I336-K382 HydrophobicContact CD1-CG 4.2Å; Q378-K382 PolarHBondContact O-N 3.49Å; L379-K382 PolarHBondContact O-N 3.14Å; K382-M384 VanDerWaalsContact C-N 3.35Å; K382-M384 PolarHBondContact O-N 3.28Å; K382-S385 PolarHBondContact O-N 2.96Å; K382-T386 PolarHBondContact O-N 2.94Å; K382-T386 PolarHBondContact O-OG1 3.06Å
383	Y	93.2	Very high	92.5	Very high	8 Å²	8	50.8 Å²	50.8	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-55.6	-48.1	175.3	171	-101.2	0	0	0	111.8	A333 V337 L379 L380 S385 T386 L387 L446	A333-Y383 HydrophobicContact CB-CD2 4.14Å; A333-Y383 HydrophobicContact CB-CE2 4.41Å; V337-Y383 HydrophobicContact CG2-CD2 4.07Å; V337-Y383 HydrophobicContact CG2-CE2 3.59Å; L379-Y383 WeakPolarHBondContact O-CB 3.26Å; L379-Y383 PolarHBondContact O-N 3.15Å; L380-Y383 PolarHBondContact O-N 2.82Å; Y383-S385 VanDerWaalsContact C-N 3.34Å; Y383-S385 PolarHBondContact O-N 3.14Å; Y383-T386 PolarHBondContact O-N 3.39Å; Y383-L387 HydrophobicContact CE1-CD2 3.89Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.45Å; Y383-L446 HydrophobicContact CD1-CD1 4.44Å; Y383-L446 HydrophobicContact CD1-CD2 4.32Å; Y383-L446 HydrophobicContact CE1-CD1 4.48Å; Y383-L446 HydrophobicContact CE1-CD2 4.08Å
384	M	92.7	Very high	92.8	Very high	38 Å²	38	51.1 Å²	51.1	19%	0.187	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-39.1	179.7	-74.3	-62.1	-68.3	0	0	112.4	L380 S381 K382 L387 T388 L446 K449 V450 L453	L380-M384 WeakPolarHBondContact O-CB 3.31Å; L380-M384 WeakPolarHBondContact O-CG 3.45Å; L380-M384 PolarHBondContact O-N 3.33Å; S381-M384 PolarHBondContact O-N 3.04Å; K382-M384 VanDerWaalsContact C-N 3.35Å; K382-M384 PolarHBondContact O-N 3.28Å; M384-L387 HydrophobicContact SD-CD2 4.38Å; M384-T388 WeakPolarHBondContact O-CB 3.39Å; M384-T388 PolarHBondContact O-N 2.93Å; M384-T388 PolarHBondContact O-OG1 3.35Å; M384-L446 HydrophobicContact CG-CD1 4.14Å; M384-L446 HydrophobicContact SD-CD1 3.67Å; M384-K449 HydrophobicContact CE-CB 4.19Å; M384-V450 HydrophobicContact CE-CG2 4.3Å; M384-V450 HydrophobicContact SD-CG2 3.68Å; M384-L453 HydrophobicContact CE-CB 4.18Å; M384-L453 HydrophobicContact CE-CD2 3.84Å
385	S	93.2	Very high	93.1	Very high	83 Å²	83	48 Å²	48	58%	0.58	27%	0.272	S	S	*	.	H	α-helix	trans	-63.6	-49	175.3	-176.9	0	0	0	0	111.7	S381 K382 Y383 L387 T388 S389	S381-S385 WeakPolarHBondContact O-CB 3.3Å; S381-S385 PolarHBondContact O-N 2.64Å; K382-S385 PolarHBondContact O-N 2.96Å; Y383-S385 VanDerWaalsContact C-N 3.34Å; Y383-S385 PolarHBondContact O-N 3.14Å; S385-L387 PolarHBondContact O-N 3.43Å; S385-T388 WeakPolarHBondContact O-CB 3.36Å; S385-T388 PolarHBondContact O-N 3.2Å; S385-S389 PolarHBondContact O-N 3.14Å; S385-S389 VanDerWaalsContact O-N 3.08Å
386	T	92.3	Very high	93.3	Very high	51 Å²	51	52.9 Å²	52.9	31%	0.313	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-44.7	176.9	-56.6	0	0	0	0	111.6	A333 K382 Y383 T388 S389 N390	A333-T386 HydrophobicContact CB-CG2 4.14Å; K382-T386 PolarHBondContact O-N 2.94Å; K382-T386 PolarHBondContact O-OG1 3.06Å; Y383-T386 PolarHBondContact O-N 3.39Å; T386-T388 VanDerWaalsContact C-N 3.34Å; T386-T388 PolarHBondContact O-N 3.1Å; T386-S389 PolarHBondContact O-N 3.14Å; T386-N390 WeakPolarHBondContact O-CB 3.39Å; T386-N390 VanDerWaalsContact O-CG 3.22Å; T386-N390 PolarHBondContact O-N 2.77Å; T386-N390 PolarHBondContact O-ND2 2.97Å
387	L	92.9	Very high	93.6	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-43.6	176.6	178.2	62.4	0	0	0	111.6	Y383 M384 S385 S389 N390 I391 N435 V450 L453	Y383-L387 HydrophobicContact CE1-CD2 3.89Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.45Å; M384-L387 HydrophobicContact SD-CD2 4.38Å; S385-L387 PolarHBondContact O-N 3.43Å; L387-S389 PolarHBondContact O-N 2.8Å; L387-N390 PolarHBondContact O-N 2.94Å; L387-I391 HydrophobicContact CD1-CD1 3.86Å; L387-I391 HydrophobicContact CD1-CG1 4.06Å; L387-I391 HydrophobicContact CD2-CD1 4.49Å; L387-I391 HydrophobicContact CG-CD1 3.85Å; L387-I391 HydrophobicContact CG-CG1 4.41Å; L387-I391 WeakPolarHBondContact O-CB 3.28Å; L387-I391 WeakPolarHBondContact O-CG1 3.36Å; L387-I391 PolarHBondContact O-N 3.41Å; L387-N435 HydrophobicContact CD1-CB 4.3Å; L387-N435 WeakPolarHBondContact CD1-OD1 3.42Å; L387-V450 HydrophobicContact CD2-CB 4.48Å; L387-V450 HydrophobicContact CD2-CG1 3.99Å; L387-V450 HydrophobicContact CD2-CG2 3.72Å; L387-L453 HydrophobicContact CD2-CD2 4.26Å; L387-L453 HydrophobicContact CG-CD2 4.27Å
388	T	93.9	Very high	93.8	Very high	35 Å²	35	56.5 Å²	56.5	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-49.1	176.9	-59.8	0	0	0	0	111	M384 S385 T386 N390 I391 I392 L453	M384-T388 WeakPolarHBondContact O-CB 3.39Å; M384-T388 PolarHBondContact O-N 2.93Å; M384-T388 PolarHBondContact O-OG1 3.35Å; S385-T388 WeakPolarHBondContact O-CB 3.36Å; S385-T388 PolarHBondContact O-N 3.2Å; T386-T388 VanDerWaalsContact C-N 3.34Å; T386-T388 PolarHBondContact O-N 3.1Å; T388-N390 PolarHBondContact O-N 3.41Å; T388-I391 PolarHBondContact O-N 3.05Å; T388-I392 HydrophobicContact CG2-CD1 3.82Å; T388-I392 VanDerWaalsContact O-CG1 3.27Å; T388-I392 WeakPolarHBondContact O-CG1 3.4Å; T388-I392 PolarHBondContact O-N 3.46Å; T388-L453 HydrophobicContact CG2-CD1 3.97Å; T388-L453 WeakPolarHBondContact OG1-CD1 3.46Å; T388-L453 VanDerWaalsContact OG1-CD2 3.27Å; T388-L453 WeakPolarHBondContact OG1-CD2 3.27Å
389	S	94.1	Very high	94	Very high	79 Å²	79	50.8 Å²	50.8	55%	0.552	27%	0.274	S	S	*	.	H	α-helix	trans	-60.4	-45	177.6	-171.9	0	0	0	0	111.9	S385 T386 L387 I392 G393	S385-S389 PolarHBondContact O-N 3.14Å; S385-S389 VanDerWaalsContact O-N 3.08Å; T386-S389 PolarHBondContact O-N 3.14Å; L387-S389 PolarHBondContact O-N 2.8Å; S389-I392 PolarHBondContact O-N 3.3Å; S389-G393 PolarHBondContact O-N 3.1Å
390	N	93.1	Very high	94.1	Very high	95 Å²	95	55.1 Å²	55.1	51%	0.508	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-45.6	178.8	-71.7	-12.5	0	0	0	112	T386 L387 T388 G393 W394	T386-N390 WeakPolarHBondContact O-CB 3.39Å; T386-N390 VanDerWaalsContact O-CG 3.22Å; T386-N390 PolarHBondContact O-N 2.77Å; T386-N390 PolarHBondContact O-ND2 2.97Å; L387-N390 PolarHBondContact O-N 2.94Å; T388-N390 PolarHBondContact O-N 3.41Å; N390-G393 PolarHBondContact O-N 3.46Å; N390-W394 WeakPolarHBondContact O-CB 3.23Å; N390-W394 PolarHBondContact O-N 3.39Å
391	I	95	Very high	94.3	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-46.7	176.6	-72.9	173.5	0	0	0	110.5	L387 T388 G393 W394 L395 M431 F432 L453 Q457	L387-I391 HydrophobicContact CD1-CD1 3.86Å; L387-I391 HydrophobicContact CD1-CG1 4.06Å; L387-I391 HydrophobicContact CD2-CD1 4.49Å; L387-I391 HydrophobicContact CG-CD1 3.85Å; L387-I391 HydrophobicContact CG-CG1 4.41Å; L387-I391 WeakPolarHBondContact O-CB 3.28Å; L387-I391 WeakPolarHBondContact O-CG1 3.36Å; L387-I391 PolarHBondContact O-N 3.41Å; T388-I391 PolarHBondContact O-N 3.05Å; I391-G393 PolarHBondContact O-N 2.99Å; I391-W394 PolarHBondContact O-N 3.39Å; I391-L395 HydrophobicContact CG2-CD1 3.66Å; I391-L395 HydrophobicContact CG2-CG 4.18Å; I391-L395 WeakPolarHBondContact O-CB 3.45Å; I391-L395 VanDerWaalsContact O-CG 3.26Å; I391-L395 WeakPolarHBondContact O-CG 3.43Å; I391-L395 PolarHBondContact O-N 2.92Å; I391-M431 HydrophobicContact CG1-CE 4.49Å; I391-M431 HydrophobicContact CG1-SD 4.11Å; I391-M431 HydrophobicContact CG2-CE 4.3Å; I391-F432 HydrophobicContact CG2-CE1 3.98Å; I391-L453 HydrophobicContact CD1-CD2 4.3Å; I391-Q457 HydrophobicContact CG2-CB 3.86Å; I391-Q457 HydrophobicContact CG2-CG 3.94Å
392	I	94.6	Very high	94.4	Very high	49 Å²	49	54 Å²	54	25%	0.251	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-47.9	179.6	-70.5	167.3	0	0	0	111.2	T388 S389 R396 Q457	T388-I392 HydrophobicContact CG2-CD1 3.82Å; T388-I392 VanDerWaalsContact O-CG1 3.27Å; T388-I392 WeakPolarHBondContact O-CG1 3.4Å; T388-I392 PolarHBondContact O-N 3.46Å; S389-I392 PolarHBondContact O-N 3.3Å; I392-R396 WeakPolarHBondContact O-CB 3.3Å; I392-R396 PolarHBondContact O-N 2.88Å; I392-R396 VanDerWaalsContact O-N 3.1Å; I392-Q457 HydrophobicContact CG1-CG 4.38Å
393	G	94.8	Very high	94.5	Very high	37 Å²	37	55 Å²	55	38%	0.381	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-41	179.8	0	0	0	0	0	112.1	S389 N390 I391 R396 K397	S389-G393 PolarHBondContact O-N 3.1Å; N390-G393 PolarHBondContact O-N 3.46Å; I391-G393 PolarHBondContact O-N 2.99Å; G393-R396 PolarHBondContact O-N 3.42Å; G393-K397 PolarHBondContact O-N 2.93Å
394	W	95.9	Very high	94.5	Very high	103 Å²	103	61.8 Å²	61.8	39%	0.39	32%	0.319	S	S	.	.	H	α-helix	trans	-69.2	-45.7	179.5	-164.1	102.4	0	0	0	112.3	N390 I391 R396 K397 A398 I427 V428 M431	N390-W394 WeakPolarHBondContact O-CB 3.23Å; N390-W394 PolarHBondContact O-N 3.39Å; I391-W394 PolarHBondContact O-N 3.39Å; W394-R396 VanDerWaalsContact C-N 3.27Å; W394-R396 PolarHBondContact O-N 3.02Å; W394-K397 PolarHBondContact O-N 2.63Å; W394-K397 VanDerWaalsContact O-N 3.15Å; W394-A398 HydrophobicContact CE3-CB 4.02Å; W394-A398 HydrophobicContact CZ3-CB 3.9Å; W394-A398 WeakPolarHBondContact O-CB 3.44Å; W394-A398 PolarHBondContact O-N 2.62Å; W394-I427 HydrophobicContact CH2-CB 4.27Å; W394-I427 HydrophobicContact CH2-CG2 3.09Å; W394-I427 VanDerWaalsContact CH2-O 3.28Å; W394-I427 WeakPolarHBondContact CH2-O 3.39Å; W394-I427 HydrophobicContact CZ2-CG2 3.83Å; W394-I427 HydrophobicContact CZ3-CG2 3.76Å; W394-V428 HydrophobicContact CZ3-CG2 4.47Å; W394-M431 HydrophobicContact CD2-CE 4.34Å; W394-M431 HydrophobicContact CD2-CG 3.97Å; W394-M431 HydrophobicContact CE3-CB 4.27Å; W394-M431 HydrophobicContact CE3-CE 3.69Å; W394-M431 HydrophobicContact CE3-CG 4.01Å; W394-M431 HydrophobicContact CH2-CB 3.55Å; W394-M431 HydrophobicContact CH2-CG 4.05Å; W394-M431 HydrophobicContact CZ2-CB 3.95Å; W394-M431 HydrophobicContact CZ2-CG 4.12Å; W394-M431 HydrophobicContact CZ3-CB 3.8Å; W394-M431 HydrophobicContact CZ3-CE 3.99Å; W394-M431 HydrophobicContact CZ3-CG 4.06Å
395	L	96.6	Very high	94.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59	-39.1	175.5	-74.6	174.2	0	0	0	111.8	I391 A398 L399 V428 M431 F432 Q457 F461	I391-L395 HydrophobicContact CG2-CD1 3.66Å; I391-L395 HydrophobicContact CG2-CG 4.18Å; I391-L395 WeakPolarHBondContact O-CB 3.45Å; I391-L395 VanDerWaalsContact O-CG 3.26Å; I391-L395 WeakPolarHBondContact O-CG 3.43Å; I391-L395 PolarHBondContact O-N 2.92Å; L395-A398 PolarHBondContact O-N 2.73Å; L395-L399 PolarHBondContact O-N 3.38Å; L395-V428 HydrophobicContact CD2-CB 4.38Å; L395-V428 HydrophobicContact CD2-CG1 3.78Å; L395-V428 HydrophobicContact CD2-CG2 3.85Å; L395-M431 HydrophobicContact CD2-CE 4.02Å; L395-M431 HydrophobicContact CG-CE 4.14Å; L395-F432 HydrophobicContact CD1-CE1 4.3Å; L395-F432 HydrophobicContact CD1-CZ 4.18Å; L395-F432 HydrophobicContact CD2-CE1 4.4Å; L395-F432 HydrophobicContact CD2-CZ 4.23Å; L395-Q457 HydrophobicContact CD1-CB 4Å; L395-F461 HydrophobicContact CB-CD2 3.94Å; L395-F461 HydrophobicContact CD1-CB 4.19Å; L395-F461 HydrophobicContact CD2-CD2 4.17Å; L395-F461 HydrophobicContact CD2-CE2 4.44Å; L395-F461 HydrophobicContact CD2-CG 4.42Å; L395-F461 HydrophobicContact CG-CD2 4.5Å
396	R	95.6	Very high	94.4	Very high	135 Å²	135	57.7 Å²	57.7	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-49.1	174.5	-173.7	-175.7	-58.8	173.9	1.7	111.2	I392 G393 W394 A398 L399 E400	I392-R396 WeakPolarHBondContact O-CB 3.3Å; I392-R396 PolarHBondContact O-N 2.88Å; I392-R396 VanDerWaalsContact O-N 3.1Å; G393-R396 PolarHBondContact O-N 3.42Å; W394-R396 VanDerWaalsContact C-N 3.27Å; W394-R396 PolarHBondContact O-N 3.02Å; R396-A398 VanDerWaalsContact C-N 3.32Å; R396-A398 PolarHBondContact O-N 2.86Å; R396-L399 PolarHBondContact O-N 3.44Å; R396-E400 WeakPolarHBondContact CG-OE1 3.28Å; R396-E400 WeakPolarHBondContact O-CG 3.39Å; R396-E400 PolarHBondContact O-N 3.29Å
397	K	95.6	Very high	94.3	Very high	142 Å²	142	59.9 Å²	59.9	62%	0.617	30%	0.304	S	S	*	.	H	α-helix	trans	-63.6	-37.1	178.9	-172.7	177.1	178.7	-178.8	0	112.4	G393 W394 E400 T401	G393-K397 PolarHBondContact O-N 2.93Å; W394-K397 PolarHBondContact O-N 2.63Å; W394-K397 VanDerWaalsContact O-N 3.15Å; K397-E400 PolarHBondContact O-N 3.5Å; K397-T401 WeakPolarHBondContact O-CB 3.18Å; K397-T401 PolarHBondContact O-N 3.2Å; K397-T401 PolarHBondContact O-OG1 3.32Å
398	A	96.3	Very high	94.1	Very high	13 Å²	13	64.2 Å²	64.2	11%	0.107	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-46.3	175.5	0	0	0	0	0	111.1	W394 L395 R396 T401 D402 L424 I427	W394-A398 HydrophobicContact CE3-CB 4.02Å; W394-A398 HydrophobicContact CZ3-CB 3.9Å; W394-A398 WeakPolarHBondContact O-CB 3.44Å; W394-A398 PolarHBondContact O-N 2.62Å; L395-A398 PolarHBondContact O-N 2.73Å; R396-A398 VanDerWaalsContact C-N 3.32Å; R396-A398 PolarHBondContact O-N 2.86Å; A398-T401 PolarHBondContact O-N 2.97Å; A398-D402 PolarHBondContact O-N 3.42Å; A398-L424 HydrophobicContact CB-CD1 3.87Å; A398-I427 HydrophobicContact CB-CG2 4.43Å
399	L	96.3	Very high	93.8	Very high	14 Å²	14	69.1 Å²	69.1	7%	0.073	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-44.5	175.1	-178.2	53.6	0	0	0	112.7	L395 R396 T401 D402 K403 L424 F461 R464 Y465 E468	L395-L399 PolarHBondContact O-N 3.38Å; R396-L399 PolarHBondContact O-N 3.44Å; L399-T401 PolarHBondContact O-N 3.49Å; L399-D402 PolarHBondContact O-N 2.99Å; L399-K403 WeakPolarHBondContact O-CB 3.21Å; L399-K403 PolarHBondContact O-N 2.87Å; L399-L424 HydrophobicContact CD1-CD2 4.46Å; L399-F461 HydrophobicContact CB-CE2 3.96Å; L399-R464 HydrophobicContact CD2-CB 4.12Å; L399-Y465 HydrophobicContact CD1-CD2 3.63Å; L399-Y465 HydrophobicContact CD1-CE2 4.31Å; L399-E468 HydrophobicContact CD2-CG 4.06Å; L399-E468 HydrophobicContact CG-CG 4.45Å
400	E	95.1	Very high	93.6	Very high	101 Å²	101	69.5 Å²	69.5	47%	0.472	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-32.8	176.8	-74.5	171.7	-168.2	0	0	112.4	R396 K397 K404	R396-E400 WeakPolarHBondContact CG-OE1 3.28Å; R396-E400 WeakPolarHBondContact O-CG 3.39Å; R396-E400 PolarHBondContact O-N 3.29Å; K397-E400 PolarHBondContact O-N 3.5Å; E400-K404 WeakPolarHBondContact O-CG 3.28Å; E400-K404 PolarHBondContact O-N 2.82Å
401	T	94.4	Very high	93.5	Very high	71 Å²	71	70.1 Å²	70.1	44%	0.436	34%	0.342	S	S	.	.	H	α-helix	trans	-72.8	-46.6	176.5	-54.6	0	0	0	0	110.4	K397 A398 L399 K403 K404 D405	K397-T401 WeakPolarHBondContact O-CB 3.18Å; K397-T401 PolarHBondContact O-N 3.2Å; K397-T401 PolarHBondContact O-OG1 3.32Å; A398-T401 PolarHBondContact O-N 2.97Å; L399-T401 PolarHBondContact O-N 3.49Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.8Å; T401-K404 WeakPolarHBondContact O-CB 3.23Å; T401-K404 PolarHBondContact O-N 3.17Å; T401-K404 VanDerWaalsContact O-N 3.12Å; T401-D405 PolarHBondContact O-N 3.44Å
402	D	94.8	Very high	93.3	Very high	4 Å²	4	70.5 Å²	70.5	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-42.9	177.2	-163.3	68.8	0	0	0	111.7	A398 L399 K404 D405 W406 T422 L424	A398-D402 PolarHBondContact O-N 3.42Å; L399-D402 PolarHBondContact O-N 2.99Å; D402-K404 VanDerWaalsContact C-N 3.28Å; D402-K404 PolarHBondContact O-N 3.24Å; D402-D405 WeakPolarHBondContact O-CA 3.36Å; D402-D405 VanDerWaalsContact O-CB 3.29Å; D402-D405 WeakPolarHBondContact O-CB 3.06Å; D402-D405 PolarHBondContact O-N 2.86Å; D402-W406 PolarHBondContact O-N 3.08Å; D402-W406 PolarHBondContact O-NE1 3.42Å; D402-W406 VanDerWaalsContact OD2-CZ2 3.32Å; D402-W406 WeakPolarHBondContact OD2-CZ2 3.44Å; D402-W406 PolarHBondContact OD2-NE1 3.39Å; D402-T422 WeakPolarHBondContact OD1-CB 2.93Å; D402-T422 PolarHBondContact OD1-OG1 3.1Å; D402-L424 HydrophobicContact CB-CB 4.16Å; D402-L424 HydrophobicContact CB-CD1 4.26Å; D402-L424 HydrophobicContact CB-CD2 3.92Å; D402-L424 HydrophobicContact CB-CG 4.34Å; D402-L424 WeakPolarHBondContact OD1-CB 3.37Å; D402-L424 WeakPolarHBondContact OD2-CD2 3.29Å
403	K	94.1	Very high	93	Very high	89 Å²	89	74.6 Å²	74.6	39%	0.387	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-36.5	175.4	178.7	176.9	176	169.9	0	113.3	L399 T401 D405 W406 E468	L399-K403 WeakPolarHBondContact O-CB 3.21Å; L399-K403 PolarHBondContact O-N 2.87Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.8Å; K403-D405 PolarHBondContact O-N 3.42Å; K403-W406 HydrophobicContact CB-CE3 4.37Å; K403-W406 HydrophobicContact CB-CZ3 4.46Å; K403-W406 HydrophobicContact CG-CE3 4.23Å; K403-W406 HydrophobicContact CG-CZ3 4.4Å; K403-W406 PolarHBondContact O-N 3.47Å; K403-E468 WeakPolarHBondContact CD-OE2 3.45Å; K403-E468 WeakPolarHBondContact CE-OE2 3.49Å; K403-E468 IonicContact NZ-OE2 2.59Å; K403-E468 PolarHBondContact NZ-OE2 3.07Å
404	K	92.4	Very high	92.7	Very high	151 Å²	151	75.6 Å²	75.6	66%	0.657	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-30.1	175.7	-73.2	172.5	-176.1	177	0	111.5	E400 T401 D402	E400-K404 WeakPolarHBondContact O-CG 3.28Å; E400-K404 PolarHBondContact O-N 2.82Å; T401-K404 WeakPolarHBondContact O-CB 3.23Å; T401-K404 PolarHBondContact O-N 3.17Å; T401-K404 VanDerWaalsContact O-N 3.12Å; D402-K404 VanDerWaalsContact C-N 3.28Å; D402-K404 PolarHBondContact O-N 3.24Å
405	D	90.8	Very high	92.2	Very high	34 Å²	34	72.6 Å²	72.6	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-68.9	-36.7	176.6	-63.3	-26.3	0	0	0	111.1	T401 D402 K403 V407 K408 Y489	T401-D405 PolarHBondContact O-N 3.44Å; D402-D405 WeakPolarHBondContact O-CA 3.36Å; D402-D405 VanDerWaalsContact O-CB 3.29Å; D402-D405 WeakPolarHBondContact O-CB 3.06Å; D402-D405 PolarHBondContact O-N 2.86Å; K403-D405 PolarHBondContact O-N 3.42Å; D405-V407 PolarHBondContact O-N 3.46Å; D405-K408 HydrophobicContact CB-CD 4.39Å; D405-K408 VanDerWaalsContact O-CB 3.31Å; D405-K408 WeakPolarHBondContact O-CB 3.49Å; D405-K408 WeakPolarHBondContact O-CG 3.36Å; D405-K408 PolarHBondContact O-N 2.97Å; D405-K408 WeakPolarHBondContact OD1-CE 3.3Å; D405-K408 IonicContact OD1-NZ 3.77Å; D405-K408 PolarHBondContact OD1-NZ 3.38Å; D405-Y489 HydrophobicContact CB-CE1 4.24Å; D405-Y489 WeakPolarHBondContact O-CE2 3.46Å; D405-Y489 PolarHBondContact O-OH 3.48Å
406	W	93.1	Very high	91.6	Very high	1 Å²	1	82.4 Å²	82.4	0%	0.004	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.6	-179.1	-51.9	-12.8	0	0	0	114.7	D402 K403 Y465 E468 Y472 Y489 I493	D402-W406 PolarHBondContact O-N 3.08Å; D402-W406 PolarHBondContact O-NE1 3.42Å; D402-W406 VanDerWaalsContact OD2-CZ2 3.32Å; D402-W406 WeakPolarHBondContact OD2-CZ2 3.44Å; D402-W406 PolarHBondContact OD2-NE1 3.39Å; K403-W406 HydrophobicContact CB-CE3 4.37Å; K403-W406 HydrophobicContact CB-CZ3 4.46Å; K403-W406 HydrophobicContact CG-CE3 4.23Å; K403-W406 HydrophobicContact CG-CZ3 4.4Å; K403-W406 PolarHBondContact O-N 3.47Å; W406-Y465 HydrophobicContact CH2-CD2 4.48Å; W406-Y465 HydrophobicContact CH2-CE2 4.19Å; W406-Y465 HydrophobicContact CZ2-CD2 4.44Å; W406-Y465 AromaticContact CZ2-CE2 3.79Å; W406-Y465 HydrophobicContact CZ2-CE2 3.79Å; W406-E468 HydrophobicContact CH2-CB 4.13Å; W406-E468 HydrophobicContact CZ3-CB 4.18Å; W406-Y472 HydrophobicContact CB-CD2 4.17Å; W406-Y472 HydrophobicContact CB-CE2 3.61Å; W406-Y472 HydrophobicContact CE3-CD1 4.47Å; W406-Y472 AromaticContact CE3-CD2 3.89Å; W406-Y472 HydrophobicContact CE3-CD2 3.89Å; W406-Y472 HydrophobicContact CE3-CE2 4.46Å; W406-Y472 AromaticContact CE3-CG 3.88Å; W406-Y472 HydrophobicContact CE3-CG 3.88Å; W406-Y472 HydrophobicContact CZ3-CG 4.44Å; W406-Y472 PolarHBondContact O-OH 3.36Å; W406-Y472 VanDerWaalsContact O-OH 3.12Å; W406-Y489 HydrophobicContact CB-CD1 4.33Å; W406-Y489 HydrophobicContact CB-CG 4.32Å; W406-Y489 AromaticContact CD1-CD1 3.71Å; W406-Y489 HydrophobicContact CG-CD1 4.33Å; W406-I493 HydrophobicContact CD2-CD1 4Å; W406-I493 HydrophobicContact CE3-CD1 4.17Å; W406-I493 HydrophobicContact CH2-CD1 4.22Å; W406-I493 HydrophobicContact CZ2-CD1 4.05Å; W406-I493 HydrophobicContact CZ2-CG1 4.18Å; W406-I493 HydrophobicContact CZ3-CD1 4.28Å
407	V	89.9	Confident	91.1	Very high	97 Å²	97	82.4 Å²	82.4	59%	0.588	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	2.6	-178.1	-164.5	0	0	0	0	111.8	D405 P483	D405-V407 PolarHBondContact O-N 3.46Å; V407-P483 HydrophobicContact CG1-CB 4.44Å
408	K	88.6	Confident	90.6	Very high	97 Å²	97	76.6 Å²	76.6	42%	0.422	40%	0.395	S	S	.	.	S	Bend	trans	-70.6	154.3	176.4	-69.9	176.6	173.6	170.3	0	111.4	D405 T410	D405-K408 HydrophobicContact CB-CD 4.39Å; D405-K408 VanDerWaalsContact O-CB 3.31Å; D405-K408 WeakPolarHBondContact O-CB 3.49Å; D405-K408 WeakPolarHBondContact O-CG 3.36Å; D405-K408 PolarHBondContact O-N 2.97Å; D405-K408 WeakPolarHBondContact OD1-CE 3.3Å; D405-K408 IonicContact OD1-NZ 3.77Å; D405-K408 PolarHBondContact OD1-NZ 3.38Å; K408-T410 PolarHBondContact O-N 3.34Å
409	E	87.7	Confident	90.4	Very high	138 Å²	138	79.4 Å²	79.4	65%	0.645	40%	0.404	S	S	*	.	S	Bend	trans	-83.3	5.4	174.2	-59	-174.1	153.1	0	0	112.8	Q484	E409-Q484 PolarHBondContact OE1-NE2 3.09Å
410	T	91.7	Very high	90.2	Very high	86 Å²	86	80.2 Å²	80.2	53%	0.528	41%	0.406	S	S	.	.	S	Bend	trans	-106.8	142.6	179.3	54.6	0	0	0	0	110.3	K408 Y489	K408-T410 PolarHBondContact O-N 3.34Å; T410-Y489 VanDerWaalsContact O-CE2 3.25Å; T410-Y489 WeakPolarHBondContact O-CE2 3.44Å; T410-Y489 PolarHBondContact O-OH 3.44Å
411	E	89.6	Confident	90	Very high	108 Å²	108	76.9 Å²	76.9	51%	0.505	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-59.8	148.8	173.8	-63.4	-170.6	173.7	0	0	112.1	Y420 Q488	E411-Y420 HydrophobicContact CB-CE1 4.46Å; E411-Y420 PolarHBondContact OE2-OH 3.41Å; E411-Q488 HydrophobicContact CG-CG 4.21Å
412	P	90.8	Very high	89.9	Confident	11 Å²	11	74 Å²	74	7%	0.071	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-62.8	156.3	172.4	26.4	-33.2	0	0	0	111.6	Y420 Q488 Y489 A492	P412-Y420 HydrophobicContact CG-CD1 3.77Å; P412-Y420 HydrophobicContact CG-CD2 4.5Å; P412-Y420 HydrophobicContact CG-CE1 4.41Å; P412-Y420 HydrophobicContact CG-CG 3.82Å; P412-Y420 WeakPolarHBondContact O-CD1 3.21Å; P412-Q488 VanDerWaalsContact CD-CB 3.47Å; P412-Q488 HydrophobicContact CG-CB 3.89Å; P412-Y489 HydrophobicContact CB-CD1 4.02Å; P412-Y489 HydrophobicContact CB-CE1 3.77Å; P412-Y489 HydrophobicContact CG-CD1 4.37Å; P412-Y489 HydrophobicContact CG-CE1 4.47Å; P412-A492 HydrophobicContact CB-CB 4.03Å; P412-A492 HydrophobicContact CG-CB 4.11Å
413	E	88.5	Confident	89.7	Confident	135 Å²	135	76.5 Å²	76.5	63%	0.631	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-60.3	151	173.7	-63.1	-179	178.4	0	0	110.8	Y420 Q421	E413-Y420 CarbonylContact O-C 3.53Å; E413-Y420 WeakPolarHBondContact O-CA 3.4Å; E413-Q421 PolarHBondContact O-N 2.83Å
414	A	88.4	Confident	89.8	Confident	58 Å²	58	72.4 Å²	72.4	48%	0.479	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-109.6	143.3	174.8	0	0	0	0	0	110.1	Y419 Y420	A414-Y419 CarbonylContact C-O 3.59Å; A414-Y419 VanDerWaalsContact CA-O 3.28Å; A414-Y419 WeakPolarHBondContact CA-O 3.3Å; A414-Y420 HydrophobicContact CB-CD1 4.45Å
415	D	85.9	Confident	89.9	Confident	40 Å²	40	65.2 Å²	65.2	21%	0.214	34%	0.34	C	S	.	.			trans	-71.2	-179	173.8	70.8	10.3	0	0	0	112.3	D417 G418 Y419 K587	D415-D417 PolarHBondContact O-N 3.26Å; D415-D417 VanDerWaalsContact O-N 3.16Å; D415-D417 WeakPolarHBondContact OD1-CA 3.29Å; D415-D417 PolarHBondContact OD1-N 3.34Å; D415-G418 WeakPolarHBondContact O-CA 3.35Å; D415-G418 PolarHBondContact O-N 2.91Å; D415-G418 PolarHBondContact OD1-N 3.27Å; D415-Y419 PolarHBondContact N-O 2.94Å; D415-Y419 PolarHBondContact OD1-N 2.96Å; D415-K587 WeakPolarHBondContact OD2-CE 3.48Å; D415-K587 IonicContact OD2-NZ 3.03Å; D415-K587 PolarHBondContact OD2-NZ 2.86Å
416	Q	83.2	Confident	89.9	Confident	205 Å²	205	66.6 Å²	66.6	96%	0.958	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-27	-178.4	-64.3	-179.9	9.4	0	0	113.1	G418	Q416-G418 VanDerWaalsContact C-N 3.33Å
417	D	84.8	Confident	90	Very high	136 Å²	136	69.4 Å²	69.4	73%	0.727	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	1.7	178.2	-62.3	-45.4	0	0	0	112	D415 Y419	D415-D417 PolarHBondContact O-N 3.26Å; D415-D417 VanDerWaalsContact O-N 3.16Å; D415-D417 WeakPolarHBondContact OD1-CA 3.29Å; D415-D417 PolarHBondContact OD1-N 3.34Å; D417-Y419 HydrophobicContact CB-CD2 3.67Å; D417-Y419 HydrophobicContact CB-CE2 3.63Å
418	G	86.3	Confident	90.2	Very high	19 Å²	19	64.8 Å²	64.8	20%	0.196	34%	0.342	C	S	.	.	S	Bend	trans	83	14.9	175.3	0	0	0	0	0	115	D415 Q416 K585	D415-G418 WeakPolarHBondContact O-CA 3.35Å; D415-G418 PolarHBondContact O-N 2.91Å; D415-G418 PolarHBondContact OD1-N 3.27Å; Q416-G418 VanDerWaalsContact C-N 3.33Å; G418-K585 VanDerWaalsContact O-CD 3.23Å; G418-K585 WeakPolarHBondContact O-CD 3.33Å; G418-K585 WeakPolarHBondContact O-CE 3.36Å; G418-K585 PolarHBondContact O-NZ 2.8Å
419	Y	91.3	Very high	90.5	Very high	73 Å²	73	61.2 Å²	61.2	29%	0.286	33%	0.326	S	S	.	.			trans	-83.8	136.6	174.1	-62	-85.5	0	0	0	110.9	A414 D415 D417 Q421 K585 I586 K587	A414-Y419 CarbonylContact C-O 3.59Å; A414-Y419 VanDerWaalsContact CA-O 3.28Å; A414-Y419 WeakPolarHBondContact CA-O 3.3Å; D415-Y419 PolarHBondContact N-O 2.94Å; D415-Y419 PolarHBondContact OD1-N 2.96Å; D417-Y419 HydrophobicContact CB-CD2 3.67Å; D417-Y419 HydrophobicContact CB-CE2 3.63Å; Y419-Q421 PolarHBondContact O-N 3.29Å; Y419-K585 WeakPolarHBondContact CD1-O 3.39Å; Y419-I586 WeakPolarHBondContact CE1-O 3.36Å; Y419-K587 HydrophobicContact CD1-CG 3.68Å; Y419-K587 HydrophobicContact CD2-CG 4.11Å; Y419-K587 HydrophobicContact CE1-CG 4.2Å; Y419-K587 HydrophobicContact CG-CD 4.45Å; Y419-K587 HydrophobicContact CG-CG 3.66Å
420	Y	92.8	Very high	90.8	Very high	30 Å²	30	60.1 Å²	60.1	12%	0.118	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-64.4	133.6	178	-66.2	-50.7	0	0	0	111.5	E411 P412 E413 A414 Q488 I491 N495 K585	E411-Y420 HydrophobicContact CB-CE1 4.46Å; E411-Y420 PolarHBondContact OE2-OH 3.41Å; P412-Y420 HydrophobicContact CG-CD1 3.77Å; P412-Y420 HydrophobicContact CG-CD2 4.5Å; P412-Y420 HydrophobicContact CG-CE1 4.41Å; P412-Y420 HydrophobicContact CG-CG 3.82Å; P412-Y420 WeakPolarHBondContact O-CD1 3.21Å; E413-Y420 CarbonylContact O-C 3.53Å; E413-Y420 WeakPolarHBondContact O-CA 3.4Å; A414-Y420 HydrophobicContact CB-CD1 4.45Å; Y420-Q488 HydrophobicContact CD2-CB 4.26Å; Y420-Q488 HydrophobicContact CE2-CB 4.07Å; Y420-Q488 HydrophobicContact CE2-CG 3.84Å; Y420-I491 HydrophobicContact CD2-CB 4.39Å; Y420-I491 HydrophobicContact CD2-CD1 4.44Å; Y420-I491 HydrophobicContact CD2-CG2 4.05Å; Y420-N495 VanDerWaalsContact O-CB 3.23Å; Y420-N495 WeakPolarHBondContact O-CB 3.26Å; Y420-N495 PolarHBondContact O-ND2 3.38Å; Y420-K585 HydrophobicContact CD2-CB 3.62Å; Y420-K585 HydrophobicContact CD2-CG 3.92Å; Y420-K585 HydrophobicContact CE2-CB 3.91Å; Y420-K585 HydrophobicContact CE2-CG 3.68Å; Y420-K585 HydrophobicContact CG-CB 4.35Å
421	Q	90.6	Very high	91	Very high	31 Å²	31	56.6 Å²	56.6	15%	0.145	30%	0.299	C	S	.	.			trans	-155.1	147.2	179.8	-161.1	-175.2	-53.1	0	0	109.7	E413 Y419 N496 T499	E413-Q421 PolarHBondContact O-N 2.83Å; Y419-Q421 PolarHBondContact O-N 3.29Å; Q421-N496 WeakPolarHBondContact CG-OD1 3.5Å; Q421-T499 PolarHBondContact OE1-OG1 3.43Å; Q421-T499 VanDerWaalsContact OE1-OG1 3.11Å
422	T	92.4	Very high	91.2	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	28%	0.275	C	S	.	.			trans	-91.7	164.8	169.9	81.9	0	0	0	0	110.8	D402 L424 P425 A492 N496	D402-T422 WeakPolarHBondContact OD1-CB 2.93Å; D402-T422 PolarHBondContact OD1-OG1 3.1Å; T422-L424 PolarHBondContact O-N 3.38Å; T422-L424 WeakPolarHBondContact OG1-CB 3.47Å; T422-L424 PolarHBondContact OG1-N 2.82Å; T422-P425 WeakPolarHBondContact O-CD 3.34Å; T422-A492 HydrophobicContact CG2-CB 3.99Å; T422-N496 PolarHBondContact N-OD1 3.38Å; T422-N496 VanDerWaalsContact N-OD1 3.15Å; T422-N496 PolarHBondContact OG1-ND2 2.71Å
423	T	91.9	Very high	91.3	Very high	57 Å²	57	53.9 Å²	53.9	35%	0.35	29%	0.285	S	S	.	.	S	Bend	trans	-73.7	-8.2	177.7	51.5	0	0	0	0	113.2	A426 I427	T423-A426 PolarHBondContact O-N 3.45Å; T423-I427 WeakPolarHBondContact O-CB 3.26Å; T423-I427 VanDerWaalsContact O-CG1 3.3Å; T423-I427 WeakPolarHBondContact O-CG1 3.25Å; T423-I427 PolarHBondContact O-N 2.97Å; T423-I427 WeakPolarHBondContact OG1-CD1 3.49Å
424	L	94.8	Very high	91.6	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-56.4	-47.7	-172.8	178.1	67.4	0	0	0	113.7	A398 L399 D402 T422 A426 I427 V428 F461 Y465 F500	A398-L424 HydrophobicContact CB-CD1 3.87Å; L399-L424 HydrophobicContact CD1-CD2 4.46Å; D402-L424 HydrophobicContact CB-CB 4.16Å; D402-L424 HydrophobicContact CB-CD1 4.26Å; D402-L424 HydrophobicContact CB-CD2 3.92Å; D402-L424 HydrophobicContact CB-CG 4.34Å; D402-L424 WeakPolarHBondContact OD1-CB 3.37Å; D402-L424 WeakPolarHBondContact OD2-CD2 3.29Å; T422-L424 PolarHBondContact O-N 3.38Å; T422-L424 WeakPolarHBondContact OG1-CB 3.47Å; T422-L424 PolarHBondContact OG1-N 2.82Å; L424-A426 PolarHBondContact O-N 2.7Å; L424-I427 PolarHBondContact O-N 3.02Å; L424-V428 HydrophobicContact CD1-CG2 3.95Å; L424-V428 HydrophobicContact CG-CG2 4.42Å; L424-V428 WeakPolarHBondContact O-CB 3.46Å; L424-V428 VanDerWaalsContact O-CG2 3.3Å; L424-V428 WeakPolarHBondContact O-CG2 3.31Å; L424-V428 PolarHBondContact O-N 3.45Å; L424-F461 HydrophobicContact CD1-CZ 4.08Å; L424-F461 HydrophobicContact CD2-CZ 3.96Å; L424-F461 HydrophobicContact CG-CZ 4.18Å; L424-Y465 HydrophobicContact CD2-CD2 4.13Å; L424-Y465 HydrophobicContact CD2-CE2 3.72Å; L424-F500 HydrophobicContact CD2-CZ 4.16Å; L424-F500 HydrophobicContact CG-CZ 4.06Å
425	P	94.1	Very high	91.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-44.9	176.6	-24	34.6	0	0	0	113.1	T422 V428 F429 N496 T499 F500	T422-P425 WeakPolarHBondContact O-CD 3.34Å; P425-V428 PolarHBondContact O-N 2.91Å; P425-F429 WeakPolarHBondContact O-CD2 3.4Å; P425-F429 PolarHBondContact O-N 2.73Å; P425-F429 VanDerWaalsContact O-N 3.08Å; P425-N496 HydrophobicContact CG-CB 3.94Å; P425-T499 HydrophobicContact CB-CG2 3.76Å; P425-T499 HydrophobicContact CG-CG2 4.28Å; P425-F500 VanDerWaalsContact CA-CE1 3.5Å; P425-F500 HydrophobicContact CB-CD1 3.9Å; P425-F500 HydrophobicContact CB-CE1 3.81Å; P425-F500 HydrophobicContact CB-CG 4.44Å; P425-F500 HydrophobicContact CB-CZ 4.22Å; P425-F500 HydrophobicContact CG-CD1 4.22Å; P425-F500 HydrophobicContact CG-CD2 4.33Å; P425-F500 HydrophobicContact CG-CE1 3.98Å; P425-F500 HydrophobicContact CG-CE2 4.04Å; P425-F500 HydrophobicContact CG-CG 4.42Å; P425-F500 HydrophobicContact CG-CZ 3.87Å
426	A	92.4	Very high	92.1	Very high	62 Å²	62	49.4 Å²	49.4	51%	0.512	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-46.1	-179.9	0	0	0	0	0	111.6	T423 L424 F429 Q430	T423-A426 PolarHBondContact O-N 3.45Å; L424-A426 PolarHBondContact O-N 2.7Å; A426-F429 PolarHBondContact O-N 3.11Å; A426-Q430 VanDerWaalsContact O-CB 3.24Å; A426-Q430 WeakPolarHBondContact O-CB 3.41Å; A426-Q430 PolarHBondContact O-N 3.33Å
427	I	93.9	Very high	92.5	Very high	61 Å²	61	44.2 Å²	44.2	31%	0.313	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-50.7	178.3	-75.1	174	0	0	0	110.4	W394 A398 T423 L424 F429 Q430 M431	W394-I427 HydrophobicContact CH2-CB 4.27Å; W394-I427 HydrophobicContact CH2-CG2 3.09Å; W394-I427 VanDerWaalsContact CH2-O 3.28Å; W394-I427 WeakPolarHBondContact CH2-O 3.39Å; W394-I427 HydrophobicContact CZ2-CG2 3.83Å; W394-I427 HydrophobicContact CZ3-CG2 3.76Å; A398-I427 HydrophobicContact CB-CG2 4.43Å; T423-I427 WeakPolarHBondContact O-CB 3.26Å; T423-I427 VanDerWaalsContact O-CG1 3.3Å; T423-I427 WeakPolarHBondContact O-CG1 3.25Å; T423-I427 PolarHBondContact O-N 2.97Å; T423-I427 WeakPolarHBondContact OG1-CD1 3.49Å; L424-I427 PolarHBondContact O-N 3.02Å; I427-F429 PolarHBondContact O-N 3.15Å; I427-Q430 PolarHBondContact O-N 2.88Å; I427-M431 PolarHBondContact O-N 2.83Å; I427-M431 VanDerWaalsContact O-N 3.13Å
428	V	95.6	Very high	92.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-48.1	179.4	169.3	0	0	0	0	112.1	W394 L395 L424 P425 M431 F432 M458 F461 F500	W394-V428 HydrophobicContact CZ3-CG2 4.47Å; L395-V428 HydrophobicContact CD2-CB 4.38Å; L395-V428 HydrophobicContact CD2-CG1 3.78Å; L395-V428 HydrophobicContact CD2-CG2 3.85Å; L424-V428 HydrophobicContact CD1-CG2 3.95Å; L424-V428 HydrophobicContact CG-CG2 4.42Å; L424-V428 WeakPolarHBondContact O-CB 3.46Å; L424-V428 VanDerWaalsContact O-CG2 3.3Å; L424-V428 WeakPolarHBondContact O-CG2 3.31Å; L424-V428 PolarHBondContact O-N 3.45Å; P425-V428 PolarHBondContact O-N 2.91Å; V428-M431 PolarHBondContact O-N 3.12Å; V428-F432 HydrophobicContact CG1-CD2 4.18Å; V428-F432 HydrophobicContact CG1-CE2 3.73Å; V428-F432 HydrophobicContact CG1-CZ 4.04Å; V428-F432 PolarHBondContact O-N 2.81Å; V428-F432 VanDerWaalsContact O-N 3.09Å; V428-M458 HydrophobicContact CG1-SD 4.11Å; V428-F461 HydrophobicContact CG2-CZ 4.17Å; V428-F500 HydrophobicContact CB-CE1 4.5Å
