A0A5K4FD83_SCHMA Loading...

Exocyst complex component sec6, 3

AlphaFold DB , UniProt , Accession A0A5K4FD83, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 752 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	47.4	Very low	69.4	Low	223 Å²	223	114.4 Å²	114.4	100%	1.099	60%	0.603	S	S	*	*				0	120.7	0	-78.5	-177.8	-89.9	0	0	107.3
2	S	47.8	Very low	70.3	Confident	74 Å²	74	113.8 Å²	113.8	52%	0.517	60%	0.595	S	S	.	*			trans	-67	156.2	-176.4	60.7	0	0	0	0	110.6	Q4 S5	S2-Q4 PolarHBondContact O-N 3.01Å; S2-S5 WeakPolarHBondContact O-CB 3.26Å; S2-S5 PolarHBondContact O-N 3.12Å
3	V	60.6	Low	71.3	Confident	113 Å²	113	116.2 Å²	116.2	69%	0.685	60%	0.601	S	S	*	*	H	α-helix	trans	-48.4	-33.9	177.2	177.9	0	0	0	0	112.2	S5 F6 Q7	V3-S5 VanDerWaalsContact C-N 3.35Å; V3-S5 PolarHBondContact O-N 3.43Å; V3-F6 PolarHBondContact O-N 2.89Å; V3-Q7 PolarHBondContact O-N 3.1Å; V3-Q7 VanDerWaalsContact O-N 3.15Å
4	Q	64.3	Low	72.1	Confident	139 Å²	139	116.6 Å²	116.6	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-60.5	-39.1	175.3	-71.9	177.1	-22.2	0	0	113.3	S2 F6 Q7 L8	S2-Q4 PolarHBondContact O-N 3.01Å; Q4-F6 VanDerWaalsContact C-N 3.32Å; Q4-F6 PolarHBondContact O-N 3.33Å; Q4-Q7 PolarHBondContact O-N 3.47Å; Q4-L8 WeakPolarHBondContact O-CB 3.21Å; Q4-L8 PolarHBondContact O-N 2.66Å
5	S	71	Confident	72.7	Confident	49 Å²	49	112.7 Å²	112.7	34%	0.343	59%	0.589	S	S	.	*	H	α-helix	trans	-65.6	-35.8	178.4	-178.9	0	0	0	0	112	S2 V3 S9	S2-S5 WeakPolarHBondContact O-CB 3.26Å; S2-S5 PolarHBondContact O-N 3.12Å; V3-S5 VanDerWaalsContact C-N 3.35Å; V3-S5 PolarHBondContact O-N 3.43Å; S5-S9 PolarHBondContact O-N 3.47Å
6	F	75.7	Confident	73.3	Confident	155 Å²	155	116.6 Å²	116.6	68%	0.68	59%	0.593	S	S	*	*	H	α-helix	trans	-73.2	-42.8	179.6	-158.8	-90	0	0	0	111.2	V3 Q4 L8 S9 E10	V3-F6 PolarHBondContact O-N 2.89Å; Q4-F6 VanDerWaalsContact C-N 3.32Å; Q4-F6 PolarHBondContact O-N 3.33Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.94Å; F6-S9 PolarHBondContact O-N 3.33Å; F6-E10 PolarHBondContact O-N 3.39Å
7	Q	76.1	Confident	73.9	Confident	111 Å²	111	113.5 Å²	113.5	52%	0.519	59%	0.589	S	S	.	*	H	α-helix	trans	-62.2	-39.4	175.7	-72.5	179.7	-21	0	0	112.6	V3 Q4 E10 L11	V3-Q7 PolarHBondContact O-N 3.1Å; V3-Q7 VanDerWaalsContact O-N 3.15Å; Q4-Q7 PolarHBondContact O-N 3.47Å; Q7-E10 PolarHBondContact O-N 3.44Å; Q7-L11 WeakPolarHBondContact O-CB 3.39Å; Q7-L11 WeakPolarHBondContact O-CG 3.22Å; Q7-L11 PolarHBondContact O-N 2.89Å
8	L	76.4	Confident	74.3	Confident	122 Å²	122	111 Å²	111	64%	0.639	58%	0.583	S	S	*	*	H	α-helix	trans	-63.7	-43.8	174.9	-100.7	141.2	0	0	0	111.8	Q4 F6 L11 E12	Q4-L8 WeakPolarHBondContact O-CB 3.21Å; Q4-L8 PolarHBondContact O-N 2.66Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.94Å; L8-L11 PolarHBondContact O-N 3.24Å; L8-E12 WeakPolarHBondContact O-CB 3.5Å; L8-E12 PolarHBondContact O-N 3.4Å
9	S	81.4	Confident	74.5	Confident	72 Å²	72	107.8 Å²	107.8	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-61.2	-43.5	175	-104.4	0	0	0	0	112.5	S5 F6 L11 E12 E13	S5-S9 PolarHBondContact O-N 3.47Å; F6-S9 PolarHBondContact O-N 3.33Å; S9-L11 PolarHBondContact O-N 3.19Å; S9-E12 PolarHBondContact O-N 2.65Å; S9-E13 PolarHBondContact O-N 3.37Å
10	E	81.7	Confident	74.8	Confident	84 Å²	84	109 Å²	109	39%	0.393	58%	0.58	S	S	.	*	H	α-helix	trans	-67	-37.1	-179.5	-152.8	-163.5	150.2	0	0	112.1	F6 Q7 K14	F6-E10 PolarHBondContact O-N 3.39Å; Q7-E10 PolarHBondContact O-N 3.44Å; E10-K14 WeakPolarHBondContact O-CG 3.39Å; E10-K14 PolarHBondContact O-N 2.77Å; E10-K14 IonicContact OE1-NZ 2.8Å; E10-K14 PolarHBondContact OE1-NZ 3.11Å
11	L	80.6	Confident	75.2	Confident	116 Å²	116	110.8 Å²	110.8	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-67.3	-39.5	173	-77.5	167.7	0	0	0	111.8	Q7 L8 S9 E13 K14 A15	Q7-L11 WeakPolarHBondContact O-CB 3.39Å; Q7-L11 WeakPolarHBondContact O-CG 3.22Å; Q7-L11 PolarHBondContact O-N 2.89Å; L8-L11 PolarHBondContact O-N 3.24Å; S9-L11 PolarHBondContact O-N 3.19Å; L11-E13 VanDerWaalsContact C-N 3.35Å; L11-K14 PolarHBondContact O-N 3.05Å; L11-A15 VanDerWaalsContact O-CB 3.23Å; L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.37Å
12	E	81	Confident	76.6	Confident	108 Å²	108	106.7 Å²	106.7	51%	0.505	56%	0.555	S	S	.	*	H	α-helix	trans	-64.8	-40.2	176.2	-164.7	-177.6	178.2	0	0	111.4	L8 S9 A15 R16	L8-E12 WeakPolarHBondContact O-CB 3.5Å; L8-E12 PolarHBondContact O-N 3.4Å; S9-E12 PolarHBondContact O-N 2.65Å; E12-A15 PolarHBondContact O-N 2.82Å; E12-R16 WeakPolarHBondContact O-CB 3.33Å; E12-R16 PolarHBondContact O-N 2.67Å
13	E	82.6	Confident	78	Confident	144 Å²	144	106.7 Å²	106.7	67%	0.673	55%	0.552	S	S	*	*	H	α-helix	trans	-66	-45	176.5	-161.1	176.8	-167.1	0	0	111.8	S9 L11 A15 R16 A17	S9-E13 PolarHBondContact O-N 3.37Å; L11-E13 VanDerWaalsContact C-N 3.35Å; E13-A15 PolarHBondContact O-N 3.46Å; E13-R16 PolarHBondContact O-N 3.32Å; E13-A17 WeakPolarHBondContact O-CB 3.42Å; E13-A17 PolarHBondContact O-N 2.76Å
14	K	82.6	Confident	78.8	Confident	122 Å²	122	104.9 Å²	104.9	53%	0.53	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-41.3	172.9	-77	174	-173	155.3	0	112.2	E10 L11 A17 S18	E10-K14 WeakPolarHBondContact O-CG 3.39Å; E10-K14 PolarHBondContact O-N 2.77Å; E10-K14 IonicContact OE1-NZ 2.8Å; E10-K14 PolarHBondContact OE1-NZ 3.11Å; L11-K14 PolarHBondContact O-N 3.05Å; K14-A17 PolarHBondContact O-N 3.06Å; K14-S18 WeakPolarHBondContact O-CB 3.44Å; K14-S18 PolarHBondContact O-N 3.01Å
15	A	81.5	Confident	79.4	Confident	59 Å²	59	102.3 Å²	102.3	49%	0.488	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.9	0	0	0	0	0	111.3	L11 E12 E13 S18 A19	L11-A15 VanDerWaalsContact O-CB 3.23Å; L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.37Å; E12-A15 PolarHBondContact O-N 2.82Å; E13-A15 PolarHBondContact O-N 3.46Å; A15-S18 PolarHBondContact O-N 2.83Å; A15-A19 VanDerWaalsContact O-CB 3.28Å; A15-A19 WeakPolarHBondContact O-CB 3.36Å; A15-A19 PolarHBondContact O-N 3.48Å
16	R	81.9	Confident	79.6	Confident	175 Å²	175	103.6 Å²	103.6	66%	0.66	54%	0.535	S	S	*	.	H	α-helix	trans	-61.5	-49	173.1	-87.6	-174.3	-179.5	172.4	5.1	111.8	E12 E13 S18 A19 L20	E12-R16 WeakPolarHBondContact O-CB 3.33Å; E12-R16 PolarHBondContact O-N 2.67Å; E13-R16 PolarHBondContact O-N 3.32Å; R16-S18 VanDerWaalsContact C-N 3.32Å; R16-S18 PolarHBondContact O-N 3.23Å; R16-A19 PolarHBondContact O-N 3.41Å; R16-L20 WeakPolarHBondContact O-CB 3.4Å; R16-L20 PolarHBondContact O-N 3.21Å
17	A	83	Confident	79.7	Confident	63 Å²	63	99.3 Å²	99.3	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-42.7	178.3	0	0	0	0	0	111.9	E13 K14 L20 K21	E13-A17 WeakPolarHBondContact O-CB 3.42Å; E13-A17 PolarHBondContact O-N 2.76Å; K14-A17 PolarHBondContact O-N 3.06Å; A17-L20 PolarHBondContact O-N 3.37Å; A17-K21 WeakPolarHBondContact O-CB 3.39Å; A17-K21 PolarHBondContact O-N 3.18Å
18	S	82.4	Confident	79.7	Confident	69 Å²	69	100.6 Å²	100.6	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-38.6	175.7	-175.8	0	0	0	0	112.6	K14 A15 R16 R22	K14-S18 WeakPolarHBondContact O-CB 3.44Å; K14-S18 PolarHBondContact O-N 3.01Å; A15-S18 PolarHBondContact O-N 2.83Å; R16-S18 VanDerWaalsContact C-N 3.32Å; R16-S18 PolarHBondContact O-N 3.23Å; S18-R22 WeakPolarHBondContact O-CB 3.42Å; S18-R22 PolarHBondContact O-N 3.24Å
19	A	78	Confident	79.7	Confident	51 Å²	51	101.1 Å²	101.1	42%	0.421	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-43	176.1	0	0	0	0	0	110.9	A15 R16 K21 R22 V23	A15-A19 VanDerWaalsContact O-CB 3.28Å; A15-A19 WeakPolarHBondContact O-CB 3.36Å; A15-A19 PolarHBondContact O-N 3.48Å; R16-A19 PolarHBondContact O-N 3.41Å; A19-K21 PolarHBondContact O-N 2.71Å; A19-R22 WeakPolarHBondContact O-CB 3.16Å; A19-R22 PolarHBondContact O-N 3.2Å; A19-V23 WeakPolarHBondContact O-CG2 3.25Å; A19-V23 PolarHBondContact O-N 2.77Å
20	L	81	Confident	79.4	Confident	131 Å²	131	102.9 Å²	102.9	69%	0.686	53%	0.529	S	S	*	.	H	α-helix	trans	-62	-44.3	178	-139.7	137.8	0	0	0	111.1	R16 A17 V23 S24	R16-L20 WeakPolarHBondContact O-CB 3.4Å; R16-L20 PolarHBondContact O-N 3.21Å; A17-L20 PolarHBondContact O-N 3.37Å; L20-V23 PolarHBondContact O-N 3.37Å; L20-S24 WeakPolarHBondContact O-CB 3.37Å; L20-S24 PolarHBondContact O-N 3.21Å
21	K	81.2	Confident	78.9	Confident	146 Å²	146	106.2 Å²	106.2	64%	0.635	55%	0.545	S	S	*	.	H	α-helix	trans	-60.7	-46.8	173.3	-164.4	177.7	-176.3	179.3	0	111.8	A17 A19 V23 S24 D25	A17-K21 WeakPolarHBondContact O-CB 3.39Å; A17-K21 PolarHBondContact O-N 3.18Å; A19-K21 PolarHBondContact O-N 2.71Å; K21-V23 VanDerWaalsContact C-N 3.34Å; K21-V23 PolarHBondContact O-N 2.74Å; K21-S24 WeakPolarHBondContact O-CB 3.14Å; K21-S24 PolarHBondContact O-N 3.43Å; K21-D25 VanDerWaalsContact O-CG 3.26Å; K21-D25 PolarHBondContact O-N 3.46Å
22	R	77.9	Confident	78.6	Confident	138 Å²	138	103.8 Å²	103.8	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-58.6	-43.4	176.7	-115	180	-177.1	161.5	2	112.3	S18 A19 D25 H26	S18-R22 WeakPolarHBondContact O-CB 3.42Å; S18-R22 PolarHBondContact O-N 3.24Å; A19-R22 WeakPolarHBondContact O-CB 3.16Å; A19-R22 PolarHBondContact O-N 3.2Å; R22-D25 PolarHBondContact O-N 2.88Å; R22-H26 PolarHBondContact O-N 3.38Å; R22-H26 PolarHBondContact O-ND1 3.42Å
23	V	77.1	Confident	78.2	Confident	73 Å²	73	103.1 Å²	103.1	44%	0.442	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-44.3	178.2	172.7	0	0	0	0	110.2	A19 L20 K21 D25 H26 F27	A19-V23 WeakPolarHBondContact O-CG2 3.25Å; A19-V23 PolarHBondContact O-N 2.77Å; L20-V23 PolarHBondContact O-N 3.37Å; K21-V23 VanDerWaalsContact C-N 3.34Å; K21-V23 PolarHBondContact O-N 2.74Å; V23-D25 VanDerWaalsContact C-N 3.29Å; V23-D25 PolarHBondContact O-N 3.5Å; V23-H26 PolarHBondContact O-N 2.78Å; V23-H26 VanDerWaalsContact O-N 3.13Å; V23-F27 HydrophobicContact CG1-CD2 3.91Å; V23-F27 HydrophobicContact CG1-CE2 4.09Å; V23-F27 VanDerWaalsContact O-CD2 3.26Å; V23-F27 WeakPolarHBondContact O-CD2 3.19Å; V23-F27 PolarHBondContact O-N 3.49Å
24	S	77.9	Confident	78	Confident	75 Å²	75	103.3 Å²	103.3	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-59.3	-39	175.7	-169.4	0	0	0	0	112.6	L20 K21 H26 F27	L20-S24 WeakPolarHBondContact O-CB 3.37Å; L20-S24 PolarHBondContact O-N 3.21Å; K21-S24 WeakPolarHBondContact O-CB 3.14Å; K21-S24 PolarHBondContact O-N 3.43Å; S24-H26 VanDerWaalsContact C-N 3.27Å; S24-H26 PolarHBondContact O-N 3.24Å; S24-F27 PolarHBondContact O-N 3.34Å
25	D	77	Confident	77.6	Confident	86 Å²	86	103.8 Å²	103.8	46%	0.46	54%	0.538	S	S	.	.	H	α-helix	trans	-67.8	-26.3	178.3	-70.6	-23.7	0	0	0	112.7	K21 R22 V23	K21-D25 VanDerWaalsContact O-CG 3.26Å; K21-D25 PolarHBondContact O-N 3.46Å; R22-D25 PolarHBondContact O-N 2.88Å; V23-D25 VanDerWaalsContact C-N 3.29Å; V23-D25 PolarHBondContact O-N 3.5Å
26	H	74.8	Confident	77.5	Confident	75 Å²	75	104.3 Å²	104.3	35%	0.347	53%	0.531	S	S	.	.	H	α-helix	trans	-82.8	-19.9	178.3	-76.7	75	0	0	0	113.8	R22 V23 S24 Q32 I39	R22-H26 PolarHBondContact O-N 3.38Å; R22-H26 PolarHBondContact O-ND1 3.42Å; V23-H26 PolarHBondContact O-N 2.78Å; V23-H26 VanDerWaalsContact O-N 3.13Å; S24-H26 VanDerWaalsContact C-N 3.27Å; S24-H26 PolarHBondContact O-N 3.24Å; H26-Q32 PolarHBondContact O-OE1 2.87Å; H26-I39 HydrophobicContact CB-CD1 4.37Å
27	F	77.5	Confident	77.6	Confident	65 Å²	65	101.8 Å²	101.8	29%	0.285	53%	0.531	S	S	.	.			trans	-128	54.7	-172.7	-58.7	-65.7	0	0	0	112.7	V23 S24 Q32 L33 I36 I39	V23-F27 HydrophobicContact CG1-CD2 3.91Å; V23-F27 HydrophobicContact CG1-CE2 4.09Å; V23-F27 VanDerWaalsContact O-CD2 3.26Å; V23-F27 WeakPolarHBondContact O-CD2 3.19Å; V23-F27 PolarHBondContact O-N 3.49Å; S24-F27 PolarHBondContact O-N 3.34Å; F27-Q32 HydrophobicContact CD1-CB 4.49Å; F27-L33 HydrophobicContact CD1-CD2 4.19Å; F27-L33 HydrophobicContact CE1-CD2 4.49Å; F27-I36 HydrophobicContact CE1-CD1 4.28Å; F27-I36 HydrophobicContact CE1-CG1 3.59Å; F27-I36 HydrophobicContact CZ-CD1 4.39Å; F27-I36 HydrophobicContact CZ-CG1 3.63Å; F27-I39 HydrophobicContact CE1-CD1 4Å; F27-I39 HydrophobicContact CZ-CD1 4.01Å; F27-I39 HydrophobicContact CZ-CG2 4.49Å
28	Q	76.7	Confident	77.6	Confident	138 Å²	138	104.5 Å²	104.5	65%	0.645	54%	0.535	S	S	*	.	S	Bend	trans	-81.9	-22.7	176.7	-65.6	-173.5	-5.7	0	0	113.5
29	K	75.4	Confident	77.5	Confident	133 Å²	133	102.5 Å²	102.5	58%	0.578	52%	0.519	S	S	*	.	S	Bend	trans	-126.8	146	-179.4	-63.4	-175.8	-179.8	-176.2	0	111.3	E31 Q32	K29-E31 VanDerWaalsContact C-N 3.26Å; K29-E31 PolarHBondContact O-N 3.37Å; K29-Q32 HydrophobicContact CB-CG 4.27Å; K29-Q32 VanDerWaalsContact N-OE1 3.1Å; K29-Q32 WeakPolarHBondContact O-CB 3.32Å; K29-Q32 PolarHBondContact O-N 2.83Å
30	P	75.1	Confident	77.8	Confident	109 Å²	109	107.1 Å²	107.1	71%	0.708	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-55.8	-38.7	-180	-23	31.6	0	0	0	113.4	Q32 L33	P30-Q32 PolarHBondContact O-N 2.86Å; P30-Q32 VanDerWaalsContact O-N 3.11Å; P30-L33 VanDerWaalsContact O-CB 3.3Å; P30-L33 WeakPolarHBondContact O-CB 3.29Å; P30-L33 WeakPolarHBondContact O-CG 3.49Å; P30-L33 PolarHBondContact O-N 3.44Å
31	E	72.6	Confident	77.9	Confident	155 Å²	155	103.9 Å²	103.9	72%	0.724	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-60	-20.8	178.1	-61.2	167.3	-168.6	0	0	113.5	K29 L33	K29-E31 VanDerWaalsContact C-N 3.26Å; K29-E31 PolarHBondContact O-N 3.37Å; E31-L33 PolarHBondContact O-N 2.73Å
32	Q	72.5	Confident	78	Confident	65 Å²	65	106 Å²	106	30%	0.304	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-76.2	-14	178.7	-65.2	175	-32.3	0	0	112.6	H26 F27 K29 P30 D34 K35	H26-Q32 PolarHBondContact O-OE1 2.87Å; F27-Q32 HydrophobicContact CD1-CB 4.49Å; K29-Q32 HydrophobicContact CB-CG 4.27Å; K29-Q32 VanDerWaalsContact N-OE1 3.1Å; K29-Q32 WeakPolarHBondContact O-CB 3.32Å; K29-Q32 PolarHBondContact O-N 2.83Å; P30-Q32 PolarHBondContact O-N 2.86Å; P30-Q32 VanDerWaalsContact O-N 3.11Å; Q32-D34 PolarHBondContact O-N 2.77Å; Q32-K35 PolarHBondContact O-N 3.35Å
33	L	73.8	Confident	78.3	Confident	93 Å²	93	103 Å²	103	49%	0.487	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-64.5	-26.6	175.1	-71.1	164	0	0	0	112.2	F27 P30 E31 K35 I36	F27-L33 HydrophobicContact CD1-CD2 4.19Å; F27-L33 HydrophobicContact CE1-CD2 4.49Å; P30-L33 VanDerWaalsContact O-CB 3.3Å; P30-L33 WeakPolarHBondContact O-CB 3.29Å; P30-L33 WeakPolarHBondContact O-CG 3.49Å; P30-L33 PolarHBondContact O-N 3.44Å; E31-L33 PolarHBondContact O-N 2.73Å; L33-K35 PolarHBondContact O-N 3.29Å; L33-K35 VanDerWaalsContact O-N 3.09Å; L33-I36 HydrophobicContact CD2-CD1 3.59Å; L33-I36 HydrophobicContact CD2-CG1 4.44Å; L33-I36 VanDerWaalsContact O-CB 3.29Å; L33-I36 WeakPolarHBondContact O-CB 3.44Å; L33-I36 PolarHBondContact O-N 3.5Å
34	D	77.1	Confident	78.8	Confident	148 Å²	148	104.5 Å²	104.5	79%	0.791	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-62.3	-20.7	176.4	-68.6	-14.4	0	0	0	112.6	Q32	Q32-D34 PolarHBondContact O-N 2.77Å
35	K	74.4	Confident	79.1	Confident	133 Å²	133	105.7 Å²	105.7	58%	0.578	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-92.1	6.4	178.2	-61.9	-173.9	-178	178.7	0	113.7	Q32 L33 D37 I38 I39	Q32-K35 PolarHBondContact O-N 3.35Å; L33-K35 PolarHBondContact O-N 3.29Å; L33-K35 VanDerWaalsContact O-N 3.09Å; K35-D37 VanDerWaalsContact C-N 3.3Å; K35-D37 PolarHBondContact O-N 2.96Å; K35-I38 PolarHBondContact O-N 2.81Å; K35-I39 HydrophobicContact CB-CD1 4.1Å; K35-I39 HydrophobicContact CB-CG1 4.46Å; K35-I39 WeakPolarHBondContact O-CG1 3.25Å; K35-I39 PolarHBondContact O-N 3.41Å
36	I	80.9	Confident	79.5	Confident	70 Å²	70	106.5 Å²	106.5	36%	0.359	52%	0.519	S	S	.	.	H	α-helix	trans	-53.1	-45.2	-176.5	-102.7	173.9	0	0	0	112.3	F27 L33 I38 I39 K40	F27-I36 HydrophobicContact CE1-CD1 4.28Å; F27-I36 HydrophobicContact CE1-CG1 3.59Å; F27-I36 HydrophobicContact CZ-CD1 4.39Å; F27-I36 HydrophobicContact CZ-CG1 3.63Å; L33-I36 HydrophobicContact CD2-CD1 3.59Å; L33-I36 HydrophobicContact CD2-CG1 4.44Å; L33-I36 VanDerWaalsContact O-CB 3.29Å; L33-I36 WeakPolarHBondContact O-CB 3.44Å; L33-I36 PolarHBondContact O-N 3.5Å; I36-I38 PolarHBondContact O-N 2.99Å; I36-I39 PolarHBondContact O-N 2.78Å; I36-K40 VanDerWaalsContact O-CB 3.23Å; I36-K40 WeakPolarHBondContact O-CB 3.25Å; I36-K40 PolarHBondContact O-N 3.14Å
37	D	82.8	Confident	80	Confident	121 Å²	121	108.4 Å²	108.4	65%	0.647	53%	0.526	S	S	*	.	H	α-helix	trans	-68.8	-38.1	-175.3	-73.3	-35.2	0	0	0	112	K35 K40 S41	K35-D37 VanDerWaalsContact C-N 3.3Å; K35-D37 PolarHBondContact O-N 2.96Å; D37-K40 PolarHBondContact O-N 3.41Å; D37-S41 VanDerWaalsContact O-CB 3.31Å; D37-S41 WeakPolarHBondContact O-CB 3.47Å; D37-S41 PolarHBondContact O-N 3.35Å
38	I	83	Confident	80.4	Confident	120 Å²	120	108.6 Å²	108.6	62%	0.615	53%	0.533	S	S	*	.	H	α-helix	trans	-64.8	-45.9	175.3	-60.8	171.9	0	0	0	109.8	K35 I36 S41 R42	K35-I38 PolarHBondContact O-N 2.81Å; I36-I38 PolarHBondContact O-N 2.99Å; I38-S41 PolarHBondContact O-N 2.89Å; I38-R42 WeakPolarHBondContact O-CB 3.23Å; I38-R42 PolarHBondContact O-N 3.45Å
39	I	81.4	Confident	80.8	Confident	28 Å²	28	104.3 Å²	104.3	14%	0.144	52%	0.522	C	S	.	.	H	α-helix	trans	-64.4	-43.6	179.4	-68.3	168.1	0	0	0	110.5	H26 F27 K35 I36 R42 F43	H26-I39 HydrophobicContact CB-CD1 4.37Å; F27-I39 HydrophobicContact CE1-CD1 4Å; F27-I39 HydrophobicContact CZ-CD1 4.01Å; F27-I39 HydrophobicContact CZ-CG2 4.49Å; K35-I39 HydrophobicContact CB-CD1 4.1Å; K35-I39 HydrophobicContact CB-CG1 4.46Å; K35-I39 WeakPolarHBondContact O-CG1 3.25Å; K35-I39 PolarHBondContact O-N 3.41Å; I36-I39 PolarHBondContact O-N 2.78Å; I39-R42 WeakPolarHBondContact O-CB 3.46Å; I39-R42 PolarHBondContact O-N 3.46Å; I39-F43 HydrophobicContact CG2-CD2 3.52Å; I39-F43 HydrophobicContact CG2-CE2 3.4Å; I39-F43 VanDerWaalsContact CG2-CE2 3.4Å; I39-F43 VanDerWaalsContact O-CD2 3.27Å; I39-F43 WeakPolarHBondContact O-CD2 3.49Å; I39-F43 PolarHBondContact O-N 2.78Å
40	K	83.2	Confident	81.3	Confident	148 Å²	148	101.2 Å²	101.2	64%	0.643	51%	0.514	S	S	*	.	H	α-helix	trans	-63.5	-44.2	178.2	-168	179	-177.4	-177.9	0	111.7	I36 D37 R42 F43 L44	I36-K40 VanDerWaalsContact O-CB 3.23Å; I36-K40 WeakPolarHBondContact O-CB 3.25Å; I36-K40 PolarHBondContact O-N 3.14Å; D37-K40 PolarHBondContact O-N 3.41Å; K40-R42 VanDerWaalsContact C-N 3.32Å; K40-R42 PolarHBondContact O-N 2.78Å; K40-F43 PolarHBondContact O-N 2.8Å; K40-L44 VanDerWaalsContact O-CB 3.3Å; K40-L44 WeakPolarHBondContact O-CB 3.3Å; K40-L44 PolarHBondContact O-N 2.89Å
41	S	83.5	Confident	81.9	Confident	63 Å²	63	100.2 Å²	100.2	44%	0.441	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-42	173.2	179.3	0	0	0	0	111.5	D37 I38 L44 N45	D37-S41 VanDerWaalsContact O-CB 3.31Å; D37-S41 WeakPolarHBondContact O-CB 3.47Å; D37-S41 PolarHBondContact O-N 3.35Å; I38-S41 PolarHBondContact O-N 2.89Å; S41-L44 PolarHBondContact O-N 2.76Å; S41-N45 WeakPolarHBondContact O-CB 3.27Å; S41-N45 PolarHBondContact O-N 3.17Å; S41-N45 PolarHBondContact O-ND2 3.48Å
42	R	83.2	Confident	82.5	Confident	191 Å²	191	95.3 Å²	95.3	72%	0.721	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-46.4	177.3	-152.6	179	-159.2	171.2	5.6	112.2	I38 I39 K40 L44 N45 Q46	I38-R42 WeakPolarHBondContact O-CB 3.23Å; I38-R42 PolarHBondContact O-N 3.45Å; I39-R42 WeakPolarHBondContact O-CB 3.46Å; I39-R42 PolarHBondContact O-N 3.46Å; K40-R42 VanDerWaalsContact C-N 3.32Å; K40-R42 PolarHBondContact O-N 2.78Å; R42-L44 VanDerWaalsContact C-N 3.34Å; R42-N45 PolarHBondContact O-N 3.49Å; R42-Q46 WeakPolarHBondContact O-CB 3.37Å; R42-Q46 PolarHBondContact O-N 3.37Å
43	F	84.4	Confident	83.1	Confident	74 Å²	74	98.8 Å²	98.8	33%	0.325	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-36.6	175.3	-81.5	-63.3	0	0	0	112.3	I39 K40 Q46 K47	I39-F43 HydrophobicContact CG2-CD2 3.52Å; I39-F43 HydrophobicContact CG2-CE2 3.4Å; I39-F43 VanDerWaalsContact CG2-CE2 3.4Å; I39-F43 VanDerWaalsContact O-CD2 3.27Å; I39-F43 WeakPolarHBondContact O-CD2 3.49Å; I39-F43 PolarHBondContact O-N 2.78Å; K40-F43 PolarHBondContact O-N 2.8Å; F43-Q46 PolarHBondContact O-N 3.49Å; F43-K47 VanDerWaalsContact O-CB 3.3Å; F43-K47 WeakPolarHBondContact O-CB 3.3Å; F43-K47 PolarHBondContact O-N 2.76Å
44	L	87.9	Confident	83.7	Confident	104 Å²	104	99.9 Å²	99.9	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-45.6	175.5	-172.5	68.7	0	0	0	111.1	K40 S41 R42 Q46 K47 T48	K40-L44 VanDerWaalsContact O-CB 3.3Å; K40-L44 WeakPolarHBondContact O-CB 3.3Å; K40-L44 PolarHBondContact O-N 2.89Å; S41-L44 PolarHBondContact O-N 2.76Å; R42-L44 VanDerWaalsContact C-N 3.34Å; L44-Q46 VanDerWaalsContact C-N 3.33Å; L44-Q46 PolarHBondContact O-N 2.79Å; L44-K47 WeakPolarHBondContact O-CB 3.35Å; L44-K47 PolarHBondContact O-N 3.32Å; L44-T48 PolarHBondContact O-N 3.3Å; L44-T48 PolarHBondContact O-OG1 2.88Å
45	N	83.9	Confident	84.1	Confident	100 Å²	100	99.7 Å²	99.7	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-38.4	174.8	-75.3	-21.3	0	0	0	112.2	S41 R42 T48 A49	S41-N45 WeakPolarHBondContact O-CB 3.27Å; S41-N45 PolarHBondContact O-N 3.17Å; S41-N45 PolarHBondContact O-ND2 3.48Å; R42-N45 PolarHBondContact O-N 3.49Å; N45-T48 WeakPolarHBondContact CA-OG1 3.4Å; N45-T48 PolarHBondContact O-OG1 2.86Å; N45-T48 VanDerWaalsContact O-OG1 3.05Å; N45-A49 VanDerWaalsContact O-CB 3.23Å; N45-A49 WeakPolarHBondContact O-CB 3.5Å; N45-A49 PolarHBondContact O-N 3.43Å
46	Q	84.1	Confident	84.5	Confident	104 Å²	104	99.5 Å²	99.5	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-69.3	-36.3	177.3	-151.5	169.1	23.8	0	0	111.4	R42 F43 L44 T50	R42-Q46 WeakPolarHBondContact O-CB 3.37Å; R42-Q46 PolarHBondContact O-N 3.37Å; F43-Q46 PolarHBondContact O-N 3.49Å; L44-Q46 VanDerWaalsContact C-N 3.33Å; L44-Q46 PolarHBondContact O-N 2.79Å; Q46-T50 WeakPolarHBondContact O-CB 3.22Å; Q46-T50 PolarHBondContact O-N 2.75Å; Q46-T50 PolarHBondContact O-OG1 2.76Å
47	K	86.8	Confident	84.7	Confident	114 Å²	114	98.7 Å²	98.7	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-50.5	172.3	178.1	-177.4	169.7	-179.4	0	111.5	F43 L44 A49 T50 E51	F43-K47 VanDerWaalsContact O-CB 3.3Å; F43-K47 WeakPolarHBondContact O-CB 3.3Å; F43-K47 PolarHBondContact O-N 2.76Å; L44-K47 WeakPolarHBondContact O-CB 3.35Å; L44-K47 PolarHBondContact O-N 3.32Å; K47-A49 VanDerWaalsContact C-N 3.3Å; K47-A49 PolarHBondContact O-N 2.92Å; K47-T50 WeakPolarHBondContact CA-OG1 3.35Å; K47-T50 PolarHBondContact O-N 2.97Å; K47-T50 PolarHBondContact O-OG1 3.44Å; K47-E51 WeakPolarHBondContact CE-OE1 3.4Å; K47-E51 HydrophobicContact CG-CG 4.44Å; K47-E51 IonicContact NZ-OE1 2.75Å; K47-E51 WeakPolarHBondContact O-CB 3.31Å; K47-E51 WeakPolarHBondContact O-CG 3.32Å; K47-E51 PolarHBondContact O-N 3.42Å
48	T	85.2	Confident	84.9	Confident	69 Å²	69	98.2 Å²	98.2	42%	0.423	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-37	178.7	44	0	0	0	0	111.8	L44 N45 A52	L44-T48 PolarHBondContact O-N 3.3Å; L44-T48 PolarHBondContact O-OG1 2.88Å; N45-T48 WeakPolarHBondContact CA-OG1 3.4Å; N45-T48 PolarHBondContact O-OG1 2.86Å; N45-T48 VanDerWaalsContact O-OG1 3.05Å; T48-A52 VanDerWaalsContact O-CB 3.3Å; T48-A52 WeakPolarHBondContact O-CB 3.4Å; T48-A52 PolarHBondContact O-N 2.86Å
49	A	86.2	Confident	85	Confident	49 Å²	49	100.2 Å²	100.2	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-44.6	173.5	0	0	0	0	0	112.5	N45 K47 A52 Q53	N45-A49 VanDerWaalsContact O-CB 3.23Å; N45-A49 WeakPolarHBondContact O-CB 3.5Å; N45-A49 PolarHBondContact O-N 3.43Å; K47-A49 VanDerWaalsContact C-N 3.3Å; K47-A49 PolarHBondContact O-N 2.92Å; A49-A52 PolarHBondContact O-N 2.86Å; A49-Q53 WeakPolarHBondContact O-CB 3.22Å; A49-Q53 WeakPolarHBondContact O-CG 3.45Å; A49-Q53 PolarHBondContact O-N 3.26Å
50	T	85	Confident	85.1	Confident	67 Å²	67	102.7 Å²	102.7	41%	0.411	52%	0.524	S	S	.	.	H	α-helix	trans	-68.8	-38	177.3	37.3	0	0	0	0	112.3	Q46 K47 Q53 L54	Q46-T50 WeakPolarHBondContact O-CB 3.22Å; Q46-T50 PolarHBondContact O-N 2.75Å; Q46-T50 PolarHBondContact O-OG1 2.76Å; K47-T50 WeakPolarHBondContact CA-OG1 3.35Å; K47-T50 PolarHBondContact O-N 2.97Å; K47-T50 PolarHBondContact O-OG1 3.44Å; T50-Q53 PolarHBondContact O-N 3.48Å; T50-L54 WeakPolarHBondContact O-CB 3.36Å; T50-L54 WeakPolarHBondContact O-CG 3.5Å; T50-L54 PolarHBondContact O-N 2.93Å
51	E	87.3	Confident	85.2	Confident	89 Å²	89	102.1 Å²	102.1	42%	0.416	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-40.4	172.5	-77.4	178.9	175.6	0	0	112.1	K47 L54 K55	K47-E51 WeakPolarHBondContact CE-OE1 3.4Å; K47-E51 HydrophobicContact CG-CG 4.44Å; K47-E51 IonicContact NZ-OE1 2.75Å; K47-E51 WeakPolarHBondContact O-CB 3.31Å; K47-E51 WeakPolarHBondContact O-CG 3.32Å; K47-E51 PolarHBondContact O-N 3.42Å; E51-L54 PolarHBondContact O-N 3.31Å; E51-K55 WeakPolarHBondContact O-CB 3.37Å; E51-K55 WeakPolarHBondContact O-CG 3.31Å; E51-K55 PolarHBondContact O-N 2.83Å
52	A	85.3	Confident	85.5	Confident	52 Å²	52	104.1 Å²	104.1	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-65.8	-44.3	175.1	0	0	0	0	0	111.8	T48 A49 K55 M56	T48-A52 VanDerWaalsContact O-CB 3.3Å; T48-A52 WeakPolarHBondContact O-CB 3.4Å; T48-A52 PolarHBondContact O-N 2.86Å; A49-A52 PolarHBondContact O-N 2.86Å; A52-K55 PolarHBondContact O-N 3.24Å; A52-M56 WeakPolarHBondContact O-CB 3.34Å; A52-M56 WeakPolarHBondContact O-CG 3.32Å; A52-M56 PolarHBondContact O-N 3.3Å
53	Q	85.2	Confident	85.6	Confident	138 Å²	138	99.7 Å²	99.7	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-62	-43.4	174.7	-78.2	-179.7	-13.3	0	0	112	A49 T50 M56 A57	A49-Q53 WeakPolarHBondContact O-CB 3.22Å; A49-Q53 WeakPolarHBondContact O-CG 3.45Å; A49-Q53 PolarHBondContact O-N 3.26Å; T50-Q53 PolarHBondContact O-N 3.48Å; Q53-M56 PolarHBondContact O-N 3.32Å; Q53-A57 VanDerWaalsContact O-CB 3.3Å; Q53-A57 WeakPolarHBondContact O-CB 3.45Å; Q53-A57 PolarHBondContact O-N 3.14Å
54	L	86.4	Confident	85.8	Confident	116 Å²	116	98.3 Å²	98.3	61%	0.607	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-45.2	176	-83.3	163.4	0	0	0	111.4	T50 E51 M56 A57 L58	T50-L54 WeakPolarHBondContact O-CB 3.36Å; T50-L54 WeakPolarHBondContact O-CG 3.5Å; T50-L54 PolarHBondContact O-N 2.93Å; E51-L54 PolarHBondContact O-N 3.31Å; L54-M56 PolarHBondContact O-N 3.34Å; L54-A57 PolarHBondContact O-N 3.42Å; L54-L58 WeakPolarHBondContact O-CB 3.33Å; L54-L58 PolarHBondContact O-N 2.84Å
55	K	85.8	Confident	85.8	Confident	143 Å²	143	96.5 Å²	96.5	62%	0.622	52%	0.522	S	S	*	.	H	α-helix	trans	-59.2	-47.7	174.5	-81.5	-179.1	178.5	177.5	0	111.5	E51 A52 A57 L58 Y59	E51-K55 WeakPolarHBondContact O-CB 3.37Å; E51-K55 WeakPolarHBondContact O-CG 3.31Å; E51-K55 PolarHBondContact O-N 2.83Å; A52-K55 PolarHBondContact O-N 3.24Å; K55-A57 PolarHBondContact O-N 3.47Å; K55-L58 PolarHBondContact O-N 3.34Å; K55-Y59 WeakPolarHBondContact O-CB 3.48Å; K55-Y59 VanDerWaalsContact O-CD2 3.3Å; K55-Y59 WeakPolarHBondContact O-CD2 3.2Å; K55-Y59 PolarHBondContact O-N 3.01Å
56	M	83.1	Confident	86.1	Confident	130 Å²	130	97.4 Å²	97.4	64%	0.64	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-43.7	178.6	-72.7	-88.3	77.8	0	0	112.1	A52 Q53 L54 S60	A52-M56 WeakPolarHBondContact O-CB 3.34Å; A52-M56 WeakPolarHBondContact O-CG 3.32Å; A52-M56 PolarHBondContact O-N 3.3Å; Q53-M56 PolarHBondContact O-N 3.32Å; L54-M56 PolarHBondContact O-N 3.34Å; M56-S60 VanDerWaalsContact O-CB 3.28Å; M56-S60 WeakPolarHBondContact O-CB 3.45Å; M56-S60 PolarHBondContact O-N 3.46Å
57	A	83.9	Confident	86.3	Confident	53 Å²	53	95.3 Å²	95.3	44%	0.438	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-41.5	176.9	0	0	0	0	0	111.8	Q53 L54 K55 S60 Q61	Q53-A57 VanDerWaalsContact O-CB 3.3Å; Q53-A57 WeakPolarHBondContact O-CB 3.45Å; Q53-A57 PolarHBondContact O-N 3.14Å; L54-A57 PolarHBondContact O-N 3.42Å; K55-A57 PolarHBondContact O-N 3.47Å; A57-S60 PolarHBondContact O-N 2.88Å; A57-Q61 WeakPolarHBondContact O-CB 3.48Å; A57-Q61 VanDerWaalsContact O-CG 3.27Å; A57-Q61 WeakPolarHBondContact O-CG 3.43Å; A57-Q61 PolarHBondContact O-N 3.38Å
58	L	87.7	Confident	86.5	Confident	111 Å²	111	91.3 Å²	91.3	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-68.3	-42.7	179.7	-156.1	120.6	0	0	0	111.5	L54 K55 Q61 L62	L54-L58 WeakPolarHBondContact O-CB 3.33Å; L54-L58 PolarHBondContact O-N 2.84Å; K55-L58 PolarHBondContact O-N 3.34Å; L58-Q61 PolarHBondContact O-N 3.13Å; L58-L62 HydrophobicContact CD2-CD1 3.82Å; L58-L62 HydrophobicContact CG-CD1 4.48Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 PolarHBondContact O-N 2.68Å
59	Y	85.1	Confident	86.8	Confident	162 Å²	162	93.8 Å²	93.8	64%	0.635	52%	0.516	S	S	*	.	H	α-helix	trans	-61	-44.8	171.5	-92	-74.1	0	0	0	111.5	K55 Q61 L62 D63	K55-Y59 WeakPolarHBondContact O-CB 3.48Å; K55-Y59 VanDerWaalsContact O-CD2 3.3Å; K55-Y59 WeakPolarHBondContact O-CD2 3.2Å; K55-Y59 PolarHBondContact O-N 3.01Å; Y59-Q61 PolarHBondContact O-N 3.33Å; Y59-L62 PolarHBondContact O-N 2.94Å; Y59-D63 WeakPolarHBondContact O-CB 3.29Å; Y59-D63 PolarHBondContact O-N 3.35Å
60	S	83.5	Confident	87	Confident	79 Å²	79	96.3 Å²	96.3	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-40.9	177.4	168.7	0	0	0	0	112.7	M56 A57 G64	M56-S60 VanDerWaalsContact O-CB 3.28Å; M56-S60 WeakPolarHBondContact O-CB 3.45Å; M56-S60 PolarHBondContact O-N 3.46Å; A57-S60 PolarHBondContact O-N 2.88Å; S60-G64 PolarHBondContact O-N 3.01Å
61	Q	85.7	Confident	87.3	Confident	136 Å²	136	100.2 Å²	100.2	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-70.9	-39.2	177.7	-72.6	-69.2	-17.4	0	0	112.1	A57 L58 Y59 S65	A57-Q61 WeakPolarHBondContact O-CB 3.48Å; A57-Q61 VanDerWaalsContact O-CG 3.27Å; A57-Q61 WeakPolarHBondContact O-CG 3.43Å; A57-Q61 PolarHBondContact O-N 3.38Å; L58-Q61 PolarHBondContact O-N 3.13Å; Y59-Q61 PolarHBondContact O-N 3.33Å; Q61-S65 VanDerWaalsContact O-CB 3.29Å; Q61-S65 WeakPolarHBondContact O-CB 3.25Å; Q61-S65 PolarHBondContact O-N 3.14Å; Q61-S65 PolarHBondContact O-OG 3.32Å
62	L	89.1	Confident	87.5	Confident	106 Å²	106	101.7 Å²	101.7	56%	0.555	54%	0.541	S	S	*	.	H	α-helix	trans	-65.9	-44.3	174.5	-87.2	161.9	0	0	0	111.7	L58 Y59 S65 K66	L58-L62 HydrophobicContact CD2-CD1 3.82Å; L58-L62 HydrophobicContact CG-CD1 4.48Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 PolarHBondContact O-N 2.68Å; Y59-L62 PolarHBondContact O-N 2.94Å; L62-S65 PolarHBondContact O-N 3.18Å; L62-K66 WeakPolarHBondContact O-CB 3.2Å; L62-K66 PolarHBondContact O-N 3.4Å
63	D	86.4	Confident	87.9	Confident	98 Å²	98	104.7 Å²	104.7	52%	0.524	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-44.2	177	-165.5	55.9	0	0	0	110.9	Y59 S65 K66 V67	Y59-D63 WeakPolarHBondContact O-CB 3.29Å; Y59-D63 PolarHBondContact O-N 3.35Å; D63-S65 VanDerWaalsContact C-N 3.33Å; D63-S65 PolarHBondContact O-N 3.42Å; D63-K66 PolarHBondContact O-N 3.04Å; D63-V67 WeakPolarHBondContact O-CB 3.49Å; D63-V67 WeakPolarHBondContact O-CG2 3.45Å; D63-V67 PolarHBondContact O-N 2.84Å
64	G	87.4	Confident	88.1	Confident	45 Å²	45	101.8 Å²	101.8	46%	0.464	54%	0.542	S	S	.	.	H	α-helix	trans	-60.1	-40.1	173	0	0	0	0	0	113.1	S60 G68	S60-G64 PolarHBondContact O-N 3.01Å; G64-G68 PolarHBondContact O-N 2.6Å
65	S	89.4	Confident	88.4	Confident	65 Å²	65	98.6 Å²	98.6	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-68.9	-38.8	175.6	-60.4	0	0	0	0	112	Q61 L62 D63 G68 L69	Q61-S65 VanDerWaalsContact O-CB 3.29Å; Q61-S65 WeakPolarHBondContact O-CB 3.25Å; Q61-S65 PolarHBondContact O-N 3.14Å; Q61-S65 PolarHBondContact O-OG 3.32Å; L62-S65 PolarHBondContact O-N 3.18Å; D63-S65 VanDerWaalsContact C-N 3.33Å; D63-S65 PolarHBondContact O-N 3.42Å; S65-G68 PolarHBondContact O-N 3.3Å; S65-L69 WeakPolarHBondContact O-CB 3.43Å; S65-L69 WeakPolarHBondContact O-CG 3.31Å; S65-L69 PolarHBondContact O-N 3.06Å
66	K	89.7	Confident	88.8	Confident	120 Å²	120	96.3 Å²	96.3	52%	0.522	53%	0.526	S	S	.	.	H	α-helix	trans	-64.6	-49.9	175.8	-175.6	-173.1	172.4	-165.1	0	111.1	L62 D63 G68 L69 E70	L62-K66 WeakPolarHBondContact O-CB 3.2Å; L62-K66 PolarHBondContact O-N 3.4Å; D63-K66 PolarHBondContact O-N 3.04Å; K66-G68 VanDerWaalsContact C-N 3.26Å; K66-G68 PolarHBondContact O-N 3.41Å; K66-L69 PolarHBondContact O-N 2.97Å; K66-E70 WeakPolarHBondContact CE-OE1 3.45Å; K66-E70 IonicContact NZ-OE1 3.98Å; K66-E70 WeakPolarHBondContact O-CG 3.19Å; K66-E70 PolarHBondContact O-N 3.38Å
67	V	88.4	Confident	89.2	Confident	59 Å²	59	92.5 Å²	92.5	36%	0.358	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-38.9	174	171.9	0	0	0	0	110.7	D63 E70 K71	D63-V67 WeakPolarHBondContact O-CB 3.49Å; D63-V67 WeakPolarHBondContact O-CG2 3.45Å; D63-V67 PolarHBondContact O-N 2.84Å; V67-E70 PolarHBondContact O-N 2.84Å; V67-K71 HydrophobicContact CG1-CD 4.43Å; V67-K71 WeakPolarHBondContact O-CB 3.27Å; V67-K71 WeakPolarHBondContact O-CG 3.46Å; V67-K71 PolarHBondContact O-N 3.39Å
68	G	90.5	Very high	89.6	Confident	30 Å²	30	96.1 Å²	96.1	31%	0.309	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-44.1	174.6	0	0	0	0	0	112.9	G64 S65 K66 K71 L72	G64-G68 PolarHBondContact O-N 2.6Å; S65-G68 PolarHBondContact O-N 3.3Å; K66-G68 VanDerWaalsContact C-N 3.26Å; K66-G68 PolarHBondContact O-N 3.41Å; G68-K71 PolarHBondContact O-N 3.39Å; G68-L72 WeakPolarHBondContact O-CB 3.45Å; G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 2.7Å
69	L	91.7	Very high	89.8	Confident	121 Å²	121	94.4 Å²	94.4	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-66.2	-45.2	175.6	-81.8	162.3	0	0	0	112	S65 K66 K71 L72 D73	S65-L69 WeakPolarHBondContact O-CB 3.43Å; S65-L69 WeakPolarHBondContact O-CG 3.31Å; S65-L69 PolarHBondContact O-N 3.06Å; K66-L69 PolarHBondContact O-N 2.97Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.87Å; L69-L72 PolarHBondContact O-N 3.18Å; L69-D73 WeakPolarHBondContact O-CB 3.35Å; L69-D73 PolarHBondContact O-N 3.43Å
70	E	91	Very high	90.2	Very high	103 Å²	103	91.5 Å²	91.5	48%	0.481	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-42.1	175.3	-73.6	173.9	-178.1	0	0	111.2	K66 V67 D73 T74	K66-E70 WeakPolarHBondContact CE-OE1 3.45Å; K66-E70 IonicContact NZ-OE1 3.98Å; K66-E70 WeakPolarHBondContact O-CG 3.19Å; K66-E70 PolarHBondContact O-N 3.38Å; V67-E70 PolarHBondContact O-N 2.84Å; E70-D73 PolarHBondContact O-N 2.83Å; E70-T74 WeakPolarHBondContact O-CB 3.25Å; E70-T74 PolarHBondContact O-N 3.17Å; E70-T74 PolarHBondContact O-OG1 3.4Å
71	K	89.6	Confident	90.6	Very high	148 Å²	148	90.9 Å²	90.9	64%	0.643	51%	0.506	S	S	*	.	H	α-helix	trans	-65.2	-39.3	174.4	-79	-171.5	176.8	-172.4	0	112.7	V67 G68 L69 T74 A75	V67-K71 HydrophobicContact CG1-CD 4.43Å; V67-K71 WeakPolarHBondContact O-CB 3.27Å; V67-K71 WeakPolarHBondContact O-CG 3.46Å; V67-K71 PolarHBondContact O-N 3.39Å; G68-K71 PolarHBondContact O-N 3.39Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.87Å; K71-T74 PolarHBondContact O-N 2.95Å; K71-A75 VanDerWaalsContact O-CB 3.25Å; K71-A75 WeakPolarHBondContact O-CB 3.34Å; K71-A75 PolarHBondContact O-N 2.91Å
72	L	91.9	Very high	90.8	Very high	121 Å²	121	87.9 Å²	87.9	63%	0.634	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-41.3	175.6	-84.6	164.9	0	0	0	111.4	G68 L69 A75 L76	G68-L72 WeakPolarHBondContact O-CB 3.45Å; G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 2.7Å; L69-L72 PolarHBondContact O-N 3.18Å; L72-A75 PolarHBondContact O-N 3.46Å; L72-L76 WeakPolarHBondContact O-CB 3.41Å; L72-L76 PolarHBondContact O-N 2.89Å
73	D	93.5	Very high	91	Very high	114 Å²	114	89.6 Å²	89.6	61%	0.61	50%	0.498	S	S	*	.	H	α-helix	trans	-66.6	-41.6	177.3	-154.7	40.7	0	0	0	111	L69 E70 L76 A77	L69-D73 WeakPolarHBondContact O-CB 3.35Å; L69-D73 PolarHBondContact O-N 3.43Å; E70-D73 PolarHBondContact O-N 2.83Å; D73-L76 PolarHBondContact O-N 3.36Å; D73-A77 WeakPolarHBondContact O-CB 3.46Å; D73-A77 PolarHBondContact O-N 3.09Å
74	T	91.2	Very high	91.2	Very high	78 Å²	78	88.8 Å²	88.8	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-46.8	173.1	-48.8	0	0	0	0	111.3	E70 K71 L76 A77 E78	E70-T74 WeakPolarHBondContact O-CB 3.25Å; E70-T74 PolarHBondContact O-N 3.17Å; E70-T74 PolarHBondContact O-OG1 3.4Å; K71-T74 PolarHBondContact O-N 2.95Å; T74-L76 VanDerWaalsContact C-N 3.31Å; T74-L76 PolarHBondContact O-N 3.02Å; T74-A77 PolarHBondContact O-N 2.84Å; T74-E78 WeakPolarHBondContact O-CB 3.41Å; T74-E78 WeakPolarHBondContact O-CG 3.11Å; T74-E78 PolarHBondContact O-N 2.95Å
75	A	91.7	Very high	91.3	Very high	49 Å²	49	94.3 Å²	94.3	41%	0.405	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-34.8	177.9	0	0	0	0	0	112.2	K71 L72 S79	K71-A75 VanDerWaalsContact O-CB 3.25Å; K71-A75 WeakPolarHBondContact O-CB 3.34Å; K71-A75 PolarHBondContact O-N 2.91Å; L72-A75 PolarHBondContact O-N 3.46Å; A75-S79 WeakPolarHBondContact O-CB 3.38Å; A75-S79 PolarHBondContact O-N 3.34Å
76	L	93.9	Very high	91.3	Very high	95 Å²	95	96.8 Å²	96.8	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-46.1	173.6	-174.6	72.3	0	0	0	110.6	L72 D73 T74 S79 Q80	L72-L76 WeakPolarHBondContact O-CB 3.41Å; L72-L76 PolarHBondContact O-N 2.89Å; D73-L76 PolarHBondContact O-N 3.36Å; T74-L76 VanDerWaalsContact C-N 3.31Å; T74-L76 PolarHBondContact O-N 3.02Å; L76-S79 PolarHBondContact O-N 3.25Å; L76-Q80 WeakPolarHBondContact O-CB 3.38Å; L76-Q80 VanDerWaalsContact O-CG 3.3Å; L76-Q80 WeakPolarHBondContact O-CG 3.37Å; L76-Q80 PolarHBondContact O-N 3.32Å
77	A	91.8	Very high	91.3	Very high	50 Å²	50	95.7 Å²	95.7	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-42.8	176.2	0	0	0	0	0	112.1	D73 T74 Q80 T81	D73-A77 WeakPolarHBondContact O-CB 3.46Å; D73-A77 PolarHBondContact O-N 3.09Å; T74-A77 PolarHBondContact O-N 2.84Å; A77-Q80 PolarHBondContact O-N 3.06Å; A77-T81 WeakPolarHBondContact O-CB 3.35Å; A77-T81 PolarHBondContact O-N 3.21Å; A77-T81 PolarHBondContact O-OG1 3.33Å
78	E	92.6	Very high	91.2	Very high	129 Å²	129	99 Å²	99	60%	0.603	52%	0.519	S	S	*	.	H	α-helix	trans	-63.5	-43.8	174.2	-77.8	-176.9	169.4	0	0	111.8	T74 Q80 T81 C82	T74-E78 WeakPolarHBondContact O-CB 3.41Å; T74-E78 WeakPolarHBondContact O-CG 3.11Å; T74-E78 PolarHBondContact O-N 2.95Å; E78-Q80 PolarHBondContact O-N 3.07Å; E78-T81 CarbonylContact O-C 3.58Å; E78-T81 WeakPolarHBondContact O-CB 3.32Å; E78-T81 PolarHBondContact O-N 2.9Å; E78-C82 WeakPolarHBondContact O-CB 3.37Å; E78-C82 PolarHBondContact O-N 3.19Å
79	S	91.5	Very high	90.9	Very high	75 Å²	75	102.2 Å²	102.2	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177.3	-173.2	0	0	0	0	111.8	A75 L76 T81 C82 R83	A75-S79 WeakPolarHBondContact O-CB 3.38Å; A75-S79 PolarHBondContact O-N 3.34Å; L76-S79 PolarHBondContact O-N 3.25Å; S79-T81 VanDerWaalsContact C-N 3.32Å; S79-T81 PolarHBondContact O-N 3.49Å; S79-C82 PolarHBondContact O-N 2.84Å; S79-R83 WeakPolarHBondContact O-CB 3.2Å; S79-R83 PolarHBondContact O-N 2.95Å
80	Q	92.6	Very high	90.5	Very high	100 Å²	100	98.3 Å²	98.3	47%	0.467	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-39.7	172.7	-73.8	175	2.7	0	0	111.8	L76 A77 E78 R83 N84	L76-Q80 WeakPolarHBondContact O-CB 3.38Å; L76-Q80 VanDerWaalsContact O-CG 3.3Å; L76-Q80 WeakPolarHBondContact O-CG 3.37Å; L76-Q80 PolarHBondContact O-N 3.32Å; A77-Q80 PolarHBondContact O-N 3.06Å; E78-Q80 PolarHBondContact O-N 3.07Å; Q80-R83 PolarHBondContact O-N 2.98Å; Q80-N84 WeakPolarHBondContact O-CB 3.33Å; Q80-N84 PolarHBondContact O-N 3Å; Q80-N84 PolarHBondContact O-ND2 3.35Å
81	T	92.7	Very high	90	Very high	66 Å²	66	96.5 Å²	96.5	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-46	174.7	-57	0	0	0	0	111	A77 E78 S79 R83 N84 R85	A77-T81 WeakPolarHBondContact O-CB 3.35Å; A77-T81 PolarHBondContact O-N 3.21Å; A77-T81 PolarHBondContact O-OG1 3.33Å; E78-T81 CarbonylContact O-C 3.58Å; E78-T81 WeakPolarHBondContact O-CB 3.32Å; E78-T81 PolarHBondContact O-N 2.9Å; S79-T81 VanDerWaalsContact C-N 3.32Å; S79-T81 PolarHBondContact O-N 3.49Å; T81-R83 VanDerWaalsContact C-N 3.35Å; T81-R83 PolarHBondContact O-N 3.34Å; T81-N84 PolarHBondContact O-N 3Å; T81-R85 WeakPolarHBondContact O-CB 3.45Å; T81-R85 WeakPolarHBondContact O-CG 3.41Å; T81-R85 PolarHBondContact O-N 2.88Å
82	C	89.9	Confident	89.6	Confident	74 Å²	74	93 Å²	93	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-42.3	174.5	-107	0	0	0	0	111.6	E78 S79 R85 L86	E78-C82 WeakPolarHBondContact O-CB 3.37Å; E78-C82 PolarHBondContact O-N 3.19Å; S79-C82 PolarHBondContact O-N 2.84Å; C82-R85 CarbonylContact O-C 3.59Å; C82-R85 PolarHBondContact O-N 3.48Å; C82-L86 VanDerWaalsContact O-CB 3.32Å; C82-L86 WeakPolarHBondContact O-CB 3.48Å; C82-L86 VanDerWaalsContact O-CG 3.31Å; C82-L86 WeakPolarHBondContact O-CG 3.45Å; C82-L86 PolarHBondContact O-N 3.06Å
83	R	92.8	Very high	88.9	Confident	142 Å²	142	92 Å²	92	54%	0.536	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-46.6	175.1	-172.2	-171.9	72.1	98.6	4.9	111.3	S79 Q80 T81 R85 L86 I87	S79-R83 WeakPolarHBondContact O-CB 3.2Å; S79-R83 PolarHBondContact O-N 2.95Å; Q80-R83 PolarHBondContact O-N 2.98Å; T81-R83 VanDerWaalsContact C-N 3.35Å; T81-R83 PolarHBondContact O-N 3.34Å; R83-R85 VanDerWaalsContact C-N 3.33Å; R83-R85 PolarHBondContact O-N 3.31Å; R83-L86 PolarHBondContact O-N 3.41Å; R83-I87 HydrophobicContact CG-CD1 4.13Å; R83-I87 VanDerWaalsContact O-CG1 3.29Å; R83-I87 WeakPolarHBondContact O-CG1 3.43Å; R83-I87 PolarHBondContact O-N 3.28Å
84	N	91.3	Very high	87.9	Confident	81 Å²	81	90.2 Å²	90.2	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177.5	-69.3	-14	0	0	0	111.2	Q80 T81 I87 Q88	Q80-N84 WeakPolarHBondContact O-CB 3.33Å; Q80-N84 PolarHBondContact O-N 3Å; Q80-N84 PolarHBondContact O-ND2 3.35Å; T81-N84 PolarHBondContact O-N 3Å; N84-I87 PolarHBondContact O-N 2.87Å; N84-Q88 WeakPolarHBondContact O-CB 3.47Å; N84-Q88 PolarHBondContact O-N 3.18Å
85	R	90.3	Very high	87	Confident	161 Å²	161	89.6 Å²	89.6	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-63.5	-41.1	173.3	-76	-179.7	-179.9	177.7	1.7	111.8	T81 C82 R83 Q88 L89	T81-R85 WeakPolarHBondContact O-CB 3.45Å; T81-R85 WeakPolarHBondContact O-CG 3.41Å; T81-R85 PolarHBondContact O-N 2.88Å; C82-R85 CarbonylContact O-C 3.59Å; C82-R85 PolarHBondContact O-N 3.48Å; R83-R85 VanDerWaalsContact C-N 3.33Å; R83-R85 PolarHBondContact O-N 3.31Å; R85-Q88 CarbonylContact O-C 3.36Å; R85-Q88 WeakPolarHBondContact O-CB 3.48Å; R85-Q88 PolarHBondContact O-N 2.89Å; R85-L89 VanDerWaalsContact O-CB 3.23Å; R85-L89 WeakPolarHBondContact O-CB 3.46Å; R85-L89 PolarHBondContact O-N 3.5Å
86	L	89.2	Confident	85.9	Confident	117 Å²	117	91.3 Å²	91.3	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-37.6	176.5	-80.9	165.6	0	0	0	111.8	C82 R83 L89 G90	C82-L86 VanDerWaalsContact O-CB 3.32Å; C82-L86 WeakPolarHBondContact O-CB 3.48Å; C82-L86 VanDerWaalsContact O-CG 3.31Å; C82-L86 WeakPolarHBondContact O-CG 3.45Å; C82-L86 PolarHBondContact O-N 3.06Å; R83-L86 PolarHBondContact O-N 3.41Å; L86-L89 PolarHBondContact O-N 3.48Å; L86-G90 PolarHBondContact O-N 3.38Å
87	I	89.6	Confident	84.6	Confident	97 Å²	97	91.4 Å²	91.4	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-43.6	172.7	-67.7	165.2	0	0	0	110	R83 N84 G90 S91	R83-I87 HydrophobicContact CG-CD1 4.13Å; R83-I87 VanDerWaalsContact O-CG1 3.29Å; R83-I87 WeakPolarHBondContact O-CG1 3.43Å; R83-I87 PolarHBondContact O-N 3.28Å; N84-I87 PolarHBondContact O-N 2.87Å; I87-G90 PolarHBondContact O-N 2.85Å; I87-S91 WeakPolarHBondContact O-CB 3.35Å; I87-S91 PolarHBondContact O-N 3.46Å; I87-S91 PolarHBondContact O-OG 2.99Å
88	Q	86.9	Confident	83.5	Confident	128 Å²	128	90.8 Å²	90.8	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-60	-47.5	173	-84.2	-178.1	-21	0	0	111.4	N84 R85 G90 S91 S92	N84-Q88 WeakPolarHBondContact O-CB 3.47Å; N84-Q88 PolarHBondContact O-N 3.18Å; R85-Q88 CarbonylContact O-C 3.36Å; R85-Q88 WeakPolarHBondContact O-CB 3.48Å; R85-Q88 PolarHBondContact O-N 2.89Å; Q88-G90 VanDerWaalsContact C-N 3.33Å; Q88-G90 PolarHBondContact O-N 3.47Å; Q88-S91 WeakPolarHBondContact CA-OG 3.41Å; Q88-S91 CarbonylContact O-C 3.56Å; Q88-S91 PolarHBondContact O-N 3.36Å; Q88-S91 VanDerWaalsContact O-N 3.11Å; Q88-S91 PolarHBondContact O-OG 2.93Å; Q88-S92 WeakPolarHBondContact O-CB 3.36Å; Q88-S92 PolarHBondContact O-N 3Å; Q88-S92 PolarHBondContact O-OG 3.22Å; Q88-S92 VanDerWaalsContact O-OG 3.05Å