429	F	94.3	Very high	93.1	Very high	21 Å²	21	39.2 Å²	39.2	9%	0.092	20%	0.2	C	C	.	.	H	α-helix	trans	-74.3	-33.4	-176.1	-85.5	-91.6	0	0	0	113.3	P425 A426 I427 M431 F432 E433 M458 F500 S503 I504 L507	P425-F429 WeakPolarHBondContact O-CD2 3.4Å; P425-F429 PolarHBondContact O-N 2.73Å; P425-F429 VanDerWaalsContact O-N 3.08Å; A426-F429 PolarHBondContact O-N 3.11Å; I427-F429 PolarHBondContact O-N 3.15Å; F429-M431 VanDerWaalsContact C-N 3.3Å; F429-M431 PolarHBondContact O-N 3.28Å; F429-F432 PolarHBondContact O-N 3.27Å; F429-E433 WeakPolarHBondContact O-CB 3.5Å; F429-E433 PolarHBondContact O-N 3Å; F429-M458 HydrophobicContact CE2-CE 4.09Å; F429-M458 HydrophobicContact CZ-CE 4.5Å; F429-F500 HydrophobicContact CD2-CD1 4.45Å; F429-F500 AromaticContact CE2-CD1 3.9Å; F429-F500 HydrophobicContact CE2-CD1 3.9Å; F429-F500 HydrophobicContact CE2-CE1 4.44Å; F429-S503 VanDerWaalsContact CE1-O 3.25Å; F429-S503 WeakPolarHBondContact CE1-O 3.42Å; F429-I504 HydrophobicContact CE1-CG1 4.37Å; F429-I504 HydrophobicContact CE2-CG1 4.48Å; F429-I504 HydrophobicContact CZ-CB 4.38Å; F429-I504 HydrophobicContact CZ-CG1 3.59Å; F429-L507 HydrophobicContact CD1-CB 4.19Å; F429-L507 HydrophobicContact CD1-CD2 4.17Å; F429-L507 HydrophobicContact CE1-CB 3.9Å; F429-L507 HydrophobicContact CE1-CD2 3.81Å; F429-L507 HydrophobicContact CE1-CG 4.38Å
430	Q	94.4	Very high	93	Very high	116 Å²	116	37.6 Å²	37.6	54%	0.542	20%	0.203	S	C	.	.	H	α-helix	trans	-60.6	-42.6	171.6	-175.2	-179.1	9.5	0	0	111.1	A426 I427 E433 Q434	A426-Q430 VanDerWaalsContact O-CB 3.24Å; A426-Q430 WeakPolarHBondContact O-CB 3.41Å; A426-Q430 PolarHBondContact O-N 3.33Å; I427-Q430 PolarHBondContact O-N 2.88Å; Q430-E433 PolarHBondContact O-N 3.47Å; Q430-Q434 WeakPolarHBondContact O-CG 3.43Å; Q430-Q434 PolarHBondContact O-N 3.46Å
431	M	95.3	Very high	92.7	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.059	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-43	177.2	-178.9	-80.8	-67.3	0	0	112	I391 W394 L395 I427 V428 F429 E433 Q434 N435	I391-M431 HydrophobicContact CG1-CE 4.49Å; I391-M431 HydrophobicContact CG1-SD 4.11Å; I391-M431 HydrophobicContact CG2-CE 4.3Å; W394-M431 HydrophobicContact CD2-CE 4.34Å; W394-M431 HydrophobicContact CD2-CG 3.97Å; W394-M431 HydrophobicContact CE3-CB 4.27Å; W394-M431 HydrophobicContact CE3-CE 3.69Å; W394-M431 HydrophobicContact CE3-CG 4.01Å; W394-M431 HydrophobicContact CH2-CB 3.55Å; W394-M431 HydrophobicContact CH2-CG 4.05Å; W394-M431 HydrophobicContact CZ2-CB 3.95Å; W394-M431 HydrophobicContact CZ2-CG 4.12Å; W394-M431 HydrophobicContact CZ3-CB 3.8Å; W394-M431 HydrophobicContact CZ3-CE 3.99Å; W394-M431 HydrophobicContact CZ3-CG 4.06Å; L395-M431 HydrophobicContact CD2-CE 4.02Å; L395-M431 HydrophobicContact CG-CE 4.14Å; I427-M431 PolarHBondContact O-N 2.83Å; I427-M431 VanDerWaalsContact O-N 3.13Å; V428-M431 PolarHBondContact O-N 3.12Å; F429-M431 VanDerWaalsContact C-N 3.3Å; F429-M431 PolarHBondContact O-N 3.28Å; M431-E433 VanDerWaalsContact C-N 3.35Å; M431-E433 PolarHBondContact O-N 2.91Å; M431-Q434 PolarHBondContact O-N 2.88Å; M431-N435 PolarHBondContact O-N 3.11Å; M431-N435 PolarHBondContact O-ND2 2.89Å; M431-N435 PolarHBondContact SD-ND2 2.99Å
432	F	94.8	Very high	92.6	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-43.8	173.5	-70.5	-20	0	0	0	112.1	I391 L395 V428 F429 Q434 N435 L436 C454 M458 L507	I391-F432 HydrophobicContact CG2-CE1 3.98Å; L395-F432 HydrophobicContact CD1-CE1 4.3Å; L395-F432 HydrophobicContact CD1-CZ 4.18Å; L395-F432 HydrophobicContact CD2-CE1 4.4Å; L395-F432 HydrophobicContact CD2-CZ 4.23Å; V428-F432 HydrophobicContact CG1-CD2 4.18Å; V428-F432 HydrophobicContact CG1-CE2 3.73Å; V428-F432 HydrophobicContact CG1-CZ 4.04Å; V428-F432 PolarHBondContact O-N 2.81Å; V428-F432 VanDerWaalsContact O-N 3.09Å; F429-F432 PolarHBondContact O-N 3.27Å; F432-Q434 PolarHBondContact O-N 2.87Å; F432-N435 PolarHBondContact O-N 3.41Å; F432-L436 WeakPolarHBondContact O-CB 3.31Å; F432-L436 VanDerWaalsContact O-CG 3.31Å; F432-L436 WeakPolarHBondContact O-CG 3.16Å; F432-L436 PolarHBondContact O-N 3.07Å; F432-C454 HydrophobicContact CD1-CB 3.81Å; F432-C454 HydrophobicContact CD2-CB 4.2Å; F432-C454 HydrophobicContact CE1-CB 3.95Å; F432-C454 HydrophobicContact CE2-CB 4.32Å; F432-C454 HydrophobicContact CG-CB 3.95Å; F432-C454 HydrophobicContact CZ-CB 4.2Å; F432-M458 HydrophobicContact CE2-CB 4.14Å; F432-M458 HydrophobicContact CE2-CG 4.46Å; F432-M458 HydrophobicContact CE2-SD 4.1Å; F432-M458 HydrophobicContact CZ-CB 4.27Å; F432-M458 HydrophobicContact CZ-SD 4.49Å; F432-L507 HydrophobicContact CB-CD2 4.49Å; F432-L507 HydrophobicContact CD2-CD2 4.32Å
433	E	92.9	Very high	92.3	Very high	60 Å²	60	41.5 Å²	41.5	28%	0.28	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-42.4	-179.6	-176.4	162.2	-154.5	0	0	112.4	F429 Q430 M431 N435 L436 Q437 K510	F429-E433 WeakPolarHBondContact O-CB 3.5Å; F429-E433 PolarHBondContact O-N 3Å; Q430-E433 PolarHBondContact O-N 3.47Å; M431-E433 VanDerWaalsContact C-N 3.35Å; M431-E433 PolarHBondContact O-N 2.91Å; E433-N435 PolarHBondContact O-N 3.35Å; E433-L436 PolarHBondContact O-N 3.16Å; E433-Q437 VanDerWaalsContact O-CG 3.29Å; E433-Q437 WeakPolarHBondContact O-CG 3.45Å; E433-Q437 PolarHBondContact O-N 2.67Å; E433-K510 IonicContact OE1-NZ 3.79Å; E433-K510 PolarHBondContact OE1-NZ 3.37Å
434	Q	93.4	Very high	92	Very high	103 Å²	103	43 Å²	43	48%	0.481	23%	0.228	S	C	.	.	H	α-helix	trans	-59.7	-45.4	175.3	-74	173.3	-9.7	0	0	112	Q430 M431 F432 L436 Q437 V438	Q430-Q434 WeakPolarHBondContact O-CG 3.43Å; Q430-Q434 PolarHBondContact O-N 3.46Å; M431-Q434 PolarHBondContact O-N 2.88Å; F432-Q434 PolarHBondContact O-N 2.87Å; Q434-L436 VanDerWaalsContact C-N 3.34Å; Q434-L436 PolarHBondContact O-N 3.39Å; Q434-Q437 PolarHBondContact O-N 3.41Å; Q434-V438 WeakPolarHBondContact O-CG2 3.38Å; Q434-V438 PolarHBondContact O-N 2.81Å; Q434-V438 VanDerWaalsContact O-N 3.1Å
435	N	92.9	Very high	91.6	Very high	36 Å²	36	47 Å²	47	19%	0.193	25%	0.249	C	C	.	.	H	α-helix	trans	-67.2	-35.3	178.4	-75.4	-74.2	0	0	0	112.5	L387 M431 F432 E433 V438 A439 V450	L387-N435 HydrophobicContact CD1-CB 4.3Å; L387-N435 WeakPolarHBondContact CD1-OD1 3.42Å; M431-N435 PolarHBondContact O-N 3.11Å; M431-N435 PolarHBondContact O-ND2 2.89Å; M431-N435 PolarHBondContact SD-ND2 2.99Å; F432-N435 PolarHBondContact O-N 3.41Å; E433-N435 PolarHBondContact O-N 3.35Å; N435-V438 PolarHBondContact O-N 3.09Å; N435-A439 WeakPolarHBondContact O-CB 3.25Å; N435-A439 PolarHBondContact O-N 3.14Å; N435-V450 HydrophobicContact CB-CG1 4.5Å
436	L	92.7	Very high	91.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.5	-38	174.4	-74.8	165.7	0	0	0	112.4	F432 E433 Q434 A439 A440 K447 V450 L451 L507 Y511	F432-L436 WeakPolarHBondContact O-CB 3.31Å; F432-L436 VanDerWaalsContact O-CG 3.31Å; F432-L436 WeakPolarHBondContact O-CG 3.16Å; F432-L436 PolarHBondContact O-N 3.07Å; E433-L436 PolarHBondContact O-N 3.16Å; Q434-L436 VanDerWaalsContact C-N 3.34Å; Q434-L436 PolarHBondContact O-N 3.39Å; L436-A439 PolarHBondContact O-N 3.42Å; L436-A440 WeakPolarHBondContact O-CB 3.42Å; L436-A440 PolarHBondContact O-N 3Å; L436-K447 HydrophobicContact CD2-CG 4.36Å; L436-K447 WeakPolarHBondContact CD2-O 3.11Å; L436-V450 HydrophobicContact CD2-CB 4.23Å; L436-V450 HydrophobicContact CD2-CG1 3.92Å; L436-V450 HydrophobicContact CG-CG1 4.35Å; L436-L451 HydrophobicContact CD1-CD1 4.03Å; L436-L451 HydrophobicContact CD2-CB 3.78Å; L436-L451 HydrophobicContact CD2-CD1 4.34Å; L436-L507 HydrophobicContact CD1-CD1 3.73Å; L436-L507 HydrophobicContact CD1-CD2 4.48Å; L436-L507 HydrophobicContact CD1-CG 4.33Å; L436-Y511 HydrophobicContact CB-CE1 4.24Å; L436-Y511 HydrophobicContact CD1-CD2 3.91Å; L436-Y511 HydrophobicContact CD1-CE2 4.01Å; L436-Y511 HydrophobicContact CD1-CG 4.28Å
437	Q	91.6	Very high	91.3	Very high	97 Å²	97	45.4 Å²	45.4	45%	0.453	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-44	174.7	-73.6	174	6.3	0	0	111.3	E433 Q434 A440 Q441	E433-Q437 VanDerWaalsContact O-CG 3.29Å; E433-Q437 WeakPolarHBondContact O-CG 3.45Å; E433-Q437 PolarHBondContact O-N 2.67Å; Q434-Q437 PolarHBondContact O-N 3.41Å; Q437-A440 WeakPolarHBondContact O-CB 3.25Å; Q437-A440 PolarHBondContact O-N 2.95Å; Q437-Q441 PolarHBondContact O-N 3.31Å
438	V	91.4	Very high	91	Very high	49 Å²	49	44 Å²	44	30%	0.297	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-44.9	175.1	174.1	0	0	0	0	111	V337 Q434 N435 A440 Q441	V337-V438 HydrophobicContact CB-CG1 4.42Å; V337-V438 HydrophobicContact CG1-CG1 3.77Å; V337-V438 HydrophobicContact CG2-CG1 3.76Å; Q434-V438 WeakPolarHBondContact O-CG2 3.38Å; Q434-V438 PolarHBondContact O-N 2.81Å; Q434-V438 VanDerWaalsContact O-N 3.1Å; N435-V438 PolarHBondContact O-N 3.09Å; V438-A440 VanDerWaalsContact C-N 3.3Å; V438-A440 PolarHBondContact O-N 3.05Å; V438-Q441 WeakPolarHBondContact O-CB 3.35Å; V438-Q441 PolarHBondContact O-N 3.02Å; V438-Q441 VanDerWaalsContact O-N 3.16Å
439	A	91	Very high	90.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-38.4	177.8	0	0	0	0	0	112.6	N435 L436 Q441 I442 S443 L446 K447 V450	N435-A439 WeakPolarHBondContact O-CB 3.25Å; N435-A439 PolarHBondContact O-N 3.14Å; L436-A439 PolarHBondContact O-N 3.42Å; A439-Q441 VanDerWaalsContact C-N 3.25Å; A439-Q441 PolarHBondContact O-N 3.34Å; A439-I442 PolarHBondContact O-N 3.04Å; A439-I442 VanDerWaalsContact O-N 3.12Å; A439-S443 PolarHBondContact O-N 3.31Å; A439-S443 VanDerWaalsContact O-N 3.15Å; A439-L446 HydrophobicContact CB-CD2 4.35Å; A439-L446 HydrophobicContact CB-CG 4.16Å; A439-K447 HydrophobicContact CB-CB 4.39Å; A439-V450 HydrophobicContact CB-CB 4.06Å; A439-V450 HydrophobicContact CB-CG1 4.42Å; A439-V450 HydrophobicContact CB-CG2 3.78Å
440	A	89.6	Confident	90.6	Very high	40 Å²	40	47.6 Å²	47.6	33%	0.331	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-28.3	177.1	0	0	0	0	0	113.3	L436 Q437 V438 I442 K447	L436-A440 WeakPolarHBondContact O-CB 3.42Å; L436-A440 PolarHBondContact O-N 3Å; Q437-A440 WeakPolarHBondContact O-CB 3.25Å; Q437-A440 PolarHBondContact O-N 2.95Å; V438-A440 VanDerWaalsContact C-N 3.3Å; V438-A440 PolarHBondContact O-N 3.05Å; A440-I442 PolarHBondContact O-N 3.45Å; A440-K447 HydrophobicContact CB-CB 4.48Å; A440-K447 HydrophobicContact CB-CD 3.69Å; A440-K447 HydrophobicContact CB-CG 4.21Å
441	Q	87.1	Confident	90.4	Very high	117 Å²	117	42.1 Å²	42.1	55%	0.547	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-15.1	175.5	-68	176.4	-4.9	0	0	113.5	T341 N345 Q437 V438 A439	T341-Q441 PolarHBondContact OG1-O 3.42Å; N345-Q441 PolarHBondContact ND2-O 3.25Å; Q437-Q441 PolarHBondContact O-N 3.31Å; V438-Q441 WeakPolarHBondContact O-CB 3.35Å; V438-Q441 PolarHBondContact O-N 3.02Å; V438-Q441 VanDerWaalsContact O-N 3.16Å; A439-Q441 VanDerWaalsContact C-N 3.25Å; A439-Q441 PolarHBondContact O-N 3.34Å
442	I	87.4	Confident	90.1	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-61.1	178	-58.8	167.2	0	0	0	109.2	V337 L340 T341 L344 N345 A439 A440 L446	V337-I442 HydrophobicContact CB-CD1 4.08Å; V337-I442 HydrophobicContact CG1-CD1 3.97Å; V337-I442 HydrophobicContact CG1-CG1 4.14Å; V337-I442 HydrophobicContact CG2-CD1 3.77Å; L340-I442 HydrophobicContact CB-CG2 3.86Å; L340-I442 HydrophobicContact CD1-CG2 4.38Å; T341-I442 WeakPolarHBondContact OG1-CG1 3.49Å; L344-I442 HydrophobicContact CD1-CG2 4.12Å; N345-I442 PolarHBondContact ND2-O 2.94Å; A439-I442 PolarHBondContact O-N 3.04Å; A439-I442 VanDerWaalsContact O-N 3.12Å; A440-I442 PolarHBondContact O-N 3.45Å; I442-L446 HydrophobicContact CB-CD2 3.95Å; I442-L446 HydrophobicContact CD1-CD2 3.58Å; I442-L446 HydrophobicContact CG1-CD2 4.36Å; I442-L446 HydrophobicContact CG2-CD2 4.1Å
443	S	87.1	Confident	90	Very high	34 Å²	34	45.4 Å²	45.4	24%	0.238	23%	0.233	C	C	.	.			trans	-160.5	153.2	177.8	74	0	0	0	0	112.9	A439 D445 L446 K447	A439-S443 PolarHBondContact O-N 3.31Å; A439-S443 VanDerWaalsContact O-N 3.15Å; S443-D445 VanDerWaalsContact C-N 3.3Å; S443-D445 PolarHBondContact O-N 3.4Å; S443-L446 PolarHBondContact O-N 3.28Å; S443-L446 VanDerWaalsContact OG-CB 3.26Å; S443-L446 WeakPolarHBondContact OG-CB 3.44Å; S443-L446 PolarHBondContact OG-N 3.21Å; S443-L446 VanDerWaalsContact OG-N 3.1Å; S443-K447 PolarHBondContact O-N 2.99Å
444	E	86.4	Confident	89.9	Confident	90 Å²	90	42.6 Å²	42.6	42%	0.421	22%	0.219	S	C	.	.	H	α-helix	trans	-64.1	-33.3	175.3	-76.8	-68.7	119.1	0	0	113	K447 T448	E444-K447 IonicContact OE1-NZ 2.85Å; E444-K447 PolarHBondContact OE1-NZ 3.12Å; E444-K447 WeakPolarHBondContact OE2-CE 3.45Å; E444-K447 IonicContact OE2-NZ 3.66Å; E444-K447 PolarHBondContact OE2-NZ 3.42Å; E444-T448 PolarHBondContact O-N 3.26Å; E444-T448 PolarHBondContact O-OG1 2.97Å
445	D	86.6	Confident	89.8	Confident	86 Å²	86	37.9 Å²	37.9	46%	0.46	20%	0.197	S	C	.	.	H	α-helix	trans	-66.9	-45	175.5	176.7	68.4	0	0	0	111.3	S443 K447 T448 K449	S443-D445 VanDerWaalsContact C-N 3.3Å; S443-D445 PolarHBondContact O-N 3.4Å; D445-K447 VanDerWaalsContact C-N 3.35Å; D445-K447 PolarHBondContact O-N 3.31Å; D445-T448 WeakPolarHBondContact O-CB 3.46Å; D445-T448 PolarHBondContact O-N 3.46Å; D445-T448 VanDerWaalsContact O-N 3.16Å; D445-K449 PolarHBondContact O-N 3.47Å; D445-K449 IonicContact OD1-NZ 3.89Å; D445-K449 WeakPolarHBondContact OD2-CE 3.29Å; D445-K449 IonicContact OD2-NZ 3.81Å; D445-K449 PolarHBondContact OD2-NZ 3.06Å
446	L	88.4	Confident	89.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-42.5	176.9	-177.3	63.3	0	0	0	111.4	L380 Y383 M384 A439 I442 S443 T448 K449 V450	L380-L446 HydrophobicContact CD2-CD1 4.01Å; L380-L446 HydrophobicContact CD2-CD2 3.72Å; L380-L446 HydrophobicContact CD2-CG 4.34Å; Y383-L446 HydrophobicContact CD1-CD1 4.44Å; Y383-L446 HydrophobicContact CD1-CD2 4.32Å; Y383-L446 HydrophobicContact CE1-CD1 4.48Å; Y383-L446 HydrophobicContact CE1-CD2 4.08Å; M384-L446 HydrophobicContact CG-CD1 4.14Å; M384-L446 HydrophobicContact SD-CD1 3.67Å; A439-L446 HydrophobicContact CB-CD2 4.35Å; A439-L446 HydrophobicContact CB-CG 4.16Å; I442-L446 HydrophobicContact CB-CD2 3.95Å; I442-L446 HydrophobicContact CD1-CD2 3.58Å; I442-L446 HydrophobicContact CG1-CD2 4.36Å; I442-L446 HydrophobicContact CG2-CD2 4.1Å; S443-L446 PolarHBondContact O-N 3.28Å; S443-L446 VanDerWaalsContact OG-CB 3.26Å; S443-L446 WeakPolarHBondContact OG-CB 3.44Å; S443-L446 PolarHBondContact OG-N 3.21Å; S443-L446 VanDerWaalsContact OG-N 3.1Å; L446-T448 PolarHBondContact O-N 2.75Å; L446-K449 PolarHBondContact O-N 3.26Å; L446-K449 VanDerWaalsContact O-N 3.12Å; L446-V450 HydrophobicContact CD1-CG2 4.19Å; L446-V450 HydrophobicContact CG-CG2 4.23Å; L446-V450 WeakPolarHBondContact O-CG2 3.43Å; L446-V450 PolarHBondContact O-N 3.35Å
447	K	90.4	Very high	89.7	Confident	28 Å²	28	43.2 Å²	43.2	12%	0.122	22%	0.221	C	C	.	.	H	α-helix	trans	-52.6	-43.9	174.1	-175.2	-175.5	73.7	-172.6	0	111.6	L436 A439 A440 S443 E444 D445 V450 L451 Y511	L436-K447 HydrophobicContact CD2-CG 4.36Å; L436-K447 WeakPolarHBondContact CD2-O 3.11Å; A439-K447 HydrophobicContact CB-CB 4.39Å; A440-K447 HydrophobicContact CB-CB 4.48Å; A440-K447 HydrophobicContact CB-CD 3.69Å; A440-K447 HydrophobicContact CB-CG 4.21Å; S443-K447 PolarHBondContact O-N 2.99Å; E444-K447 IonicContact OE1-NZ 2.85Å; E444-K447 PolarHBondContact OE1-NZ 3.12Å; E444-K447 WeakPolarHBondContact OE2-CE 3.45Å; E444-K447 IonicContact OE2-NZ 3.66Å; E444-K447 PolarHBondContact OE2-NZ 3.42Å; D445-K447 VanDerWaalsContact C-N 3.35Å; D445-K447 PolarHBondContact O-N 3.31Å; K447-V450 PolarHBondContact O-N 3.47Å; K447-L451 WeakPolarHBondContact O-CB 3.42Å; K447-L451 PolarHBondContact O-N 3.43Å; K447-Y511 HydrophobicContact CD-CD1 4.03Å; K447-Y511 HydrophobicContact CD-CE1 4.48Å; K447-Y511 HydrophobicContact CG-CD1 4.43Å
448	T	88.1	Confident	89.8	Confident	32 Å²	32	38.6 Å²	38.6	20%	0.196	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-44.6	178	-53.4	0	0	0	0	111.5	E444 D445 L446 V450 L451 L452 M516	E444-T448 PolarHBondContact O-N 3.26Å; E444-T448 PolarHBondContact O-OG1 2.97Å; D445-T448 WeakPolarHBondContact O-CB 3.46Å; D445-T448 PolarHBondContact O-N 3.46Å; D445-T448 VanDerWaalsContact O-N 3.16Å; L446-T448 PolarHBondContact O-N 2.75Å; T448-V450 PolarHBondContact O-N 3.37Å; T448-L451 WeakPolarHBondContact O-CB 3.39Å; T448-L451 PolarHBondContact O-N 2.94Å; T448-L452 WeakPolarHBondContact O-CG 3.45Å; T448-L452 PolarHBondContact O-N 2.85Å; T448-L452 VanDerWaalsContact O-N 3.07Å; T448-M516 HydrophobicContact CG2-CE 3.62Å; T448-M516 HydrophobicContact CG2-SD 3.6Å
449	K	89.1	Confident	89.8	Confident	95 Å²	95	38 Å²	38	41%	0.413	20%	0.195	S	C	.	.	H	α-helix	trans	-61.7	-41.2	175.8	-71.8	170.9	175.8	163.5	0	112.7	M384 D445 L446 L452 L453	M384-K449 HydrophobicContact CE-CB 4.19Å; D445-K449 PolarHBondContact O-N 3.47Å; D445-K449 IonicContact OD1-NZ 3.89Å; D445-K449 WeakPolarHBondContact OD2-CE 3.29Å; D445-K449 IonicContact OD2-NZ 3.81Å; D445-K449 PolarHBondContact OD2-NZ 3.06Å; L446-K449 PolarHBondContact O-N 3.26Å; L446-K449 VanDerWaalsContact O-N 3.12Å; K449-L452 PolarHBondContact O-N 3.15Å; K449-L453 WeakPolarHBondContact O-CB 3.34Å; K449-L453 PolarHBondContact O-N 2.63Å
450	V	92	Very high	89.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-37.9	176.6	171.8	0	0	0	0	111.2	M384 L387 N435 L436 A439 L446 K447 T448 L453 C454	M384-V450 HydrophobicContact CE-CG2 4.3Å; M384-V450 HydrophobicContact SD-CG2 3.68Å; L387-V450 HydrophobicContact CD2-CB 4.48Å; L387-V450 HydrophobicContact CD2-CG1 3.99Å; L387-V450 HydrophobicContact CD2-CG2 3.72Å; N435-V450 HydrophobicContact CB-CG1 4.5Å; L436-V450 HydrophobicContact CD2-CB 4.23Å; L436-V450 HydrophobicContact CD2-CG1 3.92Å; L436-V450 HydrophobicContact CG-CG1 4.35Å; A439-V450 HydrophobicContact CB-CB 4.06Å; A439-V450 HydrophobicContact CB-CG1 4.42Å; A439-V450 HydrophobicContact CB-CG2 3.78Å; L446-V450 HydrophobicContact CD1-CG2 4.19Å; L446-V450 HydrophobicContact CG-CG2 4.23Å; L446-V450 WeakPolarHBondContact O-CG2 3.43Å; L446-V450 PolarHBondContact O-N 3.35Å; K447-V450 PolarHBondContact O-N 3.47Å; T448-V450 PolarHBondContact O-N 3.37Å; V450-L453 WeakPolarHBondContact O-CB 3.05Å; V450-L453 PolarHBondContact O-N 2.88Å; V450-C454 PolarHBondContact O-N 3.48Å; V450-C454 PolarHBondContact O-SG 2.87Å
451	L	91	Very high	90.2	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-48.3	174.8	-178.4	61.7	0	0	0	111.7	L436 K447 T448 L453 C454 L455 L507 L512	L436-L451 HydrophobicContact CD1-CD1 4.03Å; L436-L451 HydrophobicContact CD2-CB 3.78Å; L436-L451 HydrophobicContact CD2-CD1 4.34Å; K447-L451 WeakPolarHBondContact O-CB 3.42Å; K447-L451 PolarHBondContact O-N 3.43Å; T448-L451 WeakPolarHBondContact O-CB 3.39Å; T448-L451 PolarHBondContact O-N 2.94Å; L451-L453 VanDerWaalsContact C-N 3.29Å; L451-L453 PolarHBondContact O-N 3.36Å; L451-C454 PolarHBondContact O-N 3.06Å; L451-L455 HydrophobicContact CD1-CD1 4.32Å; L451-L455 HydrophobicContact CD1-CG 4.45Å; L451-L455 HydrophobicContact CG-CD1 4.12Å; L451-L455 VanDerWaalsContact O-CG 3.26Å; L451-L455 WeakPolarHBondContact O-CG 3.32Å; L451-L455 PolarHBondContact O-N 3.34Å; L451-L507 HydrophobicContact CD1-CD2 3.99Å; L451-L507 HydrophobicContact CD1-CG 4.05Å; L451-L512 HydrophobicContact CD2-CD1 3.56Å; L451-L512 HydrophobicContact CD2-CG 4.22Å; L451-L512 HydrophobicContact CG-CD1 4.42Å
452	L	89	Confident	90.6	Very high	67 Å²	67	33 Å²	33	35%	0.351	17%	0.17	S	C	.	.	H	α-helix	trans	-57.7	-44.3	176	-68.3	175.1	0	0	0	111.3	T448 K449 L455 Q456 M516 L520	T448-L452 WeakPolarHBondContact O-CG 3.45Å; T448-L452 PolarHBondContact O-N 2.85Å; T448-L452 VanDerWaalsContact O-N 3.07Å; K449-L452 PolarHBondContact O-N 3.15Å; L452-L455 PolarHBondContact O-N 3Å; L452-Q456 WeakPolarHBondContact O-CB 3.26Å; L452-Q456 PolarHBondContact O-N 2.97Å; L452-M516 HydrophobicContact CD1-CE 4.48Å; L452-L520 HydrophobicContact CD2-CD1 3.71Å; L452-L520 HydrophobicContact CD2-CD2 3.64Å; L452-L520 HydrophobicContact CD2-CG 3.96Å
453	L	91.2	Very high	90.9	Very high	15 Å²	15	35.9 Å²	35.9	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-49.1	175.4	177.6	67.9	0	0	0	111.7	M384 L387 T388 I391 K449 V450 L451 L455 Q456 Q457	M384-L453 HydrophobicContact CE-CB 4.18Å; M384-L453 HydrophobicContact CE-CD2 3.84Å; L387-L453 HydrophobicContact CD2-CD2 4.26Å; L387-L453 HydrophobicContact CG-CD2 4.27Å; T388-L453 HydrophobicContact CG2-CD1 3.97Å; T388-L453 WeakPolarHBondContact OG1-CD1 3.46Å; T388-L453 VanDerWaalsContact OG1-CD2 3.27Å; T388-L453 WeakPolarHBondContact OG1-CD2 3.27Å; I391-L453 HydrophobicContact CD1-CD2 4.3Å; K449-L453 WeakPolarHBondContact O-CB 3.34Å; K449-L453 PolarHBondContact O-N 2.63Å; V450-L453 WeakPolarHBondContact O-CB 3.05Å; V450-L453 PolarHBondContact O-N 2.88Å; L451-L453 VanDerWaalsContact C-N 3.29Å; L451-L453 PolarHBondContact O-N 3.36Å; L453-L455 VanDerWaalsContact C-N 3.3Å; L453-L455 PolarHBondContact O-N 3.41Å; L453-Q456 PolarHBondContact O-N 2.83Å; L453-Q457 HydrophobicContact CD1-CG 4.17Å; L453-Q457 HydrophobicContact CG-CG 4.42Å; L453-Q457 WeakPolarHBondContact O-CG 3.35Å; L453-Q457 PolarHBondContact O-N 2.83Å
454	C	92.5	Very high	91.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-43.3	179.9	-67.7	0	0	0	0	111.4	F432 V450 L451 Q457 M458	F432-C454 HydrophobicContact CD1-CB 3.81Å; F432-C454 HydrophobicContact CD2-CB 4.2Å; F432-C454 HydrophobicContact CE1-CB 3.95Å; F432-C454 HydrophobicContact CE2-CB 4.32Å; F432-C454 HydrophobicContact CG-CB 3.95Å; F432-C454 HydrophobicContact CZ-CB 4.2Å; V450-C454 PolarHBondContact O-N 3.48Å; V450-C454 PolarHBondContact O-SG 2.87Å; L451-C454 PolarHBondContact O-N 3.06Å; C454-Q457 PolarHBondContact O-N 3.1Å; C454-M458 VanDerWaalsContact O-CB 3.31Å; C454-M458 WeakPolarHBondContact O-CB 3.49Å; C454-M458 PolarHBondContact O-N 3.48Å
455	L	90.6	Very high	91.8	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-40	178.1	-65	168.5	0	0	0	112.4	L451 L452 L453 M458 N459 I504 K508 L520 M527	L451-L455 HydrophobicContact CD1-CD1 4.32Å; L451-L455 HydrophobicContact CD1-CG 4.45Å; L451-L455 HydrophobicContact CG-CD1 4.12Å; L451-L455 VanDerWaalsContact O-CG 3.26Å; L451-L455 WeakPolarHBondContact O-CG 3.32Å; L451-L455 PolarHBondContact O-N 3.34Å; L452-L455 PolarHBondContact O-N 3Å; L453-L455 VanDerWaalsContact C-N 3.3Å; L453-L455 PolarHBondContact O-N 3.41Å; L455-M458 WeakPolarHBondContact O-CB 3.47Å; L455-M458 PolarHBondContact O-N 3.29Å; L455-N459 PolarHBondContact O-N 2.93Å; L455-N459 VanDerWaalsContact O-N 3.07Å; L455-I504 HydrophobicContact CD2-CG2 4.44Å; L455-K508 HydrophobicContact CD1-CD 4.31Å; L455-K508 HydrophobicContact CD1-CG 4.26Å; L455-K508 HydrophobicContact CD2-CD 4.35Å; L455-K508 HydrophobicContact CD2-CG 4.32Å; L455-L520 HydrophobicContact CD1-CD2 4.05Å; L455-M527 HydrophobicContact CD2-CE 4.46Å
456	Q	90.4	Very high	92.2	Very high	129 Å²	129	31.1 Å²	31.1	60%	0.603	16%	0.156	S	C	*	.	H	α-helix	trans	-62.8	-44.9	174.3	-175.8	-177.5	-2.3	0	0	111.4	L452 L453 M458 N459 S460	L452-Q456 WeakPolarHBondContact O-CB 3.26Å; L452-Q456 PolarHBondContact O-N 2.97Å; L453-Q456 PolarHBondContact O-N 2.83Å; Q456-M458 VanDerWaalsContact C-N 3.33Å; Q456-N459 PolarHBondContact O-N 3.48Å; Q456-S460 PolarHBondContact O-N 3.08Å
457	Q	93	Very high	92.6	Very high	19 Å²	19	34.9 Å²	34.9	9%	0.089	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-33.9	177.4	-62.5	-45.6	-44.3	0	0	112.1	I391 I392 L395 L453 C454 N459 S460 F461	I391-Q457 HydrophobicContact CG2-CB 3.86Å; I391-Q457 HydrophobicContact CG2-CG 3.94Å; I392-Q457 HydrophobicContact CG1-CG 4.38Å; L395-Q457 HydrophobicContact CD1-CB 4Å; L453-Q457 HydrophobicContact CD1-CG 4.17Å; L453-Q457 HydrophobicContact CG-CG 4.42Å; L453-Q457 WeakPolarHBondContact O-CG 3.35Å; L453-Q457 PolarHBondContact O-N 2.83Å; C454-Q457 PolarHBondContact O-N 3.1Å; Q457-N459 VanDerWaalsContact C-N 3.34Å; Q457-N459 PolarHBondContact O-N 2.86Å; Q457-S460 PolarHBondContact O-N 3.45Å; Q457-F461 WeakPolarHBondContact O-CB 3.35Å; Q457-F461 PolarHBondContact O-N 3.3Å
458	M	93.7	Very high	92.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-59.6	-44.2	173.2	-173	61.2	-176.8	0	0	111.1	V428 F429 F432 C454 L455 Q456 S460 F461 L462 F500 I504 M527	V428-M458 HydrophobicContact CG1-SD 4.11Å; F429-M458 HydrophobicContact CE2-CE 4.09Å; F429-M458 HydrophobicContact CZ-CE 4.5Å; F432-M458 HydrophobicContact CE2-CB 4.14Å; F432-M458 HydrophobicContact CE2-CG 4.46Å; F432-M458 HydrophobicContact CE2-SD 4.1Å; F432-M458 HydrophobicContact CZ-CB 4.27Å; F432-M458 HydrophobicContact CZ-SD 4.49Å; C454-M458 VanDerWaalsContact O-CB 3.31Å; C454-M458 WeakPolarHBondContact O-CB 3.49Å; C454-M458 PolarHBondContact O-N 3.48Å; L455-M458 WeakPolarHBondContact O-CB 3.47Å; L455-M458 PolarHBondContact O-N 3.29Å; Q456-M458 VanDerWaalsContact C-N 3.33Å; M458-S460 PolarHBondContact O-N 2.9Å; M458-F461 HydrophobicContact CE-CD1 4.21Å; M458-F461 HydrophobicContact CE-CE1 4.36Å; M458-F461 WeakPolarHBondContact O-CB 3.23Å; M458-F461 PolarHBondContact O-N 3.2Å; M458-F461 VanDerWaalsContact O-N 3.15Å; M458-F461 HydrophobicContact SD-CD1 3.84Å; M458-F461 HydrophobicContact SD-CE1 4.39Å; M458-L462 HydrophobicContact CE-CD1 4.12Å; M458-L462 HydrophobicContact CE-CD2 3.67Å; M458-L462 HydrophobicContact CE-CG 3.88Å; M458-L462 HydrophobicContact CG-CD1 4.3Å; M458-L462 HydrophobicContact CG-CG 4.4Å; M458-L462 WeakPolarHBondContact O-CG 3.38Å; M458-L462 PolarHBondContact O-N 3.33Å; M458-L462 HydrophobicContact SD-CG 4.46Å; M458-F500 HydrophobicContact CE-CB 4.3Å; M458-F500 HydrophobicContact CE-CD1 3.37Å; M458-F500 HydrophobicContact CE-CE1 3.68Å; M458-F500 HydrophobicContact CE-CG 3.92Å; M458-F500 HydrophobicContact CE-CZ 4.49Å; M458-I504 HydrophobicContact CE-CD1 4.33Å; M458-I504 HydrophobicContact CG-CD1 4.36Å; M458-M527 HydrophobicContact CB-SD 4.33Å; M458-M527 HydrophobicContact CG-SD 4.21Å
459	N	91.5	Very high	93.2	Very high	36 Å²	36	34.9 Å²	34.9	19%	0.193	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-45.8	177.2	-166.7	50.2	0	0	0	112.1	L455 Q456 Q457 F461 L462 T463 N526 M527	L455-N459 PolarHBondContact O-N 2.93Å; L455-N459 VanDerWaalsContact O-N 3.07Å; Q456-N459 PolarHBondContact O-N 3.48Å; Q457-N459 VanDerWaalsContact C-N 3.34Å; Q457-N459 PolarHBondContact O-N 2.86Å; N459-F461 VanDerWaalsContact C-N 3.31Å; N459-F461 PolarHBondContact O-N 3.46Å; N459-L462 PolarHBondContact O-N 3.15Å; N459-T463 PolarHBondContact O-N 3.5Å; N459-T463 PolarHBondContact O-OG1 3.3Å; N459-N526 PolarHBondContact ND2-ND2 3.3Å; N459-M527 HydrophobicContact CB-CG 4.05Å; N459-M527 HydrophobicContact CB-SD 4.35Å; N459-M527 WeakPolarHBondContact OD1-CG 3.07Å
460	S	92.3	Very high	93.5	Very high	51 Å²	51	34.2 Å²	34.2	36%	0.357	17%	0.174	S	C	.	.	H	α-helix	trans	-64.6	-34.2	175.5	174.5	0	0	0	0	113.2	Q456 Q457 M458 R464	Q456-S460 PolarHBondContact O-N 3.08Å; Q457-S460 PolarHBondContact O-N 3.45Å; M458-S460 PolarHBondContact O-N 2.9Å; S460-R464 PolarHBondContact O-N 2.8Å; S460-R464 PolarHBondContact O-NE 2.69Å; S460-R464 PolarHBondContact OG-NH2 2.98Å
461	F	95.8	Very high	93.6	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-67.8	-43.3	175.1	165.6	-92.7	0	0	0	111.5	L395 L399 L424 V428 Q457 M458 N459 T463 R464 Y465 F500	L395-F461 HydrophobicContact CB-CD2 3.94Å; L395-F461 HydrophobicContact CD1-CB 4.19Å; L395-F461 HydrophobicContact CD2-CD2 4.17Å; L395-F461 HydrophobicContact CD2-CE2 4.44Å; L395-F461 HydrophobicContact CD2-CG 4.42Å; L395-F461 HydrophobicContact CG-CD2 4.5Å; L399-F461 HydrophobicContact CB-CE2 3.96Å; L424-F461 HydrophobicContact CD1-CZ 4.08Å; L424-F461 HydrophobicContact CD2-CZ 3.96Å; L424-F461 HydrophobicContact CG-CZ 4.18Å; V428-F461 HydrophobicContact CG2-CZ 4.17Å; Q457-F461 WeakPolarHBondContact O-CB 3.35Å; Q457-F461 PolarHBondContact O-N 3.3Å; M458-F461 HydrophobicContact CE-CD1 4.21Å; M458-F461 HydrophobicContact CE-CE1 4.36Å; M458-F461 WeakPolarHBondContact O-CB 3.23Å; M458-F461 PolarHBondContact O-N 3.2Å; M458-F461 VanDerWaalsContact O-N 3.15Å; M458-F461 HydrophobicContact SD-CD1 3.84Å; M458-F461 HydrophobicContact SD-CE1 4.39Å; N459-F461 VanDerWaalsContact C-N 3.31Å; N459-F461 PolarHBondContact O-N 3.46Å; F461-T463 VanDerWaalsContact C-N 3.33Å; F461-T463 PolarHBondContact O-N 3.11Å; F461-R464 WeakPolarHBondContact O-CB 3.37Å; F461-R464 PolarHBondContact O-N 2.77Å; F461-R464 VanDerWaalsContact O-N 3.12Å; F461-Y465 WeakPolarHBondContact O-CB 3.43Å; F461-Y465 PolarHBondContact O-N 3.06Å; F461-F500 HydrophobicContact CE1-CE1 4.22Å; F461-F500 HydrophobicContact CE1-CE2 4.46Å; F461-F500 AromaticContact CE1-CZ 3.81Å; F461-F500 HydrophobicContact CE1-CZ 3.81Å; F461-F500 HydrophobicContact CZ-CZ 4.25Å
462	L	95.5	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-36.4	179.3	-71.3	178.1	0	0	0	112.8	M458 N459 Y465 K466 F500 I504 M527 I530 L531	M458-L462 HydrophobicContact CE-CD1 4.12Å; M458-L462 HydrophobicContact CE-CD2 3.67Å; M458-L462 HydrophobicContact CE-CG 3.88Å; M458-L462 HydrophobicContact CG-CD1 4.3Å; M458-L462 HydrophobicContact CG-CG 4.4Å; M458-L462 WeakPolarHBondContact O-CG 3.38Å; M458-L462 PolarHBondContact O-N 3.33Å; M458-L462 HydrophobicContact SD-CG 4.46Å; N459-L462 PolarHBondContact O-N 3.15Å; L462-Y465 PolarHBondContact O-N 3.39Å; L462-K466 PolarHBondContact O-N 3.06Å; L462-F500 HydrophobicContact CD2-CD2 4.39Å; L462-I504 HydrophobicContact CD1-CD1 4.5Å; L462-M527 HydrophobicContact CD1-CB 4.04Å; L462-M527 HydrophobicContact CD1-CG 4.06Å; L462-I530 HydrophobicContact CB-CG2 3.99Å; L462-L531 HydrophobicContact CD1-CD1 4.05Å; L462-L531 HydrophobicContact CD1-CD2 4.2Å; L462-L531 HydrophobicContact CD1-CG 3.93Å; L462-L531 HydrophobicContact CD2-CD2 3.49Å; L462-L531 VanDerWaalsContact CD2-CD2 3.49Å; L462-L531 HydrophobicContact CD2-CG 4.18Å; L462-L531 HydrophobicContact CG-CD2 4.42Å
463	T	94.1	Very high	94	Very high	62 Å²	62	37.2 Å²	37.2	38%	0.38	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-45.9	171.3	-51.6	0	0	0	0	111.4	N459 F461 Y465 K466 D467	N459-T463 PolarHBondContact O-N 3.5Å; N459-T463 PolarHBondContact O-OG1 3.3Å; F461-T463 VanDerWaalsContact C-N 3.33Å; F461-T463 PolarHBondContact O-N 3.11Å; T463-Y465 PolarHBondContact O-N 3Å; T463-K466 WeakPolarHBondContact O-CB 3.27Å; T463-K466 PolarHBondContact O-N 3.25Å; T463-D467 PolarHBondContact O-N 2.8Å; T463-D467 VanDerWaalsContact O-N 3.15Å
464	R	95.4	Very high	94.1	Very high	62 Å²	62	40.6 Å²	40.6	23%	0.234	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-38.9	176.4	-73.7	174.9	-86.4	171.7	-10.6	112.4	L399 S460 F461 K466 D467 E468	L399-R464 HydrophobicContact CD2-CB 4.12Å; S460-R464 PolarHBondContact O-N 2.8Å; S460-R464 PolarHBondContact O-NE 2.69Å; S460-R464 PolarHBondContact OG-NH2 2.98Å; F461-R464 WeakPolarHBondContact O-CB 3.37Å; F461-R464 PolarHBondContact O-N 2.77Å; F461-R464 VanDerWaalsContact O-N 3.12Å; R464-K466 VanDerWaalsContact C-N 3.28Å; R464-K466 PolarHBondContact O-N 3.24Å; R464-D467 PolarHBondContact O-N 2.79Å; R464-E468 WeakPolarHBondContact O-CG 3.34Å; R464-E468 PolarHBondContact O-N 3.24Å
465	Y	96.7	Very high	94	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-39.6	175.9	-174.8	-117.2	0	0	0	111.4	L399 W406 L424 F461 L462 T463 A469 I493 N496 F500 I534	L399-Y465 HydrophobicContact CD1-CD2 3.63Å; L399-Y465 HydrophobicContact CD1-CE2 4.31Å; W406-Y465 HydrophobicContact CH2-CD2 4.48Å; W406-Y465 HydrophobicContact CH2-CE2 4.19Å; W406-Y465 HydrophobicContact CZ2-CD2 4.44Å; W406-Y465 AromaticContact CZ2-CE2 3.79Å; W406-Y465 HydrophobicContact CZ2-CE2 3.79Å; L424-Y465 HydrophobicContact CD2-CD2 4.13Å; L424-Y465 HydrophobicContact CD2-CE2 3.72Å; F461-Y465 WeakPolarHBondContact O-CB 3.43Å; F461-Y465 PolarHBondContact O-N 3.06Å; L462-Y465 PolarHBondContact O-N 3.39Å; T463-Y465 PolarHBondContact O-N 3Å; Y465-A469 WeakPolarHBondContact O-CB 3.1Å; Y465-A469 PolarHBondContact O-N 3.42Å; Y465-I493 HydrophobicContact CE1-CG2 4.24Å; Y465-I493 WeakPolarHBondContact OH-CA 3.38Å; Y465-N496 PolarHBondContact OH-ND2 3.31Å; Y465-F500 HydrophobicContact CD1-CE2 4.47Å; Y465-F500 HydrophobicContact CE1-CE2 4.16Å; Y465-I534 HydrophobicContact CD1-CD1 3.75Å; Y465-I534 HydrophobicContact CE1-CD1 4.46Å; Y465-I534 HydrophobicContact CE1-CG2 4.38Å
466	K	96.1	Very high	94.1	Very high	48 Å²	48	45.9 Å²	45.9	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-53.7	171.7	-178	-176.4	178	179.9	0	111.4	L462 T463 R464 E468 A469 Q470 I533 I534 E537	L462-K466 PolarHBondContact O-N 3.06Å; T463-K466 WeakPolarHBondContact O-CB 3.27Å; T463-K466 PolarHBondContact O-N 3.25Å; R464-K466 VanDerWaalsContact C-N 3.28Å; R464-K466 PolarHBondContact O-N 3.24Å; K466-E468 VanDerWaalsContact C-N 3.29Å; K466-E468 PolarHBondContact O-N 3.44Å; K466-A469 PolarHBondContact O-N 2.79Å; K466-Q470 PolarHBondContact O-N 3.2Å; K466-I533 HydrophobicContact CD-CG2 4.22Å; K466-I533 VanDerWaalsContact NZ-CG2 3.29Å; K466-I534 HydrophobicContact CB-CD1 3.73Å; K466-I534 HydrophobicContact CB-CG1 3.62Å; K466-I534 HydrophobicContact CG-CD1 4.46Å; K466-I534 HydrophobicContact CG-CG1 3.79Å; K466-E537 VanDerWaalsContact CE-OE1 3.29Å; K466-E537 WeakPolarHBondContact CE-OE1 3.32Å; K466-E537 WeakPolarHBondContact CE-OE2 3.49Å; K466-E537 IonicContact NZ-OE1 3.24Å; K466-E537 PolarHBondContact NZ-OE1 3.49Å; K466-E537 IonicContact NZ-OE2 3.17Å
467	D	95.8	Very high	94.1	Very high	80 Å²	80	43.3 Å²	43.3	43%	0.428	22%	0.217	S	C	.	.	H	α-helix	trans	-60.3	-40.9	-176.1	-60.9	-24.9	0	0	0	111.2	T463 R464 Q470 L471	T463-D467 PolarHBondContact O-N 2.8Å; T463-D467 VanDerWaalsContact O-N 3.15Å; R464-D467 PolarHBondContact O-N 2.79Å; D467-Q470 PolarHBondContact O-N 3.09Å; D467-L471 WeakPolarHBondContact O-CG 3.4Å; D467-L471 PolarHBondContact O-N 2.87Å
468	E	96.3	Very high	94	Very high	50 Å²	50	49.4 Å²	49.4	23%	0.234	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-38.6	176.7	-66.8	-62.8	160.5	0	0	112.8	L399 K403 W406 R464 K466 Q470 L471 Y472	L399-E468 HydrophobicContact CD2-CG 4.06Å; L399-E468 HydrophobicContact CG-CG 4.45Å; K403-E468 WeakPolarHBondContact CD-OE2 3.45Å; K403-E468 WeakPolarHBondContact CE-OE2 3.49Å; K403-E468 IonicContact NZ-OE2 2.59Å; K403-E468 PolarHBondContact NZ-OE2 3.07Å; W406-E468 HydrophobicContact CH2-CB 4.13Å; W406-E468 HydrophobicContact CZ3-CB 4.18Å; R464-E468 WeakPolarHBondContact O-CG 3.34Å; R464-E468 PolarHBondContact O-N 3.24Å; K466-E468 VanDerWaalsContact C-N 3.29Å; K466-E468 PolarHBondContact O-N 3.44Å; E468-Q470 VanDerWaalsContact C-N 3.32Å; E468-L471 PolarHBondContact O-N 3.36Å; E468-Y472 WeakPolarHBondContact O-CB 3.21Å; E468-Y472 PolarHBondContact O-N 3.48Å
469	A	95.8	Very high	93.9	Very high	10 Å²	10	53 Å²	53	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-36.5	174.5	0	0	0	0	0	111.8	Y465 K466 Y472 K473 I493 I534	Y465-A469 WeakPolarHBondContact O-CB 3.1Å; Y465-A469 PolarHBondContact O-N 3.42Å; K466-A469 PolarHBondContact O-N 2.79Å; A469-Y472 WeakPolarHBondContact O-CB 3.46Å; A469-Y472 PolarHBondContact O-N 3.36Å; A469-K473 PolarHBondContact O-N 3.44Å; A469-K473 VanDerWaalsContact O-N 3.15Å; A469-I493 HydrophobicContact CB-CG2 4.14Å; A469-I534 HydrophobicContact CB-CG2 4.39Å
470	Q	94.8	Very high	93.8	Very high	82 Å²	82	55.7 Å²	55.7	38%	0.383	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-46.3	174	-175.7	179.4	-23.4	0	0	111.3	K466 D467 E468 Y472 K473 E474	K466-Q470 PolarHBondContact O-N 3.2Å; D467-Q470 PolarHBondContact O-N 3.09Å; E468-Q470 VanDerWaalsContact C-N 3.32Å; Q470-Y472 PolarHBondContact O-N 3.39Å; Q470-K473 WeakPolarHBondContact O-CB 3.44Å; Q470-K473 PolarHBondContact O-N 3.22Å; Q470-E474 WeakPolarHBondContact CG-OE1 3.43Å; Q470-E474 PolarHBondContact NE2-OE1 3.02Å; Q470-E474 WeakPolarHBondContact O-CG 3.4Å; Q470-E474 PolarHBondContact O-N 2.95Å
471	L	94.4	Very high	93.6	Very high	74 Å²	74	60 Å²	60	39%	0.387	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-38.6	174.7	-75.2	169.7	0	0	0	111.8	D467 E468 E474 E475	D467-L471 WeakPolarHBondContact O-CG 3.4Å; D467-L471 PolarHBondContact O-N 2.87Å; E468-L471 PolarHBondContact O-N 3.36Å; L471-E474 PolarHBondContact O-N 3.29Å; L471-E475 WeakPolarHBondContact O-CG 3.3Å; L471-E475 PolarHBondContact O-N 3.43Å
472	Y	94.7	Very high	93.2	Very high	16 Å²	16	66.1 Å²	66.1	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-44.1	176.3	-179.2	-111.9	0	0	0	112.5	W406 E468 A469 Q470 H476 P483 Y486 M490 I493	W406-Y472 HydrophobicContact CB-CD2 4.17Å; W406-Y472 HydrophobicContact CB-CE2 3.61Å; W406-Y472 HydrophobicContact CE3-CD1 4.47Å; W406-Y472 AromaticContact CE3-CD2 3.89Å; W406-Y472 HydrophobicContact CE3-CD2 3.89Å; W406-Y472 HydrophobicContact CE3-CE2 4.46Å; W406-Y472 AromaticContact CE3-CG 3.88Å; W406-Y472 HydrophobicContact CE3-CG 3.88Å; W406-Y472 HydrophobicContact CZ3-CG 4.44Å; W406-Y472 PolarHBondContact O-OH 3.36Å; W406-Y472 VanDerWaalsContact O-OH 3.12Å; E468-Y472 WeakPolarHBondContact O-CB 3.21Å; E468-Y472 PolarHBondContact O-N 3.48Å; A469-Y472 WeakPolarHBondContact O-CB 3.46Å; A469-Y472 PolarHBondContact O-N 3.36Å; Q470-Y472 PolarHBondContact O-N 3.39Å; Y472-H476 PolarHBondContact O-N 3.02Å; Y472-P483 HydrophobicContact CE2-CG 3.61Å; Y472-P483 VanDerWaalsContact OH-CG 3.25Å; Y472-P483 WeakPolarHBondContact OH-CG 3.31Å; Y472-Y486 HydrophobicContact CD1-CD2 4.1Å; Y472-Y486 AromaticContact CD1-CE2 3.84Å; Y472-Y486 HydrophobicContact CD1-CE2 3.84Å; Y472-Y486 AromaticContact CE1-CD2 3.4Å; Y472-Y486 HydrophobicContact CE1-CD2 3.4Å; Y472-Y486 AromaticContact CE1-CE2 3.58Å; Y472-Y486 HydrophobicContact CE1-CE2 3.58Å; Y472-Y486 HydrophobicContact CE1-CG 4.5Å; Y472-Y486 AromaticContact CZ-CD2 3.69Å; Y472-Y486 WeakPolarHBondContact OH-CA 3.37Å; Y472-M490 HydrophobicContact CD1-CE 3.83Å; Y472-M490 HydrophobicContact CE1-CE 4.25Å; Y472-I493 HydrophobicContact CD1-CD1 4.13Å; Y472-I493 HydrophobicContact CE1-CD1 4.41Å
473	K	93	Very high	92.8	Very high	42 Å²	42	66.9 Å²	66.9	18%	0.183	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-51.4	170.6	179.8	-159	-177.4	143	0	111.1	A469 Q470 E475 H476 L477 M490 S541 D544	A469-K473 PolarHBondContact O-N 3.44Å; A469-K473 VanDerWaalsContact O-N 3.15Å; Q470-K473 WeakPolarHBondContact O-CB 3.44Å; Q470-K473 PolarHBondContact O-N 3.22Å; K473-E475 VanDerWaalsContact C-N 3.32Å; K473-E475 PolarHBondContact O-N 2.89Å; K473-H476 PolarHBondContact O-N 3.2Å; K473-L477 HydrophobicContact CD-CD1 4.33Å; K473-L477 HydrophobicContact CG-CD1 4.1Å; K473-L477 HydrophobicContact CG-CG 4.42Å; K473-L477 WeakPolarHBondContact O-CG 3.26Å; K473-L477 PolarHBondContact O-N 2.76Å; K473-M490 HydrophobicContact CB-CE 4.41Å; K473-S541 WeakPolarHBondContact CD-OG 3.5Å; K473-S541 VanDerWaalsContact CE-OG 3.26Å; K473-S541 WeakPolarHBondContact CE-OG 3.43Å; K473-S541 PolarHBondContact NZ-OG 2.85Å; K473-D544 IonicContact NZ-OD2 3.01Å; K473-D544 PolarHBondContact NZ-OD2 3.2Å
474	E	93.2	Very high	92.5	Very high	85 Å²	85	69.1 Å²	69.1	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-61.6	-38.5	-175.2	-71.8	174.4	-169.9	0	0	112.5	Q470 L471 K478	Q470-E474 WeakPolarHBondContact CG-OE1 3.43Å; Q470-E474 PolarHBondContact NE2-OE1 3.02Å; Q470-E474 WeakPolarHBondContact O-CG 3.4Å; Q470-E474 PolarHBondContact O-N 2.95Å; L471-E474 PolarHBondContact O-N 3.29Å; E474-K478 PolarHBondContact O-N 3.4Å
475	E	91.3	Very high	92.3	Very high	109 Å²	109	66.7 Å²	66.7	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-41.5	174.4	-71.5	-59.5	153.4	0	0	112.2	L471 K473 L477 K478	L471-E475 WeakPolarHBondContact O-CG 3.3Å; L471-E475 PolarHBondContact O-N 3.43Å; K473-E475 VanDerWaalsContact C-N 3.32Å; K473-E475 PolarHBondContact O-N 2.89Å; E475-L477 VanDerWaalsContact C-N 3.35Å; E475-L477 PolarHBondContact O-N 2.94Å; E475-K478 WeakPolarHBondContact O-CB 3.46Å; E475-K478 PolarHBondContact O-N 3.14Å; E475-K478 IonicContact OE1-NZ 3.45Å; E475-K478 PolarHBondContact OE1-NZ 3.18Å; E475-K478 WeakPolarHBondContact OE2-CD 3.37Å; E475-K478 IonicContact OE2-NZ 3.28Å; E475-K478 PolarHBondContact OE2-NZ 3.05Å
476	H	92.6	Very high	92.2	Very high	6 Å²	6	66.9 Å²	66.9	3%	0.028	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-41.6	176.2	-179.4	63.4	0	0	0	112.3	Y472 K473 K478 N479 R480 Y482 Y486 E545	Y472-H476 PolarHBondContact O-N 3.02Å; K473-H476 PolarHBondContact O-N 3.2Å; H476-K478 PolarHBondContact O-N 3.05Å; H476-K478 VanDerWaalsContact O-N 3.16Å; H476-N479 CarbonylContact O-C 2.95Å; H476-N479 PolarHBondContact O-N 2.92Å; H476-R480 PolarHBondContact CE1-O 2.75Å; H476-R480 PolarHBondContact O-N 3.11Å; H476-Y482 PolarHBondContact ND1-O 3.09Å; H476-Y486 HydrophobicContact CB-CD2 3.57Å; H476-Y486 HydrophobicContact CB-CE2 3.55Å; H476-Y486 HydrophobicContact CB-CG 4.17Å; H476-Y486 AromaticContact CD2-CD1 3.3Å; H476-Y486 WeakPolarHBondContact CD2-CD1 3.33Å; H476-Y486 AromaticContact CD2-CD2 3.79Å; H476-Y486 AromaticContact CD2-CE1 3.31Å; H476-Y486 WeakPolarHBondContact CD2-CE1 3.27Å; H476-Y486 AromaticContact CD2-CE2 3.81Å; H476-Y486 AromaticContact CD2-CG 3.54Å; H476-Y486 AromaticContact CD2-CZ 3.56Å; H476-Y486 AromaticContact CE1-CD1 3.75Å; H476-Y486 AromaticContact CE1-CG 3.65Å; H476-Y486 AromaticContact CG-CD1 3.81Å; H476-Y486 AromaticContact CG-CD2 3.46Å; H476-Y486 VanDerWaalsContact CG-CD2 3.46Å; H476-Y486 AromaticContact CG-CE2 3.71Å; H476-Y486 AromaticContact CG-CG 3.51Å; H476-Y486 AromaticContact CG-CZ 3.96Å; H476-Y486 AromaticContact ND1-CD2 3.89Å; H476-Y486 AromaticContact ND1-CG 3.61Å; H476-Y486 AromaticContact NE2-CD1 3.27Å; H476-Y486 VanDerWaalsContact NE2-CD1 3.27Å; H476-Y486 WeakPolarHBondContact NE2-CD1 3.39Å; H476-Y486 AromaticContact NE2-CE1 3.68Å; H476-Y486 AromaticContact NE2-CG 3.63Å; H476-E545 IonicContact CD2-OE1 3.49Å; H476-E545 PolarHBondContact CD2-OE1 3.33Å; H476-E545 IonicContact NE2-OE1 2.97Å; H476-E545 PolarHBondContact NE2-OE1 2.98Å; H476-E545 IonicContact NE2-OE2 3.62Å
477	L	90	Very high	92	Very high	76 Å²	76	65.8 Å²	65.8	40%	0.398	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-21.8	178.9	-69.8	177.1	0	0	0	113.5	K473 E475 M548	K473-L477 HydrophobicContact CD-CD1 4.33Å; K473-L477 HydrophobicContact CG-CD1 4.1Å; K473-L477 HydrophobicContact CG-CG 4.42Å; K473-L477 WeakPolarHBondContact O-CG 3.26Å; K473-L477 PolarHBondContact O-N 2.76Å; E475-L477 VanDerWaalsContact C-N 3.35Å; E475-L477 PolarHBondContact O-N 2.94Å; L477-M548 HydrophobicContact CD2-CE 3.77Å
478	K	91.6	Very high	92	Very high	147 Å²	147	63.8 Å²	63.8	64%	0.639	30%	0.298	S	S	*	.	H	α-helix	trans	-70.4	-34.2	172.9	-64.7	172.6	-166.8	170	0	112	E474 E475 H476	E474-K478 PolarHBondContact O-N 3.4Å; E475-K478 WeakPolarHBondContact O-CB 3.46Å; E475-K478 PolarHBondContact O-N 3.14Å; E475-K478 IonicContact OE1-NZ 3.45Å; E475-K478 PolarHBondContact OE1-NZ 3.18Å; E475-K478 WeakPolarHBondContact OE2-CD 3.37Å; E475-K478 IonicContact OE2-NZ 3.28Å; E475-K478 PolarHBondContact OE2-NZ 3.05Å; H476-K478 PolarHBondContact O-N 3.05Å; H476-K478 VanDerWaalsContact O-N 3.16Å
479	N	90.4	Very high	91.9	Very high	76 Å²	76	62 Å²	62	41%	0.406	29%	0.289	S	S	.	.			trans	-151	97.4	176.1	-175.1	-4.8	0	0	0	110.7	H476 Q481 Y482	H476-N479 CarbonylContact O-C 2.95Å; H476-N479 PolarHBondContact O-N 2.92Å; N479-Q481 PolarHBondContact O-N 3.02Å; N479-Q481 WeakPolarHBondContact OD1-CB 2.96Å; N479-Q481 PolarHBondContact OD1-N 3.48Å; N479-Y482 PolarHBondContact O-N 3.19Å
480	R	91.1	Very high	91.9	Very high	92 Å²	92	61.7 Å²	61.7	35%	0.347	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-6.8	-176.5	-63.8	177.4	65	-144.4	-7.9	115	H476 E545 D549	H476-R480 PolarHBondContact CE1-O 2.75Å; H476-R480 PolarHBondContact O-N 3.11Å; R480-E545 IonicContact CZ-OE2 3.36Å; R480-E545 VanDerWaalsContact CZ-OE2 3.27Å; R480-E545 IonicContact NE-OE1 3.64Å; R480-E545 IonicContact NE-OE2 2.7Å; R480-E545 PolarHBondContact NE-OE2 3.48Å; R480-E545 IonicContact NH2-OE2 2.77Å; R480-E545 PolarHBondContact NH2-OE2 3.21Å; R480-D549 IonicContact CZ-OD1 3.18Å; R480-D549 VanDerWaalsContact CZ-OD1 3.31Å; R480-D549 IonicContact NH1-OD1 3.59Å; R480-D549 PolarHBondContact NH1-OD1 3.34Å; R480-D549 IonicContact NH2-OD1 3.38Å; R480-D549 PolarHBondContact NH2-OD1 3.01Å; R480-D549 IonicContact NH2-OD2 2.65Å; R480-D549 PolarHBondContact NH2-OD2 3.43Å
481	Q	87.4	Confident	92	Very high	141 Å²	141	57.8 Å²	57.8	66%	0.659	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-17	172.4	-62.7	-179.5	3.4	0	0	113.3	N479	N479-Q481 PolarHBondContact O-N 3.02Å; N479-Q481 WeakPolarHBondContact OD1-CB 2.96Å; N479-Q481 PolarHBondContact OD1-N 3.48Å
482	Y	86.8	Confident	92	Very high	131 Å²	131	54.3 Å²	54.3	51%	0.514	25%	0.25	S	C	.	.	S	Bend	trans	-131.4	143.6	-176	-65.9	-87.6	0	0	0	111.2	H476 N479	H476-Y482 PolarHBondContact ND1-O 3.09Å; N479-Y482 PolarHBondContact O-N 3.19Å
483	P	86.8	Confident	92.1	Very high	16 Å²	16	53.6 Å²	53.6	10%	0.104	25%	0.247	C	C	.	.	S	Bend	cis	-68.4	152.5	-13.1	29	-32.5	0	0	0	111.8	V407 Y472 C485 Y486	V407-P483 HydrophobicContact CG1-CB 4.44Å; Y472-P483 HydrophobicContact CE2-CG 3.61Å; Y472-P483 VanDerWaalsContact OH-CG 3.25Å; Y472-P483 WeakPolarHBondContact OH-CG 3.31Å; P483-C485 VanDerWaalsContact C-N 3.29Å; P483-C485 PolarHBondContact O-N 3.3Å; P483-Y486 WeakPolarHBondContact O-CB 3Å; P483-Y486 PolarHBondContact O-N 3.12Å
484	Q	87.8	Confident	92.2	Very high	108 Å²	108	51.6 Å²	51.6	51%	0.505	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-38.1	-174.2	-69.2	175.4	11.9	0	0	112.7	E409 Y486	E409-Q484 PolarHBondContact OE1-NE2 3.09Å; Q484-Y486 VanDerWaalsContact C-N 3.35Å; Q484-Y486 PolarHBondContact O-N 3.38Å
485	C	91.9	Very high	92.3	Very high	11 Å²	11	47.5 Å²	47.5	7%	0.074	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	32.4	-179.7	-62.2	0	0	0	0	112.8	P483 V487 Q488 Y489	P483-C485 VanDerWaalsContact C-N 3.29Å; P483-C485 PolarHBondContact O-N 3.3Å; C485-V487 PolarHBondContact O-N 3.04Å; C485-Q488 VanDerWaalsContact C-OE1 3.3Å; C485-Q488 VanDerWaalsContact CA-OE1 3.27Å; C485-Q488 PolarHBondContact O-N 3.37Å; C485-Q488 PolarHBondContact O-OE1 3.3Å; C485-Y489 HydrophobicContact CB-CD2 3.85Å; C485-Y489 HydrophobicContact CB-CE2 4.09Å; C485-Y489 WeakPolarHBondContact O-CD2 3.38Å; C485-Y489 PolarHBondContact O-N 3.36Å
486	Y	93.8	Very high	92.5	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-53.9	-49.8	-175.9	171.8	-102.4	0	0	0	112.9	Y472 H476 P483 Q484 Q488 Y489 M490 E545	Y472-Y486 HydrophobicContact CD1-CD2 4.1Å; Y472-Y486 AromaticContact CD1-CE2 3.84Å; Y472-Y486 HydrophobicContact CD1-CE2 3.84Å; Y472-Y486 AromaticContact CE1-CD2 3.4Å; Y472-Y486 HydrophobicContact CE1-CD2 3.4Å; Y472-Y486 AromaticContact CE1-CE2 3.58Å; Y472-Y486 HydrophobicContact CE1-CE2 3.58Å; Y472-Y486 HydrophobicContact CE1-CG 4.5Å; Y472-Y486 AromaticContact CZ-CD2 3.69Å; Y472-Y486 WeakPolarHBondContact OH-CA 3.37Å; H476-Y486 HydrophobicContact CB-CD2 3.57Å; H476-Y486 HydrophobicContact CB-CE2 3.55Å; H476-Y486 HydrophobicContact CB-CG 4.17Å; H476-Y486 AromaticContact CD2-CD1 3.3Å; H476-Y486 WeakPolarHBondContact CD2-CD1 3.33Å; H476-Y486 AromaticContact CD2-CD2 3.79Å; H476-Y486 AromaticContact CD2-CE1 3.31Å; H476-Y486 WeakPolarHBondContact CD2-CE1 3.27Å; H476-Y486 AromaticContact CD2-CE2 3.81Å; H476-Y486 AromaticContact CD2-CG 3.54Å; H476-Y486 AromaticContact CD2-CZ 3.56Å; H476-Y486 AromaticContact CE1-CD1 3.75Å; H476-Y486 AromaticContact CE1-CG 3.65Å; H476-Y486 AromaticContact CG-CD1 3.81Å; H476-Y486 AromaticContact CG-CD2 3.46Å; H476-Y486 VanDerWaalsContact CG-CD2 3.46Å; H476-Y486 AromaticContact CG-CE2 3.71Å; H476-Y486 AromaticContact CG-CG 3.51Å; H476-Y486 AromaticContact CG-CZ 3.96Å; H476-Y486 AromaticContact ND1-CD2 3.89Å; H476-Y486 AromaticContact ND1-CG 3.61Å; H476-Y486 AromaticContact NE2-CD1 3.27Å; H476-Y486 VanDerWaalsContact NE2-CD1 3.27Å; H476-Y486 WeakPolarHBondContact NE2-CD1 3.39Å; H476-Y486 AromaticContact NE2-CE1 3.68Å; H476-Y486 AromaticContact NE2-CG 3.63Å; P483-Y486 WeakPolarHBondContact O-CB 3Å; P483-Y486 PolarHBondContact O-N 3.12Å; Q484-Y486 VanDerWaalsContact C-N 3.35Å; Q484-Y486 PolarHBondContact O-N 3.38Å; Y486-Q488 PolarHBondContact O-N 2.93Å; Y486-Y489 PolarHBondContact O-N 3.32Å; Y486-M490 HydrophobicContact CE2-CE 3.81Å; Y486-M490 WeakPolarHBondContact O-CB 3.43Å; Y486-M490 PolarHBondContact O-N 2.95Å; Y486-M490 WeakPolarHBondContact OH-CE 3.25Å; Y486-E545 HydrophobicContact CD1-CG 4.43Å; Y486-E545 HydrophobicContact CE1-CG 3.99Å
487	V	93	Very high	92.7	Very high	25 Å²	25	42 Å²	42	15%	0.152	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-48.9	-179	169.8	0	0	0	0	110.9	C485 Y489 M490 I491 L542 F583	C485-V487 PolarHBondContact O-N 3.04Å; V487-Y489 PolarHBondContact O-N 2.89Å; V487-M490 PolarHBondContact O-N 2.94Å; V487-I491 HydrophobicContact CG1-CD1 3.9Å; V487-I491 VanDerWaalsContact O-CG1 3.25Å; V487-I491 WeakPolarHBondContact O-CG1 3.46Å; V487-I491 PolarHBondContact O-N 2.89Å; V487-L542 HydrophobicContact CB-CD2 4.35Å; V487-L542 HydrophobicContact CG1-CD2 4.13Å; V487-L542 HydrophobicContact CG2-CD2 4.3Å; V487-F583 HydrophobicContact CG1-CD1 4.12Å; V487-F583 HydrophobicContact CG1-CE1 3.68Å
488	Q	94.7	Very high	92.8	Very high	39 Å²	39	39.9 Å²	39.9	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-43.9	-177	-61.7	83.3	-14	0	0	111.5	E411 P412 Y420 C485 Y486 I491 A492	E411-Q488 HydrophobicContact CG-CG 4.21Å; P412-Q488 VanDerWaalsContact CD-CB 3.47Å; P412-Q488 HydrophobicContact CG-CB 3.89Å; Y420-Q488 HydrophobicContact CD2-CB 4.26Å; Y420-Q488 HydrophobicContact CE2-CB 4.07Å; Y420-Q488 HydrophobicContact CE2-CG 3.84Å; C485-Q488 VanDerWaalsContact C-OE1 3.3Å; C485-Q488 VanDerWaalsContact CA-OE1 3.27Å; C485-Q488 PolarHBondContact O-N 3.37Å; C485-Q488 PolarHBondContact O-OE1 3.3Å; Y486-Q488 PolarHBondContact O-N 2.93Å; Q488-I491 WeakPolarHBondContact O-CB 3.25Å; Q488-I491 PolarHBondContact O-N 3.27Å; Q488-A492 PolarHBondContact O-N 3.47Å
489	Y	95.3	Very high	92.9	Very high	11 Å²	11	33.7 Å²	33.7	4%	0.043	16%	0.156	C	C	.	.	H	α-helix	trans	-70.9	-33.9	177.3	-84.5	-73.6	0	0	0	113	D405 W406 T410 P412 C485 Y486 V487 I491 A492 I493	D405-Y489 HydrophobicContact CB-CE1 4.24Å; D405-Y489 WeakPolarHBondContact O-CE2 3.46Å; D405-Y489 PolarHBondContact O-OH 3.48Å; W406-Y489 HydrophobicContact CB-CD1 4.33Å; W406-Y489 HydrophobicContact CB-CG 4.32Å; W406-Y489 AromaticContact CD1-CD1 3.71Å; W406-Y489 HydrophobicContact CG-CD1 4.33Å; T410-Y489 VanDerWaalsContact O-CE2 3.25Å; T410-Y489 WeakPolarHBondContact O-CE2 3.44Å; T410-Y489 PolarHBondContact O-OH 3.44Å; P412-Y489 HydrophobicContact CB-CD1 4.02Å; P412-Y489 HydrophobicContact CB-CE1 3.77Å; P412-Y489 HydrophobicContact CG-CD1 4.37Å; P412-Y489 HydrophobicContact CG-CE1 4.47Å; C485-Y489 HydrophobicContact CB-CD2 3.85Å; C485-Y489 HydrophobicContact CB-CE2 4.09Å; C485-Y489 WeakPolarHBondContact O-CD2 3.38Å; C485-Y489 PolarHBondContact O-N 3.36Å; Y486-Y489 PolarHBondContact O-N 3.32Å; V487-Y489 PolarHBondContact O-N 2.89Å; Y489-I491 VanDerWaalsContact C-N 3.33Å; Y489-A492 WeakPolarHBondContact O-CB 3.36Å; Y489-A492 PolarHBondContact O-N 3.18Å; Y489-I493 WeakPolarHBondContact O-CG1 3.41Å; Y489-I493 PolarHBondContact O-N 2.88Å
490	M	95.9	Very high	93.1	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.02	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-38.7	172.6	-175.1	59.7	73	0	0	111.3	Y472 K473 Y486 V487 A492 I493 I494 L542	Y472-M490 HydrophobicContact CD1-CE 3.83Å; Y472-M490 HydrophobicContact CE1-CE 4.25Å; K473-M490 HydrophobicContact CB-CE 4.41Å; Y486-M490 HydrophobicContact CE2-CE 3.81Å; Y486-M490 WeakPolarHBondContact O-CB 3.43Å; Y486-M490 PolarHBondContact O-N 2.95Å; Y486-M490 WeakPolarHBondContact OH-CE 3.25Å; V487-M490 PolarHBondContact O-N 2.94Å; M490-A492 VanDerWaalsContact C-N 3.35Å; M490-I493 PolarHBondContact O-N 3.13Å; M490-I494 HydrophobicContact CG-CD1 4.36Å; M490-I494 WeakPolarHBondContact O-CD1 3.47Å; M490-I494 VanDerWaalsContact O-CG1 3.28Å; M490-I494 WeakPolarHBondContact O-CG1 3.33Å; M490-I494 PolarHBondContact O-N 3.18Å; M490-L542 HydrophobicContact CB-CD2 3.84Å; M490-L542 HydrophobicContact CB-CG 4.31Å; M490-L542 HydrophobicContact CG-CD1 4.24Å; M490-L542 HydrophobicContact CG-CD2 3.79Å; M490-L542 HydrophobicContact CG-CG 3.75Å
491	I	95.4	Very high	93.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-44.8	170.2	-67.3	166.3	0	0	0	110.8	Y420 V487 Q488 Y489 I493 I494 N495 L542 F583 K585 I586	Y420-I491 HydrophobicContact CD2-CB 4.39Å; Y420-I491 HydrophobicContact CD2-CD1 4.44Å; Y420-I491 HydrophobicContact CD2-CG2 4.05Å; V487-I491 HydrophobicContact CG1-CD1 3.9Å; V487-I491 VanDerWaalsContact O-CG1 3.25Å; V487-I491 WeakPolarHBondContact O-CG1 3.46Å; V487-I491 PolarHBondContact O-N 2.89Å; Q488-I491 WeakPolarHBondContact O-CB 3.25Å; Q488-I491 PolarHBondContact O-N 3.27Å; Y489-I491 VanDerWaalsContact C-N 3.33Å; I491-I493 VanDerWaalsContact C-N 3.33Å; I491-I493 PolarHBondContact O-N 3.37Å; I491-I494 PolarHBondContact O-N 3.39Å; I491-N495 WeakPolarHBondContact O-CB 3.32Å; I491-N495 PolarHBondContact O-N 3.32Å; I491-L542 HydrophobicContact CG1-CD1 3.82Å; I491-F583 HydrophobicContact CD1-CD1 4.04Å; I491-K585 HydrophobicContact CG2-CB 4.13Å; I491-K585 WeakPolarHBondContact CG2-O 3.47Å; I491-I586 HydrophobicContact CB-CG1 4.25Å; I491-I586 HydrophobicContact CD1-CG1 4.46Å; I491-I586 HydrophobicContact CG1-CD1 4.17Å; I491-I586 HydrophobicContact CG1-CG1 3.83Å; I491-I586 HydrophobicContact CG2-CG1 3.71Å
492	A	95.5	Very high	93.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.8	-40.9	177.2	0	0	0	0	0	112	P412 T422 Q488 Y489 M490 I494 N495 N496	P412-A492 HydrophobicContact CB-CB 4.03Å; P412-A492 HydrophobicContact CG-CB 4.11Å; T422-A492 HydrophobicContact CG2-CB 3.99Å; Q488-A492 PolarHBondContact O-N 3.47Å; Y489-A492 WeakPolarHBondContact O-CB 3.36Å; Y489-A492 PolarHBondContact O-N 3.18Å; M490-A492 VanDerWaalsContact C-N 3.35Å; A492-I494 PolarHBondContact O-N 3.5Å; A492-N495 PolarHBondContact O-N 2.89Å; A492-N496 WeakPolarHBondContact O-CB 3.16Å; A492-N496 PolarHBondContact O-N 2.87Å; A492-N496 PolarHBondContact O-OD1 3.38Å
493	I	96.1	Very high	93.6	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-61.1	-44.7	175.1	-70.2	166.7	0	0	0	111	W406 Y465 A469 Y472 Y489 M490 I491 N496 C497 I534	W406-I493 HydrophobicContact CD2-CD1 4Å; W406-I493 HydrophobicContact CE3-CD1 4.17Å; W406-I493 HydrophobicContact CH2-CD1 4.22Å; W406-I493 HydrophobicContact CZ2-CD1 4.05Å; W406-I493 HydrophobicContact CZ2-CG1 4.18Å; W406-I493 HydrophobicContact CZ3-CD1 4.28Å; Y465-I493 HydrophobicContact CE1-CG2 4.24Å; Y465-I493 WeakPolarHBondContact OH-CA 3.38Å; A469-I493 HydrophobicContact CB-CG2 4.14Å; Y472-I493 HydrophobicContact CD1-CD1 4.13Å; Y472-I493 HydrophobicContact CE1-CD1 4.41Å; Y489-I493 WeakPolarHBondContact O-CG1 3.41Å; Y489-I493 PolarHBondContact O-N 2.88Å; M490-I493 PolarHBondContact O-N 3.13Å; I491-I493 VanDerWaalsContact C-N 3.33Å; I491-I493 PolarHBondContact O-N 3.37Å; I493-N496 WeakPolarHBondContact O-CB 3.28Å; I493-N496 PolarHBondContact O-N 3.13Å; I493-C497 PolarHBondContact O-N 3.38Å; I493-C497 PolarHBondContact O-SG 2.91Å; I493-C497 VanDerWaalsContact O-SG 3.38Å; I493-I534 HydrophobicContact CG2-CG2 4.1Å
494	I	96.1	Very high	93.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.4	-44.2	176.7	-65.7	160.6	0	0	0	110.7	M490 I491 A492 C497 A535 L542 I586 Y590	M490-I494 HydrophobicContact CG-CD1 4.36Å; M490-I494 WeakPolarHBondContact O-CD1 3.47Å; M490-I494 VanDerWaalsContact O-CG1 3.28Å; M490-I494 WeakPolarHBondContact O-CG1 3.33Å; M490-I494 PolarHBondContact O-N 3.18Å; I491-I494 PolarHBondContact O-N 3.39Å; A492-I494 PolarHBondContact O-N 3.5Å; I494-C497 WeakPolarHBondContact O-CB 3.45Å; I494-C497 PolarHBondContact O-N 3.23Å; I494-A535 HydrophobicContact CG2-CB 4.22Å; I494-L542 HydrophobicContact CD1-CD1 3.64Å; I494-L542 HydrophobicContact CD1-CG 4.47Å; I494-I586 HydrophobicContact CG2-CG2 4.05Å; I494-Y590 HydrophobicContact CG2-CD2 3.85Å; I494-Y590 HydrophobicContact CG2-CG 3.96Å
495	N	95.5	Very high	93.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-70.2	-32.9	179.5	-71.7	-17.8	0	0	0	112.8	Y420 I491 A492 C497 Q498 T499 K585 I586 K587	Y420-N495 VanDerWaalsContact O-CB 3.23Å; Y420-N495 WeakPolarHBondContact O-CB 3.26Å; Y420-N495 PolarHBondContact O-ND2 3.38Å; I491-N495 WeakPolarHBondContact O-CB 3.32Å; I491-N495 PolarHBondContact O-N 3.32Å; A492-N495 PolarHBondContact O-N 2.89Å; N495-C497 PolarHBondContact O-N 3.44Å; N495-Q498 PolarHBondContact O-N 3.32Å; N495-T499 PolarHBondContact O-N 3.04Å; N495-T499 VanDerWaalsContact O-N 3.07Å; N495-T499 PolarHBondContact O-OG1 3.42Å; N495-K585 PolarHBondContact ND2-O 3.38Å; N495-I586 WeakPolarHBondContact OD1-CA 3.15Å; N495-K587 HydrophobicContact CB-CD 4.24Å; N495-K587 HydrophobicContact CB-CG 4.4Å; N495-K587 PolarHBondContact OD1-N 2.66Å
496	N	95.3	Very high	93.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.4	-37.3	171.5	-76.3	-11	0	0	0	110.6	Q421 T422 P425 Y465 A492 I493 Q498 T499 F500	Q421-N496 WeakPolarHBondContact CG-OD1 3.5Å; T422-N496 PolarHBondContact N-OD1 3.38Å; T422-N496 VanDerWaalsContact N-OD1 3.15Å; T422-N496 PolarHBondContact OG1-ND2 2.71Å; P425-N496 HydrophobicContact CG-CB 3.94Å; Y465-N496 PolarHBondContact OH-ND2 3.31Å; A492-N496 WeakPolarHBondContact O-CB 3.16Å; A492-N496 PolarHBondContact O-N 2.87Å; A492-N496 PolarHBondContact O-OD1 3.38Å; I493-N496 WeakPolarHBondContact O-CB 3.28Å; I493-N496 PolarHBondContact O-N 3.13Å; N496-Q498 PolarHBondContact O-N 2.86Å; N496-T499 PolarHBondContact O-N 3.12Å; N496-F500 HydrophobicContact CB-CD2 4.31Å; N496-F500 HydrophobicContact CB-CE2 4.16Å; N496-F500 WeakPolarHBondContact O-CB 3.44Å; N496-F500 WeakPolarHBondContact O-CD2 3.35Å; N496-F500 WeakPolarHBondContact O-CG 3.32Å; N496-F500 PolarHBondContact O-N 3.31Å
497	C	95.6	Very high	93.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-44.5	177.2	-63.9	0	0	0	0	112.4	I493 I494 N495 T499 F500 K501 L531 A535 Y590	I493-C497 PolarHBondContact O-N 3.38Å; I493-C497 PolarHBondContact O-SG 2.91Å; I493-C497 VanDerWaalsContact O-SG 3.38Å; I494-C497 WeakPolarHBondContact O-CB 3.45Å; I494-C497 PolarHBondContact O-N 3.23Å; N495-C497 PolarHBondContact O-N 3.44Å; C497-T499 VanDerWaalsContact C-N 3.35Å; C497-F500 PolarHBondContact O-N 3.34Å; C497-K501 WeakPolarHBondContact O-CG 3.49Å; C497-K501 PolarHBondContact O-N 3.27Å; C497-K501 VanDerWaalsContact O-N 3.09Å; C497-L531 HydrophobicContact CB-CB 4.31Å; C497-L531 HydrophobicContact CB-CD2 4.07Å; C497-A535 HydrophobicContact CB-CB 4.15Å; C497-Y590 HydrophobicContact CB-CE2 4.44Å
498	Q	93.1	Very high	93	Very high	31 Å²	31	20 Å²	20	15%	0.145	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-43.7	175.1	-177.4	58.9	23	0	0	111.3	N495 N496 F500 K501 E502 Y590	N495-Q498 PolarHBondContact O-N 3.32Å; N496-Q498 PolarHBondContact O-N 2.86Å; Q498-F500 VanDerWaalsContact C-N 3.34Å; Q498-F500 PolarHBondContact O-N 3.36Å; Q498-K501 WeakPolarHBondContact O-CB 3.42Å; Q498-K501 PolarHBondContact O-N 3.14Å; Q498-E502 PolarHBondContact NE2-OE1 3.34Å; Q498-E502 PolarHBondContact O-N 2.98Å; Q498-Y590 HydrophobicContact CB-CE2 4.04Å
499	T	93.5	Very high	92.6	Very high	17 Å²	17	27.3 Å²	27.3	10%	0.104	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-39.4	179.7	-50.8	0	0	0	0	111.9	Q421 P425 N495 N496 C497 E502 S503	Q421-T499 PolarHBondContact OE1-OG1 3.43Å; Q421-T499 VanDerWaalsContact OE1-OG1 3.11Å; P425-T499 HydrophobicContact CB-CG2 3.76Å; P425-T499 HydrophobicContact CG-CG2 4.28Å; N495-T499 PolarHBondContact O-N 3.04Å; N495-T499 VanDerWaalsContact O-N 3.07Å; N495-T499 PolarHBondContact O-OG1 3.42Å; N496-T499 PolarHBondContact O-N 3.12Å; C497-T499 VanDerWaalsContact C-N 3.35Å; T499-E502 PolarHBondContact O-N 3.42Å; T499-S503 VanDerWaalsContact O-CB 3.26Å; T499-S503 WeakPolarHBondContact O-CB 3.49Å; T499-S503 PolarHBondContact O-N 3.15Å; T499-S503 PolarHBondContact O-OG 2.89Å
500	F	94.7	Very high	92.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-45.4	173.7	-78.7	-52.5	0	0	0	111.3	L424 P425 V428 F429 M458 F461 L462 Y465 N496 C497 Q498 E502 S503 I504 L531	L424-F500 HydrophobicContact CD2-CZ 4.16Å; L424-F500 HydrophobicContact CG-CZ 4.06Å; P425-F500 VanDerWaalsContact CA-CE1 3.5Å; P425-F500 HydrophobicContact CB-CD1 3.9Å; P425-F500 HydrophobicContact CB-CE1 3.81Å; P425-F500 HydrophobicContact CB-CG 4.44Å; P425-F500 HydrophobicContact CB-CZ 4.22Å; P425-F500 HydrophobicContact CG-CD1 4.22Å; P425-F500 HydrophobicContact CG-CD2 4.33Å; P425-F500 HydrophobicContact CG-CE1 3.98Å; P425-F500 HydrophobicContact CG-CE2 4.04Å; P425-F500 HydrophobicContact CG-CG 4.42Å; P425-F500 HydrophobicContact CG-CZ 3.87Å; V428-F500 HydrophobicContact CB-CE1 4.5Å; F429-F500 HydrophobicContact CD2-CD1 4.45Å; F429-F500 AromaticContact CE2-CD1 3.9Å; F429-F500 HydrophobicContact CE2-CD1 3.9Å; F429-F500 HydrophobicContact CE2-CE1 4.44Å; M458-F500 HydrophobicContact CE-CB 4.3Å; M458-F500 HydrophobicContact CE-CD1 3.37Å; M458-F500 HydrophobicContact CE-CE1 3.68Å; M458-F500 HydrophobicContact CE-CG 3.92Å; M458-F500 HydrophobicContact CE-CZ 4.49Å; F461-F500 HydrophobicContact CE1-CE1 4.22Å; F461-F500 HydrophobicContact CE1-CE2 4.46Å; F461-F500 AromaticContact CE1-CZ 3.81Å; F461-F500 HydrophobicContact CE1-CZ 3.81Å; F461-F500 HydrophobicContact CZ-CZ 4.25Å; L462-F500 HydrophobicContact CD2-CD2 4.39Å; Y465-F500 HydrophobicContact CD1-CE2 4.47Å; Y465-F500 HydrophobicContact CE1-CE2 4.16Å; N496-F500 HydrophobicContact CB-CD2 4.31Å; N496-F500 HydrophobicContact CB-CE2 4.16Å; N496-F500 WeakPolarHBondContact O-CB 3.44Å; N496-F500 WeakPolarHBondContact O-CD2 3.35Å; N496-F500 WeakPolarHBondContact O-CG 3.32Å; N496-F500 PolarHBondContact O-N 3.31Å; C497-F500 PolarHBondContact O-N 3.34Å; Q498-F500 VanDerWaalsContact C-N 3.34Å; Q498-F500 PolarHBondContact O-N 3.36Å; F500-E502 PolarHBondContact O-N 2.81Å; F500-S503 PolarHBondContact O-N 3.48Å; F500-I504 WeakPolarHBondContact O-CG1 3.38Å; F500-I504 PolarHBondContact O-N 2.56Å; F500-L531 HydrophobicContact CB-CD1 3.84Å; F500-L531 HydrophobicContact CB-CD2 4.05Å; F500-L531 HydrophobicContact CD2-CD2 4.13Å; F500-L531 HydrophobicContact CG-CD2 4.48Å
501	K	92.2	Very high	91.4	Very high	27 Å²	27	34 Å²	34	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-51.4	176.4	-71.5	-178.2	166.7	-161.5	0	112	C497 Q498 S503 I504 I505 L531 D532 Y590	C497-K501 WeakPolarHBondContact O-CG 3.49Å; C497-K501 PolarHBondContact O-N 3.27Å; C497-K501 VanDerWaalsContact O-N 3.09Å; Q498-K501 WeakPolarHBondContact O-CB 3.42Å; Q498-K501 PolarHBondContact O-N 3.14Å; K501-S503 VanDerWaalsContact C-N 3.3Å; K501-S503 PolarHBondContact O-N 3.07Å; K501-I504 PolarHBondContact O-N 3.47Å; K501-I505 VanDerWaalsContact O-CG1 3.3Å; K501-I505 WeakPolarHBondContact O-CG1 3.32Å; K501-I505 PolarHBondContact O-N 2.73Å; K501-L531 HydrophobicContact CG-CB 4.29Å; K501-L531 HydrophobicContact CG-CD1 3.61Å; K501-D532 IonicContact NZ-OD1 3.73Å; K501-D532 PolarHBondContact NZ-OD1 3Å; K501-D532 IonicContact NZ-OD2 2.61Å; K501-D532 PolarHBondContact NZ-OD2 3.26Å; K501-Y590 PolarHBondContact NZ-OH 3.36Å
502	E	91.4	Very high	90.6	Very high	101 Å²	101	35.8 Å²	35.8	47%	0.472	17%	0.17	S	C	.	.	H	α-helix	trans	-60.7	-41.2	179.3	-70.9	171.6	-171.4	0	0	111.8	Q498 T499 F500 I505 S506	Q498-E502 PolarHBondContact NE2-OE1 3.34Å; Q498-E502 PolarHBondContact O-N 2.98Å; T499-E502 PolarHBondContact O-N 3.42Å; F500-E502 PolarHBondContact O-N 2.81Å; E502-I505 PolarHBondContact O-N 3.21Å; E502-S506 VanDerWaalsContact O-CB 3.31Å; E502-S506 WeakPolarHBondContact O-CB 3.32Å; E502-S506 PolarHBondContact O-N 3.07Å
503	S	92.1	Very high	89.3	Confident	26 Å²	26	42.1 Å²	42.1	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-68.1	-40.7	179.1	-57.5	0	0	0	0	112.3	F429 T499 F500 K501 S506 L507	F429-S503 VanDerWaalsContact CE1-O 3.25Å; F429-S503 WeakPolarHBondContact CE1-O 3.42Å; T499-S503 VanDerWaalsContact O-CB 3.26Å; T499-S503 WeakPolarHBondContact O-CB 3.49Å; T499-S503 PolarHBondContact O-N 3.15Å; T499-S503 PolarHBondContact O-OG 2.89Å; F500-S503 PolarHBondContact O-N 3.48Å; K501-S503 VanDerWaalsContact C-N 3.3Å; K501-S503 PolarHBondContact O-N 3.07Å; S503-S506 PolarHBondContact O-N 3.09Å; S503-L507 VanDerWaalsContact O-CB 3.29Å; S503-L507 WeakPolarHBondContact O-CB 3.37Å; S503-L507 PolarHBondContact O-N 2.88Å
504	I	90.8	Very high	87.5	Confident	1 Å²	1	49 Å²	49	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-45.7	174.6	-68.1	167.6	0	0	0	110.3	F429 L455 M458 L462 F500 K501 K508 M527 L531	F429-I504 HydrophobicContact CE1-CG1 4.37Å; F429-I504 HydrophobicContact CE2-CG1 4.48Å; F429-I504 HydrophobicContact CZ-CB 4.38Å; F429-I504 HydrophobicContact CZ-CG1 3.59Å; L455-I504 HydrophobicContact CD2-CG2 4.44Å; M458-I504 HydrophobicContact CE-CD1 4.33Å; M458-I504 HydrophobicContact CG-CD1 4.36Å; L462-I504 HydrophobicContact CD1-CD1 4.5Å; F500-I504 WeakPolarHBondContact O-CG1 3.38Å; F500-I504 PolarHBondContact O-N 2.56Å; K501-I504 PolarHBondContact O-N 3.47Å; I504-K508 HydrophobicContact CG2-CD 4.24Å; I504-K508 WeakPolarHBondContact O-CG 3.48Å; I504-K508 PolarHBondContact O-N 3.47Å; I504-K508 VanDerWaalsContact O-N 3.11Å; I504-M527 HydrophobicContact CD1-CB 4.42Å; I504-M527 HydrophobicContact CD1-SD 4.15Å; I504-M527 HydrophobicContact CG2-CE 4.5Å; I504-L531 HydrophobicContact CD1-CD1 4.21Å
505	I	88.7	Confident	85.6	Confident	74 Å²	74	57.9 Å²	57.9	38%	0.379	27%	0.274	S	S	.	.	H	α-helix	trans	-62.4	-47.2	177.9	-67.5	166.3	0	0	0	110.3	K501 E502 K508 R509	K501-I505 VanDerWaalsContact O-CG1 3.3Å; K501-I505 WeakPolarHBondContact O-CG1 3.32Å; K501-I505 PolarHBondContact O-N 2.73Å; E502-I505 PolarHBondContact O-N 3.21Å; I505-K508 PolarHBondContact O-N 2.75Å; I505-R509 WeakPolarHBondContact O-CB 3.46Å; I505-R509 PolarHBondContact O-N 3.27Å