89	L	84.2	Confident	82.4	Confident	97 Å²	97	87.7 Å²	87.7	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-40.7	179.1	-146	160.2	0	0	0	110.4	R85 L86 S92 L93	R85-L89 VanDerWaalsContact O-CB 3.23Å; R85-L89 WeakPolarHBondContact O-CB 3.46Å; R85-L89 PolarHBondContact O-N 3.5Å; L86-L89 PolarHBondContact O-N 3.48Å; L89-S92 PolarHBondContact O-N 3.49Å; L89-L93 HydrophobicContact CD2-CD1 3.34Å; L89-L93 HydrophobicContact CD2-CG 3.78Å; L89-L93 VanDerWaalsContact O-CB 3.25Å; L89-L93 WeakPolarHBondContact O-CB 3.36Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.22Å; L89-L93 PolarHBondContact O-N 3.05Å
90	G	82.7	Confident	81.3	Confident	39 Å²	39	89 Å²	89	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-42.3	171.8	0	0	0	0	0	112.4	L86 I87 Q88 L93 S94	L86-G90 PolarHBondContact O-N 3.38Å; I87-G90 PolarHBondContact O-N 2.85Å; Q88-G90 VanDerWaalsContact C-N 3.33Å; Q88-G90 PolarHBondContact O-N 3.47Å; G90-L93 PolarHBondContact O-N 3.43Å; G90-S94 WeakPolarHBondContact O-CB 3.4Å; G90-S94 PolarHBondContact O-N 2.81Å; G90-S94 PolarHBondContact O-OG 2.81Å
91	S	81	Confident	80.2	Confident	66 Å²	66	92 Å²	92	46%	0.462	53%	0.53	S	S	.	.	H	α-helix	trans	-66.8	-41.9	175.2	71.5	0	0	0	0	112	I87 Q88 S94 G95	I87-S91 WeakPolarHBondContact O-CB 3.35Å; I87-S91 PolarHBondContact O-N 3.46Å; I87-S91 PolarHBondContact O-OG 2.99Å; Q88-S91 WeakPolarHBondContact CA-OG 3.41Å; Q88-S91 CarbonylContact O-C 3.56Å; Q88-S91 PolarHBondContact O-N 3.36Å; Q88-S91 VanDerWaalsContact O-N 3.11Å; Q88-S91 PolarHBondContact O-OG 2.93Å; S91-S94 WeakPolarHBondContact CA-OG 3.4Å; S91-S94 PolarHBondContact O-N 3.43Å; S91-S94 PolarHBondContact O-OG 3.47Å; S91-G95 PolarHBondContact O-N 2.86Å
92	S	80.8	Confident	79.1	Confident	75 Å²	75	96 Å²	96	52%	0.524	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-44.7	174.7	-58.5	0	0	0	0	111.5	Q88 L89 S94 G95 L96	Q88-S92 WeakPolarHBondContact O-CB 3.36Å; Q88-S92 PolarHBondContact O-N 3Å; Q88-S92 PolarHBondContact O-OG 3.22Å; Q88-S92 VanDerWaalsContact O-OG 3.05Å; L89-S92 PolarHBondContact O-N 3.49Å; S92-S94 VanDerWaalsContact C-N 3.32Å; S92-S94 PolarHBondContact O-N 2.96Å; S92-G95 CarbonylContact O-C 3.58Å; S92-G95 WeakPolarHBondContact O-CA 3.35Å; S92-G95 PolarHBondContact O-N 3.42Å; S92-G95 VanDerWaalsContact O-N 3.1Å; S92-L96 WeakPolarHBondContact O-CG 3.1Å; S92-L96 PolarHBondContact O-N 3.48Å
93	L	75.9	Confident	78.3	Confident	100 Å²	100	96 Å²	96	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-63.8	-36.5	175	-77.1	168.9	0	0	0	112.1	L89 G90 G95 L96 S97	L89-L93 HydrophobicContact CD2-CD1 3.34Å; L89-L93 HydrophobicContact CD2-CG 3.78Å; L89-L93 VanDerWaalsContact O-CB 3.25Å; L89-L93 WeakPolarHBondContact O-CB 3.36Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.22Å; L89-L93 PolarHBondContact O-N 3.05Å; G90-L93 PolarHBondContact O-N 3.43Å; L93-G95 VanDerWaalsContact C-N 3.28Å; L93-G95 PolarHBondContact O-N 3.41Å; L93-L96 HydrophobicContact CD2-CD1 4.15Å; L93-L96 CarbonylContact O-C 3.15Å; L93-L96 WeakPolarHBondContact O-CA 3.32Å; L93-L96 WeakPolarHBondContact O-CB 3.26Å; L93-L96 PolarHBondContact O-N 2.92Å; L93-S97 PolarHBondContact O-N 3.21Å
94	S	73.1	Confident	77.4	Confident	76 Å²	76	94 Å²	94	53%	0.531	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-33.5	173.2	72.6	0	0	0	0	111.8	G90 S91 S92 L96 S97	G90-S94 WeakPolarHBondContact O-CB 3.4Å; G90-S94 PolarHBondContact O-N 2.81Å; G90-S94 PolarHBondContact O-OG 2.81Å; S91-S94 WeakPolarHBondContact CA-OG 3.4Å; S91-S94 PolarHBondContact O-N 3.43Å; S91-S94 PolarHBondContact O-OG 3.47Å; S92-S94 VanDerWaalsContact C-N 3.32Å; S92-S94 PolarHBondContact O-N 2.96Å; S94-L96 PolarHBondContact O-N 3.37Å; S94-S97 WeakPolarHBondContact O-CB 3.5Å; S94-S97 PolarHBondContact O-N 2.76Å; S94-S97 VanDerWaalsContact O-N 3.12Å; S94-S97 PolarHBondContact O-OG 3.14Å
95	G	72.5	Confident	76.6	Confident	65 Å²	65	97.6 Å²	97.6	67%	0.67	55%	0.549	S	S	*	.	H	α-helix	trans	-68.4	-22.1	169.1	0	0	0	0	0	113.9	S91 S92 L93 S97	S91-G95 PolarHBondContact O-N 2.86Å; S92-G95 CarbonylContact O-C 3.58Å; S92-G95 WeakPolarHBondContact O-CA 3.35Å; S92-G95 PolarHBondContact O-N 3.42Å; S92-G95 VanDerWaalsContact O-N 3.1Å; L93-G95 VanDerWaalsContact C-N 3.28Å; L93-G95 PolarHBondContact O-N 3.41Å; G95-S97 VanDerWaalsContact C-N 3.32Å
96	L	68.7	Low	75.8	Confident	85 Å²	85	95.4 Å²	95.4	45%	0.445	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.5	172.1	-58.8	167.4	0	0	0	112.4	S92 L93 S94 G98 L99	S92-L96 WeakPolarHBondContact O-CG 3.1Å; S92-L96 PolarHBondContact O-N 3.48Å; L93-L96 HydrophobicContact CD2-CD1 4.15Å; L93-L96 CarbonylContact O-C 3.15Å; L93-L96 WeakPolarHBondContact O-CA 3.32Å; L93-L96 WeakPolarHBondContact O-CB 3.26Å; L93-L96 PolarHBondContact O-N 2.92Å; S94-L96 PolarHBondContact O-N 3.37Å; L96-G98 PolarHBondContact O-N 3.05Å; L96-L99 HydrophobicContact CB-CB 4.2Å; L96-L99 HydrophobicContact CD2-CB 4.42Å; L96-L99 HydrophobicContact CD2-CD1 3.98Å; L96-L99 HydrophobicContact CD2-CD2 3.97Å; L96-L99 HydrophobicContact CD2-CG 4.35Å; L96-L99 WeakPolarHBondContact O-CB 3.19Å; L96-L99 PolarHBondContact O-N 2.88Å
97	S	66.6	Low	75.2	Confident	97 Å²	97	96.3 Å²	96.3	68%	0.678	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	126.6	173.1	62.3	0	0	0	0	109.4	L93 S94 G95 L99	L93-S97 PolarHBondContact O-N 3.21Å; S94-S97 WeakPolarHBondContact O-CB 3.5Å; S94-S97 PolarHBondContact O-N 2.76Å; S94-S97 VanDerWaalsContact O-N 3.12Å; S94-S97 PolarHBondContact O-OG 3.14Å; G95-S97 VanDerWaalsContact C-N 3.32Å; S97-L99 VanDerWaalsContact C-N 3.34Å; S97-L99 PolarHBondContact O-N 3.16Å
98	G	69.5	Low	74.5	Confident	37 Å²	37	94.9 Å²	94.9	38%	0.381	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-14.3	-171.9	0	0	0	0	0	115.6	L96 S100 Q101 Q102	L96-G98 PolarHBondContact O-N 3.05Å; G98-S100 VanDerWaalsContact C-N 3.28Å; G98-S100 PolarHBondContact O-N 3.43Å; G98-Q101 WeakPolarHBondContact O-CA 3.36Å; G98-Q101 VanDerWaalsContact O-CB 3.26Å; G98-Q101 WeakPolarHBondContact O-CB 3.47Å; G98-Q101 PolarHBondContact O-N 3.43Å; G98-Q102 PolarHBondContact O-N 3.36Å
99	L	69.6	Low	73.9	Confident	64 Å²	64	93.3 Å²	93.3	34%	0.335	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-34.6	177.8	-160.3	107.5	0	0	0	111.8	L96 S97 Q101 Q102 L103	L96-L99 HydrophobicContact CB-CB 4.2Å; L96-L99 HydrophobicContact CD2-CB 4.42Å; L96-L99 HydrophobicContact CD2-CD1 3.98Å; L96-L99 HydrophobicContact CD2-CD2 3.97Å; L96-L99 HydrophobicContact CD2-CG 4.35Å; L96-L99 WeakPolarHBondContact O-CB 3.19Å; L96-L99 PolarHBondContact O-N 2.88Å; S97-L99 VanDerWaalsContact C-N 3.34Å; S97-L99 PolarHBondContact O-N 3.16Å; L99-Q101 PolarHBondContact O-N 3.3Å; L99-Q102 PolarHBondContact O-N 3.34Å; L99-L103 HydrophobicContact CD2-CD1 3.39Å; L99-L103 HydrophobicContact CD2-CG 4.08Å; L99-L103 HydrophobicContact CG-CD1 4.01Å; L99-L103 HydrophobicContact CG-CG 4.14Å; L99-L103 VanDerWaalsContact O-CB 3.25Å; L99-L103 WeakPolarHBondContact O-CB 3.35Å; L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 3.21Å
100	S	68.5	Low	73.4	Confident	102 Å²	102	91.8 Å²	91.8	71%	0.713	53%	0.534	S	S	*	.	H	α-helix	trans	-59.1	-29	171	-179.9	0	0	0	0	112.7	G98 H104	G98-S100 VanDerWaalsContact C-N 3.28Å; G98-S100 PolarHBondContact O-N 3.43Å; S100-H104 PolarHBondContact O-N 3.47Å
101	Q	67.7	Low	73	Confident	162 Å²	162	92.9 Å²	92.9	76%	0.757	53%	0.533	S	S	*	.	H	α-helix	trans	-85.1	-40.5	-179.2	-144.7	155.9	2.8	0	0	110.2	G98 L99 H104	G98-Q101 WeakPolarHBondContact O-CA 3.36Å; G98-Q101 VanDerWaalsContact O-CB 3.26Å; G98-Q101 WeakPolarHBondContact O-CB 3.47Å; G98-Q101 PolarHBondContact O-N 3.43Å; L99-Q101 PolarHBondContact O-N 3.3Å; Q101-H104 VanDerWaalsContact O-CB 3.22Å; Q101-H104 WeakPolarHBondContact O-CB 3.45Å; Q101-H104 PolarHBondContact O-N 2.85Å
102	Q	71.4	Confident	72.5	Confident	150 Å²	150	96.5 Å²	96.5	70%	0.701	54%	0.54	S	S	*	.	H	α-helix	trans	-65	-42.3	172.8	-67.9	178	-9.6	0	0	112.4	G98 L99 H104	G98-Q102 PolarHBondContact O-N 3.36Å; L99-Q102 PolarHBondContact O-N 3.34Å; Q102-H104 PolarHBondContact O-N 2.83Å
103	L	72.5	Confident	72	Confident	76 Å²	76	100.5 Å²	100.5	40%	0.398	55%	0.545	S	S	.	.	H	α-helix	trans	-80.7	0.7	175.1	-66.8	-178.9	0	0	0	112.6	L99 E105 L106 K107	L99-L103 HydrophobicContact CD2-CD1 3.39Å; L99-L103 HydrophobicContact CD2-CG 4.08Å; L99-L103 HydrophobicContact CG-CD1 4.01Å; L99-L103 HydrophobicContact CG-CG 4.14Å; L99-L103 VanDerWaalsContact O-CB 3.25Å; L99-L103 WeakPolarHBondContact O-CB 3.35Å; L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 3.21Å; L103-E105 VanDerWaalsContact C-N 3.28Å; L103-E105 PolarHBondContact O-N 2.75Å; L103-L106 HydrophobicContact CD2-CB 4.05Å; L103-L106 HydrophobicContact CD2-CD2 4.03Å; L103-L106 CarbonylContact O-C 3.4Å; L103-L106 PolarHBondContact O-N 2.86Å; L103-K107 WeakPolarHBondContact O-CB 3.29Å; L103-K107 PolarHBondContact O-N 3.4Å
104	H	72.9	Confident	71.7	Confident	98 Å²	98	99.4 Å²	99.4	45%	0.454	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-41.3	178.5	-169.4	58.3	0	0	0	110.8	S100 Q101 Q102 K107 N108	S100-H104 PolarHBondContact O-N 3.47Å; Q101-H104 VanDerWaalsContact O-CB 3.22Å; Q101-H104 WeakPolarHBondContact O-CB 3.45Å; Q101-H104 PolarHBondContact O-N 2.85Å; Q102-H104 PolarHBondContact O-N 2.83Å; H104-K107 PolarHBondContact O-N 2.83Å; H104-N108 PolarHBondContact CD2-ND2 3.07Å; H104-N108 PolarHBondContact NE2-ND2 3.05Å; H104-N108 WeakPolarHBondContact O-CB 3.47Å; H104-N108 PolarHBondContact O-N 2.85Å; H104-N108 PolarHBondContact O-ND2 3.14Å
105	E	75.5	Confident	71.4	Confident	158 Å²	158	101.8 Å²	101.8	74%	0.738	55%	0.549	S	S	*	.	H	α-helix	trans	-63.1	-46.6	172	-77.1	-168.9	164.2	0	0	111.8	L103 K107 N108 L109	L103-E105 VanDerWaalsContact C-N 3.28Å; L103-E105 PolarHBondContact O-N 2.75Å; E105-K107 VanDerWaalsContact C-N 3.29Å; E105-K107 PolarHBondContact O-N 3.02Å; E105-N108 PolarHBondContact O-N 2.78Å; E105-L109 WeakPolarHBondContact O-CB 3.3Å; E105-L109 PolarHBondContact O-N 3.3Å
106	L	74.1	Confident	71	Confident	114 Å²	114	103.7 Å²	103.7	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-64.1	-35.3	179	-156.8	103.7	0	0	0	112.1	L103 L109 S110	L103-L106 HydrophobicContact CD2-CB 4.05Å; L103-L106 HydrophobicContact CD2-CD2 4.03Å; L103-L106 CarbonylContact O-C 3.4Å; L103-L106 PolarHBondContact O-N 2.86Å; L106-L109 PolarHBondContact O-N 2.78Å; L106-S110 WeakPolarHBondContact O-CB 3.25Å; L106-S110 PolarHBondContact O-N 3.17Å
107	K	74.6	Confident	71	Confident	136 Å²	136	101.3 Å²	101.3	59%	0.591	54%	0.538	S	S	*	.	H	α-helix	trans	-67.1	-45.8	174.6	-176.8	178.9	179.6	179.2	0	110.2	L103 H104 E105 L109 S110 T111	L103-K107 WeakPolarHBondContact O-CB 3.29Å; L103-K107 PolarHBondContact O-N 3.4Å; H104-K107 PolarHBondContact O-N 2.83Å; E105-K107 VanDerWaalsContact C-N 3.29Å; E105-K107 PolarHBondContact O-N 3.02Å; K107-L109 VanDerWaalsContact C-N 3.33Å; K107-L109 PolarHBondContact O-N 3.39Å; K107-S110 PolarHBondContact O-N 3.25Å; K107-T111 WeakPolarHBondContact O-CG2 3.43Å; K107-T111 PolarHBondContact O-N 3.42Å; K107-T111 PolarHBondContact O-OG1 3.14Å
108	N	74.8	Confident	71.2	Confident	67 Å²	67	98.1 Å²	98.1	36%	0.358	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-41.1	175.8	-72.5	-16.2	0	0	0	111.3	H104 E105 T111 K112	H104-N108 PolarHBondContact CD2-ND2 3.07Å; H104-N108 PolarHBondContact NE2-ND2 3.05Å; H104-N108 WeakPolarHBondContact O-CB 3.47Å; H104-N108 PolarHBondContact O-N 2.85Å; H104-N108 PolarHBondContact O-ND2 3.14Å; E105-N108 PolarHBondContact O-N 2.78Å; N108-T111 VanDerWaalsContact C-OG1 3.3Å; N108-T111 VanDerWaalsContact CA-OG1 3.27Å; N108-T111 WeakPolarHBondContact CA-OG1 3.4Å; N108-T111 PolarHBondContact O-N 3.17Å; N108-T111 PolarHBondContact O-OG1 2.81Å; N108-K112 WeakPolarHBondContact O-CG 3.26Å; N108-K112 PolarHBondContact O-N 3.37Å
109	L	74.2	Confident	71	Confident	96 Å²	96	98.7 Å²	98.7	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-46.8	175.9	-147.5	110.2	0	0	0	110.4	E105 L106 K107 T111 K112 Y113	E105-L109 WeakPolarHBondContact O-CB 3.3Å; E105-L109 PolarHBondContact O-N 3.3Å; L106-L109 PolarHBondContact O-N 2.78Å; K107-L109 VanDerWaalsContact C-N 3.33Å; K107-L109 PolarHBondContact O-N 3.39Å; L109-T111 VanDerWaalsContact C-N 3.33Å; L109-T111 PolarHBondContact O-N 3.39Å; L109-K112 CarbonylContact O-C 3.55Å; L109-K112 WeakPolarHBondContact O-CB 3.44Å; L109-K112 PolarHBondContact O-N 3.04Å; L109-K112 VanDerWaalsContact O-N 3.14Å; L109-Y113 HydrophobicContact CD2-CD2 3.75Å; L109-Y113 HydrophobicContact CD2-CE2 3.5Å; L109-Y113 HydrophobicContact CG-CD2 4Å; L109-Y113 HydrophobicContact CG-CE2 3.96Å; L109-Y113 WeakPolarHBondContact O-CB 3.17Å; L109-Y113 WeakPolarHBondContact O-CD2 3.35Å; L109-Y113 PolarHBondContact O-N 2.84Å
110	S	74.7	Confident	70.9	Confident	65 Å²	65	101.9 Å²	101.9	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-59.2	-42.4	175.2	179.4	0	0	0	0	111.3	L106 K107 Y113 S114	L106-S110 WeakPolarHBondContact O-CB 3.25Å; L106-S110 PolarHBondContact O-N 3.17Å; K107-S110 PolarHBondContact O-N 3.25Å; S110-Y113 PolarHBondContact O-N 2.99Å; S110-S114 VanDerWaalsContact O-CB 3.3Å; S110-S114 WeakPolarHBondContact O-CB 3.19Å; S110-S114 PolarHBondContact O-N 3.41Å; S110-S114 PolarHBondContact O-OG 3.48Å
111	T	75.1	Confident	71	Confident	62 Å²	62	102.9 Å²	102.9	38%	0.38	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-39.4	175.2	45.2	0	0	0	0	111.9	K107 N108 L109 S114 Q115	K107-T111 WeakPolarHBondContact O-CG2 3.43Å; K107-T111 PolarHBondContact O-N 3.42Å; K107-T111 PolarHBondContact O-OG1 3.14Å; N108-T111 VanDerWaalsContact C-OG1 3.3Å; N108-T111 VanDerWaalsContact CA-OG1 3.27Å; N108-T111 WeakPolarHBondContact CA-OG1 3.4Å; N108-T111 PolarHBondContact O-N 3.17Å; N108-T111 PolarHBondContact O-OG1 2.81Å; L109-T111 VanDerWaalsContact C-N 3.33Å; L109-T111 PolarHBondContact O-N 3.39Å; T111-S114 PolarHBondContact O-N 3.02Å; T111-Q115 WeakPolarHBondContact O-CB 3.33Å; T111-Q115 VanDerWaalsContact O-CG 3.22Å; T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.06Å
112	K	69.6	Low	71.1	Confident	141 Å²	141	96.1 Å²	96.1	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-44.7	174.6	-77.1	178.7	179.8	-178.3	0	111.4	N108 L109 Q115 L116	N108-K112 WeakPolarHBondContact O-CG 3.26Å; N108-K112 PolarHBondContact O-N 3.37Å; L109-K112 CarbonylContact O-C 3.55Å; L109-K112 WeakPolarHBondContact O-CB 3.44Å; L109-K112 PolarHBondContact O-N 3.04Å; L109-K112 VanDerWaalsContact O-N 3.14Å; K112-Q115 PolarHBondContact O-N 3.48Å; K112-L116 WeakPolarHBondContact O-CB 3.33Å; K112-L116 PolarHBondContact O-N 2.94Å
113	Y	69.8	Low	71.2	Confident	160 Å²	160	94.7 Å²	94.7	63%	0.627	49%	0.492	S	S	*	.	H	α-helix	trans	-66.7	-36.9	176.3	-90.4	-82.5	0	0	0	112.2	L109 S110 L116 G117	L109-Y113 HydrophobicContact CD2-CD2 3.75Å; L109-Y113 HydrophobicContact CD2-CE2 3.5Å; L109-Y113 HydrophobicContact CG-CD2 4Å; L109-Y113 HydrophobicContact CG-CE2 3.96Å; L109-Y113 WeakPolarHBondContact O-CB 3.17Å; L109-Y113 WeakPolarHBondContact O-CD2 3.35Å; L109-Y113 PolarHBondContact O-N 2.84Å; S110-Y113 PolarHBondContact O-N 2.99Å; Y113-L116 PolarHBondContact O-N 3.15Å; Y113-G117 WeakPolarHBondContact O-CA 3.43Å; Y113-G117 PolarHBondContact O-N 3.14Å
114	S	69.6	Low	71.3	Confident	77 Å²	77	94 Å²	94	54%	0.538	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-41.8	173	-66.5	0	0	0	0	111.7	S110 T111 A118	S110-S114 VanDerWaalsContact O-CB 3.3Å; S110-S114 WeakPolarHBondContact O-CB 3.19Å; S110-S114 PolarHBondContact O-N 3.41Å; S110-S114 PolarHBondContact O-OG 3.48Å; T111-S114 PolarHBondContact O-N 3.02Å; S114-A118 WeakPolarHBondContact O-CB 3.35Å; S114-A118 PolarHBondContact O-N 3.5Å
115	Q	68.2	Low	71.4	Confident	126 Å²	126	94.6 Å²	94.6	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-63.9	-42.5	173.4	-76.1	171.6	-10.6	0	0	111.8	T111 K112 A118 A119	T111-Q115 WeakPolarHBondContact O-CB 3.33Å; T111-Q115 VanDerWaalsContact O-CG 3.22Å; T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.06Å; K112-Q115 PolarHBondContact O-N 3.48Å; Q115-A118 PolarHBondContact O-N 2.91Å; Q115-A119 VanDerWaalsContact O-CB 3.31Å; Q115-A119 WeakPolarHBondContact O-CB 3.3Å; Q115-A119 PolarHBondContact O-N 2.91Å
116	L	63.1	Low	71.5	Confident	105 Å²	105	89.3 Å²	89.3	55%	0.55	47%	0.468	S	S	.	.	H	α-helix	trans	-71.4	-35.7	179.9	-156.4	139.5	0	0	0	111.4	K112 Y113 A119 M120	K112-L116 WeakPolarHBondContact O-CB 3.33Å; K112-L116 PolarHBondContact O-N 2.94Å; Y113-L116 PolarHBondContact O-N 3.15Å; L116-A119 PolarHBondContact O-N 3.3Å; L116-M120 HydrophobicContact CD2-CG 4.31Å; L116-M120 HydrophobicContact CD2-SD 3.98Å; L116-M120 WeakPolarHBondContact O-CB 3.31Å; L116-M120 WeakPolarHBondContact O-CG 3.45Å; L116-M120 PolarHBondContact O-N 3.32Å
117	G	69.8	Low	71.8	Confident	34 Å²	34	89.1 Å²	89.1	35%	0.351	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-48.2	171.2	0	0	0	0	0	112	Y113 A119 M120 E121	Y113-G117 WeakPolarHBondContact O-CA 3.43Å; Y113-G117 PolarHBondContact O-N 3.14Å; G117-A119 VanDerWaalsContact C-N 3.33Å; G117-A119 PolarHBondContact O-N 2.95Å; G117-M120 PolarHBondContact O-N 3.04Å; G117-E121 WeakPolarHBondContact O-CB 3.5Å; G117-E121 PolarHBondContact O-N 3.24Å
118	A	68.8	Low	72.3	Confident	30 Å²	30	88.8 Å²	88.8	25%	0.248	47%	0.47	C	S	.	.	H	α-helix	trans	-59.8	-43.2	173.5	0	0	0	0	0	111.5	S114 Q115 M120 E121 N122	S114-A118 WeakPolarHBondContact O-CB 3.35Å; S114-A118 PolarHBondContact O-N 3.5Å; Q115-A118 PolarHBondContact O-N 2.91Å; A118-M120 PolarHBondContact O-N 3.32Å; A118-E121 PolarHBondContact O-N 3.45Å; A118-N122 VanDerWaalsContact O-CB 3.25Å; A118-N122 WeakPolarHBondContact O-CB 3.32Å; A118-N122 PolarHBondContact O-N 3.43Å; A118-N122 PolarHBondContact O-ND2 3.27Å; A118-N122 VanDerWaalsContact O-ND2 3.14Å
119	A	66.2	Low	72.8	Confident	50 Å²	50	85.7 Å²	85.7	41%	0.413	45%	0.454	S	S	.	.	H	α-helix	trans	-62.8	-41.3	176.1	0	0	0	0	0	112.7	Q115 L116 G117 M123	Q115-A119 VanDerWaalsContact O-CB 3.31Å; Q115-A119 WeakPolarHBondContact O-CB 3.3Å; Q115-A119 PolarHBondContact O-N 2.91Å; L116-A119 PolarHBondContact O-N 3.3Å; G117-A119 VanDerWaalsContact C-N 3.33Å; G117-A119 PolarHBondContact O-N 2.95Å; A119-M123 WeakPolarHBondContact O-CB 3.45Å; A119-M123 PolarHBondContact O-N 3.18Å
120	M	67	Low	73.3	Confident	130 Å²	130	84.4 Å²	84.4	64%	0.64	45%	0.451	S	S	*	.	H	α-helix	trans	-65.9	-42.4	176.3	-78	-176.3	65.9	0	0	112.3	L116 G117 A118 M123 S124	L116-M120 HydrophobicContact CD2-CG 4.31Å; L116-M120 HydrophobicContact CD2-SD 3.98Å; L116-M120 WeakPolarHBondContact O-CB 3.31Å; L116-M120 WeakPolarHBondContact O-CG 3.45Å; L116-M120 PolarHBondContact O-N 3.32Å; G117-M120 PolarHBondContact O-N 3.04Å; A118-M120 PolarHBondContact O-N 3.32Å; M120-M123 PolarHBondContact O-N 2.77Å; M120-S124 PolarHBondContact O-N 3.03Å
121	E	70.7	Confident	74	Confident	123 Å²	123	87.7 Å²	87.7	58%	0.575	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-50.3	176.6	-169.7	169.7	-170.2	0	0	110.2	G117 A118 M123 S124 Y125	G117-E121 WeakPolarHBondContact O-CB 3.5Å; G117-E121 PolarHBondContact O-N 3.24Å; A118-E121 PolarHBondContact O-N 3.45Å; E121-M123 VanDerWaalsContact C-N 3.31Å; E121-M123 PolarHBondContact O-N 2.77Å; E121-S124 WeakPolarHBondContact O-CB 3.32Å; E121-S124 PolarHBondContact O-N 3.22Å; E121-S124 VanDerWaalsContact O-N 3.13Å; E121-S124 PolarHBondContact O-OG 3.46Å; E121-Y125 HydrophobicContact CG-CE2 4.09Å; E121-Y125 WeakPolarHBondContact O-CD2 3.3Å
122	N	71.2	Confident	74.7	Confident	21 Å²	21	86.1 Å²	86.1	11%	0.112	45%	0.45	C	S	.	.	H	α-helix	trans	-58.7	-38.7	175.2	-71.5	-25.5	0	0	0	112.7	A118 S124 Y125 L126 L162	A118-N122 VanDerWaalsContact O-CB 3.25Å; A118-N122 WeakPolarHBondContact O-CB 3.32Å; A118-N122 PolarHBondContact O-N 3.43Å; A118-N122 PolarHBondContact O-ND2 3.27Å; A118-N122 VanDerWaalsContact O-ND2 3.14Å; N122-S124 VanDerWaalsContact C-N 3.32Å; N122-S124 PolarHBondContact O-N 3.5Å; N122-Y125 PolarHBondContact O-N 3.01Å; N122-L126 WeakPolarHBondContact O-CG 3.43Å; N122-L126 PolarHBondContact O-N 3.42Å; N122-L162 HydrophobicContact CB-CD2 3.83Å; N122-L162 VanDerWaalsContact ND2-CD2 3.29Å; N122-L162 WeakPolarHBondContact ND2-CD2 3.32Å
123	M	72.2	Confident	75.8	Confident	120 Å²	120	80 Å²	80	59%	0.591	42%	0.423	S	S	*	.	H	α-helix	trans	-62.8	-37.8	177.7	-172.7	176.2	-69.6	0	0	112	A119 M120 E121 Y125 L126 V127	A119-M123 WeakPolarHBondContact O-CB 3.45Å; A119-M123 PolarHBondContact O-N 3.18Å; M120-M123 PolarHBondContact O-N 2.77Å; E121-M123 VanDerWaalsContact C-N 3.31Å; E121-M123 PolarHBondContact O-N 2.77Å; M123-Y125 PolarHBondContact O-N 3.43Å; M123-L126 PolarHBondContact O-N 2.82Å; M123-V127 HydrophobicContact CG-CG2 4.5Å; M123-V127 VanDerWaalsContact O-CG2 3.31Å; M123-V127 WeakPolarHBondContact O-CG2 3.22Å; M123-V127 PolarHBondContact O-N 3.04Å
124	S	75.4	Confident	76.8	Confident	60 Å²	60	77 Å²	77	42%	0.42	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-32.1	177.5	79.8	0	0	0	0	113	M120 E121 N122	M120-S124 PolarHBondContact O-N 3.03Å; E121-S124 WeakPolarHBondContact O-CB 3.32Å; E121-S124 PolarHBondContact O-N 3.22Å; E121-S124 VanDerWaalsContact O-N 3.13Å; E121-S124 PolarHBondContact O-OG 3.46Å; N122-S124 VanDerWaalsContact C-N 3.32Å; N122-S124 PolarHBondContact O-N 3.5Å
125	Y	74.4	Confident	78	Confident	111 Å²	111	77.8 Å²	77.8	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-78.3	-43.8	174.9	-71.4	-72	0	0	0	112.1	E121 N122 M123 V127 K128 A129 I158	E121-Y125 HydrophobicContact CG-CE2 4.09Å; E121-Y125 WeakPolarHBondContact O-CD2 3.3Å; N122-Y125 PolarHBondContact O-N 3.01Å; M123-Y125 PolarHBondContact O-N 3.43Å; Y125-V127 VanDerWaalsContact C-N 3.27Å; Y125-V127 PolarHBondContact O-N 3.15Å; Y125-K128 PolarHBondContact O-N 2.92Å; Y125-A129 PolarHBondContact O-N 3.4Å; Y125-I158 HydrophobicContact CD1-CD1 3.67Å; Y125-I158 HydrophobicContact CD1-CG1 4.27Å; Y125-I158 HydrophobicContact CG-CD1 3.84Å; Y125-I158 HydrophobicContact CG-CG1 4.12Å
126	L	77.5	Confident	79.1	Confident	47 Å²	47	71.8 Å²	71.8	25%	0.246	38%	0.382	C	S	.	.	H	α-helix	trans	-59.6	-36.9	178.3	-71.4	171.8	0	0	0	112.2	N122 M123 K128 A129 L162 F181 F182	N122-L126 WeakPolarHBondContact O-CG 3.43Å; N122-L126 PolarHBondContact O-N 3.42Å; M123-L126 PolarHBondContact O-N 2.82Å; L126-K128 VanDerWaalsContact C-N 3.3Å; L126-K128 PolarHBondContact O-N 2.88Å; L126-A129 WeakPolarHBondContact O-CB 3.3Å; L126-A129 PolarHBondContact O-N 3.48Å; L126-L162 HydrophobicContact CD1-CD1 4.06Å; L126-L162 HydrophobicContact CD2-CD1 3.8Å; L126-L162 HydrophobicContact CG-CD1 4.1Å; L126-F181 HydrophobicContact CB-CZ 4.45Å; L126-F181 HydrophobicContact CD2-CD1 3.96Å; L126-F181 HydrophobicContact CD2-CE1 3.47Å; L126-F181 VanDerWaalsContact CD2-CE1 3.47Å; L126-F181 HydrophobicContact CD2-CZ 4.06Å; L126-F181 WeakPolarHBondContact O-CZ 3.33Å; L126-F182 HydrophobicContact CD2-CE2 3.93Å; L126-F182 HydrophobicContact CD2-CZ 3.63Å
127	V	81.6	Confident	80.6	Confident	110 Å²	110	69.7 Å²	69.7	67%	0.667	37%	0.367	S	S	*	.	H	α-helix	trans	-65	-33.6	176.5	171.8	0	0	0	0	112.2	M123 Y125	M123-V127 HydrophobicContact CG-CG2 4.5Å; M123-V127 VanDerWaalsContact O-CG2 3.31Å; M123-V127 WeakPolarHBondContact O-CG2 3.22Å; M123-V127 PolarHBondContact O-N 3.04Å; Y125-V127 VanDerWaalsContact C-N 3.27Å; Y125-V127 PolarHBondContact O-N 3.15Å
128	K	83.3	Confident	81.8	Confident	130 Å²	130	71.9 Å²	71.9	57%	0.565	37%	0.374	S	S	*	.	H	α-helix	trans	-87.3	-10.3	179.1	-66.8	179.5	-179.1	176.7	0	113.6	Y125 L126 E131 T132	Y125-K128 PolarHBondContact O-N 2.92Å; L126-K128 VanDerWaalsContact C-N 3.3Å; L126-K128 PolarHBondContact O-N 2.88Å; K128-E131 PolarHBondContact O-N 3.31Å; K128-T132 WeakPolarHBondContact O-CB 3.27Å; K128-T132 PolarHBondContact O-N 3.4Å; K128-T132 PolarHBondContact O-OG1 3.22Å
129	A	85.5	Confident	83	Confident	2 Å²	2	74.6 Å²	74.6	2%	0.017	38%	0.378	C	S	.	.	H	α-helix	trans	-58.5	-44.2	-174.5	0	0	0	0	0	113.3	Y125 L126 E131 T132 F133 L155 F181	Y125-A129 PolarHBondContact O-N 3.4Å; L126-A129 WeakPolarHBondContact O-CB 3.3Å; L126-A129 PolarHBondContact O-N 3.48Å; A129-E131 PolarHBondContact O-N 3.3Å; A129-T132 WeakPolarHBondContact O-CB 3.42Å; A129-T132 PolarHBondContact O-N 2.92Å; A129-T132 VanDerWaalsContact O-N 3.14Å; A129-F133 HydrophobicContact CB-CE2 4.07Å; A129-F133 HydrophobicContact CB-CZ 4.31Å; A129-F133 WeakPolarHBondContact O-CD2 3.4Å; A129-F133 WeakPolarHBondContact O-CG 3.21Å; A129-F133 PolarHBondContact O-N 2.89Å; A129-L155 HydrophobicContact CB-CD2 3.86Å; A129-F181 HydrophobicContact CB-CE1 3.83Å; A129-F181 HydrophobicContact CB-CZ 3.93Å
130	P	86.6	Confident	84.2	Confident	69 Å²	69	72.2 Å²	72.2	45%	0.448	36%	0.359	S	S	.	.	H	α-helix	trans	-58.5	-45.8	177.8	-25.6	36	0	0	0	114	T132 F133 E134	P130-T132 VanDerWaalsContact C-N 3.29Å; P130-T132 PolarHBondContact O-N 3.49Å; P130-F133 PolarHBondContact O-N 3.31Å; P130-E134 PolarHBondContact O-N 3.36Å
131	E	88.7	Confident	85.4	Confident	134 Å²	134	71.8 Å²	71.8	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-64.8	-36.9	176.9	-65.3	-178.6	173.7	0	0	111.5	K128 A129 E134 Q135	K128-E131 PolarHBondContact O-N 3.31Å; A129-E131 PolarHBondContact O-N 3.3Å; E131-E134 PolarHBondContact O-N 2.91Å; E131-Q135 VanDerWaalsContact O-CG 3.3Å; E131-Q135 WeakPolarHBondContact O-CG 3.47Å; E131-Q135 PolarHBondContact O-N 2.82Å
132	T	90.3	Very high	86.3	Confident	29 Å²	29	69.5 Å²	69.5	18%	0.178	35%	0.353	C	S	.	.	H	α-helix	trans	-69.2	-35.2	178.9	-50.7	0	0	0	0	111.4	K128 A129 P130 Q135 A136 L151 L155	K128-T132 WeakPolarHBondContact O-CB 3.27Å; K128-T132 PolarHBondContact O-N 3.4Å; K128-T132 PolarHBondContact O-OG1 3.22Å; A129-T132 WeakPolarHBondContact O-CB 3.42Å; A129-T132 PolarHBondContact O-N 2.92Å; A129-T132 VanDerWaalsContact O-N 3.14Å; P130-T132 VanDerWaalsContact C-N 3.29Å; P130-T132 PolarHBondContact O-N 3.49Å; T132-Q135 PolarHBondContact O-N 3.18Å; T132-A136 VanDerWaalsContact O-CB 3.32Å; T132-A136 WeakPolarHBondContact O-CB 3.36Å; T132-A136 PolarHBondContact O-N 2.95Å; T132-L151 HydrophobicContact CG2-CB 4.04Å; T132-L151 HydrophobicContact CG2-CD2 4.11Å; T132-L151 HydrophobicContact CG2-CG 4.44Å; T132-L155 HydrophobicContact CG2-CD1 3.65Å; T132-L155 HydrophobicContact CG2-CD2 4.1Å; T132-L155 HydrophobicContact CG2-CG 3.78Å
133	F	91.3	Very high	87	Confident	12 Å²	12	73.4 Å²	73.4	5%	0.053	37%	0.37	C	S	.	.	H	α-helix	trans	-61.2	-47.8	173.3	-67.4	-45.5	0	0	0	111.9	A129 P130 Q135 A136 R137 L155 F182 E184 L185 L188	A129-F133 HydrophobicContact CB-CE2 4.07Å; A129-F133 HydrophobicContact CB-CZ 4.31Å; A129-F133 WeakPolarHBondContact O-CD2 3.4Å; A129-F133 WeakPolarHBondContact O-CG 3.21Å; A129-F133 PolarHBondContact O-N 2.89Å; P130-F133 PolarHBondContact O-N 3.31Å; F133-Q135 PolarHBondContact O-N 3.46Å; F133-A136 PolarHBondContact O-N 3.44Å; F133-R137 WeakPolarHBondContact O-CB 3.43Å; F133-R137 PolarHBondContact O-N 2.7Å; F133-L155 HydrophobicContact CD1-CD1 3.37Å; F133-L155 HydrophobicContact CD1-CD2 4.22Å; F133-L155 HydrophobicContact CD1-CG 4.36Å; F133-L155 HydrophobicContact CE1-CB 4.26Å; F133-L155 HydrophobicContact CE1-CD1 3.47Å; F133-L155 VanDerWaalsContact CE1-CD1 3.47Å; F133-L155 HydrophobicContact CE1-CD2 3.71Å; F133-L155 HydrophobicContact CE1-CG 4.02Å; F133-L155 HydrophobicContact CG-CD1 4.35Å; F133-L155 HydrophobicContact CZ-CD2 4.03Å; F133-F182 AromaticContact CZ-CD1 3.92Å; F133-F182 HydrophobicContact CZ-CD1 3.92Å; F133-F182 HydrophobicContact CZ-CE1 4.41Å; F133-E184 HydrophobicContact CB-CB 4.45Å; F133-E184 HydrophobicContact CD1-CB 4.09Å; F133-E184 HydrophobicContact CD2-CB 4.02Å; F133-E184 HydrophobicContact CD2-CG 4.46Å; F133-E184 HydrophobicContact CE1-CB 4.4Å; F133-E184 HydrophobicContact CE2-CB 4.31Å; F133-E184 HydrophobicContact CG-CB 3.95Å; F133-L185 HydrophobicContact CE1-CD1 4.48Å; F133-L185 HydrophobicContact CE1-CD2 4Å; F133-L185 HydrophobicContact CE1-CG 3.73Å; F133-L185 HydrophobicContact CZ-CG 4.43Å; F133-L188 HydrophobicContact CD1-CD1 3.96Å
134	E	91.6	Very high	87.9	Confident	98 Å²	98	70.2 Å²	70.2	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-66.9	-36.9	179.9	-69.2	-59.3	139.4	0	0	112.1	P130 E131 R137 T138	P130-E134 PolarHBondContact O-N 3.36Å; E131-E134 PolarHBondContact O-N 2.91Å; E134-R137 PolarHBondContact O-N 2.7Å; E134-R137 IonicContact OE1-CZ 3.39Å; E134-R137 IonicContact OE1-NH1 2.66Å; E134-R137 PolarHBondContact OE1-NH1 2.73Å; E134-R137 IonicContact OE1-NH2 3.47Å; E134-R137 IonicContact OE2-NH1 3.91Å; E134-R137 PolarHBondContact OE2-NH1 2.76Å; E134-T138 WeakPolarHBondContact O-CB 3.24Å; E134-T138 PolarHBondContact O-N 3.26Å; E134-T138 PolarHBondContact O-OG1 2.89Å
135	Q	93.7	Very high	88.8	Confident	92 Å²	92	67.3 Å²	67.3	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-45.8	172.7	-72.1	174.4	35.9	0	0	111.6	E131 T132 F133 R137 T138 Y139 L151	E131-Q135 VanDerWaalsContact O-CG 3.3Å; E131-Q135 WeakPolarHBondContact O-CG 3.47Å; E131-Q135 PolarHBondContact O-N 2.82Å; T132-Q135 PolarHBondContact O-N 3.18Å; F133-Q135 PolarHBondContact O-N 3.46Å; Q135-R137 VanDerWaalsContact C-N 3.34Å; Q135-R137 PolarHBondContact O-N 2.78Å; Q135-T138 PolarHBondContact O-N 3.47Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.46Å; Q135-Y139 PolarHBondContact O-N 2.98Å; Q135-L151 HydrophobicContact CB-CD1 3.66Å
136	A	92.6	Very high	89.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-45.8	176.9	0	0	0	0	0	111	T132 F133 T138 Y139 L140 L151 M152 L188	T132-A136 VanDerWaalsContact O-CB 3.32Å; T132-A136 WeakPolarHBondContact O-CB 3.36Å; T132-A136 PolarHBondContact O-N 2.95Å; F133-A136 PolarHBondContact O-N 3.44Å; A136-T138 PolarHBondContact O-N 3.3Å; A136-Y139 PolarHBondContact O-N 2.95Å; A136-L140 WeakPolarHBondContact O-CG 3.36Å; A136-L140 PolarHBondContact O-N 2.91Å; A136-L151 HydrophobicContact CB-CB 3.91Å; A136-L151 HydrophobicContact CB-CD1 4.3Å; A136-M152 HydrophobicContact CB-CG 4.33Å; A136-L188 HydrophobicContact CB-CD1 3.83Å; A136-L188 HydrophobicContact CB-CD2 4.32Å
137	R	93.6	Very high	90.4	Very high	61 Å²	61	65.4 Å²	65.4	23%	0.23	33%	0.33	C	S	.	.	H	α-helix	trans	-56.5	-50.4	175.9	-169.8	-178.2	-69.5	154.4	-2	111.4	F133 E134 Q135 Y139 L140 E141 E184 L188 M191	F133-R137 WeakPolarHBondContact O-CB 3.43Å; F133-R137 PolarHBondContact O-N 2.7Å; E134-R137 PolarHBondContact O-N 2.7Å; E134-R137 IonicContact OE1-CZ 3.39Å; E134-R137 IonicContact OE1-NH1 2.66Å; E134-R137 PolarHBondContact OE1-NH1 2.73Å; E134-R137 IonicContact OE1-NH2 3.47Å; E134-R137 IonicContact OE2-NH1 3.91Å; E134-R137 PolarHBondContact OE2-NH1 2.76Å; Q135-R137 VanDerWaalsContact C-N 3.34Å; Q135-R137 PolarHBondContact O-N 2.78Å; R137-Y139 VanDerWaalsContact C-N 3.33Å; R137-Y139 PolarHBondContact O-N 2.84Å; R137-L140 PolarHBondContact O-N 3.17Å; R137-L140 VanDerWaalsContact O-N 3.13Å; R137-E141 WeakPolarHBondContact O-CG 3.47Å; R137-E141 PolarHBondContact O-N 3.49Å; R137-E184 IonicContact NH2-OE2 2.73Å; R137-E184 PolarHBondContact NH2-OE2 2.85Å; R137-L188 HydrophobicContact CB-CD2 3.85Å; R137-L188 HydrophobicContact CG-CD2 4.43Å; R137-M191 HydrophobicContact CG-CE 4.06Å; R137-M191 HydrophobicContact CG-SD 4.15Å
138	T	94.9	Very high	91	Very high	81 Å²	81	60.1 Å²	60.1	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-58.5	-42.6	179.1	-55.4	0	0	0	0	112.2	E134 Q135 A136 E141 S142	E134-T138 WeakPolarHBondContact O-CB 3.24Å; E134-T138 PolarHBondContact O-N 3.26Å; E134-T138 PolarHBondContact O-OG1 2.89Å; Q135-T138 PolarHBondContact O-N 3.47Å; A136-T138 PolarHBondContact O-N 3.3Å; T138-E141 PolarHBondContact O-N 2.77Å; T138-S142 WeakPolarHBondContact O-CB 3.14Å; T138-S142 PolarHBondContact O-N 3.23Å; T138-S142 PolarHBondContact O-OG 3.47Å
139	Y	94.5	Very high	91.6	Very high	87 Å²	87	54 Å²	54	34%	0.341	27%	0.271	S	S	.	.	H	α-helix	trans	-66.9	-37.6	176.6	-77.4	-55.8	0	0	0	112.9	Q135 A136 R137 S142 E143 N144 E147 L151	Q135-Y139 WeakPolarHBondContact O-CD2 3.46Å; Q135-Y139 PolarHBondContact O-N 2.98Å; A136-Y139 PolarHBondContact O-N 2.95Å; R137-Y139 VanDerWaalsContact C-N 3.33Å; R137-Y139 PolarHBondContact O-N 2.84Å; Y139-S142 WeakPolarHBondContact CA-OG 3.31Å; Y139-S142 PolarHBondContact O-OG 3.28Å; Y139-E143 PolarHBondContact O-N 3.07Å; Y139-N144 HydrophobicContact CD1-CB 3.95Å; Y139-N144 PolarHBondContact O-N 3.38Å; Y139-E147 HydrophobicContact CD1-CB 4.09Å; Y139-E147 HydrophobicContact CD2-CB 4.24Å; Y139-E147 HydrophobicContact CE1-CB 4.25Å; Y139-E147 HydrophobicContact CE2-CB 4.4Å; Y139-E147 HydrophobicContact CG-CB 4.08Å; Y139-L151 HydrophobicContact CD2-CD1 3.8Å; Y139-L151 HydrophobicContact CE2-CD1 3.94Å
140	L	91.7	Very high	92	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-42.6	175.1	-66.8	-179.8	0	0	0	111.5	A136 R137 S142 E143 L145 M152 L188 M191 F192 K195	A136-L140 WeakPolarHBondContact O-CG 3.36Å; A136-L140 PolarHBondContact O-N 2.91Å; R137-L140 PolarHBondContact O-N 3.17Å; R137-L140 VanDerWaalsContact O-N 3.13Å; L140-S142 VanDerWaalsContact C-N 3.34Å; L140-S142 PolarHBondContact O-N 3.47Å; L140-E143 PolarHBondContact O-N 2.82Å; L140-L145 HydrophobicContact CD2-CD2 4.47Å; L140-M152 HydrophobicContact CD1-SD 3.77Å; L140-M152 HydrophobicContact CD2-SD 4.31Å; L140-M152 HydrophobicContact CG-SD 4.46Å; L140-L188 HydrophobicContact CD1-CB 4.35Å; L140-L188 HydrophobicContact CD1-CD2 3.93Å; L140-M191 HydrophobicContact CB-CE 4.34Å; L140-M191 HydrophobicContact CD1-CB 4.32Å; L140-F192 HydrophobicContact CD2-CD2 3.62Å; L140-F192 HydrophobicContact CD2-CE2 4.1Å; L140-K195 WeakPolarHBondContact O-CE 3.32Å; L140-K195 PolarHBondContact O-NZ 2.91Å
141	E	91.8	Very high	92.4	Very high	120 Å²	120	57.2 Å²	57.2	56%	0.561	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-42.1	176.9	-73.3	175	179.7	0	0	111.9	R137 T138 E143 M191	R137-E141 WeakPolarHBondContact O-CG 3.47Å; R137-E141 PolarHBondContact O-N 3.49Å; T138-E141 PolarHBondContact O-N 2.77Å; E141-E143 PolarHBondContact O-N 3.46Å; E141-M191 HydrophobicContact CG-CE 3.82Å
142	S	90.2	Very high	92.6	Very high	76 Å²	76	50.8 Å²	50.8	53%	0.531	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	10.4	176.4	57.9	0	0	0	0	115.1	T138 Y139 L140 N144	T138-S142 WeakPolarHBondContact O-CB 3.14Å; T138-S142 PolarHBondContact O-N 3.23Å; T138-S142 PolarHBondContact O-OG 3.47Å; Y139-S142 WeakPolarHBondContact CA-OG 3.31Å; Y139-S142 PolarHBondContact O-OG 3.28Å; L140-S142 VanDerWaalsContact C-N 3.34Å; L140-S142 PolarHBondContact O-N 3.47Å; S142-N144 PolarHBondContact O-N 3.47Å; S142-N144 VanDerWaalsContact O-N 3.12Å
143	E	86.3	Confident	92.7	Very high	103 Å²	103	52.9 Å²	52.9	48%	0.481	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	16.6	-179.7	-55.3	-168.8	155	0	0	115.5	Y139 L140 E141 L145 F213	Y139-E143 PolarHBondContact O-N 3.07Å; L140-E143 PolarHBondContact O-N 2.82Å; E141-E143 PolarHBondContact O-N 3.46Å; E143-L145 PolarHBondContact O-N 2.98Å; E143-F213 HydrophobicContact CB-CD2 4.29Å; E143-F213 HydrophobicContact CB-CE2 4.45Å; E143-F213 HydrophobicContact CG-CE2 4.42Å
144	N	91.6	Very high	92.6	Very high	52 Å²	52	56.4 Å²	56.4	28%	0.278	28%	0.276	S	S	.	.			trans	-81.4	67	170.1	-166.6	1.3	0	0	0	110.7	Y139 S142 L146 E147 G148	Y139-N144 HydrophobicContact CD1-CB 3.95Å; Y139-N144 PolarHBondContact O-N 3.38Å; S142-N144 PolarHBondContact O-N 3.47Å; S142-N144 VanDerWaalsContact O-N 3.12Å; N144-L146 VanDerWaalsContact C-N 3.26Å; N144-L146 PolarHBondContact O-N 3.46Å; N144-E147 VanDerWaalsContact ND2-CG 3.33Å; N144-E147 WeakPolarHBondContact ND2-CG 3.41Å; N144-E147 PolarHBondContact O-N 3.27Å; N144-G148 PolarHBondContact O-N 2.98Å
145	L	92.7	Very high	92.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.1	-35.5	-170.2	-58.9	-174.8	0	0	0	113.9	L140 E143 H149 F192 K195 F213 N216 C217	L140-L145 HydrophobicContact CD2-CD2 4.47Å; E143-L145 PolarHBondContact O-N 2.98Å; L145-H149 WeakPolarHBondContact O-CB 3.34Å; L145-H149 PolarHBondContact O-N 3.44Å; L145-F192 HydrophobicContact CB-CE2 4.03Å; L145-F192 HydrophobicContact CB-CZ 4.23Å; L145-F192 HydrophobicContact CD1-CZ 4.18Å; L145-F192 HydrophobicContact CD2-CE2 4.05Å; L145-F192 HydrophobicContact CD2-CZ 4.39Å; L145-F192 HydrophobicContact CG-CE2 4.45Å; L145-K195 HydrophobicContact CD2-CD 3.74Å; L145-F213 HydrophobicContact CD1-CD2 3.82Å; L145-F213 HydrophobicContact CD1-CE2 3.62Å; L145-F213 HydrophobicContact CD1-CG 4.47Å; L145-F213 HydrophobicContact CD1-CZ 4.1Å; L145-F213 HydrophobicContact CD2-CE2 4.02Å; L145-F213 HydrophobicContact CG-CD2 4.25Å; L145-F213 HydrophobicContact CG-CE2 4.04Å; L145-N216 HydrophobicContact CB-CB 4.35Å; L145-N216 HydrophobicContact CD1-CB 4.39Å; L145-C217 HydrophobicContact CD1-CB 3.86Å
146	L	93.3	Very high	92.5	Very high	31 Å²	31	47.7 Å²	47.7	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-72.3	-42.5	-175.9	-68	176.3	0	0	0	112.1	N144 K150 N216 R219 V220	N144-L146 VanDerWaalsContact C-N 3.26Å; N144-L146 PolarHBondContact O-N 3.46Å; L146-K150 WeakPolarHBondContact O-CB 3.47Å; L146-K150 PolarHBondContact O-N 3.27Å; L146-N216 HydrophobicContact CD1-CB 4.5Å; L146-N216 WeakPolarHBondContact CD1-OD1 3.03Å; L146-N216 HydrophobicContact CG-CB 4.13Å; L146-R219 HydrophobicContact CD2-CB 4.21Å; L146-V220 HydrophobicContact CD2-CG2 3.94Å
147	E	93.9	Very high	92.3	Very high	86 Å²	86	49 Å²	49	40%	0.402	25%	0.25	S	C	.	.	H	α-helix	trans	-72.6	-41.9	178	-62	-53	143	0	0	110.8	Y139 N144 H149 K150 L151	Y139-E147 HydrophobicContact CD1-CB 4.09Å; Y139-E147 HydrophobicContact CD2-CB 4.24Å; Y139-E147 HydrophobicContact CE1-CB 4.25Å; Y139-E147 HydrophobicContact CE2-CB 4.4Å; Y139-E147 HydrophobicContact CG-CB 4.08Å; N144-E147 VanDerWaalsContact ND2-CG 3.33Å; N144-E147 WeakPolarHBondContact ND2-CG 3.41Å; N144-E147 PolarHBondContact O-N 3.27Å; E147-H149 PolarHBondContact O-N 3.3Å; E147-K150 PolarHBondContact O-N 2.84Å; E147-L151 PolarHBondContact O-N 3Å
148	G	93.6	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-46.5	173.5	0	0	0	0	0	112.2	N144 K150 L151 M152	N144-G148 PolarHBondContact O-N 2.98Å; G148-K150 PolarHBondContact O-N 3Å; G148-L151 PolarHBondContact O-N 3.36Å; G148-M152 VanDerWaalsContact O-CG 3.32Å; G148-M152 WeakPolarHBondContact O-CG 3.48Å; G148-M152 PolarHBondContact O-N 3.45Å
149	H	95.3	Very high	91.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-37.3	177.4	178.1	-104.8	0	0	0	112.9	L145 E147 M152 Q153 F192 V220 E224	L145-H149 WeakPolarHBondContact O-CB 3.34Å; L145-H149 PolarHBondContact O-N 3.44Å; E147-H149 PolarHBondContact O-N 3.3Å; H149-M152 WeakPolarHBondContact O-CB 3.48Å; H149-M152 PolarHBondContact O-N 3.01Å; H149-Q153 WeakPolarHBondContact O-CB 3.37Å; H149-Q153 PolarHBondContact O-N 2.94Å; H149-F192 HydrophobicContact CB-CE2 4.32Å; H149-V220 HydrophobicContact CB-CG1 4.11Å; H149-V220 HydrophobicContact CB-CG2 3.77Å; H149-V220 VanDerWaalsContact CD2-CG1 3.4Å; H149-V220 WeakPolarHBondContact CD2-CG1 3.29Å; H149-V220 VanDerWaalsContact CG-CG1 3.49Å; H149-E224 IonicContact CD2-OE1 3.69Å; H149-E224 IonicContact CE1-OE1 2.95Å; H149-E224 IonicContact NE2-OE1 2.76Å; H149-E224 PolarHBondContact NE2-OE1 2.88Å
150	K	94.8	Very high	91.4	Very high	110 Å²	110	40.4 Å²	40.4	48%	0.478	21%	0.209	S	C	.	.	H	α-helix	trans	-59.8	-48	176.1	-178.2	-175.4	173.5	-169.5	0	111.3	L146 E147 G148 M152 Q153 D154	L146-K150 WeakPolarHBondContact O-CB 3.47Å; L146-K150 PolarHBondContact O-N 3.27Å; E147-K150 PolarHBondContact O-N 2.84Å; G148-K150 PolarHBondContact O-N 3Å; K150-M152 VanDerWaalsContact C-N 3.33Å; K150-M152 PolarHBondContact O-N 2.79Å; K150-Q153 PolarHBondContact O-N 3.43Å; K150-D154 PolarHBondContact O-N 3.41Å
151	L	93.4	Very high	91	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-40.3	177	-64	-176.3	0	0	0	111.8	T132 Q135 A136 Y139 E147 G148 Q153 D154 L155	T132-L151 HydrophobicContact CG2-CB 4.04Å; T132-L151 HydrophobicContact CG2-CD2 4.11Å; T132-L151 HydrophobicContact CG2-CG 4.44Å; Q135-L151 HydrophobicContact CB-CD1 3.66Å; A136-L151 HydrophobicContact CB-CB 3.91Å; A136-L151 HydrophobicContact CB-CD1 4.3Å; Y139-L151 HydrophobicContact CD2-CD1 3.8Å; Y139-L151 HydrophobicContact CE2-CD1 3.94Å; E147-L151 PolarHBondContact O-N 3Å; G148-L151 PolarHBondContact O-N 3.36Å; L151-Q153 VanDerWaalsContact C-N 3.33Å; L151-Q153 PolarHBondContact O-N 3.26Å; L151-D154 PolarHBondContact O-N 3.33Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 WeakPolarHBondContact O-CD1 3.31Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 3.5Å
152	M	93.7	Very high	90.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-42.5	173.6	-68.1	169.8	66.6	0	0	112	A136 L140 G148 H149 K150 L155 E156 L188 N189	A136-M152 HydrophobicContact CB-CG 4.33Å; L140-M152 HydrophobicContact CD1-SD 3.77Å; L140-M152 HydrophobicContact CD2-SD 4.31Å; L140-M152 HydrophobicContact CG-SD 4.46Å; G148-M152 VanDerWaalsContact O-CG 3.32Å; G148-M152 WeakPolarHBondContact O-CG 3.48Å; G148-M152 PolarHBondContact O-N 3.45Å; H149-M152 WeakPolarHBondContact O-CB 3.48Å; H149-M152 PolarHBondContact O-N 3.01Å; K150-M152 VanDerWaalsContact C-N 3.33Å; K150-M152 PolarHBondContact O-N 2.79Å; M152-L155 PolarHBondContact O-N 2.88Å; M152-E156 WeakPolarHBondContact O-CB 3.28Å; M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.92Å; M152-L188 HydrophobicContact CE-CB 3.92Å; M152-L188 HydrophobicContact CG-CB 4.17Å; M152-L188 HydrophobicContact CG-CD1 4.22Å; M152-L188 HydrophobicContact SD-CB 4.14Å; M152-N189 HydrophobicContact CE-CB 4.41Å
153	Q	92.1	Very high	90.4	Very high	73 Å²	73	37.6 Å²	37.6	34%	0.341	19%	0.188	S	C	.	.	H	α-helix	trans	-67	-38.3	-179.6	-174.2	177.4	-17.3	0	0	111.8	H149 K150 L151 G157	H149-Q153 WeakPolarHBondContact O-CB 3.37Å; H149-Q153 PolarHBondContact O-N 2.94Å; K150-Q153 PolarHBondContact O-N 3.43Å; L151-Q153 VanDerWaalsContact C-N 3.33Å; L151-Q153 PolarHBondContact O-N 3.26Å; Q153-G157 PolarHBondContact O-N 3.37Å
154	D	90	Very high	90.3	Very high	85 Å²	85	34.5 Å²	34.5	46%	0.455	17%	0.173	S	C	.	.	H	α-helix	trans	-63.6	-47	174.9	-66.7	-20.5	0	0	0	110.3	K150 L151 G157 I158	K150-D154 PolarHBondContact O-N 3.41Å; L151-D154 PolarHBondContact O-N 3.33Å; D154-G157 PolarHBondContact O-N 3.49Å; D154-I158 WeakPolarHBondContact O-CD1 3.44Å; D154-I158 WeakPolarHBondContact O-CG1 3.26Å; D154-I158 PolarHBondContact O-N 3.34Å
155	L	90.6	Very high	89.8	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-43.3	176.5	-74.3	163.9	0	0	0	113.1	A129 T132 F133 L151 M152 G157 I158 R159 L185	A129-L155 HydrophobicContact CB-CD2 3.86Å; T132-L155 HydrophobicContact CG2-CD1 3.65Å; T132-L155 HydrophobicContact CG2-CD2 4.1Å; T132-L155 HydrophobicContact CG2-CG 3.78Å; F133-L155 HydrophobicContact CD1-CD1 3.37Å; F133-L155 HydrophobicContact CD1-CD2 4.22Å; F133-L155 HydrophobicContact CD1-CG 4.36Å; F133-L155 HydrophobicContact CE1-CB 4.26Å; F133-L155 HydrophobicContact CE1-CD1 3.47Å; F133-L155 VanDerWaalsContact CE1-CD1 3.47Å; F133-L155 HydrophobicContact CE1-CD2 3.71Å; F133-L155 HydrophobicContact CE1-CG 4.02Å; F133-L155 HydrophobicContact CG-CD1 4.35Å; F133-L155 HydrophobicContact CZ-CD2 4.03Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 WeakPolarHBondContact O-CD1 3.31Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 3.5Å; M152-L155 PolarHBondContact O-N 2.88Å; L155-G157 VanDerWaalsContact C-N 3.35Å; L155-I158 PolarHBondContact O-N 2.84Å; L155-R159 WeakPolarHBondContact O-CB 3.32Å; L155-R159 PolarHBondContact O-N 2.93Å; L155-L185 HydrophobicContact CB-CD1 4.22Å; L155-L185 HydrophobicContact CB-CD2 3.74Å; L155-L185 HydrophobicContact CB-CG 4.38Å; L155-L185 HydrophobicContact CD1-CD2 4.28Å