506	S	89.6	Confident	83.8	Confident	67 Å²	67	61.6 Å²	61.6	47%	0.469	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-47.8	178.8	-173.7	0	0	0	0	112	E502 S503 K508 R509 K510	E502-S506 VanDerWaalsContact O-CB 3.31Å; E502-S506 WeakPolarHBondContact O-CB 3.32Å; E502-S506 PolarHBondContact O-N 3.07Å; S503-S506 PolarHBondContact O-N 3.09Å; S506-K508 VanDerWaalsContact C-N 3.33Å; S506-K508 PolarHBondContact O-N 3.35Å; S506-R509 PolarHBondContact O-N 3.27Å; S506-K510 WeakPolarHBondContact O-CB 3.45Å; S506-K510 PolarHBondContact O-N 2.89Å
507	L	88.4	Confident	82.1	Confident	10 Å²	10	67.1 Å²	67.1	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-58.7	-45.3	179.2	-171.5	72	0	0	0	111.3	F429 F432 L436 L451 S503 K510 Y511	F429-L507 HydrophobicContact CD1-CB 4.19Å; F429-L507 HydrophobicContact CD1-CD2 4.17Å; F429-L507 HydrophobicContact CE1-CB 3.9Å; F429-L507 HydrophobicContact CE1-CD2 3.81Å; F429-L507 HydrophobicContact CE1-CG 4.38Å; F432-L507 HydrophobicContact CB-CD2 4.49Å; F432-L507 HydrophobicContact CD2-CD2 4.32Å; L436-L507 HydrophobicContact CD1-CD1 3.73Å; L436-L507 HydrophobicContact CD1-CD2 4.48Å; L436-L507 HydrophobicContact CD1-CG 4.33Å; L451-L507 HydrophobicContact CD1-CD2 3.99Å; L451-L507 HydrophobicContact CD1-CG 4.05Å; S503-L507 VanDerWaalsContact O-CB 3.29Å; S503-L507 WeakPolarHBondContact O-CB 3.37Å; S503-L507 PolarHBondContact O-N 2.88Å; L507-K510 PolarHBondContact O-N 3.24Å; L507-Y511 HydrophobicContact CD1-CD2 3.85Å; L507-Y511 HydrophobicContact CD1-CE2 3.9Å; L507-Y511 HydrophobicContact CG-CD2 4.36Å; L507-Y511 VanDerWaalsContact O-CD2 3.3Å; L507-Y511 WeakPolarHBondContact O-CD2 3.33Å; L507-Y511 PolarHBondContact O-N 2.71Å; L507-Y511 VanDerWaalsContact O-N 3.14Å
508	K	83.8	Confident	80.2	Confident	10 Å²	10	74 Å²	74	4%	0.043	36%	0.355	C	S	.	.	H	α-helix	trans	-69.3	-44.5	179.4	-70.4	176.9	-178.2	-160.3	0	112.1	L455 I504 I505 S506 K510 Y511 L512 H524	L455-K508 HydrophobicContact CD1-CD 4.31Å; L455-K508 HydrophobicContact CD1-CG 4.26Å; L455-K508 HydrophobicContact CD2-CD 4.35Å; L455-K508 HydrophobicContact CD2-CG 4.32Å; I504-K508 HydrophobicContact CG2-CD 4.24Å; I504-K508 WeakPolarHBondContact O-CG 3.48Å; I504-K508 PolarHBondContact O-N 3.47Å; I504-K508 VanDerWaalsContact O-N 3.11Å; I505-K508 PolarHBondContact O-N 2.75Å; S506-K508 VanDerWaalsContact C-N 3.33Å; S506-K508 PolarHBondContact O-N 3.35Å; K508-K510 PolarHBondContact O-N 3.2Å; K508-K510 VanDerWaalsContact O-N 3.14Å; K508-Y511 PolarHBondContact O-N 3.18Å; K508-Y511 VanDerWaalsContact O-N 3.14Å; K508-L512 HydrophobicContact CB-CD1 4.16Å; K508-L512 HydrophobicContact CD-CD1 4.48Å; K508-L512 HydrophobicContact CG-CD1 3.98Å; K508-L512 VanDerWaalsContact O-CB 3.25Å; K508-L512 WeakPolarHBondContact O-CB 3.37Å; K508-L512 PolarHBondContact O-N 2.64Å; K508-H524 WeakPolarHBondContact CD-CE1 3.45Å; K508-H524 WeakPolarHBondContact CD-NE2 3.29Å; K508-H524 WeakPolarHBondContact CE-CE1 3.38Å; K508-H524 WeakPolarHBondContact CE-NE2 3.32Å; K508-H524 PolarHBondContact NZ-CD2 2.94Å; K508-H524 PolarHBondContact NZ-CE1 3.46Å; K508-H524 PolarHBondContact NZ-ND1 3.33Å; K508-H524 PolarHBondContact NZ-NE2 3.12Å
509	R	84.9	Confident	78.5	Confident	192 Å²	192	78.2 Å²	78.2	73%	0.725	38%	0.383	S	S	*	.	H	α-helix	trans	-55.6	-34.8	175.6	-170.6	-176	-63.6	129.6	-0.9	112.1	I505 S506	I505-R509 WeakPolarHBondContact O-CB 3.46Å; I505-R509 PolarHBondContact O-N 3.27Å; S506-R509 PolarHBondContact O-N 3.27Å
510	K	85.7	Confident	76.8	Confident	126 Å²	126	78.1 Å²	78.1	55%	0.548	38%	0.382	S	S	.	.	H	α-helix	trans	-76.3	-34.3	-179.8	-172.4	170.7	178.7	177.3	0	113.7	E433 S506 L507 K508	E433-K510 IonicContact OE1-NZ 3.79Å; E433-K510 PolarHBondContact OE1-NZ 3.37Å; S506-K510 WeakPolarHBondContact O-CB 3.45Å; S506-K510 PolarHBondContact O-N 2.89Å; L507-K510 PolarHBondContact O-N 3.24Å; K508-K510 PolarHBondContact O-N 3.2Å; K508-K510 VanDerWaalsContact O-N 3.14Å
511	Y	81.4	Confident	75.1	Confident	30 Å²	30	81.1 Å²	81.1	12%	0.118	40%	0.403	C	S	.	.	H	α-helix	trans	-120.2	-13	-167.5	-67.2	-76.1	0	0	0	115.8	L436 K447 L507 K508	L436-Y511 HydrophobicContact CB-CE1 4.24Å; L436-Y511 HydrophobicContact CD1-CD2 3.91Å; L436-Y511 HydrophobicContact CD1-CE2 4.01Å; L436-Y511 HydrophobicContact CD1-CG 4.28Å; K447-Y511 HydrophobicContact CD-CD1 4.03Å; K447-Y511 HydrophobicContact CD-CE1 4.48Å; K447-Y511 HydrophobicContact CG-CD1 4.43Å; L507-Y511 HydrophobicContact CD1-CD2 3.85Å; L507-Y511 HydrophobicContact CD1-CE2 3.9Å; L507-Y511 HydrophobicContact CG-CD2 4.36Å; L507-Y511 VanDerWaalsContact O-CD2 3.3Å; L507-Y511 WeakPolarHBondContact O-CD2 3.33Å; L507-Y511 PolarHBondContact O-N 2.71Å; L507-Y511 VanDerWaalsContact O-N 3.14Å; K508-Y511 PolarHBondContact O-N 3.18Å; K508-Y511 VanDerWaalsContact O-N 3.14Å
512	L	77.8	Confident	73.5	Confident	39 Å²	39	83.8 Å²	83.8	20%	0.204	43%	0.425	C	S	.	.			trans	-93	138.7	178.4	-120.6	115.8	0	0	0	111.7	L451 K508 M516 L520	L451-L512 HydrophobicContact CD2-CD1 3.56Å; L451-L512 HydrophobicContact CD2-CG 4.22Å; L451-L512 HydrophobicContact CG-CD1 4.42Å; K508-L512 HydrophobicContact CB-CD1 4.16Å; K508-L512 HydrophobicContact CD-CD1 4.48Å; K508-L512 HydrophobicContact CG-CD1 3.98Å; K508-L512 VanDerWaalsContact O-CB 3.25Å; K508-L512 WeakPolarHBondContact O-CB 3.37Å; K508-L512 PolarHBondContact O-N 2.64Å; L512-M516 HydrophobicContact CD2-CB 3.98Å; L512-L520 HydrophobicContact CD1-CD1 3.55Å; L512-L520 HydrophobicContact CD2-CD1 3.65Å; L512-L520 HydrophobicContact CG-CD1 4.08Å
513	K	69.4	Low	72	Confident	133 Å²	133	80.6 Å²	80.6	58%	0.578	41%	0.414	S	S	*	.			trans	-89.1	145	167.7	-64.9	179.2	-178.2	174.8	0	109.3	E515 M516	K513-E515 PolarHBondContact O-N 3.29Å; K513-M516 PolarHBondContact O-N 3.44Å; K513-M516 VanDerWaalsContact O-N 3.09Å
514	I	58.8	Low	70.5	Confident	146 Å²	146	81.4 Å²	81.4	75%	0.749	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-52.3	-33.1	-173.7	-61.3	169.8	0	0	0	112.5	M516 E517	I514-M516 VanDerWaalsContact C-N 3.26Å; I514-M516 PolarHBondContact O-N 2.98Å; I514-E517 WeakPolarHBondContact O-CB 3.3Å; I514-E517 PolarHBondContact O-N 2.84Å
515	E	56	Low	69.2	Low	185 Å²	185	86 Å²	86	86%	0.864	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-67.3	-17	-177.6	-63.8	173.8	175.6	0	0	115	K513	K513-E515 PolarHBondContact O-N 3.29Å
516	M	57.9	Low	68.8	Low	78 Å²	78	86.1 Å²	86.1	38%	0.384	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-104.4	5	-179.6	-68.3	178.5	85.1	0	0	113.7	T448 L452 L512 K513 I514 D518	T448-M516 HydrophobicContact CG2-CE 3.62Å; T448-M516 HydrophobicContact CG2-SD 3.6Å; L452-M516 HydrophobicContact CD1-CE 4.48Å; L512-M516 HydrophobicContact CD2-CB 3.98Å; K513-M516 PolarHBondContact O-N 3.44Å; K513-M516 VanDerWaalsContact O-N 3.09Å; I514-M516 VanDerWaalsContact C-N 3.26Å; I514-M516 PolarHBondContact O-N 2.98Å; M516-D518 PolarHBondContact O-N 3.41Å
517	E	58.3	Low	68.7	Low	117 Å²	117	83 Å²	83	55%	0.547	42%	0.422	S	S	.	.	H	α-helix	trans	-67.6	-36.3	-173.4	-156.9	164.4	-164.1	0	0	112.2	I514 T519 L520 S521	I514-E517 WeakPolarHBondContact O-CB 3.3Å; I514-E517 PolarHBondContact O-N 2.84Å; E517-T519 PolarHBondContact O-N 2.89Å; E517-L520 PolarHBondContact O-N 3.17Å; E517-S521 PolarHBondContact O-N 3.15Å; E517-S521 VanDerWaalsContact O-N 3.15Å
518	D	56.9	Low	68.8	Low	143 Å²	143	84.7 Å²	84.7	77%	0.765	43%	0.431	S	S	*	.	H	α-helix	trans	-64.4	-37.2	-178.3	-75.3	-20.6	0	0	0	113.4	M516 L520 S521	M516-D518 PolarHBondContact O-N 3.41Å; D518-L520 VanDerWaalsContact C-N 3.32Å; D518-L520 PolarHBondContact O-N 3.14Å; D518-S521 PolarHBondContact O-OG 3.46Å
519	T	56.2	Low	69.1	Low	120 Å²	120	86.2 Å²	86.2	74%	0.736	45%	0.446	S	S	*	.	H	α-helix	trans	-74.6	-24.2	-178.3	-51	0	0	0	0	112.2	E517	E517-T519 PolarHBondContact O-N 2.89Å
520	L	57.7	Low	69.5	Low	16 Å²	16	78 Å²	78	8%	0.084	42%	0.416	C	S	.	.	H	α-helix	trans	-98.2	-11.6	-176.3	-82.4	155.5	0	0	0	114	L452 L455 L512 E517 D518 S522 S523 H524	L452-L520 HydrophobicContact CD2-CD1 3.71Å; L452-L520 HydrophobicContact CD2-CD2 3.64Å; L452-L520 HydrophobicContact CD2-CG 3.96Å; L455-L520 HydrophobicContact CD1-CD2 4.05Å; L512-L520 HydrophobicContact CD1-CD1 3.55Å; L512-L520 HydrophobicContact CD2-CD1 3.65Å; L512-L520 HydrophobicContact CG-CD1 4.08Å; E517-L520 PolarHBondContact O-N 3.17Å; D518-L520 VanDerWaalsContact C-N 3.32Å; D518-L520 PolarHBondContact O-N 3.14Å; L520-S522 PolarHBondContact O-N 3.46Å; L520-S523 PolarHBondContact O-N 3.29Å; L520-H524 PolarHBondContact O-CD2 2.74Å; L520-H524 PolarHBondContact O-N 2.79Å; L520-H524 VanDerWaalsContact O-N 3.14Å
521	S	59.8	Low	70	Confident	63 Å²	63	72 Å²	72	44%	0.441	39%	0.39	S	S	.	.	H	α-helix	trans	-55	-36.4	177.3	65	0	0	0	0	113.1	E517 D518 H524 T525	E517-S521 PolarHBondContact O-N 3.15Å; E517-S521 VanDerWaalsContact O-N 3.15Å; D518-S521 PolarHBondContact O-OG 3.46Å; S521-H524 WeakPolarHBondContact O-CB 3.39Å; S521-T525 PolarHBondContact O-N 3.2Å; S521-T525 PolarHBondContact O-OG1 3.29Å
522	S	58.5	Low	70.6	Confident	82 Å²	82	72.8 Å²	72.8	57%	0.573	40%	0.397	S	S	*	.	H	α-helix	trans	-75.2	-32	179	62.3	0	0	0	0	114	L520 T525	L520-S522 PolarHBondContact O-N 3.46Å; S522-T525 PolarHBondContact O-OG1 3.39Å
523	S	59.8	Low	71.4	Confident	35 Å²	35	74.2 Å²	74.2	25%	0.245	40%	0.403	C	S	.	.	H	α-helix	trans	-73.6	-32.2	175.3	175.2	0	0	0	0	111.3	L520 M527	L520-S523 PolarHBondContact O-N 3.29Å; S523-M527 WeakPolarHBondContact O-CE 3.09Å; S523-M527 PolarHBondContact O-N 3.28Å
524	H	59.9	Low	72.7	Confident	42 Å²	42	68 Å²	68	19%	0.194	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-51.2	174	-88	-77.9	0	0	0	113.7	K508 L520 S521 N526 M527 D528	K508-H524 WeakPolarHBondContact CD-CE1 3.45Å; K508-H524 WeakPolarHBondContact CD-NE2 3.29Å; K508-H524 WeakPolarHBondContact CE-CE1 3.38Å; K508-H524 WeakPolarHBondContact CE-NE2 3.32Å; K508-H524 PolarHBondContact NZ-CD2 2.94Å; K508-H524 PolarHBondContact NZ-CE1 3.46Å; K508-H524 PolarHBondContact NZ-ND1 3.33Å; K508-H524 PolarHBondContact NZ-NE2 3.12Å; L520-H524 PolarHBondContact O-CD2 2.74Å; L520-H524 PolarHBondContact O-N 2.79Å; L520-H524 VanDerWaalsContact O-N 3.14Å; S521-H524 WeakPolarHBondContact O-CB 3.39Å; H524-N526 PolarHBondContact O-N 3.47Å; H524-M527 PolarHBondContact O-N 2.71Å; H524-M527 VanDerWaalsContact O-N 3.12Å; H524-D528 PolarHBondContact O-N 3.37Å
525	T	64.1	Low	74.4	Confident	98 Å²	98	61.1 Å²	61.1	60%	0.601	34%	0.341	S	S	*	.	H	α-helix	trans	-59.3	-32.7	-179.4	49.2	0	0	0	0	111.2	S521 S522 A529	S521-T525 PolarHBondContact O-N 3.2Å; S521-T525 PolarHBondContact O-OG1 3.29Å; S522-T525 PolarHBondContact O-OG1 3.39Å; T525-A529 WeakPolarHBondContact O-CB 3.42Å; T525-A529 PolarHBondContact O-N 2.86Å; T525-A529 VanDerWaalsContact O-N 3.1Å
526	N	80.7	Confident	76.2	Confident	77 Å²	77	58.4 Å²	58.4	41%	0.412	33%	0.327	S	S	.	.	H	α-helix	trans	-69	-47.7	174.3	-164	19.1	0	0	0	113	N459 H524 A529 I530	N459-N526 PolarHBondContact ND2-ND2 3.3Å; H524-N526 PolarHBondContact O-N 3.47Å; N526-A529 PolarHBondContact O-N 3.19Å; N526-I530 WeakPolarHBondContact O-CG1 3.39Å; N526-I530 PolarHBondContact O-N 3.34Å
527	M	87.9	Confident	78	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-43.1	179.5	-73.3	-176.6	-78	0	0	112.4	L455 M458 N459 L462 I504 S523 H524 A529 I530 L531	L455-M527 HydrophobicContact CD2-CE 4.46Å; M458-M527 HydrophobicContact CB-SD 4.33Å; M458-M527 HydrophobicContact CG-SD 4.21Å; N459-M527 HydrophobicContact CB-CG 4.05Å; N459-M527 HydrophobicContact CB-SD 4.35Å; N459-M527 WeakPolarHBondContact OD1-CG 3.07Å; L462-M527 HydrophobicContact CD1-CB 4.04Å; L462-M527 HydrophobicContact CD1-CG 4.06Å; I504-M527 HydrophobicContact CD1-CB 4.42Å; I504-M527 HydrophobicContact CD1-SD 4.15Å; I504-M527 HydrophobicContact CG2-CE 4.5Å; S523-M527 WeakPolarHBondContact O-CE 3.09Å; S523-M527 PolarHBondContact O-N 3.28Å; H524-M527 PolarHBondContact O-N 2.71Å; H524-M527 VanDerWaalsContact O-N 3.12Å; M527-A529 VanDerWaalsContact C-N 3.31Å; M527-A529 PolarHBondContact O-N 2.93Å; M527-I530 PolarHBondContact O-N 3.21Å; M527-L531 WeakPolarHBondContact O-CG 3.27Å; M527-L531 PolarHBondContact O-N 2.91Å
528	D	88.6	Confident	79.7	Confident	45 Å²	45	52.8 Å²	52.8	24%	0.241	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-39.2	177.2	-74.2	-27.7	0	0	0	111.4	H524 L531 D532	H524-D528 PolarHBondContact O-N 3.37Å; D528-L531 PolarHBondContact O-N 2.68Å; D528-D532 WeakPolarHBondContact O-CB 3.4Å; D528-D532 PolarHBondContact O-N 3.15Å
529	A	90.9	Very high	81.6	Confident	43 Å²	43	46.4 Å²	46.4	36%	0.355	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-45.2	175.4	0	0	0	0	0	112.1	T525 N526 M527 L531 D532 I533	T525-A529 WeakPolarHBondContact O-CB 3.42Å; T525-A529 PolarHBondContact O-N 2.86Å; T525-A529 VanDerWaalsContact O-N 3.1Å; N526-A529 PolarHBondContact O-N 3.19Å; M527-A529 VanDerWaalsContact C-N 3.31Å; M527-A529 PolarHBondContact O-N 2.93Å; A529-L531 PolarHBondContact O-N 2.77Å; A529-D532 PolarHBondContact O-N 2.99Å; A529-I533 WeakPolarHBondContact O-CB 3.46Å; A529-I533 WeakPolarHBondContact O-CD1 2.82Å; A529-I533 WeakPolarHBondContact O-CG1 3.1Å; A529-I533 PolarHBondContact O-N 3.18Å
530	I	93.5	Very high	83.4	Confident	20 Å²	20	42.3 Å²	42.3	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-47.1	176.8	-67.2	166.6	0	0	0	110.3	L462 N526 M527 D532 I533 I534	L462-I530 HydrophobicContact CB-CG2 3.99Å; N526-I530 WeakPolarHBondContact O-CG1 3.39Å; N526-I530 PolarHBondContact O-N 3.34Å; M527-I530 PolarHBondContact O-N 3.21Å; I530-D532 VanDerWaalsContact C-N 3.34Å; I530-D532 PolarHBondContact O-N 3.43Å; I530-I533 WeakPolarHBondContact O-CB 3.48Å; I530-I533 PolarHBondContact O-N 3.4Å; I530-I533 VanDerWaalsContact O-N 3.17Å; I530-I534 HydrophobicContact CG2-CD1 4Å; I530-I534 HydrophobicContact CG2-CG1 4.47Å; I530-I534 VanDerWaalsContact O-CG1 3.31Å; I530-I534 WeakPolarHBondContact O-CG1 3.36Å; I530-I534 PolarHBondContact O-N 3.36Å
531	L	95.3	Very high	85.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-40.4	178.6	-72.8	172	0	0	0	112.4	L462 C497 F500 K501 I504 M527 D528 A529 I533 I534 A535	L462-L531 HydrophobicContact CD1-CD1 4.05Å; L462-L531 HydrophobicContact CD1-CD2 4.2Å; L462-L531 HydrophobicContact CD1-CG 3.93Å; L462-L531 HydrophobicContact CD2-CD2 3.49Å; L462-L531 VanDerWaalsContact CD2-CD2 3.49Å; L462-L531 HydrophobicContact CD2-CG 4.18Å; L462-L531 HydrophobicContact CG-CD2 4.42Å; C497-L531 HydrophobicContact CB-CB 4.31Å; C497-L531 HydrophobicContact CB-CD2 4.07Å; F500-L531 HydrophobicContact CB-CD1 3.84Å; F500-L531 HydrophobicContact CB-CD2 4.05Å; F500-L531 HydrophobicContact CD2-CD2 4.13Å; F500-L531 HydrophobicContact CG-CD2 4.48Å; K501-L531 HydrophobicContact CG-CB 4.29Å; K501-L531 HydrophobicContact CG-CD1 3.61Å; I504-L531 HydrophobicContact CD1-CD1 4.21Å; M527-L531 WeakPolarHBondContact O-CG 3.27Å; M527-L531 PolarHBondContact O-N 2.91Å; D528-L531 PolarHBondContact O-N 2.68Å; A529-L531 PolarHBondContact O-N 2.77Å; L531-I533 VanDerWaalsContact C-N 3.35Å; L531-I534 PolarHBondContact O-N 2.99Å; L531-A535 WeakPolarHBondContact O-CB 3.39Å; L531-A535 PolarHBondContact O-N 3.15Å
532	D	94.3	Very high	86.8	Confident	46 Å²	46	38.8 Å²	38.8	25%	0.246	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-35.2	174.3	-80.9	-31.4	0	0	0	113.2	K501 D528 A529 I530 K536 Y590	K501-D532 IonicContact NZ-OD1 3.73Å; K501-D532 PolarHBondContact NZ-OD1 3Å; K501-D532 IonicContact NZ-OD2 2.61Å; K501-D532 PolarHBondContact NZ-OD2 3.26Å; D528-D532 WeakPolarHBondContact O-CB 3.4Å; D528-D532 PolarHBondContact O-N 3.15Å; A529-D532 PolarHBondContact O-N 2.99Å; I530-D532 VanDerWaalsContact C-N 3.34Å; I530-D532 PolarHBondContact O-N 3.43Å; D532-K536 VanDerWaalsContact O-CB 3.25Å; D532-K536 WeakPolarHBondContact O-CB 3.44Å; D532-K536 WeakPolarHBondContact O-CG 3.38Å; D532-K536 PolarHBondContact O-N 3.35Å; D532-Y590 WeakPolarHBondContact OD1-CE1 3.34Å; D532-Y590 PolarHBondContact OD1-OH 2.91Å
533	I	94.8	Very high	88.5	Confident	68 Å²	68	35 Å²	35	35%	0.349	19%	0.193	S	C	.	.	H	α-helix	trans	-63.4	-48.7	174.7	-71.1	162.9	0	0	0	109.7	K466 A529 I530 L531 A535 K536 E537	K466-I533 HydrophobicContact CD-CG2 4.22Å; K466-I533 VanDerWaalsContact NZ-CG2 3.29Å; A529-I533 WeakPolarHBondContact O-CB 3.46Å; A529-I533 WeakPolarHBondContact O-CD1 2.82Å; A529-I533 WeakPolarHBondContact O-CG1 3.1Å; A529-I533 PolarHBondContact O-N 3.18Å; I530-I533 WeakPolarHBondContact O-CB 3.48Å; I530-I533 PolarHBondContact O-N 3.4Å; I530-I533 VanDerWaalsContact O-N 3.17Å; L531-I533 VanDerWaalsContact C-N 3.35Å; I533-A535 PolarHBondContact O-N 3.49Å; I533-K536 PolarHBondContact O-N 2.81Å; I533-E537 HydrophobicContact CG2-CG 4.26Å; I533-E537 WeakPolarHBondContact CG2-OE1 3.27Å; I533-E537 WeakPolarHBondContact O-CB 3.48Å; I533-E537 WeakPolarHBondContact O-CG 3.44Å; I533-E537 PolarHBondContact O-N 3.05Å
534	I	95.8	Very high	90.1	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-49.2	178.1	-62.7	169.3	0	0	0	110.6	Y465 K466 A469 I493 I530 L531 K536 E537 G538	Y465-I534 HydrophobicContact CD1-CD1 3.75Å; Y465-I534 HydrophobicContact CE1-CD1 4.46Å; Y465-I534 HydrophobicContact CE1-CG2 4.38Å; K466-I534 HydrophobicContact CB-CD1 3.73Å; K466-I534 HydrophobicContact CB-CG1 3.62Å; K466-I534 HydrophobicContact CG-CD1 4.46Å; K466-I534 HydrophobicContact CG-CG1 3.79Å; A469-I534 HydrophobicContact CB-CG2 4.39Å; I493-I534 HydrophobicContact CG2-CG2 4.1Å; I530-I534 HydrophobicContact CG2-CD1 4Å; I530-I534 HydrophobicContact CG2-CG1 4.47Å; I530-I534 VanDerWaalsContact O-CG1 3.31Å; I530-I534 WeakPolarHBondContact O-CG1 3.36Å; I530-I534 PolarHBondContact O-N 3.36Å; L531-I534 PolarHBondContact O-N 2.99Å; I534-K536 PolarHBondContact O-N 3.44Å; I534-E537 PolarHBondContact O-N 3.24Å; I534-G538 PolarHBondContact O-N 3.15Å
535	A	95.8	Very high	91.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-40.4	-179.6	0	0	0	0	0	112.5	I494 C497 L531 I533 G538 C539 Y590	I494-A535 HydrophobicContact CG2-CB 4.22Å; C497-A535 HydrophobicContact CB-CB 4.15Å; L531-A535 WeakPolarHBondContact O-CB 3.39Å; L531-A535 PolarHBondContact O-N 3.15Å; I533-A535 PolarHBondContact O-N 3.49Å; A535-G538 PolarHBondContact O-N 3.45Å; A535-C539 WeakPolarHBondContact O-CB 3.42Å; A535-C539 PolarHBondContact O-N 3.34Å; A535-C539 PolarHBondContact O-SG 3.49Å; A535-Y590 HydrophobicContact CB-CD1 3.62Å; A535-Y590 HydrophobicContact CB-CD2 4.05Å; A535-Y590 HydrophobicContact CB-CE1 3.33Å; A535-Y590 HydrophobicContact CB-CE2 3.77Å; A535-Y590 HydrophobicContact CB-CG 3.98Å; A535-Y590 VanDerWaalsContact CB-CZ 3.41Å
536	K	94.3	Very high	93.1	Very high	128 Å²	128	29.4 Å²	29.4	56%	0.557	16%	0.158	S	C	*	.	H	α-helix	trans	-67.2	-43.8	176.5	-76	173.2	-178.4	177.7	0	112.4	D532 I533 I534 G538 C539 S540	D532-K536 VanDerWaalsContact O-CB 3.25Å; D532-K536 WeakPolarHBondContact O-CB 3.44Å; D532-K536 WeakPolarHBondContact O-CG 3.38Å; D532-K536 PolarHBondContact O-N 3.35Å; I533-K536 PolarHBondContact O-N 2.81Å; I534-K536 PolarHBondContact O-N 3.44Å; K536-G538 VanDerWaalsContact C-N 3.32Å; K536-C539 PolarHBondContact O-N 2.97Å; K536-S540 WeakPolarHBondContact O-CB 3.34Å; K536-S540 PolarHBondContact O-N 3.37Å
537	E	94.5	Very high	93.8	Very high	72 Å²	72	27 Å²	27	34%	0.336	14%	0.144	S	C	.	.	H	α-helix	trans	-63.3	-40.5	175.6	-73.4	172.5	-176.1	0	0	110.5	K466 I533 I534 S540 S541	K466-E537 VanDerWaalsContact CE-OE1 3.29Å; K466-E537 WeakPolarHBondContact CE-OE1 3.32Å; K466-E537 WeakPolarHBondContact CE-OE2 3.49Å; K466-E537 IonicContact NZ-OE1 3.24Å; K466-E537 PolarHBondContact NZ-OE1 3.49Å; K466-E537 IonicContact NZ-OE2 3.17Å; I533-E537 HydrophobicContact CG2-CG 4.26Å; I533-E537 WeakPolarHBondContact CG2-OE1 3.27Å; I533-E537 WeakPolarHBondContact O-CB 3.48Å; I533-E537 WeakPolarHBondContact O-CG 3.44Å; I533-E537 PolarHBondContact O-N 3.05Å; I534-E537 PolarHBondContact O-N 3.24Å; E537-S540 PolarHBondContact O-N 2.93Å; E537-S541 WeakPolarHBondContact O-CB 3.43Å; E537-S541 PolarHBondContact O-N 3.4Å; E537-S541 PolarHBondContact O-OG 3.28Å
538	G	95.3	Very high	94	Very high	5 Å²	5	29.8 Å²	29.8	5%	0.052	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-50.6	172.9	0	0	0	0	0	112.7	I534 A535 K536 S540 S541 L542	I534-G538 PolarHBondContact O-N 3.15Å; A535-G538 PolarHBondContact O-N 3.45Å; K536-G538 VanDerWaalsContact C-N 3.32Å; G538-S540 VanDerWaalsContact C-N 3.32Å; G538-S540 PolarHBondContact O-N 3.44Å; G538-S541 WeakPolarHBondContact O-CB 3.49Å; G538-S541 PolarHBondContact O-N 3.35Å; G538-L542 PolarHBondContact O-N 2.95Å
539	C	95.1	Very high	94.2	Very high	10 Å²	10	30.3 Å²	30.3	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-43.7	174.7	-74.6	0	0	0	0	111.8	A535 K536 S541 L542 L543 M594	A535-C539 WeakPolarHBondContact O-CB 3.42Å; A535-C539 PolarHBondContact O-N 3.34Å; A535-C539 PolarHBondContact O-SG 3.49Å; K536-C539 PolarHBondContact O-N 2.97Å; C539-S541 VanDerWaalsContact C-N 3.28Å; C539-S541 PolarHBondContact O-N 3.47Å; C539-L542 PolarHBondContact O-N 3.4Å; C539-L543 WeakPolarHBondContact O-CG 3.31Å; C539-L543 PolarHBondContact O-N 2.95Å; C539-M594 HydrophobicContact CB-CB 4.24Å; C539-M594 HydrophobicContact CB-CG 4.14Å
540	S	93.9	Very high	94.4	Very high	34 Å²	34	28.2 Å²	28.2	24%	0.238	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-41.6	175.2	-174.2	0	0	0	0	111.1	K536 E537 G538 L542 L543 D544 R601	K536-S540 WeakPolarHBondContact O-CB 3.34Å; K536-S540 PolarHBondContact O-N 3.37Å; E537-S540 PolarHBondContact O-N 2.93Å; G538-S540 VanDerWaalsContact C-N 3.32Å; G538-S540 PolarHBondContact O-N 3.44Å; S540-L542 PolarHBondContact O-N 3.2Å; S540-L543 CarbonylContact O-C 3.58Å; S540-L543 PolarHBondContact O-N 2.97Å; S540-D544 PolarHBondContact O-N 3.29Å; S540-R601 PolarHBondContact OG-NH2 3.07Å
541	S	93.7	Very high	94.4	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	16%	0.164	C	C	.	.	H	α-helix	trans	-66.2	-37	-179.1	-53.9	0	0	0	0	112.6	K473 E537 G538 C539 D544 E545	K473-S541 WeakPolarHBondContact CD-OG 3.5Å; K473-S541 VanDerWaalsContact CE-OG 3.26Å; K473-S541 WeakPolarHBondContact CE-OG 3.43Å; K473-S541 PolarHBondContact NZ-OG 2.85Å; E537-S541 WeakPolarHBondContact O-CB 3.43Å; E537-S541 PolarHBondContact O-N 3.4Å; E537-S541 PolarHBondContact O-OG 3.28Å; G538-S541 WeakPolarHBondContact O-CB 3.49Å; G538-S541 PolarHBondContact O-N 3.35Å; C539-S541 VanDerWaalsContact C-N 3.28Å; C539-S541 PolarHBondContact O-N 3.47Å; S541-D544 PolarHBondContact O-N 3.43Å; S541-E545 PolarHBondContact O-N 3.29Å
542	L	95.3	Very high	94.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.3	-41.2	171.4	-70.6	179.3	0	0	0	111.7	V487 M490 I491 I494 G538 C539 S540 D544 E545 V546 F583 I586	V487-L542 HydrophobicContact CB-CD2 4.35Å; V487-L542 HydrophobicContact CG1-CD2 4.13Å; V487-L542 HydrophobicContact CG2-CD2 4.3Å; M490-L542 HydrophobicContact CB-CD2 3.84Å; M490-L542 HydrophobicContact CB-CG 4.31Å; M490-L542 HydrophobicContact CG-CD1 4.24Å; M490-L542 HydrophobicContact CG-CD2 3.79Å; M490-L542 HydrophobicContact CG-CG 3.75Å; I491-L542 HydrophobicContact CG1-CD1 3.82Å; I494-L542 HydrophobicContact CD1-CD1 3.64Å; I494-L542 HydrophobicContact CD1-CG 4.47Å; G538-L542 PolarHBondContact O-N 2.95Å; C539-L542 PolarHBondContact O-N 3.4Å; S540-L542 PolarHBondContact O-N 3.2Å; L542-D544 VanDerWaalsContact C-N 3.34Å; L542-E545 WeakPolarHBondContact O-CB 3.45Å; L542-E545 PolarHBondContact O-N 3.23Å; L542-V546 WeakPolarHBondContact O-CG2 3.43Å; L542-V546 PolarHBondContact O-N 3.11Å; L542-F583 HydrophobicContact CB-CE1 4.13Å; L542-F583 HydrophobicContact CB-CE2 4.35Å; L542-F583 HydrophobicContact CB-CZ 3.82Å; L542-F583 HydrophobicContact CD1-CD1 4.33Å; L542-F583 HydrophobicContact CD1-CE1 4.2Å; L542-F583 HydrophobicContact CD2-CE1 4.1Å; L542-F583 HydrophobicContact CG-CE1 4.38Å; L542-I586 HydrophobicContact CD1-CD1 3.98Å
543	L	95.1	Very high	94.2	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-37.6	174.3	-67.5	179.7	0	0	0	111.7	C539 S540 E545 V546 F547 F580 M594 E597 A598	C539-L543 WeakPolarHBondContact O-CG 3.31Å; C539-L543 PolarHBondContact O-N 2.95Å; S540-L543 CarbonylContact O-C 3.58Å; S540-L543 PolarHBondContact O-N 2.97Å; L543-E545 PolarHBondContact O-N 2.92Å; L543-V546 WeakPolarHBondContact O-CB 3.41Å; L543-V546 PolarHBondContact O-N 3.42Å; L543-V546 VanDerWaalsContact O-N 3.07Å; L543-F547 HydrophobicContact CB-CD2 4.49Å; L543-F547 VanDerWaalsContact O-CD2 3.29Å; L543-F547 WeakPolarHBondContact O-CD2 3.23Å; L543-F547 PolarHBondContact O-N 2.97Å; L543-F580 HydrophobicContact CD2-CE2 4.23Å; L543-F580 HydrophobicContact CD2-CZ 4.28Å; L543-M594 HydrophobicContact CD1-CG 4.12Å; L543-M594 HydrophobicContact CD2-CG 4.05Å; L543-M594 HydrophobicContact CG-CG 4.03Å; L543-E597 HydrophobicContact CD1-CB 4.05Å; L543-E597 HydrophobicContact CD1-CG 3.78Å; L543-A598 HydrophobicContact CD1-CB 4.34Å; L543-A598 HydrophobicContact CD2-CB 3.69Å
544	D	93.6	Very high	94	Very high	46 Å²	46	34.7 Å²	34.7	25%	0.246	18%	0.178	C	C	.	.	H	α-helix	trans	-57.3	-39.8	176.8	-59.3	-20.3	0	0	0	110.4	K473 S540 S541 L542 F547 M548 R601	K473-D544 IonicContact NZ-OD2 3.01Å; K473-D544 PolarHBondContact NZ-OD2 3.2Å; S540-D544 PolarHBondContact O-N 3.29Å; S541-D544 PolarHBondContact O-N 3.43Å; L542-D544 VanDerWaalsContact C-N 3.34Å; D544-F547 PolarHBondContact O-N 3.17Å; D544-M548 WeakPolarHBondContact O-CB 3.45Å; D544-M548 WeakPolarHBondContact O-CE 3.35Å; D544-M548 VanDerWaalsContact O-CG 3.31Å; D544-M548 WeakPolarHBondContact O-CG 3.47Å; D544-M548 PolarHBondContact O-N 2.88Å; D544-R601 IonicContact OD1-CZ 3.63Å; D544-R601 IonicContact OD1-NH1 3.72Å; D544-R601 PolarHBondContact OD1-NH1 3.46Å
545	E	92.6	Very high	93.8	Very high	10 Å²	10	38.1 Å²	38.1	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-48.5	172.2	-73.6	-58.7	126.1	0	0	112.5	H476 R480 Y486 S541 L542 L543 F547 M548 D549	H476-E545 IonicContact CD2-OE1 3.49Å; H476-E545 PolarHBondContact CD2-OE1 3.33Å; H476-E545 IonicContact NE2-OE1 2.97Å; H476-E545 PolarHBondContact NE2-OE1 2.98Å; H476-E545 IonicContact NE2-OE2 3.62Å; R480-E545 IonicContact CZ-OE2 3.36Å; R480-E545 VanDerWaalsContact CZ-OE2 3.27Å; R480-E545 IonicContact NE-OE1 3.64Å; R480-E545 IonicContact NE-OE2 2.7Å; R480-E545 PolarHBondContact NE-OE2 3.48Å; R480-E545 IonicContact NH2-OE2 2.77Å; R480-E545 PolarHBondContact NH2-OE2 3.21Å; Y486-E545 HydrophobicContact CD1-CG 4.43Å; Y486-E545 HydrophobicContact CE1-CG 3.99Å; S541-E545 PolarHBondContact O-N 3.29Å; L542-E545 WeakPolarHBondContact O-CB 3.45Å; L542-E545 PolarHBondContact O-N 3.23Å; L543-E545 PolarHBondContact O-N 2.92Å; E545-F547 VanDerWaalsContact C-N 3.35Å; E545-F547 PolarHBondContact O-N 3.44Å; E545-M548 HydrophobicContact CG-CE 4.46Å; E545-M548 PolarHBondContact O-N 3Å; E545-M548 WeakPolarHBondContact OE1-CE 3.44Å; E545-D549 PolarHBondContact O-N 3.49Å
546	V	94.5	Very high	93.6	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-48.9	177.4	-175.1	0	0	0	0	110.4	L542 L543 M548 D549 L550 V576 Y579 F583	L542-V546 WeakPolarHBondContact O-CG2 3.43Å; L542-V546 PolarHBondContact O-N 3.11Å; L543-V546 WeakPolarHBondContact O-CB 3.41Å; L543-V546 PolarHBondContact O-N 3.42Å; L543-V546 VanDerWaalsContact O-N 3.07Å; V546-M548 PolarHBondContact O-N 3.43Å; V546-D549 PolarHBondContact O-N 3.45Å; V546-L550 HydrophobicContact CG1-CD1 3.84Å; V546-L550 HydrophobicContact CG1-CG 4.22Å; V546-L550 VanDerWaalsContact O-CG 3.24Å; V546-L550 WeakPolarHBondContact O-CG 3.47Å; V546-L550 PolarHBondContact O-N 3.5Å; V546-V576 HydrophobicContact CG1-CG2 4.18Å; V546-Y579 HydrophobicContact CB-CD2 4.32Å; V546-Y579 HydrophobicContact CG1-CD2 4Å; V546-Y579 HydrophobicContact CG1-CG 4.46Å; V546-Y579 HydrophobicContact CG2-CD1 3.9Å; V546-Y579 HydrophobicContact CG2-CD2 3.87Å; V546-Y579 HydrophobicContact CG2-CE1 4.47Å; V546-Y579 HydrophobicContact CG2-CE2 4.48Å; V546-Y579 HydrophobicContact CG2-CG 3.58Å; V546-F583 HydrophobicContact CG2-CE2 3.8Å; V546-F583 HydrophobicContact CG2-CZ 3.85Å
547	F	94.3	Very high	93.5	Very high	26 Å²	26	33.3 Å²	33.3	11%	0.114	18%	0.176	C	C	.	.	H	α-helix	trans	-71.9	-28	-174.6	-82.5	-91.1	0	0	0	113.7	L543 D544 E545 D549 L550 E551 L554 R601 V602 E605	L543-F547 HydrophobicContact CB-CD2 4.49Å; L543-F547 VanDerWaalsContact O-CD2 3.29Å; L543-F547 WeakPolarHBondContact O-CD2 3.23Å; L543-F547 PolarHBondContact O-N 2.97Å; D544-F547 PolarHBondContact O-N 3.17Å; E545-F547 VanDerWaalsContact C-N 3.35Å; E545-F547 PolarHBondContact O-N 3.44Å; F547-D549 VanDerWaalsContact C-N 3.33Å; F547-L550 HydrophobicContact CD1-CD1 4.49Å; F547-L550 PolarHBondContact O-N 2.97Å; F547-E551 PolarHBondContact O-N 3.33Å; F547-L554 HydrophobicContact CD1-CD1 3.92Å; F547-L554 HydrophobicContact CE1-CD1 4.38Å; F547-R601 HydrophobicContact CE1-CB 3.8Å; F547-R601 HydrophobicContact CE2-CB 3.68Å; F547-R601 HydrophobicContact CE2-CG 4.44Å; F547-R601 HydrophobicContact CZ-CB 3.21Å; F547-R601 HydrophobicContact CZ-CG 4.37Å; F547-V602 HydrophobicContact CE1-CG2 4.16Å; F547-V602 HydrophobicContact CZ-CG2 3.7Å; F547-E605 HydrophobicContact CD1-CG 4.14Å; F547-E605 HydrophobicContact CE1-CG 3.92Å
548	M	93	Very high	93.3	Very high	60 Å²	60	30 Å²	30	30%	0.296	16%	0.16	S	C	.	.	H	α-helix	trans	-62.9	-39.9	170.1	-77.2	-172.7	-74.8	0	0	111.6	L477 D544 E545 V546 E551	L477-M548 HydrophobicContact CD2-CE 3.77Å; D544-M548 WeakPolarHBondContact O-CB 3.45Å; D544-M548 WeakPolarHBondContact O-CE 3.35Å; D544-M548 VanDerWaalsContact O-CG 3.31Å; D544-M548 WeakPolarHBondContact O-CG 3.47Å; D544-M548 PolarHBondContact O-N 2.88Å; E545-M548 HydrophobicContact CG-CE 4.46Å; E545-M548 PolarHBondContact O-N 3Å; E545-M548 WeakPolarHBondContact OE1-CE 3.44Å; V546-M548 PolarHBondContact O-N 3.43Å; M548-E551 WeakPolarHBondContact O-CB 3.17Å; M548-E551 PolarHBondContact O-N 2.9Å
549	D	93.1	Very high	93.1	Very high	56 Å²	56	31.6 Å²	31.6	30%	0.299	17%	0.17	S	C	.	.	H	α-helix	trans	-78.9	-24.2	178.7	-65.3	-24.9	0	0	0	112.8	R480 E545 V546 F547 P552 Y579	R480-D549 IonicContact CZ-OD1 3.18Å; R480-D549 VanDerWaalsContact CZ-OD1 3.31Å; R480-D549 IonicContact NH1-OD1 3.59Å; R480-D549 PolarHBondContact NH1-OD1 3.34Å; R480-D549 IonicContact NH2-OD1 3.38Å; R480-D549 PolarHBondContact NH2-OD1 3.01Å; R480-D549 IonicContact NH2-OD2 2.65Å; R480-D549 PolarHBondContact NH2-OD2 3.43Å; E545-D549 PolarHBondContact O-N 3.49Å; V546-D549 PolarHBondContact O-N 3.45Å; F547-D549 VanDerWaalsContact C-N 3.33Å; D549-P552 WeakPolarHBondContact O-CD 3.45Å; D549-Y579 PolarHBondContact OD2-OH 3.34Å
550	L	94.3	Very high	92.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-78.5	-18.4	172	-66.1	178.9	0	0	0	113.8	V546 F547 P552 H553 L554 I572 T575 V576	V546-L550 HydrophobicContact CG1-CD1 3.84Å; V546-L550 HydrophobicContact CG1-CG 4.22Å; V546-L550 VanDerWaalsContact O-CG 3.24Å; V546-L550 WeakPolarHBondContact O-CG 3.47Å; V546-L550 PolarHBondContact O-N 3.5Å; F547-L550 HydrophobicContact CD1-CD1 4.49Å; F547-L550 PolarHBondContact O-N 2.97Å; L550-P552 VanDerWaalsContact C-CD 3.43Å; L550-H553 PolarHBondContact O-N 3.46Å; L550-L554 HydrophobicContact CB-CD1 3.82Å; L550-L554 HydrophobicContact CB-CG 4.09Å; L550-L554 WeakPolarHBondContact O-CG 3.38Å; L550-L554 PolarHBondContact O-N 3.04Å; L550-I572 HydrophobicContact CD1-CG2 4.18Å; L550-I572 HydrophobicContact CD2-CB 4.17Å; L550-I572 HydrophobicContact CD2-CG1 4.06Å; L550-I572 HydrophobicContact CD2-CG2 4.15Å; L550-T575 HydrophobicContact CD2-CG2 3.76Å; L550-T575 HydrophobicContact CG-CG2 4.48Å; L550-V576 HydrophobicContact CD1-CG2 3.72Å
551	E	93.4	Very high	92.5	Very high	113 Å²	113	43.1 Å²	43.1	53%	0.528	21%	0.214	S	C	.	.	H	α-helix	trans	-50.5	-44.4	-173	-177.6	177.8	-169.5	0	0	114.1	F547 M548 H553 L554 N555	F547-E551 PolarHBondContact O-N 3.33Å; M548-E551 WeakPolarHBondContact O-CB 3.17Å; M548-E551 PolarHBondContact O-N 2.9Å; E551-H553 VanDerWaalsContact C-N 3.29Å; E551-H553 PolarHBondContact O-N 3.3Å; E551-L554 PolarHBondContact O-N 3.04Å; E551-N555 WeakPolarHBondContact CG-ND2 3.25Å; E551-N555 VanDerWaalsContact O-CB 3.31Å; E551-N555 WeakPolarHBondContact O-CB 3.19Å; E551-N555 PolarHBondContact O-N 3.49Å; E551-N555 PolarHBondContact O-ND2 3.18Å; E551-N555 VanDerWaalsContact O-ND2 3.12Å
552	P	92.1	Very high	92.5	Very high	84 Å²	84	42.9 Å²	42.9	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-61.3	-36.9	178.1	-23	34.8	0	0	0	113.1	D549 L550	D549-P552 WeakPolarHBondContact O-CD 3.45Å; L550-P552 VanDerWaalsContact C-CD 3.43Å
553	H	93.3	Very high	92.1	Very high	57 Å²	57	44 Å²	44	26%	0.264	22%	0.218	S	C	.	.	H	α-helix	trans	-80.2	-38.6	-178.9	-58.9	-53.2	0	0	0	111.8	L550 E551 N555 E556 A568 T571 I572	L550-H553 PolarHBondContact O-N 3.46Å; E551-H553 VanDerWaalsContact C-N 3.29Å; E551-H553 PolarHBondContact O-N 3.3Å; H553-N555 VanDerWaalsContact C-N 3.26Å; H553-N555 PolarHBondContact O-N 2.93Å; H553-E556 WeakPolarHBondContact O-CB 3.46Å; H553-E556 PolarHBondContact O-N 3.36Å; H553-A568 HydrophobicContact CB-CB 4.41Å; H553-T571 WeakPolarHBondContact NE2-CG2 3.43Å; H553-I572 HydrophobicContact CB-CD1 4.2Å; H553-I572 HydrophobicContact CB-CG1 3.86Å
554	L	92.2	Very high	91.7	Very high	16 Å²	16	51.8 Å²	51.8	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-38.3	172.1	-67.8	170.8	0	0	0	111.2	F547 L550 E551 E556 L557 I572 E605	F547-L554 HydrophobicContact CD1-CD1 3.92Å; F547-L554 HydrophobicContact CE1-CD1 4.38Å; L550-L554 HydrophobicContact CB-CD1 3.82Å; L550-L554 HydrophobicContact CB-CG 4.09Å; L550-L554 WeakPolarHBondContact O-CG 3.38Å; L550-L554 PolarHBondContact O-N 3.04Å; E551-L554 PolarHBondContact O-N 3.04Å; L554-E556 PolarHBondContact O-N 3.49Å; L554-L557 HydrophobicContact CD2-CD1 4.03Å; L554-L557 WeakPolarHBondContact O-CB 2.93Å; L554-L557 WeakPolarHBondContact O-CG 3.43Å; L554-L557 PolarHBondContact O-N 3.42Å; L554-I572 HydrophobicContact CD2-CD1 3.77Å; L554-I572 HydrophobicContact CD2-CG1 4.48Å; L554-I572 HydrophobicContact CG-CD1 4.35Å; L554-E605 HydrophobicContact CD1-CB 4.29Å; L554-E605 HydrophobicContact CD1-CG 4Å; L554-E605 HydrophobicContact CD2-CB 3.88Å; L554-E605 HydrophobicContact CD2-CG 4.46Å
555	N	90.6	Very high	91.3	Very high	76 Å²	76	52.2 Å²	52.2	41%	0.406	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.2	177.8	-87	-46.1	0	0	0	114.6	E551 H553 K613	E551-N555 WeakPolarHBondContact CG-ND2 3.25Å; E551-N555 VanDerWaalsContact O-CB 3.31Å; E551-N555 WeakPolarHBondContact O-CB 3.19Å; E551-N555 PolarHBondContact O-N 3.49Å; E551-N555 PolarHBondContact O-ND2 3.18Å; E551-N555 VanDerWaalsContact O-ND2 3.12Å; H553-N555 VanDerWaalsContact C-N 3.26Å; H553-N555 PolarHBondContact O-N 2.93Å; N555-K613 PolarHBondContact O-NZ 3.41Å; N555-K613 VanDerWaalsContact O-NZ 3.15Å; N555-K613 PolarHBondContact OD1-NZ 2.74Å
556	E	91.3	Very high	91.1	Very high	27 Å²	27	52.6 Å²	52.6	13%	0.126	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-23.5	176.5	-173.1	165.9	163.6	0	0	112.5	H553 L554 T559 K561 W562 S566 A568	H553-E556 WeakPolarHBondContact O-CB 3.46Å; H553-E556 PolarHBondContact O-N 3.36Å; L554-E556 PolarHBondContact O-N 3.49Å; E556-T559 WeakPolarHBondContact O-CB 3.16Å; E556-T559 VanDerWaalsContact O-CG2 3.29Å; E556-T559 WeakPolarHBondContact O-CG2 3.42Å; E556-T559 PolarHBondContact O-N 3.11Å; E556-T559 PolarHBondContact O-OG1 2.92Å; E556-K561 HydrophobicContact CG-CB 4.5Å; E556-K561 HydrophobicContact CG-CD 4.16Å; E556-K561 HydrophobicContact CG-CG 4.48Å; E556-K561 WeakPolarHBondContact OE1-CD 3.47Å; E556-K561 WeakPolarHBondContact OE1-CE 3.3Å; E556-K561 WeakPolarHBondContact OE1-CG 3.11Å; E556-K561 IonicContact OE1-NZ 3.44Å; E556-K561 PolarHBondContact OE1-NZ 3.1Å; E556-K561 IonicContact OE2-NZ 3.63Å; E556-K561 PolarHBondContact OE2-NZ 3.48Å; E556-W562 VanDerWaalsContact O-CB 3.26Å; E556-W562 WeakPolarHBondContact O-CB 3.09Å; E556-S566 WeakPolarHBondContact OE1-CB 3.34Å; E556-S566 PolarHBondContact OE1-OG 3Å; E556-A568 HydrophobicContact CB-CB 4.23Å; E556-A568 HydrophobicContact CG-CB 4.38Å
557	L	92.2	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	143.8	177.8	-58.4	177.3	0	0	0	111.4	L554 T559 A568 V569 I572 Y606 A609	L554-L557 HydrophobicContact CD2-CD1 4.03Å; L554-L557 WeakPolarHBondContact O-CB 2.93Å; L554-L557 WeakPolarHBondContact O-CG 3.43Å; L554-L557 PolarHBondContact O-N 3.42Å; L557-T559 PolarHBondContact O-N 3.31Å; L557-T559 VanDerWaalsContact O-N 3.15Å; L557-A568 HydrophobicContact CD2-CB 4.24Å; L557-V569 HydrophobicContact CD2-CG2 3.64Å; L557-I572 HydrophobicContact CD1-CD1 4.34Å; L557-I572 HydrophobicContact CD2-CD1 4.46Å; L557-Y606 HydrophobicContact CD1-CD2 3.75Å; L557-Y606 HydrophobicContact CD1-CE2 4.34Å; L557-Y606 HydrophobicContact CD1-CG 4.49Å; L557-Y606 HydrophobicContact CD2-CD2 4.41Å; L557-Y606 HydrophobicContact CD2-CE2 4.22Å; L557-A609 HydrophobicContact CB-CB 3.73Å
558	M	91.1	Very high	90.8	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	32.5	178.8	-58.2	-63.5	-65.2	0	0	113.6	W562 A609 I610 K613 I615 F617 V699	M558-W562 HydrophobicContact SD-CD2 4.5Å; M558-W562 HydrophobicContact SD-CE3 4.21Å; M558-W562 HydrophobicContact SD-CH2 3.68Å; M558-W562 HydrophobicContact SD-CZ2 3.98Å; M558-W562 HydrophobicContact SD-CZ3 3.8Å; M558-A609 HydrophobicContact CB-CB 4.25Å; M558-A609 HydrophobicContact CG-CB 4.05Å; M558-I610 HydrophobicContact CE-CB 4.29Å; M558-I610 HydrophobicContact CE-CG1 3.94Å; M558-I610 HydrophobicContact CE-CG2 4.21Å; M558-I610 HydrophobicContact CG-CB 4.41Å; M558-I610 HydrophobicContact CG-CG1 3.82Å; M558-I610 HydrophobicContact SD-CG1 3.86Å; M558-K613 HydrophobicContact CB-CB 4.03Å; M558-K613 HydrophobicContact CB-CG 4.27Å; M558-K613 WeakPolarHBondContact O-CB 3.08Å; M558-I615 HydrophobicContact CB-CG2 4.11Å; M558-I615 HydrophobicContact CE-CG2 3.88Å; M558-I615 VanDerWaalsContact O-CB 3.29Å; M558-I615 WeakPolarHBondContact O-CB 3.22Å; M558-I615 WeakPolarHBondContact O-CG2 3.15Å; M558-F617 HydrophobicContact CE-CZ 4.41Å; M558-V699 HydrophobicContact CE-CG1 3.84Å
559	T	90.9	Very high	90.8	Very high	40 Å²	40	54 Å²	54	25%	0.245	29%	0.286	C	S	.	.	S	Bend	trans	-107.5	170.6	169.1	70.1	0	0	0	0	111.2	E556 L557 K561 W562 L563	E556-T559 WeakPolarHBondContact O-CB 3.16Å; E556-T559 VanDerWaalsContact O-CG2 3.29Å; E556-T559 WeakPolarHBondContact O-CG2 3.42Å; E556-T559 PolarHBondContact O-N 3.11Å; E556-T559 PolarHBondContact O-OG1 2.92Å; L557-T559 PolarHBondContact O-N 3.31Å; L557-T559 VanDerWaalsContact O-N 3.15Å; T559-K561 PolarHBondContact O-N 3.32Å; T559-K561 PolarHBondContact OG1-N 2.92Å; T559-W562 WeakPolarHBondContact O-CB 3.31Å; T559-W562 PolarHBondContact O-N 2.87Å; T559-W562 VanDerWaalsContact O-N 3.16Å; T559-W562 PolarHBondContact OG1-N 3.06Å; T559-L563 PolarHBondContact O-N 3.44Å
560	K	86.8	Confident	90.8	Very high	156 Å²	156	52.1 Å²	52.1	68%	0.678	28%	0.28	S	S	*	.	H	α-helix	trans	-59.6	-35.2	172.6	-69.2	-176.4	179.8	175.8	0	112.5	W562 L563 M564	K560-W562 VanDerWaalsContact C-N 3.33Å; K560-L563 PolarHBondContact O-N 2.93Å; K560-M564 WeakPolarHBondContact O-CB 3.42Å; K560-M564 VanDerWaalsContact O-CG 3.29Å; K560-M564 WeakPolarHBondContact O-CG 3.44Å; K560-M564 PolarHBondContact O-N 2.97Å
561	K	89	Confident	90.8	Very high	129 Å²	129	54.3 Å²	54.3	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-65.8	-38.8	177.1	-170.8	-176.8	171.4	-149.9	0	111.1	E556 T559 M564 S566	E556-K561 HydrophobicContact CG-CB 4.5Å; E556-K561 HydrophobicContact CG-CD 4.16Å; E556-K561 HydrophobicContact CG-CG 4.48Å; E556-K561 WeakPolarHBondContact OE1-CD 3.47Å; E556-K561 WeakPolarHBondContact OE1-CE 3.3Å; E556-K561 WeakPolarHBondContact OE1-CG 3.11Å; E556-K561 IonicContact OE1-NZ 3.44Å; E556-K561 PolarHBondContact OE1-NZ 3.1Å; E556-K561 IonicContact OE2-NZ 3.63Å; E556-K561 PolarHBondContact OE2-NZ 3.48Å; T559-K561 PolarHBondContact O-N 3.32Å; T559-K561 PolarHBondContact OG1-N 2.92Å; K561-M564 PolarHBondContact O-N 2.98Å; K561-S566 PolarHBondContact O-N 3.35Å
562	W	92.9	Very high	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-51.6	169.6	169.3	89.5	0	0	0	111.2	E556 M558 T559 K560 M564 G565 I615 F617 R629 M630 E633	E556-W562 VanDerWaalsContact O-CB 3.26Å; E556-W562 WeakPolarHBondContact O-CB 3.09Å; M558-W562 HydrophobicContact SD-CD2 4.5Å; M558-W562 HydrophobicContact SD-CE3 4.21Å; M558-W562 HydrophobicContact SD-CH2 3.68Å; M558-W562 HydrophobicContact SD-CZ2 3.98Å; M558-W562 HydrophobicContact SD-CZ3 3.8Å; T559-W562 WeakPolarHBondContact O-CB 3.31Å; T559-W562 PolarHBondContact O-N 2.87Å; T559-W562 VanDerWaalsContact O-N 3.16Å; T559-W562 PolarHBondContact OG1-N 3.06Å; K560-W562 VanDerWaalsContact C-N 3.33Å; W562-M564 VanDerWaalsContact C-N 3.27Å; W562-M564 PolarHBondContact O-N 2.98Å; W562-G565 PolarHBondContact O-N 3.49Å; W562-G565 VanDerWaalsContact O-N 3.13Å; W562-I615 HydrophobicContact CE3-CD1 4.34Å; W562-I615 HydrophobicContact CZ3-CD1 4.49Å; W562-F617 HydrophobicContact CH2-CZ 4.46Å; W562-F617 HydrophobicContact CZ3-CE1 4.22Å; W562-F617 HydrophobicContact CZ3-CZ 4.11Å; W562-R629 HydrophobicContact CZ2-CB 4.34Å; W562-R629 HydrophobicContact CZ2-CG 3.85Å; W562-R629 VanDerWaalsContact NE1-NE 3.16Å; W562-R629 PolarHBondContact O-NH1 2.64Å; W562-M630 HydrophobicContact CH2-CG 4.03Å; W562-M630 HydrophobicContact CZ2-CG 3.98Å; W562-E633 PolarHBondContact NE1-OE1 3.33Å; W562-E633 VanDerWaalsContact NE1-OE1 3.17Å; W562-E633 PolarHBondContact NE1-OE2 2.59Å
563	L	87.5	Confident	91	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-38	179.6	-171.9	58.2	0	0	0	112.6	T559 K560 G565 I615 F617 E622	T559-L563 PolarHBondContact O-N 3.44Å; K560-L563 PolarHBondContact O-N 2.93Å; L563-G565 PolarHBondContact O-N 3.22Å; L563-G565 VanDerWaalsContact O-N 3.14Å; L563-I615 HydrophobicContact CB-CD1 4.22Å; L563-I615 HydrophobicContact CD2-CD1 4.38Å; L563-F617 HydrophobicContact CD1-CE1 3.97Å; L563-F617 HydrophobicContact CD2-CD1 4.21Å; L563-F617 HydrophobicContact CD2-CE1 4.23Å; L563-E622 HydrophobicContact CD2-CB 4.49Å; L563-E622 HydrophobicContact CD2-CG 4.31Å
564	M	86.6	Confident	91	Very high	166 Å²	166	46.8 Å²	46.8	82%	0.818	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	9.5	179.5	-69.4	178.4	68	0	0	115.6	K560 K561 W562	K560-M564 WeakPolarHBondContact O-CB 3.42Å; K560-M564 VanDerWaalsContact O-CG 3.29Å; K560-M564 WeakPolarHBondContact O-CG 3.44Å; K560-M564 PolarHBondContact O-N 2.97Å; K561-M564 PolarHBondContact O-N 2.98Å; W562-M564 VanDerWaalsContact C-N 3.27Å; W562-M564 PolarHBondContact O-N 2.98Å
565	G	85.3	Confident	91.2	Very high	55 Å²	55	47.5 Å²	47.5	57%	0.567	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.3	25.4	174.3	0	0	0	0	0	116.4	W562 L563	W562-G565 PolarHBondContact O-N 3.49Å; W562-G565 VanDerWaalsContact O-N 3.13Å; L563-G565 PolarHBondContact O-N 3.22Å; L563-G565 VanDerWaalsContact O-N 3.14Å
566	S	89.1	Confident	91.3	Very high	18 Å²	18	44 Å²	44	13%	0.126	24%	0.244	C	C	.	.			trans	-52	152.8	173.2	179.5	0	0	0	0	113.5	E556 K561 A568 R629	E556-S566 WeakPolarHBondContact OE1-CB 3.34Å; E556-S566 PolarHBondContact OE1-OG 3Å; K561-S566 PolarHBondContact O-N 3.35Å; S566-A568 WeakPolarHBondContact OG-CB 3.47Å; S566-A568 PolarHBondContact OG-N 2.81Å; S566-R629 PolarHBondContact O-NH2 2.91Å
567	N	90.1	Very high	91.5	Very high	116 Å²	116	45.2 Å²	45.2	62%	0.62	25%	0.25	S	C	*	.			trans	-102.9	22.9	168.7	-164.5	43.6	0	0	0	113.2	V569 G570 T571	N567-V569 VanDerWaalsContact C-N 3.33Å; N567-V569 PolarHBondContact O-N 2.99Å; N567-G570 PolarHBondContact O-N 2.66Å; N567-G570 VanDerWaalsContact O-N 3.08Å; N567-T571 PolarHBondContact O-N 3.18Å; N567-T571 PolarHBondContact O-OG1 3.18Å
568	A	91.7	Very high	91.5	Very high	2 Å²	2	49.6 Å²	49.6	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-52.9	-44.8	-175.6	0	0	0	0	0	113.5	H553 E556 L557 S566 T571 I572	H553-A568 HydrophobicContact CB-CB 4.41Å; E556-A568 HydrophobicContact CB-CB 4.23Å; E556-A568 HydrophobicContact CG-CB 4.38Å; L557-A568 HydrophobicContact CD2-CB 4.24Å; S566-A568 WeakPolarHBondContact OG-CB 3.47Å; S566-A568 PolarHBondContact OG-N 2.81Å; A568-T571 PolarHBondContact O-N 3.45Å; A568-I572 WeakPolarHBondContact O-CD1 3.46Å; A568-I572 VanDerWaalsContact O-CG1 3.24Å; A568-I572 WeakPolarHBondContact O-CG1 3.02Å; A568-I572 PolarHBondContact O-N 3.23Å
569	V	93.4	Very high	91.6	Very high	1 Å²	1	52 Å²	52	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-38.3	178.1	175.7	0	0	0	0	112.4	L557 N567 T571 I572 C573 Y606 E633 Q636 F637	L557-V569 HydrophobicContact CD2-CG2 3.64Å; N567-V569 VanDerWaalsContact C-N 3.33Å; N567-V569 PolarHBondContact O-N 2.99Å; V569-T571 VanDerWaalsContact C-N 3.34Å; V569-T571 PolarHBondContact O-N 3.46Å; V569-I572 PolarHBondContact O-N 3.38Å; V569-C573 PolarHBondContact O-N 2.91Å; V569-C573 PolarHBondContact O-SG 2.91Å; V569-C573 VanDerWaalsContact O-SG 3.34Å; V569-Y606 HydrophobicContact CG2-CE2 4.23Å; V569-E633 HydrophobicContact CB-CB 4.38Å; V569-E633 HydrophobicContact CB-CG 3.9Å; V569-E633 HydrophobicContact CG1-CB 4.05Å; V569-E633 HydrophobicContact CG1-CG 4.03Å; V569-E633 HydrophobicContact CG2-CB 4.05Å; V569-E633 HydrophobicContact CG2-CG 3.72Å; V569-E633 WeakPolarHBondContact CG2-OE2 3.48Å; V569-Q636 HydrophobicContact CG1-CB 4.4Å; V569-Q636 VanDerWaalsContact CG1-OE1 3.28Å; V569-F637 HydrophobicContact CB-CZ 4.4Å; V569-F637 HydrophobicContact CG1-CD1 4.34Å; V569-F637 HydrophobicContact CG1-CE1 3.66Å; V569-F637 HydrophobicContact CG1-CE2 4.24Å; V569-F637 HydrophobicContact CG1-CZ 3.61Å; V569-F637 HydrophobicContact CG2-CZ 4.04Å
570	G	93.3	Very high	91.7	Very high	16 Å²	16	50.6 Å²	50.6	17%	0.165	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-45.1	174.1	0	0	0	0	0	111.8	N567 C573 V574	N567-G570 PolarHBondContact O-N 2.66Å; N567-G570 VanDerWaalsContact O-N 3.08Å; G570-C573 PolarHBondContact O-N 3.47Å; G570-V574 WeakPolarHBondContact O-CG2 3.26Å; G570-V574 PolarHBondContact O-N 2.93Å; G570-V574 VanDerWaalsContact O-N 3.11Å
571	T	94.3	Very high	91.9	Very high	46 Å²	46	47.6 Å²	47.6	28%	0.282	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-44.2	174.9	-54.3	0	0	0	0	111.7	H553 N567 A568 V569 C573 V574 T575	H553-T571 WeakPolarHBondContact NE2-CG2 3.43Å; N567-T571 PolarHBondContact O-N 3.18Å; N567-T571 PolarHBondContact O-OG1 3.18Å; A568-T571 PolarHBondContact O-N 3.45Å; V569-T571 VanDerWaalsContact C-N 3.34Å; V569-T571 PolarHBondContact O-N 3.46Å; T571-C573 VanDerWaalsContact C-N 3.28Å; T571-C573 PolarHBondContact O-N 3.01Å; T571-V574 PolarHBondContact O-N 3.16Å; T571-T575 WeakPolarHBondContact O-CB 3.14Å; T571-T575 PolarHBondContact O-N 3.2Å; T571-T575 PolarHBondContact O-OG1 2.75Å; T571-T575 VanDerWaalsContact O-OG1 3.09Å
572	I	94.7	Very high	91.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-54.8	-47.1	175.7	-69.8	159.4	0	0	0	110.5	L550 H553 L554 L557 A568 V569 T575 V576 F637	L550-I572 HydrophobicContact CD1-CG2 4.18Å; L550-I572 HydrophobicContact CD2-CB 4.17Å; L550-I572 HydrophobicContact CD2-CG1 4.06Å; L550-I572 HydrophobicContact CD2-CG2 4.15Å; H553-I572 HydrophobicContact CB-CD1 4.2Å; H553-I572 HydrophobicContact CB-CG1 3.86Å; L554-I572 HydrophobicContact CD2-CD1 3.77Å; L554-I572 HydrophobicContact CD2-CG1 4.48Å; L554-I572 HydrophobicContact CG-CD1 4.35Å; L557-I572 HydrophobicContact CD1-CD1 4.34Å; L557-I572 HydrophobicContact CD2-CD1 4.46Å; A568-I572 WeakPolarHBondContact O-CD1 3.46Å; A568-I572 VanDerWaalsContact O-CG1 3.24Å; A568-I572 WeakPolarHBondContact O-CG1 3.02Å; A568-I572 PolarHBondContact O-N 3.23Å; V569-I572 PolarHBondContact O-N 3.38Å; I572-T575 PolarHBondContact O-N 3.4Å; I572-V576 HydrophobicContact CG2-CG2 4.36Å; I572-V576 WeakPolarHBondContact O-CB 3.42Å; I572-V576 VanDerWaalsContact O-CG2 3.26Å; I572-V576 WeakPolarHBondContact O-CG2 3.24Å; I572-V576 PolarHBondContact O-N 2.96Å; I572-F637 HydrophobicContact CG2-CE1 4.01Å
573	C	94.5	Very high	91.7	Very high	16 Å²	16	45.8 Å²	45.8	11%	0.108	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-44.5	-179.5	-71.7	0	0	0	0	112.8	V569 G570 T571 E577 L640	V569-C573 PolarHBondContact O-N 2.91Å; V569-C573 PolarHBondContact O-SG 2.91Å; V569-C573 VanDerWaalsContact O-SG 3.34Å; G570-C573 PolarHBondContact O-N 3.47Å; T571-C573 VanDerWaalsContact C-N 3.28Å; T571-C573 PolarHBondContact O-N 3.01Å; C573-E577 VanDerWaalsContact O-CB 3.32Å; C573-E577 WeakPolarHBondContact O-CB 3.47Å; C573-E577 PolarHBondContact O-N 3.23Å; C573-L640 HydrophobicContact CB-CD2 4.02Å
574	V	94.8	Very high	91.7	Very high	79 Å²	79	46.5 Å²	46.5	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-47	178.8	173.4	0	0	0	0	110.9	G570 T571 V576 E577 D578	G570-V574 WeakPolarHBondContact O-CG2 3.26Å; G570-V574 PolarHBondContact O-N 2.93Å; G570-V574 VanDerWaalsContact O-N 3.11Å; T571-V574 PolarHBondContact O-N 3.16Å; V574-V576 PolarHBondContact O-N 2.88Å; V574-E577 WeakPolarHBondContact O-CB 3.46Å; V574-E577 PolarHBondContact O-N 3.31Å; V574-E577 VanDerWaalsContact O-N 3.15Å; V574-D578 PolarHBondContact O-N 2.93Å
575	T	94.4	Very high	91.9	Very high	31 Å²	31	42.3 Å²	42.3	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-45.4	179.1	-59.1	0	0	0	0	111.6	L550 T571 I572 E577 D578 Y579	L550-T575 HydrophobicContact CD2-CG2 3.76Å; L550-T575 HydrophobicContact CG-CG2 4.48Å; T571-T575 WeakPolarHBondContact O-CB 3.14Å; T571-T575 PolarHBondContact O-N 3.2Å; T571-T575 PolarHBondContact O-OG1 2.75Å; T571-T575 VanDerWaalsContact O-OG1 3.09Å; I572-T575 PolarHBondContact O-N 3.4Å; T575-E577 VanDerWaalsContact C-N 3.31Å; T575-E577 PolarHBondContact O-N 3.42Å; T575-D578 PolarHBondContact O-N 3.41Å; T575-Y579 HydrophobicContact CG2-CD2 3.93Å; T575-Y579 HydrophobicContact CG2-CE2 3.79Å; T575-Y579 VanDerWaalsContact O-CD2 3.27Å; T575-Y579 WeakPolarHBondContact O-CD2 3.39Å; T575-Y579 PolarHBondContact O-N 3.08Å; T575-Y579 VanDerWaalsContact O-N 3.13Å
576	V	94.6	Very high	92.2	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-42.8	174.8	171.4	0	0	0	0	110.9	V546 L550 I572 V574 D578 F580 L640 F641 L644	V546-V576 HydrophobicContact CG1-CG2 4.18Å; L550-V576 HydrophobicContact CD1-CG2 3.72Å; I572-V576 HydrophobicContact CG2-CG2 4.36Å; I572-V576 WeakPolarHBondContact O-CB 3.42Å; I572-V576 VanDerWaalsContact O-CG2 3.26Å; I572-V576 WeakPolarHBondContact O-CG2 3.24Å; I572-V576 PolarHBondContact O-N 2.96Å; V574-V576 PolarHBondContact O-N 2.88Å; V576-D578 PolarHBondContact O-N 3.04Å; V576-F580 HydrophobicContact CG1-CD2 3.8Å; V576-F580 HydrophobicContact CG1-CE2 4.01Å; V576-F580 WeakPolarHBondContact O-CB 3.29Å; V576-F580 VanDerWaalsContact O-CD2 3.23Å; V576-F580 WeakPolarHBondContact O-CD2 3.49Å; V576-F580 PolarHBondContact O-N 3.25Å; V576-L640 HydrophobicContact CB-CD2 4.05Å; V576-L640 HydrophobicContact CG1-CD2 3.92Å; V576-F641 HydrophobicContact CG1-CE1 4.27Å; V576-F641 HydrophobicContact CG1-CZ 4.1Å; V576-L644 HydrophobicContact CG1-CD1 4.03Å
577	E	93.6	Very high	92.2	Very high	51 Å²	51	40.1 Å²	40.1	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-44.6	177.7	-170.3	173.7	171.2	0	0	112.3	C573 V574 T575 F580 N581 L640 K643	C573-E577 VanDerWaalsContact O-CB 3.32Å; C573-E577 WeakPolarHBondContact O-CB 3.47Å; C573-E577 PolarHBondContact O-N 3.23Å; V574-E577 WeakPolarHBondContact O-CB 3.46Å; V574-E577 PolarHBondContact O-N 3.31Å; V574-E577 VanDerWaalsContact O-N 3.15Å; T575-E577 VanDerWaalsContact C-N 3.31Å; T575-E577 PolarHBondContact O-N 3.42Å; E577-F580 PolarHBondContact O-N 3.18Å; E577-N581 VanDerWaalsContact O-CG 3.27Å; E577-N581 PolarHBondContact O-N 2.92Å; E577-N581 PolarHBondContact O-ND2 3Å; E577-N581 VanDerWaalsContact O-ND2 3.14Å; E577-L640 HydrophobicContact CB-CD1 3.87Å; E577-L640 HydrophobicContact CG-CD1 4.34Å; E577-K643 WeakPolarHBondContact OE1-CE 3.29Å; E577-K643 IonicContact OE1-NZ 2.73Å; E577-K643 PolarHBondContact OE1-NZ 3.37Å; E577-K643 IonicContact OE2-NZ 3.75Å
578	D	93.5	Very high	92.1	Very high	92 Å²	92	40.9 Å²	40.9	49%	0.492	22%	0.218	S	C	.	.	H	α-helix	trans	-60.3	-50.1	178.7	-70.3	-22.5	0	0	0	111.5	V574 T575 V576 F580 N581 D582	V574-D578 PolarHBondContact O-N 2.93Å; T575-D578 PolarHBondContact O-N 3.41Å; V576-D578 PolarHBondContact O-N 3.04Å; D578-F580 VanDerWaalsContact C-N 3.32Å; D578-F580 PolarHBondContact O-N 3.33Å; D578-N581 WeakPolarHBondContact O-CB 3.42Å; D578-N581 PolarHBondContact O-N 3.47Å; D578-D582 PolarHBondContact O-N 3.27Å
579	Y	93.4	Very high	92	Very high	51 Å²	51	43.8 Å²	43.8	20%	0.2	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-39.6	175.4	-82.9	-76.9	0	0	0	112.8	V546 D549 T575 N581 D582 F583	V546-Y579 HydrophobicContact CB-CD2 4.32Å; V546-Y579 HydrophobicContact CG1-CD2 4Å; V546-Y579 HydrophobicContact CG1-CG 4.46Å; V546-Y579 HydrophobicContact CG2-CD1 3.9Å; V546-Y579 HydrophobicContact CG2-CD2 3.87Å; V546-Y579 HydrophobicContact CG2-CE1 4.47Å; V546-Y579 HydrophobicContact CG2-CE2 4.48Å; V546-Y579 HydrophobicContact CG2-CG 3.58Å; D549-Y579 PolarHBondContact OD2-OH 3.34Å; T575-Y579 HydrophobicContact CG2-CD2 3.93Å; T575-Y579 HydrophobicContact CG2-CE2 3.79Å; T575-Y579 VanDerWaalsContact O-CD2 3.27Å; T575-Y579 WeakPolarHBondContact O-CD2 3.39Å; T575-Y579 PolarHBondContact O-N 3.08Å; T575-Y579 VanDerWaalsContact O-N 3.13Å; Y579-N581 VanDerWaalsContact C-N 3.25Å; Y579-N581 PolarHBondContact O-N 3.09Å; Y579-D582 WeakPolarHBondContact O-CB 3.48Å; Y579-D582 PolarHBondContact O-N 3.37Å; Y579-D582 VanDerWaalsContact O-N 3.13Å; Y579-F583 HydrophobicContact CD1-CE1 4.3Å; Y579-F583 AromaticContact CD1-CZ 3.98Å; Y579-F583 HydrophobicContact CD1-CZ 3.98Å; Y579-F583 HydrophobicContact CG-CZ 4.43Å; Y579-F583 WeakPolarHBondContact O-CD1 3.05Å; Y579-F583 WeakPolarHBondContact O-CG 3.43Å; Y579-F583 PolarHBondContact O-N 3.07Å
580	F	92.1	Very high	91.9	Very high	12 Å²	12	44.1 Å²	44.1	5%	0.053	24%	0.237	C	C	.	.	H	α-helix	trans	-71.5	-20.4	-179.9	-90.9	-105.6	0	0	0	113.5	L543 V576 E577 D578 F583 A584 M594 T595 A598 L644	L543-F580 HydrophobicContact CD2-CE2 4.23Å; L543-F580 HydrophobicContact CD2-CZ 4.28Å; V576-F580 HydrophobicContact CG1-CD2 3.8Å; V576-F580 HydrophobicContact CG1-CE2 4.01Å; V576-F580 WeakPolarHBondContact O-CB 3.29Å; V576-F580 VanDerWaalsContact O-CD2 3.23Å; V576-F580 WeakPolarHBondContact O-CD2 3.49Å; V576-F580 PolarHBondContact O-N 3.25Å; E577-F580 PolarHBondContact O-N 3.18Å; D578-F580 VanDerWaalsContact C-N 3.32Å; D578-F580 PolarHBondContact O-N 3.33Å; F580-F583 HydrophobicContact CD2-CD2 4.07Å; F580-F583 HydrophobicContact CD2-CE2 4.45Å; F580-F583 HydrophobicContact CE2-CD2 4.21Å; F580-F583 HydrophobicContact CE2-CE2 4.41Å; F580-F583 HydrophobicContact CG-CD2 4.35Å; F580-A584 PolarHBondContact O-N 3.31Å; F580-M594 HydrophobicContact CD1-CE 4.39Å; F580-M594 HydrophobicContact CE1-CE 3.83Å; F580-M594 HydrophobicContact CZ-CE 4.09Å; F580-T595 HydrophobicContact CE1-CG2 4.14Å; F580-A598 HydrophobicContact CE2-CB 3.82Å; F580-A598 HydrophobicContact CZ-CB 3.43Å; F580-A598 VanDerWaalsContact CZ-CB 3.43Å; F580-L644 HydrophobicContact CB-CD1 3.98Å; F580-L644 HydrophobicContact CB-CD2 3.67Å; F580-L644 HydrophobicContact CB-CG 4.41Å; F580-L644 HydrophobicContact CD1-CB 4.43Å; F580-L644 HydrophobicContact CD1-CD1 3.9Å; F580-L644 HydrophobicContact CD1-CD2 4.41Å; F580-L644 HydrophobicContact CD1-CG 4.47Å; F580-L644 HydrophobicContact CD2-CD1 4.23Å; F580-L644 HydrophobicContact CE1-CD1 4.48Å; F580-L644 HydrophobicContact CG-CD1 3.75Å; F580-L644 HydrophobicContact CG-CD2 4.28Å
581	N	90.4	Very high	91.7	Very high	92 Å²	92	46.4 Å²	46.4	49%	0.492	24%	0.243	S	C	.	.	H	α-helix	trans	-67.5	-41.8	167.6	-68.2	-38.8	0	0	0	110.8	E577 D578 Y579 A584	E577-N581 VanDerWaalsContact O-CG 3.27Å; E577-N581 PolarHBondContact O-N 2.92Å; E577-N581 PolarHBondContact O-ND2 3Å; E577-N581 VanDerWaalsContact O-ND2 3.14Å; D578-N581 WeakPolarHBondContact O-CB 3.42Å; D578-N581 PolarHBondContact O-N 3.47Å; Y579-N581 VanDerWaalsContact C-N 3.25Å; Y579-N581 PolarHBondContact O-N 3.09Å; N581-A584 WeakPolarHBondContact O-CB 3.26Å; N581-A584 PolarHBondContact O-N 3.41Å
582	D	87.2	Confident	91.4	Very high	90 Å²	90	47.4 Å²	47.4	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-67.1	-41.8	173.8	-65.1	-23	0	0	0	111.2	D578 Y579 A584 K585	D578-D582 PolarHBondContact O-N 3.27Å; Y579-D582 WeakPolarHBondContact O-CB 3.48Å; Y579-D582 PolarHBondContact O-N 3.37Å; Y579-D582 VanDerWaalsContact O-N 3.13Å; D582-A584 PolarHBondContact O-N 2.91Å; D582-A584 VanDerWaalsContact O-N 3.11Å; D582-K585 PolarHBondContact O-N 3.46Å
583	F	91.4	Very high	91	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-71.5	-2.4	176.1	-53.3	-19.7	0	0	0	113.6	V487 I491 L542 V546 Y579 F580 K585 I586 M594	V487-F583 HydrophobicContact CG1-CD1 4.12Å; V487-F583 HydrophobicContact CG1-CE1 3.68Å; I491-F583 HydrophobicContact CD1-CD1 4.04Å; L542-F583 HydrophobicContact CB-CE1 4.13Å; L542-F583 HydrophobicContact CB-CE2 4.35Å; L542-F583 HydrophobicContact CB-CZ 3.82Å; L542-F583 HydrophobicContact CD1-CD1 4.33Å; L542-F583 HydrophobicContact CD1-CE1 4.2Å; L542-F583 HydrophobicContact CD2-CE1 4.1Å; L542-F583 HydrophobicContact CG-CE1 4.38Å; V546-F583 HydrophobicContact CG2-CE2 3.8Å; V546-F583 HydrophobicContact CG2-CZ 3.85Å; Y579-F583 HydrophobicContact CD1-CE1 4.3Å; Y579-F583 AromaticContact CD1-CZ 3.98Å; Y579-F583 HydrophobicContact CD1-CZ 3.98Å; Y579-F583 HydrophobicContact CG-CZ 4.43Å; Y579-F583 WeakPolarHBondContact O-CD1 3.05Å; Y579-F583 WeakPolarHBondContact O-CG 3.43Å; Y579-F583 PolarHBondContact O-N 3.07Å; F580-F583 HydrophobicContact CD2-CD2 4.07Å; F580-F583 HydrophobicContact CD2-CE2 4.45Å; F580-F583 HydrophobicContact CE2-CD2 4.21Å; F580-F583 HydrophobicContact CE2-CE2 4.41Å; F580-F583 HydrophobicContact CG-CD2 4.35Å; F583-K585 PolarHBondContact O-N 2.95Å; F583-I586 HydrophobicContact CB-CD1 3.88Å; F583-I586 HydrophobicContact CB-CG1 4.45Å; F583-I586 HydrophobicContact CG-CD1 4.33Å; F583-I586 WeakPolarHBondContact O-CB 3.48Å; F583-I586 WeakPolarHBondContact O-CG1 3.41Å; F583-I586 PolarHBondContact O-N 3.02Å; F583-M594 HydrophobicContact CB-CE 3.65Å; F583-M594 HydrophobicContact CD2-CE 3.54Å; F583-M594 HydrophobicContact CD2-SD 3.88Å; F583-M594 HydrophobicContact CE2-CE 4.49Å; F583-M594 HydrophobicContact CE2-SD 4.36Å; F583-M594 HydrophobicContact CG-CE 3.92Å; F583-M594 HydrophobicContact CG-SD 4.34Å
584	A	87.8	Confident	90.9	Very high	38 Å²	38	50.1 Å²	50.1	31%	0.314	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-58	-24.1	174.3	0	0	0	0	0	112	F580 N581 D582 I586 K591	F580-A584 PolarHBondContact O-N 3.31Å; N581-A584 WeakPolarHBondContact O-CB 3.26Å; N581-A584 PolarHBondContact O-N 3.41Å; D582-A584 PolarHBondContact O-N 2.91Å; D582-A584 VanDerWaalsContact O-N 3.11Å; A584-I586 VanDerWaalsContact C-N 3.25Å; A584-I586 PolarHBondContact O-N 3.19Å; A584-K591 PolarHBondContact O-NZ 3.28Å
585	K	90.3	Very high	90.7	Very high	77 Å²	77	46.6 Å²	46.6	34%	0.335	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-76.1	5.3	176	-55.6	-56.7	-159.4	166.3	0	114.9	G418 Y419 Y420 I491 N495 D582 F583	G418-K585 VanDerWaalsContact O-CD 3.23Å; G418-K585 WeakPolarHBondContact O-CD 3.33Å; G418-K585 WeakPolarHBondContact O-CE 3.36Å; G418-K585 PolarHBondContact O-NZ 2.8Å; Y419-K585 WeakPolarHBondContact CD1-O 3.39Å; Y420-K585 HydrophobicContact CD2-CB 3.62Å; Y420-K585 HydrophobicContact CD2-CG 3.92Å; Y420-K585 HydrophobicContact CE2-CB 3.91Å; Y420-K585 HydrophobicContact CE2-CG 3.68Å; Y420-K585 HydrophobicContact CG-CB 4.35Å; I491-K585 HydrophobicContact CG2-CB 4.13Å; I491-K585 WeakPolarHBondContact CG2-O 3.47Å; N495-K585 PolarHBondContact ND2-O 3.38Å; D582-K585 PolarHBondContact O-N 3.46Å; F583-K585 PolarHBondContact O-N 2.95Å
586	I	91.8	Very high	90.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-87	134.6	171.1	-61.3	172.9	0	0	0	110.4	Y419 I491 I494 N495 L542 F583 A584 K591 M594	Y419-I586 WeakPolarHBondContact CE1-O 3.36Å; I491-I586 HydrophobicContact CB-CG1 4.25Å; I491-I586 HydrophobicContact CD1-CG1 4.46Å; I491-I586 HydrophobicContact CG1-CD1 4.17Å; I491-I586 HydrophobicContact CG1-CG1 3.83Å; I491-I586 HydrophobicContact CG2-CG1 3.71Å; I494-I586 HydrophobicContact CG2-CG2 4.05Å; N495-I586 WeakPolarHBondContact OD1-CA 3.15Å; L542-I586 HydrophobicContact CD1-CD1 3.98Å; F583-I586 HydrophobicContact CB-CD1 3.88Å; F583-I586 HydrophobicContact CB-CG1 4.45Å; F583-I586 HydrophobicContact CG-CD1 4.33Å; F583-I586 WeakPolarHBondContact O-CB 3.48Å; F583-I586 WeakPolarHBondContact O-CG1 3.41Å; F583-I586 PolarHBondContact O-N 3.02Å; A584-I586 VanDerWaalsContact C-N 3.25Å; A584-I586 PolarHBondContact O-N 3.19Å; I586-K591 HydrophobicContact CB-CB 4.13Å; I586-K591 HydrophobicContact CG2-CB 4.03Å; I586-M594 HydrophobicContact CD1-CE 3.66Å; I586-M594 HydrophobicContact CD1-SD 3.51Å; I586-M594 VanDerWaalsContact CD1-SD 3.51Å
587	K	90	Very high	90.1	Very high	28 Å²	28	50.6 Å²	50.6	12%	0.122	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-72	154.7	177.4	-69.8	-178.6	178.8	-175.8	0	112.3	D415 Y419 N495 Y590 K591	D415-K587 WeakPolarHBondContact OD2-CE 3.48Å; D415-K587 IonicContact OD2-NZ 3.03Å; D415-K587 PolarHBondContact OD2-NZ 2.86Å; Y419-K587 HydrophobicContact CD1-CG 3.68Å; Y419-K587 HydrophobicContact CD2-CG 4.11Å; Y419-K587 HydrophobicContact CE1-CG 4.2Å; Y419-K587 HydrophobicContact CG-CD 4.45Å; Y419-K587 HydrophobicContact CG-CG 3.66Å; N495-K587 HydrophobicContact CB-CD 4.24Å; N495-K587 HydrophobicContact CB-CG 4.4Å; N495-K587 PolarHBondContact OD1-N 2.66Å; K587-Y590 PolarHBondContact O-N 2.92Å; K587-K591 PolarHBondContact O-N 2.91Å; K587-K591 VanDerWaalsContact O-N 3.14Å
588	K	87.5	Confident	90.1	Very high	132 Å²	132	48.2 Å²	48.2	57%	0.574	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	143.9	165	-69.1	-178.6	178	-179.3	0	108.9	G647	K588-G647 PolarHBondContact NZ-O 3.01Å
589	P	89.3	Confident	90	Very high	62 Å²	62	43.9 Å²	43.9	40%	0.403	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.7	-8.8	6.6	34.8	-35.5	0	0	0	114.9	K591 K592 T593	P589-K591 PolarHBondContact O-N 3.27Å; P589-K592 VanDerWaalsContact O-CB 3.3Å; P589-K592 WeakPolarHBondContact O-CB 3.31Å; P589-K592 PolarHBondContact O-N 3.34Å; P589-T593 PolarHBondContact O-N 3.43Å
590	Y	90.9	Very high	89.8	Confident	8 Å²	8	42.3 Å²	42.3	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-37.5	-169.5	-58.2	-57.4	0	0	0	113.9	I494 C497 Q498 K501 D532 A535 K587 K592 T593 M594	I494-Y590 HydrophobicContact CG2-CD2 3.85Å; I494-Y590 HydrophobicContact CG2-CG 3.96Å; C497-Y590 HydrophobicContact CB-CE2 4.44Å; Q498-Y590 HydrophobicContact CB-CE2 4.04Å; K501-Y590 PolarHBondContact NZ-OH 3.36Å; D532-Y590 WeakPolarHBondContact OD1-CE1 3.34Å; D532-Y590 PolarHBondContact OD1-OH 2.91Å; A535-Y590 HydrophobicContact CB-CD1 3.62Å; A535-Y590 HydrophobicContact CB-CD2 4.05Å; A535-Y590 HydrophobicContact CB-CE1 3.33Å; A535-Y590 HydrophobicContact CB-CE2 3.77Å; A535-Y590 HydrophobicContact CB-CG 3.98Å; A535-Y590 VanDerWaalsContact CB-CZ 3.41Å; K587-Y590 PolarHBondContact O-N 2.92Å; Y590-K592 PolarHBondContact O-N 2.89Å; Y590-T593 PolarHBondContact O-N 3.39Å; Y590-M594 WeakPolarHBondContact O-CB 3.3Å; Y590-M594 PolarHBondContact O-N 2.92Å
591	K	89.3	Confident	89.8	Confident	65 Å²	65	44.2 Å²	44.2	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-55	-40.8	173.4	-176.9	174.5	-176.9	174	0	112.4	A584 I586 K587 P589 T595	A584-K591 PolarHBondContact O-NZ 3.28Å; I586-K591 HydrophobicContact CB-CB 4.13Å; I586-K591 HydrophobicContact CG2-CB 4.03Å; K587-K591 PolarHBondContact O-N 2.91Å; K587-K591 VanDerWaalsContact O-N 3.14Å; P589-K591 PolarHBondContact O-N 3.27Å; K591-T595 PolarHBondContact O-N 2.9Å; K591-T595 VanDerWaalsContact O-N 3.09Å; K591-T595 PolarHBondContact O-OG1 3.14Å
592	K	87.3	Confident	90	Very high	67 Å²	67	39.9 Å²	39.9	29%	0.291	20%	0.199	S	C	.	.	H	α-helix	trans	-65.7	-54.5	179.2	179.4	-177.5	179.2	-161.9	0	110.2	P589 Y590 M594 T595 I596 E650	P589-K592 VanDerWaalsContact O-CB 3.3Å; P589-K592 WeakPolarHBondContact O-CB 3.31Å; P589-K592 PolarHBondContact O-N 3.34Å; Y590-K592 PolarHBondContact O-N 2.89Å; K592-M594 VanDerWaalsContact C-N 3.28Å; K592-M594 PolarHBondContact O-N 2.88Å; K592-T595 PolarHBondContact O-N 3.39Å; K592-T595 VanDerWaalsContact O-N 3.11Å; K592-I596 HydrophobicContact CG-CD1 4.4Å; K592-I596 WeakPolarHBondContact O-CG1 3.43Å; K592-I596 PolarHBondContact O-N 3.31Å; K592-E650 VanDerWaalsContact CE-CG 3.47Å; K592-E650 WeakPolarHBondContact CE-OE1 3.44Å; K592-E650 WeakPolarHBondContact CE-OE2 3.36Å; K592-E650 IonicContact NZ-OE1 3.6Å; K592-E650 PolarHBondContact NZ-OE1 2.88Å; K592-E650 IonicContact NZ-OE2 2.8Å
593	T	88.1	Confident	90.2	Very high	71 Å²	71	35.7 Å²	35.7	44%	0.436	18%	0.177	S	C	.	.	H	α-helix	trans	-56.9	-41.9	179	-55.4	0	0	0	0	112.3	P589 Y590 T595 I596 E597	P589-T593 PolarHBondContact O-N 3.43Å; Y590-T593 PolarHBondContact O-N 3.39Å; T593-T595 PolarHBondContact O-N 2.94Å; T593-I596 PolarHBondContact O-N 2.98Å; T593-E597 WeakPolarHBondContact O-CB 3.49Å; T593-E597 PolarHBondContact O-N 2.86Å
594	M	90.9	Very high	90.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-37.2	178.3	-172.1	-170	66.9	0	0	112.6	C539 L543 F580 F583 I586 Y590 K592 E597 A598	C539-M594 HydrophobicContact CB-CB 4.24Å; C539-M594 HydrophobicContact CB-CG 4.14Å; L543-M594 HydrophobicContact CD1-CG 4.12Å; L543-M594 HydrophobicContact CD2-CG 4.05Å; L543-M594 HydrophobicContact CG-CG 4.03Å; F580-M594 HydrophobicContact CD1-CE 4.39Å; F580-M594 HydrophobicContact CE1-CE 3.83Å; F580-M594 HydrophobicContact CZ-CE 4.09Å; F583-M594 HydrophobicContact CB-CE 3.65Å; F583-M594 HydrophobicContact CD2-CE 3.54Å; F583-M594 HydrophobicContact CD2-SD 3.88Å; F583-M594 HydrophobicContact CE2-CE 4.49Å; F583-M594 HydrophobicContact CE2-SD 4.36Å; F583-M594 HydrophobicContact CG-CE 3.92Å; F583-M594 HydrophobicContact CG-SD 4.34Å; I586-M594 HydrophobicContact CD1-CE 3.66Å; I586-M594 HydrophobicContact CD1-SD 3.51Å; I586-M594 VanDerWaalsContact CD1-SD 3.51Å; Y590-M594 WeakPolarHBondContact O-CB 3.3Å; Y590-M594 PolarHBondContact O-N 2.92Å; K592-M594 VanDerWaalsContact C-N 3.28Å; K592-M594 PolarHBondContact O-N 2.88Å; M594-E597 PolarHBondContact O-N 3.11Å; M594-A598 WeakPolarHBondContact O-CB 3.38Å; M594-A598 PolarHBondContact O-N 3.27Å