156	E	91.5	Very high	89.3	Confident	3 Å²	3	36 Å²	36	1%	0.014	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-39.9	173.6	-78.2	179.4	-172.1	0	0	111.5	M152 I158 R159 D160 L185 N189 R245 K247	M152-E156 WeakPolarHBondContact O-CB 3.28Å; M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.92Å; E156-I158 PolarHBondContact O-N 3.31Å; E156-R159 PolarHBondContact O-N 3.19Å; E156-D160 WeakPolarHBondContact O-CB 3.48Å; E156-D160 PolarHBondContact O-N 3.44Å; E156-L185 HydrophobicContact CG-CD1 4Å; E156-L185 HydrophobicContact CG-CD2 4.07Å; E156-N189 PolarHBondContact OE1-ND2 3.37Å; E156-N189 PolarHBondContact OE1-OD1 2.84Å; E156-R245 IonicContact OE2-CZ 2.77Å; E156-R245 IonicContact OE2-NH2 3.44Å; E156-R245 PolarHBondContact OE2-NH2 3.48Å; E156-K247 WeakPolarHBondContact OE1-CE 3.33Å; E156-K247 IonicContact OE1-NZ 2.7Å; E156-K247 PolarHBondContact OE1-NZ 2.94Å; E156-K247 IonicContact OE2-NZ 3.9Å; E156-K247 PolarHBondContact OE2-NZ 3.46Å
157	G	89	Confident	88.8	Confident	29 Å²	29	39.3 Å²	39.3	30%	0.299	19%	0.191	S	C	.	.	H	α-helix	trans	-57.8	-49.2	175.9	0	0	0	0	0	111.7	Q153 D154 L155 D160 E161	Q153-G157 PolarHBondContact O-N 3.37Å; D154-G157 PolarHBondContact O-N 3.49Å; L155-G157 VanDerWaalsContact C-N 3.35Å; G157-D160 PolarHBondContact O-N 2.92Å; G157-E161 WeakPolarHBondContact O-CB 3.45Å; G157-E161 WeakPolarHBondContact O-CG 3.45Å; G157-E161 PolarHBondContact O-N 3.49Å
158	I	85.9	Confident	88.2	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-48.7	177.4	-62.8	150.9	0	0	0	110.9	Y125 D154 L155 E156 D160 E161 L162 F182	Y125-I158 HydrophobicContact CD1-CD1 3.67Å; Y125-I158 HydrophobicContact CD1-CG1 4.27Å; Y125-I158 HydrophobicContact CG-CD1 3.84Å; Y125-I158 HydrophobicContact CG-CG1 4.12Å; D154-I158 WeakPolarHBondContact O-CD1 3.44Å; D154-I158 WeakPolarHBondContact O-CG1 3.26Å; D154-I158 PolarHBondContact O-N 3.34Å; L155-I158 PolarHBondContact O-N 2.84Å; E156-I158 PolarHBondContact O-N 3.31Å; I158-D160 VanDerWaalsContact C-N 3.34Å; I158-D160 PolarHBondContact O-N 3.34Å; I158-E161 PolarHBondContact O-N 3.11Å; I158-L162 HydrophobicContact CG2-CD1 3.88Å; I158-L162 WeakPolarHBondContact O-CB 3.4Å; I158-L162 WeakPolarHBondContact O-CG 3.47Å; I158-L162 PolarHBondContact O-N 3.2Å; I158-F182 HydrophobicContact CG2-CZ 4.21Å
159	R	88.7	Confident	87.6	Confident	18 Å²	18	48.7 Å²	48.7	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-55	-51.7	177.2	178.7	-166.3	66.9	173.4	9.8	110.6	L155 E156 E161 L162 M163 F182 L185 D243	L155-R159 WeakPolarHBondContact O-CB 3.32Å; L155-R159 PolarHBondContact O-N 2.93Å; E156-R159 PolarHBondContact O-N 3.19Å; R159-E161 PolarHBondContact O-N 3.01Å; R159-L162 PolarHBondContact O-N 3.12Å; R159-M163 HydrophobicContact CG-CG 4.1Å; R159-M163 VanDerWaalsContact O-CB 3.26Å; R159-M163 WeakPolarHBondContact O-CB 3.39Å; R159-M163 WeakPolarHBondContact O-CG 3.33Å; R159-M163 PolarHBondContact O-N 3.08Å; R159-F182 HydrophobicContact CB-CB 4.46Å; R159-F182 HydrophobicContact CB-CD1 3.73Å; R159-F182 HydrophobicContact CB-CD2 3.85Å; R159-F182 HydrophobicContact CB-CE1 3.82Å; R159-F182 HydrophobicContact CB-CE2 3.93Å; R159-F182 HydrophobicContact CB-CG 3.75Å; R159-F182 HydrophobicContact CB-CZ 3.91Å; R159-F182 HydrophobicContact CG-CB 3.88Å; R159-F182 HydrophobicContact CG-CD1 4.1Å; R159-F182 HydrophobicContact CG-CD2 3.59Å; R159-F182 HydrophobicContact CG-CE2 4.1Å; R159-F182 HydrophobicContact CG-CG 3.59Å; R159-L185 HydrophobicContact CB-CD1 4.17Å; R159-D243 PolarHBondContact NH2-O 2.98Å
160	D	89.2	Confident	86.7	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-70	-35.3	-171.3	-65.1	-6.1	0	0	0	111.5	E156 G157 I158 F164 W231 P242	E156-D160 WeakPolarHBondContact O-CB 3.48Å; E156-D160 PolarHBondContact O-N 3.44Å; G157-D160 PolarHBondContact O-N 2.92Å; I158-D160 VanDerWaalsContact C-N 3.34Å; I158-D160 PolarHBondContact O-N 3.34Å; D160-F164 WeakPolarHBondContact O-CB 3.35Å; D160-F164 PolarHBondContact O-N 3.1Å; D160-W231 HydrophobicContact CB-CH2 3.97Å; D160-W231 HydrophobicContact CB-CZ2 3.55Å; D160-P242 HydrophobicContact CB-CB 4.32Å; D160-P242 HydrophobicContact CB-CG 4.01Å; D160-P242 VanDerWaalsContact CG-CB 3.48Å; D160-P242 WeakPolarHBondContact OD1-CB 3.28Å; D160-P242 WeakPolarHBondContact OD2-CB 3.43Å; D160-P242 WeakPolarHBondContact OD2-CG 3.47Å
161	E	84.7	Confident	86.1	Confident	115 Å²	115	54 Å²	54	54%	0.537	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-46.8	173.5	-75.6	-178.3	178.3	0	0	111.8	G157 I158 R159 F164 E165	G157-E161 WeakPolarHBondContact O-CB 3.45Å; G157-E161 WeakPolarHBondContact O-CG 3.45Å; G157-E161 PolarHBondContact O-N 3.49Å; I158-E161 PolarHBondContact O-N 3.11Å; R159-E161 PolarHBondContact O-N 3.01Å; E161-F164 PolarHBondContact O-N 3.4Å; E161-E165 WeakPolarHBondContact O-CG 3.4Å; E161-E165 PolarHBondContact O-N 3.21Å
162	L	83.3	Confident	85.4	Confident	16 Å²	16	58 Å²	58	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-60.4	-48.9	175.1	-78.5	173.2	0	0	0	111.8	N122 L126 I158 R159 F164 E165 V166 L178 F182	N122-L162 HydrophobicContact CB-CD2 3.83Å; N122-L162 VanDerWaalsContact ND2-CD2 3.29Å; N122-L162 WeakPolarHBondContact ND2-CD2 3.32Å; L126-L162 HydrophobicContact CD1-CD1 4.06Å; L126-L162 HydrophobicContact CD2-CD1 3.8Å; L126-L162 HydrophobicContact CG-CD1 4.1Å; I158-L162 HydrophobicContact CG2-CD1 3.88Å; I158-L162 WeakPolarHBondContact O-CB 3.4Å; I158-L162 WeakPolarHBondContact O-CG 3.47Å; I158-L162 PolarHBondContact O-N 3.2Å; R159-L162 PolarHBondContact O-N 3.12Å; L162-F164 VanDerWaalsContact C-N 3.25Å; L162-F164 PolarHBondContact O-N 2.8Å; L162-E165 PolarHBondContact O-N 2.87Å; L162-E165 VanDerWaalsContact O-N 3.17Å; L162-V166 WeakPolarHBondContact O-CG2 3.26Å; L162-V166 PolarHBondContact O-N 2.91Å; L162-L178 HydrophobicContact CB-CD1 4.06Å; L162-L178 HydrophobicContact CB-CD2 4.5Å; L162-L178 HydrophobicContact CD1-CD2 4.33Å; L162-F182 HydrophobicContact CD1-CE2 4.27Å; L162-F182 HydrophobicContact CD1-CZ 4.37Å
163	M	85.6	Confident	84.8	Confident	7 Å²	7	65.7 Å²	65.7	3%	0.034	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-36.9	177.8	-71.1	-71	-78.5	0	0	111.2	R159 Y167 L175 L178 R179 F240	R159-M163 HydrophobicContact CG-CG 4.1Å; R159-M163 VanDerWaalsContact O-CB 3.26Å; R159-M163 WeakPolarHBondContact O-CB 3.39Å; R159-M163 WeakPolarHBondContact O-CG 3.33Å; R159-M163 PolarHBondContact O-N 3.08Å; M163-Y167 WeakPolarHBondContact O-CB 3.4Å; M163-Y167 PolarHBondContact O-N 3.13Å; M163-L175 HydrophobicContact CB-CD2 4.26Å; M163-L175 HydrophobicContact CE-CB 4.14Å; M163-L175 HydrophobicContact CE-CD2 3.64Å; M163-L175 HydrophobicContact CE-CG 4.46Å; M163-L175 WeakPolarHBondContact O-CD2 3.42Å; M163-L175 HydrophobicContact SD-CB 4.37Å; M163-L175 HydrophobicContact SD-CD2 3.52Å; M163-L175 VanDerWaalsContact SD-CD2 3.52Å; M163-L178 HydrophobicContact CG-CB 4.36Å; M163-L178 HydrophobicContact CG-CD1 4.19Å; M163-L178 HydrophobicContact SD-CB 3.37Å; M163-L178 WeakPolarHBondContact SD-CB 3.42Å; M163-L178 HydrophobicContact SD-CD1 3.64Å; M163-L178 HydrophobicContact SD-CG 4.17Å; M163-R179 HydrophobicContact CE-CG 3.76Å; M163-F240 HydrophobicContact CB-CE2 4.33Å; M163-F240 HydrophobicContact CB-CZ 3.78Å
164	F	84.2	Confident	84.2	Confident	37 Å²	37	66 Å²	66	16%	0.162	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-39.5	175.3	-179.7	-115.3	0	0	0	112.9	D160 E161 L162 R168 H238 F240	D160-F164 WeakPolarHBondContact O-CB 3.35Å; D160-F164 PolarHBondContact O-N 3.1Å; E161-F164 PolarHBondContact O-N 3.4Å; L162-F164 VanDerWaalsContact C-N 3.25Å; L162-F164 PolarHBondContact O-N 2.8Å; F164-R168 HydrophobicContact CE2-CG 4.33Å; F164-R168 HydrophobicContact CZ-CG 4.26Å; F164-R168 WeakPolarHBondContact O-CG 2.93Å; F164-R168 PolarHBondContact O-N 3.4Å; F164-R168 VanDerWaalsContact O-N 3.09Å; F164-H238 HydrophobicContact CE2-CB 3.77Å; F164-H238 HydrophobicContact CZ-CB 4.1Å; F164-H238 AromaticContact CZ-CG 3.89Å; F164-F240 HydrophobicContact CB-CD1 4.01Å; F164-F240 HydrophobicContact CB-CE1 3.83Å; F164-F240 HydrophobicContact CB-CZ 4.33Å; F164-F240 HydrophobicContact CD2-CB 3.78Å; F164-F240 AromaticContact CD2-CD1 3.55Å; F164-F240 HydrophobicContact CD2-CD1 3.55Å; F164-F240 HydrophobicContact CD2-CE1 4.26Å; F164-F240 AromaticContact CD2-CG 3.7Å; F164-F240 HydrophobicContact CD2-CG 3.7Å; F164-F240 HydrophobicContact CE2-CB 4.03Å; F164-F240 HydrophobicContact CE2-CD1 4.47Å; F164-F240 HydrophobicContact CE2-CG 4.45Å; F164-F240 HydrophobicContact CG-CD1 4.2Å
165	E	81.2	Confident	83.9	Confident	66 Å²	66	62.5 Å²	62.5	31%	0.308	30%	0.296	S	S	.	.	H	α-helix	trans	-63.2	-47.1	174.7	-74.7	-173.4	165.4	0	0	112.1	E161 L162 R168 Q169	E161-E165 WeakPolarHBondContact O-CG 3.4Å; E161-E165 PolarHBondContact O-N 3.21Å; L162-E165 PolarHBondContact O-N 2.87Å; L162-E165 VanDerWaalsContact O-N 3.17Å; E165-R168 PolarHBondContact O-N 3.46Å; E165-Q169 WeakPolarHBondContact O-CG 3.42Å; E165-Q169 PolarHBondContact O-N 3.21Å
166	V	81.5	Confident	83.6	Confident	19 Å²	19	66 Å²	66	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-66.8	-39.7	177.9	178.8	0	0	0	0	111.2	L162 R168 Q169 K170 S171 D174 L175 L178	L162-V166 WeakPolarHBondContact O-CG2 3.26Å; L162-V166 PolarHBondContact O-N 2.91Å; V166-R168 VanDerWaalsContact C-N 3.31Å; V166-R168 PolarHBondContact O-N 2.73Å; V166-Q169 CarbonylContact O-C 3.6Å; V166-Q169 WeakPolarHBondContact O-CA 3.4Å; V166-Q169 WeakPolarHBondContact O-CB 3.44Å; V166-Q169 PolarHBondContact O-N 2.88Å; V166-K170 PolarHBondContact O-N 3.31Å; V166-K170 VanDerWaalsContact O-N 3.14Å; V166-S171 WeakPolarHBondContact CG1-O 3.03Å; V166-D174 HydrophobicContact CG1-CB 3.48Å; V166-D174 VanDerWaalsContact CG1-CB 3.48Å; V166-D174 HydrophobicContact CG2-CB 4.48Å; V166-L175 HydrophobicContact CB-CD2 3.85Å; V166-L175 HydrophobicContact CB-CG 4.35Å; V166-L175 HydrophobicContact CG1-CD2 3.79Å; V166-L175 HydrophobicContact CG1-CG 3.73Å; V166-L178 HydrophobicContact CB-CD1 4.39Å; V166-L178 HydrophobicContact CG2-CD1 3.77Å
167	Y	82.9	Confident	83.3	Confident	100 Å²	100	70.3 Å²	70.3	39%	0.392	34%	0.341	S	S	.	.	H	α-helix	trans	-59	-40.8	174.9	177.8	-97.8	0	0	0	112.1	M163 Q169 K170 L175 F240	M163-Y167 WeakPolarHBondContact O-CB 3.4Å; M163-Y167 PolarHBondContact O-N 3.13Å; Y167-Q169 PolarHBondContact O-N 3.05Å; Y167-K170 PolarHBondContact O-N 3.18Å; Y167-L175 HydrophobicContact CD2-CD1 4.46Å; Y167-F240 HydrophobicContact CD1-CB 3.92Å; Y167-F240 AromaticContact CD1-CD2 3.82Å; Y167-F240 HydrophobicContact CD1-CD2 3.82Å; Y167-F240 HydrophobicContact CD1-CG 4.22Å; Y167-F240 AromaticContact CD2-CD2 3.96Å; Y167-F240 HydrophobicContact CD2-CD2 3.96Å; Y167-F240 HydrophobicContact CE1-CB 3.97Å; Y167-F240 HydrophobicContact CE1-CD2 4.38Å; Y167-F240 HydrophobicContact CE2-CD2 4.5Å; Y167-F240 AromaticContact CG-CD2 3.59Å; Y167-F240 HydrophobicContact CG-CD2 3.59Å; Y167-F240 HydrophobicContact CG-CE2 4.23Å; Y167-F240 HydrophobicContact CG-CG 4.42Å
168	R	80.9	Confident	83.1	Confident	152 Å²	152	70 Å²	70	57%	0.574	33%	0.333	S	S	*	.	H	α-helix	trans	-63.9	-29.3	174.9	-76	-173.5	-69.5	177	-1.9	113	F164 E165 V166 K170	F164-R168 HydrophobicContact CE2-CG 4.33Å; F164-R168 HydrophobicContact CZ-CG 4.26Å; F164-R168 WeakPolarHBondContact O-CG 2.93Å; F164-R168 PolarHBondContact O-N 3.4Å; F164-R168 VanDerWaalsContact O-N 3.09Å; E165-R168 PolarHBondContact O-N 3.46Å; V166-R168 VanDerWaalsContact C-N 3.31Å; V166-R168 PolarHBondContact O-N 2.73Å; R168-K170 VanDerWaalsContact C-N 3.27Å
169	Q	80.4	Confident	83.1	Confident	130 Å²	130	72.8 Å²	72.8	61%	0.607	34%	0.341	S	S	*	.	H	α-helix	trans	-80.7	-8.1	174.9	-62.6	176.2	27.4	0	0	112.9	E165 V166 Y167 S171	E165-Q169 WeakPolarHBondContact O-CG 3.42Å; E165-Q169 PolarHBondContact O-N 3.21Å; V166-Q169 CarbonylContact O-C 3.6Å; V166-Q169 WeakPolarHBondContact O-CA 3.4Å; V166-Q169 WeakPolarHBondContact O-CB 3.44Å; V166-Q169 PolarHBondContact O-N 2.88Å; Y167-Q169 PolarHBondContact O-N 3.05Å; Q169-S171 PolarHBondContact O-N 2.8Å
170	K	77.6	Confident	83	Confident	192 Å²	192	74.4 Å²	74.4	84%	0.835	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	29.7	-178.3	-55.3	-178.9	177.6	-179.3	0	113.7	V166 Y167 R168	V166-K170 PolarHBondContact O-N 3.31Å; V166-K170 VanDerWaalsContact O-N 3.14Å; Y167-K170 PolarHBondContact O-N 3.18Å; R168-K170 VanDerWaalsContact C-N 3.27Å
171	S	81.8	Confident	82.9	Confident	31 Å²	31	78.1 Å²	78.1	22%	0.217	38%	0.375	C	S	.	.			trans	-91.2	107.4	175.9	-174.2	0	0	0	0	110.3	V166 Q169 D174 L175	V166-S171 WeakPolarHBondContact CG1-O 3.03Å; Q169-S171 PolarHBondContact O-N 2.8Å; S171-D174 VanDerWaalsContact CB-OD2 3.27Å; S171-D174 WeakPolarHBondContact CB-OD2 2.85Å; S171-D174 VanDerWaalsContact OG-CG 3.24Å; S171-D174 PolarHBondContact OG-OD2 3.18Å; S171-L175 WeakPolarHBondContact O-CG 3.41Å
172	M	77.8	Confident	83.1	Confident	113 Å²	113	72.9 Å²	72.9	56%	0.557	35%	0.35	S	S	*	.	H	α-helix	trans	-77.3	-37.8	-178.7	-169.9	68.2	179.2	0	0	112.4	D174 L175 D176	M172-D174 VanDerWaalsContact C-N 3.32Å; M172-D174 PolarHBondContact O-N 3.43Å; M172-L175 WeakPolarHBondContact O-CB 3.48Å; M172-L175 PolarHBondContact O-N 3.48Å; M172-L175 HydrophobicContact SD-CD1 4.3Å; M172-D176 PolarHBondContact O-N 3.33Å
173	E	81.7	Confident	83.4	Confident	160 Å²	160	79.1 Å²	79.1	75%	0.748	37%	0.373	S	S	*	.	H	α-helix	trans	-62.6	-39.1	-179.3	-63.8	178.6	-178.2	0	0	111.9	D176 T177	E173-D176 PolarHBondContact O-N 3.26Å; E173-T177 PolarHBondContact O-N 3.08Å; E173-T177 PolarHBondContact O-OG1 3.48Å
174	D	80.3	Confident	83.6	Confident	79 Å²	79	81.6 Å²	81.6	42%	0.422	38%	0.384	S	S	.	.	H	α-helix	trans	-69.8	-35.9	176.7	-66.4	-38.7	0	0	0	111.8	V166 S171 M172 D176 T177 L178	V166-D174 HydrophobicContact CG1-CB 3.48Å; V166-D174 VanDerWaalsContact CG1-CB 3.48Å; V166-D174 HydrophobicContact CG2-CB 4.48Å; S171-D174 VanDerWaalsContact CB-OD2 3.27Å; S171-D174 WeakPolarHBondContact CB-OD2 2.85Å; S171-D174 VanDerWaalsContact OG-CG 3.24Å; S171-D174 PolarHBondContact OG-OD2 3.18Å; M172-D174 VanDerWaalsContact C-N 3.32Å; M172-D174 PolarHBondContact O-N 3.43Å; D174-D176 VanDerWaalsContact C-N 3.34Å; D174-T177 PolarHBondContact O-N 2.8Å; D174-L178 WeakPolarHBondContact O-CG 3.23Å; D174-L178 PolarHBondContact O-N 3.45Å
175	L	82.3	Confident	83.9	Confident	12 Å²	12	79.9 Å²	79.9	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-62.6	-42.2	173.8	-71.1	172.6	0	0	0	111.1	M163 V166 Y167 S171 M172 T177 L178 R179	M163-L175 HydrophobicContact CB-CD2 4.26Å; M163-L175 HydrophobicContact CE-CB 4.14Å; M163-L175 HydrophobicContact CE-CD2 3.64Å; M163-L175 HydrophobicContact CE-CG 4.46Å; M163-L175 WeakPolarHBondContact O-CD2 3.42Å; M163-L175 HydrophobicContact SD-CB 4.37Å; M163-L175 HydrophobicContact SD-CD2 3.52Å; M163-L175 VanDerWaalsContact SD-CD2 3.52Å; V166-L175 HydrophobicContact CB-CD2 3.85Å; V166-L175 HydrophobicContact CB-CG 4.35Å; V166-L175 HydrophobicContact CG1-CD2 3.79Å; V166-L175 HydrophobicContact CG1-CG 3.73Å; Y167-L175 HydrophobicContact CD2-CD1 4.46Å; S171-L175 WeakPolarHBondContact O-CG 3.41Å; M172-L175 WeakPolarHBondContact O-CB 3.48Å; M172-L175 PolarHBondContact O-N 3.48Å; M172-L175 HydrophobicContact SD-CD1 4.3Å; L175-T177 VanDerWaalsContact C-N 3.32Å; L175-T177 PolarHBondContact O-N 3.13Å; L175-L178 PolarHBondContact O-N 3.33Å; L175-R179 WeakPolarHBondContact O-CG 3.43Å; L175-R179 PolarHBondContact O-N 2.9Å
176	D	85.4	Confident	84.4	Confident	78 Å²	78	81.6 Å²	81.6	42%	0.417	39%	0.385	S	S	.	.	H	α-helix	trans	-68.2	-34.2	178.7	-69.7	-24.3	0	0	0	112.1	M172 E173 D174 R179 A180	M172-D176 PolarHBondContact O-N 3.33Å; E173-D176 PolarHBondContact O-N 3.26Å; D174-D176 VanDerWaalsContact C-N 3.34Å; D176-R179 PolarHBondContact O-N 3.49Å; D176-R179 IonicContact OD1-CZ 3.67Å; D176-R179 IonicContact OD1-NH1 2.81Å; D176-R179 PolarHBondContact OD1-NH1 2.86Å; D176-A180 PolarHBondContact O-N 3.2Å
177	T	84.6	Confident	84.9	Confident	94 Å²	94	84.1 Å²	84.1	58%	0.577	40%	0.398	S	S	*	.	H	α-helix	trans	-64	-45.1	172.7	-58.2	0	0	0	0	111.5	E173 D174 L175 A180 F181	E173-T177 PolarHBondContact O-N 3.08Å; E173-T177 PolarHBondContact O-OG1 3.48Å; D174-T177 PolarHBondContact O-N 2.8Å; L175-T177 VanDerWaalsContact C-N 3.32Å; L175-T177 PolarHBondContact O-N 3.13Å; T177-A180 PolarHBondContact O-N 2.78Å; T177-F181 PolarHBondContact O-N 3.01Å
178	L	84.4	Confident	85.4	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.12	38%	0.379	C	S	.	.	H	α-helix	trans	-64.2	-41.2	175.9	-72.8	175.4	0	0	0	111.8	L162 M163 V166 D174 L175 A180 F181 F182	L162-L178 HydrophobicContact CB-CD1 4.06Å; L162-L178 HydrophobicContact CB-CD2 4.5Å; L162-L178 HydrophobicContact CD1-CD2 4.33Å; M163-L178 HydrophobicContact CG-CB 4.36Å; M163-L178 HydrophobicContact CG-CD1 4.19Å; M163-L178 HydrophobicContact SD-CB 3.37Å; M163-L178 WeakPolarHBondContact SD-CB 3.42Å; M163-L178 HydrophobicContact SD-CD1 3.64Å; M163-L178 HydrophobicContact SD-CG 4.17Å; V166-L178 HydrophobicContact CB-CD1 4.39Å; V166-L178 HydrophobicContact CG2-CD1 3.77Å; D174-L178 WeakPolarHBondContact O-CG 3.23Å; D174-L178 PolarHBondContact O-N 3.45Å; L175-L178 PolarHBondContact O-N 3.33Å; L178-A180 VanDerWaalsContact C-N 3.31Å; L178-A180 PolarHBondContact O-N 2.85Å; L178-F181 PolarHBondContact O-N 2.89Å; L178-F182 HydrophobicContact CD2-CE2 4.19Å; L178-F182 VanDerWaalsContact O-CD2 3.32Å; L178-F182 WeakPolarHBondContact O-CD2 3.44Å; L178-F182 PolarHBondContact O-N 2.94Å
179	R	87.6	Confident	86	Confident	82 Å²	82	73.2 Å²	73.2	31%	0.309	36%	0.358	S	S	.	.	H	α-helix	trans	-57.5	-44	173.1	-75.6	169.6	174.9	151.8	-1.8	112.1	M163 L175 D176 R183 D243	M163-R179 HydrophobicContact CE-CG 3.76Å; L175-R179 WeakPolarHBondContact O-CG 3.43Å; L175-R179 PolarHBondContact O-N 2.9Å; D176-R179 PolarHBondContact O-N 3.49Å; D176-R179 IonicContact OD1-CZ 3.67Å; D176-R179 IonicContact OD1-NH1 2.81Å; D176-R179 PolarHBondContact OD1-NH1 2.86Å; R179-R183 PolarHBondContact O-N 3.26Å; R179-R183 VanDerWaalsContact O-N 3.16Å; R179-D243 WeakPolarHBondContact CG-OD2 3.29Å; R179-D243 IonicContact CZ-OD2 3.97Å; R179-D243 IonicContact NE-OD1 3.94Å; R179-D243 IonicContact NE-OD2 2.76Å; R179-D243 PolarHBondContact NE-OD2 3.48Å; R179-D243 IonicContact NH2-OD1 3.61Å; R179-D243 PolarHBondContact NH2-OD1 3.38Å; R179-D243 IonicContact NH2-OD2 3.7Å
180	A	86.6	Confident	86.7	Confident	52 Å²	52	71.5 Å²	71.5	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-41.8	177.2	0	0	0	0	0	112	D176 T177 L178 R183	D176-A180 PolarHBondContact O-N 3.2Å; T177-A180 PolarHBondContact O-N 2.78Å; L178-A180 VanDerWaalsContact C-N 3.31Å; L178-A180 PolarHBondContact O-N 2.85Å; A180-R183 WeakPolarHBondContact O-CB 3.39Å
181	F	85.9	Confident	87.5	Confident	83 Å²	83	64.9 Å²	64.9	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-65	-42.6	178.4	-177.8	-94.9	0	0	0	112.6	L126 A129 T177 L178 R183	L126-F181 HydrophobicContact CB-CZ 4.45Å; L126-F181 HydrophobicContact CD2-CD1 3.96Å; L126-F181 HydrophobicContact CD2-CE1 3.47Å; L126-F181 VanDerWaalsContact CD2-CE1 3.47Å; L126-F181 HydrophobicContact CD2-CZ 4.06Å; L126-F181 WeakPolarHBondContact O-CZ 3.33Å; A129-F181 HydrophobicContact CB-CE1 3.83Å; A129-F181 HydrophobicContact CB-CZ 3.93Å; T177-F181 PolarHBondContact O-N 3.01Å; L178-F181 PolarHBondContact O-N 2.89Å; F181-R183 VanDerWaalsContact C-N 3.32Å; F181-R183 PolarHBondContact O-N 3.39Å
182	F	89.2	Confident	88.1	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.018	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	11	-177.2	-75.3	-74.5	0	0	0	114.2	L126 F133 I158 R159 L162 L178 E184 L185	L126-F182 HydrophobicContact CD2-CE2 3.93Å; L126-F182 HydrophobicContact CD2-CZ 3.63Å; F133-F182 AromaticContact CZ-CD1 3.92Å; F133-F182 HydrophobicContact CZ-CD1 3.92Å; F133-F182 HydrophobicContact CZ-CE1 4.41Å; I158-F182 HydrophobicContact CG2-CZ 4.21Å; R159-F182 HydrophobicContact CB-CB 4.46Å; R159-F182 HydrophobicContact CB-CD1 3.73Å; R159-F182 HydrophobicContact CB-CD2 3.85Å; R159-F182 HydrophobicContact CB-CE1 3.82Å; R159-F182 HydrophobicContact CB-CE2 3.93Å; R159-F182 HydrophobicContact CB-CG 3.75Å; R159-F182 HydrophobicContact CB-CZ 3.91Å; R159-F182 HydrophobicContact CG-CB 3.88Å; R159-F182 HydrophobicContact CG-CD1 4.1Å; R159-F182 HydrophobicContact CG-CD2 3.59Å; R159-F182 HydrophobicContact CG-CE2 4.1Å; R159-F182 HydrophobicContact CG-CG 3.59Å; L162-F182 HydrophobicContact CD1-CE2 4.27Å; L162-F182 HydrophobicContact CD1-CZ 4.37Å; L178-F182 HydrophobicContact CD2-CE2 4.19Å; L178-F182 VanDerWaalsContact O-CD2 3.32Å; L178-F182 WeakPolarHBondContact O-CD2 3.44Å; L178-F182 PolarHBondContact O-N 2.94Å; F182-E184 PolarHBondContact O-N 2.93Å; F182-E184 VanDerWaalsContact O-N 3.14Å; F182-L185 HydrophobicContact CB-CD1 4.21Å; F182-L185 HydrophobicContact CD1-CD1 3.7Å; F182-L185 HydrophobicContact CG-CD1 4.33Å; F182-L185 VanDerWaalsContact O-CB 3.3Å; F182-L185 WeakPolarHBondContact O-CB 3.32Å; F182-L185 PolarHBondContact O-N 3.49Å
183	R	89.4	Confident	88.9	Confident	147 Å²	147	63.4 Å²	63.4	56%	0.555	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-34.7	-178.2	-174	178.9	-66.6	165.8	0.8	113.3	R179 A180 F181 L185 E186	R179-R183 PolarHBondContact O-N 3.26Å; R179-R183 VanDerWaalsContact O-N 3.16Å; A180-R183 WeakPolarHBondContact O-CB 3.39Å; F181-R183 VanDerWaalsContact C-N 3.32Å; F181-R183 PolarHBondContact O-N 3.39Å; R183-L185 PolarHBondContact O-N 2.84Å; R183-L185 VanDerWaalsContact O-N 3.15Å; R183-E186 WeakPolarHBondContact O-CB 3.48Å; R183-E186 PolarHBondContact O-N 2.92Å
184	E	89.5	Confident	89.6	Confident	60 Å²	60	61.5 Å²	61.5	28%	0.28	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-22.5	177.2	-71.6	-56.4	133.3	0	0	113.7	F133 R137 F182 E186 N187 L188	F133-E184 HydrophobicContact CB-CB 4.45Å; F133-E184 HydrophobicContact CD1-CB 4.09Å; F133-E184 HydrophobicContact CD2-CB 4.02Å; F133-E184 HydrophobicContact CD2-CG 4.46Å; F133-E184 HydrophobicContact CE1-CB 4.4Å; F133-E184 HydrophobicContact CE2-CB 4.31Å; F133-E184 HydrophobicContact CG-CB 3.95Å; R137-E184 IonicContact NH2-OE2 2.73Å; R137-E184 PolarHBondContact NH2-OE2 2.85Å; F182-E184 PolarHBondContact O-N 2.93Å; F182-E184 VanDerWaalsContact O-N 3.14Å; E184-E186 VanDerWaalsContact C-N 3.27Å; E184-E186 PolarHBondContact O-N 2.75Å; E184-N187 VanDerWaalsContact CD-ND2 3.35Å; E184-N187 PolarHBondContact O-N 2.83Å; E184-N187 PolarHBondContact OE1-ND2 2.94Å; E184-N187 PolarHBondContact OE2-ND2 3.47Å; E184-L188 WeakPolarHBondContact O-CG 3.27Å; E184-L188 PolarHBondContact O-N 3.02Å
185	L	91.4	Very high	90.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-33	171.2	-78.4	171.9	0	0	0	112.5	F133 L155 E156 R159 F182 R183 L188 N189	F133-L185 HydrophobicContact CE1-CD1 4.48Å; F133-L185 HydrophobicContact CE1-CD2 4Å; F133-L185 HydrophobicContact CE1-CG 3.73Å; F133-L185 HydrophobicContact CZ-CG 4.43Å; L155-L185 HydrophobicContact CB-CD1 4.22Å; L155-L185 HydrophobicContact CB-CD2 3.74Å; L155-L185 HydrophobicContact CB-CG 4.38Å; L155-L185 HydrophobicContact CD1-CD2 4.28Å; E156-L185 HydrophobicContact CG-CD1 4Å; E156-L185 HydrophobicContact CG-CD2 4.07Å; R159-L185 HydrophobicContact CB-CD1 4.17Å; F182-L185 HydrophobicContact CB-CD1 4.21Å; F182-L185 HydrophobicContact CD1-CD1 3.7Å; F182-L185 HydrophobicContact CG-CD1 4.33Å; F182-L185 VanDerWaalsContact O-CB 3.3Å; F182-L185 WeakPolarHBondContact O-CB 3.32Å; F182-L185 PolarHBondContact O-N 3.49Å; R183-L185 PolarHBondContact O-N 2.84Å; R183-L185 VanDerWaalsContact O-N 3.15Å; L185-L188 HydrophobicContact CD2-CD1 4.5Å; L185-L188 PolarHBondContact O-N 3.4Å; L185-N189 VanDerWaalsContact O-CB 3.31Å; L185-N189 WeakPolarHBondContact O-CB 3.48Å; L185-N189 PolarHBondContact O-N 3.48Å; L185-N189 PolarHBondContact O-ND2 3.37Å
186	E	90.4	Very high	91	Very high	103 Å²	103	58.7 Å²	58.7	48%	0.481	28%	0.283	S	S	.	.	H	α-helix	trans	-63.9	-46	176.4	-60.4	179.2	177.9	0	0	109.7	R183 E184 L188 N189 D190	R183-E186 WeakPolarHBondContact O-CB 3.48Å; R183-E186 PolarHBondContact O-N 2.92Å; E184-E186 VanDerWaalsContact C-N 3.27Å; E184-E186 PolarHBondContact O-N 2.75Å; E186-L188 PolarHBondContact O-N 3.32Å; E186-N189 PolarHBondContact O-N 3.12Å; E186-D190 WeakPolarHBondContact O-CB 3.48Å; E186-D190 PolarHBondContact O-N 2.68Å
187	N	92.2	Very high	91.6	Very high	72 Å²	72	57.7 Å²	57.7	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-46.8	176.2	-64.2	-28.3	0	0	0	112.1	E184 N189 D190 M191	E184-N187 VanDerWaalsContact CD-ND2 3.35Å; E184-N187 PolarHBondContact O-N 2.83Å; E184-N187 PolarHBondContact OE1-ND2 2.94Å; E184-N187 PolarHBondContact OE2-ND2 3.47Å; N187-N189 VanDerWaalsContact C-N 3.34Å; N187-N189 PolarHBondContact O-N 3.03Å; N187-D190 PolarHBondContact O-N 2.92Å; N187-M191 VanDerWaalsContact O-CG 3.31Å; N187-M191 WeakPolarHBondContact O-CG 3.25Å; N187-M191 PolarHBondContact O-N 3.18Å
188	L	93.6	Very high	92.1	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-40	178.2	-67.9	173.3	0	0	0	111.8	F133 A136 R137 L140 M152 E184 L185 E186 M191 F192	F133-L188 HydrophobicContact CD1-CD1 3.96Å; A136-L188 HydrophobicContact CB-CD1 3.83Å; A136-L188 HydrophobicContact CB-CD2 4.32Å; R137-L188 HydrophobicContact CB-CD2 3.85Å; R137-L188 HydrophobicContact CG-CD2 4.43Å; L140-L188 HydrophobicContact CD1-CB 4.35Å; L140-L188 HydrophobicContact CD1-CD2 3.93Å; M152-L188 HydrophobicContact CE-CB 3.92Å; M152-L188 HydrophobicContact CG-CB 4.17Å; M152-L188 HydrophobicContact CG-CD1 4.22Å; M152-L188 HydrophobicContact SD-CB 4.14Å; E184-L188 WeakPolarHBondContact O-CG 3.27Å; E184-L188 PolarHBondContact O-N 3.02Å; L185-L188 HydrophobicContact CD2-CD1 4.5Å; L185-L188 PolarHBondContact O-N 3.4Å; E186-L188 PolarHBondContact O-N 3.32Å; L188-M191 HydrophobicContact CD2-SD 4.36Å; L188-M191 PolarHBondContact O-N 2.88Å; L188-F192 PolarHBondContact O-N 2.96Å; L188-F192 VanDerWaalsContact O-N 3.08Å
189	N	94.2	Very high	92.7	Very high	21 Å²	21	54.7 Å²	54.7	11%	0.112	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-43.2	173.9	-86.4	-69.2	0	0	0	111.6	M152 E156 L185 E186 N187 F192 R193 K247 W249	M152-N189 HydrophobicContact CE-CB 4.41Å; E156-N189 PolarHBondContact OE1-ND2 3.37Å; E156-N189 PolarHBondContact OE1-OD1 2.84Å; L185-N189 VanDerWaalsContact O-CB 3.31Å; L185-N189 WeakPolarHBondContact O-CB 3.48Å; L185-N189 PolarHBondContact O-N 3.48Å; L185-N189 PolarHBondContact O-ND2 3.37Å; E186-N189 PolarHBondContact O-N 3.12Å; N187-N189 VanDerWaalsContact C-N 3.34Å; N187-N189 PolarHBondContact O-N 3.03Å; N189-F192 PolarHBondContact O-N 3.46Å; N189-R193 VanDerWaalsContact O-CB 3.26Å; N189-R193 WeakPolarHBondContact O-CB 3.33Å; N189-R193 PolarHBondContact O-N 3.25Å; N189-K247 VanDerWaalsContact OD1-CE 3.24Å; N189-K247 WeakPolarHBondContact OD1-CE 3.4Å; N189-K247 PolarHBondContact OD1-NZ 2.91Å; N189-W249 WeakPolarHBondContact OD1-CZ2 3.23Å
190	D	94.3	Very high	93.1	Very high	94 Å²	94	50.9 Å²	50.9	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-66.3	-37.4	177.4	-81.2	-23.6	0	0	0	112.6	E186 N187 F192 R193 H194	E186-D190 WeakPolarHBondContact O-CB 3.48Å; E186-D190 PolarHBondContact O-N 2.68Å; N187-D190 PolarHBondContact O-N 2.92Å; D190-F192 VanDerWaalsContact C-N 3.35Å; D190-F192 PolarHBondContact O-N 3.03Å; D190-R193 WeakPolarHBondContact O-CB 3.33Å; D190-R193 PolarHBondContact O-N 3.01Å; D190-H194 WeakPolarHBondContact O-CB 3.34Å; D190-H194 PolarHBondContact O-N 3.38Å
191	M	94.4	Very high	93.5	Very high	53 Å²	53	51.1 Å²	51.1	26%	0.261	24%	0.244	S	C	.	.	H	α-helix	trans	-59.7	-45	171.6	-73.5	176	72	0	0	111.4	R137 L140 E141 N187 L188 H194 K195	R137-M191 HydrophobicContact CG-CE 4.06Å; R137-M191 HydrophobicContact CG-SD 4.15Å; L140-M191 HydrophobicContact CB-CE 4.34Å; L140-M191 HydrophobicContact CD1-CB 4.32Å; E141-M191 HydrophobicContact CG-CE 3.82Å; N187-M191 VanDerWaalsContact O-CG 3.31Å; N187-M191 WeakPolarHBondContact O-CG 3.25Å; N187-M191 PolarHBondContact O-N 3.18Å; L188-M191 HydrophobicContact CD2-SD 4.36Å; L188-M191 PolarHBondContact O-N 2.88Å; M191-H194 PolarHBondContact O-N 2.89Å; M191-K195 WeakPolarHBondContact O-CG 3.39Å; M191-K195 PolarHBondContact O-N 3.23Å; M191-K195 VanDerWaalsContact O-N 3.15Å
192	F	95.3	Very high	93.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.8	-154.6	-70.1	0	0	0	111.4	L140 L145 H149 L188 N189 D190 H194 K195 I196 V220 W249	L140-F192 HydrophobicContact CD2-CD2 3.62Å; L140-F192 HydrophobicContact CD2-CE2 4.1Å; L145-F192 HydrophobicContact CB-CE2 4.03Å; L145-F192 HydrophobicContact CB-CZ 4.23Å; L145-F192 HydrophobicContact CD1-CZ 4.18Å; L145-F192 HydrophobicContact CD2-CE2 4.05Å; L145-F192 HydrophobicContact CD2-CZ 4.39Å; L145-F192 HydrophobicContact CG-CE2 4.45Å; H149-F192 HydrophobicContact CB-CE2 4.32Å; L188-F192 PolarHBondContact O-N 2.96Å; L188-F192 VanDerWaalsContact O-N 3.08Å; N189-F192 PolarHBondContact O-N 3.46Å; D190-F192 VanDerWaalsContact C-N 3.35Å; D190-F192 PolarHBondContact O-N 3.03Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3.01Å; F192-K195 WeakPolarHBondContact O-CA 3.48Å; F192-K195 WeakPolarHBondContact O-CB 3.44Å; F192-K195 PolarHBondContact O-N 2.93Å; F192-I196 HydrophobicContact CD1-CD1 3.61Å; F192-I196 HydrophobicContact CD1-CG1 3.8Å; F192-I196 HydrophobicContact CE1-CD1 3.84Å; F192-I196 HydrophobicContact CE1-CG1 3.82Å; F192-I196 PolarHBondContact O-N 3.03Å; F192-V220 HydrophobicContact CE1-CB 4.23Å; F192-V220 HydrophobicContact CE1-CG1 3.72Å; F192-V220 HydrophobicContact CE2-CB 4.36Å; F192-V220 HydrophobicContact CE2-CG1 3.86Å; F192-V220 HydrophobicContact CE2-CG2 4.22Å; F192-V220 HydrophobicContact CZ-CB 3.63Å; F192-V220 HydrophobicContact CZ-CG1 3.34Å; F192-V220 HydrophobicContact CZ-CG2 3.85Å; F192-W249 HydrophobicContact CB-CH2 3.88Å; F192-W249 HydrophobicContact CB-CZ2 4.31Å; F192-W249 HydrophobicContact CB-CZ3 4.44Å; F192-W249 AromaticContact CD1-CE3 3.96Å; F192-W249 HydrophobicContact CD1-CE3 3.96Å; F192-W249 AromaticContact CD1-CH2 3.78Å; F192-W249 HydrophobicContact CD1-CH2 3.78Å; F192-W249 HydrophobicContact CD1-CZ2 4.47Å; F192-W249 AromaticContact CD1-CZ3 3.46Å; F192-W249 HydrophobicContact CD1-CZ3 3.46Å; F192-W249 VanDerWaalsContact CD1-CZ3 3.46Å; F192-W249 HydrophobicContact CD2-CZ3 4.49Å; F192-W249 HydrophobicContact CE1-CE3 4.17Å; F192-W249 AromaticContact CE1-CZ3 3.82Å; F192-W249 HydrophobicContact CE1-CZ3 3.82Å; F192-W249 AromaticContact CG-CH2 3.79Å; F192-W249 HydrophobicContact CG-CH2 3.79Å; F192-W249 AromaticContact CG-CZ3 3.87Å; F192-W249 HydrophobicContact CG-CZ3 3.87Å; F192-W249 HydrophobicContact CZ-CZ3 4.49Å
193	R	95.4	Very high	94.3	Very high	113 Å²	113	54.6 Å²	54.6	43%	0.426	26%	0.255	S	S	.	.	H	α-helix	trans	-53.5	-46.6	175.1	-169.3	-175.7	176.3	-90	-5.1	111	N189 D190 K195 I196 I197 L252	N189-R193 VanDerWaalsContact O-CB 3.26Å; N189-R193 WeakPolarHBondContact O-CB 3.33Å; N189-R193 PolarHBondContact O-N 3.25Å; D190-R193 WeakPolarHBondContact O-CB 3.33Å; D190-R193 PolarHBondContact O-N 3.01Å; R193-K195 PolarHBondContact O-N 3.42Å; R193-I196 WeakPolarHBondContact O-CB 3.39Å; R193-I196 PolarHBondContact O-N 3.15Å; R193-I197 HydrophobicContact CG-CD1 4.46Å; R193-I197 WeakPolarHBondContact O-CG1 3.3Å; R193-I197 PolarHBondContact O-N 3.42Å; R193-L252 HydrophobicContact CB-CD2 4.33Å; R193-L252 HydrophobicContact CG-CD2 3.39Å
194	H	95.9	Very high	94.4	Very high	119 Å²	119	48.8 Å²	48.8	55%	0.551	24%	0.236	S	C	*	.	H	α-helix	trans	-61.3	-42.4	175.8	-177.9	-89.8	0	0	0	111.8	D190 M191 F192 I196 I197 V198	D190-H194 WeakPolarHBondContact O-CB 3.34Å; D190-H194 PolarHBondContact O-N 3.38Å; M191-H194 PolarHBondContact O-N 2.89Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3.01Å; H194-I196 VanDerWaalsContact C-N 3.33Å; H194-I196 PolarHBondContact O-N 3.06Å; H194-I197 PolarHBondContact O-N 3.23Å; H194-V198 VanDerWaalsContact CE1-CG2 3.49Å; H194-V198 WeakPolarHBondContact CE1-CG2 3.49Å; H194-V198 WeakPolarHBondContact O-CG2 3.36Å; H194-V198 PolarHBondContact O-N 2.93Å
195	K	94.9	Very high	94.6	Very high	33 Å²	33	48.8 Å²	48.8	14%	0.143	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-37	175.2	-71.8	179.3	-174.4	-80.1	0	112.8	L140 L145 M191 F192 R193 V198 L199 F213	L140-K195 WeakPolarHBondContact O-CE 3.32Å; L140-K195 PolarHBondContact O-NZ 2.91Å; L145-K195 HydrophobicContact CD2-CD 3.74Å; M191-K195 WeakPolarHBondContact O-CG 3.39Å; M191-K195 PolarHBondContact O-N 3.23Å; M191-K195 VanDerWaalsContact O-N 3.15Å; F192-K195 WeakPolarHBondContact O-CA 3.48Å; F192-K195 WeakPolarHBondContact O-CB 3.44Å; F192-K195 PolarHBondContact O-N 2.93Å; R193-K195 PolarHBondContact O-N 3.42Å; K195-V198 PolarHBondContact O-N 3.48Å; K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.48Å; K195-F213 HydrophobicContact CB-CZ 4.24Å
196	I	96.9	Very high	94.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-43.1	173.4	-66.2	166.8	0	0	0	110.7	F192 R193 H194 L199 G200 I221 W249 L252 L253	F192-I196 HydrophobicContact CD1-CD1 3.61Å; F192-I196 HydrophobicContact CD1-CG1 3.8Å; F192-I196 HydrophobicContact CE1-CD1 3.84Å; F192-I196 HydrophobicContact CE1-CG1 3.82Å; F192-I196 PolarHBondContact O-N 3.03Å; R193-I196 WeakPolarHBondContact O-CB 3.39Å; R193-I196 PolarHBondContact O-N 3.15Å; H194-I196 VanDerWaalsContact C-N 3.33Å; H194-I196 PolarHBondContact O-N 3.06Å; I196-L199 WeakPolarHBondContact O-CB 3.47Å; I196-L199 PolarHBondContact O-N 3.31Å; I196-G200 PolarHBondContact O-N 3.35Å; I196-I221 HydrophobicContact CD1-CD1 4.46Å; I196-I221 HydrophobicContact CD1-CG1 4.22Å; I196-I221 HydrophobicContact CG1-CD1 4.4Å; I196-I221 HydrophobicContact CG2-CD1 4.41Å; I196-W249 HydrophobicContact CD1-CB 3.81Å; I196-W249 HydrophobicContact CD1-CD2 3.52Å; I196-W249 HydrophobicContact CD1-CE3 3.63Å; I196-W249 HydrophobicContact CD1-CG 3.61Å; I196-W249 HydrophobicContact CD1-CZ3 4.41Å; I196-L252 HydrophobicContact CB-CD2 4.05Å; I196-L252 HydrophobicContact CD1-CD2 4.3Å; I196-L252 HydrophobicContact CG2-CB 4.44Å; I196-L252 HydrophobicContact CG2-CD2 3.9Å; I196-L252 HydrophobicContact CG2-CG 4.07Å; I196-L253 HydrophobicContact CG2-CB 3.8Å; I196-L253 HydrophobicContact CG2-CD1 4.2Å
197	I	97.8	Very high	94.8	Very high	56 Å²	56	44.3 Å²	44.3	29%	0.287	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-43.4	177.2	-65.6	164.4	0	0	0	110.9	R193 H194 L199 G200 S201 L252 S256	R193-I197 HydrophobicContact CG-CD1 4.46Å; R193-I197 WeakPolarHBondContact O-CG1 3.3Å; R193-I197 PolarHBondContact O-N 3.42Å; H194-I197 PolarHBondContact O-N 3.23Å; I197-L199 VanDerWaalsContact C-N 3.32Å; I197-L199 PolarHBondContact O-N 2.85Å; I197-G200 PolarHBondContact O-N 3.12Å; I197-S201 WeakPolarHBondContact O-CB 3.48Å; I197-S201 PolarHBondContact O-N 2.88Å; I197-S201 PolarHBondContact O-OG 3.47Å; I197-L252 HydrophobicContact CD1-CD1 4.21Å; I197-L252 HydrophobicContact CG1-CD1 3.99Å; I197-L252 HydrophobicContact CG1-CD2 4.38Å; I197-L252 HydrophobicContact CG1-CG 4.21Å; I197-S256 PolarHBondContact O-OG 2.89Å
198	V	95.6	Very high	94.8	Very high	51 Å²	51	45.5 Å²	45.5	31%	0.309	23%	0.228	S	C	.	.	H	α-helix	trans	-63.2	-41.3	176.1	173.9	0	0	0	0	110.7	H194 K195 S201 R202	H194-V198 VanDerWaalsContact CE1-CG2 3.49Å; H194-V198 WeakPolarHBondContact CE1-CG2 3.49Å; H194-V198 WeakPolarHBondContact O-CG2 3.36Å; H194-V198 PolarHBondContact O-N 2.93Å; K195-V198 PolarHBondContact O-N 3.48Å; V198-S201 PolarHBondContact O-N 3.44Å; V198-S201 PolarHBondContact O-OG 3.42Å; V198-R202 PolarHBondContact O-N 2.68Å
199	L	95.6	Very high	94.8	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-51.6	174.9	176.2	58.8	0	0	0	111.7	K195 I196 I197 S201 R202 L203 A206 F213 V214 C217 L253	K195-L199 WeakPolarHBondContact O-CB 3.39Å; K195-L199 PolarHBondContact O-N 3.48Å; I196-L199 WeakPolarHBondContact O-CB 3.47Å; I196-L199 PolarHBondContact O-N 3.31Å; I197-L199 VanDerWaalsContact C-N 3.32Å; I197-L199 PolarHBondContact O-N 2.85Å; L199-S201 VanDerWaalsContact C-N 3.29Å; L199-S201 PolarHBondContact O-N 3.02Å; L199-R202 CarbonylContact O-C 3.58Å; L199-R202 PolarHBondContact O-N 3.4Å; L199-R202 VanDerWaalsContact O-N 3.11Å; L199-L203 HydrophobicContact CD1-CD1 4.06Å; L199-L203 HydrophobicContact CG-CD1 4.44Å; L199-L203 VanDerWaalsContact O-CA 3.29Å; L199-L203 WeakPolarHBondContact O-CA 3.49Å; L199-L203 PolarHBondContact O-N 3.05Å; L199-A206 HydrophobicContact CD1-CB 3.84Å; L199-F213 HydrophobicContact CB-CE1 4.11Å; L199-F213 HydrophobicContact CD1-CD1 4.26Å; L199-F213 HydrophobicContact CD1-CE1 4.29Å; L199-V214 HydrophobicContact CD1-CB 4.43Å; L199-V214 HydrophobicContact CD1-CG1 4.47Å; L199-V214 HydrophobicContact CD1-CG2 3.8Å; L199-C217 HydrophobicContact CD2-CB 3.59Å; L199-C217 VanDerWaalsContact CD2-SG 3.5Å; L199-L253 HydrophobicContact CD2-CD1 4.19Å; L199-L253 HydrophobicContact CG-CD1 4.17Å
200	G	95.9	Very high	94.7	Very high	2 Å²	2	53.9 Å²	53.9	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-59	-42.7	-178.7	0	0	0	0	0	111.8	I196 I197 R202 L203 S256	I196-G200 PolarHBondContact O-N 3.35Å; I197-G200 PolarHBondContact O-N 3.12Å; G200-R202 PolarHBondContact O-N 2.94Å; G200-L203 PolarHBondContact O-N 3.25Å; G200-S256 WeakPolarHBondContact CA-OG 3.46Å
201	S	95.4	Very high	94.5	Very high	57 Å²	57	52.9 Å²	52.9	40%	0.399	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-18.5	178.5	68.8	0	0	0	0	115	I197 V198 L199 S256	I197-S201 WeakPolarHBondContact O-CB 3.48Å; I197-S201 PolarHBondContact O-N 2.88Å; I197-S201 PolarHBondContact O-OG 3.47Å; V198-S201 PolarHBondContact O-N 3.44Å; V198-S201 PolarHBondContact O-OG 3.42Å; L199-S201 VanDerWaalsContact C-N 3.29Å; L199-S201 PolarHBondContact O-N 3.02Å; S201-S256 PolarHBondContact N-OG 2.86Å; S201-S256 VanDerWaalsContact N-OG 3.16Å
202	R	95	Very high	94.3	Very high	157 Å²	157	59.2 Å²	59.2	59%	0.592	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	19.8	-176.6	-60.7	-179.6	-179.7	179.7	0.4	112.5	V198 L199 G200 T204 S205 A206	V198-R202 PolarHBondContact O-N 2.68Å; L199-R202 CarbonylContact O-C 3.58Å; L199-R202 PolarHBondContact O-N 3.4Å; L199-R202 VanDerWaalsContact O-N 3.11Å; G200-R202 PolarHBondContact O-N 2.94Å; R202-T204 VanDerWaalsContact C-N 3.33Å; R202-T204 PolarHBondContact O-N 3.02Å; R202-S205 PolarHBondContact O-N 3.46Å; R202-S205 PolarHBondContact O-OG 2.89Å; R202-A206 VanDerWaalsContact O-CB 3.23Å; R202-A206 WeakPolarHBondContact O-CB 3.48Å; R202-A206 PolarHBondContact O-N 2.98Å
203	L	96.2	Very high	94.2	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.016	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-44.7	-166	-179.1	60.9	0	0	0	112.7	L199 G200 S205 A206 V207 V214 I257 F305 F315	L199-L203 HydrophobicContact CD1-CD1 4.06Å; L199-L203 HydrophobicContact CG-CD1 4.44Å; L199-L203 VanDerWaalsContact O-CA 3.29Å; L199-L203 WeakPolarHBondContact O-CA 3.49Å; L199-L203 PolarHBondContact O-N 3.05Å; G200-L203 PolarHBondContact O-N 3.25Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 2.83Å; L203-A206 PolarHBondContact O-N 2.96Å; L203-V207 HydrophobicContact CD1-CG1 3.84Å; L203-V207 HydrophobicContact CG-CG1 4.38Å; L203-V207 WeakPolarHBondContact O-CG2 3.28Å; L203-V207 PolarHBondContact O-N 2.99Å; L203-V214 HydrophobicContact CD1-CG1 4.12Å; L203-I257 HydrophobicContact CB-CG1 4.36Å; L203-I257 HydrophobicContact CD2-CD1 3.45Å; L203-I257 VanDerWaalsContact CD2-CD1 3.45Å; L203-I257 HydrophobicContact CD2-CG1 3.95Å; L203-F305 HydrophobicContact CD1-CE2 4Å; L203-F305 HydrophobicContact CD1-CZ 3.85Å; L203-F305 HydrophobicContact CD2-CE2 4.27Å; L203-F305 HydrophobicContact CD2-CZ 3.91Å; L203-F315 HydrophobicContact CD2-CE2 3.84Å; L203-F315 HydrophobicContact CD2-CZ 3.87Å; L203-F315 HydrophobicContact CG-CZ 4.49Å
204	T	92.4	Very high	94.2	Very high	26 Å²	26	55.3 Å²	55.3	16%	0.16	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-30.9	-176.2	53.1	0	0	0	0	113.5	R202 V207 D293 F315	R202-T204 VanDerWaalsContact C-N 3.33Å; R202-T204 PolarHBondContact O-N 3.02Å; T204-V207 WeakPolarHBondContact O-CG2 3.37Å; T204-D293 HydrophobicContact CG2-CB 4.11Å; T204-F315 HydrophobicContact CG2-CE1 3.77Å; T204-F315 HydrophobicContact CG2-CZ 4.06Å
205	S	93.7	Very high	94.1	Very high	59 Å²	59	51.2 Å²	51.2	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-85.2	-36	171.7	62.1	0	0	0	0	112.1	R202 L203 V207 I208 T209	R202-S205 PolarHBondContact O-N 3.46Å; R202-S205 PolarHBondContact O-OG 2.89Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 2.83Å; S205-V207 PolarHBondContact O-N 3.4Å; S205-I208 PolarHBondContact O-N 2.82Å; S205-T209 PolarHBondContact O-N 3.14Å; S205-T209 PolarHBondContact O-OG1 3.35Å
206	A	93.8	Very high	94.1	Very high	8 Å²	8	50.2 Å²	50.2	7%	0.066	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-36.1	-179	0	0	0	0	0	112.6	L199 R202 L203 I208 T209 H210 N211 V214	L199-A206 HydrophobicContact CD1-CB 3.84Å; R202-A206 VanDerWaalsContact O-CB 3.23Å; R202-A206 WeakPolarHBondContact O-CB 3.48Å; R202-A206 PolarHBondContact O-N 2.98Å; L203-A206 PolarHBondContact O-N 2.96Å; A206-I208 PolarHBondContact O-N 3.24Å; A206-T209 PolarHBondContact O-N 3.4Å; A206-H210 CarbonylContact O-C 3.57Å; A206-H210 WeakPolarHBondContact O-CA 3.3Å; A206-H210 PolarHBondContact O-N 3.17Å; A206-N211 PolarHBondContact O-N 3.4Å; A206-V214 HydrophobicContact CB-CG2 3.96Å
207	V	93.3	Very high	94	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-23	175.9	-71.6	0	0	0	0	113.4	L203 T204 S205 V214 I296 I300 Y304	L203-V207 HydrophobicContact CD1-CG1 3.84Å; L203-V207 HydrophobicContact CG-CG1 4.38Å; L203-V207 WeakPolarHBondContact O-CG2 3.28Å; L203-V207 PolarHBondContact O-N 2.99Å; T204-V207 WeakPolarHBondContact O-CG2 3.37Å; S205-V207 PolarHBondContact O-N 3.4Å; V207-V214 HydrophobicContact CG1-CG1 4.11Å; V207-V214 HydrophobicContact CG1-CG2 4.25Å; V207-I296 HydrophobicContact CG2-CG2 3.57Å; V207-I300 HydrophobicContact CB-CG2 4.06Å; V207-I300 HydrophobicContact CG2-CG2 4.02Å; V207-Y304 HydrophobicContact CB-CD2 4.14Å; V207-Y304 HydrophobicContact CB-CE2 4.15Å; V207-Y304 HydrophobicContact CG1-CD2 4.07Å; V207-Y304 WeakPolarHBondContact O-CE2 3.41Å
208	I	92.3	Very high	93.9	Very high	98 Å²	98	47.8 Å²	47.8	50%	0.503	24%	0.242	S	C	.	.	H	α-helix	trans	-91.6	-47.5	178	-60.3	168.8	0	0	0	110.3	S205 A206 I296 I300	S205-I208 PolarHBondContact O-N 2.82Å; A206-I208 PolarHBondContact O-N 3.24Å; I208-I296 HydrophobicContact CD1-CD1 4.17Å; I208-I300 HydrophobicContact CD1-CD1 4.42Å; I208-I300 HydrophobicContact CG1-CD1 4.15Å
209	T	93.5	Very high	93.9	Very high	89 Å²	89	52 Å²	52	55%	0.546	25%	0.252	S	S	.	.	H	α-helix	trans	-91.1	-32.6	-169.3	52.9	0	0	0	0	114	S205 A206	S205-T209 PolarHBondContact O-N 3.14Å; S205-T209 PolarHBondContact O-OG1 3.35Å; A206-T209 PolarHBondContact O-N 3.4Å
210	H	90.8	Very high	93.9	Very high	110 Å²	110	51.9 Å²	51.9	51%	0.509	25%	0.251	S	S	.	.			trans	-132.1	42.8	-171.6	-58.9	87.5	0	0	0	111.6	A206 R212 F213 V214	A206-H210 CarbonylContact O-C 3.57Å; A206-H210 WeakPolarHBondContact O-CA 3.3Å; A206-H210 PolarHBondContact O-N 3.17Å; H210-R212 VanDerWaalsContact C-N 3.31Å; H210-R212 PolarHBondContact O-N 3.01Å; H210-R212 VanDerWaalsContact O-N 3.17Å; H210-F213 HydrophobicContact CB-CB 4.18Å; H210-F213 WeakPolarHBondContact O-CB 3.49Å; H210-F213 PolarHBondContact O-N 3.45Å; H210-V214 PolarHBondContact O-N 3.31Å
211	N	89.8	Confident	93.9	Very high	73 Å²	73	51.8 Å²	51.8	39%	0.39	25%	0.251	S	S	.	.	H	α-helix	trans	-52.1	-40.6	-173.4	54.2	35.1	0	0	0	114.6	A206 F213 V214 V215 Y304	A206-N211 PolarHBondContact O-N 3.4Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.17Å; N211-V214 WeakPolarHBondContact O-CB 3.3Å; N211-V214 PolarHBondContact O-N 2.98Å; N211-V215 WeakPolarHBondContact O-CG2 3.38Å; N211-V215 PolarHBondContact O-N 3.38Å; N211-Y304 HydrophobicContact CB-CE1 3.84Å; N211-Y304 HydrophobicContact CB-CE2 4.27Å; N211-Y304 WeakPolarHBondContact CB-OH 3.34Å