595	T	90	Very high	90.5	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-42.6	177.1	-52.7	0	0	0	0	111.7	F580 K591 K592 T593 A598 H599 F641 L644	F580-T595 HydrophobicContact CE1-CG2 4.14Å; K591-T595 PolarHBondContact O-N 2.9Å; K591-T595 VanDerWaalsContact O-N 3.09Å; K591-T595 PolarHBondContact O-OG1 3.14Å; K592-T595 PolarHBondContact O-N 3.39Å; K592-T595 VanDerWaalsContact O-N 3.11Å; T593-T595 PolarHBondContact O-N 2.94Å; T595-A598 PolarHBondContact O-N 3.34Å; T595-H599 PolarHBondContact O-N 3.41Å; T595-F641 HydrophobicContact CG2-CD1 4.37Å; T595-L644 HydrophobicContact CG2-CB 4.13Å
596	I	88	Confident	90.7	Very high	53 Å²	53	33.2 Å²	33.2	27%	0.272	16%	0.16	S	C	.	.	H	α-helix	trans	-62.3	-47.3	176.4	-58.4	163.8	0	0	0	110.3	K592 T593 A598 H599 R600 E650	K592-I596 HydrophobicContact CG-CD1 4.4Å; K592-I596 WeakPolarHBondContact O-CG1 3.43Å; K592-I596 PolarHBondContact O-N 3.31Å; T593-I596 PolarHBondContact O-N 2.98Å; I596-A598 PolarHBondContact O-N 3.49Å; I596-H599 PolarHBondContact O-N 3.32Å; I596-R600 WeakPolarHBondContact O-CB 3.4Å; I596-R600 PolarHBondContact O-N 3.46Å; I596-E650 WeakPolarHBondContact CD1-OE2 3.49Å; I596-E650 WeakPolarHBondContact CG1-OE2 3.43Å
597	E	90.2	Very high	90.7	Very high	64 Å²	64	33.2 Å²	33.2	30%	0.299	16%	0.16	S	C	.	.	H	α-helix	trans	-64.5	-40.8	-178.3	-177.5	56.4	-156.7	0	0	111.5	L543 T593 M594 R600 R601	L543-E597 HydrophobicContact CD1-CB 4.05Å; L543-E597 HydrophobicContact CD1-CG 3.78Å; T593-E597 WeakPolarHBondContact O-CB 3.49Å; T593-E597 PolarHBondContact O-N 2.86Å; M594-E597 PolarHBondContact O-N 3.11Å; E597-R600 PolarHBondContact O-N 3.3Å; E597-R601 WeakPolarHBondContact O-CB 3.31Å; E597-R601 WeakPolarHBondContact O-CG 3.45Å; E597-R601 PolarHBondContact O-N 3.29Å; E597-R601 IonicContact OE1-CZ 3.48Å; E597-R601 IonicContact OE1-NE 2.6Å; E597-R601 PolarHBondContact OE1-NE 2.89Å; E597-R601 IonicContact OE1-NH2 2.69Å
598	A	92.3	Very high	90.8	Very high	2 Å²	2	35 Å²	35	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-61.6	-46.6	173.9	0	0	0	0	0	112.4	L543 F580 M594 T595 I596 R600 R601 V602 F641	L543-A598 HydrophobicContact CD1-CB 4.34Å; L543-A598 HydrophobicContact CD2-CB 3.69Å; F580-A598 HydrophobicContact CE2-CB 3.82Å; F580-A598 HydrophobicContact CZ-CB 3.43Å; F580-A598 VanDerWaalsContact CZ-CB 3.43Å; M594-A598 WeakPolarHBondContact O-CB 3.38Å; M594-A598 PolarHBondContact O-N 3.27Å; T595-A598 PolarHBondContact O-N 3.34Å; I596-A598 PolarHBondContact O-N 3.49Å; A598-R600 VanDerWaalsContact C-N 3.29Å; A598-R600 PolarHBondContact O-N 3.18Å; A598-R601 PolarHBondContact O-N 2.87Å; A598-V602 WeakPolarHBondContact O-CG2 3.24Å; A598-V602 PolarHBondContact O-N 3.05Å; A598-F641 HydrophobicContact CB-CE1 3.94Å; A598-F641 HydrophobicContact CB-CZ 4.38Å
599	H	91.1	Very high	91	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-47	176.4	-173.2	-177.6	0	0	0	110.7	T595 I596 V602 V603 F641 T652 L655 C656	T595-H599 PolarHBondContact O-N 3.41Å; I596-H599 PolarHBondContact O-N 3.32Å; H599-V602 PolarHBondContact O-N 3.36Å; H599-V603 WeakPolarHBondContact O-CG2 3.42Å; H599-V603 PolarHBondContact O-N 3.06Å; H599-V603 VanDerWaalsContact O-N 3.14Å; H599-F641 VanDerWaalsContact CA-CZ 3.44Å; H599-F641 HydrophobicContact CB-CB 4.19Å; H599-F641 HydrophobicContact CB-CD1 3.58Å; H599-F641 HydrophobicContact CB-CD2 3.83Å; H599-F641 HydrophobicContact CB-CE1 3.85Å; H599-F641 HydrophobicContact CB-CE2 4.1Å; H599-F641 HydrophobicContact CB-CG 3.58Å; H599-F641 HydrophobicContact CB-CZ 4.11Å; H599-F641 AromaticContact CD2-CD2 3.34Å; H599-F641 WeakPolarHBondContact CD2-CD2 3.41Å; H599-F641 AromaticContact CD2-CE2 3.85Å; H599-F641 AromaticContact CD2-CG 3.82Å; H599-F641 AromaticContact CG-CD2 3.55Å; H599-F641 AromaticContact CG-CG 3.52Å; H599-F641 AromaticContact ND1-CG 3.96Å; H599-F641 AromaticContact NE2-CD2 3.98Å; H599-T652 PolarHBondContact CE1-O 2.94Å; H599-L655 HydrophobicContact CB-CD1 4.17Å; H599-C656 PolarHBondContact NE2-SG 3.15Å
600	R	90.6	Very high	91.1	Very high	18 Å²	18	26 Å²	26	7%	0.068	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-48.7	178.4	-172.6	176.2	-177.4	-77.7	-6.8	112	I596 E597 A598 V602 V603 V604 L655 P728 E732	I596-R600 WeakPolarHBondContact O-CB 3.4Å; I596-R600 PolarHBondContact O-N 3.46Å; E597-R600 PolarHBondContact O-N 3.3Å; A598-R600 VanDerWaalsContact C-N 3.29Å; A598-R600 PolarHBondContact O-N 3.18Å; R600-V602 PolarHBondContact O-N 3.05Å; R600-V603 PolarHBondContact O-N 3.42Å; R600-V604 HydrophobicContact CG-CG2 4.31Å; R600-V604 WeakPolarHBondContact O-CB 3.4Å; R600-V604 VanDerWaalsContact O-CG2 3.23Å; R600-V604 WeakPolarHBondContact O-CG2 3.47Å; R600-V604 PolarHBondContact O-N 2.97Å; R600-L655 HydrophobicContact CB-CD1 4.16Å; R600-P728 PolarHBondContact NH2-O 2.98Å; R600-E732 IonicContact CZ-OE1 3.42Å; R600-E732 IonicContact CZ-OE2 2.96Å; R600-E732 IonicContact NH1-OE1 2.65Å; R600-E732 PolarHBondContact NH1-OE1 2.6Å; R600-E732 IonicContact NH1-OE2 3.44Å; R600-E732 PolarHBondContact NH1-OE2 3.31Å; R600-E732 IonicContact NH2-OE1 2.77Å; R600-E732 PolarHBondContact NH2-OE1 3.14Å; R600-E732 IonicContact NH2-OE2 3.79Å; R600-E732 PolarHBondContact NH2-OE2 3.04Å
601	R	92.4	Very high	91.1	Very high	51 Å²	51	26 Å²	26	19%	0.192	12%	0.122	C	C	.	.	H	α-helix	trans	-60.1	-43.5	178.9	-73.5	-175.9	-170.7	-165	2.6	112.1	S540 D544 F547 E597 A598 V603 V604 E605	S540-R601 PolarHBondContact OG-NH2 3.07Å; D544-R601 IonicContact OD1-CZ 3.63Å; D544-R601 IonicContact OD1-NH1 3.72Å; D544-R601 PolarHBondContact OD1-NH1 3.46Å; F547-R601 HydrophobicContact CE1-CB 3.8Å; F547-R601 HydrophobicContact CE2-CB 3.68Å; F547-R601 HydrophobicContact CE2-CG 4.44Å; F547-R601 HydrophobicContact CZ-CB 3.21Å; F547-R601 HydrophobicContact CZ-CG 4.37Å; E597-R601 WeakPolarHBondContact O-CB 3.31Å; E597-R601 WeakPolarHBondContact O-CG 3.45Å; E597-R601 PolarHBondContact O-N 3.29Å; E597-R601 IonicContact OE1-CZ 3.48Å; E597-R601 IonicContact OE1-NE 2.6Å; E597-R601 PolarHBondContact OE1-NE 2.89Å; E597-R601 IonicContact OE1-NH2 2.69Å; A598-R601 PolarHBondContact O-N 2.87Å; R601-V603 VanDerWaalsContact C-N 3.35Å; R601-V603 PolarHBondContact O-N 3.34Å; R601-V604 PolarHBondContact O-N 2.89Å; R601-E605 WeakPolarHBondContact O-CG 3.38Å; R601-E605 PolarHBondContact O-N 3.45Å
602	V	93.1	Very high	91	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-59.1	-46.2	177	170.8	0	0	0	0	111.2	F547 A598 H599 R600 E605 Y606 F637 F641	F547-V602 HydrophobicContact CE1-CG2 4.16Å; F547-V602 HydrophobicContact CZ-CG2 3.7Å; A598-V602 WeakPolarHBondContact O-CG2 3.24Å; A598-V602 PolarHBondContact O-N 3.05Å; H599-V602 PolarHBondContact O-N 3.36Å; R600-V602 PolarHBondContact O-N 3.05Å; V602-E605 PolarHBondContact O-N 2.51Å; V602-Y606 PolarHBondContact O-N 3.17Å; V602-F637 HydrophobicContact CG1-CD1 3.65Å; V602-F637 HydrophobicContact CG1-CD2 4.28Å; V602-F637 HydrophobicContact CG1-CE1 3.45Å; V602-F637 VanDerWaalsContact CG1-CE1 3.45Å; V602-F637 HydrophobicContact CG1-CE2 4.11Å; V602-F637 HydrophobicContact CG1-CG 4.07Å; V602-F637 HydrophobicContact CG1-CZ 3.69Å; V602-F641 HydrophobicContact CB-CE2 4.17Å; V602-F641 HydrophobicContact CB-CZ 4.37Å; V602-F641 HydrophobicContact CG1-CE2 4.41Å; V602-F641 HydrophobicContact CG2-CE2 4.12Å; V602-F641 HydrophobicContact CG2-CZ 3.9Å
603	V	92.2	Very high	90.8	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-65.4	-42.5	178.3	171.7	0	0	0	0	111.4	H599 R600 R601 Y606 I607 L655 I658 I659	H599-V603 WeakPolarHBondContact O-CG2 3.42Å; H599-V603 PolarHBondContact O-N 3.06Å; H599-V603 VanDerWaalsContact O-N 3.14Å; R600-V603 PolarHBondContact O-N 3.42Å; R601-V603 VanDerWaalsContact C-N 3.35Å; R601-V603 PolarHBondContact O-N 3.34Å; V603-Y606 WeakPolarHBondContact O-CB 3.45Å; V603-Y606 PolarHBondContact O-N 2.68Å; V603-I607 HydrophobicContact CG1-CD1 3.84Å; V603-I607 HydrophobicContact CG1-CG1 4.47Å; V603-I607 VanDerWaalsContact O-CG1 3.3Å; V603-I607 WeakPolarHBondContact O-CG1 3.43Å; V603-I607 PolarHBondContact O-N 2.89Å; V603-L655 HydrophobicContact CG2-CB 4.37Å; V603-I658 HydrophobicContact CG1-CG2 3.66Å; V603-I659 HydrophobicContact CG1-CD1 4.41Å; V603-I659 HydrophobicContact CG1-CG1 4.5Å
604	V	92.6	Very high	90.2	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-60.8	-45.4	176.6	170.2	0	0	0	0	111.1	R600 R601 Y606 I607 R608 I729 I733	R600-V604 HydrophobicContact CG-CG2 4.31Å; R600-V604 WeakPolarHBondContact O-CB 3.4Å; R600-V604 VanDerWaalsContact O-CG2 3.23Å; R600-V604 WeakPolarHBondContact O-CG2 3.47Å; R600-V604 PolarHBondContact O-N 2.97Å; R601-V604 PolarHBondContact O-N 2.89Å; V604-Y606 VanDerWaalsContact C-N 3.32Å; V604-Y606 PolarHBondContact O-N 2.82Å; V604-I607 PolarHBondContact O-N 2.85Å; V604-R608 VanDerWaalsContact O-CB 3.26Å; V604-R608 WeakPolarHBondContact O-CB 3.38Å; V604-R608 PolarHBondContact O-N 3.45Å; V604-I729 HydrophobicContact CG2-CG2 4Å; V604-I733 HydrophobicContact CG1-CG1 4.31Å
605	E	92.7	Very high	90	Very high	60 Å²	60	35.6 Å²	35.6	28%	0.28	15%	0.154	S	C	.	.	H	α-helix	trans	-62.3	-39.4	176.6	-69.8	-59.6	151.6	0	0	112	F547 L554 R601 V602 R608 A609	F547-E605 HydrophobicContact CD1-CG 4.14Å; F547-E605 HydrophobicContact CE1-CG 3.92Å; L554-E605 HydrophobicContact CD1-CB 4.29Å; L554-E605 HydrophobicContact CD1-CG 4Å; L554-E605 HydrophobicContact CD2-CB 3.88Å; L554-E605 HydrophobicContact CD2-CG 4.46Å; R601-E605 WeakPolarHBondContact O-CG 3.38Å; R601-E605 PolarHBondContact O-N 3.45Å; V602-E605 PolarHBondContact O-N 2.51Å; E605-R608 WeakPolarHBondContact O-CB 3.35Å; E605-R608 PolarHBondContact O-N 3.03Å; E605-R608 IonicContact OE1-CZ 2.84Å; E605-R608 IonicContact OE1-NH1 3.95Å; E605-R608 PolarHBondContact OE1-NH1 3.42Å; E605-R608 IonicContact OE2-CZ 3.72Å; E605-R608 IonicContact OE2-NH1 3.6Å; E605-R608 PolarHBondContact OE2-NH1 3.28Å; E605-A609 PolarHBondContact O-N 2.9Å
606	Y	93.7	Very high	89.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-46.7	176.6	-165.9	-82.7	0	0	0	111.7	L557 V569 V602 V603 V604 R608 A609 I610 M630 E633 F637 I659	L557-Y606 HydrophobicContact CD1-CD2 3.75Å; L557-Y606 HydrophobicContact CD1-CE2 4.34Å; L557-Y606 HydrophobicContact CD1-CG 4.49Å; L557-Y606 HydrophobicContact CD2-CD2 4.41Å; L557-Y606 HydrophobicContact CD2-CE2 4.22Å; V569-Y606 HydrophobicContact CG2-CE2 4.23Å; V602-Y606 PolarHBondContact O-N 3.17Å; V603-Y606 WeakPolarHBondContact O-CB 3.45Å; V603-Y606 PolarHBondContact O-N 2.68Å; V604-Y606 VanDerWaalsContact C-N 3.32Å; V604-Y606 PolarHBondContact O-N 2.82Å; Y606-R608 VanDerWaalsContact C-N 3.34Å; Y606-A609 WeakPolarHBondContact O-CB 3.5Å; Y606-A609 PolarHBondContact O-N 3.02Å; Y606-I610 HydrophobicContact CD1-CD1 3.88Å; Y606-I610 HydrophobicContact CD1-CG1 4.35Å; Y606-I610 HydrophobicContact CE1-CD1 3.84Å; Y606-I610 HydrophobicContact CE1-CG1 4.27Å; Y606-I610 WeakPolarHBondContact O-CG1 3.23Å; Y606-I610 PolarHBondContact O-N 2.84Å; Y606-I610 VanDerWaalsContact O-N 3.09Å; Y606-M630 HydrophobicContact CE1-CG 4.38Å; Y606-M630 WeakPolarHBondContact OH-CG 3.49Å; Y606-E633 HydrophobicContact CE2-CB 4.3Å; Y606-E633 WeakPolarHBondContact CE2-OE2 3.19Å; Y606-E633 PolarHBondContact OH-OE2 2.99Å; Y606-F637 AromaticContact CD2-CE2 3.64Å; Y606-F637 HydrophobicContact CD2-CE2 3.64Å; Y606-F637 HydrophobicContact CD2-CZ 4.13Å; Y606-F637 HydrophobicContact CE2-CE2 4.15Å; Y606-F637 HydrophobicContact CG-CE2 4.26Å; Y606-I659 HydrophobicContact CD1-CD1 3.7Å; Y606-I659 HydrophobicContact CD1-CG1 3.9Å; Y606-I659 HydrophobicContact CD1-CG2 4.03Å; Y606-I659 HydrophobicContact CE1-CD1 4.25Å; Y606-I659 HydrophobicContact CE1-CG1 4.36Å; Y606-I659 HydrophobicContact CE1-CG2 3.6Å; Y606-I659 HydrophobicContact CG-CD1 3.96Å
607	I	92.8	Very high	89.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-38.1	176.7	-58.3	160.2	0	0	0	110.7	V603 V604 A609 I610 M611 I658 I662 I729 F730 I733	V603-I607 HydrophobicContact CG1-CD1 3.84Å; V603-I607 HydrophobicContact CG1-CG1 4.47Å; V603-I607 VanDerWaalsContact O-CG1 3.3Å; V603-I607 WeakPolarHBondContact O-CG1 3.43Å; V603-I607 PolarHBondContact O-N 2.89Å; V604-I607 PolarHBondContact O-N 2.85Å; I607-A609 PolarHBondContact O-N 3.04Å; I607-I610 WeakPolarHBondContact O-CA 3.44Å; I607-I610 WeakPolarHBondContact O-CB 3.35Å; I607-I610 PolarHBondContact O-N 2.89Å; I607-M611 HydrophobicContact CG2-CE 4.33Å; I607-M611 HydrophobicContact CG2-CG 4.11Å; I607-M611 VanDerWaalsContact O-CG 3.28Å; I607-M611 WeakPolarHBondContact O-CG 3.41Å; I607-M611 PolarHBondContact O-N 3.46Å; I607-I658 HydrophobicContact CD1-CB 4.42Å; I607-I658 HydrophobicContact CD1-CD1 3.58Å; I607-I658 HydrophobicContact CD1-CG1 3.98Å; I607-I658 HydrophobicContact CD1-CG2 3.56Å; I607-I658 HydrophobicContact CG1-CG2 4.3Å; I607-I662 HydrophobicContact CG1-CD1 4.4Å; I607-I662 HydrophobicContact CG2-CD1 4.17Å; I607-I729 HydrophobicContact CD1-CG2 3.47Å; I607-I729 VanDerWaalsContact CD1-CG2 3.47Å; I607-F730 HydrophobicContact CG2-CD1 4.32Å; I607-F730 HydrophobicContact CG2-CE1 3.8Å; I607-F730 HydrophobicContact CG2-CZ 4.42Å; I607-I733 HydrophobicContact CB-CD1 3.68Å; I607-I733 HydrophobicContact CG2-CD1 3.42Å; I607-I733 VanDerWaalsContact CG2-CD1 3.42Å
608	R	92.6	Very high	89.7	Confident	65 Å²	65	40.4 Å²	40.4	25%	0.245	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-40.7	174.1	-175.4	179.3	-64.6	114.5	-4.7	110.6	V604 E605 Y606 M611 L612 I733	V604-R608 VanDerWaalsContact O-CB 3.26Å; V604-R608 WeakPolarHBondContact O-CB 3.38Å; V604-R608 PolarHBondContact O-N 3.45Å; E605-R608 WeakPolarHBondContact O-CB 3.35Å; E605-R608 PolarHBondContact O-N 3.03Å; E605-R608 IonicContact OE1-CZ 2.84Å; E605-R608 IonicContact OE1-NH1 3.95Å; E605-R608 PolarHBondContact OE1-NH1 3.42Å; E605-R608 IonicContact OE2-CZ 3.72Å; E605-R608 IonicContact OE2-NH1 3.6Å; E605-R608 PolarHBondContact OE2-NH1 3.28Å; Y606-R608 VanDerWaalsContact C-N 3.34Å; R608-M611 PolarHBondContact O-N 2.89Å; R608-L612 HydrophobicContact CG-CD1 3.45Å; R608-L612 VanDerWaalsContact CG-CD1 3.45Å; R608-L612 HydrophobicContact CG-CG 4.05Å; R608-L612 VanDerWaalsContact O-CB 3.31Å; R608-L612 WeakPolarHBondContact O-CB 3.49Å; R608-L612 WeakPolarHBondContact O-CG 3.35Å; R608-L612 PolarHBondContact O-N 3.17Å; R608-I733 HydrophobicContact CG-CG2 4.5Å
609	A	91.8	Very high	89.5	Confident	6 Å²	6	43.6 Å²	43.6	5%	0.05	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-42.6	173.4	0	0	0	0	0	111.8	L557 M558 E605 Y606 I607 M611 K613	L557-A609 HydrophobicContact CB-CB 3.73Å; M558-A609 HydrophobicContact CB-CB 4.25Å; M558-A609 HydrophobicContact CG-CB 4.05Å; E605-A609 PolarHBondContact O-N 2.9Å; Y606-A609 WeakPolarHBondContact O-CB 3.5Å; Y606-A609 PolarHBondContact O-N 3.02Å; I607-A609 PolarHBondContact O-N 3.04Å; A609-M611 VanDerWaalsContact C-N 3.32Å; A609-M611 PolarHBondContact O-N 3.43Å; A609-K613 HydrophobicContact CB-CG 4.25Å; A609-K613 WeakPolarHBondContact O-CB 3.11Å; A609-K613 WeakPolarHBondContact O-CG 3.37Å; A609-K613 PolarHBondContact O-N 3.27Å; A609-K613 VanDerWaalsContact O-N 3.09Å
610	I	91.2	Very high	89.3	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.5	-45.9	174.8	-61.9	166.7	0	0	0	110.8	M558 Y606 I607 M630 I662 L696 V699	M558-I610 HydrophobicContact CE-CB 4.29Å; M558-I610 HydrophobicContact CE-CG1 3.94Å; M558-I610 HydrophobicContact CE-CG2 4.21Å; M558-I610 HydrophobicContact CG-CB 4.41Å; M558-I610 HydrophobicContact CG-CG1 3.82Å; M558-I610 HydrophobicContact SD-CG1 3.86Å; Y606-I610 HydrophobicContact CD1-CD1 3.88Å; Y606-I610 HydrophobicContact CD1-CG1 4.35Å; Y606-I610 HydrophobicContact CE1-CD1 3.84Å; Y606-I610 HydrophobicContact CE1-CG1 4.27Å; Y606-I610 WeakPolarHBondContact O-CG1 3.23Å; Y606-I610 PolarHBondContact O-N 2.84Å; Y606-I610 VanDerWaalsContact O-N 3.09Å; I607-I610 WeakPolarHBondContact O-CA 3.44Å; I607-I610 WeakPolarHBondContact O-CB 3.35Å; I607-I610 PolarHBondContact O-N 2.89Å; I610-M630 HydrophobicContact CD1-CE 3.54Å; I610-M630 HydrophobicContact CG1-CE 4.35Å; I610-I662 HydrophobicContact CD1-CD1 4.19Å; I610-I662 HydrophobicContact CD1-CG2 4.21Å; I610-I662 HydrophobicContact CG2-CG2 4.27Å; I610-L696 HydrophobicContact CG2-CD1 4.46Å; I610-V699 WeakPolarHBondContact O-CG2 2.97Å
611	M	90.4	Very high	89.2	Confident	9 Å²	9	51 Å²	51	4%	0.044	24%	0.24	C	C	.	.	H	α-helix	trans	-79.6	-31.4	-170.9	-64.3	-64.9	146.6	0	0	113.6	I607 R608 A609 I662 H692 A695 L696 F730 I733 V735	I607-M611 HydrophobicContact CG2-CE 4.33Å; I607-M611 HydrophobicContact CG2-CG 4.11Å; I607-M611 VanDerWaalsContact O-CG 3.28Å; I607-M611 WeakPolarHBondContact O-CG 3.41Å; I607-M611 PolarHBondContact O-N 3.46Å; R608-M611 PolarHBondContact O-N 2.89Å; A609-M611 VanDerWaalsContact C-N 3.32Å; A609-M611 PolarHBondContact O-N 3.43Å; M611-I662 HydrophobicContact CE-CD1 4.23Å; M611-H692 HydrophobicContact SD-CB 3.99Å; M611-H692 VanDerWaalsContact SD-O 3.39Å; M611-A695 WeakPolarHBondContact O-CB 3.28Å; M611-A695 HydrophobicContact SD-CB 4.07Å; M611-L696 HydrophobicContact CE-CB 4.21Å; M611-F730 HydrophobicContact CE-CE1 3.89Å; M611-I733 HydrophobicContact CB-CG2 4.16Å; M611-I733 HydrophobicContact CG-CG2 4.37Å; M611-V735 HydrophobicContact CB-CG2 3.67Å; M611-V735 HydrophobicContact CG-CG2 4.41Å
612	L	87.4	Confident	89.1	Confident	75 Å²	75	50.8 Å²	50.8	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-103.6	-23.9	-171.9	-61.2	-175	0	0	0	114.3	R608 V735	R608-L612 HydrophobicContact CG-CD1 3.45Å; R608-L612 VanDerWaalsContact CG-CD1 3.45Å; R608-L612 HydrophobicContact CG-CG 4.05Å; R608-L612 VanDerWaalsContact O-CB 3.31Å; R608-L612 WeakPolarHBondContact O-CB 3.49Å; R608-L612 WeakPolarHBondContact O-CG 3.35Å; R608-L612 PolarHBondContact O-N 3.17Å; L612-V735 HydrophobicContact CD2-CB 4.46Å; L612-V735 HydrophobicContact CD2-CG2 4.05Å
613	K	83.4	Confident	89	Confident	61 Å²	61	51.8 Å²	51.8	27%	0.265	25%	0.245	S	C	.	.	S	Bend	trans	-82.4	138.2	-177.4	-57.1	-74.8	-176.6	173.9	0	110.1	N555 M558 A609 I615	N555-K613 PolarHBondContact O-NZ 3.41Å; N555-K613 VanDerWaalsContact O-NZ 3.15Å; N555-K613 PolarHBondContact OD1-NZ 2.74Å; M558-K613 HydrophobicContact CB-CB 4.03Å; M558-K613 HydrophobicContact CB-CG 4.27Å; M558-K613 WeakPolarHBondContact O-CB 3.08Å; A609-K613 HydrophobicContact CB-CG 4.25Å; A609-K613 WeakPolarHBondContact O-CB 3.11Å; A609-K613 WeakPolarHBondContact O-CG 3.37Å; A609-K613 PolarHBondContact O-N 3.27Å; A609-K613 VanDerWaalsContact O-N 3.09Å; K613-I615 PolarHBondContact O-N 2.94Å
614	R	75.6	Confident	88.9	Confident	257 Å²	257	56 Å²	56	97%	0.97	26%	0.263	S	S	*	.			trans	-86.5	47.9	-175.1	-61	-176.1	-179.4	-175.9	0.2	113
615	I	85.1	Confident	88.8	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.067	28%	0.284	C	S	.	.			trans	-84	147.5	168.4	-173	161.1	0	0	0	109.5	M558 W562 L563 K613 F617 V699	M558-I615 HydrophobicContact CB-CG2 4.11Å; M558-I615 HydrophobicContact CE-CG2 3.88Å; M558-I615 VanDerWaalsContact O-CB 3.29Å; M558-I615 WeakPolarHBondContact O-CB 3.22Å; M558-I615 WeakPolarHBondContact O-CG2 3.15Å; W562-I615 HydrophobicContact CE3-CD1 4.34Å; W562-I615 HydrophobicContact CZ3-CD1 4.49Å; L563-I615 HydrophobicContact CB-CD1 4.22Å; L563-I615 HydrophobicContact CD2-CD1 4.38Å; K613-I615 PolarHBondContact O-N 2.94Å; I615-F617 HydrophobicContact CD1-CE1 4.42Å; I615-V699 HydrophobicContact CG2-CG1 4.21Å; I615-V699 HydrophobicContact CG2-CG2 4.44Å; I615-V699 WeakPolarHBondContact O-CA 3.26Å
616	S	86.6	Confident	88.8	Confident	57 Å²	57	57.7 Å²	57.7	40%	0.399	27%	0.271	S	S	.	.			trans	-142.8	122.8	173.7	-169.1	0	0	0	0	108.9	K618 T698 V699 G701	S616-K618 PolarHBondContact O-N 3.03Å; S616-T698 PolarHBondContact OG-O 2.85Å; S616-V699 WeakPolarHBondContact CA-O 3.42Å; S616-G701 WeakPolarHBondContact OG-CA 3.29Å
617	F	90.1	Very high	88.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.271	C	S	.	.			trans	-76.5	116	179.2	-59.4	-65.5	0	0	0	109.9	M558 W562 L563 I615 E622 R623 I666 V699 R700	M558-F617 HydrophobicContact CE-CZ 4.41Å; W562-F617 HydrophobicContact CH2-CZ 4.46Å; W562-F617 HydrophobicContact CZ3-CE1 4.22Å; W562-F617 HydrophobicContact CZ3-CZ 4.11Å; L563-F617 HydrophobicContact CD1-CE1 3.97Å; L563-F617 HydrophobicContact CD2-CD1 4.21Å; L563-F617 HydrophobicContact CD2-CE1 4.23Å; I615-F617 HydrophobicContact CD1-CE1 4.42Å; F617-E622 HydrophobicContact CB-CB 4.24Å; F617-E622 HydrophobicContact CD1-CB 4.14Å; F617-E622 WeakPolarHBondContact CD1-O 3.31Å; F617-R623 HydrophobicContact CB-CB 4.41Å; F617-R623 HydrophobicContact CB-CG 3.45Å; F617-R623 VanDerWaalsContact CB-CG 3.45Å; F617-R623 HydrophobicContact CD2-CG 4.27Å; F617-R623 HydrophobicContact CG-CG 4.07Å; F617-I666 HydrophobicContact CD2-CG2 3.83Å; F617-I666 HydrophobicContact CE2-CD1 4.13Å; F617-I666 HydrophobicContact CE2-CG1 4.48Å; F617-I666 HydrophobicContact CE2-CG2 3.66Å; F617-I666 HydrophobicContact CZ-CG2 4.48Å; F617-V699 HydrophobicContact CD2-CG1 3.99Å; F617-V699 WeakPolarHBondContact CD2-O 3.26Å; F617-V699 HydrophobicContact CE2-CG1 3.56Å; F617-V699 HydrophobicContact CZ-CG1 4.44Å; F617-V699 PolarHBondContact N-O 3.42Å; F617-R700 VanDerWaalsContact O-O 3.09Å
618	K	85.9	Confident	88.7	Confident	166 Å²	166	62 Å²	62	72%	0.722	29%	0.291	S	S	*	.			trans	-82.1	-25.8	-168.5	-62.5	-176.2	-177.4	-179.1	0	113.8	S616 E622	S616-K618 PolarHBondContact O-N 3.03Å; K618-E622 PolarHBondContact N-OE2 3.06Å
619	N	88.1	Confident	88.8	Confident	69 Å²	69	60.9 Å²	60.9	37%	0.369	29%	0.287	S	S	.	.	S	Bend	trans	-142.6	169.6	-174.4	61.4	58.9	0	0	0	110.9	E621 E622 R623	N619-E621 VanDerWaalsContact C-N 3.25Å; N619-E621 PolarHBondContact O-N 3.42Å; N619-E621 WeakPolarHBondContact OD1-CB 3.39Å; N619-E621 PolarHBondContact OD1-N 3.47Å; N619-E621 VanDerWaalsContact OD1-N 3.12Å; N619-E622 PolarHBondContact ND2-OE1 2.93Å; N619-E622 PolarHBondContact O-N 3.38Å; N619-E622 PolarHBondContact OD1-N 3.01Å; N619-R623 PolarHBondContact O-N 3.08Å; N619-R623 VanDerWaalsContact O-N 3.16Å
620	A	87.1	Confident	88.9	Confident	53 Å²	53	60.6 Å²	60.6	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-30.8	-177.6	0	0	0	0	0	113	K624	A620-K624 WeakPolarHBondContact O-CB 3.39Å; A620-K624 PolarHBondContact O-N 3.45Å
621	E	88.3	Confident	89	Confident	121 Å²	121	62.2 Å²	62.2	57%	0.565	29%	0.293	S	S	*	.	H	α-helix	trans	-70.5	-46.6	178.8	-165.1	61.6	-157.6	0	0	111.1	N619 R623 K624 E625	N619-E621 VanDerWaalsContact C-N 3.25Å; N619-E621 PolarHBondContact O-N 3.42Å; N619-E621 WeakPolarHBondContact OD1-CB 3.39Å; N619-E621 PolarHBondContact OD1-N 3.47Å; N619-E621 VanDerWaalsContact OD1-N 3.12Å; E621-R623 VanDerWaalsContact C-N 3.27Å; E621-R623 PolarHBondContact O-N 2.87Å; E621-K624 PolarHBondContact O-N 3.23Å; E621-K624 VanDerWaalsContact O-N 3.13Å; E621-E625 WeakPolarHBondContact O-CB 3.42Å; E621-E625 PolarHBondContact O-N 3.2Å
622	E	89.9	Confident	89.2	Confident	47 Å²	47	68 Å²	68	22%	0.22	32%	0.318	C	S	.	.	H	α-helix	trans	-59.3	-37.7	174.8	-76	-179	-163.4	0	0	111.9	L563 F617 K618 N619 G626	L563-E622 HydrophobicContact CD2-CB 4.49Å; L563-E622 HydrophobicContact CD2-CG 4.31Å; F617-E622 HydrophobicContact CB-CB 4.24Å; F617-E622 HydrophobicContact CD1-CB 4.14Å; F617-E622 WeakPolarHBondContact CD1-O 3.31Å; K618-E622 PolarHBondContact N-OE2 3.06Å; N619-E622 PolarHBondContact ND2-OE1 2.93Å; N619-E622 PolarHBondContact O-N 3.38Å; N619-E622 PolarHBondContact OD1-N 3.01Å; E622-G626 PolarHBondContact O-N 3.01Å
623	R	91.3	Very high	89.5	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.087	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-44.9	174.6	-76.2	-167.2	-62.2	-92.2	10.4	112	F617 N619 E621 A627 I666 R700 D702	F617-R623 HydrophobicContact CB-CB 4.41Å; F617-R623 HydrophobicContact CB-CG 3.45Å; F617-R623 VanDerWaalsContact CB-CG 3.45Å; F617-R623 HydrophobicContact CD2-CG 4.27Å; F617-R623 HydrophobicContact CG-CG 4.07Å; N619-R623 PolarHBondContact O-N 3.08Å; N619-R623 VanDerWaalsContact O-N 3.16Å; E621-R623 VanDerWaalsContact C-N 3.27Å; E621-R623 PolarHBondContact O-N 2.87Å; R623-A627 VanDerWaalsContact O-CB 3.27Å; R623-A627 WeakPolarHBondContact O-CB 3.17Å; R623-A627 PolarHBondContact O-N 3.43Å; R623-I666 HydrophobicContact CB-CG2 4.22Å; R623-I666 WeakPolarHBondContact CD-O 3.41Å; R623-I666 HydrophobicContact CG-CG2 4.39Å; R623-R700 WeakPolarHBondContact CD-O 3.35Å; R623-D702 IonicContact CZ-OD2 2.64Å; R623-D702 IonicContact NE-OD2 2.62Å; R623-D702 IonicContact NH1-OD2 3.43Å; R623-D702 PolarHBondContact NH1-OD2 3.32Å; R623-D702 IonicContact NH2-OD2 2.63Å; R623-D702 PolarHBondContact NH2-OD2 3.41Å
624	K	90.6	Very high	90	Very high	90 Å²	90	62 Å²	62	39%	0.391	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-49.4	178.4	-177.1	-174.3	169.2	-164.2	0	111	A620 E621 A627 E628	A620-K624 WeakPolarHBondContact O-CB 3.39Å; A620-K624 PolarHBondContact O-N 3.45Å; E621-K624 PolarHBondContact O-N 3.23Å; E621-K624 VanDerWaalsContact O-N 3.13Å; K624-A627 PolarHBondContact O-N 2.94Å; K624-E628 WeakPolarHBondContact CE-OE1 3.3Å; K624-E628 HydrophobicContact CG-CG 4.47Å; K624-E628 WeakPolarHBondContact O-CB 3.49Å; K624-E628 WeakPolarHBondContact O-CG 3.5Å; K624-E628 PolarHBondContact O-N 3.06Å
625	E	90.7	Very high	90.8	Very high	98 Å²	98	54.7 Å²	54.7	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-45.9	178.1	-175.6	177.6	-170.4	0	0	111.5	E621 R629	E621-E625 WeakPolarHBondContact O-CB 3.42Å; E621-E625 PolarHBondContact O-N 3.2Å; E625-R629 WeakPolarHBondContact O-CB 3.26Å; E625-R629 PolarHBondContact O-N 3.03Å
626	G	91.6	Very high	91.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-44.2	176.1	0	0	0	0	0	113	E622 R629 M630	E622-G626 PolarHBondContact O-N 3.01Å; G626-R629 PolarHBondContact O-N 3.44Å; G626-M630 VanDerWaalsContact O-CG 3.23Å; G626-M630 WeakPolarHBondContact O-CG 3.35Å; G626-M630 PolarHBondContact O-N 3.31Å
627	A	92.6	Very high	91.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-45.4	178.9	0	0	0	0	0	113	R623 K624 R629 M630 I631 A663 I666 K667	R623-A627 VanDerWaalsContact O-CB 3.27Å; R623-A627 WeakPolarHBondContact O-CB 3.17Å; R623-A627 PolarHBondContact O-N 3.43Å; K624-A627 PolarHBondContact O-N 2.94Å; A627-R629 PolarHBondContact O-N 3.28Å; A627-M630 PolarHBondContact O-N 3.12Å; A627-I631 WeakPolarHBondContact O-CG1 3.48Å; A627-I631 PolarHBondContact O-N 2.75Å; A627-A663 HydrophobicContact CB-CB 4.23Å; A627-A663 WeakPolarHBondContact CB-O 3.4Å; A627-I666 HydrophobicContact CB-CB 4.34Å; A627-I666 HydrophobicContact CB-CG2 4.16Å; A627-K667 HydrophobicContact CB-CB 3.67Å; A627-K667 HydrophobicContact CB-CG 4.28Å
628	E	93.1	Very high	91.6	Very high	93 Å²	93	57.5 Å²	57.5	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-38.3	175.6	-74.7	176.3	178.4	0	0	111.2	K624 I631 K632	K624-E628 WeakPolarHBondContact CE-OE1 3.3Å; K624-E628 HydrophobicContact CG-CG 4.47Å; K624-E628 WeakPolarHBondContact O-CB 3.49Å; K624-E628 WeakPolarHBondContact O-CG 3.5Å; K624-E628 PolarHBondContact O-N 3.06Å; E628-I631 PolarHBondContact O-N 3.36Å; E628-K632 PolarHBondContact O-N 2.78Å
629	R	93.3	Very high	91.8	Very high	41 Å²	41	56.7 Å²	56.7	16%	0.155	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-46.3	173.9	-178.6	174.7	179.4	123.5	13.7	112.6	W562 S566 E625 G626 A627 I631 K632 E633	W562-R629 HydrophobicContact CZ2-CB 4.34Å; W562-R629 HydrophobicContact CZ2-CG 3.85Å; W562-R629 VanDerWaalsContact NE1-NE 3.16Å; W562-R629 PolarHBondContact O-NH1 2.64Å; S566-R629 PolarHBondContact O-NH2 2.91Å; E625-R629 WeakPolarHBondContact O-CB 3.26Å; E625-R629 PolarHBondContact O-N 3.03Å; G626-R629 PolarHBondContact O-N 3.44Å; A627-R629 PolarHBondContact O-N 3.28Å; R629-I631 VanDerWaalsContact C-N 3.28Å; R629-I631 PolarHBondContact O-N 3.14Å; R629-K632 PolarHBondContact O-N 3.24Å; R629-E633 HydrophobicContact CG-CG 4.35Å; R629-E633 IonicContact CZ-OE1 2.73Å; R629-E633 VanDerWaalsContact CZ-OE1 3.28Å; R629-E633 IonicContact NE-OE1 3.62Å; R629-E633 PolarHBondContact NE-OE1 2.73Å; R629-E633 IonicContact NH2-OE1 3.84Å; R629-E633 PolarHBondContact NH2-OE1 3.39Å; R629-E633 WeakPolarHBondContact O-CB 3.4Å; R629-E633 WeakPolarHBondContact O-CG 3.49Å; R629-E633 PolarHBondContact O-N 3.02Å
630	M	94.3	Very high	92	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-41.4	176.1	-72.8	171.3	61.4	0	0	112.1	W562 Y606 I610 G626 A627 E633 A634 I659 I662 A663 I666	W562-M630 HydrophobicContact CH2-CG 4.03Å; W562-M630 HydrophobicContact CZ2-CG 3.98Å; Y606-M630 HydrophobicContact CE1-CG 4.38Å; Y606-M630 WeakPolarHBondContact OH-CG 3.49Å; I610-M630 HydrophobicContact CD1-CE 3.54Å; I610-M630 HydrophobicContact CG1-CE 4.35Å; G626-M630 VanDerWaalsContact O-CG 3.23Å; G626-M630 WeakPolarHBondContact O-CG 3.35Å; G626-M630 PolarHBondContact O-N 3.31Å; A627-M630 PolarHBondContact O-N 3.12Å; M630-E633 PolarHBondContact O-N 3.16Å; M630-A634 WeakPolarHBondContact O-CB 3.42Å; M630-A634 PolarHBondContact O-N 2.95Å; M630-I659 HydrophobicContact CB-CG2 4.11Å; M630-I659 HydrophobicContact CE-CG2 4.25Å; M630-I662 HydrophobicContact CE-CB 4.17Å; M630-I662 HydrophobicContact CE-CG2 3.83Å; M630-A663 HydrophobicContact CB-CB 3.95Å; M630-A663 HydrophobicContact CE-CB 4.16Å; M630-A663 HydrophobicContact SD-CB 4.5Å; M630-I666 HydrophobicContact CE-CD1 3.89Å; M630-I666 HydrophobicContact SD-CD1 3.48Å; M630-I666 WeakPolarHBondContact SD-CD1 3.48Å
631	I	94.3	Very high	92.1	Very high	34 Å²	34	51.1 Å²	51.1	17%	0.174	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-48.2	176.6	-66.6	165.2	0	0	0	110.3	A627 E628 R629 E633 A634 E635 A663	A627-I631 WeakPolarHBondContact O-CG1 3.48Å; A627-I631 PolarHBondContact O-N 2.75Å; E628-I631 PolarHBondContact O-N 3.36Å; R629-I631 VanDerWaalsContact C-N 3.28Å; R629-I631 PolarHBondContact O-N 3.14Å; I631-E633 VanDerWaalsContact C-N 3.35Å; I631-E633 PolarHBondContact O-N 3.25Å; I631-A634 WeakPolarHBondContact O-CB 3.23Å; I631-A634 PolarHBondContact O-N 3.13Å; I631-E635 WeakPolarHBondContact O-CG 3.38Å; I631-E635 PolarHBondContact O-N 3.09Å; I631-A663 HydrophobicContact CD1-CB 4.22Å; I631-A663 HydrophobicContact CG1-CB 3.78Å
632	K	93.6	Very high	92.1	Very high	131 Å²	131	50.6 Å²	50.6	57%	0.57	23%	0.225	S	C	*	.	H	α-helix	trans	-61.1	-41.7	177.9	-175	-179.8	177.6	-177.8	0	112.5	E628 R629 E635 Q636	E628-K632 PolarHBondContact O-N 2.78Å; R629-K632 PolarHBondContact O-N 3.24Å; K632-E635 PolarHBondContact O-N 2.96Å; K632-Q636 WeakPolarHBondContact O-CG 3.38Å; K632-Q636 PolarHBondContact O-N 3.27Å
633	E	94.8	Very high	92.1	Very high	9 Å²	9	53.2 Å²	53.2	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-67.8	-35.9	177.5	-71.7	179	174.3	0	0	111.1	W562 V569 Y606 R629 M630 I631 Q636 F637	W562-E633 PolarHBondContact NE1-OE1 3.33Å; W562-E633 VanDerWaalsContact NE1-OE1 3.17Å; W562-E633 PolarHBondContact NE1-OE2 2.59Å; V569-E633 HydrophobicContact CB-CB 4.38Å; V569-E633 HydrophobicContact CB-CG 3.9Å; V569-E633 HydrophobicContact CG1-CB 4.05Å; V569-E633 HydrophobicContact CG1-CG 4.03Å; V569-E633 HydrophobicContact CG2-CB 4.05Å; V569-E633 HydrophobicContact CG2-CG 3.72Å; V569-E633 WeakPolarHBondContact CG2-OE2 3.48Å; Y606-E633 HydrophobicContact CE2-CB 4.3Å; Y606-E633 WeakPolarHBondContact CE2-OE2 3.19Å; Y606-E633 PolarHBondContact OH-OE2 2.99Å; R629-E633 HydrophobicContact CG-CG 4.35Å; R629-E633 IonicContact CZ-OE1 2.73Å; R629-E633 VanDerWaalsContact CZ-OE1 3.28Å; R629-E633 IonicContact NE-OE1 3.62Å; R629-E633 PolarHBondContact NE-OE1 2.73Å; R629-E633 IonicContact NH2-OE1 3.84Å; R629-E633 PolarHBondContact NH2-OE1 3.39Å; R629-E633 WeakPolarHBondContact O-CB 3.4Å; R629-E633 WeakPolarHBondContact O-CG 3.49Å; R629-E633 PolarHBondContact O-N 3.02Å; M630-E633 PolarHBondContact O-N 3.16Å; I631-E633 VanDerWaalsContact C-N 3.35Å; I631-E633 PolarHBondContact O-N 3.25Å; E633-Q636 WeakPolarHBondContact O-CB 2.97Å; E633-Q636 PolarHBondContact O-N 2.88Å; E633-F637 VanDerWaalsContact O-CD2 3.31Å; E633-F637 WeakPolarHBondContact O-CD2 3.27Å; E633-F637 PolarHBondContact O-N 3.45Å; E633-F637 VanDerWaalsContact O-N 3.11Å
634	A	93.4	Very high	91.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-36.6	171.5	0	0	0	0	0	113.1	M630 I631 R638 C656 I659 E660	M630-A634 WeakPolarHBondContact O-CB 3.42Å; M630-A634 PolarHBondContact O-N 2.95Å; I631-A634 WeakPolarHBondContact O-CB 3.23Å; I631-A634 PolarHBondContact O-N 3.13Å; A634-R638 WeakPolarHBondContact O-CB 3.4Å; A634-R638 PolarHBondContact O-N 2.81Å; A634-C656 HydrophobicContact CB-CB 4.37Å; A634-C656 PolarHBondContact O-SG 3.34Å; A634-I659 HydrophobicContact CB-CB 3.93Å; A634-I659 HydrophobicContact CB-CD1 4.33Å; A634-I659 HydrophobicContact CB-CG2 3.91Å; A634-E660 HydrophobicContact CB-CG 4.22Å
635	E	92.4	Very high	91.5	Very high	103 Å²	103	49.6 Å²	49.6	48%	0.481	22%	0.223	S	C	.	.	H	α-helix	trans	-65.5	-38	172.4	-72.7	176.3	171.8	0	0	112.1	I631 K632 R638 F639	I631-E635 WeakPolarHBondContact O-CG 3.38Å; I631-E635 PolarHBondContact O-N 3.09Å; K632-E635 PolarHBondContact O-N 2.96Å; E635-R638 PolarHBondContact O-N 3.28Å; E635-F639 WeakPolarHBondContact O-CB 3.5Å; E635-F639 PolarHBondContact O-N 2.99Å
636	Q	93.4	Very high	90.7	Very high	66 Å²	66	50.7 Å²	50.7	31%	0.308	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-47.4	176.2	-73.1	178.7	-4.7	0	0	112	V569 K632 E633 R638 F639 L640	V569-Q636 HydrophobicContact CG1-CB 4.4Å; V569-Q636 VanDerWaalsContact CG1-OE1 3.28Å; K632-Q636 WeakPolarHBondContact O-CG 3.38Å; K632-Q636 PolarHBondContact O-N 3.27Å; E633-Q636 WeakPolarHBondContact O-CB 2.97Å; E633-Q636 PolarHBondContact O-N 2.88Å; Q636-R638 VanDerWaalsContact C-N 3.32Å; Q636-R638 PolarHBondContact O-N 3.22Å; Q636-F639 PolarHBondContact O-N 3.27Å; Q636-L640 PolarHBondContact O-N 2.89Å
637	F	93.2	Very high	89.3	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-42.8	175	-65.6	-42.6	0	0	0	111.8	V569 I572 V602 Y606 E633 F639 L640 F641 I659	V569-F637 HydrophobicContact CB-CZ 4.4Å; V569-F637 HydrophobicContact CG1-CD1 4.34Å; V569-F637 HydrophobicContact CG1-CE1 3.66Å; V569-F637 HydrophobicContact CG1-CE2 4.24Å; V569-F637 HydrophobicContact CG1-CZ 3.61Å; V569-F637 HydrophobicContact CG2-CZ 4.04Å; I572-F637 HydrophobicContact CG2-CE1 4.01Å; V602-F637 HydrophobicContact CG1-CD1 3.65Å; V602-F637 HydrophobicContact CG1-CD2 4.28Å; V602-F637 HydrophobicContact CG1-CE1 3.45Å; V602-F637 VanDerWaalsContact CG1-CE1 3.45Å; V602-F637 HydrophobicContact CG1-CE2 4.11Å; V602-F637 HydrophobicContact CG1-CG 4.07Å; V602-F637 HydrophobicContact CG1-CZ 3.69Å; Y606-F637 AromaticContact CD2-CE2 3.64Å; Y606-F637 HydrophobicContact CD2-CE2 3.64Å; Y606-F637 HydrophobicContact CD2-CZ 4.13Å; Y606-F637 HydrophobicContact CE2-CE2 4.15Å; Y606-F637 HydrophobicContact CG-CE2 4.26Å; E633-F637 VanDerWaalsContact O-CD2 3.31Å; E633-F637 WeakPolarHBondContact O-CD2 3.27Å; E633-F637 PolarHBondContact O-N 3.45Å; E633-F637 VanDerWaalsContact O-N 3.11Å; F637-F639 VanDerWaalsContact C-N 3.35Å; F637-F639 PolarHBondContact O-N 3.34Å; F637-L640 PolarHBondContact O-N 3.33Å; F637-F641 VanDerWaalsContact O-CD2 3.3Å; F637-F641 WeakPolarHBondContact O-CD2 3.26Å; F637-F641 PolarHBondContact O-N 2.97Å; F637-I659 HydrophobicContact CD2-CD1 4.29Å
638	R	91	Very high	87.7	Confident	63 Å²	63	54.6 Å²	54.6	24%	0.238	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-44.9	176.6	-167.9	-174.7	-35.5	153.4	21.1	111.9	A634 E635 Q636 K642 C656 E660	A634-R638 WeakPolarHBondContact O-CB 3.4Å; A634-R638 PolarHBondContact O-N 2.81Å; E635-R638 PolarHBondContact O-N 3.28Å; Q636-R638 VanDerWaalsContact C-N 3.32Å; Q636-R638 PolarHBondContact O-N 3.22Å; R638-K642 WeakPolarHBondContact O-CB 3.14Å; R638-K642 PolarHBondContact O-N 3.19Å; R638-C656 HydrophobicContact CB-CB 4.48Å; R638-E660 IonicContact CZ-OE1 3.74Å; R638-E660 IonicContact NH1-OE1 3.81Å; R638-E660 IonicContact NH2-OE1 3.46Å; R638-E660 PolarHBondContact NH2-OE1 2.65Å
639	F	90.9	Very high	86	Confident	149 Å²	149	54.1 Å²	54.1	65%	0.654	29%	0.292	S	S	*	.	H	α-helix	trans	-61.6	-47.9	177.4	178.5	-96.8	0	0	0	111.6	E635 Q636 F637 K642 K643	E635-F639 WeakPolarHBondContact O-CB 3.5Å; E635-F639 PolarHBondContact O-N 2.99Å; Q636-F639 PolarHBondContact O-N 3.27Å; F637-F639 VanDerWaalsContact C-N 3.35Å; F637-F639 PolarHBondContact O-N 3.34Å; F639-K642 PolarHBondContact O-N 3.49Å; F639-K643 WeakPolarHBondContact O-CB 3.16Å; F639-K643 PolarHBondContact O-N 2.73Å
640	L	91.8	Very high	84.3	Confident	5 Å²	5	56 Å²	56	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-57.7	-57	177.6	174	66.9	0	0	0	111.6	C573 V576 E577 Q636 F637 K642 K643 L644	C573-L640 HydrophobicContact CB-CD2 4.02Å; V576-L640 HydrophobicContact CB-CD2 4.05Å; V576-L640 HydrophobicContact CG1-CD2 3.92Å; E577-L640 HydrophobicContact CB-CD1 3.87Å; E577-L640 HydrophobicContact CG-CD1 4.34Å; Q636-L640 PolarHBondContact O-N 2.89Å; F637-L640 PolarHBondContact O-N 3.33Å; L640-K642 VanDerWaalsContact C-N 3.3Å; L640-K642 PolarHBondContact O-N 2.94Å; L640-K643 WeakPolarHBondContact O-CA 3.26Å; L640-K643 VanDerWaalsContact O-CB 3.32Å; L640-K643 WeakPolarHBondContact O-CB 3.4Å; L640-K643 PolarHBondContact O-N 3.18Å; L640-L644 HydrophobicContact CD1-CD1 3.91Å; L640-L644 HydrophobicContact CD1-CG 4.11Å; L640-L644 HydrophobicContact CG-CD1 3.96Å; L640-L644 HydrophobicContact CG-CG 4.42Å; L640-L644 WeakPolarHBondContact O-CG 3.12Å; L640-L644 PolarHBondContact O-N 3.07Å
641	F	90.3	Very high	82.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.7	-26.8	-175.2	-73.9	-70.6	0	0	0	112.7	V576 T595 A598 H599 V602 F637 L644 A645	V576-F641 HydrophobicContact CG1-CE1 4.27Å; V576-F641 HydrophobicContact CG1-CZ 4.1Å; T595-F641 HydrophobicContact CG2-CD1 4.37Å; A598-F641 HydrophobicContact CB-CE1 3.94Å; A598-F641 HydrophobicContact CB-CZ 4.38Å; H599-F641 VanDerWaalsContact CA-CZ 3.44Å; H599-F641 HydrophobicContact CB-CB 4.19Å; H599-F641 HydrophobicContact CB-CD1 3.58Å; H599-F641 HydrophobicContact CB-CD2 3.83Å; H599-F641 HydrophobicContact CB-CE1 3.85Å; H599-F641 HydrophobicContact CB-CE2 4.1Å; H599-F641 HydrophobicContact CB-CG 3.58Å; H599-F641 HydrophobicContact CB-CZ 4.11Å; H599-F641 AromaticContact CD2-CD2 3.34Å; H599-F641 WeakPolarHBondContact CD2-CD2 3.41Å; H599-F641 AromaticContact CD2-CE2 3.85Å; H599-F641 AromaticContact CD2-CG 3.82Å; H599-F641 AromaticContact CG-CD2 3.55Å; H599-F641 AromaticContact CG-CG 3.52Å; H599-F641 AromaticContact ND1-CG 3.96Å; H599-F641 AromaticContact NE2-CD2 3.98Å; V602-F641 HydrophobicContact CB-CE2 4.17Å; V602-F641 HydrophobicContact CB-CZ 4.37Å; V602-F641 HydrophobicContact CG1-CE2 4.41Å; V602-F641 HydrophobicContact CG2-CE2 4.12Å; V602-F641 HydrophobicContact CG2-CZ 3.9Å; F637-F641 VanDerWaalsContact O-CD2 3.3Å; F637-F641 WeakPolarHBondContact O-CD2 3.26Å; F637-F641 PolarHBondContact O-N 2.97Å; F641-L644 HydrophobicContact CD1-CD1 4.14Å; F641-L644 HydrophobicContact CE1-CD1 4.22Å; F641-L644 PolarHBondContact O-N 2.9Å; F641-A645 WeakPolarHBondContact O-CB 3.29Å; F641-A645 PolarHBondContact O-N 3.38Å
642	K	88.4	Confident	81.2	Confident	109 Å²	109	61 Å²	61	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-40.7	168	-173.8	167.7	-171.9	156	0	111.6	R638 F639 L640 V646 E653	R638-K642 WeakPolarHBondContact O-CB 3.14Å; R638-K642 PolarHBondContact O-N 3.19Å; F639-K642 PolarHBondContact O-N 3.49Å; L640-K642 VanDerWaalsContact C-N 3.3Å; L640-K642 PolarHBondContact O-N 2.94Å; K642-V646 WeakPolarHBondContact O-CG2 3.43Å; K642-V646 PolarHBondContact O-N 3.3Å; K642-E653 IonicContact NZ-OE1 3.66Å; K642-E653 PolarHBondContact NZ-OE1 2.75Å
643	K	88.4	Confident	79.7	Confident	102 Å²	102	59.3 Å²	59.3	44%	0.443	33%	0.325	S	S	.	.	H	α-helix	trans	-65.4	-45.7	174.4	-178.5	-177	178.1	-178.4	0	111.6	E577 F639 L640 A645 V646	E577-K643 WeakPolarHBondContact OE1-CE 3.29Å; E577-K643 IonicContact OE1-NZ 2.73Å; E577-K643 PolarHBondContact OE1-NZ 3.37Å; E577-K643 IonicContact OE2-NZ 3.75Å; F639-K643 WeakPolarHBondContact O-CB 3.16Å; F639-K643 PolarHBondContact O-N 2.73Å; L640-K643 WeakPolarHBondContact O-CA 3.26Å; L640-K643 VanDerWaalsContact O-CB 3.32Å; L640-K643 WeakPolarHBondContact O-CB 3.4Å; L640-K643 PolarHBondContact O-N 3.18Å; K643-A645 VanDerWaalsContact C-N 3.3Å; K643-A645 PolarHBondContact O-N 3.46Å; K643-V646 WeakPolarHBondContact O-CB 3.17Å; K643-V646 VanDerWaalsContact O-CG2 3.27Å; K643-V646 WeakPolarHBondContact O-CG2 3.29Å; K643-V646 PolarHBondContact O-N 2.97Å
644	L	87.4	Confident	78.5	Confident	29 Å²	29	61.8 Å²	61.8	15%	0.152	35%	0.352	C	S	.	.	H	α-helix	trans	-69	-28	179.5	-63.4	179.5	0	0	0	112.9	V576 F580 T595 L640 F641 V646	V576-L644 HydrophobicContact CG1-CD1 4.03Å; F580-L644 HydrophobicContact CB-CD1 3.98Å; F580-L644 HydrophobicContact CB-CD2 3.67Å; F580-L644 HydrophobicContact CB-CG 4.41Å; F580-L644 HydrophobicContact CD1-CB 4.43Å; F580-L644 HydrophobicContact CD1-CD1 3.9Å; F580-L644 HydrophobicContact CD1-CD2 4.41Å; F580-L644 HydrophobicContact CD1-CG 4.47Å; F580-L644 HydrophobicContact CD2-CD1 4.23Å; F580-L644 HydrophobicContact CE1-CD1 4.48Å; F580-L644 HydrophobicContact CG-CD1 3.75Å; F580-L644 HydrophobicContact CG-CD2 4.28Å; T595-L644 HydrophobicContact CG2-CB 4.13Å; L640-L644 HydrophobicContact CD1-CD1 3.91Å; L640-L644 HydrophobicContact CD1-CG 4.11Å; L640-L644 HydrophobicContact CG-CD1 3.96Å; L640-L644 HydrophobicContact CG-CG 4.42Å; L640-L644 WeakPolarHBondContact O-CG 3.12Å; L640-L644 PolarHBondContact O-N 3.07Å; F641-L644 HydrophobicContact CD1-CD1 4.14Å; F641-L644 HydrophobicContact CE1-CD1 4.22Å; F641-L644 PolarHBondContact O-N 2.9Å; L644-V646 VanDerWaalsContact C-N 3.34Å
645	A	82.6	Confident	78	Confident	9 Å²	9	63.5 Å²	63.5	7%	0.074	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.5	176.6	0	0	0	0	0	114.1	F641 K643 G647 S648 T652	F641-A645 WeakPolarHBondContact O-CB 3.29Å; F641-A645 PolarHBondContact O-N 3.38Å; K643-A645 VanDerWaalsContact C-N 3.3Å; K643-A645 PolarHBondContact O-N 3.46Å; A645-G647 PolarHBondContact O-N 3.38Å; A645-G647 VanDerWaalsContact O-N 3.11Å; A645-S648 VanDerWaalsContact O-CB 3.29Å; A645-S648 WeakPolarHBondContact O-CB 3.11Å; A645-S648 PolarHBondContact O-N 3.38Å; A645-S648 PolarHBondContact O-OG 3.07Å; A645-T652 HydrophobicContact CB-CG2 3.87Å
646	V	73.4	Confident	77.8	Confident	120 Å²	120	58.6 Å²	58.6	73%	0.727	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	121.8	179.1	174.5	0	0	0	0	110.1	K642 K643 L644	K642-V646 WeakPolarHBondContact O-CG2 3.43Å; K642-V646 PolarHBondContact O-N 3.3Å; K643-V646 WeakPolarHBondContact O-CB 3.17Å; K643-V646 VanDerWaalsContact O-CG2 3.27Å; K643-V646 WeakPolarHBondContact O-CG2 3.29Å; K643-V646 PolarHBondContact O-N 2.97Å; L644-V646 VanDerWaalsContact C-N 3.34Å
647	G	62.8	Low	77.5	Confident	57 Å²	57	55.9 Å²	55.9	59%	0.588	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	3	-177.4	0	0	0	0	0	115.7	K588 A645	K588-G647 PolarHBondContact NZ-O 3.01Å; A645-G647 PolarHBondContact O-N 3.38Å; A645-G647 VanDerWaalsContact O-N 3.11Å
648	S	59.7	Low	77.3	Confident	26 Å²	26	55.8 Å²	55.8	18%	0.182	33%	0.328	C	S	.	.	S	Bend	trans	-88	-18	174.5	78.9	0	0	0	0	113.9	A645	A645-S648 VanDerWaalsContact O-CB 3.29Å; A645-S648 WeakPolarHBondContact O-CB 3.11Å; A645-S648 PolarHBondContact O-N 3.38Å; A645-S648 PolarHBondContact O-OG 3.07Å
649	G	55.5	Low	77.4	Confident	82 Å²	82	52.8 Å²	52.8	85%	0.845	32%	0.316	S	S	*	.			trans	76.7	17.5	177.1	0	0	0	0	0	115
650	E	59.2	Low	77.4	Confident	80 Å²	80	48.4 Å²	48.4	37%	0.374	30%	0.298	S	S	.	.			trans	-113.6	151	-175.9	-104.7	177.9	-168.3	0	0	114.8	K592 I596 T652	K592-E650 VanDerWaalsContact CE-CG 3.47Å; K592-E650 WeakPolarHBondContact CE-OE1 3.44Å; K592-E650 WeakPolarHBondContact CE-OE2 3.36Å; K592-E650 IonicContact NZ-OE1 3.6Å; K592-E650 PolarHBondContact NZ-OE1 2.88Å; K592-E650 IonicContact NZ-OE2 2.8Å; I596-E650 WeakPolarHBondContact CD1-OE2 3.49Å; I596-E650 WeakPolarHBondContact CG1-OE2 3.43Å; E650-T652 PolarHBondContact O-N 3.36Å
651	D	61.2	Low	77.4	Confident	125 Å²	125	49.1 Å²	49.1	67%	0.668	30%	0.304	S	S	*	.			trans	-88.6	97.4	171.8	-171.5	1.3	0	0	0	109.9	E653	D651-E653 PolarHBondContact O-N 2.63Å; D651-E653 WeakPolarHBondContact OD1-CB 3.18Å; D651-E653 WeakPolarHBondContact OD1-CG 3.34Å; D651-E653 PolarHBondContact OD1-N 3.32Å
652	T	62.1	Low	77.5	Confident	16 Å²	16	49.1 Å²	49.1	10%	0.098	30%	0.304	C	S	.	.			trans	-82.8	5.3	174.4	55.1	0	0	0	0	112.6	H599 A645 E650 G654	H599-T652 PolarHBondContact CE1-O 2.94Å; A645-T652 HydrophobicContact CB-CG2 3.87Å; E650-T652 PolarHBondContact O-N 3.36Å; T652-G654 VanDerWaalsContact C-N 3.32Å; T652-G654 PolarHBondContact O-N 3.38Å
653	E	62.3	Low	77.7	Confident	95 Å²	95	43.9 Å²	43.9	44%	0.444	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-21.9	-166.1	-64.6	-176.1	166.5	0	0	113.7	K642 D651	K642-E653 IonicContact NZ-OE1 3.66Å; K642-E653 PolarHBondContact NZ-OE1 2.75Å; D651-E653 PolarHBondContact O-N 2.63Å; D651-E653 WeakPolarHBondContact OD1-CB 3.18Å; D651-E653 WeakPolarHBondContact OD1-CG 3.34Å; D651-E653 PolarHBondContact OD1-N 3.32Å
654	G	70.1	Confident	77.8	Confident	60 Å²	60	43 Å²	43	62%	0.619	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-28	-170.5	0	0	0	0	0	117.3	T652 G657	T652-G654 VanDerWaalsContact C-N 3.32Å; T652-G654 PolarHBondContact O-N 3.38Å; G654-G657 PolarHBondContact O-N 2.89Å
655	L	82.7	Confident	78	Confident	36 Å²	36	41.6 Å²	41.6	19%	0.188	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.9	-170.1	-74.5	172.6	0	0	0	113	H599 R600 V603 G657 I658 I729	H599-L655 HydrophobicContact CB-CD1 4.17Å; R600-L655 HydrophobicContact CB-CD1 4.16Å; V603-L655 HydrophobicContact CG2-CB 4.37Å; L655-G657 PolarHBondContact O-N 3.15Å; L655-I658 WeakPolarHBondContact O-CG2 3.39Å; L655-I729 HydrophobicContact CD2-CD1 4.08Å
656	C	87.1	Confident	78.3	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.1	-179.7	-73.6	0	0	0	0	113.6	H599 A634 R638 I658 I659	H599-C656 PolarHBondContact NE2-SG 3.15Å; A634-C656 HydrophobicContact CB-CB 4.37Å; A634-C656 PolarHBondContact O-SG 3.34Å; R638-C656 HydrophobicContact CB-CB 4.48Å; C656-I658 PolarHBondContact O-N 3.09Å; C656-I659 WeakPolarHBondContact O-CB 3.49Å; C656-I659 PolarHBondContact O-N 3.24Å
657	G	87.4	Confident	79.1	Confident	8 Å²	8	39.2 Å²	39.2	8%	0.082	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-14.2	-176.7	0	0	0	0	0	114.7	G654 L655 A661 Y685	G654-G657 PolarHBondContact O-N 2.89Å; L655-G657 PolarHBondContact O-N 3.15Å; G657-A661 WeakPolarHBondContact O-CB 3.28Å; G657-A661 PolarHBondContact O-N 3.29Å; G657-Y685 VanDerWaalsContact C-OH 3.23Å; G657-Y685 PolarHBondContact O-OH 2.93Å
658	I	89.8	Confident	80.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-72.6	-37.2	172.7	-169.8	165.5	0	0	0	111.8	V603 I607 L655 C656 E660 A661 I662 Y685 I729 F730	V603-I658 HydrophobicContact CG1-CG2 3.66Å; I607-I658 HydrophobicContact CD1-CB 4.42Å; I607-I658 HydrophobicContact CD1-CD1 3.58Å; I607-I658 HydrophobicContact CD1-CG1 3.98Å; I607-I658 HydrophobicContact CD1-CG2 3.56Å; I607-I658 HydrophobicContact CG1-CG2 4.3Å; L655-I658 WeakPolarHBondContact O-CG2 3.39Å; C656-I658 PolarHBondContact O-N 3.09Å; I658-E660 VanDerWaalsContact C-N 3.33Å; I658-A661 PolarHBondContact O-N 2.91Å; I658-I662 HydrophobicContact CG1-CD1 4.27Å; I658-I662 VanDerWaalsContact O-CG1 3.26Å; I658-I662 WeakPolarHBondContact O-CG1 3.35Å; I658-I662 PolarHBondContact O-N 3.06Å; I658-Y685 VanDerWaalsContact CA-OH 3.26Å; I658-Y685 WeakPolarHBondContact CA-OH 3.39Å; I658-Y685 HydrophobicContact CB-CD1 4.49Å; I658-Y685 HydrophobicContact CB-CE1 3.77Å; I658-Y685 HydrophobicContact CB-CE2 4.14Å; I658-Y685 HydrophobicContact CD1-CD1 3.77Å; I658-Y685 HydrophobicContact CD1-CE1 3.87Å; I658-Y685 HydrophobicContact CD1-CG 4.16Å; I658-Y685 HydrophobicContact CG1-CD1 4.14Å; I658-Y685 HydrophobicContact CG1-CD2 4.26Å; I658-Y685 HydrophobicContact CG1-CE1 3.9Å; I658-Y685 HydrophobicContact CG1-CE2 4Å; I658-Y685 HydrophobicContact CG1-CG 4.33Å; I658-Y685 PolarHBondContact N-OH 3.42Å; I658-Y685 VanDerWaalsContact N-OH 3.08Å; I658-I729 HydrophobicContact CD1-CB 4.22Å; I658-I729 HydrophobicContact CD1-CD1 4.13Å; I658-I729 HydrophobicContact CD1-CG2 4.03Å; I658-F730 HydrophobicContact CD1-CD2 4.05Å; I658-F730 HydrophobicContact CD1-CE2 3.44Å; I658-F730 VanDerWaalsContact CD1-CE2 3.44Å; I658-F730 HydrophobicContact CD1-CZ 3.87Å; I658-F730 HydrophobicContact CG1-CE2 4.11Å; I658-F730 HydrophobicContact CG1-CZ 4.25Å
659	I	92.2	Very high	81.5	Confident	0 Å²	0	42 Å²	42	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-42.2	178.2	-60.3	172.8	0	0	0	108.9	V603 Y606 M630 A634 F637 C656 I662 A663	V603-I659 HydrophobicContact CG1-CD1 4.41Å; V603-I659 HydrophobicContact CG1-CG1 4.5Å; Y606-I659 HydrophobicContact CD1-CD1 3.7Å; Y606-I659 HydrophobicContact CD1-CG1 3.9Å; Y606-I659 HydrophobicContact CD1-CG2 4.03Å; Y606-I659 HydrophobicContact CE1-CD1 4.25Å; Y606-I659 HydrophobicContact CE1-CG1 4.36Å; Y606-I659 HydrophobicContact CE1-CG2 3.6Å; Y606-I659 HydrophobicContact CG-CD1 3.96Å; M630-I659 HydrophobicContact CB-CG2 4.11Å; M630-I659 HydrophobicContact CE-CG2 4.25Å; A634-I659 HydrophobicContact CB-CB 3.93Å; A634-I659 HydrophobicContact CB-CD1 4.33Å; A634-I659 HydrophobicContact CB-CG2 3.91Å; F637-I659 HydrophobicContact CD2-CD1 4.29Å; C656-I659 WeakPolarHBondContact O-CB 3.49Å; C656-I659 PolarHBondContact O-N 3.24Å; I659-I662 PolarHBondContact O-N 3.36Å; I659-A663 WeakPolarHBondContact O-CB 3.43Å; I659-A663 PolarHBondContact O-N 2.82Å
660	E	91.3	Very high	82.9	Confident	56 Å²	56	41.6 Å²	41.6	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-62.3	-46	175	-61.3	178.4	152.9	0	0	111.7	A634 R638 I658 I662 A663 E664	A634-E660 HydrophobicContact CB-CG 4.22Å; R638-E660 IonicContact CZ-OE1 3.74Å; R638-E660 IonicContact NH1-OE1 3.81Å; R638-E660 IonicContact NH2-OE1 3.46Å; R638-E660 PolarHBondContact NH2-OE1 2.65Å; I658-E660 VanDerWaalsContact C-N 3.33Å; E660-I662 VanDerWaalsContact C-N 3.31Å; E660-I662 PolarHBondContact O-N 2.91Å; E660-A663 WeakPolarHBondContact O-CA 3.44Å; E660-A663 WeakPolarHBondContact O-CB 3.47Å; E660-A663 PolarHBondContact O-N 3.02Å; E660-A663 VanDerWaalsContact O-N 3.07Å; E660-E664 PolarHBondContact O-N 3.06Å
661	A	90.7	Very high	84.1	Confident	20 Å²	20	40 Å²	40	17%	0.165	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-38.9	177.8	0	0	0	0	0	112.4	G657 I658 V665 L681 Y685	G657-A661 WeakPolarHBondContact O-CB 3.28Å; G657-A661 PolarHBondContact O-N 3.29Å; I658-A661 PolarHBondContact O-N 2.91Å; A661-V665 PolarHBondContact O-N 3.43Å; A661-L681 HydrophobicContact CB-CD1 3.62Å; A661-Y685 HydrophobicContact CB-CE2 3.96Å
662	I	92.5	Very high	85.1	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-38.3	173.6	-64.6	167.9	0	0	0	110.9	I607 I610 M611 M630 I658 I659 E660 E664 V665 I666 L681 L696 F730	I607-I662 HydrophobicContact CG1-CD1 4.4Å; I607-I662 HydrophobicContact CG2-CD1 4.17Å; I610-I662 HydrophobicContact CD1-CD1 4.19Å; I610-I662 HydrophobicContact CD1-CG2 4.21Å; I610-I662 HydrophobicContact CG2-CG2 4.27Å; M611-I662 HydrophobicContact CE-CD1 4.23Å; M630-I662 HydrophobicContact CE-CB 4.17Å; M630-I662 HydrophobicContact CE-CG2 3.83Å; I658-I662 HydrophobicContact CG1-CD1 4.27Å; I658-I662 VanDerWaalsContact O-CG1 3.26Å; I658-I662 WeakPolarHBondContact O-CG1 3.35Å; I658-I662 PolarHBondContact O-N 3.06Å; I659-I662 PolarHBondContact O-N 3.36Å; E660-I662 VanDerWaalsContact C-N 3.31Å; E660-I662 PolarHBondContact O-N 2.91Å; I662-E664 VanDerWaalsContact C-N 3.33Å; I662-E664 PolarHBondContact O-N 2.83Å; I662-V665 PolarHBondContact O-N 2.84Å; I662-I666 HydrophobicContact CG2-CD1 4.1Å; I662-I666 PolarHBondContact O-N 3.32Å; I662-I666 VanDerWaalsContact O-N 3.13Å; I662-L681 HydrophobicContact CG1-CD1 4.24Å; I662-L681 HydrophobicContact CG1-CD2 4.4Å; I662-L696 HydrophobicContact CG2-CD1 3.48Å; I662-L696 VanDerWaalsContact CG2-CD1 3.48Å; I662-L696 HydrophobicContact CG2-CD2 4.22Å; I662-F730 HydrophobicContact CD1-CZ 4.11Å
663	A	92.3	Very high	86.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-38.1	177.7	0	0	0	0	0	112.1	A627 M630 I631 I659 E660 V665 I666 K667	A627-A663 HydrophobicContact CB-CB 4.23Å; A627-A663 WeakPolarHBondContact CB-O 3.4Å; M630-A663 HydrophobicContact CB-CB 3.95Å; M630-A663 HydrophobicContact CE-CB 4.16Å; M630-A663 HydrophobicContact SD-CB 4.5Å; I631-A663 HydrophobicContact CD1-CB 4.22Å; I631-A663 HydrophobicContact CG1-CB 3.78Å; I659-A663 WeakPolarHBondContact O-CB 3.43Å; I659-A663 PolarHBondContact O-N 2.82Å; E660-A663 WeakPolarHBondContact O-CA 3.44Å; E660-A663 WeakPolarHBondContact O-CB 3.47Å; E660-A663 PolarHBondContact O-N 3.02Å; E660-A663 VanDerWaalsContact O-N 3.07Å; A663-V665 VanDerWaalsContact C-N 3.35Å; A663-V665 PolarHBondContact O-N 3.13Å; A663-I666 PolarHBondContact O-N 3.01Å; A663-I666 VanDerWaalsContact O-N 3.09Å; A663-K667 VanDerWaalsContact O-CB 3.3Å; A663-K667 WeakPolarHBondContact O-CB 3.5Å; A663-K667 PolarHBondContact O-N 3.16Å
664	E	91.2	Very high	87.4	Confident	82 Å²	82	36.7 Å²	36.7	38%	0.383	22%	0.22	S	C	.	.	H	α-helix	trans	-61.9	-40.9	174.7	-68.5	-54.8	141.1	0	0	112.1	E660 I662 I666 K667 L668	E660-E664 PolarHBondContact O-N 3.06Å; I662-E664 VanDerWaalsContact C-N 3.33Å; I662-E664 PolarHBondContact O-N 2.83Å; E664-I666 VanDerWaalsContact C-N 3.27Å; E664-I666 PolarHBondContact O-N 2.92Å; E664-K667 PolarHBondContact O-N 2.82Å; E664-L668 PolarHBondContact O-N 2.95Å
665	V	91.4	Very high	88.1	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-34.3	173	179.4	0	0	0	0	111.7	A661 I662 A663 L674 E677 V678 L681 L696 R700	A661-V665 PolarHBondContact O-N 3.43Å; I662-V665 PolarHBondContact O-N 2.84Å; A663-V665 VanDerWaalsContact C-N 3.35Å; A663-V665 PolarHBondContact O-N 3.13Å; V665-L674 HydrophobicContact CG1-CD2 4.25Å; V665-E677 HydrophobicContact CG2-CB 4.1Å; V665-V678 HydrophobicContact CG1-CG2 4Å; V665-L681 HydrophobicContact CG2-CD2 4.32Å; V665-L696 HydrophobicContact CB-CD2 4.24Å; V665-L696 HydrophobicContact CG1-CD2 3.9Å; V665-L696 HydrophobicContact CG1-CG 4.28Å; V665-R700 PolarHBondContact O-NH1 3.22Å
666	I	90	Very high	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-76.2	-40.9	177.5	-67.9	164.4	0	0	0	111.1	F617 R623 A627 M630 I662 A663 E664 L696	F617-I666 HydrophobicContact CD2-CG2 3.83Å; F617-I666 HydrophobicContact CE2-CD1 4.13Å; F617-I666 HydrophobicContact CE2-CG1 4.48Å; F617-I666 HydrophobicContact CE2-CG2 3.66Å; F617-I666 HydrophobicContact CZ-CG2 4.48Å; R623-I666 HydrophobicContact CB-CG2 4.22Å; R623-I666 WeakPolarHBondContact CD-O 3.41Å; R623-I666 HydrophobicContact CG-CG2 4.39Å; A627-I666 HydrophobicContact CB-CB 4.34Å; A627-I666 HydrophobicContact CB-CG2 4.16Å; M630-I666 HydrophobicContact CE-CD1 3.89Å; M630-I666 HydrophobicContact SD-CD1 3.48Å; M630-I666 WeakPolarHBondContact SD-CD1 3.48Å; I662-I666 HydrophobicContact CG2-CD1 4.1Å; I662-I666 PolarHBondContact O-N 3.32Å; I662-I666 VanDerWaalsContact O-N 3.13Å; A663-I666 PolarHBondContact O-N 3.01Å; A663-I666 VanDerWaalsContact O-N 3.09Å; E664-I666 VanDerWaalsContact C-N 3.27Å; E664-I666 PolarHBondContact O-N 2.92Å; I666-L696 HydrophobicContact CD1-CD1 4.19Å; I666-L696 HydrophobicContact CG1-CD1 4.09Å
667	K	88.9	Confident	88.3	Confident	78 Å²	78	44.4 Å²	44.4	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-70.7	-29	-175.4	-169.4	177.2	176.1	-175.9	0	113.6	A627 A663 E664 T669	A627-K667 HydrophobicContact CB-CB 3.67Å; A627-K667 HydrophobicContact CB-CG 4.28Å; A663-K667 VanDerWaalsContact O-CB 3.3Å; A663-K667 WeakPolarHBondContact O-CB 3.5Å; A663-K667 PolarHBondContact O-N 3.16Å; E664-K667 PolarHBondContact O-N 2.82Å; K667-T669 PolarHBondContact O-N 3.21Å; K667-T669 VanDerWaalsContact O-N 3.16Å
668	L	89.8	Confident	88.3	Confident	30 Å²	30	44 Å²	44	16%	0.157	23%	0.234	C	C	.	.			trans	-50.8	121.6	-176.6	176.9	76.5	0	0	0	111.2	E664 D670 L673 L674 E677 R700	E664-L668 PolarHBondContact O-N 2.95Å; L668-D670 WeakPolarHBondContact CD2-O 3.3Å; L668-L673 HydrophobicContact CD1-CB 4.21Å; L668-L673 HydrophobicContact CD2-CB 4.02Å; L668-L674 HydrophobicContact CD2-CB 4.47Å; L668-L674 HydrophobicContact CD2-CD2 3.99Å; L668-L674 HydrophobicContact CD2-CG 4.04Å; L668-E677 HydrophobicContact CD1-CG 4.35Å; L668-E677 HydrophobicContact CD2-CG 4Å; L668-R700 PolarHBondContact O-NH1 3.16Å; L668-R700 PolarHBondContact O-NH2 3.16Å
669	T	84.1	Confident	88.2	Confident	112 Å²	112	46 Å²	46	69%	0.687	25%	0.248	S	C	*	.	S	Bend	trans	-81.8	-34.6	-173.4	-52.1	0	0	0	0	112.9	K667 P671	K667-T669 PolarHBondContact O-N 3.21Å; K667-T669 VanDerWaalsContact O-N 3.16Å; T669-P671 WeakPolarHBondContact O-CD 3.48Å
670	D	85.6	Confident	88	Confident	73 Å²	73	49.6 Å²	49.6	39%	0.39	27%	0.27	S	S	.	.			trans	-91.3	112.3	-179.7	-176	-5.4	0	0	0	111	L668 S672 L673	L668-D670 WeakPolarHBondContact CD2-O 3.3Å; D670-S672 PolarHBondContact O-N 3.06Å; D670-S672 WeakPolarHBondContact OD1-CB 3.35Å; D670-S672 PolarHBondContact OD1-N 2.82Å; D670-S672 PolarHBondContact OD1-OG 3.34Å; D670-S672 PolarHBondContact OD2-OG 3.13Å; D670-L673 HydrophobicContact CB-CD1 4.31Å; D670-L673 HydrophobicContact CB-CG 4.41Å; D670-L673 PolarHBondContact O-N 3.29Å
671	P	82.9	Confident	87.9	Confident	46 Å²	46	47.2 Å²	47.2	30%	0.299	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-61.6	-27.9	177.9	-22.8	35.3	0	0	0	113.2	T669 L673 L674 M707	T669-P671 WeakPolarHBondContact O-CD 3.48Å; P671-L673 PolarHBondContact O-N 3.09Å; P671-L674 HydrophobicContact CB-CD1 4.17Å; P671-L674 WeakPolarHBondContact O-CB 3.5Å; P671-L674 WeakPolarHBondContact O-CG 3.37Å; P671-L674 PolarHBondContact O-N 3.44Å; P671-M707 HydrophobicContact CB-CE 3.83Å; P671-M707 HydrophobicContact CB-SD 4.24Å; P671-M707 WeakPolarHBondContact O-CE 3.34Å
672	S	82.8	Confident	87.7	Confident	85 Å²	85	47.4 Å²	47.4	59%	0.594	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-64.5	-22.8	-177.1	74.5	0	0	0	0	113.3	D670	D670-S672 PolarHBondContact O-N 3.06Å; D670-S672 WeakPolarHBondContact OD1-CB 3.35Å; D670-S672 PolarHBondContact OD1-N 2.82Å; D670-S672 PolarHBondContact OD1-OG 3.34Å; D670-S672 PolarHBondContact OD2-OG 3.13Å
673	L	86.8	Confident	87.4	Confident	83 Å²	83	51.6 Å²	51.6	44%	0.435	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-92.2	-0.3	178.1	-60.6	178.8	0	0	0	113.4	L668 D670 P671 Y675 L676 E677	L668-L673 HydrophobicContact CD1-CB 4.21Å; L668-L673 HydrophobicContact CD2-CB 4.02Å; D670-L673 HydrophobicContact CB-CD1 4.31Å; D670-L673 HydrophobicContact CB-CG 4.41Å; D670-L673 PolarHBondContact O-N 3.29Å; P671-L673 PolarHBondContact O-N 3.09Å; L673-Y675 PolarHBondContact O-N 3.33Å; L673-L676 WeakPolarHBondContact O-CB 3.5Å; L673-L676 PolarHBondContact O-N 3.47Å; L673-E677 PolarHBondContact O-N 3.25Å
674	L	85.6	Confident	87.1	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.3	-36.8	-178.5	-88.1	171.1	0	0	0	113.3	V665 L668 P671 L676 E677 V678 L697 M707 I711	V665-L674 HydrophobicContact CG1-CD2 4.25Å; L668-L674 HydrophobicContact CD2-CB 4.47Å; L668-L674 HydrophobicContact CD2-CD2 3.99Å; L668-L674 HydrophobicContact CD2-CG 4.04Å; P671-L674 HydrophobicContact CB-CD1 4.17Å; P671-L674 WeakPolarHBondContact O-CB 3.5Å; P671-L674 WeakPolarHBondContact O-CG 3.37Å; P671-L674 PolarHBondContact O-N 3.44Å; L674-L676 VanDerWaalsContact C-N 3.27Å; L674-L676 PolarHBondContact O-N 3.25Å; L674-E677 PolarHBondContact O-N 3.15Å; L674-V678 WeakPolarHBondContact O-CB 3.46Å; L674-V678 VanDerWaalsContact O-CG2 3.23Å; L674-V678 WeakPolarHBondContact O-CG2 3.34Å; L674-V678 PolarHBondContact O-N 3.4Å; L674-L697 HydrophobicContact CD2-CD2 4.35Å; L674-M707 HydrophobicContact CD1-CE 4.19Å; L674-M707 HydrophobicContact CD1-SD 4.04Å; L674-I711 HydrophobicContact CB-CD1 3.89Å
675	Y	85.4	Confident	86.9	Confident	96 Å²	96	54 Å²	54	38%	0.376	30%	0.296	S	S	.	.	H	α-helix	trans	-58	-41.4	176.8	170.4	-100.6	0	0	0	111.9	L673 S679 T714 L715	L673-Y675 PolarHBondContact O-N 3.33Å; Y675-S679 WeakPolarHBondContact O-CB 3.32Å; Y675-S679 PolarHBondContact O-N 2.85Å; Y675-T714 HydrophobicContact CD2-CG2 4.16Å; Y675-T714 HydrophobicContact CE2-CG2 3.36Å; Y675-L715 HydrophobicContact CD2-CD2 4.48Å; Y675-L715 HydrophobicContact CE2-CD2 3.94Å; Y675-L715 HydrophobicContact CE2-CG 4.15Å
676	L	86.1	Confident	86.6	Confident	101 Å²	101	55.9 Å²	55.9	53%	0.529	31%	0.308	S	S	.	.	H	α-helix	trans	-65.7	-49.3	-177.7	-174.4	68.1	0	0	0	111.1	L673 L674 S679 T680	L673-L676 WeakPolarHBondContact O-CB 3.5Å; L673-L676 PolarHBondContact O-N 3.47Å; L674-L676 VanDerWaalsContact C-N 3.27Å; L674-L676 PolarHBondContact O-N 3.25Å; L676-S679 WeakPolarHBondContact O-CB 3.38Å; L676-S679 PolarHBondContact O-N 3.3Å; L676-T680 PolarHBondContact O-N 3.22Å; L676-T680 PolarHBondContact O-OG1 3.41Å; L676-T680 VanDerWaalsContact O-OG1 3.12Å
677	E	88.1	Confident	86.5	Confident	61 Å²	61	57.1 Å²	57.1	29%	0.285	32%	0.315	S	S	.	.	H	α-helix	trans	-67.1	-39.5	-179.4	-67.9	-58.3	150.6	0	0	112.4	V665 L668 L673 L674 S679 T680 L681	V665-E677 HydrophobicContact CG2-CB 4.1Å; L668-E677 HydrophobicContact CD1-CG 4.35Å; L668-E677 HydrophobicContact CD2-CG 4Å; L673-E677 PolarHBondContact O-N 3.25Å; L674-E677 PolarHBondContact O-N 3.15Å; E677-S679 VanDerWaalsContact C-N 3.34Å; E677-T680 PolarHBondContact O-N 2.9Å; E677-L681 WeakPolarHBondContact O-CB 3.31Å; E677-L681 PolarHBondContact O-N 2.9Å
678	V	87.9	Confident	86.4	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-38.6	173.8	177.8	0	0	0	0	110.5	V665 L674 L681 V682 I693 L697 I711 L715	V665-V678 HydrophobicContact CG1-CG2 4Å; L674-V678 WeakPolarHBondContact O-CB 3.46Å; L674-V678 VanDerWaalsContact O-CG2 3.23Å; L674-V678 WeakPolarHBondContact O-CG2 3.34Å; L674-V678 PolarHBondContact O-N 3.4Å; V678-L681 WeakPolarHBondContact O-CB 3.42Å; V678-L681 PolarHBondContact O-N 3.44Å; V678-V682 HydrophobicContact CG1-CG2 4.35Å; V678-V682 VanDerWaalsContact O-CG2 3.26Å; V678-V682 WeakPolarHBondContact O-CG2 3.41Å; V678-V682 PolarHBondContact O-N 2.88Å; V678-I693 HydrophobicContact CG1-CD1 4.28Å; V678-I693 HydrophobicContact CG1-CG1 4.41Å; V678-I693 HydrophobicContact CG1-CG2 3.82Å; V678-L697 HydrophobicContact CG2-CD2 4.47Å; V678-I711 HydrophobicContact CB-CG2 4.29Å; V678-I711 HydrophobicContact CG1-CG2 4.09Å; V678-L715 HydrophobicContact CB-CD1 4.49Å; V678-L715 HydrophobicContact CG1-CD1 3.54Å
679	S	86.5	Confident	86.4	Confident	41 Å²	41	56.7 Å²	56.7	29%	0.287	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-41.7	174.1	-173.5	0	0	0	0	111.8	Y675 L676 E677 V682 S683	Y675-S679 WeakPolarHBondContact O-CB 3.32Å; Y675-S679 PolarHBondContact O-N 2.85Å; L676-S679 WeakPolarHBondContact O-CB 3.38Å; L676-S679 PolarHBondContact O-N 3.3Å; E677-S679 VanDerWaalsContact C-N 3.34Å; S679-V682 PolarHBondContact O-N 3.06Å; S679-S683 WeakPolarHBondContact O-CB 3.18Å; S679-S683 PolarHBondContact O-N 3.42Å
680	T	88.2	Confident	86.6	Confident	76 Å²	76	54.7 Å²	54.7	47%	0.466	30%	0.295	S	S	.	.	H	α-helix	trans	-62.3	-41.3	172.9	-59.3	0	0	0	0	111.8	L676 E677 S683 K684	L676-T680 PolarHBondContact O-N 3.22Å; L676-T680 PolarHBondContact O-OG1 3.41Å; L676-T680 VanDerWaalsContact O-OG1 3.12Å; E677-T680 PolarHBondContact O-N 2.9Å; T680-S683 PolarHBondContact O-N 2.99Å; T680-K684 WeakPolarHBondContact O-CB 3.49Å; T680-K684 PolarHBondContact O-N 3.41Å
681	L	88.5	Confident	86.7	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-62.2	-46.8	175.8	-175.1	70.9	0	0	0	111.8	A661 I662 V665 E677 V678 K684 Y685 I688 L696	A661-L681 HydrophobicContact CB-CD1 3.62Å; I662-L681 HydrophobicContact CG1-CD1 4.24Å; I662-L681 HydrophobicContact CG1-CD2 4.4Å; V665-L681 HydrophobicContact CG2-CD2 4.32Å; E677-L681 WeakPolarHBondContact O-CB 3.31Å; E677-L681 PolarHBondContact O-N 2.9Å; V678-L681 WeakPolarHBondContact O-CB 3.42Å; V678-L681 PolarHBondContact O-N 3.44Å; L681-K684 PolarHBondContact O-N 2.89Å; L681-Y685 HydrophobicContact CD1-CD2 3.77Å; L681-Y685 HydrophobicContact CD1-CE2 4.14Å; L681-Y685 PolarHBondContact O-N 3.12Å; L681-I688 HydrophobicContact CD2-CD1 3.8Å; L681-I688 HydrophobicContact CG-CD1 4.31Å; L681-L696 HydrophobicContact CD2-CD2 3.82Å
682	V	87.9	Confident	87.1	Confident	24 Å²	24	51.2 Å²	51.2	15%	0.145	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-41.3	177.3	173.8	0	0	0	0	111.2	V678 S679 K684 Y685 P686 I688 I693 L715	V678-V682 HydrophobicContact CG1-CG2 4.35Å; V678-V682 VanDerWaalsContact O-CG2 3.26Å; V678-V682 WeakPolarHBondContact O-CG2 3.41Å; V678-V682 PolarHBondContact O-N 2.88Å; S679-V682 PolarHBondContact O-N 3.06Å; V682-K684 VanDerWaalsContact C-N 3.33Å; V682-K684 PolarHBondContact O-N 2.78Å; V682-Y685 CarbonylContact O-C 3.23Å; V682-Y685 VanDerWaalsContact O-C 3.23Å; V682-Y685 PolarHBondContact O-N 3.45Å; V682-P686 WeakPolarHBondContact O-CA 3.48Å; V682-I688 HydrophobicContact CB-CG2 4.15Å; V682-I688 HydrophobicContact CG1-CG2 4.29Å; V682-I688 HydrophobicContact CG2-CG2 3.65Å; V682-I693 HydrophobicContact CG2-CD1 3.86Å; V682-L715 HydrophobicContact CG2-CD1 4.34Å
683	S	85.6	Confident	87.4	Confident	89 Å²	89	47.4 Å²	47.4	62%	0.622	25%	0.247	S	C	*	.	H	α-helix	trans	-63.1	-39	176.9	-178.8	0	0	0	0	112.2	S679 T680	S679-S683 WeakPolarHBondContact O-CB 3.18Å; S679-S683 PolarHBondContact O-N 3.42Å; T680-S683 PolarHBondContact O-N 2.99Å
684	K	85.2	Confident	87.5	Confident	113 Å²	113	44.4 Å²	44.4	49%	0.491	23%	0.234	S	C	.	.	H	α-helix	trans	-78.2	-31.3	178.7	-167.2	175.8	177.6	-169.5	0	112.9	T680 L681 V682	T680-K684 WeakPolarHBondContact O-CB 3.49Å; T680-K684 PolarHBondContact O-N 3.41Å; L681-K684 PolarHBondContact O-N 2.89Å; V682-K684 VanDerWaalsContact C-N 3.33Å; V682-K684 PolarHBondContact O-N 2.78Å