212	R	91.6	Very high	93.9	Very high	186 Å²	186	51 Å²	51	70%	0.702	24%	0.242	S	C	*	.	H	α-helix	trans	-62.2	-39.5	177.6	-176.1	176.5	177.2	176.6	-2.8	111.9	H210 N216	H210-R212 VanDerWaalsContact C-N 3.31Å; H210-R212 PolarHBondContact O-N 3.01Å; H210-R212 VanDerWaalsContact O-N 3.17Å; R212-N216 VanDerWaalsContact O-CB 3.3Å; R212-N216 WeakPolarHBondContact O-CB 3.4Å; R212-N216 PolarHBondContact O-N 3.21Å; R212-N216 PolarHBondContact O-ND2 3.18Å
213	F	92.8	Very high	93.9	Very high	30 Å²	30	48.8 Å²	48.8	13%	0.132	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-44.2	176.2	179.5	-93.3	0	0	0	110.8	E143 L145 K195 L199 H210 N211 N216 C217	E143-F213 HydrophobicContact CB-CD2 4.29Å; E143-F213 HydrophobicContact CB-CE2 4.45Å; E143-F213 HydrophobicContact CG-CE2 4.42Å; L145-F213 HydrophobicContact CD1-CD2 3.82Å; L145-F213 HydrophobicContact CD1-CE2 3.62Å; L145-F213 HydrophobicContact CD1-CG 4.47Å; L145-F213 HydrophobicContact CD1-CZ 4.1Å; L145-F213 HydrophobicContact CD2-CE2 4.02Å; L145-F213 HydrophobicContact CG-CD2 4.25Å; L145-F213 HydrophobicContact CG-CE2 4.04Å; K195-F213 HydrophobicContact CB-CZ 4.24Å; L199-F213 HydrophobicContact CB-CE1 4.11Å; L199-F213 HydrophobicContact CD1-CD1 4.26Å; L199-F213 HydrophobicContact CD1-CE1 4.29Å; H210-F213 HydrophobicContact CB-CB 4.18Å; H210-F213 WeakPolarHBondContact O-CB 3.49Å; H210-F213 PolarHBondContact O-N 3.45Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.17Å; F213-N216 PolarHBondContact O-N 2.79Å; F213-C217 VanDerWaalsContact O-CB 3.29Å; F213-C217 WeakPolarHBondContact O-CB 3.14Å; F213-C217 PolarHBondContact O-N 2.86Å
214	V	94.2	Very high	93.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-53.2	175.8	-174.9	0	0	0	0	111	L199 L203 A206 V207 H210 N211 N216 C217 V218 F305	L199-V214 HydrophobicContact CD1-CB 4.43Å; L199-V214 HydrophobicContact CD1-CG1 4.47Å; L199-V214 HydrophobicContact CD1-CG2 3.8Å; L203-V214 HydrophobicContact CD1-CG1 4.12Å; A206-V214 HydrophobicContact CB-CG2 3.96Å; V207-V214 HydrophobicContact CG1-CG1 4.11Å; V207-V214 HydrophobicContact CG1-CG2 4.25Å; H210-V214 PolarHBondContact O-N 3.31Å; N211-V214 WeakPolarHBondContact O-CB 3.3Å; N211-V214 PolarHBondContact O-N 2.98Å; V214-N216 VanDerWaalsContact C-N 3.33Å; V214-N216 PolarHBondContact O-N 2.89Å; V214-C217 PolarHBondContact O-N 2.98Å; V214-V218 HydrophobicContact CG1-CG2 4.34Å; V214-V218 WeakPolarHBondContact O-CG2 3.41Å; V214-V218 PolarHBondContact O-N 3.42Å; V214-F305 HydrophobicContact CG1-CE2 3.99Å; V214-F305 HydrophobicContact CG1-CZ 4.28Å
215	V	94.3	Very high	94	Very high	33 Å²	33	49.9 Å²	49.9	20%	0.2	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-43.5	-178.5	173.1	0	0	0	0	111.5	N211 V218 R219 Y304	N211-V215 WeakPolarHBondContact O-CG2 3.38Å; N211-V215 PolarHBondContact O-N 3.38Å; V215-V218 PolarHBondContact O-N 3.48Å; V215-R219 HydrophobicContact CG1-CG 4.49Å; V215-R219 WeakPolarHBondContact O-CB 3.48Å; V215-R219 VanDerWaalsContact O-CG 3.25Å; V215-R219 WeakPolarHBondContact O-CG 3.47Å; V215-R219 PolarHBondContact O-N 2.88Å; V215-Y304 HydrophobicContact CG2-CD1 3.29Å; V215-Y304 HydrophobicContact CG2-CE1 4.13Å; V215-Y304 HydrophobicContact CG2-CG 3.95Å
216	N	94.7	Very high	94	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.07	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-42.7	178.4	-74.5	-10.2	0	0	0	111.6	L145 L146 R212 F213 V214 R219 V220	L145-N216 HydrophobicContact CB-CB 4.35Å; L145-N216 HydrophobicContact CD1-CB 4.39Å; L146-N216 HydrophobicContact CD1-CB 4.5Å; L146-N216 WeakPolarHBondContact CD1-OD1 3.03Å; L146-N216 HydrophobicContact CG-CB 4.13Å; R212-N216 VanDerWaalsContact O-CB 3.3Å; R212-N216 WeakPolarHBondContact O-CB 3.4Å; R212-N216 PolarHBondContact O-N 3.21Å; R212-N216 PolarHBondContact O-ND2 3.18Å; F213-N216 PolarHBondContact O-N 2.79Å; V214-N216 VanDerWaalsContact C-N 3.33Å; V214-N216 PolarHBondContact O-N 2.89Å; N216-R219 PolarHBondContact O-N 3.28Å; N216-V220 WeakPolarHBondContact O-CG2 3.34Å; N216-V220 PolarHBondContact O-N 2.85Å
217	C	95.4	Very high	94	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-46.9	176.4	-170.1	0	0	0	0	111.5	L145 L199 F213 V214 R219 V220 I221	L145-C217 HydrophobicContact CD1-CB 3.86Å; L199-C217 HydrophobicContact CD2-CB 3.59Å; L199-C217 VanDerWaalsContact CD2-SG 3.5Å; F213-C217 VanDerWaalsContact O-CB 3.29Å; F213-C217 WeakPolarHBondContact O-CB 3.14Å; F213-C217 PolarHBondContact O-N 2.86Å; V214-C217 PolarHBondContact O-N 2.98Å; C217-R219 VanDerWaalsContact C-N 3.32Å; C217-R219 PolarHBondContact O-N 3.32Å; C217-V220 PolarHBondContact O-N 2.89Å; C217-V220 VanDerWaalsContact O-N 3.12Å; C217-I221 WeakPolarHBondContact O-CG1 3.33Å; C217-I221 PolarHBondContact O-N 3.48Å
218	V	95.4	Very high	94.1	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.03	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-40.2	177.2	173	0	0	0	0	111.7	V214 V215 V220 I221 D222 F305 P306	V214-V218 HydrophobicContact CG1-CG2 4.34Å; V214-V218 WeakPolarHBondContact O-CG2 3.41Å; V214-V218 PolarHBondContact O-N 3.42Å; V215-V218 PolarHBondContact O-N 3.48Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 3.02Å; V218-I221 PolarHBondContact O-N 3.41Å; V218-D222 PolarHBondContact O-N 2.89Å; V218-F305 HydrophobicContact CG1-CD1 4.41Å; V218-F305 HydrophobicContact CG2-CD1 3.96Å; V218-F305 HydrophobicContact CG2-CE1 3.59Å; V218-F305 HydrophobicContact CG2-CE2 4.4Å; V218-F305 HydrophobicContact CG2-CZ 3.84Å; V218-P306 HydrophobicContact CG1-CG 4.36Å
219	R	95.4	Very high	94.1	Very high	140 Å²	140	52.1 Å²	52.1	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-62.1	-40.8	174.4	-76.2	172.4	176.8	-173.5	-0.5	112.5	L146 V215 N216 C217 R223	L146-R219 HydrophobicContact CD2-CB 4.21Å; V215-R219 HydrophobicContact CG1-CG 4.49Å; V215-R219 WeakPolarHBondContact O-CB 3.48Å; V215-R219 VanDerWaalsContact O-CG 3.25Å; V215-R219 WeakPolarHBondContact O-CG 3.47Å; V215-R219 PolarHBondContact O-N 2.88Å; N216-R219 PolarHBondContact O-N 3.28Å; C217-R219 VanDerWaalsContact C-N 3.32Å; C217-R219 PolarHBondContact O-N 3.32Å; R219-R223 WeakPolarHBondContact O-CG 3.47Å; R219-R223 PolarHBondContact O-N 3.4Å; R219-R223 VanDerWaalsContact O-N 3.12Å
220	V	96	Very high	94	Very high	0 Å²	0	52 Å²	52	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-45.3	175.8	170.1	0	0	0	0	110.4	L146 H149 F192 N216 C217 V218 D222 R223 E224 W249	L146-V220 HydrophobicContact CD2-CG2 3.94Å; H149-V220 HydrophobicContact CB-CG1 4.11Å; H149-V220 HydrophobicContact CB-CG2 3.77Å; H149-V220 VanDerWaalsContact CD2-CG1 3.4Å; H149-V220 WeakPolarHBondContact CD2-CG1 3.29Å; H149-V220 VanDerWaalsContact CG-CG1 3.49Å; F192-V220 HydrophobicContact CE1-CB 4.23Å; F192-V220 HydrophobicContact CE1-CG1 3.72Å; F192-V220 HydrophobicContact CE2-CB 4.36Å; F192-V220 HydrophobicContact CE2-CG1 3.86Å; F192-V220 HydrophobicContact CE2-CG2 4.22Å; F192-V220 HydrophobicContact CZ-CB 3.63Å; F192-V220 HydrophobicContact CZ-CG1 3.34Å; F192-V220 HydrophobicContact CZ-CG2 3.85Å; N216-V220 WeakPolarHBondContact O-CG2 3.34Å; N216-V220 PolarHBondContact O-N 2.85Å; C217-V220 PolarHBondContact O-N 2.89Å; C217-V220 VanDerWaalsContact O-N 3.12Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 3.02Å; V220-D222 VanDerWaalsContact C-N 3.35Å; V220-D222 PolarHBondContact O-N 3.46Å; V220-R223 WeakPolarHBondContact O-CB 3.45Å; V220-R223 PolarHBondContact O-N 2.99Å; V220-E224 HydrophobicContact CG1-CG 4.33Å; V220-E224 WeakPolarHBondContact O-CG 3.38Å; V220-E224 PolarHBondContact O-N 2.89Å; V220-W249 HydrophobicContact CG1-CE3 4.15Å; V220-W249 HydrophobicContact CG1-CZ3 3.66Å
221	I	96.8	Very high	94	Very high	0 Å²	0	48 Å²	48	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-48	176.7	-67.6	169.6	0	0	0	110.7	I196 C217 V218 R223 E224 E225 W249 K250 L253 Y309	I196-I221 HydrophobicContact CD1-CD1 4.46Å; I196-I221 HydrophobicContact CD1-CG1 4.22Å; I196-I221 HydrophobicContact CG1-CD1 4.4Å; I196-I221 HydrophobicContact CG2-CD1 4.41Å; C217-I221 WeakPolarHBondContact O-CG1 3.33Å; C217-I221 PolarHBondContact O-N 3.48Å; V218-I221 PolarHBondContact O-N 3.41Å; I221-R223 VanDerWaalsContact C-N 3.32Å; I221-R223 PolarHBondContact O-N 3.42Å; I221-E224 PolarHBondContact O-N 3.22Å; I221-E224 VanDerWaalsContact O-N 3.13Å; I221-E225 HydrophobicContact CG2-CG 4.24Å; I221-E225 WeakPolarHBondContact O-CG 3.3Å; I221-E225 PolarHBondContact O-N 3.19Å; I221-W249 HydrophobicContact CG1-CB 4.16Å; I221-W249 HydrophobicContact CG2-CB 4.37Å; I221-K250 HydrophobicContact CG2-CB 3.76Å; I221-L253 HydrophobicContact CD1-CB 4.11Å; I221-L253 HydrophobicContact CD1-CD2 3.78Å; I221-L253 HydrophobicContact CD1-CG 4.44Å; I221-Y309 WeakPolarHBondContact CG2-OH 3.36Å
222	D	94.7	Very high	94.1	Very high	40 Å²	40	50 Å²	50	21%	0.214	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-38.1	179.7	-176.2	49.2	0	0	0	112.4	V218 V220 E224 R226	V218-D222 PolarHBondContact O-N 2.89Å; V220-D222 VanDerWaalsContact C-N 3.35Å; V220-D222 PolarHBondContact O-N 3.46Å; D222-E224 VanDerWaalsContact C-N 3.34Å; D222-R226 VanDerWaalsContact O-CG 3.26Å; D222-R226 WeakPolarHBondContact O-CG 3.38Å; D222-R226 PolarHBondContact O-N 3.4Å; D222-R226 VanDerWaalsContact O-N 3.1Å; D222-R226 IonicContact OD1-NE 2.73Å; D222-R226 IonicContact OD1-NH2 2.7Å; D222-R226 IonicContact OD2-CZ 3.64Å; D222-R226 IonicContact OD2-NE 2.89Å; D222-R226 PolarHBondContact OD2-NE 3.18Å; D222-R226 VanDerWaalsContact OD2-NE 3.11Å; D222-R226 IonicContact OD2-NH2 2.91Å; D222-R226 PolarHBondContact OD2-NH2 3.21Å
223	R	94.6	Very high	94	Very high	110 Å²	110	47.5 Å²	47.5	42%	0.415	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-43.8	172.6	-73.4	174.3	179.7	-175.1	-1	111.4	R219 V220 I221 R226 T227	R219-R223 WeakPolarHBondContact O-CG 3.47Å; R219-R223 PolarHBondContact O-N 3.4Å; R219-R223 VanDerWaalsContact O-N 3.12Å; V220-R223 WeakPolarHBondContact O-CB 3.45Å; V220-R223 PolarHBondContact O-N 2.99Å; I221-R223 VanDerWaalsContact C-N 3.32Å; I221-R223 PolarHBondContact O-N 3.42Å; R223-R226 PolarHBondContact O-N 3.25Å; R223-T227 PolarHBondContact O-N 3.07Å; R223-T227 PolarHBondContact O-OG1 2.86Å
224	E	95.5	Very high	93.8	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-67.6	-39.6	-179.7	-74.9	-69.8	176.6	0	0	112.9	H149 V220 I221 D222 R226 T227 D228 R245 K247 W249	H149-E224 IonicContact CD2-OE1 3.69Å; H149-E224 IonicContact CE1-OE1 2.95Å; H149-E224 IonicContact NE2-OE1 2.76Å; H149-E224 PolarHBondContact NE2-OE1 2.88Å; V220-E224 HydrophobicContact CG1-CG 4.33Å; V220-E224 WeakPolarHBondContact O-CG 3.38Å; V220-E224 PolarHBondContact O-N 2.89Å; I221-E224 PolarHBondContact O-N 3.22Å; I221-E224 VanDerWaalsContact O-N 3.13Å; D222-E224 VanDerWaalsContact C-N 3.34Å; E224-R226 VanDerWaalsContact C-N 3.32Å; E224-R226 PolarHBondContact O-N 3.06Å; E224-T227 PolarHBondContact O-N 3.09Å; E224-D228 WeakPolarHBondContact O-CB 3.5Å; E224-D228 PolarHBondContact O-N 2.94Å; E224-R245 IonicContact OE1-NH2 3.24Å; E224-R245 IonicContact OE2-CZ 3.96Å; E224-R245 IonicContact OE2-NH1 3.75Å; E224-R245 PolarHBondContact OE2-NH1 3.23Å; E224-R245 IonicContact OE2-NH2 3.7Å; E224-R245 PolarHBondContact OE2-NH2 2.87Å; E224-K247 IonicContact OE1-NZ 3.18Å; E224-K247 PolarHBondContact OE1-NZ 3.39Å; E224-K247 WeakPolarHBondContact OE2-CD 3.47Å; E224-K247 IonicContact OE2-NZ 3.62Å; E224-K247 PolarHBondContact OE2-NZ 3.49Å; E224-W249 HydrophobicContact CB-CE3 4.06Å; E224-W249 HydrophobicContact CG-CD2 4.38Å; E224-W249 HydrophobicContact CG-CE3 3.62Å; E224-W249 HydrophobicContact CG-CH2 4.36Å; E224-W249 HydrophobicContact CG-CZ3 3.61Å
225	E	95	Very high	93.6	Very high	52 Å²	52	53.5 Å²	53.5	24%	0.243	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-36.8	174.6	-68.3	-65.9	146.5	0	0	111.8	I221 D228 A229 Q248 W249 K250	I221-E225 HydrophobicContact CG2-CG 4.24Å; I221-E225 WeakPolarHBondContact O-CG 3.3Å; I221-E225 PolarHBondContact O-N 3.19Å; E225-D228 PolarHBondContact O-N 2.97Å; E225-A229 WeakPolarHBondContact O-CB 3.46Å; E225-A229 PolarHBondContact O-N 3.23Å; E225-Q248 WeakPolarHBondContact OE1-CA 3.43Å; E225-W249 PolarHBondContact OE1-N 3.35Å; E225-K250 HydrophobicContact CG-CB 3.78Å; E225-K250 VanDerWaalsContact OE1-CB 3.27Å; E225-K250 WeakPolarHBondContact OE1-CB 3.23Å; E225-K250 PolarHBondContact OE1-N 2.9Å
226	R	94.5	Very high	93.3	Very high	153 Å²	153	59 Å²	59	58%	0.577	26%	0.26	S	S	*	.	H	α-helix	trans	-66.2	-41.2	172.8	-69.5	171.6	-165.8	-158.2	4.4	111.7	D222 R223 E224 A229 N230	D222-R226 VanDerWaalsContact O-CG 3.26Å; D222-R226 WeakPolarHBondContact O-CG 3.38Å; D222-R226 PolarHBondContact O-N 3.4Å; D222-R226 VanDerWaalsContact O-N 3.1Å; D222-R226 IonicContact OD1-NE 2.73Å; D222-R226 IonicContact OD1-NH2 2.7Å; D222-R226 IonicContact OD2-CZ 3.64Å; D222-R226 IonicContact OD2-NE 2.89Å; D222-R226 PolarHBondContact OD2-NE 3.18Å; D222-R226 VanDerWaalsContact OD2-NE 3.11Å; D222-R226 IonicContact OD2-NH2 2.91Å; D222-R226 PolarHBondContact OD2-NH2 3.21Å; R223-R226 PolarHBondContact O-N 3.25Å; E224-R226 VanDerWaalsContact C-N 3.32Å; E224-R226 PolarHBondContact O-N 3.06Å; R226-A229 PolarHBondContact O-N 3.42Å; R226-N230 VanDerWaalsContact O-CG 3.26Å; R226-N230 PolarHBondContact O-N 3.01Å; R226-N230 PolarHBondContact O-ND2 3.38Å
227	T	93	Very high	92.9	Very high	25 Å²	25	66.5 Å²	66.5	15%	0.153	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-42.7	176.6	-58	0	0	0	0	111	R223 E224 A229 N230 W231	R223-T227 PolarHBondContact O-N 3.07Å; R223-T227 PolarHBondContact O-OG1 2.86Å; E224-T227 PolarHBondContact O-N 3.09Å; T227-A229 VanDerWaalsContact C-N 3.34Å; T227-A229 PolarHBondContact O-N 3.44Å; T227-N230 PolarHBondContact O-N 2.87Å; T227-W231 PolarHBondContact O-N 2.98Å
228	D	94.8	Very high	92.1	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.011	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-42.1	172.6	-79.3	-10	0	0	0	111.9	E224 E225 N230 W231 R232 R245 P246 K247 Q248	E224-D228 WeakPolarHBondContact O-CB 3.5Å; E224-D228 PolarHBondContact O-N 2.94Å; E225-D228 PolarHBondContact O-N 2.97Å; D228-N230 VanDerWaalsContact C-N 3.35Å; D228-N230 PolarHBondContact O-N 3.25Å; D228-W231 PolarHBondContact O-N 3.27Å; D228-R232 WeakPolarHBondContact O-CB 3.23Å; D228-R232 PolarHBondContact O-N 2.82Å; D228-R245 IonicContact OD1-CZ 2.86Å; D228-R245 IonicContact OD1-NH1 2.77Å; D228-R245 PolarHBondContact OD1-NH1 2.92Å; D228-P246 HydrophobicContact CB-CB 4.15Å; D228-P246 WeakPolarHBondContact OD1-CA 3.48Å; D228-K247 PolarHBondContact OD1-N 3.05Å; D228-K247 PolarHBondContact OD2-N 2.72Å; D228-Q248 PolarHBondContact OD2-N 3.17Å; D228-Q248 VanDerWaalsContact OD2-N 3.08Å
229	A	93.6	Very high	91.6	Very high	32 Å²	32	73.9 Å²	73.9	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-37.6	176.4	0	0	0	0	0	112.6	E225 R226 T227 K233	E225-A229 WeakPolarHBondContact O-CB 3.46Å; E225-A229 PolarHBondContact O-N 3.23Å; R226-A229 PolarHBondContact O-N 3.42Å; T227-A229 VanDerWaalsContact C-N 3.34Å; T227-A229 PolarHBondContact O-N 3.44Å; A229-K233 WeakPolarHBondContact O-CG 3.37Å; A229-K233 PolarHBondContact O-N 3.48Å
230	N	91.6	Very high	91.1	Very high	88 Å²	88	67.9 Å²	67.9	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-67.9	-43.7	175.5	-72	-25.9	0	0	0	111.6	R226 T227 D228 K233 R234	R226-N230 VanDerWaalsContact O-CG 3.26Å; R226-N230 PolarHBondContact O-N 3.01Å; R226-N230 PolarHBondContact O-ND2 3.38Å; T227-N230 PolarHBondContact O-N 2.87Å; D228-N230 VanDerWaalsContact C-N 3.35Å; D228-N230 PolarHBondContact O-N 3.25Å; N230-K233 PolarHBondContact O-N 3.23Å; N230-R234 WeakPolarHBondContact O-CG 3.36Å; N230-R234 PolarHBondContact O-N 2.96Å
231	W	90	Very high	90.8	Very high	25 Å²	25	70.8 Å²	70.8	10%	0.095	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-36.8	176.8	-83.4	117.7	0	0	0	112.7	D160 T227 D228 K233 R234 S235 F240 M241 P242	D160-W231 HydrophobicContact CB-CH2 3.97Å; D160-W231 HydrophobicContact CB-CZ2 3.55Å; T227-W231 PolarHBondContact O-N 2.98Å; D228-W231 PolarHBondContact O-N 3.27Å; W231-K233 VanDerWaalsContact C-N 3.35Å; W231-K233 PolarHBondContact O-N 3.35Å; W231-R234 HydrophobicContact CE3-CB 4.08Å; W231-R234 HydrophobicContact CZ3-CB 4.46Å; W231-R234 PolarHBondContact O-N 3.44Å; W231-S235 VanDerWaalsContact O-CB 3.26Å; W231-S235 WeakPolarHBondContact O-CB 3.34Å; W231-S235 PolarHBondContact O-N 3.05Å; W231-F240 HydrophobicContact CH2-CE1 4.28Å; W231-F240 AromaticContact CZ3-CD1 3.98Å; W231-F240 HydrophobicContact CZ3-CD1 3.98Å; W231-F240 HydrophobicContact CZ3-CE1 4.13Å; W231-M241 HydrophobicContact CB-SD 3.98Å; W231-P242 HydrophobicContact CD2-CG 3.54Å; W231-P242 VanDerWaalsContact CE2-CG 3.47Å; W231-P242 HydrophobicContact CE3-CG 3.73Å; W231-P242 HydrophobicContact CG-CG 4.15Å; W231-P242 HydrophobicContact CH2-CG 3.79Å; W231-P242 HydrophobicContact CZ2-CG 3.62Å; W231-P242 HydrophobicContact CZ3-CG 3.85Å
232	R	91.4	Very high	90.4	Very high	116 Å²	116	71 Å²	71	44%	0.438	33%	0.333	S	S	.	.	H	α-helix	trans	-55.2	-49.8	171.8	-170.1	179.1	-62	115.1	4.9	111.5	D228 R234 S235 E236	D228-R232 WeakPolarHBondContact O-CB 3.23Å; D228-R232 PolarHBondContact O-N 2.82Å; R232-R234 VanDerWaalsContact C-N 3.33Å; R232-R234 PolarHBondContact O-N 3.48Å; R232-S235 PolarHBondContact O-N 3.16Å; R232-E236 WeakPolarHBondContact O-CG 3.49Å; R232-E236 PolarHBondContact O-N 3.46Å
233	K	91.1	Very high	89.9	Confident	133 Å²	133	71.6 Å²	71.6	58%	0.578	34%	0.337	S	S	*	.	H	α-helix	trans	-64.2	-33.7	177.3	-68	175.9	-177.6	177	0	113.5	A229 N230 W231	A229-K233 WeakPolarHBondContact O-CG 3.37Å; A229-K233 PolarHBondContact O-N 3.48Å; N230-K233 PolarHBondContact O-N 3.23Å; W231-K233 VanDerWaalsContact C-N 3.35Å; W231-K233 PolarHBondContact O-N 3.35Å
234	R	88.5	Confident	89.5	Confident	128 Å²	128	69.5 Å²	69.5	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-73.1	-41.1	176.2	-72.8	179.8	-179.4	-167	-0.7	111.5	N230 W231 R232 E236 K237 H238	N230-R234 WeakPolarHBondContact O-CG 3.36Å; N230-R234 PolarHBondContact O-N 2.96Å; W231-R234 HydrophobicContact CE3-CB 4.08Å; W231-R234 HydrophobicContact CZ3-CB 4.46Å; W231-R234 PolarHBondContact O-N 3.44Å; R232-R234 VanDerWaalsContact C-N 3.33Å; R232-R234 PolarHBondContact O-N 3.48Å; R234-E236 VanDerWaalsContact C-N 3.34Å; R234-K237 PolarHBondContact O-N 2.91Å; R234-K237 VanDerWaalsContact O-N 3.07Å; R234-H238 PolarHBondContact O-CD2 3.38Å; R234-H238 PolarHBondContact O-N 3.11Å
235	S	88.6	Confident	89.3	Confident	28 Å²	28	70.4 Å²	70.4	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-63.7	-39.9	178.8	-170.3	0	0	0	0	111.6	W231 R232 K237 H238 G239 F240	W231-S235 VanDerWaalsContact O-CB 3.26Å; W231-S235 WeakPolarHBondContact O-CB 3.34Å; W231-S235 PolarHBondContact O-N 3.05Å; R232-S235 PolarHBondContact O-N 3.16Å; S235-K237 PolarHBondContact O-N 3.21Å; S235-K237 VanDerWaalsContact O-N 3.14Å; S235-H238 PolarHBondContact O-N 3.28Å; S235-G239 VanDerWaalsContact O-CA 3.3Å; S235-G239 WeakPolarHBondContact O-CA 3.2Å; S235-G239 PolarHBondContact O-N 3.12Å; S235-F240 VanDerWaalsContact CA-O 3.25Å; S235-F240 WeakPolarHBondContact CA-O 3.32Å; S235-F240 WeakPolarHBondContact CB-O 3.41Å; S235-F240 PolarHBondContact OG-O 2.89Å
236	E	89.5	Confident	89.2	Confident	148 Å²	148	70.6 Å²	70.6	69%	0.692	36%	0.359	S	S	*	.	H	α-helix	trans	-57	-28.6	172.2	-73.6	165.7	-170.5	0	0	113.4	R232 R234	R232-E236 WeakPolarHBondContact O-CG 3.49Å; R232-E236 PolarHBondContact O-N 3.46Å; R234-E236 VanDerWaalsContact C-N 3.34Å
237	K	85.6	Confident	89.2	Confident	170 Å²	170	64.7 Å²	64.7	74%	0.739	34%	0.337	S	S	*	.	H	α-helix	trans	-90.5	-38	179.8	-68.4	-178.8	178.8	-176.8	0	113.9	R234 S235	R234-K237 PolarHBondContact O-N 2.91Å; R234-K237 VanDerWaalsContact O-N 3.07Å; S235-K237 PolarHBondContact O-N 3.21Å; S235-K237 VanDerWaalsContact O-N 3.14Å
238	H	79.3	Confident	89.3	Confident	107 Å²	107	67.7 Å²	67.7	50%	0.495	35%	0.35	S	S	.	.	H	α-helix	trans	-117.1	-7.4	-168.2	-57.5	-59.1	0	0	0	114.3	F164 R234 S235 F240	F164-H238 HydrophobicContact CE2-CB 3.77Å; F164-H238 HydrophobicContact CZ-CB 4.1Å; F164-H238 AromaticContact CZ-CG 3.89Å; R234-H238 PolarHBondContact O-CD2 3.38Å; R234-H238 PolarHBondContact O-N 3.11Å; S235-H238 PolarHBondContact O-N 3.28Å; H238-F240 PolarHBondContact O-N 3.5Å
239	G	83.1	Confident	89.4	Confident	53 Å²	53	68.1 Å²	68.1	55%	0.546	35%	0.351	S	S	.	.	S	Bend	trans	72.1	-0	-176.7	0	0	0	0	0	115	S235	S235-G239 VanDerWaalsContact O-CA 3.3Å; S235-G239 WeakPolarHBondContact O-CA 3.2Å; S235-G239 PolarHBondContact O-N 3.12Å
240	F	86.1	Confident	89.5	Confident	15 Å²	15	68.8 Å²	68.8	7%	0.066	35%	0.348	C	S	.	.			trans	-96.2	135.7	-179.4	178.7	-102.8	0	0	0	111.7	M163 F164 Y167 W231 S235 H238 P242	M163-F240 HydrophobicContact CB-CE2 4.33Å; M163-F240 HydrophobicContact CB-CZ 3.78Å; F164-F240 HydrophobicContact CB-CD1 4.01Å; F164-F240 HydrophobicContact CB-CE1 3.83Å; F164-F240 HydrophobicContact CB-CZ 4.33Å; F164-F240 HydrophobicContact CD2-CB 3.78Å; F164-F240 AromaticContact CD2-CD1 3.55Å; F164-F240 HydrophobicContact CD2-CD1 3.55Å; F164-F240 HydrophobicContact CD2-CE1 4.26Å; F164-F240 AromaticContact CD2-CG 3.7Å; F164-F240 HydrophobicContact CD2-CG 3.7Å; F164-F240 HydrophobicContact CE2-CB 4.03Å; F164-F240 HydrophobicContact CE2-CD1 4.47Å; F164-F240 HydrophobicContact CE2-CG 4.45Å; F164-F240 HydrophobicContact CG-CD1 4.2Å; Y167-F240 HydrophobicContact CD1-CB 3.92Å; Y167-F240 AromaticContact CD1-CD2 3.82Å; Y167-F240 HydrophobicContact CD1-CD2 3.82Å; Y167-F240 HydrophobicContact CD1-CG 4.22Å; Y167-F240 AromaticContact CD2-CD2 3.96Å; Y167-F240 HydrophobicContact CD2-CD2 3.96Å; Y167-F240 HydrophobicContact CE1-CB 3.97Å; Y167-F240 HydrophobicContact CE1-CD2 4.38Å; Y167-F240 HydrophobicContact CE2-CD2 4.5Å; Y167-F240 AromaticContact CG-CD2 3.59Å; Y167-F240 HydrophobicContact CG-CD2 3.59Å; Y167-F240 HydrophobicContact CG-CE2 4.23Å; Y167-F240 HydrophobicContact CG-CG 4.42Å; W231-F240 HydrophobicContact CH2-CE1 4.28Å; W231-F240 AromaticContact CZ3-CD1 3.98Å; W231-F240 HydrophobicContact CZ3-CD1 3.98Å; W231-F240 HydrophobicContact CZ3-CE1 4.13Å; S235-F240 VanDerWaalsContact CA-O 3.25Å; S235-F240 WeakPolarHBondContact CA-O 3.32Å; S235-F240 WeakPolarHBondContact CB-O 3.41Å; S235-F240 PolarHBondContact OG-O 2.89Å; H238-F240 PolarHBondContact O-N 3.5Å; F240-P242 HydrophobicContact CE1-CG 4.04Å
241	M	89.4	Confident	89.7	Confident	60 Å²	60	70.1 Å²	70.1	30%	0.296	35%	0.35	S	S	.	.			trans	-131.6	130.1	170.3	-178.8	64.9	72.7	0	0	108	W231 R245	W231-M241 HydrophobicContact CB-SD 3.98Å; M241-R245 HydrophobicContact CG-CB 4.4Å; M241-R245 WeakPolarHBondContact CG-O 3.29Å; M241-R245 HydrophobicContact SD-CB 3.86Å
242	P	87.9	Confident	90.1	Very high	4 Å²	4	70.1 Å²	70.1	3%	0.026	35%	0.352	C	S	.	.			trans	-59.6	149.2	174.7	-26.6	35	0	0	0	113.8	D160 W231 F240 G244 R245	D160-P242 HydrophobicContact CB-CB 4.32Å; D160-P242 HydrophobicContact CB-CG 4.01Å; D160-P242 VanDerWaalsContact CG-CB 3.48Å; D160-P242 WeakPolarHBondContact OD1-CB 3.28Å; D160-P242 WeakPolarHBondContact OD2-CB 3.43Å; D160-P242 WeakPolarHBondContact OD2-CG 3.47Å; W231-P242 HydrophobicContact CD2-CG 3.54Å; W231-P242 VanDerWaalsContact CE2-CG 3.47Å; W231-P242 HydrophobicContact CE3-CG 3.73Å; W231-P242 HydrophobicContact CG-CG 4.15Å; W231-P242 HydrophobicContact CH2-CG 3.79Å; W231-P242 HydrophobicContact CZ2-CG 3.62Å; W231-P242 HydrophobicContact CZ3-CG 3.85Å; F240-P242 HydrophobicContact CE1-CG 4.04Å; P242-G244 PolarHBondContact O-N 3.31Å; P242-R245 PolarHBondContact O-N 2.81Å
243	D	85.4	Confident	90.4	Very high	53 Å²	53	64.6 Å²	64.6	28%	0.283	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.1	174.2	-63.9	-24.7	0	0	0	110	R159 R179	R159-D243 PolarHBondContact NH2-O 2.98Å; R179-D243 WeakPolarHBondContact CG-OD2 3.29Å; R179-D243 IonicContact CZ-OD2 3.97Å; R179-D243 IonicContact NE-OD1 3.94Å; R179-D243 IonicContact NE-OD2 2.76Å; R179-D243 PolarHBondContact NE-OD2 3.48Å; R179-D243 IonicContact NH2-OD1 3.61Å; R179-D243 PolarHBondContact NH2-OD1 3.38Å; R179-D243 IonicContact NH2-OD2 3.7Å
244	G	86.4	Confident	90.7	Very high	67 Å²	67	59.4 Å²	59.4	69%	0.691	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	0.6	-177.5	0	0	0	0	0	115.8	P242	P242-G244 PolarHBondContact O-N 3.31Å
245	R	90.6	Very high	91.2	Very high	19 Å²	19	56.9 Å²	56.9	7%	0.072	30%	0.304	C	S	.	.			trans	-108.1	147.3	175.8	-71.8	-164.8	-178.3	-86.6	-5.9	113.3	E156 E224 D228 M241 P242 K247	E156-R245 IonicContact OE2-CZ 2.77Å; E156-R245 IonicContact OE2-NH2 3.44Å; E156-R245 PolarHBondContact OE2-NH2 3.48Å; E224-R245 IonicContact OE1-NH2 3.24Å; E224-R245 IonicContact OE2-CZ 3.96Å; E224-R245 IonicContact OE2-NH1 3.75Å; E224-R245 PolarHBondContact OE2-NH1 3.23Å; E224-R245 IonicContact OE2-NH2 3.7Å; E224-R245 PolarHBondContact OE2-NH2 2.87Å; D228-R245 IonicContact OD1-CZ 2.86Å; D228-R245 IonicContact OD1-NH1 2.77Å; D228-R245 PolarHBondContact OD1-NH1 2.92Å; M241-R245 HydrophobicContact CG-CB 4.4Å; M241-R245 WeakPolarHBondContact CG-O 3.29Å; M241-R245 HydrophobicContact SD-CB 3.86Å; P242-R245 PolarHBondContact O-N 2.81Å; R245-K247 HydrophobicContact CG-CG 4.27Å
246	P	92	Very high	91.6	Very high	56 Å²	56	56 Å²	56	36%	0.364	30%	0.298	S	S	.	.			cis	-72.8	141	-1.3	31.4	-35.3	0	0	0	112.2	D228 Q248	D228-P246 HydrophobicContact CB-CB 4.15Å; D228-P246 WeakPolarHBondContact OD1-CA 3.48Å; P246-Q248 HydrophobicContact CB-CG 4.04Å; P246-Q248 HydrophobicContact CG-CG 4.1Å
247	K	94.4	Very high	92	Very high	29 Å²	29	49.1 Å²	49.1	13%	0.126	27%	0.266	C	S	.	.			trans	-73.3	-32.1	179.7	-68.8	-168.4	-170.2	176.8	0	112.6	E156 N189 E224 D228 R245 W249	E156-K247 WeakPolarHBondContact OE1-CE 3.33Å; E156-K247 IonicContact OE1-NZ 2.7Å; E156-K247 PolarHBondContact OE1-NZ 2.94Å; E156-K247 IonicContact OE2-NZ 3.9Å; E156-K247 PolarHBondContact OE2-NZ 3.46Å; N189-K247 VanDerWaalsContact OD1-CE 3.24Å; N189-K247 WeakPolarHBondContact OD1-CE 3.4Å; N189-K247 PolarHBondContact OD1-NZ 2.91Å; E224-K247 IonicContact OE1-NZ 3.18Å; E224-K247 PolarHBondContact OE1-NZ 3.39Å; E224-K247 WeakPolarHBondContact OE2-CD 3.47Å; E224-K247 IonicContact OE2-NZ 3.62Å; E224-K247 PolarHBondContact OE2-NZ 3.49Å; D228-K247 PolarHBondContact OD1-N 3.05Å; D228-K247 PolarHBondContact OD2-N 2.72Å; R245-K247 HydrophobicContact CG-CG 4.27Å; K247-W249 HydrophobicContact CB-CD2 4.44Å; K247-W249 HydrophobicContact CB-CG 4.14Å; K247-W249 HydrophobicContact CD-CD2 4.29Å; K247-W249 HydrophobicContact CD-CH2 4.24Å; K247-W249 HydrophobicContact CD-CZ2 3.62Å; K247-W249 PolarHBondContact O-N 3.21Å
248	Q	95.3	Very high	92.7	Very high	89 Å²	89	42.5 Å²	42.5	42%	0.416	24%	0.237	S	C	.	.			trans	52.1	38.9	178.7	-54.5	-172.5	-35.1	0	0	113.8	E225 D228 P246 K250 K251 L252	E225-Q248 WeakPolarHBondContact OE1-CA 3.43Å; D228-Q248 PolarHBondContact OD2-N 3.17Å; D228-Q248 VanDerWaalsContact OD2-N 3.08Å; P246-Q248 HydrophobicContact CB-CG 4.04Å; P246-Q248 HydrophobicContact CG-CG 4.1Å; Q248-K250 PolarHBondContact O-N 3.35Å; Q248-K251 HydrophobicContact CB-CB 4.18Å; Q248-K251 WeakPolarHBondContact O-CB 3.44Å; Q248-K251 PolarHBondContact O-N 3.3Å; Q248-L252 PolarHBondContact O-N 3.44Å
249	W	96.7	Very high	93.5	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.038	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-25.5	-175.4	-76.5	1.8	0	0	0	113.3	N189 F192 I196 V220 I221 E224 E225 K247 L252 L253	N189-W249 WeakPolarHBondContact OD1-CZ2 3.23Å; F192-W249 HydrophobicContact CB-CH2 3.88Å; F192-W249 HydrophobicContact CB-CZ2 4.31Å; F192-W249 HydrophobicContact CB-CZ3 4.44Å; F192-W249 AromaticContact CD1-CE3 3.96Å; F192-W249 HydrophobicContact CD1-CE3 3.96Å; F192-W249 AromaticContact CD1-CH2 3.78Å; F192-W249 HydrophobicContact CD1-CH2 3.78Å; F192-W249 HydrophobicContact CD1-CZ2 4.47Å; F192-W249 AromaticContact CD1-CZ3 3.46Å; F192-W249 HydrophobicContact CD1-CZ3 3.46Å; F192-W249 VanDerWaalsContact CD1-CZ3 3.46Å; F192-W249 HydrophobicContact CD2-CZ3 4.49Å; F192-W249 HydrophobicContact CE1-CE3 4.17Å; F192-W249 AromaticContact CE1-CZ3 3.82Å; F192-W249 HydrophobicContact CE1-CZ3 3.82Å; F192-W249 AromaticContact CG-CH2 3.79Å; F192-W249 HydrophobicContact CG-CH2 3.79Å; F192-W249 AromaticContact CG-CZ3 3.87Å; F192-W249 HydrophobicContact CG-CZ3 3.87Å; F192-W249 HydrophobicContact CZ-CZ3 4.49Å; I196-W249 HydrophobicContact CD1-CB 3.81Å; I196-W249 HydrophobicContact CD1-CD2 3.52Å; I196-W249 HydrophobicContact CD1-CE3 3.63Å; I196-W249 HydrophobicContact CD1-CG 3.61Å; I196-W249 HydrophobicContact CD1-CZ3 4.41Å; V220-W249 HydrophobicContact CG1-CE3 4.15Å; V220-W249 HydrophobicContact CG1-CZ3 3.66Å; I221-W249 HydrophobicContact CG1-CB 4.16Å; I221-W249 HydrophobicContact CG2-CB 4.37Å; E224-W249 HydrophobicContact CB-CE3 4.06Å; E224-W249 HydrophobicContact CG-CD2 4.38Å; E224-W249 HydrophobicContact CG-CE3 3.62Å; E224-W249 HydrophobicContact CG-CH2 4.36Å; E224-W249 HydrophobicContact CG-CZ3 3.61Å; E225-W249 PolarHBondContact OE1-N 3.35Å; K247-W249 HydrophobicContact CB-CD2 4.44Å; K247-W249 HydrophobicContact CB-CG 4.14Å; K247-W249 HydrophobicContact CD-CD2 4.29Å; K247-W249 HydrophobicContact CD-CH2 4.24Å; K247-W249 HydrophobicContact CD-CZ2 3.62Å; K247-W249 PolarHBondContact O-N 3.21Å; W249-L252 PolarHBondContact O-N 2.72Å; W249-L253 PolarHBondContact O-N 2.89Å
250	K	96.3	Very high	94.2	Very high	46 Å²	46	40 Å²	40	20%	0.2	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-44.8	171	-175.7	170.5	-179.2	171	0	110.8	I221 E225 Q248 L253 F254 D308 Y309	I221-K250 HydrophobicContact CG2-CB 3.76Å; E225-K250 HydrophobicContact CG-CB 3.78Å; E225-K250 VanDerWaalsContact OE1-CB 3.27Å; E225-K250 WeakPolarHBondContact OE1-CB 3.23Å; E225-K250 PolarHBondContact OE1-N 2.9Å; Q248-K250 PolarHBondContact O-N 3.35Å; K250-L253 PolarHBondContact O-N 3.04Å; K250-F254 HydrophobicContact CD-CE2 4.36Å; K250-F254 HydrophobicContact CG-CD2 3.97Å; K250-F254 HydrophobicContact CG-CE2 3.67Å; K250-F254 WeakPolarHBondContact O-CD2 3.38Å; K250-F254 PolarHBondContact O-N 3.38Å; K250-D308 IonicContact NZ-OD2 2.83Å; K250-D308 PolarHBondContact NZ-OD2 3Å; K250-Y309 HydrophobicContact CD-CE1 3.98Å; K250-Y309 HydrophobicContact CD-CE2 4.12Å; K250-Y309 HydrophobicContact CG-CE1 3.93Å
251	K	96.5	Very high	94.7	Very high	116 Å²	116	39.5 Å²	39.5	50%	0.504	22%	0.217	S	C	.	.	H	α-helix	trans	-62.1	-45.7	175.1	-176.9	-175.3	172.4	-173.7	0	110.9	Q248 L253 F254 D255	Q248-K251 HydrophobicContact CB-CB 4.18Å; Q248-K251 WeakPolarHBondContact O-CB 3.44Å; Q248-K251 PolarHBondContact O-N 3.3Å; K251-L253 VanDerWaalsContact C-N 3.31Å; K251-L253 PolarHBondContact O-N 3.26Å; K251-F254 PolarHBondContact O-N 2.78Å; K251-F254 VanDerWaalsContact O-N 3.14Å; K251-D255 WeakPolarHBondContact CE-OD2 3.27Å; K251-D255 WeakPolarHBondContact O-CB 3.34Å; K251-D255 VanDerWaalsContact O-CG 3.3Å; K251-D255 PolarHBondContact O-N 2.94Å
252	L	97.9	Very high	95.1	Very high	26 Å²	26	39.5 Å²	39.5	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-56.3	-44.2	177.6	-179.2	71.1	0	0	0	112.8	R193 I196 I197 Q248 W249 S256	R193-L252 HydrophobicContact CB-CD2 4.33Å; R193-L252 HydrophobicContact CG-CD2 3.39Å; I196-L252 HydrophobicContact CB-CD2 4.05Å; I196-L252 HydrophobicContact CD1-CD2 4.3Å; I196-L252 HydrophobicContact CG2-CB 4.44Å; I196-L252 HydrophobicContact CG2-CD2 3.9Å; I196-L252 HydrophobicContact CG2-CG 4.07Å; I197-L252 HydrophobicContact CD1-CD1 4.21Å; I197-L252 HydrophobicContact CG1-CD1 3.99Å; I197-L252 HydrophobicContact CG1-CD2 4.38Å; I197-L252 HydrophobicContact CG1-CG 4.21Å; Q248-L252 PolarHBondContact O-N 3.44Å; W249-L252 PolarHBondContact O-N 2.72Å; L252-S256 WeakPolarHBondContact O-CB 3.44Å; L252-S256 PolarHBondContact O-N 3.3Å
253	L	97.6	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-49.6	176.2	177	64.4	0	0	0	110.7	I196 L199 I221 W249 K250 K251 S256 I257 F305	I196-L253 HydrophobicContact CG2-CB 3.8Å; I196-L253 HydrophobicContact CG2-CD1 4.2Å; L199-L253 HydrophobicContact CD2-CD1 4.19Å; L199-L253 HydrophobicContact CG-CD1 4.17Å; I221-L253 HydrophobicContact CD1-CB 4.11Å; I221-L253 HydrophobicContact CD1-CD2 3.78Å; I221-L253 HydrophobicContact CD1-CG 4.44Å; W249-L253 PolarHBondContact O-N 2.89Å; K250-L253 PolarHBondContact O-N 3.04Å; K251-L253 VanDerWaalsContact C-N 3.31Å; K251-L253 PolarHBondContact O-N 3.26Å; L253-S256 WeakPolarHBondContact O-CB 3.45Å; L253-S256 PolarHBondContact O-N 3.15Å; L253-I257 HydrophobicContact CD1-CD1 4.24Å; L253-I257 HydrophobicContact CG-CD1 3.97Å; L253-I257 VanDerWaalsContact O-CG1 3.28Å; L253-I257 WeakPolarHBondContact O-CG1 3.31Å; L253-I257 PolarHBondContact O-N 2.93Å; L253-F305 HydrophobicContact CD2-CE1 3.95Å; L253-F305 HydrophobicContact CD2-CZ 4.43Å
254	F	97.8	Very high	95.8	Very high	24 Å²	24	45.2 Å²	45.2	11%	0.105	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-179.5	-75.8	-59.1	0	0	0	113.1	K250 K251 S256 I257 F258 Y309 I311 R314 M318	K250-F254 HydrophobicContact CD-CE2 4.36Å; K250-F254 HydrophobicContact CG-CD2 3.97Å; K250-F254 HydrophobicContact CG-CE2 3.67Å; K250-F254 WeakPolarHBondContact O-CD2 3.38Å; K250-F254 PolarHBondContact O-N 3.38Å; K251-F254 PolarHBondContact O-N 2.78Å; K251-F254 VanDerWaalsContact O-N 3.14Å; F254-S256 VanDerWaalsContact C-N 3.26Å; F254-S256 PolarHBondContact O-N 3.21Å; F254-I257 HydrophobicContact CD1-CD1 4.1Å; F254-I257 PolarHBondContact O-N 3.48Å; F254-F258 WeakPolarHBondContact O-CB 3.31Å; F254-F258 PolarHBondContact O-N 3.48Å; F254-Y309 AromaticContact CE2-CD1 3.99Å; F254-Y309 HydrophobicContact CE2-CD1 3.99Å; F254-Y309 HydrophobicContact CE2-CE1 4.43Å; F254-Y309 AromaticContact CZ-CD1 3.7Å; F254-Y309 HydrophobicContact CZ-CD1 3.7Å; F254-Y309 HydrophobicContact CZ-CG 4.38Å; F254-I311 HydrophobicContact CE1-CD1 3.75Å; F254-I311 HydrophobicContact CZ-CD1 4.39Å; F254-R314 HydrophobicContact CD1-CB 4.43Å; F254-R314 HydrophobicContact CE1-CB 3.94Å; F254-R314 HydrophobicContact CE1-CG 3.91Å; F254-R314 HydrophobicContact CZ-CG 4.14Å; F254-M318 HydrophobicContact CB-CE 3.66Å; F254-M318 HydrophobicContact CD1-CE 3.54Å; F254-M318 HydrophobicContact CG-CE 4.01Å; F254-M318 VanDerWaalsContact O-CE 3.29Å; F254-M318 WeakPolarHBondContact O-CE 3.27Å
255	D	98.2	Very high	96.2	Very high	74 Å²	74	42.1 Å²	42.1	40%	0.396	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-38.6	174.7	-70.3	-13.9	0	0	0	110.6	K251 N259	K251-D255 WeakPolarHBondContact CE-OD2 3.27Å; K251-D255 WeakPolarHBondContact O-CB 3.34Å; K251-D255 VanDerWaalsContact O-CG 3.3Å; K251-D255 PolarHBondContact O-N 2.94Å; D255-N259 WeakPolarHBondContact O-CB 3.5Å; D255-N259 VanDerWaalsContact O-CG 3.24Å; D255-N259 PolarHBondContact O-N 3.07Å; D255-N259 PolarHBondContact O-ND2 3.34Å
256	S	98.1	Very high	96.3	Very high	10 Å²	10	44.3 Å²	44.3	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-67.5	-41.7	175.7	178.1	0	0	0	0	113	I197 G200 S201 L252 L253 F254 N259 A260	I197-S256 PolarHBondContact O-OG 2.89Å; G200-S256 WeakPolarHBondContact CA-OG 3.46Å; S201-S256 PolarHBondContact N-OG 2.86Å; S201-S256 VanDerWaalsContact N-OG 3.16Å; L252-S256 WeakPolarHBondContact O-CB 3.44Å; L252-S256 PolarHBondContact O-N 3.3Å; L253-S256 WeakPolarHBondContact O-CB 3.45Å; L253-S256 PolarHBondContact O-N 3.15Å; F254-S256 VanDerWaalsContact C-N 3.26Å; F254-S256 PolarHBondContact O-N 3.21Å; S256-N259 PolarHBondContact O-N 3.12Å; S256-A260 PolarHBondContact O-N 3.43Å; S256-A260 VanDerWaalsContact O-N 3.12Å
257	I	98.3	Very high	96	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-48.3	174.3	-64.1	161.1	0	0	0	110	L203 L253 F254 N259 A260 I261 F315 M318	L203-I257 HydrophobicContact CB-CG1 4.36Å; L203-I257 HydrophobicContact CD2-CD1 3.45Å; L203-I257 VanDerWaalsContact CD2-CD1 3.45Å; L203-I257 HydrophobicContact CD2-CG1 3.95Å; L253-I257 HydrophobicContact CD1-CD1 4.24Å; L253-I257 HydrophobicContact CG-CD1 3.97Å; L253-I257 VanDerWaalsContact O-CG1 3.28Å; L253-I257 WeakPolarHBondContact O-CG1 3.31Å; L253-I257 PolarHBondContact O-N 2.93Å; F254-I257 HydrophobicContact CD1-CD1 4.1Å; F254-I257 PolarHBondContact O-N 3.48Å; I257-N259 PolarHBondContact O-N 2.91Å; I257-A260 PolarHBondContact O-N 3.16Å; I257-A260 VanDerWaalsContact O-N 3.16Å; I257-I261 HydrophobicContact CG2-CD1 3.84Å; I257-I261 HydrophobicContact CG2-CG1 4.47Å; I257-I261 WeakPolarHBondContact O-CG1 3.44Å; I257-I261 PolarHBondContact O-N 2.92Å; I257-F315 HydrophobicContact CG2-CE1 4.31Å; I257-F315 HydrophobicContact CG2-CE2 4.16Å; I257-F315 HydrophobicContact CG2-CZ 3.92Å; I257-M318 HydrophobicContact CB-SD 4.12Å; I257-M318 HydrophobicContact CG2-SD 3.68Å
258	F	98.2	Very high	94.7	Very high	30 Å²	30	43.2 Å²	43.2	13%	0.132	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-46.1	178.9	174.9	-110.9	0	0	0	111.8	F254 A260 I261 K262 M318 E321 A322 M325	F254-F258 WeakPolarHBondContact O-CB 3.31Å; F254-F258 PolarHBondContact O-N 3.48Å; F258-A260 VanDerWaalsContact C-N 3.29Å; F258-A260 PolarHBondContact O-N 3.45Å; F258-I261 PolarHBondContact O-N 3.05Å; F258-K262 HydrophobicContact CE1-CD 4.38Å; F258-K262 WeakPolarHBondContact O-CB 3.38Å; F258-K262 PolarHBondContact O-N 3.48Å; F258-M318 HydrophobicContact CB-CE 4.26Å; F258-M318 HydrophobicContact CB-CG 4.07Å; F258-M318 HydrophobicContact CB-SD 4.07Å; F258-M318 HydrophobicContact CD2-CB 3.91Å; F258-M318 HydrophobicContact CD2-CG 3.93Å; F258-M318 HydrophobicContact CG-CG 4.45Å; F258-E321 HydrophobicContact CE2-CB 3.96Å; F258-E321 HydrophobicContact CE2-CG 3.75Å; F258-E321 HydrophobicContact CZ-CB 4.48Å; F258-E321 HydrophobicContact CZ-CG 3.78Å; F258-A322 HydrophobicContact CE2-CB 4.24Å; F258-M325 HydrophobicContact CZ-SD 4.06Å
259	N	97.9	Very high	93.1	Very high	82 Å²	82	40.5 Å²	40.5	44%	0.439	22%	0.217	S	C	.	.	H	α-helix	trans	-60.6	-37.5	177.2	-76	-35.5	0	0	0	112.4	D255 S256 I257 N263	D255-N259 WeakPolarHBondContact O-CB 3.5Å; D255-N259 VanDerWaalsContact O-CG 3.24Å; D255-N259 PolarHBondContact O-N 3.07Å; D255-N259 PolarHBondContact O-ND2 3.34Å; S256-N259 PolarHBondContact O-N 3.12Å; I257-N259 PolarHBondContact O-N 2.91Å; N259-N263 WeakPolarHBondContact O-CB 3.34Å; N259-N263 PolarHBondContact O-N 3.46Å; N259-N263 PolarHBondContact O-ND2 3.34Å
260	A	97.1	Very high	91.3	Very high	26 Å²	26	45.4 Å²	45.4	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-69.4	-40.6	175.8	0	0	0	0	0	112.7	S256 I257 F258 K264	S256-A260 PolarHBondContact O-N 3.43Å; S256-A260 VanDerWaalsContact O-N 3.12Å; I257-A260 PolarHBondContact O-N 3.16Å; I257-A260 VanDerWaalsContact O-N 3.16Å; F258-A260 VanDerWaalsContact C-N 3.29Å; F258-A260 PolarHBondContact O-N 3.45Å; A260-K264 WeakPolarHBondContact O-CB 3.38Å; A260-K264 PolarHBondContact O-N 3.35Å
261	I	97.6	Very high	89.4	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-48.2	172.8	-70	169.8	0	0	0	110.1	I257 F258 N263 K264 V265 F315 M318 Y319 A322	I257-I261 HydrophobicContact CG2-CD1 3.84Å; I257-I261 HydrophobicContact CG2-CG1 4.47Å; I257-I261 WeakPolarHBondContact O-CG1 3.44Å; I257-I261 PolarHBondContact O-N 2.92Å; F258-I261 PolarHBondContact O-N 3.05Å; I261-N263 PolarHBondContact O-N 3.23Å; I261-K264 WeakPolarHBondContact O-CB 3.13Å; I261-K264 PolarHBondContact O-N 2.93Å; I261-K264 VanDerWaalsContact O-N 3.14Å; I261-V265 HydrophobicContact CG2-CG2 4.34Å; I261-V265 WeakPolarHBondContact O-CG2 3.33Å; I261-V265 PolarHBondContact O-N 3.21Å; I261-F315 HydrophobicContact CD1-CD1 4.01Å; I261-F315 HydrophobicContact CD1-CE1 4.2Å; I261-M318 HydrophobicContact CD1-CB 3.77Å; I261-M318 HydrophobicContact CD1-SD 4.14Å; I261-Y319 HydrophobicContact CD1-CD2 3.92Å; I261-Y319 HydrophobicContact CD1-CE2 3.82Å; I261-Y319 HydrophobicContact CG1-CD2 4.36Å; I261-Y319 HydrophobicContact CG1-CE2 3.9Å; I261-Y319 HydrophobicContact CG2-CD1 3.68Å; I261-Y319 HydrophobicContact CG2-CD2 3.97Å; I261-Y319 HydrophobicContact CG2-CE1 3.73Å; I261-Y319 HydrophobicContact CG2-CE2 4Å; I261-Y319 HydrophobicContact CG2-CG 3.81Å; I261-A322 HydrophobicContact CG2-CB 3.97Å
262	K	96.9	Very high	87.4	Confident	61 Å²	61	50.1 Å²	50.1	27%	0.265	28%	0.277	S	S	.	.	H	α-helix	trans	-57	-51.3	177.7	-175.1	-177.9	176.9	-176.5	0	111.4	F258 K264 V265 F266 A322 M325	F258-K262 HydrophobicContact CE1-CD 4.38Å; F258-K262 WeakPolarHBondContact O-CB 3.38Å; F258-K262 PolarHBondContact O-N 3.48Å; K262-K264 PolarHBondContact O-N 3.41Å; K262-V265 PolarHBondContact O-N 2.95Å; K262-F266 HydrophobicContact CG-CD2 3.87Å; K262-F266 HydrophobicContact CG-CE2 3.88Å; K262-F266 VanDerWaalsContact O-CD2 3.27Å; K262-F266 WeakPolarHBondContact O-CD2 3.4Å; K262-F266 PolarHBondContact O-N 2.83Å; K262-A322 HydrophobicContact CB-CB 4.35Å; K262-M325 HydrophobicContact CD-SD 4.48Å
263	N	94.6	Very high	85.6	Confident	115 Å²	115	55.6 Å²	55.6	62%	0.615	30%	0.301	S	S	*	.	H	α-helix	trans	-59.7	-37.1	177.9	-70.2	-15.6	0	0	0	112	N259 I261 G267	N259-N263 WeakPolarHBondContact O-CB 3.34Å; N259-N263 PolarHBondContact O-N 3.46Å; N259-N263 PolarHBondContact O-ND2 3.34Å; I261-N263 PolarHBondContact O-N 3.23Å; N263-G267 PolarHBondContact O-N 3.2Å
264	K	93	Very high	83.8	Confident	61 Å²	61	63.6 Å²	63.6	27%	0.265	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-48	175.8	-168.7	-176.8	-60.6	178.9	0	111.6	A260 I261 K262 G267 S268 H289 D293	A260-K264 WeakPolarHBondContact O-CB 3.38Å; A260-K264 PolarHBondContact O-N 3.35Å; I261-K264 WeakPolarHBondContact O-CB 3.13Å; I261-K264 PolarHBondContact O-N 2.93Å; I261-K264 VanDerWaalsContact O-N 3.14Å; K262-K264 PolarHBondContact O-N 3.41Å; K264-G267 PolarHBondContact O-N 3.17Å; K264-S268 PolarHBondContact O-N 2.79Å; K264-S268 VanDerWaalsContact O-N 3.14Å; K264-S268 PolarHBondContact O-OG 3.34Å; K264-H289 HydrophobicContact CD-CB 3.75Å; K264-H289 HydrophobicContact CG-CB 4.35Å; K264-D293 VanDerWaalsContact NZ-CG 3.29Å; K264-D293 IonicContact NZ-OD1 2.78Å; K264-D293 PolarHBondContact NZ-OD1 2.88Å; K264-D293 IonicContact NZ-OD2 3.05Å; K264-D293 PolarHBondContact NZ-OD2 3.05Å
265	V	94.7	Very high	82.5	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-47.7	179.2	171.6	0	0	0	0	110.9	I261 K262 G267 H282 I286 Y319 A322 I323 H326	I261-V265 HydrophobicContact CG2-CG2 4.34Å; I261-V265 WeakPolarHBondContact O-CG2 3.33Å; I261-V265 PolarHBondContact O-N 3.21Å; K262-V265 PolarHBondContact O-N 2.95Å; V265-G267 VanDerWaalsContact C-N 3.35Å; V265-G267 PolarHBondContact O-N 2.94Å; V265-H282 PolarHBondContact O-CE1 3.16Å; V265-H282 VanDerWaalsContact O-CE1 3.31Å; V265-I286 HydrophobicContact CG1-CD1 4Å; V265-I286 HydrophobicContact CG1-CG1 4.26Å; V265-I286 HydrophobicContact CG1-CG2 4.43Å; V265-I286 HydrophobicContact CG2-CG2 4.49Å; V265-Y319 HydrophobicContact CG2-CD1 4.21Å; V265-Y319 HydrophobicContact CG2-CE1 4.17Å; V265-A322 HydrophobicContact CB-CB 4.4Å; V265-A322 HydrophobicContact CG2-CB 4.06Å; V265-I323 HydrophobicContact CG1-CG1 4.16Å; V265-I323 HydrophobicContact CG2-CG1 4.23Å; V265-H326 HydrophobicContact CG1-CB 3.78Å
266	F	92.2	Very high	81.2	Confident	65 Å²	65	70.2 Å²	70.2	29%	0.285	37%	0.372	S	S	.	.	H	α-helix	trans	-70.6	-29.2	179.8	-80.5	-105.5	0	0	0	113	K262 M325 H326	K262-F266 HydrophobicContact CG-CD2 3.87Å; K262-F266 HydrophobicContact CG-CE2 3.88Å; K262-F266 VanDerWaalsContact O-CD2 3.27Å; K262-F266 WeakPolarHBondContact O-CD2 3.4Å; K262-F266 PolarHBondContact O-N 2.83Å; F266-M325 HydrophobicContact CE2-CB 4.26Å; F266-M325 HydrophobicContact CZ-CB 4.14Å; F266-H326 AromaticContact CD1-ND1 3.7Å; F266-H326 HydrophobicContact CD2-CB 4.11Å; F266-H326 HydrophobicContact CE1-CB 4.34Å; F266-H326 AromaticContact CE1-ND1 3.84Å; F266-H326 HydrophobicContact CE2-CB 3.72Å; F266-H326 AromaticContact CG-ND1 3.97Å; F266-H326 VanDerWaalsContact CZ-CA 3.49Å; F266-H326 HydrophobicContact CZ-CB 3.85Å