685	Y	87.2	Confident	87.7	Confident	18 Å²	18	44.8 Å²	44.8	7%	0.071	24%	0.238	C	C	.	.			trans	-130.6	80.8	-178.3	-57.3	-79.4	0	0	0	110.8	G657 I658 A661 L681 V682 D687 I688 Y726 F730	G657-Y685 VanDerWaalsContact C-OH 3.23Å; G657-Y685 PolarHBondContact O-OH 2.93Å; I658-Y685 VanDerWaalsContact CA-OH 3.26Å; I658-Y685 WeakPolarHBondContact CA-OH 3.39Å; I658-Y685 HydrophobicContact CB-CD1 4.49Å; I658-Y685 HydrophobicContact CB-CE1 3.77Å; I658-Y685 HydrophobicContact CB-CE2 4.14Å; I658-Y685 HydrophobicContact CD1-CD1 3.77Å; I658-Y685 HydrophobicContact CD1-CE1 3.87Å; I658-Y685 HydrophobicContact CD1-CG 4.16Å; I658-Y685 HydrophobicContact CG1-CD1 4.14Å; I658-Y685 HydrophobicContact CG1-CD2 4.26Å; I658-Y685 HydrophobicContact CG1-CE1 3.9Å; I658-Y685 HydrophobicContact CG1-CE2 4Å; I658-Y685 HydrophobicContact CG1-CG 4.33Å; I658-Y685 PolarHBondContact N-OH 3.42Å; I658-Y685 VanDerWaalsContact N-OH 3.08Å; A661-Y685 HydrophobicContact CB-CE2 3.96Å; L681-Y685 HydrophobicContact CD1-CD2 3.77Å; L681-Y685 HydrophobicContact CD1-CE2 4.14Å; L681-Y685 PolarHBondContact O-N 3.12Å; V682-Y685 CarbonylContact O-C 3.23Å; V682-Y685 VanDerWaalsContact O-C 3.23Å; V682-Y685 PolarHBondContact O-N 3.45Å; Y685-D687 PolarHBondContact O-N 3.36Å; Y685-D687 VanDerWaalsContact O-N 3.15Å; Y685-I688 WeakPolarHBondContact O-CB 3.38Å; Y685-I688 WeakPolarHBondContact O-CG2 3.47Å; Y685-I688 PolarHBondContact O-N 3.19Å; Y685-Y726 AromaticContact CD1-CE2 3.92Å; Y685-Y726 HydrophobicContact CD1-CE2 3.92Å; Y685-F730 HydrophobicContact CG-CE2 4.19Å
686	P	85.6	Confident	88	Confident	41 Å²	41	40.3 Å²	40.3	27%	0.266	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.2	-170.3	28.3	-36.5	0	0	0	114.9	V682 P722 Y726	V682-P686 WeakPolarHBondContact O-CA 3.48Å; P686-P722 HydrophobicContact CG-CB 3.8Å; P686-Y726 HydrophobicContact CG-CD1 4.17Å; P686-Y726 HydrophobicContact CG-CE1 4.13Å
687	D	87.8	Confident	88.1	Confident	26 Å²	26	35.6 Å²	35.6	14%	0.139	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1	175.3	75.1	-26	0	0	0	113.6	Y685 Y726 P728 I729 F730 K731	Y685-D687 PolarHBondContact O-N 3.36Å; Y685-D687 VanDerWaalsContact O-N 3.15Å; D687-Y726 HydrophobicContact CB-CE1 4.04Å; D687-Y726 PolarHBondContact OD1-OH 3.49Å; D687-P728 HydrophobicContact CB-CB 3.97Å; D687-P728 VanDerWaalsContact OD2-C 3.28Å; D687-P728 WeakPolarHBondContact OD2-CA 3.49Å; D687-P728 WeakPolarHBondContact OD2-CB 3.3Å; D687-I729 PolarHBondContact OD2-N 3.45Å; D687-F730 WeakPolarHBondContact O-CB 3.27Å; D687-F730 WeakPolarHBondContact OD1-CB 3.31Å; D687-F730 WeakPolarHBondContact OD1-CD2 3.34Å; D687-F730 WeakPolarHBondContact OD2-CA 3.38Å; D687-F730 PolarHBondContact OD2-N 3.25Å; D687-K731 PolarHBondContact OD2-N 3.37Å
688	I	87.9	Confident	88.2	Confident	17 Å²	17	35.2 Å²	35.2	9%	0.087	20%	0.197	C	C	.	.			trans	-66.4	136.4	171.7	-161.7	172.4	0	0	0	109.8	L681 V682 Y685 H692 I693 F730	L681-I688 HydrophobicContact CD2-CD1 3.8Å; L681-I688 HydrophobicContact CG-CD1 4.31Å; V682-I688 HydrophobicContact CB-CG2 4.15Å; V682-I688 HydrophobicContact CG1-CG2 4.29Å; V682-I688 HydrophobicContact CG2-CG2 3.65Å; Y685-I688 WeakPolarHBondContact O-CB 3.38Å; Y685-I688 WeakPolarHBondContact O-CG2 3.47Å; Y685-I688 PolarHBondContact O-N 3.19Å; I688-H692 HydrophobicContact CD1-CB 4.26Å; I688-H692 HydrophobicContact CG1-CB 3.6Å; I688-I693 HydrophobicContact CD1-CG1 4.04Å; I688-I693 HydrophobicContact CG1-CG1 4.2Å; I688-F730 HydrophobicContact CB-CD2 3.83Å; I688-F730 HydrophobicContact CB-CE2 4.08Å; I688-F730 HydrophobicContact CB-CG 4.06Å; I688-F730 HydrophobicContact CD1-CE1 4.02Å; I688-F730 HydrophobicContact CD1-CE2 4.04Å; I688-F730 HydrophobicContact CD1-CZ 3.76Å; I688-F730 HydrophobicContact CG1-CD1 4.05Å; I688-F730 HydrophobicContact CG1-CD2 4.14Å; I688-F730 HydrophobicContact CG1-CE1 4.07Å; I688-F730 HydrophobicContact CG1-CE2 4.15Å; I688-F730 HydrophobicContact CG1-CG 4.09Å; I688-F730 HydrophobicContact CG1-CZ 4.11Å
689	R	88.9	Confident	88.2	Confident	83 Å²	83	35.4 Å²	35.4	31%	0.313	20%	0.198	S	C	.	.			trans	-110.9	161.8	-178.4	-57.4	-170.5	-58.9	-91.7	-3.8	110.1	D691 H692 I693 I733	R689-D691 PolarHBondContact O-N 2.95Å; R689-D691 VanDerWaalsContact O-N 3.13Å; R689-H692 PolarHBondContact N-ND1 3.29Å; R689-H692 VanDerWaalsContact N-ND1 3.16Å; R689-H692 PolarHBondContact NH2-CE1 3.02Å; R689-H692 PolarHBondContact NH2-NE2 3.46Å; R689-H692 WeakPolarHBondContact O-CA 3.48Å; R689-H692 VanDerWaalsContact O-CB 3.28Å; R689-H692 WeakPolarHBondContact O-CB 3.32Å; R689-H692 PolarHBondContact O-N 3.12Å; R689-I693 PolarHBondContact O-N 2.93Å; R689-I693 VanDerWaalsContact O-N 3.15Å; R689-I733 PolarHBondContact NH2-O 3.33Å
690	D	88.5	Confident	88.3	Confident	70 Å²	70	33.5 Å²	33.5	37%	0.374	19%	0.185	S	C	.	.	H	α-helix	trans	-49.8	-40.8	176.9	-59.3	-6.2	0	0	0	112.8	H692 I693 A694 I712	D690-H692 VanDerWaalsContact C-N 3.28Å; D690-H692 PolarHBondContact O-N 3.36Å; D690-I693 PolarHBondContact O-N 3.27Å; D690-A694 WeakPolarHBondContact O-CB 3.46Å; D690-A694 PolarHBondContact O-N 3.05Å; D690-I712 HydrophobicContact CB-CG2 3.88Å
691	D	88.3	Confident	88.2	Confident	45 Å²	45	31.8 Å²	31.8	24%	0.241	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-37	177.4	-65.1	-39.6	0	0	0	112.3	R689 A695 V735 T737	R689-D691 PolarHBondContact O-N 2.95Å; R689-D691 VanDerWaalsContact O-N 3.13Å; D691-A695 WeakPolarHBondContact O-CB 3.43Å; D691-A695 PolarHBondContact O-N 2.92Å; D691-V735 HydrophobicContact CB-CB 4.12Å; D691-V735 HydrophobicContact CB-CG1 4.25Å; D691-T737 WeakPolarHBondContact OD1-CG2 3.33Å
692	H	90.6	Very high	88	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-70.5	-42.1	177	-54.1	154.4	0	0	0	111	M611 I688 R689 D690 A694 A695 L696 F730 I733 V735	M611-H692 HydrophobicContact SD-CB 3.99Å; M611-H692 VanDerWaalsContact SD-O 3.39Å; I688-H692 HydrophobicContact CD1-CB 4.26Å; I688-H692 HydrophobicContact CG1-CB 3.6Å; R689-H692 PolarHBondContact N-ND1 3.29Å; R689-H692 VanDerWaalsContact N-ND1 3.16Å; R689-H692 PolarHBondContact NH2-CE1 3.02Å; R689-H692 PolarHBondContact NH2-NE2 3.46Å; R689-H692 WeakPolarHBondContact O-CA 3.48Å; R689-H692 VanDerWaalsContact O-CB 3.28Å; R689-H692 WeakPolarHBondContact O-CB 3.32Å; R689-H692 PolarHBondContact O-N 3.12Å; D690-H692 VanDerWaalsContact C-N 3.28Å; D690-H692 PolarHBondContact O-N 3.36Å; H692-A694 VanDerWaalsContact C-N 3.35Å; H692-A695 PolarHBondContact O-N 3.38Å; H692-L696 WeakPolarHBondContact O-CB 3.21Å; H692-L696 PolarHBondContact O-N 3.15Å; H692-F730 HydrophobicContact CB-CD1 4.27Å; H692-F730 PolarHBondContact CE1-O 3.11Å; H692-F730 AromaticContact ND1-CD1 3.63Å; H692-F730 AromaticContact ND1-CG 3.92Å; H692-I733 PolarHBondContact NE2-O 3.47Å; H692-V735 WeakPolarHBondContact CD2-CG2 3.43Å
693	I	89.6	Confident	87.8	Confident	6 Å²	6	33.3 Å²	33.3	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-44.9	176.9	-59.9	173	0	0	0	109.6	V678 V682 I688 R689 D690 A695 L696 L697 I712 L715	V678-I693 HydrophobicContact CG1-CD1 4.28Å; V678-I693 HydrophobicContact CG1-CG1 4.41Å; V678-I693 HydrophobicContact CG1-CG2 3.82Å; V682-I693 HydrophobicContact CG2-CD1 3.86Å; I688-I693 HydrophobicContact CD1-CG1 4.04Å; I688-I693 HydrophobicContact CG1-CG1 4.2Å; R689-I693 PolarHBondContact O-N 2.93Å; R689-I693 VanDerWaalsContact O-N 3.15Å; D690-I693 PolarHBondContact O-N 3.27Å; I693-A695 PolarHBondContact O-N 3.3Å; I693-L696 PolarHBondContact O-N 3.34Å; I693-L697 HydrophobicContact CG2-CD1 4.02Å; I693-L697 HydrophobicContact CG2-CG 4.39Å; I693-L697 VanDerWaalsContact O-CG 3.31Å; I693-L697 WeakPolarHBondContact O-CG 3.42Å; I693-L697 PolarHBondContact O-N 3.4Å; I693-I712 HydrophobicContact CG2-CG1 4.19Å; I693-L715 HydrophobicContact CD1-CD1 3.95Å
694	A	88.1	Confident	87.7	Confident	19 Å²	19	32.2 Å²	32.2	16%	0.157	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-41.1	176.7	0	0	0	0	0	112.5	D690 H692 T698 I712	D690-A694 WeakPolarHBondContact O-CB 3.46Å; D690-A694 PolarHBondContact O-N 3.05Å; H692-A694 VanDerWaalsContact C-N 3.35Å; A694-T698 WeakPolarHBondContact O-CB 3.34Å; A694-T698 PolarHBondContact O-N 3.34Å; A694-T698 PolarHBondContact O-OG1 3.24Å; A694-I712 HydrophobicContact CB-CD1 4.16Å
695	A	89.6	Confident	87.5	Confident	9 Å²	9	34.5 Å²	34.5	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-47.7	174.5	0	0	0	0	0	111.6	M611 D691 H692 I693 L697 T698 V699 V735	M611-A695 WeakPolarHBondContact O-CB 3.28Å; M611-A695 HydrophobicContact SD-CB 4.07Å; D691-A695 WeakPolarHBondContact O-CB 3.43Å; D691-A695 PolarHBondContact O-N 2.92Å; H692-A695 PolarHBondContact O-N 3.38Å; I693-A695 PolarHBondContact O-N 3.3Å; A695-L697 PolarHBondContact O-N 3.16Å; A695-T698 WeakPolarHBondContact O-CA 3.36Å; A695-T698 WeakPolarHBondContact O-CB 3.36Å; A695-T698 PolarHBondContact O-N 3.2Å; A695-V699 PolarHBondContact O-N 2.69Å; A695-V735 HydrophobicContact CB-CG1 4.05Å
696	L	91.4	Very high	87.3	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-59	-47.3	177.6	177.7	55.7	0	0	0	112.3	I610 M611 I662 V665 I666 L681 H692 I693 T698 V699 R700	I610-L696 HydrophobicContact CG2-CD1 4.46Å; M611-L696 HydrophobicContact CE-CB 4.21Å; I662-L696 HydrophobicContact CG2-CD1 3.48Å; I662-L696 VanDerWaalsContact CG2-CD1 3.48Å; I662-L696 HydrophobicContact CG2-CD2 4.22Å; V665-L696 HydrophobicContact CB-CD2 4.24Å; V665-L696 HydrophobicContact CG1-CD2 3.9Å; V665-L696 HydrophobicContact CG1-CG 4.28Å; I666-L696 HydrophobicContact CD1-CD1 4.19Å; I666-L696 HydrophobicContact CG1-CD1 4.09Å; L681-L696 HydrophobicContact CD2-CD2 3.82Å; H692-L696 WeakPolarHBondContact O-CB 3.21Å; H692-L696 PolarHBondContact O-N 3.15Å; I693-L696 PolarHBondContact O-N 3.34Å; L696-T698 PolarHBondContact O-N 2.91Å; L696-V699 WeakPolarHBondContact O-CB 3.23Å; L696-V699 PolarHBondContact O-N 2.77Å; L696-R700 PolarHBondContact O-N 3.34Å
697	L	89.6	Confident	87.1	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-23.6	176.9	-66	176.9	0	0	0	112.4	L674 V678 I693 A695 A703 K708 I711	L674-L697 HydrophobicContact CD2-CD2 4.35Å; V678-L697 HydrophobicContact CG2-CD2 4.47Å; I693-L697 HydrophobicContact CG2-CD1 4.02Å; I693-L697 HydrophobicContact CG2-CG 4.39Å; I693-L697 VanDerWaalsContact O-CG 3.31Å; I693-L697 WeakPolarHBondContact O-CG 3.42Å; I693-L697 PolarHBondContact O-N 3.4Å; A695-L697 PolarHBondContact O-N 3.16Å; L697-A703 HydrophobicContact CB-CB 4.17Å; L697-A703 HydrophobicContact CD2-CB 4.43Å; L697-K708 HydrophobicContact CB-CD 4.19Å; L697-K708 HydrophobicContact CB-CG 3.9Å; L697-K708 HydrophobicContact CD1-CB 4.23Å; L697-K708 HydrophobicContact CD1-CG 3.85Å; L697-I711 HydrophobicContact CD1-CD1 4.2Å
698	T	88.6	Confident	86.9	Confident	54 Å²	54	40.8 Å²	40.8	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-76.1	-40.4	173.5	-59.1	0	0	0	0	111.9	S616 A694 A695 L696 R700 G701 K708	S616-T698 PolarHBondContact OG-O 2.85Å; A694-T698 WeakPolarHBondContact O-CB 3.34Å; A694-T698 PolarHBondContact O-N 3.34Å; A694-T698 PolarHBondContact O-OG1 3.24Å; A695-T698 WeakPolarHBondContact O-CA 3.36Å; A695-T698 WeakPolarHBondContact O-CB 3.36Å; A695-T698 PolarHBondContact O-N 3.2Å; L696-T698 PolarHBondContact O-N 2.91Å; T698-R700 VanDerWaalsContact C-N 3.28Å; T698-R700 PolarHBondContact O-N 2.73Å; T698-G701 PolarHBondContact O-N 2.86Å; T698-K708 PolarHBondContact OG1-NZ 2.96Å
699	V	89.3	Confident	86.7	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-39.9	172	168.8	0	0	0	0	111.3	M558 I610 I615 S616 F617 A695 L696 G701	M558-V699 HydrophobicContact CE-CG1 3.84Å; I610-V699 WeakPolarHBondContact O-CG2 2.97Å; I615-V699 HydrophobicContact CG2-CG1 4.21Å; I615-V699 HydrophobicContact CG2-CG2 4.44Å; I615-V699 WeakPolarHBondContact O-CA 3.26Å; S616-V699 WeakPolarHBondContact CA-O 3.42Å; F617-V699 HydrophobicContact CD2-CG1 3.99Å; F617-V699 WeakPolarHBondContact CD2-O 3.26Å; F617-V699 HydrophobicContact CE2-CG1 3.56Å; F617-V699 HydrophobicContact CZ-CG1 4.44Å; F617-V699 PolarHBondContact N-O 3.42Å; A695-V699 PolarHBondContact O-N 2.69Å; L696-V699 WeakPolarHBondContact O-CB 3.23Å; L696-V699 PolarHBondContact O-N 2.77Å; V699-G701 VanDerWaalsContact C-N 3.32Å; V699-G701 PolarHBondContact O-N 3.26Å
700	R	88	Confident	86.4	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-33.6	178.8	-166	-175.1	149.2	107	7	114.3	F617 R623 V665 L668 L696 T698 D702	F617-R700 VanDerWaalsContact O-O 3.09Å; R623-R700 WeakPolarHBondContact CD-O 3.35Å; V665-R700 PolarHBondContact O-NH1 3.22Å; L668-R700 PolarHBondContact O-NH1 3.16Å; L668-R700 PolarHBondContact O-NH2 3.16Å; L696-R700 PolarHBondContact O-N 3.34Å; T698-R700 VanDerWaalsContact C-N 3.28Å; T698-R700 PolarHBondContact O-N 2.73Å; R700-D702 WeakPolarHBondContact CD-OD1 3.4Å; R700-D702 WeakPolarHBondContact CG-OD1 3.42Å; R700-D702 IonicContact CZ-OD1 2.7Å; R700-D702 IonicContact CZ-OD2 3.95Å; R700-D702 IonicContact NE-OD1 2.56Å; R700-D702 PolarHBondContact NE-OD1 3.48Å; R700-D702 IonicContact NE-OD2 2.75Å; R700-D702 PolarHBondContact NE-OD2 3.38Å; R700-D702 IonicContact NH2-OD1 2.67Å; R700-D702 IonicContact NH2-OD2 3.85Å; R700-D702 PolarHBondContact NH2-OD2 2.86Å; R700-D702 PolarHBondContact O-N 2.99Å
701	G	85.5	Confident	86.2	Confident	40 Å²	40	39.7 Å²	39.7	41%	0.412	22%	0.22	S	C	.	.	S	Bend	trans	82.6	-14.4	167	0	0	0	0	0	118.1	S616 T698 V699	S616-G701 WeakPolarHBondContact OG-CA 3.29Å; T698-G701 PolarHBondContact O-N 2.86Å; V699-G701 VanDerWaalsContact C-N 3.32Å; V699-G701 PolarHBondContact O-N 3.26Å
702	D	85.6	Confident	86	Confident	50 Å²	50	38.5 Å²	38.5	27%	0.267	21%	0.214	S	C	.	.			trans	-106.3	-6.9	-179.6	63.5	-12	0	0	0	114.6	R623 R700 S704	R623-D702 IonicContact CZ-OD2 2.64Å; R623-D702 IonicContact NE-OD2 2.62Å; R623-D702 IonicContact NH1-OD2 3.43Å; R623-D702 PolarHBondContact NH1-OD2 3.32Å; R623-D702 IonicContact NH2-OD2 2.63Å; R623-D702 PolarHBondContact NH2-OD2 3.41Å; R700-D702 WeakPolarHBondContact CD-OD1 3.4Å; R700-D702 WeakPolarHBondContact CG-OD1 3.42Å; R700-D702 IonicContact CZ-OD1 2.7Å; R700-D702 IonicContact CZ-OD2 3.95Å; R700-D702 IonicContact NE-OD1 2.56Å; R700-D702 PolarHBondContact NE-OD1 3.48Å; R700-D702 IonicContact NE-OD2 2.75Å; R700-D702 PolarHBondContact NE-OD2 3.38Å; R700-D702 IonicContact NH2-OD1 2.67Å; R700-D702 IonicContact NH2-OD2 3.85Å; R700-D702 PolarHBondContact NH2-OD2 2.86Å; R700-D702 PolarHBondContact O-N 2.99Å; D702-S704 PolarHBondContact O-N 3.44Å
703	A	83.6	Confident	85.5	Confident	12 Å²	12	43.4 Å²	43.4	10%	0.099	24%	0.236	C	C	.	.			trans	-79	119.1	178.1	0	0	0	0	0	111.6	L697 M707 K708	L697-A703 HydrophobicContact CB-CB 4.17Å; L697-A703 HydrophobicContact CD2-CB 4.43Å; A703-M707 HydrophobicContact CB-SD 4.47Å; A703-K708 HydrophobicContact CB-CG 4.02Å; A703-K708 VanDerWaalsContact O-CE 3.31Å; A703-K708 WeakPolarHBondContact O-CE 3.31Å
704	S	82.4	Confident	85	Confident	65 Å²	65	45.7 Å²	45.7	46%	0.455	25%	0.251	S	S	.	.			trans	-66.8	161.3	174.6	73.8	0	0	0	0	111.6	D702 D706 M707 K708	D702-S704 PolarHBondContact O-N 3.44Å; S704-D706 VanDerWaalsContact C-N 3.28Å; S704-D706 PolarHBondContact O-N 3Å; S704-M707 PolarHBondContact O-N 2.88Å; S704-M707 VanDerWaalsContact OG-CB 3.3Å; S704-M707 WeakPolarHBondContact OG-CB 3.17Å; S704-M707 PolarHBondContact OG-N 3.41Å; S704-K708 WeakPolarHBondContact O-CG 3.39Å; S704-K708 PolarHBondContact O-N 3.09Å
705	R	81.9	Confident	84.4	Confident	161 Å²	161	46 Å²	46	61%	0.608	25%	0.25	S	C	*	.	H	α-helix	trans	-57.9	-42.4	177.5	-176.1	178.4	175.5	-177.1	-3.8	111.9	K708 Q709 V740	R705-K708 PolarHBondContact O-N 3.06Å; R705-Q709 PolarHBondContact O-N 3.17Å; R705-Q709 VanDerWaalsContact O-N 3.11Å; R705-V740 VanDerWaalsContact NH2-CG1 3.33Å
706	D	82.2	Confident	83.1	Confident	122 Å²	122	51.1 Å²	51.1	65%	0.652	28%	0.276	S	S	*	.	H	α-helix	trans	-66.7	-41.8	179.4	-58.3	-29.8	0	0	0	110.9	S704 K708 Q709 T710	S704-D706 VanDerWaalsContact C-N 3.28Å; S704-D706 PolarHBondContact O-N 3Å; D706-K708 PolarHBondContact O-N 3.45Å; D706-Q709 PolarHBondContact O-N 2.83Å; D706-T710 PolarHBondContact O-N 3.32Å; D706-T710 PolarHBondContact O-OG1 3.44Å
707	M	82.1	Confident	81.4	Confident	48 Å²	48	59 Å²	59	24%	0.236	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-41.9	176.4	-176.3	172.7	-134.8	0	0	112.5	P671 L674 A703 S704 T710 I711	P671-M707 HydrophobicContact CB-CE 3.83Å; P671-M707 HydrophobicContact CB-SD 4.24Å; P671-M707 WeakPolarHBondContact O-CE 3.34Å; L674-M707 HydrophobicContact CD1-CE 4.19Å; L674-M707 HydrophobicContact CD1-SD 4.04Å; A703-M707 HydrophobicContact CB-SD 4.47Å; S704-M707 PolarHBondContact O-N 2.88Å; S704-M707 VanDerWaalsContact OG-CB 3.3Å; S704-M707 WeakPolarHBondContact OG-CB 3.17Å; S704-M707 PolarHBondContact OG-N 3.41Å; M707-T710 PolarHBondContact O-N 2.71Å; M707-I711 HydrophobicContact CG-CD1 3.93Å; M707-I711 VanDerWaalsContact O-CG1 3.27Å; M707-I711 WeakPolarHBondContact O-CG1 3.21Å; M707-I711 PolarHBondContact O-N 3.32Å
708	K	84.1	Confident	79.5	Confident	47 Å²	47	61.2 Å²	61.2	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-60.1	-45.9	174.6	-69.6	178.4	-175.4	-179	0	111.3	L697 T698 A703 S704 R705 D706 I712	L697-K708 HydrophobicContact CB-CD 4.19Å; L697-K708 HydrophobicContact CB-CG 3.9Å; L697-K708 HydrophobicContact CD1-CB 4.23Å; L697-K708 HydrophobicContact CD1-CG 3.85Å; T698-K708 PolarHBondContact OG1-NZ 2.96Å; A703-K708 HydrophobicContact CB-CG 4.02Å; A703-K708 VanDerWaalsContact O-CE 3.31Å; A703-K708 WeakPolarHBondContact O-CE 3.31Å; S704-K708 WeakPolarHBondContact O-CG 3.39Å; S704-K708 PolarHBondContact O-N 3.09Å; R705-K708 PolarHBondContact O-N 3.06Å; D706-K708 PolarHBondContact O-N 3.45Å; K708-I712 WeakPolarHBondContact O-CD1 2.93Å; K708-I712 VanDerWaalsContact O-CG1 3.29Å; K708-I712 WeakPolarHBondContact O-CG1 3.33Å; K708-I712 PolarHBondContact O-N 2.99Å; K708-I712 VanDerWaalsContact O-N 3.14Å
709	Q	82.3	Confident	77.5	Confident	61 Å²	61	65 Å²	65	29%	0.285	36%	0.361	S	S	.	.	H	α-helix	trans	-64.6	-45.7	179.9	-169.6	64.1	30.9	0	0	111.4	R705 D706 I711 I712 E713	R705-Q709 PolarHBondContact O-N 3.17Å; R705-Q709 VanDerWaalsContact O-N 3.11Å; D706-Q709 PolarHBondContact O-N 2.83Å; Q709-I711 PolarHBondContact O-N 2.87Å; Q709-I712 PolarHBondContact O-N 3.2Å; Q709-E713 HydrophobicContact CG-CG 4.37Å; Q709-E713 WeakPolarHBondContact CG-OE1 3.49Å; Q709-E713 PolarHBondContact NE2-OE1 3.13Å; Q709-E713 WeakPolarHBondContact O-CB 3.37Å; Q709-E713 WeakPolarHBondContact O-CG 3.31Å; Q709-E713 PolarHBondContact O-N 3.18Å
710	T	83.7	Confident	75.9	Confident	79 Å²	79	67.8 Å²	67.8	49%	0.485	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-43.3	178.5	-56.7	0	0	0	0	112.2	D706 M707 T714	D706-T710 PolarHBondContact O-N 3.32Å; D706-T710 PolarHBondContact O-OG1 3.44Å; M707-T710 PolarHBondContact O-N 2.71Å; T710-T714 VanDerWaalsContact O-CB 3.31Å; T710-T714 WeakPolarHBondContact O-CB 3.29Å; T710-T714 PolarHBondContact O-N 3.31Å; T710-T714 PolarHBondContact O-OG1 2.78Å
711	I	83.7	Confident	74.3	Confident	8 Å²	8	76.8 Å²	76.8	4%	0.041	42%	0.423	C	S	.	.	H	α-helix	trans	-61.6	-47.2	177.9	-70	168.2	0	0	0	110.2	L674 V678 L697 M707 Q709 T714 L715	L674-I711 HydrophobicContact CB-CD1 3.89Å; V678-I711 HydrophobicContact CB-CG2 4.29Å; V678-I711 HydrophobicContact CG1-CG2 4.09Å; L697-I711 HydrophobicContact CD1-CD1 4.2Å; M707-I711 HydrophobicContact CG-CD1 3.93Å; M707-I711 VanDerWaalsContact O-CG1 3.27Å; M707-I711 WeakPolarHBondContact O-CG1 3.21Å; M707-I711 PolarHBondContact O-N 3.32Å; Q709-I711 PolarHBondContact O-N 2.87Å; I711-T714 PolarHBondContact O-N 3.06Å; I711-L715 HydrophobicContact CG2-CD1 3.68Å; I711-L715 VanDerWaalsContact O-CD1 3.31Å; I711-L715 WeakPolarHBondContact O-CD1 3.22Å; I711-L715 WeakPolarHBondContact O-CG 3.4Å; I711-L715 PolarHBondContact O-N 3.18Å
712	I	84.3	Confident	73	Confident	20 Å²	20	78.9 Å²	78.9	10%	0.103	43%	0.429	C	S	.	.	H	α-helix	trans	-63.6	-48.9	-179.4	-66.8	167.4	0	0	0	111.2	D690 I693 A694 K708 Q709 T714 L715 D716	D690-I712 HydrophobicContact CB-CG2 3.88Å; I693-I712 HydrophobicContact CG2-CG1 4.19Å; A694-I712 HydrophobicContact CB-CD1 4.16Å; K708-I712 WeakPolarHBondContact O-CD1 2.93Å; K708-I712 VanDerWaalsContact O-CG1 3.29Å; K708-I712 WeakPolarHBondContact O-CG1 3.33Å; K708-I712 PolarHBondContact O-N 2.99Å; K708-I712 VanDerWaalsContact O-N 3.14Å; Q709-I712 PolarHBondContact O-N 3.2Å; I712-T714 VanDerWaalsContact C-N 3.27Å; I712-T714 PolarHBondContact O-N 3.42Å; I712-L715 PolarHBondContact O-N 3.2Å; I712-D716 PolarHBondContact O-N 3.29Å
713	E	80.7	Confident	71.8	Confident	102 Å²	102	81.7 Å²	81.7	48%	0.477	44%	0.444	S	S	.	.	H	α-helix	trans	-63.7	-30.2	-179.9	-72.6	175	177.7	0	0	113.7	Q709	Q709-E713 HydrophobicContact CG-CG 4.37Å; Q709-E713 WeakPolarHBondContact CG-OE1 3.49Å; Q709-E713 PolarHBondContact NE2-OE1 3.13Å; Q709-E713 WeakPolarHBondContact O-CB 3.37Å; Q709-E713 WeakPolarHBondContact O-CG 3.31Å; Q709-E713 PolarHBondContact O-N 3.18Å
714	T	78.1	Confident	70.5	Confident	54 Å²	54	87.1 Å²	87.1	33%	0.331	48%	0.479	S	S	.	.	H	α-helix	trans	-78.3	-29.5	179.2	-50.6	0	0	0	0	111.5	Y675 T710 I711 I712	Y675-T714 HydrophobicContact CD2-CG2 4.16Å; Y675-T714 HydrophobicContact CE2-CG2 3.36Å; T710-T714 VanDerWaalsContact O-CB 3.31Å; T710-T714 WeakPolarHBondContact O-CB 3.29Å; T710-T714 PolarHBondContact O-N 3.31Å; T710-T714 PolarHBondContact O-OG1 2.78Å; I711-T714 PolarHBondContact O-N 3.06Å; I712-T714 VanDerWaalsContact C-N 3.27Å; I712-T714 PolarHBondContact O-N 3.42Å
715	L	77	Confident	69.4	Low	26 Å²	26	91.1 Å²	91.1	14%	0.136	50%	0.495	C	S	.	.	H	α-helix	trans	-75.6	-27.9	178.6	-68.8	164.7	0	0	0	112.8	Y675 V678 V682 I693 I711 I712 Q717 G718	Y675-L715 HydrophobicContact CD2-CD2 4.48Å; Y675-L715 HydrophobicContact CE2-CD2 3.94Å; Y675-L715 HydrophobicContact CE2-CG 4.15Å; V678-L715 HydrophobicContact CB-CD1 4.49Å; V678-L715 HydrophobicContact CG1-CD1 3.54Å; V682-L715 HydrophobicContact CG2-CD1 4.34Å; I693-L715 HydrophobicContact CD1-CD1 3.95Å; I711-L715 HydrophobicContact CG2-CD1 3.68Å; I711-L715 VanDerWaalsContact O-CD1 3.31Å; I711-L715 WeakPolarHBondContact O-CD1 3.22Å; I711-L715 WeakPolarHBondContact O-CG 3.4Å; I711-L715 PolarHBondContact O-N 3.18Å; I712-L715 PolarHBondContact O-N 3.2Å; L715-Q717 PolarHBondContact O-N 2.94Å; L715-Q717 VanDerWaalsContact O-N 3.08Å; L715-G718 PolarHBondContact O-N 3.38Å
716	D	62.1	Low	68.8	Low	117 Å²	117	86.2 Å²	86.2	63%	0.626	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-13.6	176.2	-106.3	-8	0	0	0	114	I712	I712-D716 PolarHBondContact O-N 3.29Å
717	Q	54.4	Low	68.4	Low	167 Å²	167	85.2 Å²	85.2	78%	0.78	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	2.3	-175.9	-60.3	-175.5	17	0	0	114.4	L715	L715-Q717 PolarHBondContact O-N 2.94Å; L715-Q717 VanDerWaalsContact O-N 3.08Å
718	G	49.5	Very low	68.4	Low	47 Å²	47	85.2 Å²	85.2	49%	0.485	47%	0.473	S	S	.	.			trans	-112.1	125	-177.1	0	0	0	0	0	114.1	L715 S720	L715-G718 PolarHBondContact O-N 3.38Å; G718-S720 PolarHBondContact O-N 3.08Å
719	P	47	Very low	68.4	Low	134 Å²	134	83.3 Å²	83.3	87%	0.87	47%	0.465	S	S	*	.			trans	-76.8	120.2	171.3	29.8	-29.7	0	0	0	110.2
720	S	56.2	Low	68.6	Low	63 Å²	63	80.4 Å²	80.4	44%	0.441	45%	0.451	S	S	.	.			trans	-101.4	113.8	170.7	-62	0	0	0	0	109.6	G718 P722	G718-S720 PolarHBondContact O-N 3.08Å; S720-P722 WeakPolarHBondContact O-CD 3.31Å
721	Q	54	Low	68.7	Low	189 Å²	189	84 Å²	84	88%	0.883	46%	0.46	S	S	*	.			trans	-82.7	116	166.3	-75.2	-161.6	-12.2	0	0	108.9
722	P	57.7	Low	68.7	Low	84 Å²	84	88 Å²	88	55%	0.545	48%	0.479	S	S	.	.			trans	-70.1	140.7	178.8	27	-32	0	0	0	111	P686 S720	P686-P722 HydrophobicContact CG-CB 3.8Å; S720-P722 WeakPolarHBondContact O-CD 3.31Å
723	N	60.2	Low	68.8	Low	110 Å²	110	87.1 Å²	87.1	59%	0.588	47%	0.474	S	S	*	.			trans	-58	132.5	170.6	-175	-16.3	0	0	0	109.6	N725 Y726	N723-N725 PolarHBondContact O-N 3.06Å; N723-N725 PolarHBondContact OD1-N 2.77Å; N723-Y726 WeakPolarHBondContact O-CB 3.16Å; N723-Y726 PolarHBondContact O-N 3.18Å
724	P	56.2	Low	69	Low	126 Å²	126	87.4 Å²	87.4	82%	0.818	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.5	-178.3	19	-32.2	0	0	0	115
725	N	59.3	Low	69.3	Low	149 Å²	149	85.4 Å²	85.4	80%	0.797	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	11.3	175.9	-70.6	-13.8	0	0	0	113.7	N723 M727	N723-N725 PolarHBondContact O-N 3.06Å; N723-N725 PolarHBondContact OD1-N 2.77Å; N725-M727 PolarHBondContact O-N 3.42Å
726	Y	70.7	Confident	69.2	Low	57 Å²	57	88.9 Å²	88.9	22%	0.224	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-75.7	119.8	-179.5	-179.2	-104.5	0	0	0	111.7	Y685 P686 D687 N723 P728	Y685-Y726 AromaticContact CD1-CE2 3.92Å; Y685-Y726 HydrophobicContact CD1-CE2 3.92Å; P686-Y726 HydrophobicContact CG-CD1 4.17Å; P686-Y726 HydrophobicContact CG-CE1 4.13Å; D687-Y726 HydrophobicContact CB-CE1 4.04Å; D687-Y726 PolarHBondContact OD1-OH 3.49Å; N723-Y726 WeakPolarHBondContact O-CB 3.16Å; N723-Y726 PolarHBondContact O-N 3.18Å; Y726-P728 HydrophobicContact CE1-CB 4.07Å
727	M	73	Confident	69.1	Low	102 Å²	102	88 Å²	88	50%	0.502	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-92.1	116.7	169.1	-78.2	-179	36.1	0	0	110	N725	N725-M727 PolarHBondContact O-N 3.42Å
728	P	81.8	Confident	69	Low	47 Å²	47	85.4 Å²	85.4	31%	0.305	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-66.2	139.4	-179.8	27.4	-33.4	0	0	0	111	R600 D687 Y726 K731	R600-P728 PolarHBondContact NH2-O 2.98Å; D687-P728 HydrophobicContact CB-CB 3.97Å; D687-P728 VanDerWaalsContact OD2-C 3.28Å; D687-P728 WeakPolarHBondContact OD2-CA 3.49Å; D687-P728 WeakPolarHBondContact OD2-CB 3.3Å; Y726-P728 HydrophobicContact CE1-CB 4.07Å; P728-K731 HydrophobicContact CB-CB 3.9Å; P728-K731 HydrophobicContact CB-CD 4.47Å; P728-K731 HydrophobicContact CG-CD 4.48Å
729	I	84.5	Confident	68.4	Low	8 Å²	8	89.3 Å²	89.3	4%	0.041	50%	0.499	C	S	.	.	S	Bend	trans	-119.3	-48.4	178.7	-68.7	176.6	0	0	0	109.7	V604 I607 L655 I658 D687 K731 E732	V604-I729 HydrophobicContact CG2-CG2 4Å; I607-I729 HydrophobicContact CD1-CG2 3.47Å; I607-I729 VanDerWaalsContact CD1-CG2 3.47Å; L655-I729 HydrophobicContact CD2-CD1 4.08Å; I658-I729 HydrophobicContact CD1-CB 4.22Å; I658-I729 HydrophobicContact CD1-CD1 4.13Å; I658-I729 HydrophobicContact CD1-CG2 4.03Å; D687-I729 PolarHBondContact OD2-N 3.45Å; I729-K731 PolarHBondContact O-N 3.01Å; I729-E732 PolarHBondContact O-N 3.48Å
730	F	85.9	Confident	68	Low	0 Å²	0	86 Å²	86	0%	0	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-65.2	-25.9	178.1	-72.8	-75.4	0	0	0	112.6	I607 M611 I658 I662 Y685 D687 I688 H692 E732 I733	I607-F730 HydrophobicContact CG2-CD1 4.32Å; I607-F730 HydrophobicContact CG2-CE1 3.8Å; I607-F730 HydrophobicContact CG2-CZ 4.42Å; M611-F730 HydrophobicContact CE-CE1 3.89Å; I658-F730 HydrophobicContact CD1-CD2 4.05Å; I658-F730 HydrophobicContact CD1-CE2 3.44Å; I658-F730 VanDerWaalsContact CD1-CE2 3.44Å; I658-F730 HydrophobicContact CD1-CZ 3.87Å; I658-F730 HydrophobicContact CG1-CE2 4.11Å; I658-F730 HydrophobicContact CG1-CZ 4.25Å; I662-F730 HydrophobicContact CD1-CZ 4.11Å; Y685-F730 HydrophobicContact CG-CE2 4.19Å; D687-F730 WeakPolarHBondContact O-CB 3.27Å; D687-F730 WeakPolarHBondContact OD1-CB 3.31Å; D687-F730 WeakPolarHBondContact OD1-CD2 3.34Å; D687-F730 WeakPolarHBondContact OD2-CA 3.38Å; D687-F730 PolarHBondContact OD2-N 3.25Å; I688-F730 HydrophobicContact CB-CD2 3.83Å; I688-F730 HydrophobicContact CB-CE2 4.08Å; I688-F730 HydrophobicContact CB-CG 4.06Å; I688-F730 HydrophobicContact CD1-CE1 4.02Å; I688-F730 HydrophobicContact CD1-CE2 4.04Å; I688-F730 HydrophobicContact CD1-CZ 3.76Å; I688-F730 HydrophobicContact CG1-CD1 4.05Å; I688-F730 HydrophobicContact CG1-CD2 4.14Å; I688-F730 HydrophobicContact CG1-CE1 4.07Å; I688-F730 HydrophobicContact CG1-CE2 4.15Å; I688-F730 HydrophobicContact CG1-CG 4.09Å; I688-F730 HydrophobicContact CG1-CZ 4.11Å; H692-F730 HydrophobicContact CB-CD1 4.27Å; H692-F730 PolarHBondContact CE1-O 3.11Å; H692-F730 AromaticContact ND1-CD1 3.63Å; H692-F730 AromaticContact ND1-CG 3.92Å; F730-E732 PolarHBondContact O-N 3.22Å; F730-I733 PolarHBondContact O-N 2.93Å; F730-I733 VanDerWaalsContact O-O 3.12Å
731	K	85.6	Confident	67	Low	153 Å²	153	87.5 Å²	87.5	67%	0.665	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-58.1	-30.1	174.4	-167.2	175	179.5	179.7	0	113.1	D687 P728 I729 I733	D687-K731 PolarHBondContact OD2-N 3.37Å; P728-K731 HydrophobicContact CB-CB 3.9Å; P728-K731 HydrophobicContact CB-CD 4.47Å; P728-K731 HydrophobicContact CG-CD 4.48Å; I729-K731 PolarHBondContact O-N 3.01Å; K731-I733 VanDerWaalsContact C-N 3.34Å
732	E	83.8	Confident	66.1	Low	94 Å²	94	87.5 Å²	87.5	44%	0.439	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-86	-5.6	179.2	-67.2	-179.1	-166.8	0	0	114	R600 I729 F730	R600-E732 IonicContact CZ-OE1 3.42Å; R600-E732 IonicContact CZ-OE2 2.96Å; R600-E732 IonicContact NH1-OE1 2.65Å; R600-E732 PolarHBondContact NH1-OE1 2.6Å; R600-E732 IonicContact NH1-OE2 3.44Å; R600-E732 PolarHBondContact NH1-OE2 3.31Å; R600-E732 IonicContact NH2-OE1 2.77Å; R600-E732 PolarHBondContact NH2-OE1 3.14Å; R600-E732 IonicContact NH2-OE2 3.79Å; R600-E732 PolarHBondContact NH2-OE2 3.04Å; I729-E732 PolarHBondContact O-N 3.48Å; F730-E732 PolarHBondContact O-N 3.22Å
733	I	86.6	Confident	65.1	Low	0 Å²	0	91.4 Å²	91.4	0%	0	50%	0.497	C	S	.	.			trans	-104.2	117.5	179.5	-56.4	175.4	0	0	0	107.4	V604 I607 R608 M611 R689 H692 F730 K731 V735	V604-I733 HydrophobicContact CG1-CG1 4.31Å; I607-I733 HydrophobicContact CB-CD1 3.68Å; I607-I733 HydrophobicContact CG2-CD1 3.42Å; I607-I733 VanDerWaalsContact CG2-CD1 3.42Å; R608-I733 HydrophobicContact CG-CG2 4.5Å; M611-I733 HydrophobicContact CB-CG2 4.16Å; M611-I733 HydrophobicContact CG-CG2 4.37Å; R689-I733 PolarHBondContact NH2-O 3.33Å; H692-I733 PolarHBondContact NE2-O 3.47Å; F730-I733 PolarHBondContact O-N 2.93Å; F730-I733 VanDerWaalsContact O-O 3.12Å; K731-I733 VanDerWaalsContact C-N 3.34Å; I733-V735 HydrophobicContact CG2-CG2 4.26Å
734	T	85.6	Confident	64	Low	109 Å²	109	94.1 Å²	94.1	67%	0.669	51%	0.511	S	S	*	.			trans	-100.4	112.3	175.2	-51.1	0	0	0	0	109
735	V	83.6	Confident	62.9	Low	11 Å²	11	101.1 Å²	101.1	7%	0.067	53%	0.529	C	S	.	.			trans	-96.4	130	174.4	176	0	0	0	0	109.3	M611 L612 D691 H692 A695 I733 T737	M611-V735 HydrophobicContact CB-CG2 3.67Å; M611-V735 HydrophobicContact CG-CG2 4.41Å; L612-V735 HydrophobicContact CD2-CB 4.46Å; L612-V735 HydrophobicContact CD2-CG2 4.05Å; D691-V735 HydrophobicContact CB-CB 4.12Å; D691-V735 HydrophobicContact CB-CG1 4.25Å; H692-V735 WeakPolarHBondContact CD2-CG2 3.43Å; A695-V735 HydrophobicContact CB-CG1 4.05Å; I733-V735 HydrophobicContact CG2-CG2 4.26Å; V735-T737 PolarHBondContact O-N 3.04Å
736	P	75.3	Confident	63.1	Low	99 Å²	99	98.8 Å²	98.8	64%	0.643	52%	0.515	S	S	*	.			trans	-60.9	125.9	174.4	-20.3	31.1	0	0	0	110.8	L738	P736-L738 PolarHBondContact O-N 2.64Å; P736-L738 VanDerWaalsContact O-N 3.09Å
737	T	60.5	Low	62.7	Low	99 Å²	99	100.9 Å²	100.9	61%	0.607	53%	0.53	S	S	*	.			trans	-59.1	114.3	179.6	-40	0	0	0	0	109.8	D691 V735 T739	D691-T737 WeakPolarHBondContact OD1-CG2 3.33Å; V735-T737 PolarHBondContact O-N 3.04Å; T737-T739 PolarHBondContact O-N 2.88Å
738	L	51.9	Low	62.1	Low	113 Å²	113	100.9 Å²	100.9	59%	0.592	53%	0.532	S	S	*	.			trans	-71.5	99.9	166.2	-73.4	165.3	0	0	0	106.3	P736 V740	P736-L738 PolarHBondContact O-N 2.64Å; P736-L738 VanDerWaalsContact O-N 3.09Å; L738-V740 VanDerWaalsContact C-N 3.33Å; L738-V740 PolarHBondContact O-N 2.99Å
739	T	36.7	Very low	60.9	Low	129 Å²	129	104.1 Å²	104.1	79%	0.791	55%	0.545	S	S	*	.			trans	-57.6	95	175.2	43.2	0	0	0	0	110.1	T737	T737-T739 PolarHBondContact O-N 2.88Å
740	V	39.2	Very low	59.5	Low	65 Å²	65	110.1 Å²	110.1	39%	0.394	58%	0.577	S	S	.	*			trans	-90	112.6	156.6	-170.9	0	0	0	0	104.5	R705 L738 K742	R705-V740 VanDerWaalsContact NH2-CG1 3.33Å; L738-V740 VanDerWaalsContact C-N 3.33Å; L738-V740 PolarHBondContact O-N 2.99Å; V740-K742 PolarHBondContact O-N 3.11Å
741	P	34.3	Very low	57.7	Low	94 Å²	94	117.4 Å²	117.4	61%	0.61	62%	0.615	S	S	*	*			trans	-58.1	118.5	177.8	-18	28.9	0	0	0	108.3	L743	P741-L743 PolarHBondContact O-N 2.74Å
742	K	35.9	Very low	55.7	Low	188 Å²	188	114.9 Å²	114.9	82%	0.817	61%	0.612	S	S	*	*			trans	-59.1	104.4	165.7	-77.8	-174.9	174.2	-175.4	0	106.7	V740 L744	V740-K742 PolarHBondContact O-N 3.11Å; K742-L744 PolarHBondContact O-N 2.96Å; K742-L744 VanDerWaalsContact O-N 3.11Å
743	L	37.1	Very low	53.6	Low	166 Å²	166	116.5 Å²	116.5	87%	0.869	63%	0.625	S	S	*	*			trans	-70.4	102.4	163.4	-86.7	162.2	0	0	0	106.1	P741 K745	P741-L743 PolarHBondContact O-N 2.74Å; L743-K745 PolarHBondContact O-N 3.33Å
744	L	36.5	Very low	50.8	Low	168 Å²	168	126.2 Å²	126.2	88%	0.88	68%	0.677	S	S	*	*			trans	-52.8	125.4	167.5	-76.2	151.6	0	0	0	108.8	K742	K742-L744 PolarHBondContact O-N 2.96Å; K742-L744 VanDerWaalsContact O-N 3.11Å
745	K	33	Very low	47.6	Very low	273 Å²	273	127.7 Å²	127.7	100%	1.187	68%	0.678	S	S	*	*			trans	-106.5	0	152.3	-95.1	-171.7	176.9	178.5	0	108.4	L743	L743-K745 PolarHBondContact O-N 3.33Å

Retrieved 745 of 745 residues in 372.5 ms (Link to these results)

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