267	G	85.9	Confident	80.2	Confident	43 Å²	43	74 Å²	74	44%	0.443	39%	0.392	S	S	.	.	H	α-helix	trans	-93.9	2.6	-177.3	0	0	0	0	0	116.2	N263 K264 V265 A269	N263-G267 PolarHBondContact O-N 3.2Å; K264-G267 PolarHBondContact O-N 3.17Å; V265-G267 VanDerWaalsContact C-N 3.35Å; V265-G267 PolarHBondContact O-N 2.94Å; G267-A269 VanDerWaalsContact C-N 3.27Å; G267-A269 PolarHBondContact O-N 3.18Å; G267-A269 VanDerWaalsContact O-N 3.12Å
268	S	68.4	Low	79.5	Confident	20 Å²	20	76.4 Å²	76.4	14%	0.14	40%	0.402	C	S	.	.	S	Bend	trans	-65.4	-13.7	-166.7	-75.2	0	0	0	0	116.3	K264 A285 H289	K264-S268 PolarHBondContact O-N 2.79Å; K264-S268 VanDerWaalsContact O-N 3.14Å; K264-S268 PolarHBondContact O-OG 3.34Å; S268-A285 WeakPolarHBondContact O-CB 3.38Å; S268-H289 PolarHBondContact OG-CD2 3Å
269	A	61.2	Low	79	Confident	31 Å²	31	75.5 Å²	75.5	26%	0.256	40%	0.398	S	S	.	.			trans	-168	101.6	167.3	0	0	0	0	0	112	G267 H282	G267-A269 VanDerWaalsContact C-N 3.27Å; G267-A269 PolarHBondContact O-N 3.18Å; G267-A269 VanDerWaalsContact O-N 3.12Å; A269-H282 HydrophobicContact CB-CB 3.9Å; A269-H282 PolarHBondContact N-ND1 3.22Å
270	L	58.4	Low	78.5	Confident	113 Å²	113	74.8 Å²	74.8	59%	0.592	40%	0.397	S	S	*	.			trans	-114.3	-3.4	177.2	-75.4	168.7	0	0	0	114.8	N272	L270-N272 PolarHBondContact O-N 2.7Å
271	D	56.4	Low	78.1	Confident	156 Å²	156	80.6 Å²	80.6	83%	0.834	41%	0.413	S	S	*	.	S	Bend	trans	-80.7	-12.9	-158.3	-67.4	-22.5	0	0	0	116.2
272	N	56.2	Low	77.7	Confident	106 Å²	106	81 Å²	81	57%	0.567	42%	0.415	S	S	*	.			trans	-142.1	106.8	179.2	-72.4	-39	0	0	0	113.1	L270 N274	L270-N272 PolarHBondContact O-N 2.7Å; N272-N274 VanDerWaalsContact C-N 3.33Å; N272-N274 PolarHBondContact O-N 3.48Å
273	E	58.5	Low	77.5	Confident	140 Å²	140	78.4 Å²	78.4	65%	0.654	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-27	178.8	-73.2	-68.2	122.5	0	0	114.2	K278	E273-K278 IonicContact OE1-NZ 3.02Å; E273-K278 PolarHBondContact OE1-NZ 3.38Å; E273-K278 IonicContact OE2-NZ 3.99Å
274	N	60.9	Low	77.4	Confident	169 Å²	169	76.5 Å²	76.5	90%	0.904	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	9.7	-168.4	-84.5	-1.3	0	0	0	116.1	N272	N272-N274 VanDerWaalsContact C-N 3.33Å; N272-N274 PolarHBondContact O-N 3.48Å
275	D	69.1	Low	77.3	Confident	59 Å²	59	74.7 Å²	74.7	32%	0.316	39%	0.388	S	S	.	.			trans	-96.4	122.4	-177	-169.6	-6.2	0	0	0	111.9	N277 K278 R281	D275-N277 PolarHBondContact O-N 2.92Å; D275-N277 PolarHBondContact OD1-N 3.32Å; D275-K278 HydrophobicContact CB-CB 4.48Å; D275-K278 VanDerWaalsContact O-CB 3.24Å; D275-K278 WeakPolarHBondContact O-CB 3.44Å; D275-K278 PolarHBondContact O-N 3.26Å; D275-R281 IonicContact OD2-NH1 3.01Å
276	K	70.8	Confident	77.3	Confident	177 Å²	177	74.6 Å²	74.6	77%	0.77	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.6	174.9	-70.6	-176	178.4	-178.9	0	113.1	Q342	K276-Q342 PolarHBondContact O-NE2 3.43Å
277	N	78.7	Confident	77.5	Confident	90 Å²	90	73.9 Å²	73.9	48%	0.481	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	14.2	179.5	-63.4	-26.9	0	0	0	113	D275 L279 V280 R281	D275-N277 PolarHBondContact O-N 2.92Å; D275-N277 PolarHBondContact OD1-N 3.32Å; N277-L279 PolarHBondContact O-N 3.13Å; N277-V280 PolarHBondContact O-N 3.18Å; N277-R281 WeakPolarHBondContact O-CG 3.31Å; N277-R281 PolarHBondContact O-N 3.01Å
278	K	82.8	Confident	77.8	Confident	54 Å²	54	76.3 Å²	76.3	24%	0.235	38%	0.382	C	S	.	.	H	α-helix	trans	-53	-54	178.2	178.6	-175.5	173.4	-172.3	0	111.5	E273 D275 V280 R281 H282	E273-K278 IonicContact OE1-NZ 3.02Å; E273-K278 PolarHBondContact OE1-NZ 3.38Å; E273-K278 IonicContact OE2-NZ 3.99Å; D275-K278 HydrophobicContact CB-CB 4.48Å; D275-K278 VanDerWaalsContact O-CB 3.24Å; D275-K278 WeakPolarHBondContact O-CB 3.44Å; D275-K278 PolarHBondContact O-N 3.26Å; K278-V280 VanDerWaalsContact C-N 3.35Å; K278-V280 PolarHBondContact O-N 3.03Å; K278-R281 PolarHBondContact O-N 3.09Å; K278-H282 WeakPolarHBondContact O-CB 3.41Å; K278-H282 PolarHBondContact O-N 3.36Å
279	L	87.9	Confident	79	Confident	11 Å²	11	79.1 Å²	79.1	6%	0.058	39%	0.393	C	S	.	.	H	α-helix	trans	-68.1	-33.1	-177.7	176.5	66.7	0	0	0	112.1	N277 H282 N283 L330 E339 Q342 L343	N277-L279 PolarHBondContact O-N 3.13Å; L279-H282 PolarHBondContact O-N 3.37Å; L279-N283 WeakPolarHBondContact CD1-OD1 3.43Å; L279-N283 WeakPolarHBondContact O-CB 3.45Å; L279-N283 PolarHBondContact O-N 3.4Å; L279-N283 PolarHBondContact O-ND2 3.38Å; L279-L330 HydrophobicContact CD1-CD1 3.75Å; L279-E339 HydrophobicContact CD2-CB 3.83Å; L279-E339 HydrophobicContact CD2-CG 4.03Å; L279-Q342 VanDerWaalsContact CB-OE1 3.29Å; L279-Q342 HydrophobicContact CD2-CB 4.11Å; L279-Q342 HydrophobicContact CG-CB 4.47Å; L279-L343 HydrophobicContact CD2-CB 4.46Å
280	V	88.3	Confident	80.7	Confident	67 Å²	67	77.7 Å²	77.7	41%	0.406	38%	0.381	S	S	.	.	H	α-helix	trans	-59.3	-49.8	170.9	-177.4	0	0	0	0	111.6	N277 K278 H282 N283 E284 Q342	N277-V280 PolarHBondContact O-N 3.18Å; K278-V280 VanDerWaalsContact C-N 3.35Å; K278-V280 PolarHBondContact O-N 3.03Å; V280-H282 VanDerWaalsContact C-N 3.34Å; V280-H282 PolarHBondContact O-N 2.97Å; V280-N283 PolarHBondContact O-N 2.77Å; V280-E284 WeakPolarHBondContact O-CB 3.49Å; V280-E284 PolarHBondContact O-N 3.07Å; V280-Q342 HydrophobicContact CG2-CB 4.46Å; V280-Q342 HydrophobicContact CG2-CG 3.7Å
281	R	87.7	Confident	82.4	Confident	149 Å²	149	73.6 Å²	73.6	56%	0.562	36%	0.36	S	S	*	.	H	α-helix	trans	-64.9	-40.3	-179.7	-69.4	174	63.5	179.3	-0.4	111.6	D275 N277 K278 E284 A285	D275-R281 IonicContact OD2-NH1 3.01Å; N277-R281 WeakPolarHBondContact O-CG 3.31Å; N277-R281 PolarHBondContact O-N 3.01Å; K278-R281 PolarHBondContact O-N 3.09Å; R281-E284 PolarHBondContact O-N 3.07Å; R281-A285 WeakPolarHBondContact O-CB 3.37Å; R281-A285 PolarHBondContact O-N 3.04Å
282	H	90	Very high	84.2	Confident	13 Å²	13	68.6 Å²	68.6	6%	0.06	34%	0.34	C	S	.	.	H	α-helix	trans	-61.3	-50	175.8	-176.1	62.7	0	0	0	111.8	V265 A269 K278 L279 V280 E284 A285 I286 H326	V265-H282 PolarHBondContact O-CE1 3.16Å; V265-H282 VanDerWaalsContact O-CE1 3.31Å; A269-H282 HydrophobicContact CB-CB 3.9Å; A269-H282 PolarHBondContact N-ND1 3.22Å; K278-H282 WeakPolarHBondContact O-CB 3.41Å; K278-H282 PolarHBondContact O-N 3.36Å; L279-H282 PolarHBondContact O-N 3.37Å; V280-H282 VanDerWaalsContact C-N 3.34Å; V280-H282 PolarHBondContact O-N 2.97Å; H282-E284 VanDerWaalsContact C-N 3.3Å; H282-E284 PolarHBondContact O-N 3.41Å; H282-A285 PolarHBondContact O-N 2.88Å; H282-A285 VanDerWaalsContact O-N 3.17Å; H282-I286 WeakPolarHBondContact NE2-CD1 3.33Å; H282-I286 WeakPolarHBondContact O-CG1 3.44Å; H282-I286 PolarHBondContact O-N 3.17Å; H282-H326 AromaticContact CD2-NE2 3.4Å; H282-H326 PolarHBondContact CD2-NE2 2.81Å; H282-H326 AromaticContact CE1-NE2 3.99Å; H282-H326 AromaticContact NE2-CD2 3.71Å; H282-H326 AromaticContact NE2-CE1 3.37Å; H282-H326 PolarHBondContact NE2-CE1 3.39Å; H282-H326 AromaticContact NE2-NE2 2.81Å; H282-H326 PolarHBondContact NE2-NE2 3.4Å
283	N	91.5	Very high	86.1	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.027	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-38.6	177.4	-76.8	-4.4	0	0	0	112.3	L279 V280 R287 W346	L279-N283 WeakPolarHBondContact CD1-OD1 3.43Å; L279-N283 WeakPolarHBondContact O-CB 3.45Å; L279-N283 PolarHBondContact O-N 3.4Å; L279-N283 PolarHBondContact O-ND2 3.38Å; V280-N283 PolarHBondContact O-N 2.77Å; N283-R287 WeakPolarHBondContact O-CB 3.17Å; N283-R287 PolarHBondContact O-N 3.47Å; N283-W346 HydrophobicContact CB-CD2 4.1Å; N283-W346 HydrophobicContact CB-CG 3.9Å; N283-W346 PolarHBondContact O-NE1 2.83Å
284	E	92.1	Very high	87.9	Confident	76 Å²	76	57.5 Å²	57.5	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-68.7	-40.2	174.8	177.9	56.6	-164.6	0	0	112.1	V280 R281 H282 R287 Q288	V280-E284 WeakPolarHBondContact O-CB 3.49Å; V280-E284 PolarHBondContact O-N 3.07Å; R281-E284 PolarHBondContact O-N 3.07Å; H282-E284 VanDerWaalsContact C-N 3.3Å; H282-E284 PolarHBondContact O-N 3.41Å; E284-R287 WeakPolarHBondContact O-CB 3.46Å; E284-R287 PolarHBondContact O-N 3.27Å; E284-R287 IonicContact OE1-CZ 2.72Å; E284-R287 IonicContact OE1-NE 3.58Å; E284-R287 IonicContact OE1-NH2 3.8Å; E284-R287 PolarHBondContact OE1-NH2 2.9Å; E284-R287 IonicContact OE2-CZ 3.6Å; E284-R287 IonicContact OE2-NE 3.92Å; E284-R287 PolarHBondContact OE2-NE 3.18Å; E284-R287 IonicContact OE2-NH2 3.83Å; E284-R287 PolarHBondContact OE2-NH2 2.92Å; E284-Q288 HydrophobicContact CG-CG 4.49Å; E284-Q288 VanDerWaalsContact O-CG 3.29Å; E284-Q288 WeakPolarHBondContact O-CG 3.27Å; E284-Q288 PolarHBondContact O-N 3.41Å; E284-Q288 WeakPolarHBondContact OE1-CG 3.38Å; E284-Q288 PolarHBondContact OE1-NE2 3.1Å
285	A	92.2	Very high	89.5	Confident	22 Å²	22	56 Å²	56	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-44.3	174.7	0	0	0	0	0	111.6	S268 R281 H282 R287 Q288 H289	S268-A285 WeakPolarHBondContact O-CB 3.38Å; R281-A285 WeakPolarHBondContact O-CB 3.37Å; R281-A285 PolarHBondContact O-N 3.04Å; H282-A285 PolarHBondContact O-N 2.88Å; H282-A285 VanDerWaalsContact O-N 3.17Å; A285-R287 VanDerWaalsContact C-N 3.31Å; A285-R287 PolarHBondContact O-N 3.29Å; A285-Q288 PolarHBondContact O-N 3.36Å; A285-H289 WeakPolarHBondContact O-CB 3.29Å; A285-H289 PolarHBondContact O-CD2 3.24Å; A285-H289 PolarHBondContact O-N 2.82Å
286	I	95.1	Very high	90.8	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-55.5	-48.2	172.6	-68.4	168.5	0	0	0	110.2	V265 H282 H289 T290 I323 W346	V265-I286 HydrophobicContact CG1-CD1 4Å; V265-I286 HydrophobicContact CG1-CG1 4.26Å; V265-I286 HydrophobicContact CG1-CG2 4.43Å; V265-I286 HydrophobicContact CG2-CG2 4.49Å; H282-I286 WeakPolarHBondContact NE2-CD1 3.33Å; H282-I286 WeakPolarHBondContact O-CG1 3.44Å; H282-I286 PolarHBondContact O-N 3.17Å; I286-H289 PolarHBondContact O-N 2.89Å; I286-T290 VanDerWaalsContact O-CB 3.29Å; I286-T290 WeakPolarHBondContact O-CB 3.37Å; I286-T290 PolarHBondContact O-N 2.96Å; I286-T290 PolarHBondContact O-OG1 2.97Å; I286-I323 HydrophobicContact CG2-CD1 3.95Å; I286-I323 HydrophobicContact CG2-CG1 3.92Å; I286-W346 HydrophobicContact CB-CZ2 4.26Å; I286-W346 HydrophobicContact CG2-CH2 4.04Å; I286-W346 HydrophobicContact CG2-CZ2 3.89Å
287	R	94.7	Very high	91.9	Very high	50 Å²	50	46.1 Å²	46.1	19%	0.189	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-49.7	-179.6	-166.2	-174.2	68.7	82	4	111.6	N283 E284 A285 T290 L291 E354 F355	N283-R287 WeakPolarHBondContact O-CB 3.17Å; N283-R287 PolarHBondContact O-N 3.47Å; E284-R287 WeakPolarHBondContact O-CB 3.46Å; E284-R287 PolarHBondContact O-N 3.27Å; E284-R287 IonicContact OE1-CZ 2.72Å; E284-R287 IonicContact OE1-NE 3.58Å; E284-R287 IonicContact OE1-NH2 3.8Å; E284-R287 PolarHBondContact OE1-NH2 2.9Å; E284-R287 IonicContact OE2-CZ 3.6Å; E284-R287 IonicContact OE2-NE 3.92Å; E284-R287 PolarHBondContact OE2-NE 3.18Å; E284-R287 IonicContact OE2-NH2 3.83Å; E284-R287 PolarHBondContact OE2-NH2 2.92Å; A285-R287 VanDerWaalsContact C-N 3.31Å; A285-R287 PolarHBondContact O-N 3.29Å; R287-T290 PolarHBondContact O-N 2.88Å; R287-L291 HydrophobicContact CG-CD1 4.23Å; R287-L291 VanDerWaalsContact NH1-CD1 3.31Å; R287-L291 WeakPolarHBondContact O-CG 3.29Å; R287-L291 PolarHBondContact O-N 3.45Å; R287-E354 PolarHBondContact NH1-O 3.25Å; R287-F355 HydrophobicContact CB-CD2 4.49Å; R287-F355 HydrophobicContact CB-CE2 4.25Å; R287-F355 HydrophobicContact CB-CZ 4.34Å; R287-F355 HydrophobicContact CG-CB 4.33Å; R287-F355 HydrophobicContact CG-CD1 4.22Å; R287-F355 HydrophobicContact CG-CD2 3.53Å; R287-F355 HydrophobicContact CG-CE1 4.43Å; R287-F355 HydrophobicContact CG-CE2 3.75Å; R287-F355 HydrophobicContact CG-CG 3.79Å; R287-F355 HydrophobicContact CG-CZ 4.2Å
288	Q	93.3	Very high	92.7	Very high	94 Å²	94	45 Å²	45	44%	0.439	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-46.5	179.8	-69.6	-69.2	-13.7	0	0	112.1	E284 A285 T290 L291 A292	E284-Q288 HydrophobicContact CG-CG 4.49Å; E284-Q288 VanDerWaalsContact O-CG 3.29Å; E284-Q288 WeakPolarHBondContact O-CG 3.27Å; E284-Q288 PolarHBondContact O-N 3.41Å; E284-Q288 WeakPolarHBondContact OE1-CG 3.38Å; E284-Q288 PolarHBondContact OE1-NE2 3.1Å; A285-Q288 PolarHBondContact O-N 3.36Å; Q288-T290 PolarHBondContact O-N 3.01Å; Q288-L291 PolarHBondContact O-N 3.41Å; Q288-A292 VanDerWaalsContact O-CB 3.32Å; Q288-A292 WeakPolarHBondContact O-CB 3.26Å; Q288-A292 PolarHBondContact O-N 2.92Å
289	H	93.4	Very high	93.2	Very high	79 Å²	79	47.3 Å²	47.3	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-62	-43.6	177.2	-73.9	-42.5	0	0	0	112.2	K264 S268 A285 I286 A292 D293 Y319	K264-H289 HydrophobicContact CD-CB 3.75Å; K264-H289 HydrophobicContact CG-CB 4.35Å; S268-H289 PolarHBondContact OG-CD2 3Å; A285-H289 WeakPolarHBondContact O-CB 3.29Å; A285-H289 PolarHBondContact O-CD2 3.24Å; A285-H289 PolarHBondContact O-N 2.82Å; I286-H289 PolarHBondContact O-N 2.89Å; H289-A292 PolarHBondContact O-N 3.45Å; H289-D293 WeakPolarHBondContact O-CB 3.34Å; H289-D293 PolarHBondContact O-N 3.24Å; H289-Y319 PolarHBondContact O-OH 2.93Å
290	T	95.9	Very high	93.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-50.4	177.2	-56.2	0	0	0	0	110.6	I286 R287 Q288 A292 D293 L294 Y319 F355 M356	I286-T290 VanDerWaalsContact O-CB 3.29Å; I286-T290 WeakPolarHBondContact O-CB 3.37Å; I286-T290 PolarHBondContact O-N 2.96Å; I286-T290 PolarHBondContact O-OG1 2.97Å; R287-T290 PolarHBondContact O-N 2.88Å; Q288-T290 PolarHBondContact O-N 3.01Å; T290-A292 PolarHBondContact O-N 3.4Å; T290-D293 PolarHBondContact O-N 3.4Å; T290-L294 HydrophobicContact CG2-CD1 3.8Å; T290-L294 HydrophobicContact CG2-CG 4.21Å; T290-L294 VanDerWaalsContact O-CB 3.27Å; T290-L294 WeakPolarHBondContact O-CB 3.38Å; T290-L294 WeakPolarHBondContact O-CG 3.41Å; T290-L294 PolarHBondContact O-N 3.41Å; T290-Y319 HydrophobicContact CG2-CD1 3.62Å; T290-Y319 HydrophobicContact CG2-CD2 4.31Å; T290-Y319 HydrophobicContact CG2-CE1 4.06Å; T290-Y319 HydrophobicContact CG2-CG 3.76Å; T290-Y319 WeakPolarHBondContact OG1-CD1 3.29Å; T290-Y319 WeakPolarHBondContact OG1-CE1 3.32Å; T290-F355 HydrophobicContact CG2-CE2 3.77Å; T290-F355 HydrophobicContact CG2-CZ 4.22Å; T290-M356 HydrophobicContact CG2-SD 3.91Å
291	L	94.9	Very high	93.8	Very high	28 Å²	28	46.1 Å²	46.1	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-38.3	-179.1	-68.8	177.5	0	0	0	112.7	R287 Q288 K295 F355 M361	R287-L291 HydrophobicContact CG-CD1 4.23Å; R287-L291 VanDerWaalsContact NH1-CD1 3.31Å; R287-L291 WeakPolarHBondContact O-CG 3.29Å; R287-L291 PolarHBondContact O-N 3.45Å; Q288-L291 PolarHBondContact O-N 3.41Å; L291-K295 WeakPolarHBondContact O-CB 3.32Å; L291-K295 PolarHBondContact O-N 3.38Å; L291-F355 HydrophobicContact CD2-CD2 4.38Å; L291-F355 HydrophobicContact CG-CD2 4.43Å; L291-M361 HydrophobicContact CD2-CE 4.12Å; L291-M361 VanDerWaalsContact O-CE 3.32Å; L291-M361 WeakPolarHBondContact O-CE 3.36Å
292	A	94.2	Very high	94.1	Very high	50 Å²	50	42.2 Å²	42.2	41%	0.413	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-48.7	176.2	0	0	0	0	0	111.8	Q288 H289 T290 K295 I296	Q288-A292 VanDerWaalsContact O-CB 3.32Å; Q288-A292 WeakPolarHBondContact O-CB 3.26Å; Q288-A292 PolarHBondContact O-N 2.92Å; H289-A292 PolarHBondContact O-N 3.45Å; T290-A292 PolarHBondContact O-N 3.4Å; A292-K295 PolarHBondContact O-N 2.83Å; A292-I296 WeakPolarHBondContact O-CG1 3.39Å; A292-I296 PolarHBondContact O-N 3.23Å
293	D	95.8	Very high	94.2	Very high	13 Å²	13	46.7 Å²	46.7	7%	0.07	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-41.9	-179.5	-80.4	16.7	0	0	0	111.4	T204 K264 H289 T290 K295 I296 A297 Y319	T204-D293 HydrophobicContact CG2-CB 4.11Å; K264-D293 VanDerWaalsContact NZ-CG 3.29Å; K264-D293 IonicContact NZ-OD1 2.78Å; K264-D293 PolarHBondContact NZ-OD1 2.88Å; K264-D293 IonicContact NZ-OD2 3.05Å; K264-D293 PolarHBondContact NZ-OD2 3.05Å; H289-D293 WeakPolarHBondContact O-CB 3.34Å; H289-D293 PolarHBondContact O-N 3.24Å; T290-D293 PolarHBondContact O-N 3.4Å; D293-K295 VanDerWaalsContact C-N 3.26Å; D293-K295 PolarHBondContact O-N 2.63Å; D293-I296 PolarHBondContact O-N 2.63Å; D293-A297 WeakPolarHBondContact O-CB 3.48Å; D293-A297 PolarHBondContact O-N 3.11Å; D293-Y319 HydrophobicContact CB-CE2 3.71Å; D293-Y319 WeakPolarHBondContact CB-OH 3.41Å; D293-Y319 PolarHBondContact OD2-OH 3.05Å
294	L	96.4	Very high	94.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-33.6	175.6	-73.2	-177.1	0	0	0	112.1	T290 I296 A297 K298 F312 F315 V316 Y319 M356 M361 I363	T290-L294 HydrophobicContact CG2-CD1 3.8Å; T290-L294 HydrophobicContact CG2-CG 4.21Å; T290-L294 VanDerWaalsContact O-CB 3.27Å; T290-L294 WeakPolarHBondContact O-CB 3.38Å; T290-L294 WeakPolarHBondContact O-CG 3.41Å; T290-L294 PolarHBondContact O-N 3.41Å; L294-I296 VanDerWaalsContact C-N 3.34Å; L294-A297 PolarHBondContact O-N 3Å; L294-K298 VanDerWaalsContact O-CB 3.32Å; L294-K298 WeakPolarHBondContact O-CB 3.39Å; L294-K298 PolarHBondContact O-N 3.49Å; L294-F312 HydrophobicContact CB-CE2 4.41Å; L294-F312 HydrophobicContact CD2-CE2 4.27Å; L294-F315 HydrophobicContact CD2-CB 3.93Å; L294-V316 HydrophobicContact CD1-CG2 4.46Å; L294-V316 HydrophobicContact CD2-CB 4.45Å; L294-V316 HydrophobicContact CD2-CG2 3.63Å; L294-Y319 HydrophobicContact CD2-CD2 4.44Å; L294-M356 HydrophobicContact CD1-CE 4.16Å; L294-M356 HydrophobicContact CD1-SD 4.05Å; L294-M361 HydrophobicContact CB-CE 3.28Å; L294-M361 HydrophobicContact CB-SD 3.92Å; L294-M361 HydrophobicContact CD1-CE 4.4Å; L294-M361 HydrophobicContact CG-CE 4.48Å; L294-I363 HydrophobicContact CD1-CD1 4.28Å
295	K	95.6	Very high	94.3	Very high	137 Å²	137	46 Å²	46	60%	0.596	24%	0.239	S	C	*	.	H	α-helix	trans	-66.8	-38.5	176.8	-174.3	177.8	-179.3	177.8	0	111	L291 A292 D293 N299 M361	L291-K295 WeakPolarHBondContact O-CB 3.32Å; L291-K295 PolarHBondContact O-N 3.38Å; A292-K295 PolarHBondContact O-N 2.83Å; D293-K295 VanDerWaalsContact C-N 3.26Å; D293-K295 PolarHBondContact O-N 2.63Å; K295-N299 WeakPolarHBondContact O-CB 3.34Å; K295-N299 PolarHBondContact O-N 3.21Å; K295-N299 VanDerWaalsContact O-N 3.1Å; K295-N299 PolarHBondContact O-ND2 2.88Å; K295-M361 HydrophobicContact CB-CE 4.27Å
296	I	95.3	Very high	94.3	Very high	30 Å²	30	47.1 Å²	47.1	15%	0.154	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-45.8	174.2	-64.6	168.7	0	0	0	110	V207 I208 A292 D293 L294 K298 N299 I300 C301	V207-I296 HydrophobicContact CG2-CG2 3.57Å; I208-I296 HydrophobicContact CD1-CD1 4.17Å; A292-I296 WeakPolarHBondContact O-CG1 3.39Å; A292-I296 PolarHBondContact O-N 3.23Å; D293-I296 PolarHBondContact O-N 2.63Å; L294-I296 VanDerWaalsContact C-N 3.34Å; I296-K298 PolarHBondContact O-N 2.97Å; I296-N299 PolarHBondContact O-N 3.29Å; I296-I300 HydrophobicContact CG1-CD1 4.48Å; I296-I300 HydrophobicContact CG2-CB 4.23Å; I296-I300 HydrophobicContact CG2-CD1 4.31Å; I296-I300 WeakPolarHBondContact O-CA 3.47Å; I296-I300 WeakPolarHBondContact O-CB 3.4Å; I296-I300 PolarHBondContact O-N 2.62Å; I296-C301 PolarHBondContact O-N 3.14Å; I296-C301 VanDerWaalsContact O-N 3.12Å
297	A	95.2	Very high	94.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-32.5	179.2	0	0	0	0	0	112.9	D293 L294 P302 F312 F315	D293-A297 WeakPolarHBondContact O-CB 3.48Å; D293-A297 PolarHBondContact O-N 3.11Å; L294-A297 PolarHBondContact O-N 3Å; A297-P302 VanDerWaalsContact O-CD 3.31Å; A297-P302 WeakPolarHBondContact O-CD 3.33Å; A297-F312 HydrophobicContact CB-CD2 4.22Å; A297-F315 HydrophobicContact CB-CB 3.85Å; A297-F315 HydrophobicContact CB-CD1 3.93Å; A297-F315 HydrophobicContact CB-CD2 3.84Å; A297-F315 HydrophobicContact CB-CE1 4.42Å; A297-F315 HydrophobicContact CB-CE2 4.33Å; A297-F315 HydrophobicContact CB-CG 3.6Å
298	K	94.5	Very high	94.1	Very high	67 Å²	67	54.6 Å²	54.6	29%	0.291	30%	0.303	S	S	.	.	H	α-helix	trans	-79.9	-45.8	177	-170.8	168.2	178.7	171.9	0	113.4	L294 I296 P302 F312 F360 M361	L294-K298 VanDerWaalsContact O-CB 3.32Å; L294-K298 WeakPolarHBondContact O-CB 3.39Å; L294-K298 PolarHBondContact O-N 3.49Å; I296-K298 PolarHBondContact O-N 2.97Å; K298-P302 WeakPolarHBondContact O-CG 3.43Å; K298-F312 HydrophobicContact CB-CD2 3.59Å; K298-F312 HydrophobicContact CB-CE2 3.67Å; K298-F312 HydrophobicContact CB-CG 4.33Å; K298-F312 HydrophobicContact CB-CZ 4.45Å; K298-F312 HydrophobicContact CD-CE2 4.16Å; K298-F312 HydrophobicContact CD-CZ 4.14Å; K298-F312 HydrophobicContact CG-CD2 4.22Å; K298-F312 HydrophobicContact CG-CE2 4.2Å; K298-F360 PolarHBondContact NZ-O 3.47Å; K298-M361 HydrophobicContact CD-SD 4.45Å; K298-M361 PolarHBondContact NZ-O 3.28Å
299	N	94.2	Very high	94.1	Very high	101 Å²	101	50.2 Å²	50.2	54%	0.54	28%	0.282	S	S	.	.	H	α-helix	trans	-99.5	-21.9	-166.6	-60.8	-59	0	0	0	114.2	K295 I296	K295-N299 WeakPolarHBondContact O-CB 3.34Å; K295-N299 PolarHBondContact O-N 3.21Å; K295-N299 VanDerWaalsContact O-N 3.1Å; K295-N299 PolarHBondContact O-ND2 2.88Å; I296-N299 PolarHBondContact O-N 3.29Å
300	I	94.8	Very high	94.2	Very high	53 Å²	53	48.3 Å²	48.3	27%	0.272	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-48.6	-171.8	-57.9	178	0	0	0	111	V207 I208 I296 P302 T303 Y304	V207-I300 HydrophobicContact CB-CG2 4.06Å; V207-I300 HydrophobicContact CG2-CG2 4.02Å; I208-I300 HydrophobicContact CD1-CD1 4.42Å; I208-I300 HydrophobicContact CG1-CD1 4.15Å; I296-I300 HydrophobicContact CG1-CD1 4.48Å; I296-I300 HydrophobicContact CG2-CB 4.23Å; I296-I300 HydrophobicContact CG2-CD1 4.31Å; I296-I300 WeakPolarHBondContact O-CA 3.47Å; I296-I300 WeakPolarHBondContact O-CB 3.4Å; I296-I300 PolarHBondContact O-N 2.62Å; I300-P302 VanDerWaalsContact C-CD 3.45Å; I300-T303 WeakPolarHBondContact O-CB 3.5Å; I300-T303 PolarHBondContact O-N 3.14Å; I300-T303 PolarHBondContact O-OG1 2.93Å; I300-Y304 HydrophobicContact CG2-CD2 4.41Å; I300-Y304 HydrophobicContact CG2-CE2 3.77Å
301	C	94.1	Very high	94.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-56.7	-40.2	-177.1	-66.4	0	0	0	0	114.4	I296 T303 Y304 F305 I311	I296-C301 PolarHBondContact O-N 3.14Å; I296-C301 VanDerWaalsContact O-N 3.12Å; C301-T303 PolarHBondContact O-N 3.32Å; C301-Y304 PolarHBondContact O-N 2.84Å; C301-F305 HydrophobicContact CB-CD2 4.2Å; C301-F305 VanDerWaalsContact O-CD2 3.32Å; C301-F305 WeakPolarHBondContact O-CD2 3.21Å; C301-F305 PolarHBondContact O-N 3.07Å; C301-F305 VanDerWaalsContact O-N 3.09Å; C301-I311 HydrophobicContact CB-CG1 3.99Å; C301-I311 HydrophobicContact CB-CG2 3.8Å
302	P	92.8	Very high	94.2	Very high	67 Å²	67	48.7 Å²	48.7	44%	0.435	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-62.3	-19	-178.1	-25.8	38.1	0	0	0	114.4	A297 K298 I300 Y304 I311	A297-P302 VanDerWaalsContact O-CD 3.31Å; A297-P302 WeakPolarHBondContact O-CD 3.33Å; K298-P302 WeakPolarHBondContact O-CG 3.43Å; I300-P302 VanDerWaalsContact C-CD 3.45Å; P302-Y304 VanDerWaalsContact C-N 3.26Å; P302-Y304 PolarHBondContact O-N 3.43Å; P302-I311 HydrophobicContact CG-CG2 4.25Å
303	T	92.3	Very high	94.3	Very high	108 Å²	108	49.2 Å²	49.2	66%	0.663	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-68.5	-26.3	174.2	-51.9	0	0	0	0	112.5	I300 C301	I300-T303 WeakPolarHBondContact O-CB 3.5Å; I300-T303 PolarHBondContact O-N 3.14Å; I300-T303 PolarHBondContact O-OG1 2.93Å; C301-T303 PolarHBondContact O-N 3.32Å
304	Y	91.7	Very high	94.3	Very high	55 Å²	55	53.1 Å²	53.1	22%	0.216	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-14.5	-173	-52.5	-57.9	0	0	0	113.6	V207 N211 V215 I300 C301 P302	V207-Y304 HydrophobicContact CB-CD2 4.14Å; V207-Y304 HydrophobicContact CB-CE2 4.15Å; V207-Y304 HydrophobicContact CG1-CD2 4.07Å; V207-Y304 WeakPolarHBondContact O-CE2 3.41Å; N211-Y304 HydrophobicContact CB-CE1 3.84Å; N211-Y304 HydrophobicContact CB-CE2 4.27Å; N211-Y304 WeakPolarHBondContact CB-OH 3.34Å; V215-Y304 HydrophobicContact CG2-CD1 3.29Å; V215-Y304 HydrophobicContact CG2-CE1 4.13Å; V215-Y304 HydrophobicContact CG2-CG 3.95Å; I300-Y304 HydrophobicContact CG2-CD2 4.41Å; I300-Y304 HydrophobicContact CG2-CE2 3.77Å; C301-Y304 PolarHBondContact O-N 2.84Å; P302-Y304 VanDerWaalsContact C-N 3.26Å; P302-Y304 PolarHBondContact O-N 3.43Å
305	F	94.1	Very high	94.3	Very high	10 Å²	10	53.3 Å²	53.3	4%	0.044	29%	0.291	C	S	.	.	S	Bend	trans	-111.6	135.4	-178.6	-75.7	-95.5	0	0	0	111.2	L203 V214 V218 L253 C301 Y309 I311	L203-F305 HydrophobicContact CD1-CE2 4Å; L203-F305 HydrophobicContact CD1-CZ 3.85Å; L203-F305 HydrophobicContact CD2-CE2 4.27Å; L203-F305 HydrophobicContact CD2-CZ 3.91Å; V214-F305 HydrophobicContact CG1-CE2 3.99Å; V214-F305 HydrophobicContact CG1-CZ 4.28Å; V218-F305 HydrophobicContact CG1-CD1 4.41Å; V218-F305 HydrophobicContact CG2-CD1 3.96Å; V218-F305 HydrophobicContact CG2-CE1 3.59Å; V218-F305 HydrophobicContact CG2-CE2 4.4Å; V218-F305 HydrophobicContact CG2-CZ 3.84Å; L253-F305 HydrophobicContact CD2-CE1 3.95Å; L253-F305 HydrophobicContact CD2-CZ 4.43Å; C301-F305 HydrophobicContact CB-CD2 4.2Å; C301-F305 VanDerWaalsContact O-CD2 3.32Å; C301-F305 WeakPolarHBondContact O-CD2 3.21Å; C301-F305 PolarHBondContact O-N 3.07Å; C301-F305 VanDerWaalsContact O-N 3.09Å; F305-Y309 AromaticContact CD1-CD1 3.65Å; F305-Y309 HydrophobicContact CD1-CD1 3.65Å; F305-Y309 HydrophobicContact CD1-CE1 4.15Å; F305-Y309 HydrophobicContact CD1-CG 4.23Å; F305-Y309 HydrophobicContact CE1-CD1 4.2Å; F305-Y309 HydrophobicContact CE1-CE1 4.46Å; F305-I311 HydrophobicContact CB-CB 4.23Å; F305-I311 HydrophobicContact CB-CG2 4.18Å; F305-I311 HydrophobicContact CD1-CD1 4.19Å; F305-I311 HydrophobicContact CD1-CG1 4.34Å; F305-I311 HydrophobicContact CD2-CG1 4.22Å; F305-I311 HydrophobicContact CE1-CD1 4.15Å; F305-I311 HydrophobicContact CG-CB 4.3Å; F305-I311 HydrophobicContact CG-CD1 4.47Å; F305-I311 HydrophobicContact CG-CG1 4.12Å; F305-I311 HydrophobicContact CZ-CD1 4.41Å
306	P	92.9	Very high	94.4	Very high	47 Å²	47	46.8 Å²	46.8	31%	0.305	26%	0.262	S	S	.	.			trans	-56.3	149.1	169.7	-27.5	37	0	0	0	112.9	V218 D308 Y309	V218-P306 HydrophobicContact CG1-CG 4.36Å; P306-D308 VanDerWaalsContact C-N 3.27Å; P306-D308 WeakPolarHBondContact CB-OD1 3.42Å; P306-D308 PolarHBondContact O-N 3.36Å; P306-Y309 HydrophobicContact CB-CD2 3.9Å; P306-Y309 HydrophobicContact CB-CE2 4.2Å; P306-Y309 HydrophobicContact CG-CD2 4.12Å; P306-Y309 HydrophobicContact CG-CE2 4.01Å; P306-Y309 WeakPolarHBondContact O-CB 3.48Å; P306-Y309 PolarHBondContact O-N 3Å
307	A	91.8	Very high	94.5	Very high	100 Å²	100	46.3 Å²	46.3	83%	0.826	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-61.6	-32	-175.8	0	0	0	0	0	113.5	Y309 A310	A307-Y309 PolarHBondContact O-N 3.11Å; A307-A310 PolarHBondContact O-N 3.19Å
308	D	92.1	Very high	94.7	Very high	108 Å²	108	47.1 Å²	47.1	58%	0.578	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-67.1	-11.8	177.6	67.9	-69.7	0	0	0	113.6	K250 P306 A310	K250-D308 IonicContact NZ-OD2 2.83Å; K250-D308 PolarHBondContact NZ-OD2 3Å; P306-D308 VanDerWaalsContact C-N 3.27Å; P306-D308 WeakPolarHBondContact CB-OD1 3.42Å; P306-D308 PolarHBondContact O-N 3.36Å; D308-A310 VanDerWaalsContact C-N 3.26Å
309	Y	94.5	Very high	94.8	Very high	2 Å²	2	44 Å²	44	1%	0.008	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-74.1	-22.1	172.5	-80.4	-124.5	0	0	0	111.9	I221 K250 F254 F305 P306 A307 I311 R314	I221-Y309 WeakPolarHBondContact CG2-OH 3.36Å; K250-Y309 HydrophobicContact CD-CE1 3.98Å; K250-Y309 HydrophobicContact CD-CE2 4.12Å; K250-Y309 HydrophobicContact CG-CE1 3.93Å; F254-Y309 AromaticContact CE2-CD1 3.99Å; F254-Y309 HydrophobicContact CE2-CD1 3.99Å; F254-Y309 HydrophobicContact CE2-CE1 4.43Å; F254-Y309 AromaticContact CZ-CD1 3.7Å; F254-Y309 HydrophobicContact CZ-CD1 3.7Å; F254-Y309 HydrophobicContact CZ-CG 4.38Å; F305-Y309 AromaticContact CD1-CD1 3.65Å; F305-Y309 HydrophobicContact CD1-CD1 3.65Å; F305-Y309 HydrophobicContact CD1-CE1 4.15Å; F305-Y309 HydrophobicContact CD1-CG 4.23Å; F305-Y309 HydrophobicContact CE1-CD1 4.2Å; F305-Y309 HydrophobicContact CE1-CE1 4.46Å; P306-Y309 HydrophobicContact CB-CD2 3.9Å; P306-Y309 HydrophobicContact CB-CE2 4.2Å; P306-Y309 HydrophobicContact CG-CD2 4.12Å; P306-Y309 HydrophobicContact CG-CE2 4.01Å; P306-Y309 WeakPolarHBondContact O-CB 3.48Å; P306-Y309 PolarHBondContact O-N 3Å; A307-Y309 PolarHBondContact O-N 3.11Å; Y309-I311 PolarHBondContact O-N 3.15Å; Y309-R314 WeakPolarHBondContact O-CG 3.17Å
310	A	94.4	Very high	94.9	Very high	38 Å²	38	39.1 Å²	39.1	31%	0.314	22%	0.224	S	C	.	.			trans	46.6	45.1	-173.9	0	0	0	0	0	111.7	A307 D308 F312 D313 R314	A307-A310 PolarHBondContact O-N 3.19Å; D308-A310 VanDerWaalsContact C-N 3.26Å; A310-F312 VanDerWaalsContact C-N 3.27Å; A310-F312 PolarHBondContact O-N 3.4Å; A310-F312 VanDerWaalsContact O-N 3.15Å; A310-D313 HydrophobicContact CB-CB 4.32Å; A310-D313 PolarHBondContact O-N 3.37Å; A310-R314 WeakPolarHBondContact O-CG 3.28Å; A310-R314 PolarHBondContact O-N 3.38Å
311	I	95.4	Very high	95.1	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-56.3	-39.8	-163.7	-169.2	58.6	0	0	0	112.9	F254 C301 P302 F305 Y309 R314 F315	F254-I311 HydrophobicContact CE1-CD1 3.75Å; F254-I311 HydrophobicContact CZ-CD1 4.39Å; C301-I311 HydrophobicContact CB-CG1 3.99Å; C301-I311 HydrophobicContact CB-CG2 3.8Å; P302-I311 HydrophobicContact CG-CG2 4.25Å; F305-I311 HydrophobicContact CB-CB 4.23Å; F305-I311 HydrophobicContact CB-CG2 4.18Å; F305-I311 HydrophobicContact CD1-CD1 4.19Å; F305-I311 HydrophobicContact CD1-CG1 4.34Å; F305-I311 HydrophobicContact CD2-CG1 4.22Å; F305-I311 HydrophobicContact CE1-CD1 4.15Å; F305-I311 HydrophobicContact CG-CB 4.3Å; F305-I311 HydrophobicContact CG-CD1 4.47Å; F305-I311 HydrophobicContact CG-CG1 4.12Å; F305-I311 HydrophobicContact CZ-CD1 4.41Å; Y309-I311 PolarHBondContact O-N 3.15Å; I311-R314 PolarHBondContact O-N 2.73Å; I311-F315 HydrophobicContact CD1-CD2 4.08Å; I311-F315 HydrophobicContact CD1-CE2 3.9Å; I311-F315 HydrophobicContact CG1-CD2 4.17Å; I311-F315 HydrophobicContact CG1-CE2 4.11Å; I311-F315 VanDerWaalsContact O-CD2 3.31Å; I311-F315 WeakPolarHBondContact O-CD2 3.39Å; I311-F315 PolarHBondContact O-N 3.42Å
312	F	95.5	Very high	95.2	Very high	28 Å²	28	38.1 Å²	38.1	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-51.2	176.6	175	-111.3	0	0	0	111.9	L294 A297 K298 A310 R314 F315 V316 M361 I363	L294-F312 HydrophobicContact CB-CE2 4.41Å; L294-F312 HydrophobicContact CD2-CE2 4.27Å; A297-F312 HydrophobicContact CB-CD2 4.22Å; K298-F312 HydrophobicContact CB-CD2 3.59Å; K298-F312 HydrophobicContact CB-CE2 3.67Å; K298-F312 HydrophobicContact CB-CG 4.33Å; K298-F312 HydrophobicContact CB-CZ 4.45Å; K298-F312 HydrophobicContact CD-CE2 4.16Å; K298-F312 HydrophobicContact CD-CZ 4.14Å; K298-F312 HydrophobicContact CG-CD2 4.22Å; K298-F312 HydrophobicContact CG-CE2 4.2Å; A310-F312 VanDerWaalsContact C-N 3.27Å; A310-F312 PolarHBondContact O-N 3.4Å; A310-F312 VanDerWaalsContact O-N 3.15Å; F312-R314 VanDerWaalsContact C-N 3.27Å; F312-R314 PolarHBondContact O-N 2.85Å; F312-F315 WeakPolarHBondContact O-CB 3.39Å; F312-F315 PolarHBondContact O-N 2.84Å; F312-V316 HydrophobicContact CE1-CG2 4.18Å; F312-V316 HydrophobicContact CE2-CG2 4.16Å; F312-V316 HydrophobicContact CZ-CG2 3.97Å; F312-V316 WeakPolarHBondContact O-CG2 3.3Å; F312-V316 PolarHBondContact O-N 2.81Å; F312-M361 HydrophobicContact CE2-SD 4.27Å; F312-M361 HydrophobicContact CZ-CB 4.44Å; F312-M361 HydrophobicContact CZ-SD 4.45Å; F312-I363 HydrophobicContact CE1-CG1 4.15Å; F312-I363 HydrophobicContact CZ-CD1 4.4Å; F312-I363 HydrophobicContact CZ-CG1 3.88Å
313	D	96.2	Very high	95.4	Very high	62 Å²	62	34.9 Å²	34.9	33%	0.332	20%	0.197	S	C	.	.	H	α-helix	trans	-60.9	-38.6	178.9	-64.6	-14.7	0	0	0	111.2	A310 F315 V316 E317 L368	A310-D313 HydrophobicContact CB-CB 4.32Å; A310-D313 PolarHBondContact O-N 3.37Å; D313-F315 VanDerWaalsContact C-N 3.35Å; D313-F315 PolarHBondContact O-N 2.75Å; D313-V316 PolarHBondContact O-N 3.36Å; D313-V316 VanDerWaalsContact O-N 3.16Å; D313-E317 WeakPolarHBondContact O-CG 3.35Å; D313-E317 PolarHBondContact O-N 2.93Å; D313-L368 HydrophobicContact CB-CD2 3.63Å
314	R	96.1	Very high	95.6	Very high	95 Å²	95	29.8 Å²	29.8	36%	0.358	17%	0.166	S	C	.	.	H	α-helix	trans	-61.4	-40.6	174	-66.1	-52.6	-174.7	-177.1	-2.5	112.6	F254 Y309 A310 I311 F312 V316 E317 M318	F254-R314 HydrophobicContact CD1-CB 4.43Å; F254-R314 HydrophobicContact CE1-CB 3.94Å; F254-R314 HydrophobicContact CE1-CG 3.91Å; F254-R314 HydrophobicContact CZ-CG 4.14Å; Y309-R314 WeakPolarHBondContact O-CG 3.17Å; A310-R314 WeakPolarHBondContact O-CG 3.28Å; A310-R314 PolarHBondContact O-N 3.38Å; I311-R314 PolarHBondContact O-N 2.73Å; F312-R314 VanDerWaalsContact C-N 3.27Å; F312-R314 PolarHBondContact O-N 2.85Å; R314-V316 VanDerWaalsContact C-N 3.35Å; R314-E317 WeakPolarHBondContact CD-OE2 3.27Å; R314-E317 IonicContact CZ-OE2 3.6Å; R314-E317 IonicContact NE-OE2 3.62Å; R314-E317 IonicContact NH1-OE1 3.11Å; R314-E317 IonicContact NH1-OE2 3.18Å; R314-E317 PolarHBondContact NH1-OE2 3.35Å; R314-E317 PolarHBondContact O-N 3.3Å; R314-M318 WeakPolarHBondContact O-CB 3.18Å; R314-M318 WeakPolarHBondContact O-CG 3.18Å; R314-M318 PolarHBondContact O-N 3.03Å
315	F	97.2	Very high	95.9	Very high	3 Å²	3	29.9 Å²	29.9	1%	0.013	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-42.1	173.6	-95.1	-102.6	0	0	0	111.6	L203 T204 I257 I261 L294 A297 I311 F312 D313 M318 Y319	L203-F315 HydrophobicContact CD2-CE2 3.84Å; L203-F315 HydrophobicContact CD2-CZ 3.87Å; L203-F315 HydrophobicContact CG-CZ 4.49Å; T204-F315 HydrophobicContact CG2-CE1 3.77Å; T204-F315 HydrophobicContact CG2-CZ 4.06Å; I257-F315 HydrophobicContact CG2-CE1 4.31Å; I257-F315 HydrophobicContact CG2-CE2 4.16Å; I257-F315 HydrophobicContact CG2-CZ 3.92Å; I261-F315 HydrophobicContact CD1-CD1 4.01Å; I261-F315 HydrophobicContact CD1-CE1 4.2Å; L294-F315 HydrophobicContact CD2-CB 3.93Å; A297-F315 HydrophobicContact CB-CB 3.85Å; A297-F315 HydrophobicContact CB-CD1 3.93Å; A297-F315 HydrophobicContact CB-CD2 3.84Å; A297-F315 HydrophobicContact CB-CE1 4.42Å; A297-F315 HydrophobicContact CB-CE2 4.33Å; A297-F315 HydrophobicContact CB-CG 3.6Å; I311-F315 HydrophobicContact CD1-CD2 4.08Å; I311-F315 HydrophobicContact CD1-CE2 3.9Å; I311-F315 HydrophobicContact CG1-CD2 4.17Å; I311-F315 HydrophobicContact CG1-CE2 4.11Å; I311-F315 VanDerWaalsContact O-CD2 3.31Å; I311-F315 WeakPolarHBondContact O-CD2 3.39Å; I311-F315 PolarHBondContact O-N 3.42Å; F312-F315 WeakPolarHBondContact O-CB 3.39Å; F312-F315 PolarHBondContact O-N 2.84Å; D313-F315 VanDerWaalsContact C-N 3.35Å; D313-F315 PolarHBondContact O-N 2.75Å; F315-M318 PolarHBondContact O-N 2.86Å; F315-Y319 HydrophobicContact CD1-CE2 4.29Å; F315-Y319 WeakPolarHBondContact O-CB 3.32Å; F315-Y319 WeakPolarHBondContact O-CD2 3.48Å; F315-Y319 PolarHBondContact O-N 3.44Å
316	V	97.3	Very high	95.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-47.7	177	179.6	0	0	0	0	110.9	L294 F312 D313 R314 M318 Y319 H320 M356 I363 L368	L294-V316 HydrophobicContact CD1-CG2 4.46Å; L294-V316 HydrophobicContact CD2-CB 4.45Å; L294-V316 HydrophobicContact CD2-CG2 3.63Å; F312-V316 HydrophobicContact CE1-CG2 4.18Å; F312-V316 HydrophobicContact CE2-CG2 4.16Å; F312-V316 HydrophobicContact CZ-CG2 3.97Å; F312-V316 WeakPolarHBondContact O-CG2 3.3Å; F312-V316 PolarHBondContact O-N 2.81Å; D313-V316 PolarHBondContact O-N 3.36Å; D313-V316 VanDerWaalsContact O-N 3.16Å; R314-V316 VanDerWaalsContact C-N 3.35Å; V316-M318 PolarHBondContact O-N 2.94Å; V316-Y319 PolarHBondContact O-N 3.46Å; V316-H320 WeakPolarHBondContact O-CB 3.35Å; V316-H320 PolarHBondContact O-N 3.12Å; V316-M356 HydrophobicContact CG1-CE 3.75Å; V316-I363 HydrophobicContact CG1-CD1 4.1Å; V316-I363 HydrophobicContact CG1-CG2 3.94Å; V316-I363 HydrophobicContact CG2-CD1 3.85Å; V316-I363 HydrophobicContact CG2-CG1 4.12Å; V316-L368 HydrophobicContact CB-CD1 4.21Å; V316-L368 HydrophobicContact CG1-CD1 3.46Å; V316-L368 VanDerWaalsContact CG1-CD1 3.46Å
317	E	97.9	Very high	96	Very high	20 Å²	20	27.8 Å²	27.8	9%	0.093	16%	0.156	C	C	.	.	H	α-helix	trans	-58.2	-46.6	176.4	-71.8	171.5	172.3	0	0	111.6	D313 R314 H320 E321 L368 N369	D313-E317 WeakPolarHBondContact O-CG 3.35Å; D313-E317 PolarHBondContact O-N 2.93Å; R314-E317 WeakPolarHBondContact CD-OE2 3.27Å; R314-E317 IonicContact CZ-OE2 3.6Å; R314-E317 IonicContact NE-OE2 3.62Å; R314-E317 IonicContact NH1-OE1 3.11Å; R314-E317 IonicContact NH1-OE2 3.18Å; R314-E317 PolarHBondContact NH1-OE2 3.35Å; R314-E317 PolarHBondContact O-N 3.3Å; E317-H320 PolarHBondContact O-N 3.07Å; E317-E321 WeakPolarHBondContact O-CB 3.39Å; E317-E321 PolarHBondContact O-N 3.35Å; E317-L368 HydrophobicContact CG-CB 4.14Å; E317-L368 HydrophobicContact CG-CD2 4.35Å; E317-N369 WeakPolarHBondContact OE1-CB 3.31Å; E317-N369 PolarHBondContact OE1-N 3.06Å; E317-N369 PolarHBondContact OE1-ND2 3.11Å
318	M	97.9	Very high	96.2	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.084	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-42.4	179.7	-74.5	174.2	-178.4	0	0	112.8	F254 I257 F258 I261 R314 F315 V316 A322	F254-M318 HydrophobicContact CB-CE 3.66Å; F254-M318 HydrophobicContact CD1-CE 3.54Å; F254-M318 HydrophobicContact CG-CE 4.01Å; F254-M318 VanDerWaalsContact O-CE 3.29Å; F254-M318 WeakPolarHBondContact O-CE 3.27Å; I257-M318 HydrophobicContact CB-SD 4.12Å; I257-M318 HydrophobicContact CG2-SD 3.68Å; F258-M318 HydrophobicContact CB-CE 4.26Å; F258-M318 HydrophobicContact CB-CG 4.07Å; F258-M318 HydrophobicContact CB-SD 4.07Å; F258-M318 HydrophobicContact CD2-CB 3.91Å; F258-M318 HydrophobicContact CD2-CG 3.93Å; F258-M318 HydrophobicContact CG-CG 4.45Å; I261-M318 HydrophobicContact CD1-CB 3.77Å; I261-M318 HydrophobicContact CD1-SD 4.14Å; R314-M318 WeakPolarHBondContact O-CB 3.18Å; R314-M318 WeakPolarHBondContact O-CG 3.18Å; R314-M318 PolarHBondContact O-N 3.03Å; F315-M318 PolarHBondContact O-N 2.86Å; V316-M318 PolarHBondContact O-N 2.94Å; M318-A322 VanDerWaalsContact O-CB 3.27Å; M318-A322 WeakPolarHBondContact O-CB 3.31Å; M318-A322 PolarHBondContact O-N 3.4Å
319	Y	97.3	Very high	96.2	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-66.1	-43.1	175.4	-95.9	-75.6	0	0	0	111.6	I261 V265 H289 T290 D293 L294 F315 V316 A322 I323	I261-Y319 HydrophobicContact CD1-CD2 3.92Å; I261-Y319 HydrophobicContact CD1-CE2 3.82Å; I261-Y319 HydrophobicContact CG1-CD2 4.36Å; I261-Y319 HydrophobicContact CG1-CE2 3.9Å; I261-Y319 HydrophobicContact CG2-CD1 3.68Å; I261-Y319 HydrophobicContact CG2-CD2 3.97Å; I261-Y319 HydrophobicContact CG2-CE1 3.73Å; I261-Y319 HydrophobicContact CG2-CE2 4Å; I261-Y319 HydrophobicContact CG2-CG 3.81Å; V265-Y319 HydrophobicContact CG2-CD1 4.21Å; V265-Y319 HydrophobicContact CG2-CE1 4.17Å; H289-Y319 PolarHBondContact O-OH 2.93Å; T290-Y319 HydrophobicContact CG2-CD1 3.62Å; T290-Y319 HydrophobicContact CG2-CD2 4.31Å; T290-Y319 HydrophobicContact CG2-CE1 4.06Å; T290-Y319 HydrophobicContact CG2-CG 3.76Å; T290-Y319 WeakPolarHBondContact OG1-CD1 3.29Å; T290-Y319 WeakPolarHBondContact OG1-CE1 3.32Å; D293-Y319 HydrophobicContact CB-CE2 3.71Å; D293-Y319 WeakPolarHBondContact CB-OH 3.41Å; D293-Y319 PolarHBondContact OD2-OH 3.05Å; L294-Y319 HydrophobicContact CD2-CD2 4.44Å; F315-Y319 HydrophobicContact CD1-CE2 4.29Å; F315-Y319 WeakPolarHBondContact O-CB 3.32Å; F315-Y319 WeakPolarHBondContact O-CD2 3.48Å; F315-Y319 PolarHBondContact O-N 3.44Å; V316-Y319 PolarHBondContact O-N 3.46Å; Y319-A322 PolarHBondContact O-N 3.15Å; Y319-I323 HydrophobicContact CD1-CD1 4.46Å; Y319-I323 VanDerWaalsContact O-CB 3.28Å; Y319-I323 WeakPolarHBondContact O-CB 3.33Å; Y319-I323 WeakPolarHBondContact O-CD1 3.42Å; Y319-I323 WeakPolarHBondContact O-CG1 3.42Å; Y319-I323 PolarHBondContact O-N 2.89Å
320	H	97.4	Very high	96.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.1	-46.3	176.4	-176.8	78	0	0	0	111.8	V316 E317 G324 Y350 L370 H372 P373	V316-H320 WeakPolarHBondContact O-CB 3.35Å; V316-H320 PolarHBondContact O-N 3.12Å; E317-H320 PolarHBondContact O-N 3.07Å; H320-G324 PolarHBondContact O-N 3.02Å; H320-Y350 AromaticContact ND1-CE1 3.61Å; H320-Y350 AromaticContact ND1-CZ 3.53Å; H320-Y350 PolarHBondContact ND1-OH 2.87Å; H320-L370 HydrophobicContact CB-CD2 4.44Å; H320-H372 PolarHBondContact NE2-O 2.69Å; H320-P373 PolarHBondContact CE1-O 2.76Å; H320-P373 PolarHBondContact NE2-O 2.87Å
321	E	97.7	Very high	96.1	Very high	31 Å²	31	23.2 Å²	23.2	15%	0.145	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-49.7	175.7	-179	173.9	-162.6	0	0	111.3	F258 E317 I323 G324 M325 R371	F258-E321 HydrophobicContact CE2-CB 3.96Å; F258-E321 HydrophobicContact CE2-CG 3.75Å; F258-E321 HydrophobicContact CZ-CB 4.48Å; F258-E321 HydrophobicContact CZ-CG 3.78Å; E317-E321 WeakPolarHBondContact O-CB 3.39Å; E317-E321 PolarHBondContact O-N 3.35Å; E321-I323 PolarHBondContact O-N 3.34Å; E321-G324 PolarHBondContact O-N 3.34Å; E321-M325 HydrophobicContact CG-SD 4.47Å; E321-M325 VanDerWaalsContact O-CG 3.29Å; E321-M325 WeakPolarHBondContact O-CG 3.47Å; E321-M325 PolarHBondContact O-N 3.33Å; E321-R371 VanDerWaalsContact CD-CD 3.5Å; E321-R371 WeakPolarHBondContact OE1-CD 3.34Å; E321-R371 IonicContact OE1-CZ 3.46Å; E321-R371 IonicContact OE1-NH1 3.77Å; E321-R371 PolarHBondContact OE1-NH1 3.24Å; E321-R371 WeakPolarHBondContact OE2-CD 3.29Å; E321-R371 IonicContact OE2-NH1 2.73Å
322	A	97.2	Very high	95.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-41.3	-179.8	0	0	0	0	0	112.9	F258 I261 K262 V265 M318 Y319 H326	F258-A322 HydrophobicContact CE2-CB 4.24Å; I261-A322 HydrophobicContact CG2-CB 3.97Å; K262-A322 HydrophobicContact CB-CB 4.35Å; V265-A322 HydrophobicContact CB-CB 4.4Å; V265-A322 HydrophobicContact CG2-CB 4.06Å; M318-A322 VanDerWaalsContact O-CB 3.27Å; M318-A322 WeakPolarHBondContact O-CB 3.31Å; M318-A322 PolarHBondContact O-N 3.4Å; Y319-A322 PolarHBondContact O-N 3.15Å; A322-H326 WeakPolarHBondContact O-CB 3.37Å; A322-H326 PolarHBondContact O-N 2.68Å
323	I	97.3	Very high	95.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-44.8	176	-69.8	168.8	0	0	0	110.4	V265 I286 Y319 E321 M325 H326 V327 W346 Y350 F355 L376	V265-I323 HydrophobicContact CG1-CG1 4.16Å; V265-I323 HydrophobicContact CG2-CG1 4.23Å; I286-I323 HydrophobicContact CG2-CD1 3.95Å; I286-I323 HydrophobicContact CG2-CG1 3.92Å; Y319-I323 HydrophobicContact CD1-CD1 4.46Å; Y319-I323 VanDerWaalsContact O-CB 3.28Å; Y319-I323 WeakPolarHBondContact O-CB 3.33Å; Y319-I323 WeakPolarHBondContact O-CD1 3.42Å; Y319-I323 WeakPolarHBondContact O-CG1 3.42Å; Y319-I323 PolarHBondContact O-N 2.89Å; E321-I323 PolarHBondContact O-N 3.34Å; I323-M325 PolarHBondContact O-N 3.04Å; I323-H326 PolarHBondContact O-N 3.49Å; I323-H326 VanDerWaalsContact O-N 3.15Å; I323-V327 HydrophobicContact CG2-CG2 4.19Å; I323-V327 WeakPolarHBondContact O-CG2 3.41Å; I323-V327 PolarHBondContact O-N 3.44Å; I323-W346 HydrophobicContact CD1-CH2 4.45Å; I323-W346 HydrophobicContact CG1-CH2 4.43Å; I323-W346 HydrophobicContact CG2-CH2 3.42Å; I323-W346 VanDerWaalsContact CG2-CH2 3.42Å; I323-W346 HydrophobicContact CG2-CZ3 3.59Å; I323-Y350 HydrophobicContact CD1-CE2 4.1Å; I323-Y350 HydrophobicContact CG2-CE2 4.39Å; I323-F355 HydrophobicContact CD1-CE1 4.43Å; I323-F355 HydrophobicContact CD1-CZ 3.92Å; I323-L376 HydrophobicContact CB-CD2 4.39Å; I323-L376 HydrophobicContact CG2-CD1 3.69Å; I323-L376 HydrophobicContact CG2-CD2 3.84Å; I323-L376 HydrophobicContact CG2-CG 4.36Å
324	G	96.6	Very high	95.3	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.4	-47.3	176.7	0	0	0	0	0	112.2	H320 E321 H326 V327 E328	H320-G324 PolarHBondContact O-N 3.02Å; E321-G324 PolarHBondContact O-N 3.34Å; G324-H326 VanDerWaalsContact C-N 3.32Å; G324-H326 PolarHBondContact O-N 3.4Å; G324-V327 PolarHBondContact O-N 3.06Å; G324-E328 WeakPolarHBondContact O-CB 3.3Å; G324-E328 PolarHBondContact O-N 2.93Å
325	M	96.3	Very high	95	Very high	58 Å²	58	30.8 Å²	30.8	29%	0.286	17%	0.169	S	C	.	.	H	α-helix	trans	-59.6	-41.3	174.7	-68.2	-177	79	0	0	112.4	F258 K262 F266 E321 I323 E328 S329 H372	F258-M325 HydrophobicContact CZ-SD 4.06Å; K262-M325 HydrophobicContact CD-SD 4.48Å; F266-M325 HydrophobicContact CE2-CB 4.26Å; F266-M325 HydrophobicContact CZ-CB 4.14Å; E321-M325 HydrophobicContact CG-SD 4.47Å; E321-M325 VanDerWaalsContact O-CG 3.29Å; E321-M325 WeakPolarHBondContact O-CG 3.47Å; E321-M325 PolarHBondContact O-N 3.33Å; I323-M325 PolarHBondContact O-N 3.04Å; M325-E328 PolarHBondContact O-N 3.36Å; M325-S329 PolarHBondContact O-N 3.43Å; M325-H372 WeakPolarHBondContact CG-NE2 3.32Å
326	H	95.1	Very high	94.7	Very high	12 Å²	12	33.3 Å²	33.3	6%	0.056	19%	0.187	C	C	.	.	H	α-helix	trans	-68	-47	-179.5	-179.7	56.2	0	0	0	112	V265 F266 H282 A322 I323 G324 E328 S329 L330	V265-H326 HydrophobicContact CG1-CB 3.78Å; F266-H326 AromaticContact CD1-ND1 3.7Å; F266-H326 HydrophobicContact CD2-CB 4.11Å; F266-H326 HydrophobicContact CE1-CB 4.34Å; F266-H326 AromaticContact CE1-ND1 3.84Å; F266-H326 HydrophobicContact CE2-CB 3.72Å; F266-H326 AromaticContact CG-ND1 3.97Å; F266-H326 VanDerWaalsContact CZ-CA 3.49Å; F266-H326 HydrophobicContact CZ-CB 3.85Å; H282-H326 AromaticContact CD2-NE2 3.4Å; H282-H326 PolarHBondContact CD2-NE2 2.81Å; H282-H326 AromaticContact CE1-NE2 3.99Å; H282-H326 AromaticContact NE2-CD2 3.71Å; H282-H326 AromaticContact NE2-CE1 3.37Å; H282-H326 PolarHBondContact NE2-CE1 3.39Å; H282-H326 AromaticContact NE2-NE2 2.81Å; H282-H326 PolarHBondContact NE2-NE2 3.4Å; A322-H326 WeakPolarHBondContact O-CB 3.37Å; A322-H326 PolarHBondContact O-N 2.68Å; I323-H326 PolarHBondContact O-N 3.49Å; I323-H326 VanDerWaalsContact O-N 3.15Å; G324-H326 VanDerWaalsContact C-N 3.32Å; G324-H326 PolarHBondContact O-N 3.4Å; H326-E328 VanDerWaalsContact C-N 3.26Å; H326-E328 PolarHBondContact O-N 3.48Å; H326-S329 WeakPolarHBondContact O-CB 3.45Å; H326-S329 PolarHBondContact O-N 3.06Å; H326-S329 VanDerWaalsContact O-N 3.11Å; H326-L330 WeakPolarHBondContact O-CG 3.42Å; H326-L330 PolarHBondContact O-N 3.14Å
327	V	95.2	Very high	94.3	Very high	1 Å²	1	37 Å²	37	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-41.3	175.4	169.4	0	0	0	0	110.8	I323 G324 L330 V331 L343 W346 I347 L376 L377	I323-V327 HydrophobicContact CG2-CG2 4.19Å; I323-V327 WeakPolarHBondContact O-CG2 3.41Å; I323-V327 PolarHBondContact O-N 3.44Å; G324-V327 PolarHBondContact O-N 3.06Å; V327-L330 PolarHBondContact O-N 2.99Å; V327-V331 WeakPolarHBondContact O-CG2 3.4Å; V327-V331 PolarHBondContact O-N 3.31Å; V327-V331 VanDerWaalsContact O-N 3.14Å; V327-L343 HydrophobicContact CG1-CD1 4.11Å; V327-L343 HydrophobicContact CG1-CD2 4.35Å; V327-L343 HydrophobicContact CG2-CD1 4.17Å; V327-W346 HydrophobicContact CG2-CE3 4.34Å; V327-W346 HydrophobicContact CG2-CZ3 3.73Å; V327-I347 HydrophobicContact CG1-CD1 3.94Å; V327-I347 HydrophobicContact CG1-CG1 4.48Å; V327-L376 HydrophobicContact CG2-CD1 4.31Å; V327-L377 HydrophobicContact CG1-CD1 3.74Å; V327-L377 HydrophobicContact CG1-CD2 3.86Å; V327-L377 HydrophobicContact CG1-CG 3.59Å
328	E	94.6	Very high	93.9	Very high	57 Å²	57	39.5 Å²	39.5	27%	0.266	22%	0.223	S	C	.	.	H	α-helix	trans	-65.1	-38.8	175.8	-173.9	165.6	-146.8	0	0	112.6	G324 M325 H326 V331 L332 H372 L377 K381	G324-E328 WeakPolarHBondContact O-CB 3.3Å; G324-E328 PolarHBondContact O-N 2.93Å; M325-E328 PolarHBondContact O-N 3.36Å; H326-E328 VanDerWaalsContact C-N 3.26Å; H326-E328 PolarHBondContact O-N 3.48Å; E328-V331 PolarHBondContact O-N 2.93Å; E328-L332 HydrophobicContact CG-CD1 4.24Å; E328-L332 VanDerWaalsContact O-CG 3.3Å; E328-L332 WeakPolarHBondContact O-CG 3.34Å; E328-L332 PolarHBondContact O-N 3.46Å; E328-H372 IonicContact OE2-CE1 2.75Å; E328-L377 HydrophobicContact CB-CD2 4.3Å; E328-K381 IonicContact OE1-NZ 2.68Å; E328-K381 PolarHBondContact OE1-NZ 2.82Å
329	S	94	Very high	93.6	Very high	34 Å²	34	41.8 Å²	41.8	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-47.7	173.3	-159.6	0	0	0	0	111.7	M325 H326 V331 L332 E333	M325-S329 PolarHBondContact O-N 3.43Å; H326-S329 WeakPolarHBondContact O-CB 3.45Å; H326-S329 PolarHBondContact O-N 3.06Å; H326-S329 VanDerWaalsContact O-N 3.11Å; S329-V331 VanDerWaalsContact C-N 3.28Å; S329-V331 PolarHBondContact O-N 3.36Å; S329-L332 PolarHBondContact O-N 3.37Å; S329-E333 WeakPolarHBondContact O-CG 3.15Å; S329-E333 PolarHBondContact O-N 3.12Å; S329-E333 PolarHBondContact OG-OE1 2.93Å
330	L	92.5	Very high	93.4	Very high	26 Å²	26	41.8 Å²	41.8	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-40.6	178.4	-70.1	178.1	0	0	0	112	L279 H326 V327 G334 L335 L343	L279-L330 HydrophobicContact CD1-CD1 3.75Å; H326-L330 WeakPolarHBondContact O-CG 3.42Å; H326-L330 PolarHBondContact O-N 3.14Å; V327-L330 PolarHBondContact O-N 2.99Å; L330-G334 PolarHBondContact O-N 3.32Å; L330-L335 HydrophobicContact CB-CD2 4.22Å; L330-L343 HydrophobicContact CD1-CD1 4.34Å
331	V	92.7	Very high	93.2	Very high	34 Å²	34	43.2 Å²	43.2	21%	0.206	24%	0.242	C	C	.	.	H	α-helix	trans	-68.7	-35.5	177.2	175.2	0	0	0	0	111.9	V327 E328 S329 L335 L343 L377 L385	V327-V331 WeakPolarHBondContact O-CG2 3.4Å; V327-V331 PolarHBondContact O-N 3.31Å; V327-V331 VanDerWaalsContact O-N 3.14Å; E328-V331 PolarHBondContact O-N 2.93Å; S329-V331 VanDerWaalsContact C-N 3.28Å; S329-V331 PolarHBondContact O-N 3.36Å; V331-L335 HydrophobicContact CG2-CD1 4.09Å; V331-L343 HydrophobicContact CG2-CD2 3.83Å; V331-L377 HydrophobicContact CG2-CD1 4.02Å; V331-L377 HydrophobicContact CG2-CD2 4.43Å; V331-L385 HydrophobicContact CG2-CD1 3.83Å
332	L	92.2	Very high	92.9	Very high	131 Å²	131	42.6 Å²	42.6	69%	0.686	24%	0.24	S	C	*	.	H	α-helix	trans	-72.7	-35.9	178.7	-72.4	171	0	0	0	113	E328 S329 G334	E328-L332 HydrophobicContact CG-CD1 4.24Å; E328-L332 VanDerWaalsContact O-CG 3.3Å; E328-L332 WeakPolarHBondContact O-CG 3.34Å; E328-L332 PolarHBondContact O-N 3.46Å; S329-L332 PolarHBondContact O-N 3.37Å; L332-G334 PolarHBondContact O-N 3.07Å
333	E	89.4	Confident	92.8	Very high	144 Å²	144	42.6 Å²	42.6	67%	0.673	24%	0.24	S	C	*	.	H	α-helix	trans	-68.6	-24.4	176.6	-72.7	165.1	-146	0	0	112.3	S329	S329-E333 WeakPolarHBondContact O-CG 3.15Å; S329-E333 PolarHBondContact O-N 3.12Å; S329-E333 PolarHBondContact OG-OE1 2.93Å
334	G	88.5	Confident	92.7	Very high	49 Å²	49	42.9 Å²	42.9	51%	0.505	24%	0.241	S	C	.	.			trans	96.4	137.7	-179	0	0	0	0	0	111.4	L330 L332	L330-G334 PolarHBondContact O-N 3.32Å; L332-G334 PolarHBondContact O-N 3.07Å
335	L	90.2	Very high	92.5	Very high	29 Å²	29	42.9 Å²	42.9	15%	0.152	24%	0.241	C	C	.	.			trans	-116.9	138.4	-174.6	-62.4	165.8	0	0	0	110.4	L330 V331 E339 I340 L343 L385	L330-L335 HydrophobicContact CB-CD2 4.22Å; V331-L335 HydrophobicContact CG2-CD1 4.09Å; L335-E339 HydrophobicContact CB-CB 4.14Å; L335-E339 HydrophobicContact CD2-CB 3.87Å; L335-I340 HydrophobicContact CB-CG1 3.68Å; L335-I340 HydrophobicContact CD1-CG1 4.36Å; L335-L343 HydrophobicContact CD1-CD2 3.49Å; L335-L343 VanDerWaalsContact CD1-CD2 3.49Å; L335-L385 HydrophobicContact CD1-CD2 4.04Å
336	S	90.8	Very high	92.4	Very high	55 Å²	55	40.7 Å²	40.7	39%	0.385	23%	0.23	S	C	.	.			trans	-71.3	165.5	165.1	69.5	0	0	0	0	111.5	T338 E339 I340	S336-T338 PolarHBondContact O-N 3.3Å; S336-E339 WeakPolarHBondContact CB-OE2 3.31Å; S336-E339 PolarHBondContact N-OE2 3.22Å; S336-E339 PolarHBondContact O-N 3.25Å; S336-E339 VanDerWaalsContact OG-CD 3.27Å; S336-E339 WeakPolarHBondContact OG-CG 3.43Å; S336-E339 PolarHBondContact OG-N 3.13Å; S336-E339 PolarHBondContact OG-OE2 3.06Å; S336-I340 WeakPolarHBondContact O-CG1 3.29Å; S336-I340 PolarHBondContact O-N 3.45Å
337	D	88.6	Confident	92.4	Very high	78 Å²	78	40.6 Å²	40.6	42%	0.417	23%	0.229	S	C	.	.	H	α-helix	trans	-59.8	-34.3	-179	-65.9	-23.5	0	0	0	113.2	V341 K392	D337-V341 WeakPolarHBondContact O-CG2 3.43Å; D337-V341 PolarHBondContact O-N 3.17Å; D337-K392 WeakPolarHBondContact OD1-CD 3.29Å; D337-K392 WeakPolarHBondContact OD1-CE 3.16Å; D337-K392 IonicContact OD1-NZ 3.95Å; D337-K392 PolarHBondContact OD1-NZ 3.23Å; D337-K392 WeakPolarHBondContact OD2-CD 3.39Å; D337-K392 IonicContact OD2-NZ 3.76Å; D337-K392 PolarHBondContact OD2-NZ 3.05Å; D337-K392 VanDerWaalsContact OD2-NZ 3.11Å
338	T	89.6	Confident	92.2	Very high	73 Å²	73	43.8 Å²	43.8	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-69.2	-41.5	175.9	-46.3	0	0	0	0	110.6	S336 V341 Q342	S336-T338 PolarHBondContact O-N 3.3Å; T338-V341 PolarHBondContact O-N 3.22Å; T338-Q342 VanDerWaalsContact O-CG 3.29Å; T338-Q342 WeakPolarHBondContact O-CG 3.24Å; T338-Q342 PolarHBondContact O-N 3.26Å; T338-Q342 VanDerWaalsContact O-N 3.09Å
339	E	91.7	Very high	92.1	Very high	65 Å²	65	41.9 Å²	41.9	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-33.8	-179.4	-69.6	163.6	138.9	0	0	112.3	L279 L335 S336 V341 Q342 L343	L279-E339 HydrophobicContact CD2-CB 3.83Å; L279-E339 HydrophobicContact CD2-CG 4.03Å; L335-E339 HydrophobicContact CB-CB 4.14Å; L335-E339 HydrophobicContact CD2-CB 3.87Å; S336-E339 WeakPolarHBondContact CB-OE2 3.31Å; S336-E339 PolarHBondContact N-OE2 3.22Å; S336-E339 PolarHBondContact O-N 3.25Å; S336-E339 VanDerWaalsContact OG-CD 3.27Å; S336-E339 WeakPolarHBondContact OG-CG 3.43Å; S336-E339 PolarHBondContact OG-N 3.13Å; S336-E339 PolarHBondContact OG-OE2 3.06Å; E339-V341 VanDerWaalsContact C-N 3.32Å; E339-V341 PolarHBondContact O-N 3.08Å; E339-Q342 PolarHBondContact O-N 2.96Å; E339-L343 VanDerWaalsContact O-CB 3.28Å; E339-L343 WeakPolarHBondContact O-CB 3.45Å; E339-L343 PolarHBondContact O-N 2.74Å
340	I	94	Very high	92.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-46.2	172.7	-66.3	165.6	0	0	0	110.2	L335 S336 L343 L344 L385 Q388	L335-I340 HydrophobicContact CB-CG1 3.68Å; L335-I340 HydrophobicContact CD1-CG1 4.36Å; S336-I340 WeakPolarHBondContact O-CG1 3.29Å; S336-I340 PolarHBondContact O-N 3.45Å; I340-L343 PolarHBondContact O-N 3.06Å; I340-L344 HydrophobicContact CG2-CD1 3.8Å; I340-L344 HydrophobicContact CG2-CG 4.28Å; I340-L344 WeakPolarHBondContact O-CB 3.35Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.21Å; I340-L344 PolarHBondContact O-N 3.06Å; I340-L385 HydrophobicContact CG1-CD2 4.43Å; I340-Q388 HydrophobicContact CD1-CG 4.03Å
341	V	92.5	Very high	91.9	Very high	30 Å²	30	40.5 Å²	40.5	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-47.1	177.6	169.1	0	0	0	0	111.1	D337 T338 E339 G345 Y389 L447 L451	D337-V341 WeakPolarHBondContact O-CG2 3.43Å; D337-V341 PolarHBondContact O-N 3.17Å; T338-V341 PolarHBondContact O-N 3.22Å; E339-V341 VanDerWaalsContact C-N 3.32Å; E339-V341 PolarHBondContact O-N 3.08Å; V341-G345 PolarHBondContact O-N 2.96Å; V341-G345 VanDerWaalsContact O-N 3.11Å; V341-Y389 HydrophobicContact CG2-CD2 3.51Å; V341-Y389 HydrophobicContact CG2-CE2 3.4Å; V341-Y389 VanDerWaalsContact CG2-CE2 3.4Å; V341-L447 HydrophobicContact CG1-CD1 3.8Å; V341-L451 HydrophobicContact CB-CD2 4.48Å; V341-L451 HydrophobicContact CG1-CD2 4.15Å; V341-L451 WeakPolarHBondContact O-CD2 3.37Å
342	Q	92.3	Very high	91.8	Very high	19 Å²	19	41.3 Å²	41.3	9%	0.089	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-40.9	-179.9	-68.5	173.5	15.4	0	0	111.8	K276 L279 V280 T338 E339 W346	K276-Q342 PolarHBondContact O-NE2 3.43Å; L279-Q342 VanDerWaalsContact CB-OE1 3.29Å; L279-Q342 HydrophobicContact CD2-CB 4.11Å; L279-Q342 HydrophobicContact CG-CB 4.47Å; V280-Q342 HydrophobicContact CG2-CB 4.46Å; V280-Q342 HydrophobicContact CG2-CG 3.7Å; T338-Q342 VanDerWaalsContact O-CG 3.29Å; T338-Q342 WeakPolarHBondContact O-CG 3.24Å; T338-Q342 PolarHBondContact O-N 3.26Å; T338-Q342 VanDerWaalsContact O-N 3.09Å; E339-Q342 PolarHBondContact O-N 2.96Å; Q342-W346 VanDerWaalsContact O-CB 3.29Å; Q342-W346 WeakPolarHBondContact O-CB 3.34Å; Q342-W346 PolarHBondContact O-N 3.21Å
343	L	94.3	Very high	91.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.4	-46.2	-179.9	-173.9	63.1	0	0	0	112	L279 V327 L330 V331 L335 E339 I340 G345 W346 I347 L385	L279-L343 HydrophobicContact CD2-CB 4.46Å; V327-L343 HydrophobicContact CG1-CD1 4.11Å; V327-L343 HydrophobicContact CG1-CD2 4.35Å; V327-L343 HydrophobicContact CG2-CD1 4.17Å; L330-L343 HydrophobicContact CD1-CD1 4.34Å; V331-L343 HydrophobicContact CG2-CD2 3.83Å; L335-L343 HydrophobicContact CD1-CD2 3.49Å; L335-L343 VanDerWaalsContact CD1-CD2 3.49Å; E339-L343 VanDerWaalsContact O-CB 3.28Å; E339-L343 WeakPolarHBondContact O-CB 3.45Å; E339-L343 PolarHBondContact O-N 2.74Å; I340-L343 PolarHBondContact O-N 3.06Å; L343-G345 VanDerWaalsContact C-N 3.33Å; L343-G345 PolarHBondContact O-N 3.47Å; L343-W346 PolarHBondContact O-N 3.48Å; L343-I347 HydrophobicContact CD1-CD1 4.3Å; L343-I347 HydrophobicContact CD1-CG1 4.43Å; L343-I347 HydrophobicContact CG-CD1 3.95Å; L343-I347 HydrophobicContact CG-CG1 4.49Å; L343-I347 VanDerWaalsContact O-CG1 3.3Å; L343-I347 WeakPolarHBondContact O-CG1 3.16Å; L343-I347 PolarHBondContact O-N 3.49Å; L343-L385 HydrophobicContact CD2-CD1 4.24Å
344	L	95	Very high	91.5	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-45.9	178.3	-77.6	175.6	0	0	0	111.4	I340 I347 N348 L382 L385 R386 L451 V455	I340-L344 HydrophobicContact CG2-CD1 3.8Å; I340-L344 HydrophobicContact CG2-CG 4.28Å; I340-L344 WeakPolarHBondContact O-CB 3.35Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.21Å; I340-L344 PolarHBondContact O-N 3.06Å; L344-I347 PolarHBondContact O-N 3.49Å; L344-N348 WeakPolarHBondContact O-CB 3.5Å; L344-N348 PolarHBondContact O-N 3.07Å; L344-L382 HydrophobicContact CD2-CD1 3.81Å; L344-L385 HydrophobicContact CD2-CB 4Å; L344-L385 HydrophobicContact CG-CB 4.43Å; L344-R386 HydrophobicContact CD1-CG 4.45Å; L344-R386 HydrophobicContact CD2-CG 3.85Å; L344-L451 HydrophobicContact CB-CD2 3.71Å; L344-L451 HydrophobicContact CD1-CD2 4.36Å; L344-V455 HydrophobicContact CD1-CG2 4.43Å
345	G	93.1	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-34.4	178.5	0	0	0	0	0	113.5	V341 L343 N348 S349 Y450	V341-G345 PolarHBondContact O-N 2.96Å; V341-G345 VanDerWaalsContact O-N 3.11Å; L343-G345 VanDerWaalsContact C-N 3.33Å; L343-G345 PolarHBondContact O-N 3.47Å; G345-N348 PolarHBondContact O-N 3.32Å; G345-S349 PolarHBondContact O-N 3.41Å; G345-Y450 VanDerWaalsContact CA-CE1 3.48Å; G345-Y450 WeakPolarHBondContact CA-O 3.25Å
346	W	93.5	Very high	91.9	Very high	13 Å²	13	37.6 Å²	37.6	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-69.6	-38.2	173.9	-169.7	74.9	0	0	0	113.2	N283 I286 I323 V327 Q342 L343 N348 S349 Y350 F355 L376	N283-W346 HydrophobicContact CB-CD2 4.1Å; N283-W346 HydrophobicContact CB-CG 3.9Å; N283-W346 PolarHBondContact O-NE1 2.83Å; I286-W346 HydrophobicContact CB-CZ2 4.26Å; I286-W346 HydrophobicContact CG2-CH2 4.04Å; I286-W346 HydrophobicContact CG2-CZ2 3.89Å; I323-W346 HydrophobicContact CD1-CH2 4.45Å; I323-W346 HydrophobicContact CG1-CH2 4.43Å; I323-W346 HydrophobicContact CG2-CH2 3.42Å; I323-W346 VanDerWaalsContact CG2-CH2 3.42Å; I323-W346 HydrophobicContact CG2-CZ3 3.59Å; V327-W346 HydrophobicContact CG2-CE3 4.34Å; V327-W346 HydrophobicContact CG2-CZ3 3.73Å; Q342-W346 VanDerWaalsContact O-CB 3.29Å; Q342-W346 WeakPolarHBondContact O-CB 3.34Å; Q342-W346 PolarHBondContact O-N 3.21Å; L343-W346 PolarHBondContact O-N 3.48Å; W346-N348 VanDerWaalsContact C-N 3.29Å; W346-N348 PolarHBondContact O-N 3.11Å; W346-S349 PolarHBondContact O-N 3.38Å; W346-S349 PolarHBondContact O-OG 3.03Å; W346-Y350 PolarHBondContact O-N 2.92Å; W346-F355 HydrophobicContact CH2-CE1 4.18Å; W346-F355 HydrophobicContact CZ2-CD1 4.5Å; W346-F355 AromaticContact CZ2-CE1 3.59Å; W346-F355 HydrophobicContact CZ2-CE1 3.59Å; W346-F355 HydrophobicContact CZ2-CZ 4.23Å; W346-L376 HydrophobicContact CZ3-CD1 4.11Å
347	I	95.1	Very high	91.9	Very high	9 Å²	9	40.3 Å²	40.3	5%	0.046	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-40.4	171.8	-68.9	168.8	0	0	0	110.2	V327 L343 L344 Y350 N375 L376 L377 L382	V327-I347 HydrophobicContact CG1-CD1 3.94Å; V327-I347 HydrophobicContact CG1-CG1 4.48Å; L343-I347 HydrophobicContact CD1-CD1 4.3Å; L343-I347 HydrophobicContact CD1-CG1 4.43Å; L343-I347 HydrophobicContact CG-CD1 3.95Å; L343-I347 HydrophobicContact CG-CG1 4.49Å; L343-I347 VanDerWaalsContact O-CG1 3.3Å; L343-I347 WeakPolarHBondContact O-CG1 3.16Å; L343-I347 PolarHBondContact O-N 3.49Å; L344-I347 PolarHBondContact O-N 3.49Å; I347-Y350 WeakPolarHBondContact O-CB 3.27Å; I347-Y350 PolarHBondContact O-N 3.22Å; I347-N375 WeakPolarHBondContact CG2-O 3.4Å; I347-L376 HydrophobicContact CG1-CD1 4.38Å; I347-L377 HydrophobicContact CD1-CD1 3.78Å; I347-L377 HydrophobicContact CD1-CG 4.43Å; I347-L382 HydrophobicContact CD1-CD1 4.14Å; I347-L382 HydrophobicContact CG2-CD1 4.33Å
348	N	92.2	Very high	91.9	Very high	69 Å²	69	38.3 Å²	38.3	37%	0.369	19%	0.193	S	C	.	.	H	α-helix	trans	-66.5	-36.8	177	-167	43.6	0	0	0	112	L344 G345 W346 Y350 H449 Y450	L344-N348 WeakPolarHBondContact O-CB 3.5Å; L344-N348 PolarHBondContact O-N 3.07Å; G345-N348 PolarHBondContact O-N 3.32Å; W346-N348 VanDerWaalsContact C-N 3.29Å; W346-N348 PolarHBondContact O-N 3.11Å; N348-Y350 VanDerWaalsContact C-N 3.28Å; N348-Y350 PolarHBondContact O-N 3.46Å; N348-H449 PolarHBondContact ND2-O 3.02Å; N348-Y450 PolarHBondContact ND2-O 2.88Å
349	S	91.8	Very high	91.9	Very high	17 Å²	17	38.8 Å²	38.8	12%	0.119	20%	0.197	C	C	.	.	H	α-helix	trans	-74.9	-13.5	175.6	75.1	0	0	0	0	114	G345 W346 H351 T352	G345-S349 PolarHBondContact O-N 3.41Å; W346-S349 PolarHBondContact O-N 3.38Å; W346-S349 PolarHBondContact O-OG 3.03Å; S349-H351 PolarHBondContact O-N 3.42Å; S349-T352 PolarHBondContact O-N 3.17Å; S349-T352 PolarHBondContact O-OG1 3.43Å
350	Y	93.8	Very high	91.7	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-55.7	-40.1	178.4	-170.6	-100.7	0	0	0	112.6	H320 I323 W346 I347 N348 F355 M356 F365 L376	H320-Y350 AromaticContact ND1-CE1 3.61Å; H320-Y350 AromaticContact ND1-CZ 3.53Å; H320-Y350 PolarHBondContact ND1-OH 2.87Å; I323-Y350 HydrophobicContact CD1-CE2 4.1Å; I323-Y350 HydrophobicContact CG2-CE2 4.39Å; W346-Y350 PolarHBondContact O-N 2.92Å; I347-Y350 WeakPolarHBondContact O-CB 3.27Å; I347-Y350 PolarHBondContact O-N 3.22Å; N348-Y350 VanDerWaalsContact C-N 3.28Å; N348-Y350 PolarHBondContact O-N 3.46Å; Y350-F355 AromaticContact CD2-CD1 3.62Å; Y350-F355 HydrophobicContact CD2-CD1 3.62Å; Y350-F355 AromaticContact CD2-CE1 3.47Å; Y350-F355 HydrophobicContact CD2-CE1 3.47Å; Y350-F355 VanDerWaalsContact CD2-CE1 3.47Å; Y350-F355 HydrophobicContact CD2-CZ 4.36Å; Y350-F355 HydrophobicContact CE2-CD1 4.27Å; Y350-F355 AromaticContact CE2-CE1 3.81Å; Y350-F355 HydrophobicContact CE2-CE1 3.81Å; Y350-F355 HydrophobicContact CE2-CZ 4.28Å; Y350-F355 HydrophobicContact CG-CD1 4.39Å; Y350-M356 HydrophobicContact CD1-CG 4.35Å; Y350-M356 HydrophobicContact CD2-CG 3.92Å; Y350-M356 HydrophobicContact CE1-CB 4.34Å; Y350-M356 HydrophobicContact CE1-CG 3.95Å; Y350-M356 HydrophobicContact CE2-CG 3.45Å; Y350-M356 VanDerWaalsContact CE2-CG 3.45Å; Y350-M356 HydrophobicContact CE2-SD 4.4Å; Y350-M356 HydrophobicContact CG-CG 4.35Å; Y350-M356 VanDerWaalsContact CZ-CG 3.47Å; Y350-M356 VanDerWaalsContact O-CB 3.31Å; Y350-M356 WeakPolarHBondContact O-CB 3.36Å; Y350-M356 PolarHBondContact O-N 2.92Å; Y350-F365 HydrophobicContact CE1-CE1 4.35Å; Y350-F365 HydrophobicContact CE1-CZ 4.27Å; Y350-L376 HydrophobicContact CD1-CD1 4.39Å; Y350-L376 HydrophobicContact CD1-CD2 4.44Å; Y350-L376 HydrophobicContact CD1-CG 4.34Å; Y350-L376 HydrophobicContact CD2-CD1 3.74Å; Y350-L376 HydrophobicContact CD2-CD2 4.41Å; Y350-L376 HydrophobicContact CD2-CG 4.4Å; Y350-L376 HydrophobicContact CE1-CD2 4.03Å; Y350-L376 HydrophobicContact CE1-CG 4.4Å; Y350-L376 HydrophobicContact CE2-CD1 4.1Å; Y350-L376 HydrophobicContact CE2-CD2 4Å; Y350-L376 HydrophobicContact CE2-CG 4.47Å; Y350-L376 HydrophobicContact CG-CD1 3.89Å; Y350-L376 HydrophobicContact CG-CG 4.33Å
351	H	88.8	Confident	91.4	Very high	30 Å²	30	44.9 Å²	44.9	14%	0.139	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	29.5	-178.4	-75.9	-64.2	0	0	0	114	S349 K357 F365 I374	S349-H351 PolarHBondContact O-N 3.42Å; H351-K357 WeakPolarHBondContact O-CD 3.29Å; H351-K357 WeakPolarHBondContact O-CE 3.45Å; H351-K357 PolarHBondContact O-NZ 2.88Å; H351-F365 AromaticContact CE1-CZ 3.86Å; H351-F365 AromaticContact ND1-CE2 3.97Å; H351-I374 PolarHBondContact NE2-O 3.44Å
352	T	90.5	Very high	91.3	Very high	50 Å²	50	49.8 Å²	49.8	31%	0.307	25%	0.249	S	C	.	.	S	Bend	trans	-114.1	171.3	175.5	73.5	0	0	0	0	111.9	S349 E354 F355 K357	S349-T352 PolarHBondContact O-N 3.17Å; S349-T352 PolarHBondContact O-OG1 3.43Å; T352-E354 PolarHBondContact O-N 2.91Å; T352-E354 PolarHBondContact OG1-N 2.96Å; T352-F355 PolarHBondContact O-N 3.38Å; T352-K357 CarbonylContact O-C 3.46Å; T352-K357 WeakPolarHBondContact O-CA 3.3Å; T352-K357 WeakPolarHBondContact O-CB 3.48Å; T352-K357 PolarHBondContact O-N 2.67Å
353	E	88.9	Confident	91.3	Very high	138 Å²	138	50 Å²	50	65%	0.645	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.5	177.9	-61	-174.5	172.4	0	0	113.2	F355 N358 P359	E353-F355 VanDerWaalsContact C-N 3.27Å; E353-F355 PolarHBondContact O-N 3.44Å; E353-N358 WeakPolarHBondContact O-CA 3.28Å; E353-N358 WeakPolarHBondContact O-CB 3.46Å; E353-N358 PolarHBondContact O-ND2 3.18Å; E353-N358 VanDerWaalsContact O-ND2 3.17Å; E353-P359 HydrophobicContact CG-CG 4.34Å
354	E	87.2	Confident	91.1	Very high	136 Å²	136	52.9 Å²	52.9	64%	0.636	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-21.9	178.3	-59.3	-175.9	159.8	0	0	112.7	R287 T352	R287-E354 PolarHBondContact NH1-O 3.25Å; T352-E354 PolarHBondContact O-N 2.91Å; T352-E354 PolarHBondContact OG1-N 2.96Å
355	F	93.2	Very high	90.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-111.6	-179.2	-162.2	-174.1	0	0	0	113.2	R287 T290 L291 I323 W346 Y350 T352 E353 K357 N358	R287-F355 HydrophobicContact CB-CD2 4.49Å; R287-F355 HydrophobicContact CB-CE2 4.25Å; R287-F355 HydrophobicContact CB-CZ 4.34Å; R287-F355 HydrophobicContact CG-CB 4.33Å; R287-F355 HydrophobicContact CG-CD1 4.22Å; R287-F355 HydrophobicContact CG-CD2 3.53Å; R287-F355 HydrophobicContact CG-CE1 4.43Å; R287-F355 HydrophobicContact CG-CE2 3.75Å; R287-F355 HydrophobicContact CG-CG 3.79Å; R287-F355 HydrophobicContact CG-CZ 4.2Å; T290-F355 HydrophobicContact CG2-CE2 3.77Å; T290-F355 HydrophobicContact CG2-CZ 4.22Å; L291-F355 HydrophobicContact CD2-CD2 4.38Å; L291-F355 HydrophobicContact CG-CD2 4.43Å; I323-F355 HydrophobicContact CD1-CE1 4.43Å; I323-F355 HydrophobicContact CD1-CZ 3.92Å; W346-F355 HydrophobicContact CH2-CE1 4.18Å; W346-F355 HydrophobicContact CZ2-CD1 4.5Å; W346-F355 AromaticContact CZ2-CE1 3.59Å; W346-F355 HydrophobicContact CZ2-CE1 3.59Å; W346-F355 HydrophobicContact CZ2-CZ 4.23Å; Y350-F355 AromaticContact CD2-CD1 3.62Å; Y350-F355 HydrophobicContact CD2-CD1 3.62Å; Y350-F355 AromaticContact CD2-CE1 3.47Å; Y350-F355 HydrophobicContact CD2-CE1 3.47Å; Y350-F355 VanDerWaalsContact CD2-CE1 3.47Å; Y350-F355 HydrophobicContact CD2-CZ 4.36Å; Y350-F355 HydrophobicContact CE2-CD1 4.27Å; Y350-F355 AromaticContact CE2-CE1 3.81Å; Y350-F355 HydrophobicContact CE2-CE1 3.81Å; Y350-F355 HydrophobicContact CE2-CZ 4.28Å; Y350-F355 HydrophobicContact CG-CD1 4.39Å; T352-F355 PolarHBondContact O-N 3.38Å; E353-F355 VanDerWaalsContact C-N 3.27Å; E353-F355 PolarHBondContact O-N 3.44Å; F355-K357 PolarHBondContact O-N 3.4Å; F355-N358 VanDerWaalsContact O-CB 3.24Å; F355-N358 WeakPolarHBondContact O-CB 3.19Å; F355-N358 PolarHBondContact O-N 3.44Å
356	M	93.8	Very high	90.6	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.9	-166.4	-62.7	-69.2	-71.8	0	0	114.2	T290 L294 V316 Y350 N358 I363 F365	T290-M356 HydrophobicContact CG2-SD 3.91Å; L294-M356 HydrophobicContact CD1-CE 4.16Å; L294-M356 HydrophobicContact CD1-SD 4.05Å; V316-M356 HydrophobicContact CG1-CE 3.75Å; Y350-M356 HydrophobicContact CD1-CG 4.35Å; Y350-M356 HydrophobicContact CD2-CG 3.92Å; Y350-M356 HydrophobicContact CE1-CB 4.34Å; Y350-M356 HydrophobicContact CE1-CG 3.95Å; Y350-M356 HydrophobicContact CE2-CG 3.45Å; Y350-M356 VanDerWaalsContact CE2-CG 3.45Å; Y350-M356 HydrophobicContact CE2-SD 4.4Å; Y350-M356 HydrophobicContact CG-CG 4.35Å; Y350-M356 VanDerWaalsContact CZ-CG 3.47Å; Y350-M356 VanDerWaalsContact O-CB 3.31Å; Y350-M356 WeakPolarHBondContact O-CB 3.36Å; Y350-M356 PolarHBondContact O-N 2.92Å; M356-N358 VanDerWaalsContact C-N 3.26Å; M356-I363 HydrophobicContact CE-CD1 4.05Å; M356-F365 HydrophobicContact CB-CE2 4.23Å; M356-F365 HydrophobicContact CB-CZ 3.71Å; M356-F365 HydrophobicContact CE-CZ 4.49Å
357	K	89.8	Confident	90.5	Very high	112 Å²	112	69.5 Å²	69.5	49%	0.487	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	22.5	168.7	-65.4	-164	-166.7	153.3	0	112.8	H351 T352 F355 P359 F365	H351-K357 WeakPolarHBondContact O-CD 3.29Å; H351-K357 WeakPolarHBondContact O-CE 3.45Å; H351-K357 PolarHBondContact O-NZ 2.88Å; T352-K357 CarbonylContact O-C 3.46Å; T352-K357 WeakPolarHBondContact O-CA 3.3Å; T352-K357 WeakPolarHBondContact O-CB 3.48Å; T352-K357 PolarHBondContact O-N 2.67Å; F355-K357 PolarHBondContact O-N 3.4Å; K357-P359 WeakPolarHBondContact O-CD 3.43Å; K357-F365 HydrophobicContact CG-CE2 4.38Å
358	N	89.4	Confident	90.4	Very high	36 Å²	36	69.9 Å²	69.9	19%	0.193	34%	0.342	C	S	.	.			trans	-55.7	124	174	-172.5	-70.5	0	0	0	110.9	E353 F355 M356 F360 M361 N362	E353-N358 WeakPolarHBondContact O-CA 3.28Å; E353-N358 WeakPolarHBondContact O-CB 3.46Å; E353-N358 PolarHBondContact O-ND2 3.18Å; E353-N358 VanDerWaalsContact O-ND2 3.17Å; F355-N358 VanDerWaalsContact O-CB 3.24Å; F355-N358 WeakPolarHBondContact O-CB 3.19Å; F355-N358 PolarHBondContact O-N 3.44Å; M356-N358 VanDerWaalsContact C-N 3.26Å; N358-F360 PolarHBondContact O-N 3.23Å; N358-F360 VanDerWaalsContact O-N 3.13Å; N358-F360 VanDerWaalsContact OD1-CB 3.29Å; N358-F360 WeakPolarHBondContact OD1-CB 3.42Å; N358-F360 VanDerWaalsContact OD1-CD2 3.31Å; N358-F360 WeakPolarHBondContact OD1-CD2 3.46Å; N358-F360 PolarHBondContact OD1-N 3.17Å; N358-M361 HydrophobicContact CB-CG 4.33Å; N358-M361 PolarHBondContact O-N 3Å; N358-N362 PolarHBondContact O-N 3.35Å
359	P	88.9	Confident	90.5	Very high	83 Å²	83	71.8 Å²	71.8	54%	0.539	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.8	-175.8	-27.9	35.1	0	0	0	114.1	E353 K357 M361 N362	E353-P359 HydrophobicContact CG-CG 4.34Å; K357-P359 WeakPolarHBondContact O-CD 3.43Å; P359-M361 VanDerWaalsContact C-N 3.25Å; P359-M361 PolarHBondContact O-N 2.93Å; P359-N362 PolarHBondContact O-N 3.47Å
360	F	87.3	Confident	90.6	Very high	180 Å²	180	73.4 Å²	73.4	79%	0.789	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.2	177.5	-65	-74.9	0	0	0	112.5	K298 N358	K298-F360 PolarHBondContact NZ-O 3.47Å; N358-F360 PolarHBondContact O-N 3.23Å; N358-F360 VanDerWaalsContact O-N 3.13Å; N358-F360 VanDerWaalsContact OD1-CB 3.29Å; N358-F360 WeakPolarHBondContact OD1-CB 3.42Å; N358-F360 VanDerWaalsContact OD1-CD2 3.31Å; N358-F360 WeakPolarHBondContact OD1-CD2 3.46Å; N358-F360 PolarHBondContact OD1-N 3.17Å
361	M	88.6	Confident	90.5	Very high	13 Å²	13	82.7 Å²	82.7	6%	0.064	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-32.6	177.5	-65.3	-60.3	-166	0	0	112.3	L291 L294 K295 K298 F312 N358 P359 I363	L291-M361 HydrophobicContact CD2-CE 4.12Å; L291-M361 VanDerWaalsContact O-CE 3.32Å; L291-M361 WeakPolarHBondContact O-CE 3.36Å; L294-M361 HydrophobicContact CB-CE 3.28Å; L294-M361 HydrophobicContact CB-SD 3.92Å; L294-M361 HydrophobicContact CD1-CE 4.4Å; L294-M361 HydrophobicContact CG-CE 4.48Å; K295-M361 HydrophobicContact CB-CE 4.27Å; K298-M361 HydrophobicContact CD-SD 4.45Å; K298-M361 PolarHBondContact NZ-O 3.28Å; F312-M361 HydrophobicContact CE2-SD 4.27Å; F312-M361 HydrophobicContact CZ-CB 4.44Å; F312-M361 HydrophobicContact CZ-SD 4.45Å; N358-M361 HydrophobicContact CB-CG 4.33Å; N358-M361 PolarHBondContact O-N 3Å; P359-M361 VanDerWaalsContact C-N 3.25Å; P359-M361 PolarHBondContact O-N 2.93Å; M361-I363 VanDerWaalsContact C-N 3.32Å; M361-I363 HydrophobicContact CB-CD1 3.87Å; M361-I363 HydrophobicContact CB-CG1 3.88Å; M361-I363 PolarHBondContact O-N 2.99Å
362	N	89.4	Confident	90.7	Very high	134 Å²	134	82.7 Å²	82.7	72%	0.717	39%	0.394	S	S	*	.			trans	49.1	50.8	179.4	-168.1	40.2	0	0	0	112.6	N358 P359	N358-N362 PolarHBondContact O-N 3.35Å; P359-N362 PolarHBondContact O-N 3.47Å
363	I	92.2	Very high	90.8	Very high	24 Å²	24	82.8 Å²	82.8	12%	0.123	40%	0.396	C	S	.	.			trans	-79.9	122.5	-178.5	-66.4	167.3	0	0	0	109.1	L294 F312 V316 M356 M361 F365 L368	L294-I363 HydrophobicContact CD1-CD1 4.28Å; F312-I363 HydrophobicContact CE1-CG1 4.15Å; F312-I363 HydrophobicContact CZ-CD1 4.4Å; F312-I363 HydrophobicContact CZ-CG1 3.88Å; V316-I363 HydrophobicContact CG1-CD1 4.1Å; V316-I363 HydrophobicContact CG1-CG2 3.94Å; V316-I363 HydrophobicContact CG2-CD1 3.85Å; V316-I363 HydrophobicContact CG2-CG1 4.12Å; M356-I363 HydrophobicContact CE-CD1 4.05Å; M361-I363 VanDerWaalsContact C-N 3.32Å; M361-I363 HydrophobicContact CB-CD1 3.87Å; M361-I363 HydrophobicContact CB-CG1 3.88Å; M361-I363 PolarHBondContact O-N 2.99Å; I363-F365 HydrophobicContact CG2-CD2 3.93Å; I363-F365 HydrophobicContact CG2-CE2 3.89Å; I363-F365 HydrophobicContact CG2-CG 4.29Å; I363-F365 HydrophobicContact CG2-CZ 4.22Å; I363-L368 HydrophobicContact CG2-CD1 3.94Å
364	D	90.8	Very high	90.8	Very high	59 Å²	59	80.1 Å²	80.1	32%	0.316	39%	0.385	S	S	.	.			trans	-98.9	94.9	170.5	-175.1	-0.1	0	0	0	109.6	N366 R367	D364-N366 PolarHBondContact O-N 2.94Å; D364-N366 WeakPolarHBondContact OD1-CB 3.29Å; D364-N366 PolarHBondContact OD1-N 3.01Å; D364-N366 VanDerWaalsContact OD1-N 3.15Å; D364-N366 PolarHBondContact OD1-ND2 3.37Å; D364-R367 HydrophobicContact CB-CG 4.22Å; D364-R367 PolarHBondContact O-N 3.5Å; D364-R367 VanDerWaalsContact O-N 3.07Å; D364-R367 WeakPolarHBondContact OD2-CD 3.46Å; D364-R367 WeakPolarHBondContact OD2-CG 3.39Å; D364-R367 IonicContact OD2-CZ 3.59Å; D364-R367 IonicContact OD2-NE 3.39Å; D364-R367 PolarHBondContact OD2-NE 2.95Å; D364-R367 IonicContact OD2-NH2 3.75Å
365	F	89.2	Confident	91	Very high	22 Å²	22	76.3 Å²	76.3	10%	0.096	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-57.9	-21.2	-179.5	-78.3	-85.7	0	0	0	113.7	Y350 H351 M356 K357 I363 R367 L368 L370 I374	Y350-F365 HydrophobicContact CE1-CE1 4.35Å; Y350-F365 HydrophobicContact CE1-CZ 4.27Å; H351-F365 AromaticContact CE1-CZ 3.86Å; H351-F365 AromaticContact ND1-CE2 3.97Å; M356-F365 HydrophobicContact CB-CE2 4.23Å; M356-F365 HydrophobicContact CB-CZ 3.71Å; M356-F365 HydrophobicContact CE-CZ 4.49Å; K357-F365 HydrophobicContact CG-CE2 4.38Å; I363-F365 HydrophobicContact CG2-CD2 3.93Å; I363-F365 HydrophobicContact CG2-CE2 3.89Å; I363-F365 HydrophobicContact CG2-CG 4.29Å; I363-F365 HydrophobicContact CG2-CZ 4.22Å; F365-R367 PolarHBondContact O-N 3.47Å; F365-L368 HydrophobicContact CD1-CD1 4.12Å; F365-L368 PolarHBondContact O-N 2.92Å; F365-L370 HydrophobicContact CD1-CD1 4.12Å; F365-I374 HydrophobicContact CB-CD1 4.48Å
366	N	89.3	Confident	91	Very high	152 Å²	152	76.3 Å²	76.3	81%	0.813	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-74	-16.3	179.5	-55.1	-63.2	0	0	0	113.2	D364	D364-N366 PolarHBondContact O-N 2.94Å; D364-N366 WeakPolarHBondContact OD1-CB 3.29Å; D364-N366 PolarHBondContact OD1-N 3.01Å; D364-N366 VanDerWaalsContact OD1-N 3.15Å; D364-N366 PolarHBondContact OD1-ND2 3.37Å
367	R	89.8	Confident	91	Very high	193 Å²	193	76.3 Å²	76.3	73%	0.728	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-94.5	-11.5	179.8	-61.3	-179.2	-169.4	-162.5	-3.8	113.1	D364 F365	D364-R367 HydrophobicContact CB-CG 4.22Å; D364-R367 PolarHBondContact O-N 3.5Å; D364-R367 VanDerWaalsContact O-N 3.07Å; D364-R367 WeakPolarHBondContact OD2-CD 3.46Å; D364-R367 WeakPolarHBondContact OD2-CG 3.39Å; D364-R367 IonicContact OD2-CZ 3.59Å; D364-R367 IonicContact OD2-NE 3.39Å; D364-R367 PolarHBondContact OD2-NE 2.95Å; D364-R367 IonicContact OD2-NH2 3.75Å; F365-R367 PolarHBondContact O-N 3.47Å
368	L	93.9	Very high	91.2	Very high	17 Å²	17	73.2 Å²	73.2	9%	0.089	36%	0.36	C	S	.	.	S	Bend	trans	-88	148	-173.5	-57.2	179.2	0	0	0	111.6	D313 V316 E317 I363 F365 L370	D313-L368 HydrophobicContact CB-CD2 3.63Å; V316-L368 HydrophobicContact CB-CD1 4.21Å; V316-L368 HydrophobicContact CG1-CD1 3.46Å; V316-L368 VanDerWaalsContact CG1-CD1 3.46Å; E317-L368 HydrophobicContact CG-CB 4.14Å; E317-L368 HydrophobicContact CG-CD2 4.35Å; I363-L368 HydrophobicContact CG2-CD1 3.94Å; F365-L368 HydrophobicContact CD1-CD1 4.12Å; F365-L368 PolarHBondContact O-N 2.92Å; L368-L370 HydrophobicContact CB-CD2 3.7Å; L368-L370 HydrophobicContact CB-CG 4.12Å; L368-L370 HydrophobicContact CD1-CD2 4.05Å; L368-L370 PolarHBondContact O-N 3.25Å
369	N	93.2	Very high	91.4	Very high	110 Å²	110	76.1 Å²	76.1	59%	0.588	38%	0.376	S	S	*	.			trans	-92.1	76.2	172.7	-56.5	-76.8	0	0	0	109.9	E317 R371	E317-N369 WeakPolarHBondContact OE1-CB 3.31Å; E317-N369 PolarHBondContact OE1-N 3.06Å; E317-N369 PolarHBondContact OE1-ND2 3.11Å; N369-R371 PolarHBondContact O-N 3.43Å
370	L	94	Very high	91.6	Very high	51 Å²	51	80.2 Å²	80.2	27%	0.267	39%	0.388	S	S	.	.			trans	-73	126.3	-178.2	-52.6	179.3	0	0	0	111	H320 F365 L368	H320-L370 HydrophobicContact CB-CD2 4.44Å; F365-L370 HydrophobicContact CD1-CD1 4.12Å; L368-L370 HydrophobicContact CB-CD2 3.7Å; L368-L370 HydrophobicContact CB-CG 4.12Å; L368-L370 HydrophobicContact CD1-CD2 4.05Å; L368-L370 PolarHBondContact O-N 3.25Å
371	R	92.2	Very high	91.9	Very high	195 Å²	195	74.9 Å²	74.9	74%	0.736	36%	0.364	S	S	*	.	S	Bend	trans	-89.6	-22.4	173.8	-69.1	177.4	175.7	-175.2	3	113.6	E321 N369	E321-R371 VanDerWaalsContact CD-CD 3.5Å; E321-R371 WeakPolarHBondContact OE1-CD 3.34Å; E321-R371 IonicContact OE1-CZ 3.46Å; E321-R371 IonicContact OE1-NH1 3.77Å; E321-R371 PolarHBondContact OE1-NH1 3.24Å; E321-R371 WeakPolarHBondContact OE2-CD 3.29Å; E321-R371 IonicContact OE2-NH1 2.73Å; N369-R371 PolarHBondContact O-N 3.43Å
372	H	92.6	Very high	92.2	Very high	31 Å²	31	74.4 Å²	74.4	14%	0.144	36%	0.362	C	S	.	.	S	Bend	trans	-102.9	157.6	172.1	-90.1	-96.3	0	0	0	110.5	H320 M325 E328	H320-H372 PolarHBondContact NE2-O 2.69Å; M325-H372 WeakPolarHBondContact CG-NE2 3.32Å; E328-H372 IonicContact OE2-CE1 2.75Å
373	P	92.7	Very high	92.4	Very high	52 Å²	52	70.7 Å²	70.7	34%	0.338	34%	0.342	S	S	.	.			trans	-58.2	149.5	174.3	-24.4	35.6	0	0	0	111.8	H320 N375 L376 P378	H320-P373 PolarHBondContact CE1-O 2.76Å; H320-P373 PolarHBondContact NE2-O 2.87Å; P373-N375 PolarHBondContact O-N 2.79Å; P373-L376 WeakPolarHBondContact O-CA 3.29Å; P373-L376 PolarHBondContact O-N 3.45Å; P373-P378 HydrophobicContact CG-CG 4.33Å
374	I	90.3	Very high	92.6	Very high	82 Å²	82	73 Å²	73	42%	0.421	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35	-178.2	-164	161.6	0	0	0	112.5	H351 F365 L376	H351-I374 PolarHBondContact NE2-O 3.44Å; F365-I374 HydrophobicContact CB-CD1 4.48Å; I374-L376 VanDerWaalsContact C-N 3.29Å; I374-L376 PolarHBondContact O-N 3.27Å
375	N	89.9	Confident	92.8	Very high	55 Å²	55	70.6 Å²	70.6	29%	0.294	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	22.1	178.3	-63.6	-36.9	0	0	0	113.5	I347 P373 L377 L382	I347-N375 WeakPolarHBondContact CG2-O 3.4Å; P373-N375 PolarHBondContact O-N 2.79Å; N375-L377 PolarHBondContact O-N 2.92Å; N375-L382 HydrophobicContact CB-CD2 4.13Å
376	L	94.7	Very high	93.2	Very high	1 Å²	1	71.9 Å²	71.9	1%	0.005	35%	0.352	C	S	.	.	S	Bend	trans	66.9	-30.5	179.6	-54.5	172.2	0	0	0	115.6	I323 V327 W346 I347 Y350 P373 I374	I323-L376 HydrophobicContact CB-CD2 4.39Å; I323-L376 HydrophobicContact CG2-CD1 3.69Å; I323-L376 HydrophobicContact CG2-CD2 3.84Å; I323-L376 HydrophobicContact CG2-CG 4.36Å; V327-L376 HydrophobicContact CG2-CD1 4.31Å; W346-L376 HydrophobicContact CZ3-CD1 4.11Å; I347-L376 HydrophobicContact CG1-CD1 4.38Å; Y350-L376 HydrophobicContact CD1-CD1 4.39Å; Y350-L376 HydrophobicContact CD1-CD2 4.44Å; Y350-L376 HydrophobicContact CD1-CG 4.34Å; Y350-L376 HydrophobicContact CD2-CD1 3.74Å; Y350-L376 HydrophobicContact CD2-CD2 4.41Å; Y350-L376 HydrophobicContact CD2-CG 4.4Å; Y350-L376 HydrophobicContact CE1-CD2 4.03Å; Y350-L376 HydrophobicContact CE1-CG 4.4Å; Y350-L376 HydrophobicContact CE2-CD1 4.1Å; Y350-L376 HydrophobicContact CE2-CD2 4Å; Y350-L376 HydrophobicContact CE2-CG 4.47Å; Y350-L376 HydrophobicContact CG-CD1 3.89Å; Y350-L376 HydrophobicContact CG-CG 4.33Å; P373-L376 WeakPolarHBondContact O-CA 3.29Å; P373-L376 PolarHBondContact O-N 3.45Å; I374-L376 VanDerWaalsContact C-N 3.29Å; I374-L376 PolarHBondContact O-N 3.27Å
377	L	93.8	Very high	93.5	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.34	C	S	.	.	S	Bend	trans	-118	149.9	176.1	-73	173.8	0	0	0	111.3	V327 E328 V331 I347 N375 L382 L385	V327-L377 HydrophobicContact CG1-CD1 3.74Å; V327-L377 HydrophobicContact CG1-CD2 3.86Å; V327-L377 HydrophobicContact CG1-CG 3.59Å; E328-L377 HydrophobicContact CB-CD2 4.3Å; V331-L377 HydrophobicContact CG2-CD1 4.02Å; V331-L377 HydrophobicContact CG2-CD2 4.43Å; I347-L377 HydrophobicContact CD1-CD1 3.78Å; I347-L377 HydrophobicContact CD1-CG 4.43Å; N375-L377 PolarHBondContact O-N 2.92Å; L377-L382 HydrophobicContact CB-CB 4.25Å; L377-L382 HydrophobicContact CD1-CD1 4.48Å; L377-L385 HydrophobicContact CD1-CD1 3.9Å
378	P	93.5	Very high	93.8	Very high	47 Å²	47	65.3 Å²	65.3	31%	0.305	32%	0.322	S	S	.	.			trans	-57.2	143.2	163.7	-21.7	32.8	0	0	0	110.9	P373 E380 K381 L382	P373-P378 HydrophobicContact CG-CG 4.33Å; P378-E380 PolarHBondContact O-N 3.38Å; P378-E380 VanDerWaalsContact O-N 3.12Å; P378-K381 PolarHBondContact O-N 3.36Å; P378-L382 PolarHBondContact O-N 3.03Å
379	D	92.3	Very high	93.8	Very high	98 Å²	98	65.5 Å²	65.5	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-57.1	-32.6	-175.8	-71	-36.5	0	0	0	112.9	L382 N383	D379-L382 PolarHBondContact O-N 3.46Å; D379-N383 WeakPolarHBondContact O-CB 3.43Å; D379-N383 PolarHBondContact O-N 3.49Å; D379-N383 PolarHBondContact O-ND2 3.2Å; D379-N383 VanDerWaalsContact O-ND2 3.08Å
380	E	93.8	Very high	94	Very high	169 Å²	169	60.2 Å²	60.2	79%	0.79	29%	0.294	S	S	*	.	H	α-helix	trans	-60.4	-49.9	175.6	-64.4	179.8	175.3	0	0	112.2	P378 N383 S384	P378-E380 PolarHBondContact O-N 3.38Å; P378-E380 VanDerWaalsContact O-N 3.12Å; E380-N383 PolarHBondContact O-N 2.9Å; E380-S384 WeakPolarHBondContact O-CB 3.42Å; E380-S384 PolarHBondContact O-N 3.46Å
381	K	93.5	Very high	94.1	Very high	68 Å²	68	60.9 Å²	60.9	30%	0.296	30%	0.303	S	S	.	.	H	α-helix	trans	-66.8	-43	178.8	-67.9	-171.5	178.6	-176.6	0	110.9	E328 P378 N383 S384 L385	E328-K381 IonicContact OE1-NZ 2.68Å; E328-K381 PolarHBondContact OE1-NZ 2.82Å; P378-K381 PolarHBondContact O-N 3.36Å; K381-N383 PolarHBondContact O-N 3.01Å; K381-S384 WeakPolarHBondContact O-CB 3.36Å; K381-S384 PolarHBondContact O-N 2.98Å; K381-L385 PolarHBondContact O-N 3.43Å; K381-L385 VanDerWaalsContact O-N 3.11Å
382	L	94.2	Very high	94.2	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-43.6	178.5	-174.3	58.4	0	0	0	111.4	L344 I347 N375 L377 P378 D379 S384 L385 R386	L344-L382 HydrophobicContact CD2-CD1 3.81Å; I347-L382 HydrophobicContact CD1-CD1 4.14Å; I347-L382 HydrophobicContact CG2-CD1 4.33Å; N375-L382 HydrophobicContact CB-CD2 4.13Å; L377-L382 HydrophobicContact CB-CB 4.25Å; L377-L382 HydrophobicContact CD1-CD1 4.48Å; P378-L382 PolarHBondContact O-N 3.03Å; D379-L382 PolarHBondContact O-N 3.46Å; L382-S384 VanDerWaalsContact C-N 3.32Å; L382-S384 PolarHBondContact O-N 3.01Å; L382-L385 PolarHBondContact O-N 3.31Å; L382-R386 VanDerWaalsContact CD2-NH2 3.33Å; L382-R386 VanDerWaalsContact O-CG 3.27Å; L382-R386 WeakPolarHBondContact O-CG 3.32Å; L382-R386 PolarHBondContact O-N 3.09Å; L382-R386 VanDerWaalsContact O-N 3.07Å
383	N	95.3	Very high	94.3	Very high	57 Å²	57	54 Å²	54	31%	0.305	28%	0.278	S	S	.	.	H	α-helix	trans	-67.4	-32.2	176	-71.9	-27.9	0	0	0	112.5	D379 E380 K381 R386 K387	D379-N383 WeakPolarHBondContact O-CB 3.43Å; D379-N383 PolarHBondContact O-N 3.49Å; D379-N383 PolarHBondContact O-ND2 3.2Å; D379-N383 VanDerWaalsContact O-ND2 3.08Å; E380-N383 PolarHBondContact O-N 2.9Å; K381-N383 PolarHBondContact O-N 3.01Å; N383-R386 PolarHBondContact O-N 3.41Å; N383-R386 PolarHBondContact OD1-NH1 3.28Å; N383-K387 WeakPolarHBondContact O-CB 3.21Å; N383-K387 VanDerWaalsContact O-CG 3.29Å; N383-K387 WeakPolarHBondContact O-CG 3.24Å; N383-K387 PolarHBondContact O-N 3.05Å
384	S	95.4	Very high	94.5	Very high	72 Å²	72	52.1 Å²	52.1	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-60.9	-47	172	-171.2	0	0	0	0	111.8	E380 K381 L382 K387 Q388	E380-S384 WeakPolarHBondContact O-CB 3.42Å; E380-S384 PolarHBondContact O-N 3.46Å; K381-S384 WeakPolarHBondContact O-CB 3.36Å; K381-S384 PolarHBondContact O-N 2.98Å; L382-S384 VanDerWaalsContact C-N 3.32Å; L382-S384 PolarHBondContact O-N 3.01Å; S384-K387 PolarHBondContact O-N 3.01Å; S384-Q388 WeakPolarHBondContact O-CB 3.34Å; S384-Q388 PolarHBondContact O-N 3.22Å
385	L	95.8	Very high	94.8	Very high	9 Å²	9	54 Å²	54	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-43.7	177	-68.1	174.3	0	0	0	112.2	V331 L335 I340 L343 L344 L377 K381 L382 K387 Q388 Y389	V331-L385 HydrophobicContact CG2-CD1 3.83Å; L335-L385 HydrophobicContact CD1-CD2 4.04Å; I340-L385 HydrophobicContact CG1-CD2 4.43Å; L343-L385 HydrophobicContact CD2-CD1 4.24Å; L344-L385 HydrophobicContact CD2-CB 4Å; L344-L385 HydrophobicContact CG-CB 4.43Å; L377-L385 HydrophobicContact CD1-CD1 3.9Å; K381-L385 PolarHBondContact O-N 3.43Å; K381-L385 VanDerWaalsContact O-N 3.11Å; L382-L385 PolarHBondContact O-N 3.31Å; L385-K387 PolarHBondContact O-N 3.17Å; L385-Q388 PolarHBondContact O-N 3.39Å; L385-Y389 PolarHBondContact O-N 2.65Å
386	R	96.1	Very high	95.1	Very high	48 Å²	48	56.8 Å²	56.8	18%	0.181	28%	0.278	C	S	.	.	H	α-helix	trans	-58.8	-48.8	176.5	-68	170.5	175.5	162.3	-4.6	111.2	L344 L382 N383 Q388 Y389 V390 V455	L344-R386 HydrophobicContact CD1-CG 4.45Å; L344-R386 HydrophobicContact CD2-CG 3.85Å; L382-R386 VanDerWaalsContact CD2-NH2 3.33Å; L382-R386 VanDerWaalsContact O-CG 3.27Å; L382-R386 WeakPolarHBondContact O-CG 3.32Å; L382-R386 PolarHBondContact O-N 3.09Å; L382-R386 VanDerWaalsContact O-N 3.07Å; N383-R386 PolarHBondContact O-N 3.41Å; N383-R386 PolarHBondContact OD1-NH1 3.28Å; R386-Q388 VanDerWaalsContact C-N 3.33Å; R386-Q388 PolarHBondContact O-N 3.44Å; R386-Y389 PolarHBondContact O-N 2.8Å; R386-V390 WeakPolarHBondContact O-CG2 3.48Å; R386-V390 PolarHBondContact O-N 3.23Å; R386-V455 HydrophobicContact CB-CG2 3.96Å; R386-V455 HydrophobicContact CG-CG2 3.63Å
387	K	96.4	Very high	95.2	Very high	129 Å²	129	56.7 Å²	56.7	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-61.4	-41.2	177.2	-76.2	177.6	180	-177.1	0	112	N383 S384 L385 V390 S391	N383-K387 WeakPolarHBondContact O-CB 3.21Å; N383-K387 VanDerWaalsContact O-CG 3.29Å; N383-K387 WeakPolarHBondContact O-CG 3.24Å; N383-K387 PolarHBondContact O-N 3.05Å; S384-K387 PolarHBondContact O-N 3.01Å; L385-K387 PolarHBondContact O-N 3.17Å; K387-V390 PolarHBondContact O-N 3.26Å; K387-S391 WeakPolarHBondContact O-CB 3.35Å; K387-S391 PolarHBondContact O-N 3.14Å
388	Q	95.7	Very high	95.4	Very high	78 Å²	78	62 Å²	62	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-46.8	178.8	-172	176.3	33.2	0	0	111.7	I340 S384 L385 R386 K392	I340-Q388 HydrophobicContact CD1-CG 4.03Å; S384-Q388 WeakPolarHBondContact O-CB 3.34Å; S384-Q388 PolarHBondContact O-N 3.22Å; L385-Q388 PolarHBondContact O-N 3.39Å; R386-Q388 VanDerWaalsContact C-N 3.33Å; R386-Q388 PolarHBondContact O-N 3.44Å; Q388-K392 WeakPolarHBondContact O-CG 3.44Å; Q388-K392 PolarHBondContact O-N 2.92Å; Q388-K392 VanDerWaalsContact O-N 3.15Å
389	Y	95	Very high	95.6	Very high	21 Å²	21	62.6 Å²	62.6	8%	0.082	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-49.5	175.5	168.5	-99.1	0	0	0	112.1	V341 L385 R386 T393 L448 L451 V455	V341-Y389 HydrophobicContact CG2-CD2 3.51Å; V341-Y389 HydrophobicContact CG2-CE2 3.4Å; V341-Y389 VanDerWaalsContact CG2-CE2 3.4Å; L385-Y389 PolarHBondContact O-N 2.65Å; R386-Y389 PolarHBondContact O-N 2.8Å; Y389-T393 WeakPolarHBondContact O-CB 3.43Å; Y389-T393 PolarHBondContact O-N 3.36Å; Y389-T393 PolarHBondContact O-OG1 3.42Å; Y389-L448 HydrophobicContact CE1-CD2 4.48Å; Y389-L451 HydrophobicContact CD1-CD1 3.96Å; Y389-L451 HydrophobicContact CE1-CD1 3.36Å; Y389-L451 HydrophobicContact CE2-CD1 4Å; Y389-L451 HydrophobicContact CG-CD1 4.49Å; Y389-V455 HydrophobicContact CD1-CG1 3.64Å; Y389-V455 HydrophobicContact CE1-CG1 3.68Å
390	V	96.4	Very high	95.8	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-49.4	-177.9	174.7	0	0	0	0	110.3	R386 K387 K392 T393 I394 V455 Q458 F459 Q462	R386-V390 WeakPolarHBondContact O-CG2 3.48Å; R386-V390 PolarHBondContact O-N 3.23Å; K387-V390 PolarHBondContact O-N 3.26Å; V390-K392 VanDerWaalsContact C-N 3.34Å; V390-K392 PolarHBondContact O-N 3.4Å; V390-T393 PolarHBondContact O-N 3Å; V390-T393 VanDerWaalsContact O-N 3.08Å; V390-I394 HydrophobicContact CG1-CG1 4.06Å; V390-I394 WeakPolarHBondContact O-CG1 3.41Å; V390-I394 PolarHBondContact O-N 3.44Å; V390-V455 HydrophobicContact CG2-CG1 3.97Å; V390-Q458 HydrophobicContact CG1-CB 4.26Å; V390-Q458 HydrophobicContact CG2-CB 3.99Å; V390-F459 HydrophobicContact CG1-CB 4.46Å; V390-F459 HydrophobicContact CG2-CB 4.38Å; V390-Q462 HydrophobicContact CG1-CG 4.49Å
391	S	96.5	Very high	96	Very high	65 Å²	65	54.7 Å²	54.7	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-55.9	-46.5	-179.2	-173.8	0	0	0	0	111.9	K387 T393 I394 E395	K387-S391 WeakPolarHBondContact O-CB 3.35Å; K387-S391 PolarHBondContact O-N 3.14Å; S391-T393 VanDerWaalsContact C-N 3.34Å; S391-T393 PolarHBondContact O-N 3.3Å; S391-I394 PolarHBondContact O-N 3.36Å; S391-E395 WeakPolarHBondContact O-CB 3.45Å; S391-E395 PolarHBondContact O-N 2.9Å
392	K	94.4	Very high	96.2	Very high	78 Å²	78	54 Å²	54	34%	0.339	27%	0.269	S	S	.	.	H	α-helix	trans	-67	-35.9	178.1	-73.7	-173	171.3	-166.9	0	112.9	D337 Q388 V390 R396	D337-K392 WeakPolarHBondContact OD1-CD 3.29Å; D337-K392 WeakPolarHBondContact OD1-CE 3.16Å; D337-K392 IonicContact OD1-NZ 3.95Å; D337-K392 PolarHBondContact OD1-NZ 3.23Å; D337-K392 WeakPolarHBondContact OD2-CD 3.39Å; D337-K392 IonicContact OD2-NZ 3.76Å; D337-K392 PolarHBondContact OD2-NZ 3.05Å; D337-K392 VanDerWaalsContact OD2-NZ 3.11Å; Q388-K392 WeakPolarHBondContact O-CG 3.44Å; Q388-K392 PolarHBondContact O-N 2.92Å; Q388-K392 VanDerWaalsContact O-N 3.15Å; V390-K392 VanDerWaalsContact C-N 3.34Å; V390-K392 PolarHBondContact O-N 3.4Å; K392-R396 WeakPolarHBondContact O-CB 3.3Å; K392-R396 PolarHBondContact O-N 3.18Å; K392-R396 VanDerWaalsContact O-N 3.07Å
393	T	94.2	Very high	96.4	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-67.7	-42.6	177.2	-62.1	0	0	0	0	111.1	Y389 V390 S391 R396 L397 M441 F459	Y389-T393 WeakPolarHBondContact O-CB 3.43Å; Y389-T393 PolarHBondContact O-N 3.36Å; Y389-T393 PolarHBondContact O-OG1 3.42Å; V390-T393 PolarHBondContact O-N 3Å; V390-T393 VanDerWaalsContact O-N 3.08Å; S391-T393 VanDerWaalsContact C-N 3.34Å; S391-T393 PolarHBondContact O-N 3.3Å; T393-R396 PolarHBondContact O-N 2.86Å; T393-L397 PolarHBondContact O-N 3.44Å; T393-M441 HydrophobicContact CG2-CG 4.27Å; T393-M441 HydrophobicContact CG2-SD 3.79Å; T393-F459 HydrophobicContact CG2-CD2 4.09Å; T393-F459 HydrophobicContact CG2-CE2 3.73Å
394	I	96.8	Very high	96.5	Very high	14 Å²	14	56.8 Å²	56.8	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-39.6	175.7	-64.9	-58.6	0	0	0	111.6	V390 S391 R396 L397 K398 F459 Q462 C463 E466	V390-I394 HydrophobicContact CG1-CG1 4.06Å; V390-I394 WeakPolarHBondContact O-CG1 3.41Å; V390-I394 PolarHBondContact O-N 3.44Å; S391-I394 PolarHBondContact O-N 3.36Å; I394-R396 VanDerWaalsContact C-N 3.29Å; I394-R396 PolarHBondContact O-N 2.95Å; I394-L397 HydrophobicContact CD1-CD2 4.48Å; I394-L397 WeakPolarHBondContact O-CB 3.44Å; I394-L397 PolarHBondContact O-N 3.4Å; I394-L397 VanDerWaalsContact O-N 3.12Å; I394-K398 WeakPolarHBondContact O-CB 3.46Å; I394-K398 PolarHBondContact O-N 2.91Å; I394-F459 HydrophobicContact CD1-CD2 4.14Å; I394-F459 HydrophobicContact CD1-CE2 4.17Å; I394-Q462 HydrophobicContact CD1-CB 3.93Å; I394-Q462 HydrophobicContact CG1-CB 3.71Å; I394-Q462 HydrophobicContact CG2-CB 4.49Å; I394-C463 HydrophobicContact CD1-CB 4.17Å; I394-E466 HydrophobicContact CG2-CB 4.47Å
395	E	97.2	Very high	96.6	Very high	122 Å²	122	53.7 Å²	53.7	57%	0.57	26%	0.263	S	S	*	.	H	α-helix	trans	-62.1	-37.7	175	-175.1	176.3	-168	0	0	112.3	S391 S399	S391-E395 WeakPolarHBondContact O-CB 3.45Å; S391-E395 PolarHBondContact O-N 2.9Å; E395-S399 WeakPolarHBondContact O-CB 3.32Å; E395-S399 PolarHBondContact O-N 3.01Å; E395-S399 PolarHBondContact O-OG 2.81Å
396	R	95.6	Very high	96.6	Very high	112 Å²	112	58.8 Å²	58.8	42%	0.423	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-43.5	172	-175.8	172.9	64.4	-110.1	-1.6	111.6	K392 T393 I394 S399 W400 M441	K392-R396 WeakPolarHBondContact O-CB 3.3Å; K392-R396 PolarHBondContact O-N 3.18Å; K392-R396 VanDerWaalsContact O-N 3.07Å; T393-R396 PolarHBondContact O-N 2.86Å; I394-R396 VanDerWaalsContact C-N 3.29Å; I394-R396 PolarHBondContact O-N 2.95Å; R396-S399 PolarHBondContact O-N 3.11Å; R396-W400 PolarHBondContact O-N 2.82Å; R396-M441 HydrophobicContact CB-CE 4.47Å; R396-M441 HydrophobicContact CG-CE 4.26Å
397	L	96.8	Very high	96.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-52.5	175.8	177.8	60.8	0	0	0	110.5	T393 I394 S399 W400 L401 P437 I438 M441 E466	T393-L397 PolarHBondContact O-N 3.44Å; I394-L397 HydrophobicContact CD1-CD2 4.48Å; I394-L397 WeakPolarHBondContact O-CB 3.44Å; I394-L397 PolarHBondContact O-N 3.4Å; I394-L397 VanDerWaalsContact O-N 3.12Å; L397-S399 VanDerWaalsContact C-N 3.28Å; L397-S399 PolarHBondContact O-N 3.47Å; L397-W400 PolarHBondContact O-N 3.03Å; L397-L401 HydrophobicContact CD1-CD1 4.1Å; L397-L401 HydrophobicContact CD1-CD2 4.29Å; L397-L401 HydrophobicContact CD1-CG 3.97Å; L397-L401 HydrophobicContact CG-CD1 3.9Å; L397-L401 HydrophobicContact CG-CG 4.2Å; L397-L401 WeakPolarHBondContact O-CG 3.06Å; L397-L401 PolarHBondContact O-N 3.38Å; L397-P437 HydrophobicContact CD1-CB 3.75Å; L397-P437 HydrophobicContact CD1-CG 4.3Å; L397-I438 HydrophobicContact CD1-CG1 3.89Å; L397-M441 HydrophobicContact CB-CE 3.83Å; L397-M441 HydrophobicContact CB-SD 3.91Å; L397-M441 HydrophobicContact CD1-CE 4.29Å; L397-M441 HydrophobicContact CD1-SD 4.34Å; L397-E466 HydrophobicContact CD2-CG 4.36Å; L397-E466 HydrophobicContact CG-CG 4.47Å
398	K	98	Very high	96.4	Very high	110 Å²	110	55.6 Å²	55.6	48%	0.478	28%	0.277	S	S	.	.	H	α-helix	trans	-50.6	-48.3	176.3	176.7	168	-175.2	175.8	0	112.3	I394 W400 L401 A402 E466	I394-K398 WeakPolarHBondContact O-CB 3.46Å; I394-K398 PolarHBondContact O-N 2.91Å; K398-W400 PolarHBondContact O-N 3.06Å; K398-L401 PolarHBondContact O-N 3.15Å; K398-A402 WeakPolarHBondContact O-CB 3.47Å; K398-A402 PolarHBondContact O-N 2.57Å; K398-E466 WeakPolarHBondContact CA-OE1 3.42Å; K398-E466 HydrophobicContact CB-CG 4.41Å; K398-E466 VanDerWaalsContact CB-OE1 3.24Å; K398-E466 WeakPolarHBondContact CB-OE1 3.25Å; K398-E466 WeakPolarHBondContact CG-OE1 3.49Å
399	S	97.7	Very high	96.3	Very high	60 Å²	60	53.3 Å²	53.3	42%	0.42	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-40.5	179.2	-59.3	0	0	0	0	112.1	E395 R396 L397 N403	E395-S399 WeakPolarHBondContact O-CB 3.32Å; E395-S399 PolarHBondContact O-N 3.01Å; E395-S399 PolarHBondContact O-OG 2.81Å; R396-S399 PolarHBondContact O-N 3.11Å; L397-S399 VanDerWaalsContact C-N 3.28Å; L397-S399 PolarHBondContact O-N 3.47Å; S399-N403 WeakPolarHBondContact O-CB 3.39Å; S399-N403 PolarHBondContact O-N 3.19Å; S399-N403 VanDerWaalsContact O-N 3.12Å; S399-N403 PolarHBondContact O-ND2 3.04Å
400	W	97.4	Very high	96	Very high	100 Å²	100	55.9 Å²	55.9	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-45	174.7	-81.6	20.2	0	0	0	111.9	R396 L397 K398 A402 N403 S404 P437 E440	R396-W400 PolarHBondContact O-N 2.82Å; L397-W400 PolarHBondContact O-N 3.03Å; K398-W400 PolarHBondContact O-N 3.06Å; W400-A402 PolarHBondContact O-N 3.21Å; W400-N403 PolarHBondContact O-N 3.26Å; W400-S404 WeakPolarHBondContact O-CB 3.19Å; W400-S404 PolarHBondContact O-N 3.26Å; W400-S404 PolarHBondContact O-OG 3.02Å; W400-P437 HydrophobicContact CB-CG 4.43Å; W400-P437 HydrophobicContact CD2-CB 4.26Å; W400-P437 HydrophobicContact CE3-CB 3.26Å; W400-P437 HydrophobicContact CE3-CG 3.58Å; W400-P437 HydrophobicContact CZ3-CB 3.68Å; W400-P437 HydrophobicContact CZ3-CG 4.25Å; W400-E440 WeakPolarHBondContact CH2-OE2 3.5Å
401	L	98.6	Very high	95.6	Very high	1 Å²	1	57 Å²	57	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-47	179.1	-68	179.1	0	0	0	111.5	L397 K398 N403 S404 L405 V434 E466 M467 F470	L397-L401 HydrophobicContact CD1-CD1 4.1Å; L397-L401 HydrophobicContact CD1-CD2 4.29Å; L397-L401 HydrophobicContact CD1-CG 3.97Å; L397-L401 HydrophobicContact CG-CD1 3.9Å; L397-L401 HydrophobicContact CG-CG 4.2Å; L397-L401 WeakPolarHBondContact O-CG 3.06Å; L397-L401 PolarHBondContact O-N 3.38Å; K398-L401 PolarHBondContact O-N 3.15Å; L401-N403 PolarHBondContact O-N 3.04Å; L401-S404 PolarHBondContact O-N 3.37Å; L401-L405 PolarHBondContact O-N 2.94Å; L401-V434 HydrophobicContact CD2-CB 4.1Å; L401-V434 HydrophobicContact CD2-CG1 3.78Å; L401-V434 HydrophobicContact CD2-CG2 3.93Å; L401-E466 HydrophobicContact CD1-CG 3.99Å; L401-M467 HydrophobicContact CD1-SD 3.97Å; L401-M467 HydrophobicContact CD2-SD 4.5Å; L401-F470 HydrophobicContact CB-CD2 3.66Å; L401-F470 HydrophobicContact CB-CE2 3.95Å; L401-F470 HydrophobicContact CB-CG 4.42Å; L401-F470 HydrophobicContact CD1-CB 4.19Å; L401-F470 HydrophobicContact CD1-CD2 4.33Å; L401-F470 HydrophobicContact CD1-CG 4.29Å; L401-F470 HydrophobicContact CD2-CD2 4.48Å; L401-F470 HydrophobicContact CG-CD2 4.37Å; L401-F470 WeakPolarHBondContact O-CE2 3.46Å
402	A	97.8	Very high	95.4	Very high	53 Å²	53	54.2 Å²	54.2	44%	0.438	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-44.2	176.9	0	0	0	0	0	112.3	K398 W400 L406	K398-A402 WeakPolarHBondContact O-CB 3.47Å; K398-A402 PolarHBondContact O-N 2.57Å; W400-A402 PolarHBondContact O-N 3.21Å; A402-L406 WeakPolarHBondContact O-CB 3.23Å; A402-L406 PolarHBondContact O-N 3.44Å
403	N	97.3	Very high	95	Very high	102 Å²	102	56.5 Å²	56.5	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-67.2	-38.2	177.3	-71.2	-28.9	0	0	0	112.5	S399 W400 L401 L406 K407	S399-N403 WeakPolarHBondContact O-CB 3.39Å; S399-N403 PolarHBondContact O-N 3.19Å; S399-N403 VanDerWaalsContact O-N 3.12Å; S399-N403 PolarHBondContact O-ND2 3.04Å; W400-N403 PolarHBondContact O-N 3.26Å; L401-N403 PolarHBondContact O-N 3.04Å; N403-L406 PolarHBondContact O-N 3.04Å; N403-K407 WeakPolarHBondContact O-CB 3.13Å; N403-K407 PolarHBondContact O-N 2.81Å
404	S	97.3	Very high	94.7	Very high	17 Å²	17	62.2 Å²	62.2	12%	0.119	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-45.4	176.6	-66.8	0	0	0	0	111.6	W400 L401 K407 D408 L433	W400-S404 WeakPolarHBondContact O-CB 3.19Å; W400-S404 PolarHBondContact O-N 3.26Å; W400-S404 PolarHBondContact O-OG 3.02Å; L401-S404 PolarHBondContact O-N 3.37Å; S404-K407 PolarHBondContact O-N 2.67Å; S404-D408 PolarHBondContact O-N 3.46Å; S404-L433 PolarHBondContact OG-O 3.04Å
405	L	98.1	Very high	94.1	Very high	7 Å²	7	66.2 Å²	66.2	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-65	-45.8	175.9	178.6	62.2	0	0	0	111.4	L401 K407 D408 T409 L430 F470 D473 Y474	L401-L405 PolarHBondContact O-N 2.94Å; L405-K407 VanDerWaalsContact C-N 3.27Å; L405-K407 PolarHBondContact O-N 2.99Å; L405-D408 PolarHBondContact O-N 3.06Å; L405-D408 VanDerWaalsContact O-N 3.13Å; L405-T409 HydrophobicContact CD1-CG2 3.99Å; L405-T409 HydrophobicContact CG-CG2 4.18Å; L405-T409 WeakPolarHBondContact O-CG2 3.11Å; L405-T409 PolarHBondContact O-N 3.32Å; L405-T409 PolarHBondContact O-OG1 3.03Å; L405-L430 HydrophobicContact CD1-CD2 4Å; L405-F470 HydrophobicContact CB-CE2 3.85Å; L405-F470 HydrophobicContact CB-CZ 4.31Å; L405-F470 HydrophobicContact CD2-CE2 4.26Å; L405-D473 HydrophobicContact CD2-CB 4.15Å; L405-Y474 HydrophobicContact CD1-CD2 3.53Å; L405-Y474 HydrophobicContact CD1-CE2 4.09Å; L405-Y474 HydrophobicContact CD1-CG 4.03Å
406	L	95.8	Very high	93.9	Very high	116 Å²	116	64.6 Å²	64.6	61%	0.607	34%	0.336	S	S	*	.	H	α-helix	trans	-57.5	-42.3	176.5	-178.6	65.6	0	0	0	111.7	A402 N403 T409 S410	A402-L406 WeakPolarHBondContact O-CB 3.23Å; A402-L406 PolarHBondContact O-N 3.44Å; N403-L406 PolarHBondContact O-N 3.04Å; L406-T409 PolarHBondContact O-OG1 3.17Å; L406-S410 PolarHBondContact O-N 3.09Å
407	K	93.6	Very high	93.6	Very high	107 Å²	107	61 Å²	61	47%	0.465	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-48.9	175.3	-175.3	-169.8	171.8	-159.8	0	111.1	N403 S404 L405 T409 S410 L433	N403-K407 WeakPolarHBondContact O-CB 3.13Å; N403-K407 PolarHBondContact O-N 2.81Å; S404-K407 PolarHBondContact O-N 2.67Å; L405-K407 VanDerWaalsContact C-N 3.27Å; L405-K407 PolarHBondContact O-N 2.99Å; K407-T409 PolarHBondContact O-N 3.46Å; K407-S410 PolarHBondContact O-N 3.4Å; K407-S410 PolarHBondContact O-OG 3.47Å; K407-L433 HydrophobicContact CD-CD1 4.24Å
408	D	94.7	Very high	93.6	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-40.8	-177.4	-160.8	78.1	0	0	0	112.2	S404 L405 S410 D411 W412 T428 L430	S404-D408 PolarHBondContact O-N 3.46Å; L405-D408 PolarHBondContact O-N 3.06Å; L405-D408 VanDerWaalsContact O-N 3.13Å; D408-S410 PolarHBondContact O-N 2.9Å; D408-S410 VanDerWaalsContact O-N 3.17Å; D408-D411 WeakPolarHBondContact O-CB 3.35Å; D408-D411 PolarHBondContact O-N 3.3Å; D408-W412 PolarHBondContact O-NE1 3.38Å; D408-W412 PolarHBondContact OD2-NE1 3.04Å; D408-T428 VanDerWaalsContact OD1-CB 3.27Å; D408-T428 WeakPolarHBondContact OD1-CB 3.45Å; D408-T428 PolarHBondContact OD1-OG1 3.02Å; D408-T428 PolarHBondContact OD2-OG1 3.18Å; D408-L430 HydrophobicContact CB-CB 4.1Å; D408-L430 HydrophobicContact CB-CD1 4.02Å; D408-L430 HydrophobicContact CB-CD2 4.46Å; D408-L430 HydrophobicContact CB-CG 4.43Å; D408-L430 PolarHBondContact OD1-N 3.3Å
409	T	93.6	Very high	93.4	Very high	29 Å²	29	63.1 Å²	63.1	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-30	178.7	63.1	0	0	0	0	113.3	L405 L406 K407 D411 W412 D477	L405-T409 HydrophobicContact CD1-CG2 3.99Å; L405-T409 HydrophobicContact CG-CG2 4.18Å; L405-T409 WeakPolarHBondContact O-CG2 3.11Å; L405-T409 PolarHBondContact O-N 3.32Å; L405-T409 PolarHBondContact O-OG1 3.03Å; L406-T409 PolarHBondContact O-OG1 3.17Å; K407-T409 PolarHBondContact O-N 3.46Å; T409-D411 PolarHBondContact O-N 2.8Å; T409-W412 HydrophobicContact CG2-CE3 4.3Å; T409-W412 HydrophobicContact CG2-CH2 3.39Å; T409-W412 HydrophobicContact CG2-CZ2 3.71Å; T409-W412 HydrophobicContact CG2-CZ3 3.71Å; T409-W412 PolarHBondContact O-N 3.31Å; T409-D477 HydrophobicContact CG2-CB 3.96Å
410	S	89.3	Confident	93.4	Very high	75 Å²	75	64 Å²	64	52%	0.524	35%	0.346	S	S	.	.	H	α-helix	trans	-68.9	-20.7	176.8	75.1	0	0	0	0	113	L406 K407 D408	L406-S410 PolarHBondContact O-N 3.09Å; K407-S410 PolarHBondContact O-N 3.4Å; K407-S410 PolarHBondContact O-OG 3.47Å; D408-S410 PolarHBondContact O-N 2.9Å; D408-S410 VanDerWaalsContact O-N 3.17Å
411	D	88	Confident	93.2	Very high	25 Å²	25	61.2 Å²	61.2	13%	0.134	34%	0.339	C	S	.	.	H	α-helix	trans	-86.1	-20.5	-178.1	-68.3	-22.5	0	0	0	113	D408 T409 Q413 R414 Y498	D408-D411 WeakPolarHBondContact O-CB 3.35Å; D408-D411 PolarHBondContact O-N 3.3Å; T409-D411 PolarHBondContact O-N 2.8Å; D411-Q413 PolarHBondContact O-N 3.47Å; D411-Q413 VanDerWaalsContact O-N 3.08Å; D411-R414 VanDerWaalsContact CG-NE 3.32Å; D411-R414 VanDerWaalsContact O-CB 3.3Å; D411-R414 WeakPolarHBondContact O-CB 3.41Å; D411-R414 WeakPolarHBondContact O-CD 3.46Å; D411-R414 WeakPolarHBondContact O-CG 3.38Å; D411-R414 PolarHBondContact O-N 2.86Å; D411-R414 IonicContact OD1-CZ 3.58Å; D411-R414 IonicContact OD1-NE 3.11Å; D411-R414 PolarHBondContact OD1-NE 3.39Å; D411-R414 IonicContact OD1-NH2 2.57Å; D411-R414 PolarHBondContact OD1-NH2 3.07Å; D411-R414 IonicContact OD2-CZ 3.1Å; D411-R414 IonicContact OD2-NE 2.67Å; D411-R414 IonicContact OD2-NH2 2.7Å; D411-R414 PolarHBondContact OD2-NH2 3.08Å; D411-Y498 VanDerWaalsContact O-CZ 3.28Å; D411-Y498 PolarHBondContact O-OH 3.42Å
412	W	91.9	Very high	92.8	Very high	5 Å²	5	65.3 Å²	65.3	2%	0.019	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.2	-178.6	-51.2	-15.3	0	0	0	113.6	D408 T409 Y474 D477 I478 Y481 Y498 N502	D408-W412 PolarHBondContact O-NE1 3.38Å; D408-W412 PolarHBondContact OD2-NE1 3.04Å; T409-W412 HydrophobicContact CG2-CE3 4.3Å; T409-W412 HydrophobicContact CG2-CH2 3.39Å; T409-W412 HydrophobicContact CG2-CZ2 3.71Å; T409-W412 HydrophobicContact CG2-CZ3 3.71Å; T409-W412 PolarHBondContact O-N 3.31Å; W412-Y474 HydrophobicContact CH2-CD2 4.29Å; W412-Y474 HydrophobicContact CH2-CE2 4.02Å; W412-Y474 HydrophobicContact CZ2-CD2 4.46Å; W412-Y474 AromaticContact CZ2-CE2 3.82Å; W412-Y474 HydrophobicContact CZ2-CE2 3.82Å; W412-D477 HydrophobicContact CH2-CB 4.1Å; W412-D477 HydrophobicContact CZ3-CB 4.21Å; W412-I478 HydrophobicContact CE3-CD1 4.35Å; W412-I478 HydrophobicContact CH2-CD1 3.51Å; W412-I478 HydrophobicContact CH2-CG1 4.03Å; W412-I478 HydrophobicContact CZ2-CD1 3.98Å; W412-I478 HydrophobicContact CZ3-CD1 3.73Å; W412-I478 HydrophobicContact CZ3-CG1 4.37Å; W412-Y481 HydrophobicContact CB-CD2 4.12Å; W412-Y481 HydrophobicContact CB-CE1 4.42Å; W412-Y481 HydrophobicContact CB-CE2 3.62Å; W412-Y481 HydrophobicContact CE3-CD1 4.27Å; W412-Y481 HydrophobicContact CE3-CD2 4.03Å; W412-Y481 AromaticContact CE3-CG 3.82Å; W412-Y481 HydrophobicContact CE3-CG 3.82Å; W412-Y481 HydrophobicContact CZ3-CG 4.46Å; W412-Y481 WeakPolarHBondContact O-CE2 3.4Å; W412-Y481 PolarHBondContact O-OH 3.37Å; W412-Y498 HydrophobicContact CB-CD1 4.3Å; W412-Y498 HydrophobicContact CB-CG 4.22Å; W412-Y498 AromaticContact CD1-CD1 3.71Å; W412-Y498 HydrophobicContact CG-CD1 4.28Å; W412-N502 VanDerWaalsContact CZ2-OD1 3.24Å; W412-N502 WeakPolarHBondContact CZ2-OD1 3.19Å; W412-N502 PolarHBondContact NE1-ND2 3.34Å; W412-N502 PolarHBondContact NE1-OD1 3.29Å
413	Q	86.3	Confident	92.5	Very high	127 Å²	127	67.1 Å²	67.1	59%	0.593	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	3.5	177.2	-57.1	-169.5	-10.9	0	0	113.1	D411 F492	D411-Q413 PolarHBondContact O-N 3.47Å; D411-Q413 VanDerWaalsContact O-N 3.08Å; Q413-F492 HydrophobicContact CG-CD1 4.31Å; Q413-F492 HydrophobicContact CG-CE1 3.9Å
414	R	86	Confident	92.4	Very high	122 Å²	122	65.6 Å²	65.6	46%	0.46	39%	0.388	S	S	.	.			trans	-63.7	146	177.8	-70.6	171	-179.5	-166.1	4	110.4	D411 T416	D411-R414 VanDerWaalsContact CG-NE 3.32Å; D411-R414 VanDerWaalsContact O-CB 3.3Å; D411-R414 WeakPolarHBondContact O-CB 3.41Å; D411-R414 WeakPolarHBondContact O-CD 3.46Å; D411-R414 WeakPolarHBondContact O-CG 3.38Å; D411-R414 PolarHBondContact O-N 2.86Å; D411-R414 IonicContact OD1-CZ 3.58Å; D411-R414 IonicContact OD1-NE 3.11Å; D411-R414 PolarHBondContact OD1-NE 3.39Å; D411-R414 IonicContact OD1-NH2 2.57Å; D411-R414 PolarHBondContact OD1-NH2 3.07Å; D411-R414 IonicContact OD2-CZ 3.1Å; D411-R414 IonicContact OD2-NE 2.67Å; D411-R414 IonicContact OD2-NH2 2.7Å; D411-R414 PolarHBondContact OD2-NH2 3.08Å; R414-T416 PolarHBondContact O-N 3.33Å
415	S	86	Confident	92.5	Very high	98 Å²	98	65.8 Å²	65.8	69%	0.685	39%	0.387	S	S	*	.	S	Bend	trans	-74.3	-9	173.5	58.1	0	0	0	0	113.4
416	T	92	Very high	92.5	Very high	88 Å²	88	66.7 Å²	66.7	54%	0.54	39%	0.39	S	S	.	.	S	Bend	trans	-106.6	134.9	177.8	54.8	0	0	0	0	109.6	R414 Y498	R414-T416 PolarHBondContact O-N 3.33Å; T416-Y498 PolarHBondContact O-OH 3.14Å
417	G	90.1	Very high	92.5	Very high	35 Å²	35	64 Å²	64	36%	0.361	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-63.8	157.5	176.7	0	0	0	0	0	112.7	C494	G417-C494 PolarHBondContact N-SG 3.5Å
418	P	95.5	Very high	92.6	Very high	14 Å²	14	59.4 Å²	59.4	9%	0.091	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-59.3	154.1	171.2	24.9	-32	0	0	0	111.5	Y426 F427 E497 Y498 A501	P418-Y426 HydrophobicContact CB-CD1 4.38Å; P418-Y426 HydrophobicContact CG-CD1 3.75Å; P418-Y426 HydrophobicContact CG-CE1 4.45Å; P418-Y426 HydrophobicContact CG-CG 3.99Å; P418-Y426 WeakPolarHBondContact O-CD1 3.17Å; P418-F427 WeakPolarHBondContact CB-O 3.36Å; P418-E497 VanDerWaalsContact CD-CB 3.44Å; P418-E497 HydrophobicContact CG-CB 3.75Å; P418-Y498 HydrophobicContact CB-CD1 4.41Å; P418-Y498 HydrophobicContact CB-CE1 4.13Å; P418-Y498 HydrophobicContact CG-CD1 4.33Å; P418-Y498 HydrophobicContact CG-CE1 4.4Å; P418-Y498 HydrophobicContact CG-CG 4.49Å; P418-A501 HydrophobicContact CB-CB 4Å; P418-A501 HydrophobicContact CG-CB 3.86Å
419	E	94.6	Very high	92.6	Very high	142 Å²	142	63.2 Å²	63.2	66%	0.664	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-73.5	164.5	177.1	-67.1	-176.3	-173.8	0	0	111.6	Y426 F427	E419-Y426 WeakPolarHBondContact O-CA 3.37Å; E419-F427 HydrophobicContact CB-CD1 4.29Å; E419-F427 HydrophobicContact CB-CE1 3.45Å; E419-F427 VanDerWaalsContact CB-CE1 3.45Å; E419-F427 HydrophobicContact CB-CZ 3.72Å; E419-F427 VanDerWaalsContact O-CD1 3.23Å; E419-F427 WeakPolarHBondContact O-CD1 3.44Å; E419-F427 PolarHBondContact O-N 3.42Å; E419-F427 VanDerWaalsContact O-N 3.08Å
420	L	96.8	Very high	92.8	Very high	77 Å²	77	61.8 Å²	61.8	40%	0.403	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-100.1	135.7	174.9	-64.2	178.5	0	0	0	110.7	N425 Y426 H597	L420-N425 CarbonylContact C-O 3.59Å; L420-N425 WeakPolarHBondContact CA-O 3.36Å; L420-Y426 HydrophobicContact CD2-CD1 3.41Å; L420-Y426 VanDerWaalsContact CD2-CD1 3.41Å; L420-Y426 HydrophobicContact CD2-CE1 3.58Å; L420-Y426 HydrophobicContact CD2-CG 4.03Å; L420-Y426 HydrophobicContact CG-CD1 4.38Å; L420-Y426 HydrophobicContact CG-CE1 4.37Å; L420-H597 HydrophobicContact CD2-CB 3.85Å; L420-H597 WeakPolarHBondContact CD2-ND1 3.43Å
421	D	93.3	Very high	93.2	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.23	35%	0.345	C	S	.	.			trans	-76.6	178.7	174.9	75.3	7.1	0	0	0	111.8	S423 S424 N425 F427	D421-S423 PolarHBondContact O-N 3.49Å; D421-S423 VanDerWaalsContact OD1-CA 3.24Å; D421-S423 WeakPolarHBondContact OD1-CA 3.33Å; D421-S423 WeakPolarHBondContact OD1-CB 3.49Å; D421-S423 PolarHBondContact OD1-N 3.38Å; D421-S424 PolarHBondContact O-N 3.47Å; D421-S424 PolarHBondContact OD1-N 2.89Å; D421-N425 PolarHBondContact N-O 3.46Å; D421-N425 PolarHBondContact OD1-N 3.02Å; D421-F427 HydrophobicContact CB-CD1 3.87Å; D421-F427 HydrophobicContact CB-CE1 4.43Å; D421-F427 HydrophobicContact CB-CG 4.48Å
422	G	90.4	Very high	93.5	Very high	86 Å²	86	62 Å²	62	89%	0.887	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14	178.2	0	0	0	0	0	114.7
423	S	93	Very high	93.8	Very high	92 Å²	92	63.8 Å²	63.8	64%	0.643	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	12.1	173.9	-58.7	0	0	0	0	112.4	D421 N425	D421-S423 PolarHBondContact O-N 3.49Å; D421-S423 VanDerWaalsContact OD1-CA 3.24Å; D421-S423 WeakPolarHBondContact OD1-CA 3.33Å; D421-S423 WeakPolarHBondContact OD1-CB 3.49Å; D421-S423 PolarHBondContact OD1-N 3.38Å; S423-N425 VanDerWaalsContact C-N 3.28Å; S423-N425 WeakPolarHBondContact CB-ND2 3.16Å; S423-N425 PolarHBondContact O-N 2.61Å
424	S	95.2	Very high	94.3	Very high	70 Å²	70	57.8 Å²	57.8	49%	0.49	35%	0.347	S	S	.	.	S	Bend	trans	61.7	29.8	-177.4	-55.1	0	0	0	0	114.3	D421 H597	D421-S424 PolarHBondContact O-N 3.47Å; D421-S424 PolarHBondContact OD1-N 2.89Å; S424-H597 PolarHBondContact O-ND1 2.81Å
425	N	97.5	Very high	94.8	Very high	20 Å²	20	52.6 Å²	52.6	11%	0.107	33%	0.328	C	S	.	.			trans	-99.4	144.4	172.3	-55.7	-61.3	0	0	0	111.2	L420 D421 S423 H597 T598 R599	L420-N425 CarbonylContact C-O 3.59Å; L420-N425 WeakPolarHBondContact CA-O 3.36Å; D421-N425 PolarHBondContact N-O 3.46Å; D421-N425 PolarHBondContact OD1-N 3.02Å; S423-N425 VanDerWaalsContact C-N 3.28Å; S423-N425 WeakPolarHBondContact CB-ND2 3.16Å; S423-N425 PolarHBondContact O-N 2.61Å; N425-H597 CarbonylContact C-O 3.59Å; N425-H597 WeakPolarHBondContact CA-O 3.49Å; N425-T598 VanDerWaalsContact OD1-C 3.3Å; N425-T598 PolarHBondContact OD1-O 3Å; N425-R599 PolarHBondContact OD1-N 2.99Å
426	Y	98.1	Very high	95.2	Very high	26 Å²	26	50.9 Å²	50.9	10%	0.102	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-62	139	169.5	-68.4	-55.9	0	0	0	111.2	P418 E419 L420 E497 L500 N504 T594 H597	P418-Y426 HydrophobicContact CB-CD1 4.38Å; P418-Y426 HydrophobicContact CG-CD1 3.75Å; P418-Y426 HydrophobicContact CG-CE1 4.45Å; P418-Y426 HydrophobicContact CG-CG 3.99Å; P418-Y426 WeakPolarHBondContact O-CD1 3.17Å; E419-Y426 WeakPolarHBondContact O-CA 3.37Å; L420-Y426 HydrophobicContact CD2-CD1 3.41Å; L420-Y426 VanDerWaalsContact CD2-CD1 3.41Å; L420-Y426 HydrophobicContact CD2-CE1 3.58Å; L420-Y426 HydrophobicContact CD2-CG 4.03Å; L420-Y426 HydrophobicContact CG-CD1 4.38Å; L420-Y426 HydrophobicContact CG-CE1 4.37Å; Y426-E497 HydrophobicContact CD2-CB 4.31Å; Y426-E497 HydrophobicContact CE1-CB 4.39Å; Y426-E497 HydrophobicContact CE1-CG 4.25Å; Y426-E497 HydrophobicContact CE2-CB 4.03Å; Y426-E497 HydrophobicContact CE2-CG 3.87Å; Y426-L500 HydrophobicContact CD2-CB 4.18Å; Y426-L500 HydrophobicContact CD2-CD1 4.36Å; Y426-L500 HydrophobicContact CE2-CD1 4.48Å; Y426-N504 WeakPolarHBondContact O-CB 3.36Å; Y426-N504 PolarHBondContact O-ND2 2.85Å; Y426-T594 HydrophobicContact CE2-CG2 3.83Å; Y426-T594 WeakPolarHBondContact CE2-O 3.45Å; Y426-H597 HydrophobicContact CD1-CB 4.41Å; Y426-H597 HydrophobicContact CD2-CB 3.42Å; Y426-H597 VanDerWaalsContact CD2-CB 3.42Å; Y426-H597 HydrophobicContact CE1-CB 4.36Å; Y426-H597 HydrophobicContact CE2-CB 3.37Å; Y426-H597 AromaticContact CE2-CD2 3.96Å; Y426-H597 AromaticContact CE2-CG 3.99Å; Y426-H597 HydrophobicContact CG-CB 3.95Å; Y426-H597 AromaticContact CZ-CD2 3.72Å; Y426-H597 PolarHBondContact N-O 3.36Å; Y426-H597 PolarHBondContact OH-CD2 3.28Å
427	F	96.4	Very high	95.3	Very high	59 Å²	59	46.9 Å²	46.9	26%	0.259	29%	0.29	S	S	.	.			trans	-138.4	156.5	175.5	75.5	-83.3	0	0	0	112.3	P418 E419 D421	P418-F427 WeakPolarHBondContact CB-O 3.36Å; E419-F427 HydrophobicContact CB-CD1 4.29Å; E419-F427 HydrophobicContact CB-CE1 3.45Å; E419-F427 VanDerWaalsContact CB-CE1 3.45Å; E419-F427 HydrophobicContact CB-CZ 3.72Å; E419-F427 VanDerWaalsContact O-CD1 3.23Å; E419-F427 WeakPolarHBondContact O-CD1 3.44Å; E419-F427 PolarHBondContact O-N 3.42Å; E419-F427 VanDerWaalsContact O-N 3.08Å; D421-F427 HydrophobicContact CB-CD1 3.87Å; D421-F427 HydrophobicContact CB-CE1 4.43Å; D421-F427 HydrophobicContact CB-CG 4.48Å
428	T	95.8	Very high	95.5	Very high	12 Å²	12	45.2 Å²	45.2	7%	0.074	27%	0.272	C	S	.	.			trans	-114.5	168.6	163.4	75.7	0	0	0	0	109.2	D408 L430 P431 Y498 A501	D408-T428 VanDerWaalsContact OD1-CB 3.27Å; D408-T428 WeakPolarHBondContact OD1-CB 3.45Å; D408-T428 PolarHBondContact OD1-OG1 3.02Å; D408-T428 PolarHBondContact OD2-OG1 3.18Å; T428-L430 PolarHBondContact O-N 2.88Å; T428-L430 PolarHBondContact OG1-N 3.25Å; T428-P431 VanDerWaalsContact O-CD 3.22Å; T428-P431 WeakPolarHBondContact O-CD 3.29Å; T428-Y498 HydrophobicContact CG2-CD1 4.33Å; T428-A501 HydrophobicContact CG2-CB 3.7Å
429	D	94.7	Very high	95.3	Very high	82 Å²	82	47.9 Å²	47.9	44%	0.439	29%	0.286	S	S	.	.	S	Bend	trans	-72.1	-14.4	178.9	-73.1	-26.8	0	0	0	112.6	V432 L433	D429-V432 PolarHBondContact O-N 3.29Å; D429-L433 HydrophobicContact CB-CD1 4.04Å; D429-L433 HydrophobicContact CB-CG 4.23Å; D429-L433 WeakPolarHBondContact O-CG 3.35Å; D429-L433 PolarHBondContact O-N 2.94Å
430	L	97.5	Very high	95.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-51.7	-45.6	-172.7	-169.9	61.1	0	0	0	114.5	L405 D408 T428 V432 L433 V434 F470 Y474 I509	L405-L430 HydrophobicContact CD1-CD2 4Å; D408-L430 HydrophobicContact CB-CB 4.1Å; D408-L430 HydrophobicContact CB-CD1 4.02Å; D408-L430 HydrophobicContact CB-CD2 4.46Å; D408-L430 HydrophobicContact CB-CG 4.43Å; D408-L430 PolarHBondContact OD1-N 3.3Å; T428-L430 PolarHBondContact O-N 2.88Å; T428-L430 PolarHBondContact OG1-N 3.25Å; L430-V432 VanDerWaalsContact C-N 3.26Å; L430-V432 PolarHBondContact O-N 3.38Å; L430-L433 CarbonylContact O-C 3.28Å; L430-L433 PolarHBondContact O-N 3.16Å; L430-L433 VanDerWaalsContact O-N 3.14Å; L430-V434 HydrophobicContact CD1-CG2 3.91Å; L430-V434 HydrophobicContact CG-CG2 4.06Å; L430-V434 WeakPolarHBondContact O-CB 3.35Å; L430-V434 VanDerWaalsContact O-CG2 3.26Å; L430-V434 WeakPolarHBondContact O-CG2 3.34Å; L430-V434 PolarHBondContact O-N 3.46Å; L430-F470 HydrophobicContact CD1-CZ 4.18Å; L430-F470 HydrophobicContact CD2-CZ 4.3Å; L430-F470 HydrophobicContact CG-CZ 4.43Å; L430-Y474 HydrophobicContact CD2-CD1 4.17Å; L430-Y474 HydrophobicContact CD2-CD2 4.31Å; L430-Y474 HydrophobicContact CD2-CE1 3.65Å; L430-Y474 HydrophobicContact CD2-CE2 3.8Å; L430-Y474 HydrophobicContact CD2-CG 4.48Å; L430-Y474 VanDerWaalsContact CD2-CZ 3.44Å; L430-I509 HydrophobicContact CG-CD1 4.47Å
431	P	97.3	Very high	94.8	Very high	10 Å²	10	42.5 Å²	42.5	7%	0.065	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-38.4	178.3	-25.7	37	0	0	0	113.4	T428 M435 M508 I509	T428-P431 VanDerWaalsContact O-CD 3.22Å; T428-P431 WeakPolarHBondContact O-CD 3.29Å; P431-M435 WeakPolarHBondContact O-CB 3.48Å; P431-M435 VanDerWaalsContact O-CG 3.3Å; P431-M435 WeakPolarHBondContact O-CG 3.4Å; P431-M435 PolarHBondContact O-N 3.14Å; P431-M508 HydrophobicContact CB-CB 3.97Å; P431-M508 HydrophobicContact CG-CB 4.1Å; P431-M508 HydrophobicContact CG-CG 4.36Å; P431-I509 HydrophobicContact CB-CG1 3.84Å; P431-I509 HydrophobicContact CG-CD1 4.41Å; P431-I509 HydrophobicContact CG-CG1 4.16Å
432	V	95.9	Very high	94.5	Very high	93 Å²	93	40.9 Å²	40.9	56%	0.564	25%	0.25	S	C	*	.	H	α-helix	trans	-70.9	-43.8	176.7	178.1	0	0	0	0	110.3	D429 L430 V434 M435 T436	D429-V432 PolarHBondContact O-N 3.29Å; L430-V432 VanDerWaalsContact C-N 3.26Å; L430-V432 PolarHBondContact O-N 3.38Å; V432-V434 PolarHBondContact O-N 3.07Å; V432-M435 PolarHBondContact O-N 3.17Å; V432-T436 WeakPolarHBondContact O-CB 3.42Å; V432-T436 PolarHBondContact O-N 3.03Å; V432-T436 PolarHBondContact O-OG1 3.27Å
433	L	96.7	Very high	93.3	Very high	44 Å²	44	39 Å²	39	23%	0.23	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-28.1	177.8	-64.8	175.8	0	0	0	113	S404 K407 D429 L430 P437	S404-L433 PolarHBondContact OG-O 3.04Å; K407-L433 HydrophobicContact CD-CD1 4.24Å; D429-L433 HydrophobicContact CB-CD1 4.04Å; D429-L433 HydrophobicContact CB-CG 4.23Å; D429-L433 WeakPolarHBondContact O-CG 3.35Å; D429-L433 PolarHBondContact O-N 2.94Å; L430-L433 CarbonylContact O-C 3.28Å; L430-L433 PolarHBondContact O-N 3.16Å; L430-L433 VanDerWaalsContact O-N 3.14Å; L433-P437 WeakPolarHBondContact O-CD 3.21Å; L433-P437 WeakPolarHBondContact O-CG 3.47Å
434	V	98.1	Very high	91.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-83.4	-44	175.9	167.8	0	0	0	0	111.6	L401 L430 V432 P437 I438 M467 F470 I509	L401-V434 HydrophobicContact CD2-CB 4.1Å; L401-V434 HydrophobicContact CD2-CG1 3.78Å; L401-V434 HydrophobicContact CD2-CG2 3.93Å; L430-V434 HydrophobicContact CD1-CG2 3.91Å; L430-V434 HydrophobicContact CG-CG2 4.06Å; L430-V434 WeakPolarHBondContact O-CB 3.35Å; L430-V434 VanDerWaalsContact O-CG2 3.26Å; L430-V434 WeakPolarHBondContact O-CG2 3.34Å; L430-V434 PolarHBondContact O-N 3.46Å; V432-V434 PolarHBondContact O-N 3.07Å; V434-P437 WeakPolarHBondContact O-CD 3.24Å; V434-P437 VanDerWaalsContact O-CG 3.27Å; V434-P437 WeakPolarHBondContact O-CG 3.39Å; V434-I438 HydrophobicContact CG1-CD1 4.25Å; V434-I438 WeakPolarHBondContact O-CD1 3.47Å; V434-I438 WeakPolarHBondContact O-CG1 3.24Å; V434-M467 HydrophobicContact CG1-CE 3.6Å; V434-M467 HydrophobicContact CG1-SD 4.27Å; V434-F470 HydrophobicContact CG1-CE1 4.49Å; V434-F470 HydrophobicContact CG2-CE1 3.68Å; V434-F470 HydrophobicContact CG2-CE2 4.36Å; V434-F470 HydrophobicContact CG2-CZ 3.51Å; V434-I509 HydrophobicContact CB-CD1 4.35Å; V434-I509 HydrophobicContact CB-CG1 4.43Å; V434-I509 HydrophobicContact CG1-CD1 4.43Å; V434-I509 HydrophobicContact CG1-CG1 4.35Å; V434-I509 HydrophobicContact CG1-CG2 3.94Å; V434-I509 HydrophobicContact CG2-CD1 4.16Å
435	M	96.5	Very high	89.7	Confident	13 Å²	13	42.1 Å²	42.1	6%	0.064	25%	0.247	C	C	.	.	H	α-helix	trans	-77.9	-28.4	-175.5	-70.8	-55.2	-53.4	0	0	113.7	P431 V432 I438 N439 F513 V516	P431-M435 WeakPolarHBondContact O-CB 3.48Å; P431-M435 VanDerWaalsContact O-CG 3.3Å; P431-M435 WeakPolarHBondContact O-CG 3.4Å; P431-M435 PolarHBondContact O-N 3.14Å; V432-M435 PolarHBondContact O-N 3.17Å; M435-I438 HydrophobicContact CE-CG2 4.34Å; M435-I438 PolarHBondContact O-N 3.06Å; M435-I438 HydrophobicContact SD-CD1 4.2Å; M435-N439 WeakPolarHBondContact O-CB 3.41Å; M435-N439 VanDerWaalsContact O-CG 3.28Å; M435-N439 PolarHBondContact O-N 2.98Å; M435-N439 PolarHBondContact O-ND2 2.84Å; M435-F513 HydrophobicContact CE-CB 4.46Å; M435-F513 HydrophobicContact SD-CB 4.05Å; M435-V516 HydrophobicContact CE-CB 4.35Å; M435-V516 HydrophobicContact CE-CG2 3.92Å
436	T	94.8	Very high	88.7	Confident	63 Å²	63	46.6 Å²	46.6	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-57	-52.9	177.9	-58	0	0	0	0	112.9	V432 I438 N439 E440	V432-T436 WeakPolarHBondContact O-CB 3.42Å; V432-T436 PolarHBondContact O-N 3.03Å; V432-T436 PolarHBondContact O-OG1 3.27Å; T436-I438 VanDerWaalsContact C-N 3.29Å; T436-I438 PolarHBondContact O-N 3.32Å; T436-N439 PolarHBondContact O-N 3.37Å; T436-E440 WeakPolarHBondContact O-CG 3.24Å; T436-E440 PolarHBondContact O-N 3.38Å
437	P	93.4	Very high	88.2	Confident	4 Å²	4	48 Å²	48	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-53	-45.7	173.5	-1.3	-9.9	0	0	0	113.7	L397 W400 L433 V434 E440 M441	L397-P437 HydrophobicContact CD1-CB 3.75Å; L397-P437 HydrophobicContact CD1-CG 4.3Å; W400-P437 HydrophobicContact CB-CG 4.43Å; W400-P437 HydrophobicContact CD2-CB 4.26Å; W400-P437 HydrophobicContact CE3-CB 3.26Å; W400-P437 HydrophobicContact CE3-CG 3.58Å; W400-P437 HydrophobicContact CZ3-CB 3.68Å; W400-P437 HydrophobicContact CZ3-CG 4.25Å; L433-P437 WeakPolarHBondContact O-CD 3.21Å; L433-P437 WeakPolarHBondContact O-CG 3.47Å; V434-P437 WeakPolarHBondContact O-CD 3.24Å; V434-P437 VanDerWaalsContact O-CG 3.27Å; V434-P437 WeakPolarHBondContact O-CG 3.39Å; P437-E440 PolarHBondContact O-N 3.14Å; P437-M441 HydrophobicContact CB-CE 4.33Å; P437-M441 WeakPolarHBondContact O-CB 3.34Å; P437-M441 VanDerWaalsContact O-CG 3.24Å; P437-M441 WeakPolarHBondContact O-CG 3.46Å; P437-M441 PolarHBondContact O-N 2.74Å
438	I	94.1	Very high	88	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-47.5	-174.4	-64.6	172.5	0	0	0	108.9	L397 V434 M435 T436 E440 M441 I442 M467 F513	L397-I438 HydrophobicContact CD1-CG1 3.89Å; V434-I438 HydrophobicContact CG1-CD1 4.25Å; V434-I438 WeakPolarHBondContact O-CD1 3.47Å; V434-I438 WeakPolarHBondContact O-CG1 3.24Å; M435-I438 HydrophobicContact CE-CG2 4.34Å; M435-I438 PolarHBondContact O-N 3.06Å; M435-I438 HydrophobicContact SD-CD1 4.2Å; T436-I438 VanDerWaalsContact C-N 3.29Å; T436-I438 PolarHBondContact O-N 3.32Å; I438-E440 VanDerWaalsContact C-N 3.33Å; I438-E440 PolarHBondContact O-N 3.4Å; I438-M441 PolarHBondContact O-N 3.07Å; I438-I442 HydrophobicContact CG2-CD1 3.59Å; I438-I442 HydrophobicContact CG2-CG1 4.47Å; I438-I442 WeakPolarHBondContact O-CB 3.19Å; I438-I442 VanDerWaalsContact O-CG1 3.24Å; I438-I442 WeakPolarHBondContact O-CG1 3.4Å; I438-I442 PolarHBondContact O-N 2.94Å; I438-M467 HydrophobicContact CD1-CE 4.13Å; I438-M467 HydrophobicContact CD1-CG 4.37Å; I438-M467 HydrophobicContact CD1-SD 3.64Å; I438-F513 HydrophobicContact CD1-CD2 3.82Å; I438-F513 HydrophobicContact CD1-CE2 4.07Å; I438-F513 HydrophobicContact CG2-CD2 4.22Å; I438-F513 HydrophobicContact CG2-CE2 4.24Å
439	N	91.7	Very high	87.6	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-63.5	-35.2	175.6	-70.7	-20	0	0	0	112.7	M435 T436 G443 V516	M435-N439 WeakPolarHBondContact O-CB 3.41Å; M435-N439 VanDerWaalsContact O-CG 3.28Å; M435-N439 PolarHBondContact O-N 2.98Å; M435-N439 PolarHBondContact O-ND2 2.84Å; T436-N439 PolarHBondContact O-N 3.37Å; N439-G443 WeakPolarHBondContact O-CA 3.14Å; N439-G443 PolarHBondContact O-N 3.43Å; N439-V516 WeakPolarHBondContact OD1-CG2 3.43Å
440	E	90.2	Very high	87.4	Confident	89 Å²	89	49 Å²	49	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-70.3	-36.7	175.8	-74.9	-171.8	170.2	0	0	113	W400 T436 P437 I438	W400-E440 WeakPolarHBondContact CH2-OE2 3.5Å; T436-E440 WeakPolarHBondContact O-CG 3.24Å; T436-E440 PolarHBondContact O-N 3.38Å; P437-E440 PolarHBondContact O-N 3.14Å; I438-E440 VanDerWaalsContact C-N 3.33Å; I438-E440 PolarHBondContact O-N 3.4Å
441	M	89.4	Confident	87.1	Confident	17 Å²	17	49.2 Å²	49.2	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-74.6	-33.3	178.9	-68.9	179.4	-165.2	0	0	112.5	T393 R396 L397 P437 I438 F459	T393-M441 HydrophobicContact CG2-CG 4.27Å; T393-M441 HydrophobicContact CG2-SD 3.79Å; R396-M441 HydrophobicContact CB-CE 4.47Å; R396-M441 HydrophobicContact CG-CE 4.26Å; L397-M441 HydrophobicContact CB-CE 3.83Å; L397-M441 HydrophobicContact CB-SD 3.91Å; L397-M441 HydrophobicContact CD1-CE 4.29Å; L397-M441 HydrophobicContact CD1-SD 4.34Å; P437-M441 HydrophobicContact CB-CE 4.33Å; P437-M441 WeakPolarHBondContact O-CB 3.34Å; P437-M441 VanDerWaalsContact O-CG 3.24Å; P437-M441 WeakPolarHBondContact O-CG 3.46Å; P437-M441 PolarHBondContact O-N 2.74Å; I438-M441 PolarHBondContact O-N 3.07Å; M441-F459 HydrophobicContact CB-CE2 4.26Å; M441-F459 HydrophobicContact CB-CZ 3.93Å
442	I	87.3	Confident	86.8	Confident	8 Å²	8	49 Å²	49	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-81.9	-50.4	176.3	-67.7	173.4	0	0	0	111	I438 F459 F460 V516 I517 E520	I438-I442 HydrophobicContact CG2-CD1 3.59Å; I438-I442 HydrophobicContact CG2-CG1 4.47Å; I438-I442 WeakPolarHBondContact O-CB 3.19Å; I438-I442 VanDerWaalsContact O-CG1 3.24Å; I438-I442 WeakPolarHBondContact O-CG1 3.4Å; I438-I442 PolarHBondContact O-N 2.94Å; I442-F459 HydrophobicContact CG1-CE1 3.86Å; I442-F459 HydrophobicContact CG1-CZ 4.27Å; I442-F460 HydrophobicContact CD1-CE1 4.18Å; I442-F460 HydrophobicContact CG1-CE1 4.17Å; I442-V516 HydrophobicContact CD1-CG1 3.68Å; I442-I517 HydrophobicContact CD1-CD1 3.64Å; I442-E520 HydrophobicContact CG2-CG 3.4Å; I442-E520 WeakPolarHBondContact CG2-OE1 3.43Å
443	G	65.5	Low	86.5	Confident	48 Å²	48	49.1 Å²	49.1	50%	0.495	28%	0.276	S	S	.	.	S	Bend	trans	-108	37.7	-151.8	0	0	0	0	0	117.3	N439	N439-G443 WeakPolarHBondContact O-CA 3.14Å; N439-G443 PolarHBondContact O-N 3.43Å
444	K	55.8	Low	86.2	Confident	148 Å²	148	48.4 Å²	48.4	64%	0.643	28%	0.277	S	S	*	.	S	Bend	trans	-123.2	113.6	161	-75.9	-178.8	-177.7	166.1	0	111	N446 L447	K444-N446 PolarHBondContact O-N 2.92Å; K444-L447 PolarHBondContact O-N 2.94Å
445	G	57.6	Low	86.1	Confident	79 Å²	79	48.4 Å²	48.4	81%	0.814	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	29.1	160	0	0	0	0	0	116.3	L447	G445-L447 PolarHBondContact O-N 3.33Å; G445-L447 VanDerWaalsContact O-N 3.17Å
446	N	76.6	Confident	85.9	Confident	113 Å²	113	48.4 Å²	48.4	60%	0.604	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	30.1	-178.7	-68	-25.2	0	0	0	112.7	K444 L448 H449 Y450	K444-N446 PolarHBondContact O-N 2.92Å; N446-L448 VanDerWaalsContact C-N 3.34Å; N446-L448 PolarHBondContact O-N 3.47Å; N446-H449 HydrophobicContact CB-CB 4.12Å; N446-H449 CarbonylContact O-C 3.54Å; N446-H449 WeakPolarHBondContact O-CA 3.21Å; N446-H449 WeakPolarHBondContact O-CB 3.38Å; N446-H449 PolarHBondContact O-N 3.29Å; N446-Y450 PolarHBondContact O-N 2.85Å
447	L	88	Confident	85.8	Confident	57 Å²	57	48.5 Å²	48.5	30%	0.298	27%	0.272	S	S	.	.	H	α-helix	trans	-56.3	-46.6	-174.6	178.6	61.9	0	0	0	112.3	V341 K444 G445 H449 Y450 L451	V341-L447 HydrophobicContact CG1-CD1 3.8Å; K444-L447 PolarHBondContact O-N 2.94Å; G445-L447 PolarHBondContact O-N 3.33Å; G445-L447 VanDerWaalsContact O-N 3.17Å; L447-H449 VanDerWaalsContact C-N 3.28Å; L447-H449 PolarHBondContact O-N 3.38Å; L447-Y450 HydrophobicContact CD1-CD1 4.25Å; L447-Y450 WeakPolarHBondContact O-CB 3.45Å; L447-Y450 PolarHBondContact O-N 3.05Å; L447-L451 HydrophobicContact CD1-CD1 4.26Å; L447-L451 HydrophobicContact CD1-CG 4.32Å; L447-L451 HydrophobicContact CG-CD1 4.15Å; L447-L451 VanDerWaalsContact O-CG 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.48Å; L447-L451 PolarHBondContact O-N 3.12Å
448	L	90.3	Very high	85.9	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-34.5	177.8	-74.2	179.2	0	0	0	112.3	Y389 N446 G452 V455 R456 F459 F460	Y389-L448 HydrophobicContact CE1-CD2 4.48Å; N446-L448 VanDerWaalsContact C-N 3.34Å; N446-L448 PolarHBondContact O-N 3.47Å; L448-G452 PolarHBondContact O-N 3.02Å; L448-V455 HydrophobicContact CD2-CG1 4.36Å; L448-R456 HydrophobicContact CB-CG 4.08Å; L448-R456 WeakPolarHBondContact O-CG 3.33Å; L448-F459 HydrophobicContact CD1-CD1 3.49Å; L448-F459 VanDerWaalsContact CD1-CD1 3.49Å; L448-F459 HydrophobicContact CD1-CE1 3.67Å; L448-F459 HydrophobicContact CD1-CG 4.23Å; L448-F459 HydrophobicContact CD2-CB 4.18Å; L448-F459 HydrophobicContact CD2-CD1 4.12Å; L448-F459 HydrophobicContact CD2-CG 4.01Å; L448-F459 HydrophobicContact CG-CD1 4.48Å; L448-F460 HydrophobicContact CD1-CE1 4.23Å; L448-F460 HydrophobicContact CD1-CZ 3.96Å
449	H	88.8	Confident	85.9	Confident	72 Å²	72	50.4 Å²	50.4	33%	0.333	28%	0.281	S	S	.	.	H	α-helix	trans	-68.6	-42.8	172.7	-66.2	83.9	0	0	0	111.7	N348 N446 L447 L451 G452 R456 E520	N348-H449 PolarHBondContact ND2-O 3.02Å; N446-H449 HydrophobicContact CB-CB 4.12Å; N446-H449 CarbonylContact O-C 3.54Å; N446-H449 WeakPolarHBondContact O-CA 3.21Å; N446-H449 WeakPolarHBondContact O-CB 3.38Å; N446-H449 PolarHBondContact O-N 3.29Å; L447-H449 VanDerWaalsContact C-N 3.28Å; L447-H449 PolarHBondContact O-N 3.38Å; H449-L451 VanDerWaalsContact C-N 3.26Å; H449-L451 PolarHBondContact O-N 2.83Å; H449-G452 PolarHBondContact O-N 2.87Å; H449-R456 VanDerWaalsContact CD2-CZ 3.49Å; H449-R456 PolarHBondContact CD2-NH1 2.92Å; H449-R456 PolarHBondContact CE1-NH2 3.37Å; H449-R456 VanDerWaalsContact CE1-NH2 3.32Å; H449-R456 PolarHBondContact NE2-NH1 2.9Å; H449-R456 PolarHBondContact NE2-NH2 2.97Å; H449-E520 IonicContact CE1-OE2 2.91Å
450	Y	90	Very high	86.1	Confident	99 Å²	99	47.1 Å²	47.1	39%	0.388	26%	0.263	S	S	.	.	H	α-helix	trans	-58.4	-39.2	175.9	174.6	-114.2	0	0	0	111.6	G345 N348 N446 L447 G452	G345-Y450 VanDerWaalsContact CA-CE1 3.48Å; G345-Y450 WeakPolarHBondContact CA-O 3.25Å; N348-Y450 PolarHBondContact ND2-O 2.88Å; N446-Y450 PolarHBondContact O-N 2.85Å; L447-Y450 HydrophobicContact CD1-CD1 4.25Å; L447-Y450 WeakPolarHBondContact O-CB 3.45Å; L447-Y450 PolarHBondContact O-N 3.05Å; Y450-G452 VanDerWaalsContact C-N 3.3Å; Y450-G452 PolarHBondContact O-N 2.97Å
451	L	92.2	Very high	86.3	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-75.3	-13.8	176.9	-65.8	174.9	0	0	0	114.5	V341 L344 Y389 L447 H449 V455	V341-L451 HydrophobicContact CB-CD2 4.48Å; V341-L451 HydrophobicContact CG1-CD2 4.15Å; V341-L451 WeakPolarHBondContact O-CD2 3.37Å; L344-L451 HydrophobicContact CB-CD2 3.71Å; L344-L451 HydrophobicContact CD1-CD2 4.36Å; Y389-L451 HydrophobicContact CD1-CD1 3.96Å; Y389-L451 HydrophobicContact CE1-CD1 3.36Å; Y389-L451 HydrophobicContact CE2-CD1 4Å; Y389-L451 HydrophobicContact CG-CD1 4.49Å; L447-L451 HydrophobicContact CD1-CD1 4.26Å; L447-L451 HydrophobicContact CD1-CG 4.32Å; L447-L451 HydrophobicContact CG-CD1 4.15Å; L447-L451 VanDerWaalsContact O-CG 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.48Å; L447-L451 PolarHBondContact O-N 3.12Å; H449-L451 VanDerWaalsContact C-N 3.26Å; H449-L451 PolarHBondContact O-N 2.83Å; L451-V455 HydrophobicContact CB-CB 3.99Å; L451-V455 HydrophobicContact CB-CG1 3.96Å; L451-V455 HydrophobicContact CB-CG2 4.12Å; L451-V455 HydrophobicContact CD1-CG1 4.08Å
452	G	90.1	Very high	86.6	Confident	6 Å²	6	46.1 Å²	46.1	6%	0.062	26%	0.261	C	S	.	.			trans	90.1	159.7	174	0	0	0	0	0	115.3	L448 H449 Y450 A454 V455 R456	L448-G452 PolarHBondContact O-N 3.02Å; H449-G452 PolarHBondContact O-N 2.87Å; Y450-G452 VanDerWaalsContact C-N 3.3Å; Y450-G452 PolarHBondContact O-N 2.97Å; G452-A454 VanDerWaalsContact C-N 3.29Å; G452-A454 PolarHBondContact O-N 3.11Å; G452-A454 VanDerWaalsContact O-N 3.14Å; G452-V455 PolarHBondContact O-N 3.32Å; G452-R456 PolarHBondContact O-N 3.49Å
453	N	89.7	Confident	87.1	Confident	95 Å²	95	45.8 Å²	45.8	51%	0.508	26%	0.259	S	S	.	.	H	α-helix	trans	-57.2	-34.6	-168.1	-69.3	-4.5	0	0	0	114.8	V455 R456 E457	N453-V455 VanDerWaalsContact C-N 3.31Å; N453-V455 PolarHBondContact O-N 3.46Å; N453-R456 WeakPolarHBondContact O-CB 3.46Å; N453-R456 PolarHBondContact O-N 3.02Å; N453-E457 PolarHBondContact O-N 3.34Å
454	A	91.3	Very high	88.5	Confident	30 Å²	30	43.8 Å²	43.8	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-33.6	178.1	0	0	0	0	0	112.9	G452 Q458	G452-A454 VanDerWaalsContact C-N 3.29Å; G452-A454 PolarHBondContact O-N 3.11Å; G452-A454 VanDerWaalsContact O-N 3.14Å; A454-Q458 WeakPolarHBondContact O-CG 3.17Å; A454-Q458 PolarHBondContact O-N 3.5Å; A454-Q458 PolarHBondContact O-NE2 2.92Å
455	V	94.3	Very high	90.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.5	-42.8	173.9	174.4	0	0	0	0	110	L344 R386 Y389 V390 L448 L451 G452 N453 E457 Q458 F459	L344-V455 HydrophobicContact CD1-CG2 4.43Å; R386-V455 HydrophobicContact CB-CG2 3.96Å; R386-V455 HydrophobicContact CG-CG2 3.63Å; Y389-V455 HydrophobicContact CD1-CG1 3.64Å; Y389-V455 HydrophobicContact CE1-CG1 3.68Å; V390-V455 HydrophobicContact CG2-CG1 3.97Å; L448-V455 HydrophobicContact CD2-CG1 4.36Å; L451-V455 HydrophobicContact CB-CB 3.99Å; L451-V455 HydrophobicContact CB-CG1 3.96Å; L451-V455 HydrophobicContact CB-CG2 4.12Å; L451-V455 HydrophobicContact CD1-CG1 4.08Å; G452-V455 PolarHBondContact O-N 3.32Å; N453-V455 VanDerWaalsContact C-N 3.31Å; N453-V455 PolarHBondContact O-N 3.46Å; V455-E457 PolarHBondContact O-N 3.41Å; V455-Q458 PolarHBondContact O-N 3.31Å; V455-F459 VanDerWaalsContact O-CB 3.3Å; V455-F459 WeakPolarHBondContact O-CB 3.36Å; V455-F459 PolarHBondContact O-N 3.2Å
456	R	92.8	Very high	92.4	Very high	12 Å²	12	38.2 Å²	38.2	5%	0.045	19%	0.192	C	C	.	.	H	α-helix	trans	-55.8	-51.4	177.2	-58.7	-176.8	64.8	-172	3	111.7	L448 H449 G452 N453 Q458 F459 F460 E520 L527	L448-R456 HydrophobicContact CB-CG 4.08Å; L448-R456 WeakPolarHBondContact O-CG 3.33Å; H449-R456 VanDerWaalsContact CD2-CZ 3.49Å; H449-R456 PolarHBondContact CD2-NH1 2.92Å; H449-R456 PolarHBondContact CE1-NH2 3.37Å; H449-R456 VanDerWaalsContact CE1-NH2 3.32Å; H449-R456 PolarHBondContact NE2-NH1 2.9Å; H449-R456 PolarHBondContact NE2-NH2 2.97Å; G452-R456 PolarHBondContact O-N 3.49Å; N453-R456 WeakPolarHBondContact O-CB 3.46Å; N453-R456 PolarHBondContact O-N 3.02Å; R456-Q458 PolarHBondContact O-N 3.42Å; R456-F459 PolarHBondContact O-N 3.46Å; R456-F460 HydrophobicContact CB-CD2 4.25Å; R456-F460 HydrophobicContact CB-CE2 4.12Å; R456-F460 WeakPolarHBondContact O-CD2 3.5Å; R456-F460 PolarHBondContact O-N 3.43Å; R456-E520 PolarHBondContact NH2-O 3.41Å; R456-L527 HydrophobicContact CB-CD1 4.12Å
457	E	92.6	Very high	93.4	Very high	66 Å²	66	32.9 Å²	32.9	31%	0.308	16%	0.163	S	C	.	.	H	α-helix	trans	-57.8	-49.2	-179.6	-172.1	165.6	-160.1	0	0	111.6	N453 V455 T461 L527 N530	N453-E457 PolarHBondContact O-N 3.34Å; V455-E457 PolarHBondContact O-N 3.41Å; E457-T461 WeakPolarHBondContact O-CB 3.48Å; E457-T461 PolarHBondContact O-N 3.26Å; E457-T461 PolarHBondContact O-OG1 3.09Å; E457-L527 HydrophobicContact CB-CD2 3.5Å; E457-L527 VanDerWaalsContact CB-CD2 3.5Å; E457-L527 HydrophobicContact CG-CD2 3.53Å; E457-N530 PolarHBondContact OE1-ND2 3.01Å
458	Q	95	Very high	93.9	Very high	43 Å²	43	31.7 Å²	31.7	20%	0.201	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-43.1	179.4	-72.4	179.1	48.2	0	0	111.8	V390 A454 V455 R456 Q462	V390-Q458 HydrophobicContact CG1-CB 4.26Å; V390-Q458 HydrophobicContact CG2-CB 3.99Å; A454-Q458 WeakPolarHBondContact O-CG 3.17Å; A454-Q458 PolarHBondContact O-N 3.5Å; A454-Q458 PolarHBondContact O-NE2 2.92Å; V455-Q458 PolarHBondContact O-N 3.31Å; R456-Q458 PolarHBondContact O-N 3.42Å; Q458-Q462 WeakPolarHBondContact O-CB 3.42Å; Q458-Q462 WeakPolarHBondContact O-CG 3.5Å; Q458-Q462 PolarHBondContact O-N 2.88Å
459	F	95.5	Very high	94.3	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-53.9	178.5	172.1	-96.3	0	0	0	111.6	V390 T393 I394 M441 I442 L448 V455 R456 T461 Q462 C463	V390-F459 HydrophobicContact CG1-CB 4.46Å; V390-F459 HydrophobicContact CG2-CB 4.38Å; T393-F459 HydrophobicContact CG2-CD2 4.09Å; T393-F459 HydrophobicContact CG2-CE2 3.73Å; I394-F459 HydrophobicContact CD1-CD2 4.14Å; I394-F459 HydrophobicContact CD1-CE2 4.17Å; M441-F459 HydrophobicContact CB-CE2 4.26Å; M441-F459 HydrophobicContact CB-CZ 3.93Å; I442-F459 HydrophobicContact CG1-CE1 3.86Å; I442-F459 HydrophobicContact CG1-CZ 4.27Å; L448-F459 HydrophobicContact CD1-CD1 3.49Å; L448-F459 VanDerWaalsContact CD1-CD1 3.49Å; L448-F459 HydrophobicContact CD1-CE1 3.67Å; L448-F459 HydrophobicContact CD1-CG 4.23Å; L448-F459 HydrophobicContact CD2-CB 4.18Å; L448-F459 HydrophobicContact CD2-CD1 4.12Å; L448-F459 HydrophobicContact CD2-CG 4.01Å; L448-F459 HydrophobicContact CG-CD1 4.48Å; V455-F459 VanDerWaalsContact O-CB 3.3Å; V455-F459 WeakPolarHBondContact O-CB 3.36Å; V455-F459 PolarHBondContact O-N 3.2Å; R456-F459 PolarHBondContact O-N 3.46Å; F459-T461 VanDerWaalsContact C-N 3.32Å; F459-T461 PolarHBondContact O-N 3.31Å; F459-Q462 PolarHBondContact O-N 3.34Å; F459-C463 HydrophobicContact CE1-CB 4.45Å; F459-C463 HydrophobicContact CZ-CB 4.46Å; F459-C463 WeakPolarHBondContact O-CB 3.44Å; F459-C463 PolarHBondContact O-N 3.27Å
460	F	94.9	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-38.4	-178	-69	-54.1	0	0	0	112	I442 L448 R456 C463 V464 I517 E520 L521 L531	I442-F460 HydrophobicContact CD1-CE1 4.18Å; I442-F460 HydrophobicContact CG1-CE1 4.17Å; L448-F460 HydrophobicContact CD1-CE1 4.23Å; L448-F460 HydrophobicContact CD1-CZ 3.96Å; R456-F460 HydrophobicContact CB-CD2 4.25Å; R456-F460 HydrophobicContact CB-CE2 4.12Å; R456-F460 WeakPolarHBondContact O-CD2 3.5Å; R456-F460 PolarHBondContact O-N 3.43Å; F460-C463 PolarHBondContact O-N 2.96Å; F460-V464 VanDerWaalsContact O-CG2 3.29Å; F460-V464 WeakPolarHBondContact O-CG2 3.41Å; F460-V464 PolarHBondContact O-N 3.28Å; F460-I517 HydrophobicContact CD1-CD1 3.65Å; F460-I517 HydrophobicContact CE1-CD1 3.86Å; F460-E520 HydrophobicContact CE1-CB 4.43Å; F460-E520 HydrophobicContact CZ-CB 3.94Å; F460-E520 HydrophobicContact CZ-CG 4.46Å; F460-L521 HydrophobicContact CD2-CD2 3.85Å; F460-L521 HydrophobicContact CE2-CD2 3.87Å; F460-L531 HydrophobicContact CB-CD1 3.56Å; F460-L531 HydrophobicContact CG-CD1 4.45Å
461	T	94.6	Very high	95.2	Very high	29 Å²	29	27.7 Å²	27.7	18%	0.178	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-51.8	175	-60.9	0	0	0	0	111.3	E457 F459 V464 E465 R534	E457-T461 WeakPolarHBondContact O-CB 3.48Å; E457-T461 PolarHBondContact O-N 3.26Å; E457-T461 PolarHBondContact O-OG1 3.09Å; F459-T461 VanDerWaalsContact C-N 3.32Å; F459-T461 PolarHBondContact O-N 3.31Å; T461-V464 PolarHBondContact O-N 2.87Å; T461-E465 WeakPolarHBondContact O-CG 3.37Å; T461-E465 PolarHBondContact O-N 3.18Å; T461-R534 VanDerWaalsContact CG2-NH1 3.3Å
462	Q	96.4	Very high	95.5	Very high	57 Å²	57	33.2 Å²	33.2	27%	0.266	17%	0.173	S	C	.	.	H	α-helix	trans	-71.9	-30.2	-179.4	-69.4	-178.4	42.4	0	0	112.7	V390 I394 Q458 F459 E465 E466	V390-Q462 HydrophobicContact CG1-CG 4.49Å; I394-Q462 HydrophobicContact CD1-CB 3.93Å; I394-Q462 HydrophobicContact CG1-CB 3.71Å; I394-Q462 HydrophobicContact CG2-CB 4.49Å; Q458-Q462 WeakPolarHBondContact O-CB 3.42Å; Q458-Q462 WeakPolarHBondContact O-CG 3.5Å; Q458-Q462 PolarHBondContact O-N 2.88Å; F459-Q462 PolarHBondContact O-N 3.34Å; Q462-E465 PolarHBondContact O-N 3.48Å; Q462-E466 WeakPolarHBondContact O-CB 3.39Å; Q462-E466 PolarHBondContact O-N 2.9Å
463	C	96.7	Very high	95.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-42.3	175.8	-173.8	0	0	0	0	111.4	I394 F459 F460 E465 E466 M467	I394-C463 HydrophobicContact CD1-CB 4.17Å; F459-C463 HydrophobicContact CE1-CB 4.45Å; F459-C463 HydrophobicContact CZ-CB 4.46Å; F459-C463 WeakPolarHBondContact O-CB 3.44Å; F459-C463 PolarHBondContact O-N 3.27Å; F460-C463 PolarHBondContact O-N 2.96Å; C463-E465 VanDerWaalsContact C-N 3.35Å; C463-E466 PolarHBondContact O-N 3.32Å; C463-M467 WeakPolarHBondContact O-CG 3.11Å; C463-M467 PolarHBondContact O-N 3.26Å
464	V	96.4	Very high	96.3	Very high	7 Å²	7	32.5 Å²	32.5	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-42.1	173.2	172.6	0	0	0	0	111.2	F460 T461 M467 A468 F513 R534 I535 L538	F460-V464 VanDerWaalsContact O-CG2 3.29Å; F460-V464 WeakPolarHBondContact O-CG2 3.41Å; F460-V464 PolarHBondContact O-N 3.28Å; T461-V464 PolarHBondContact O-N 2.87Å; V464-M467 PolarHBondContact O-N 3.23Å; V464-A468 PolarHBondContact O-N 2.92Å; V464-F513 HydrophobicContact CG2-CE1 3.96Å; V464-F513 HydrophobicContact CG2-CZ 3.98Å; V464-R534 HydrophobicContact CG1-CB 4.08Å; V464-I535 HydrophobicContact CG2-CG1 3.94Å; V464-L538 HydrophobicContact CG1-CD2 4.18Å
465	E	96.6	Very high	96.6	Very high	93 Å²	93	31.8 Å²	31.8	44%	0.435	16%	0.16	S	C	.	.	H	α-helix	trans	-63.9	-42.1	177	-72	169.5	-173.6	0	0	111.7	T461 Q462 C463 A468 L469 R534	T461-E465 WeakPolarHBondContact O-CG 3.37Å; T461-E465 PolarHBondContact O-N 3.18Å; Q462-E465 PolarHBondContact O-N 3.48Å; C463-E465 VanDerWaalsContact C-N 3.35Å; E465-A468 WeakPolarHBondContact O-CB 3.4Å; E465-A468 PolarHBondContact O-N 2.95Å; E465-A468 VanDerWaalsContact O-N 3.14Å; E465-L469 PolarHBondContact O-N 3.45Å; E465-R534 IonicContact OE1-NH1 3.59Å; E465-R534 PolarHBondContact OE1-NH1 3.15Å
466	E	97.7	Very high	96.8	Very high	17 Å²	17	35.4 Å²	35.4	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-41.1	176.5	-172.2	59.7	-148.2	0	0	111.5	I394 L397 K398 L401 Q462 C463 A468 L469 F470	I394-E466 HydrophobicContact CG2-CB 4.47Å; L397-E466 HydrophobicContact CD2-CG 4.36Å; L397-E466 HydrophobicContact CG-CG 4.47Å; K398-E466 WeakPolarHBondContact CA-OE1 3.42Å; K398-E466 HydrophobicContact CB-CG 4.41Å; K398-E466 VanDerWaalsContact CB-OE1 3.24Å; K398-E466 WeakPolarHBondContact CB-OE1 3.25Å; K398-E466 WeakPolarHBondContact CG-OE1 3.49Å; L401-E466 HydrophobicContact CD1-CG 3.99Å; Q462-E466 WeakPolarHBondContact O-CB 3.39Å; Q462-E466 PolarHBondContact O-N 2.9Å; C463-E466 PolarHBondContact O-N 3.32Å; E466-A468 PolarHBondContact O-N 3.3Å; E466-L469 WeakPolarHBondContact O-CB 3.43Å; E466-L469 PolarHBondContact O-N 3.12Å; E466-L469 VanDerWaalsContact O-N 3.09Å; E466-F470 WeakPolarHBondContact O-CB 3.39Å; E466-F470 PolarHBondContact O-N 3.03Å
467	M	98.2	Very high	97.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-28.4	174.1	-70.7	-53.9	-70.7	0	0	113.1	L401 V434 I438 C463 V464 F470 V471 I509 F513 L538 Y542	L401-M467 HydrophobicContact CD1-SD 3.97Å; L401-M467 HydrophobicContact CD2-SD 4.5Å; V434-M467 HydrophobicContact CG1-CE 3.6Å; V434-M467 HydrophobicContact CG1-SD 4.27Å; I438-M467 HydrophobicContact CD1-CE 4.13Å; I438-M467 HydrophobicContact CD1-CG 4.37Å; I438-M467 HydrophobicContact CD1-SD 3.64Å; C463-M467 WeakPolarHBondContact O-CG 3.11Å; C463-M467 PolarHBondContact O-N 3.26Å; V464-M467 PolarHBondContact O-N 3.23Å; M467-F470 HydrophobicContact CE-CD1 4.44Å; M467-V471 PolarHBondContact O-N 3.47Å; M467-I509 HydrophobicContact CE-CG2 3.49Å; M467-I509 VanDerWaalsContact CE-CG2 3.49Å; M467-F513 HydrophobicContact CB-CZ 4.38Å; M467-F513 HydrophobicContact CE-CD2 4.5Å; M467-F513 HydrophobicContact CG-CD2 3.97Å; M467-F513 HydrophobicContact CG-CE1 4.3Å; M467-F513 HydrophobicContact CG-CE2 3.59Å; M467-F513 HydrophobicContact CG-CG 4.47Å; M467-F513 HydrophobicContact CG-CZ 3.77Å; M467-L538 HydrophobicContact CB-CD1 4.21Å; M467-L538 HydrophobicContact CB-CD2 3.72Å; M467-Y542 WeakPolarHBondContact CE-OH 3.4Å; M467-Y542 PolarHBondContact O-OH 3.27Å
468	A	97.8	Very high	97.4	Very high	32 Å²	32	33.4 Å²	33.4	26%	0.264	17%	0.172	S	C	.	.	H	α-helix	trans	-75.7	-26.3	174.3	0	0	0	0	0	112.7	V464 E465 E466 V471 L538	V464-A468 PolarHBondContact O-N 2.92Å; E465-A468 WeakPolarHBondContact O-CB 3.4Å; E465-A468 PolarHBondContact O-N 2.95Å; E465-A468 VanDerWaalsContact O-N 3.14Å; E466-A468 PolarHBondContact O-N 3.3Å; A468-V471 WeakPolarHBondContact O-CG1 3.4Å; A468-L538 HydrophobicContact CB-CD1 3.73Å
469	L	98.3	Very high	97.5	Very high	80 Å²	80	35 Å²	35	42%	0.419	18%	0.178	S	C	.	.	H	α-helix	trans	-76.4	-45.7	170.6	-67.3	177.7	0	0	0	110.5	E465 E466 V471 K472 D473	E465-L469 PolarHBondContact O-N 3.45Å; E466-L469 WeakPolarHBondContact O-CB 3.43Å; E466-L469 PolarHBondContact O-N 3.12Å; E466-L469 VanDerWaalsContact O-N 3.09Å; L469-V471 VanDerWaalsContact C-N 3.3Å; L469-V471 PolarHBondContact O-N 2.76Å; L469-K472 WeakPolarHBondContact O-CB 3.49Å; L469-K472 PolarHBondContact O-N 3.09Å; L469-D473 PolarHBondContact O-N 2.96Å
470	F	98.6	Very high	97.6	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-54.9	-42.8	-179.6	177.7	-105.4	0	0	0	113.2	L401 L405 L430 V434 E466 M467 K472 D473 Y474 I509 Y542	L401-F470 HydrophobicContact CB-CD2 3.66Å; L401-F470 HydrophobicContact CB-CE2 3.95Å; L401-F470 HydrophobicContact CB-CG 4.42Å; L401-F470 HydrophobicContact CD1-CB 4.19Å; L401-F470 HydrophobicContact CD1-CD2 4.33Å; L401-F470 HydrophobicContact CD1-CG 4.29Å; L401-F470 HydrophobicContact CD2-CD2 4.48Å; L401-F470 HydrophobicContact CG-CD2 4.37Å; L401-F470 WeakPolarHBondContact O-CE2 3.46Å; L405-F470 HydrophobicContact CB-CE2 3.85Å; L405-F470 HydrophobicContact CB-CZ 4.31Å; L405-F470 HydrophobicContact CD2-CE2 4.26Å; L430-F470 HydrophobicContact CD1-CZ 4.18Å; L430-F470 HydrophobicContact CD2-CZ 4.3Å; L430-F470 HydrophobicContact CG-CZ 4.43Å; V434-F470 HydrophobicContact CG1-CE1 4.49Å; V434-F470 HydrophobicContact CG2-CE1 3.68Å; V434-F470 HydrophobicContact CG2-CE2 4.36Å; V434-F470 HydrophobicContact CG2-CZ 3.51Å; E466-F470 WeakPolarHBondContact O-CB 3.39Å; E466-F470 PolarHBondContact O-N 3.03Å; M467-F470 HydrophobicContact CE-CD1 4.44Å; F470-K472 PolarHBondContact O-N 3.04Å; F470-D473 PolarHBondContact O-N 2.84Å; F470-Y474 HydrophobicContact CE1-CD1 4.32Å; F470-Y474 WeakPolarHBondContact O-CB 3.04Å; F470-Y474 PolarHBondContact O-N 3.15Å; F470-I509 HydrophobicContact CE1-CD1 4.32Å; F470-Y542 WeakPolarHBondContact CD1-OH 3.43Å
471	V	98.5	Very high	97.7	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-28.3	178.8	70.5	0	0	0	0	113	M467 A468 L469 D475 Y542 V545	M467-V471 PolarHBondContact O-N 3.47Å; A468-V471 WeakPolarHBondContact O-CG1 3.4Å; L469-V471 VanDerWaalsContact C-N 3.3Å; L469-V471 PolarHBondContact O-N 2.76Å; V471-D475 WeakPolarHBondContact O-CB 3.34Å; V471-D475 PolarHBondContact O-N 3.46Å; V471-Y542 HydrophobicContact CB-CD1 4.42Å; V471-Y542 HydrophobicContact CB-CD2 4.03Å; V471-Y542 HydrophobicContact CB-CE1 4Å; V471-Y542 HydrophobicContact CB-CE2 3.55Å; V471-Y542 HydrophobicContact CB-CG 4.44Å; V471-Y542 HydrophobicContact CG1-CD2 4.38Å; V471-Y542 HydrophobicContact CG1-CE2 4.02Å; V471-Y542 HydrophobicContact CG2-CD1 3.84Å; V471-Y542 HydrophobicContact CG2-CD2 3.87Å; V471-Y542 HydrophobicContact CG2-CE1 3.87Å; V471-Y542 HydrophobicContact CG2-CE2 3.89Å; V471-Y542 HydrophobicContact CG2-CG 3.85Å; V471-V545 HydrophobicContact CG2-CG1 4.39Å; V471-V545 HydrophobicContact CG2-CG2 3.66Å
472	K	98.6	Very high	97.8	Very high	120 Å²	120	43.5 Å²	43.5	52%	0.522	21%	0.21	S	C	.	.	H	α-helix	trans	-73.7	-44.6	176.5	-62.5	174.3	-176.3	176.7	0	110.8	L469 F470 Y474 D475 D476	L469-K472 WeakPolarHBondContact O-CB 3.49Å; L469-K472 PolarHBondContact O-N 3.09Å; F470-K472 PolarHBondContact O-N 3.04Å; K472-Y474 VanDerWaalsContact C-N 3.26Å; K472-Y474 PolarHBondContact O-N 3.38Å; K472-D475 PolarHBondContact O-N 2.94Å; K472-D476 PolarHBondContact O-N 3.31Å
473	D	98.5	Very high	97.8	Very high	87 Å²	87	43.5 Å²	43.5	47%	0.465	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-41.1	175.3	-66	-23.7	0	0	0	110.4	L405 L469 F470 D476 D477	L405-D473 HydrophobicContact CD2-CB 4.15Å; L469-D473 PolarHBondContact O-N 2.96Å; F470-D473 PolarHBondContact O-N 2.84Å; D473-D476 PolarHBondContact O-N 3.08Å; D473-D477 PolarHBondContact O-N 3.2Å; D473-D477 VanDerWaalsContact O-N 3.09Å
474	Y	98.4	Very high	97.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-47.3	176	-171.2	-171.3	0	0	0	112.2	L405 W412 L430 F470 K472 D476 D477 I478 N502 A506 W549	L405-Y474 HydrophobicContact CD1-CD2 3.53Å; L405-Y474 HydrophobicContact CD1-CE2 4.09Å; L405-Y474 HydrophobicContact CD1-CG 4.03Å; W412-Y474 HydrophobicContact CH2-CD2 4.29Å; W412-Y474 HydrophobicContact CH2-CE2 4.02Å; W412-Y474 HydrophobicContact CZ2-CD2 4.46Å; W412-Y474 AromaticContact CZ2-CE2 3.82Å; W412-Y474 HydrophobicContact CZ2-CE2 3.82Å; L430-Y474 HydrophobicContact CD2-CD1 4.17Å; L430-Y474 HydrophobicContact CD2-CD2 4.31Å; L430-Y474 HydrophobicContact CD2-CE1 3.65Å; L430-Y474 HydrophobicContact CD2-CE2 3.8Å; L430-Y474 HydrophobicContact CD2-CG 4.48Å; L430-Y474 VanDerWaalsContact CD2-CZ 3.44Å; F470-Y474 HydrophobicContact CE1-CD1 4.32Å; F470-Y474 WeakPolarHBondContact O-CB 3.04Å; F470-Y474 PolarHBondContact O-N 3.15Å; K472-Y474 VanDerWaalsContact C-N 3.26Å; K472-Y474 PolarHBondContact O-N 3.38Å; Y474-D476 VanDerWaalsContact C-N 3.31Å; Y474-D476 PolarHBondContact O-N 3.06Å; Y474-D477 PolarHBondContact O-N 2.99Å; Y474-I478 HydrophobicContact CD2-CG1 4Å; Y474-I478 HydrophobicContact CE2-CD1 4.03Å; Y474-I478 HydrophobicContact CE2-CG1 3.89Å; Y474-I478 WeakPolarHBondContact O-CG1 3.33Å; Y474-I478 PolarHBondContact O-N 3.4Å; Y474-N502 HydrophobicContact CE2-CB 4.31Å; Y474-N502 VanDerWaalsContact CE2-OD1 3.28Å; Y474-N502 WeakPolarHBondContact CE2-OD1 3.33Å; Y474-N502 VanDerWaalsContact CZ-OD1 3.31Å; Y474-N502 VanDerWaalsContact OH-CA 3.32Å; Y474-N502 WeakPolarHBondContact OH-CA 3.36Å; Y474-N502 VanDerWaalsContact OH-CB 3.25Å; Y474-N502 WeakPolarHBondContact OH-CB 3.41Å; Y474-N502 VanDerWaalsContact OH-CG 3.25Å; Y474-N502 PolarHBondContact OH-O 3.05Å; Y474-N502 PolarHBondContact OH-OD1 3.39Å; Y474-A506 HydrophobicContact CE1-CB 4.43Å; Y474-W549 AromaticContact CD1-CH2 3.63Å; Y474-W549 HydrophobicContact CD1-CH2 3.63Å; Y474-W549 HydrophobicContact CD1-CZ3 4.36Å; Y474-W549 HydrophobicContact CD2-CH2 4.07Å; Y474-W549 AromaticContact CE1-CH2 3.6Å; Y474-W549 HydrophobicContact CE1-CH2 3.6Å; Y474-W549 AromaticContact CE1-CZ3 3.86Å; Y474-W549 HydrophobicContact CE1-CZ3 3.86Å; Y474-W549 HydrophobicContact CE2-CH2 4.05Å; Y474-W549 HydrophobicContact CE2-CZ3 4.29Å; Y474-W549 AromaticContact CG-CH2 3.87Å; Y474-W549 HydrophobicContact CG-CH2 3.87Å; Y474-W549 HydrophobicContact CG-CZ2 4.45Å; Y474-W549 AromaticContact CZ-CH2 3.82Å; Y474-W549 AromaticContact CZ-CZ3 3.83Å
475	D	98.6	Very high	97.8	Very high	15 Å²	15	45.4 Å²	45.4	8%	0.08	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-39	176.2	-177.7	45.6	0	0	0	112.3	V471 K472 D477 I478 K479 V545 W549	V471-D475 WeakPolarHBondContact O-CB 3.34Å; V471-D475 PolarHBondContact O-N 3.46Å; K472-D475 PolarHBondContact O-N 2.94Å; D475-D477 VanDerWaalsContact C-N 3.34Å; D475-D477 PolarHBondContact O-N 3.35Å; D475-I478 PolarHBondContact O-N 3.07Å; D475-K479 VanDerWaalsContact O-CG 3.32Å; D475-K479 WeakPolarHBondContact O-CG 3.35Å; D475-K479 PolarHBondContact O-N 3.12Å; D475-K479 WeakPolarHBondContact OD2-CE 3.47Å; D475-K479 IonicContact OD2-NZ 3.23Å; D475-K479 PolarHBondContact OD2-NZ 3.39Å; D475-V545 HydrophobicContact CB-CG1 4.14Å; D475-W549 HydrophobicContact CB-CZ2 4.08Å; D475-W549 PolarHBondContact OD1-NE1 2.86Å
476	D	98.6	Very high	97.7	Very high	75 Å²	75	44.5 Å²	44.5	40%	0.401	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-37.1	176	-77.1	-12.6	0	0	0	112.7	K472 D473 Y474 K479 K480	K472-D476 PolarHBondContact O-N 3.31Å; D473-D476 PolarHBondContact O-N 3.08Å; Y474-D476 VanDerWaalsContact C-N 3.31Å; Y474-D476 PolarHBondContact O-N 3.06Å; D476-K479 PolarHBondContact O-N 3.34Å; D476-K479 IonicContact OD1-NZ 2.63Å; D476-K479 PolarHBondContact OD1-NZ 3.36Å; D476-K480 VanDerWaalsContact O-CG 3.3Å; D476-K480 WeakPolarHBondContact O-CG 3.15Å; D476-K480 PolarHBondContact O-N 3.38Å
477	D	98.3	Very high	97.6	Very high	37 Å²	37	51.9 Å²	51.9	20%	0.198	27%	0.265	C	S	.	.	H	α-helix	trans	-70.8	-37.6	174.9	-77.5	-8.1	0	0	0	112.5	T409 W412 D473 Y474 D475 K479 K480 Y481	T409-D477 HydrophobicContact CG2-CB 3.96Å; W412-D477 HydrophobicContact CH2-CB 4.1Å; W412-D477 HydrophobicContact CZ3-CB 4.21Å; D473-D477 PolarHBondContact O-N 3.2Å; D473-D477 VanDerWaalsContact O-N 3.09Å; Y474-D477 PolarHBondContact O-N 2.99Å; D475-D477 VanDerWaalsContact C-N 3.34Å; D475-D477 PolarHBondContact O-N 3.35Å; D477-K479 VanDerWaalsContact C-N 3.34Å; D477-K479 PolarHBondContact O-N 3.04Å; D477-K480 PolarHBondContact O-N 2.63Å; D477-K480 IonicContact OD1-NZ 2.63Å; D477-K480 PolarHBondContact OD1-NZ 3.27Å; D477-Y481 WeakPolarHBondContact O-CB 3.34Å; D477-Y481 PolarHBondContact O-N 2.96Å
478	I	98.2	Very high	97.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-40	172.1	-65.9	-70	0	0	0	111.1	W412 Y474 D475 K480 Y481 R482 I499 N502 W549 Y552	W412-I478 HydrophobicContact CE3-CD1 4.35Å; W412-I478 HydrophobicContact CH2-CD1 3.51Å; W412-I478 HydrophobicContact CH2-CG1 4.03Å; W412-I478 HydrophobicContact CZ2-CD1 3.98Å; W412-I478 HydrophobicContact CZ3-CD1 3.73Å; W412-I478 HydrophobicContact CZ3-CG1 4.37Å; Y474-I478 HydrophobicContact CD2-CG1 4Å; Y474-I478 HydrophobicContact CE2-CD1 4.03Å; Y474-I478 HydrophobicContact CE2-CG1 3.89Å; Y474-I478 WeakPolarHBondContact O-CG1 3.33Å; Y474-I478 PolarHBondContact O-N 3.4Å; D475-I478 PolarHBondContact O-N 3.07Å; I478-K480 PolarHBondContact O-N 3.49Å; I478-Y481 WeakPolarHBondContact O-CB 2.98Å; I478-Y481 PolarHBondContact O-N 3.01Å; I478-R482 PolarHBondContact O-N 2.98Å; I478-I499 HydrophobicContact CG2-CD1 3.98Å; I478-N502 HydrophobicContact CD1-CB 3.7Å; I478-W549 HydrophobicContact CB-CD2 4.42Å; I478-W549 HydrophobicContact CB-CZ2 4.39Å; I478-W549 HydrophobicContact CG1-CD2 4.15Å; I478-W549 HydrophobicContact CG1-CE3 4.39Å; I478-W549 HydrophobicContact CG1-CH2 4.23Å; I478-W549 HydrophobicContact CG1-CZ2 3.96Å; I478-W549 HydrophobicContact CG1-CZ3 4.42Å; I478-W549 HydrophobicContact CG2-CD2 4.02Å; I478-W549 HydrophobicContact CG2-CG 3.79Å; I478-Y552 HydrophobicContact CG2-CD2 4.15Å; I478-Y552 HydrophobicContact CG2-CE2 4.09Å
479	K	98.3	Very high	97.1	Very high	76 Å²	76	56.3 Å²	56.3	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-41.1	174.3	-73.5	168.5	-167.4	154.3	0	112.4	D475 D476 D477 Y481 R482 A483	D475-K479 VanDerWaalsContact O-CG 3.32Å; D475-K479 WeakPolarHBondContact O-CG 3.35Å; D475-K479 PolarHBondContact O-N 3.12Å; D475-K479 WeakPolarHBondContact OD2-CE 3.47Å; D475-K479 IonicContact OD2-NZ 3.23Å; D475-K479 PolarHBondContact OD2-NZ 3.39Å; D476-K479 PolarHBondContact O-N 3.34Å; D476-K479 IonicContact OD1-NZ 2.63Å; D476-K479 PolarHBondContact OD1-NZ 3.36Å; D477-K479 VanDerWaalsContact C-N 3.34Å; D477-K479 PolarHBondContact O-N 3.04Å; K479-Y481 VanDerWaalsContact C-N 3.35Å; K479-R482 PolarHBondContact O-N 3.46Å; K479-A483 WeakPolarHBondContact O-CB 3.27Å; K479-A483 PolarHBondContact O-N 2.87Å
480	K	97.2	Very high	96.8	Very high	130 Å²	130	57.3 Å²	57.3	57%	0.565	29%	0.292	S	S	*	.	H	α-helix	trans	-63.2	-42.8	174.5	-69.8	167.7	-157	156.7	0	111	D476 D477 I478 A483 A484	D476-K480 VanDerWaalsContact O-CG 3.3Å; D476-K480 WeakPolarHBondContact O-CG 3.15Å; D476-K480 PolarHBondContact O-N 3.38Å; D477-K480 PolarHBondContact O-N 2.63Å; D477-K480 IonicContact OD1-NZ 2.63Å; D477-K480 PolarHBondContact OD1-NZ 3.27Å; I478-K480 PolarHBondContact O-N 3.49Å; K480-A483 PolarHBondContact O-N 2.96Å; K480-A484 PolarHBondContact O-N 2.9Å
481	Y	96.8	Very high	96.4	Very high	13 Å²	13	63.6 Å²	63.6	5%	0.051	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-47.4	176.5	-176.8	-115.3	0	0	0	111.7	W412 D477 I478 K479 A483 A484 Y485 F492 Y495 I499	W412-Y481 HydrophobicContact CB-CD2 4.12Å; W412-Y481 HydrophobicContact CB-CE1 4.42Å; W412-Y481 HydrophobicContact CB-CE2 3.62Å; W412-Y481 HydrophobicContact CE3-CD1 4.27Å; W412-Y481 HydrophobicContact CE3-CD2 4.03Å; W412-Y481 AromaticContact CE3-CG 3.82Å; W412-Y481 HydrophobicContact CE3-CG 3.82Å; W412-Y481 HydrophobicContact CZ3-CG 4.46Å; W412-Y481 WeakPolarHBondContact O-CE2 3.4Å; W412-Y481 PolarHBondContact O-OH 3.37Å; D477-Y481 WeakPolarHBondContact O-CB 3.34Å; D477-Y481 PolarHBondContact O-N 2.96Å; I478-Y481 WeakPolarHBondContact O-CB 2.98Å; I478-Y481 PolarHBondContact O-N 3.01Å; K479-Y481 VanDerWaalsContact C-N 3.35Å; Y481-A483 PolarHBondContact O-N 3.21Å; Y481-A484 PolarHBondContact O-N 3.03Å; Y481-Y485 PolarHBondContact O-N 3.3Å; Y481-F492 HydrophobicContact CD2-CD1 4.22Å; Y481-F492 HydrophobicContact CD2-CE1 4.07Å; Y481-F492 AromaticContact CE2-CD1 3.42Å; Y481-F492 HydrophobicContact CE2-CD1 3.42Å; Y481-F492 VanDerWaalsContact CE2-CD1 3.42Å; Y481-F492 AromaticContact CE2-CE1 3.69Å; Y481-F492 HydrophobicContact CE2-CE1 3.69Å; Y481-F492 HydrophobicContact CE2-CG 4.41Å; Y481-Y495 AromaticContact CD1-CD2 3.87Å; Y481-Y495 HydrophobicContact CD1-CD2 3.87Å; Y481-Y495 AromaticContact CD1-CE2 3.62Å; Y481-Y495 HydrophobicContact CD1-CE2 3.62Å; Y481-Y495 AromaticContact CE1-CD2 3.23Å; Y481-Y495 HydrophobicContact CE1-CD2 3.23Å; Y481-Y495 AromaticContact CE1-CE2 3.49Å; Y481-Y495 HydrophobicContact CE1-CE2 3.49Å; Y481-Y495 VanDerWaalsContact CE1-CE2 3.49Å; Y481-Y495 HydrophobicContact CE1-CG 4.28Å; Y481-Y495 AromaticContact CZ-CD2 3.7Å; Y481-I499 HydrophobicContact CD1-CD1 3.95Å; Y481-I499 HydrophobicContact CD1-CG1 4.49Å; Y481-I499 HydrophobicContact CE1-CD1 4.26Å; Y481-I499 HydrophobicContact CE1-CG1 4.32Å
482	R	96.8	Very high	96.2	Very high	66 Å²	66	64 Å²	64	25%	0.249	32%	0.321	C	S	.	.	H	α-helix	trans	-56.1	-47.7	171.8	172.8	178.5	176.7	-86.4	-2.4	112.4	I478 K479 A484 Y485 I486 Y495 Y552 E555	I478-R482 PolarHBondContact O-N 2.98Å; K479-R482 PolarHBondContact O-N 3.46Å; R482-A484 VanDerWaalsContact C-N 3.31Å; R482-A484 PolarHBondContact O-N 2.94Å; R482-Y485 WeakPolarHBondContact O-CB 3.26Å; R482-Y485 PolarHBondContact O-N 3.42Å; R482-I486 HydrophobicContact CG-CD1 3.79Å; R482-I486 HydrophobicContact CG-CG1 4.43Å; R482-I486 VanDerWaalsContact CZ-CD1 3.48Å; R482-I486 WeakPolarHBondContact O-CG1 3.41Å; R482-I486 PolarHBondContact O-N 2.96Å; R482-Y495 WeakPolarHBondContact CB-OH 3.3Å; R482-Y552 HydrophobicContact CB-CD2 4.34Å; R482-Y552 HydrophobicContact CB-CE2 4.46Å; R482-Y552 HydrophobicContact CG-CG 4.48Å; R482-E555 IonicContact CZ-OE1 3.58Å; R482-E555 IonicContact CZ-OE2 3.24Å; R482-E555 IonicContact NE-OE2 3.66Å; R482-E555 PolarHBondContact NE-OE2 2.71Å; R482-E555 IonicContact NH2-OE1 2.69Å; R482-E555 PolarHBondContact NH2-OE1 3.31Å; R482-E555 IonicContact NH2-OE2 2.76Å; R482-E555 PolarHBondContact NH2-OE2 3.46Å
483	A	97.3	Very high	95.8	Very high	56 Å²	56	62.3 Å²	62.3	46%	0.463	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-40.5	-179.1	0	0	0	0	0	111.9	K479 K480 Y481 I486 Q487	K479-A483 WeakPolarHBondContact O-CB 3.27Å; K479-A483 PolarHBondContact O-N 2.87Å; K480-A483 PolarHBondContact O-N 2.96Å; Y481-A483 PolarHBondContact O-N 3.21Å; A483-I486 PolarHBondContact O-N 3.09Å; A483-Q487 PolarHBondContact O-N 3.43Å; A483-Q487 VanDerWaalsContact O-N 3.16Å
484	A	96.1	Very high	95.7	Very high	33 Å²	33	58.9 Å²	58.9	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-39.9	175.8	0	0	0	0	0	112.2	K480 Y481 R482 Q487 D488 F492	K480-A484 PolarHBondContact O-N 2.9Å; Y481-A484 PolarHBondContact O-N 3.03Å; R482-A484 VanDerWaalsContact C-N 3.31Å; R482-A484 PolarHBondContact O-N 2.94Å; A484-Q487 WeakPolarHBondContact O-CB 3.3Å; A484-Q487 PolarHBondContact O-N 3.41Å; A484-D488 PolarHBondContact O-N 3.37Å; A484-D488 VanDerWaalsContact O-N 3.15Å; A484-F492 HydrophobicContact CB-CE2 4.08Å; A484-F492 HydrophobicContact CB-CZ 3.64Å; A484-F492 WeakPolarHBondContact O-CE2 3.4Å
485	Y	95.8	Very high	95.6	Very high	14 Å²	14	59 Å²	59	6%	0.055	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-47	174.4	176.8	-108.5	0	0	0	112.8	Y481 R482 Q487 D488 R489 F492 Y495 T556 M559	Y481-Y485 PolarHBondContact O-N 3.3Å; R482-Y485 WeakPolarHBondContact O-CB 3.26Å; R482-Y485 PolarHBondContact O-N 3.42Å; Y485-Q487 PolarHBondContact O-N 2.84Å; Y485-D488 CarbonylContact O-C 3.56Å; Y485-D488 VanDerWaalsContact O-C 3.28Å; Y485-D488 PolarHBondContact O-N 3.47Å; Y485-R489 HydrophobicContact CD1-CG 4.44Å; Y485-R489 HydrophobicContact CD2-CB 4.35Å; Y485-R489 HydrophobicContact CD2-CG 4.29Å; Y485-R489 HydrophobicContact CE1-CG 3.95Å; Y485-R489 HydrophobicContact CE2-CB 3.8Å; Y485-R489 HydrophobicContact CE2-CG 3.83Å; Y485-R489 WeakPolarHBondContact O-CA 3.34Å; Y485-R489 WeakPolarHBondContact O-CG 3.34Å; Y485-R489 PolarHBondContact O-N 2.92Å; Y485-R489 VanDerWaalsContact O-N 3.08Å; Y485-R489 PolarHBondContact OH-NE 3.31Å; Y485-F492 HydrophobicContact CD2-CB 3.84Å; Y485-F492 HydrophobicContact CD2-CD2 4.07Å; Y485-F492 HydrophobicContact CD2-CG 4.27Å; Y485-F492 HydrophobicContact CE2-CB 4.4Å; Y485-Y495 VanDerWaalsContact CB-CE2 3.44Å; Y485-Y495 AromaticContact CD1-CD1 3.74Å; Y485-Y495 HydrophobicContact CD1-CD1 3.74Å; Y485-Y495 HydrophobicContact CD1-CD2 4.04Å; Y485-Y495 AromaticContact CD1-CE1 3.64Å; Y485-Y495 HydrophobicContact CD1-CE1 3.64Å; Y485-Y495 AromaticContact CD1-CE2 3.95Å; Y485-Y495 HydrophobicContact CD1-CE2 3.95Å; Y485-Y495 AromaticContact CD1-CG 3.94Å; Y485-Y495 HydrophobicContact CD1-CG 3.94Å; Y485-Y495 AromaticContact CD1-CZ 3.74Å; Y485-Y495 HydrophobicContact CD2-CD1 4.08Å; Y485-Y495 AromaticContact CD2-CD2 3.64Å; Y485-Y495 HydrophobicContact CD2-CD2 3.64Å; Y485-Y495 HydrophobicContact CD2-CE2 4.3Å; Y485-Y495 AromaticContact CD2-CG 3.51Å; Y485-Y495 HydrophobicContact CD2-CG 3.51Å; Y485-Y495 AromaticContact CE1-CD1 3.7Å; Y485-Y495 HydrophobicContact CE1-CD1 3.7Å; Y485-Y495 AromaticContact CE1-CE1 3.86Å; Y485-Y495 HydrophobicContact CE1-CE1 3.86Å; Y485-Y495 HydrophobicContact CE1-CG 4.15Å; Y485-Y495 HydrophobicContact CE2-CD1 4.01Å; Y485-Y495 HydrophobicContact CE2-CD2 4.31Å; Y485-Y495 AromaticContact CE2-CG 3.7Å; Y485-Y495 HydrophobicContact CE2-CG 3.7Å; Y485-Y495 AromaticContact CG-CD1 3.92Å; Y485-Y495 HydrophobicContact CG-CD1 3.92Å; Y485-Y495 AromaticContact CG-CD2 3.45Å; Y485-Y495 HydrophobicContact CG-CD2 3.45Å; Y485-Y495 VanDerWaalsContact CG-CD2 3.45Å; Y485-Y495 HydrophobicContact CG-CE1 4.09Å; Y485-Y495 AromaticContact CG-CE2 3.63Å; Y485-Y495 HydrophobicContact CG-CE2 3.63Å; Y485-Y495 AromaticContact CG-CG 3.6Å; Y485-Y495 HydrophobicContact CG-CG 3.6Å; Y485-Y495 AromaticContact CG-CZ 3.94Å; Y485-Y495 AromaticContact CZ-CD1 3.82Å; Y485-T556 HydrophobicContact CE1-CG2 3.91Å; Y485-T556 VanDerWaalsContact OH-CG2 3.23Å; Y485-T556 WeakPolarHBondContact OH-CG2 3.29Å; Y485-M559 HydrophobicContact CE1-SD 4.5Å
486	I	94.7	Very high	95.4	Very high	75 Å²	75	58.8 Å²	58.8	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-34.7	179.4	-68.8	170.6	0	0	0	110.9	R482 A483 M559	R482-I486 HydrophobicContact CG-CD1 3.79Å; R482-I486 HydrophobicContact CG-CG1 4.43Å; R482-I486 VanDerWaalsContact CZ-CD1 3.48Å; R482-I486 WeakPolarHBondContact O-CG1 3.41Å; R482-I486 PolarHBondContact O-N 2.96Å; A483-I486 PolarHBondContact O-N 3.09Å; I486-M559 HydrophobicContact CG1-CE 4.04Å
487	Q	95.5	Very high	95.4	Very high	172 Å²	172	57 Å²	57	80%	0.804	29%	0.293	S	S	*	.	H	α-helix	trans	-67.6	-42.3	177	-171.9	179.3	18.9	0	0	112.5	A483 A484 Y485	A483-Q487 PolarHBondContact O-N 3.43Å; A483-Q487 VanDerWaalsContact O-N 3.16Å; A484-Q487 WeakPolarHBondContact O-CB 3.3Å; A484-Q487 PolarHBondContact O-N 3.41Å; Y485-Q487 PolarHBondContact O-N 2.84Å
488	D	94.4	Very high	95.4	Very high	49 Å²	49	55.7 Å²	55.7	26%	0.262	29%	0.286	S	S	.	.			trans	-153.5	89.4	-177.6	-173.8	-3.6	0	0	0	111.9	A484 Y485 S490 K491 F492	A484-D488 PolarHBondContact O-N 3.37Å; A484-D488 VanDerWaalsContact O-N 3.15Å; Y485-D488 CarbonylContact O-C 3.56Å; Y485-D488 VanDerWaalsContact O-C 3.28Å; Y485-D488 PolarHBondContact O-N 3.47Å; D488-S490 PolarHBondContact O-N 3.14Å; D488-S490 VanDerWaalsContact O-N 3.15Å; D488-S490 PolarHBondContact OD1-N 3.49Å; D488-S490 PolarHBondContact OD1-OG 2.73Å; D488-K491 HydrophobicContact CB-CD 4.15Å; D488-K491 PolarHBondContact O-N 3Å; D488-K491 VanDerWaalsContact OD2-CD 3.31Å; D488-K491 WeakPolarHBondContact OD2-CD 3.13Å; D488-K491 WeakPolarHBondContact OD2-CE 3.38Å; D488-K491 IonicContact OD2-NZ 3.18Å; D488-K491 PolarHBondContact OD2-NZ 3.13Å; D488-F492 WeakPolarHBondContact O-CD2 3.33Å
489	R	92.4	Very high	95.3	Very high	76 Å²	76	55.7 Å²	55.7	29%	0.287	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-57.7	-30.2	-177.7	-65	177	63.6	-169.3	-4.8	113	Y485 K491 F492 D560	Y485-R489 HydrophobicContact CD1-CG 4.44Å; Y485-R489 HydrophobicContact CD2-CB 4.35Å; Y485-R489 HydrophobicContact CD2-CG 4.29Å; Y485-R489 HydrophobicContact CE1-CG 3.95Å; Y485-R489 HydrophobicContact CE2-CB 3.8Å; Y485-R489 HydrophobicContact CE2-CG 3.83Å; Y485-R489 WeakPolarHBondContact O-CA 3.34Å; Y485-R489 WeakPolarHBondContact O-CG 3.34Å; Y485-R489 PolarHBondContact O-N 2.92Å; Y485-R489 VanDerWaalsContact O-N 3.08Å; Y485-R489 PolarHBondContact OH-NE 3.31Å; R489-K491 PolarHBondContact O-N 2.88Å; R489-F492 PolarHBondContact O-N 3.4Å; R489-D560 IonicContact CZ-OD1 2.75Å; R489-D560 IonicContact CZ-OD2 3.93Å; R489-D560 IonicContact NH1-OD1 2.74Å; R489-D560 PolarHBondContact NH1-OD1 3.39Å; R489-D560 IonicContact NH2-OD1 2.82Å; R489-D560 PolarHBondContact NH2-OD1 2.94Å; R489-D560 IonicContact NH2-OD2 2.91Å; R489-D560 PolarHBondContact NH2-OD2 3.14Å
490	S	90.9	Very high	95.3	Very high	100 Å²	100	52 Å²	52	70%	0.699	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.3	-173.6	73.1	0	0	0	0	113.3	D488 F492	D488-S490 PolarHBondContact O-N 3.14Å; D488-S490 VanDerWaalsContact O-N 3.15Å; D488-S490 PolarHBondContact OD1-N 3.49Å; D488-S490 PolarHBondContact OD1-OG 2.73Å; S490-F492 VanDerWaalsContact C-N 3.34Å
491	K	90.5	Very high	95.4	Very high	136 Å²	136	45.9 Å²	45.9	59%	0.591	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-79.9	-12.3	179.2	-71.5	176.8	177.6	143.3	0	114.2	D488 R489	D488-K491 HydrophobicContact CB-CD 4.15Å; D488-K491 PolarHBondContact O-N 3Å; D488-K491 VanDerWaalsContact OD2-CD 3.31Å; D488-K491 WeakPolarHBondContact OD2-CD 3.13Å; D488-K491 WeakPolarHBondContact OD2-CE 3.38Å; D488-K491 IonicContact OD2-NZ 3.18Å; D488-K491 PolarHBondContact OD2-NZ 3.13Å; R489-K491 PolarHBondContact O-N 2.88Å
492	F	93.9	Very high	95.4	Very high	14 Å²	14	45.2 Å²	45.2	6%	0.061	24%	0.241	C	C	.	.			trans	-130.9	73.7	-172.5	-50.6	-89.6	0	0	0	110.2	Q413 Y481 A484 Y485 D488 R489 S490 C494 Y495	Q413-F492 HydrophobicContact CG-CD1 4.31Å; Q413-F492 HydrophobicContact CG-CE1 3.9Å; Y481-F492 HydrophobicContact CD2-CD1 4.22Å; Y481-F492 HydrophobicContact CD2-CE1 4.07Å; Y481-F492 AromaticContact CE2-CD1 3.42Å; Y481-F492 HydrophobicContact CE2-CD1 3.42Å; Y481-F492 VanDerWaalsContact CE2-CD1 3.42Å; Y481-F492 AromaticContact CE2-CE1 3.69Å; Y481-F492 HydrophobicContact CE2-CE1 3.69Å; Y481-F492 HydrophobicContact CE2-CG 4.41Å; A484-F492 HydrophobicContact CB-CE2 4.08Å; A484-F492 HydrophobicContact CB-CZ 3.64Å; A484-F492 WeakPolarHBondContact O-CE2 3.4Å; Y485-F492 HydrophobicContact CD2-CB 3.84Å; Y485-F492 HydrophobicContact CD2-CD2 4.07Å; Y485-F492 HydrophobicContact CD2-CG 4.27Å; Y485-F492 HydrophobicContact CE2-CB 4.4Å; D488-F492 WeakPolarHBondContact O-CD2 3.33Å; R489-F492 PolarHBondContact O-N 3.4Å; S490-F492 VanDerWaalsContact C-N 3.34Å; F492-C494 VanDerWaalsContact C-N 3.26Å; F492-C494 PolarHBondContact O-N 2.98Å; F492-Y495 WeakPolarHBondContact O-CB 3.36Å; F492-Y495 PolarHBondContact O-N 3.38Å
493	P	91.5	Very high	95.5	Very high	84 Å²	84	42.1 Å²	42.1	55%	0.545	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.2	-174.3	25.5	-35.2	0	0	0	113.4
494	C	94.6	Very high	95.6	Very high	16 Å²	16	39.5 Å²	39.5	11%	0.108	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	33.3	-178.8	-59.9	0	0	0	0	112.8	G417 F492 I496 E497 Y498	G417-C494 PolarHBondContact N-SG 3.5Å; F492-C494 VanDerWaalsContact C-N 3.26Å; F492-C494 PolarHBondContact O-N 2.98Å; C494-I496 PolarHBondContact O-N 2.96Å; C494-E497 WeakPolarHBondContact CA-OE2 3.4Å; C494-E497 HydrophobicContact CB-CB 4.44Å; C494-E497 PolarHBondContact O-N 2.88Å; C494-Y498 HydrophobicContact CB-CD2 4.05Å; C494-Y498 HydrophobicContact CB-CE2 4.07Å; C494-Y498 VanDerWaalsContact O-CD2 3.3Å; C494-Y498 WeakPolarHBondContact O-CD2 3Å; C494-Y498 PolarHBondContact O-N 3.44Å; C494-Y498 VanDerWaalsContact O-N 3.12Å
495	Y	96.2	Very high	95.6	Very high	3 Å²	3	38 Å²	38	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-57	-48.3	-173.8	171.8	-98.2	0	0	0	113.1	Y481 R482 Y485 F492 E497 Y498 I499 T556	Y481-Y495 AromaticContact CD1-CD2 3.87Å; Y481-Y495 HydrophobicContact CD1-CD2 3.87Å; Y481-Y495 AromaticContact CD1-CE2 3.62Å; Y481-Y495 HydrophobicContact CD1-CE2 3.62Å; Y481-Y495 AromaticContact CE1-CD2 3.23Å; Y481-Y495 HydrophobicContact CE1-CD2 3.23Å; Y481-Y495 AromaticContact CE1-CE2 3.49Å; Y481-Y495 HydrophobicContact CE1-CE2 3.49Å; Y481-Y495 VanDerWaalsContact CE1-CE2 3.49Å; Y481-Y495 HydrophobicContact CE1-CG 4.28Å; Y481-Y495 AromaticContact CZ-CD2 3.7Å; R482-Y495 WeakPolarHBondContact CB-OH 3.3Å; Y485-Y495 VanDerWaalsContact CB-CE2 3.44Å; Y485-Y495 AromaticContact CD1-CD1 3.74Å; Y485-Y495 HydrophobicContact CD1-CD1 3.74Å; Y485-Y495 HydrophobicContact CD1-CD2 4.04Å; Y485-Y495 AromaticContact CD1-CE1 3.64Å; Y485-Y495 HydrophobicContact CD1-CE1 3.64Å; Y485-Y495 AromaticContact CD1-CE2 3.95Å; Y485-Y495 HydrophobicContact CD1-CE2 3.95Å; Y485-Y495 AromaticContact CD1-CG 3.94Å; Y485-Y495 HydrophobicContact CD1-CG 3.94Å; Y485-Y495 AromaticContact CD1-CZ 3.74Å; Y485-Y495 HydrophobicContact CD2-CD1 4.08Å; Y485-Y495 AromaticContact CD2-CD2 3.64Å; Y485-Y495 HydrophobicContact CD2-CD2 3.64Å; Y485-Y495 HydrophobicContact CD2-CE2 4.3Å; Y485-Y495 AromaticContact CD2-CG 3.51Å; Y485-Y495 HydrophobicContact CD2-CG 3.51Å; Y485-Y495 AromaticContact CE1-CD1 3.7Å; Y485-Y495 HydrophobicContact CE1-CD1 3.7Å; Y485-Y495 AromaticContact CE1-CE1 3.86Å; Y485-Y495 HydrophobicContact CE1-CE1 3.86Å; Y485-Y495 HydrophobicContact CE1-CG 4.15Å; Y485-Y495 HydrophobicContact CE2-CD1 4.01Å; Y485-Y495 HydrophobicContact CE2-CD2 4.31Å; Y485-Y495 AromaticContact CE2-CG 3.7Å; Y485-Y495 HydrophobicContact CE2-CG 3.7Å; Y485-Y495 AromaticContact CG-CD1 3.92Å; Y485-Y495 HydrophobicContact CG-CD1 3.92Å; Y485-Y495 AromaticContact CG-CD2 3.45Å; Y485-Y495 HydrophobicContact CG-CD2 3.45Å; Y485-Y495 VanDerWaalsContact CG-CD2 3.45Å; Y485-Y495 HydrophobicContact CG-CE1 4.09Å; Y485-Y495 AromaticContact CG-CE2 3.63Å; Y485-Y495 HydrophobicContact CG-CE2 3.63Å; Y485-Y495 AromaticContact CG-CG 3.6Å; Y485-Y495 HydrophobicContact CG-CG 3.6Å; Y485-Y495 AromaticContact CG-CZ 3.94Å; Y485-Y495 AromaticContact CZ-CD1 3.82Å; F492-Y495 WeakPolarHBondContact O-CB 3.36Å; F492-Y495 PolarHBondContact O-N 3.38Å; Y495-E497 VanDerWaalsContact C-N 3.35Å; Y495-E497 PolarHBondContact O-N 3.41Å; Y495-Y498 PolarHBondContact O-N 3.31Å; Y495-I499 HydrophobicContact CD1-CG1 4.28Å; Y495-I499 HydrophobicContact CD2-CG1 4.27Å; Y495-I499 HydrophobicContact CE1-CG1 3.82Å; Y495-I499 HydrophobicContact CE2-CD1 4.02Å; Y495-I499 HydrophobicContact CE2-CG1 3.81Å; Y495-I499 HydrophobicContact CG-CG1 4.49Å; Y495-I499 WeakPolarHBondContact O-CG1 3.41Å; Y495-I499 PolarHBondContact O-N 3.12Å; Y495-T556 VanDerWaalsContact CE1-OG1 3.32Å; Y495-T556 WeakPolarHBondContact CE1-OG1 3.17Å
496	I	96.3	Very high	95.7	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.051	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-44.7	-176.7	-66.6	-175.1	0	0	0	109.7	C494 Y498 I499 L500 A553 T556 V557 Y591 T594 L595	C494-I496 PolarHBondContact O-N 2.96Å; I496-Y498 VanDerWaalsContact C-N 3.32Å; I496-Y498 PolarHBondContact O-N 3.42Å; I496-I499 PolarHBondContact O-N 3.41Å; I496-I499 VanDerWaalsContact O-N 3.14Å; I496-L500 HydrophobicContact CG2-CD1 3.87Å; I496-L500 HydrophobicContact CG2-CG 4.11Å; I496-L500 VanDerWaalsContact O-CG 3.29Å; I496-L500 WeakPolarHBondContact O-CG 3.24Å; I496-L500 PolarHBondContact O-N 3.48Å; I496-A553 HydrophobicContact CG2-CB 4.14Å; I496-T556 HydrophobicContact CD1-CG2 3.71Å; I496-T556 HydrophobicContact CG1-CG2 3.92Å; I496-V557 HydrophobicContact CD1-CG2 4.43Å; I496-Y591 HydrophobicContact CD1-CD1 3.65Å; I496-Y591 HydrophobicContact CD1-CE1 3.3Å; I496-T594 HydrophobicContact CB-CG2 4.46Å; I496-T594 HydrophobicContact CG2-CG2 3.88Å; I496-L595 HydrophobicContact CG2-CD2 4.03Å
497	E	97.3	Very high	95.8	Very high	37 Å²	37	34.2 Å²	34.2	17%	0.173	18%	0.177	C	C	.	.	H	α-helix	trans	-57.6	-46.1	-179.7	-60.9	83.2	158.9	0	0	111	P418 Y426 C494 Y495 L500 A501 T594	P418-E497 VanDerWaalsContact CD-CB 3.44Å; P418-E497 HydrophobicContact CG-CB 3.75Å; Y426-E497 HydrophobicContact CD2-CB 4.31Å; Y426-E497 HydrophobicContact CE1-CB 4.39Å; Y426-E497 HydrophobicContact CE1-CG 4.25Å; Y426-E497 HydrophobicContact CE2-CB 4.03Å; Y426-E497 HydrophobicContact CE2-CG 3.87Å; C494-E497 WeakPolarHBondContact CA-OE2 3.4Å; C494-E497 HydrophobicContact CB-CB 4.44Å; C494-E497 PolarHBondContact O-N 2.88Å; Y495-E497 VanDerWaalsContact C-N 3.35Å; Y495-E497 PolarHBondContact O-N 3.41Å; E497-L500 PolarHBondContact O-N 3.5Å; E497-A501 VanDerWaalsContact O-CB 3.3Å; E497-A501 WeakPolarHBondContact O-CB 3.44Å; E497-A501 PolarHBondContact O-N 3.32Å; E497-T594 HydrophobicContact CG-CG2 3.73Å
498	Y	97.6	Very high	95.9	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-37.6	176.1	-80.7	-73.1	0	0	0	112.7	D411 W412 T416 P418 T428 C494 Y495 I496 L500 A501 N502	D411-Y498 VanDerWaalsContact O-CZ 3.28Å; D411-Y498 PolarHBondContact O-OH 3.42Å; W412-Y498 HydrophobicContact CB-CD1 4.3Å; W412-Y498 HydrophobicContact CB-CG 4.22Å; W412-Y498 AromaticContact CD1-CD1 3.71Å; W412-Y498 HydrophobicContact CG-CD1 4.28Å; T416-Y498 PolarHBondContact O-OH 3.14Å; P418-Y498 HydrophobicContact CB-CD1 4.41Å; P418-Y498 HydrophobicContact CB-CE1 4.13Å; P418-Y498 HydrophobicContact CG-CD1 4.33Å; P418-Y498 HydrophobicContact CG-CE1 4.4Å; P418-Y498 HydrophobicContact CG-CG 4.49Å; T428-Y498 HydrophobicContact CG2-CD1 4.33Å; C494-Y498 HydrophobicContact CB-CD2 4.05Å; C494-Y498 HydrophobicContact CB-CE2 4.07Å; C494-Y498 VanDerWaalsContact O-CD2 3.3Å; C494-Y498 WeakPolarHBondContact O-CD2 3Å; C494-Y498 PolarHBondContact O-N 3.44Å; C494-Y498 VanDerWaalsContact O-N 3.12Å; Y495-Y498 PolarHBondContact O-N 3.31Å; I496-Y498 VanDerWaalsContact C-N 3.32Å; I496-Y498 PolarHBondContact O-N 3.42Å; Y498-L500 VanDerWaalsContact C-N 3.32Å; Y498-L500 PolarHBondContact O-N 2.94Å; Y498-A501 PolarHBondContact O-N 3.06Å; Y498-N502 WeakPolarHBondContact O-CB 3.49Å; Y498-N502 PolarHBondContact O-N 3.44Å; Y498-N502 PolarHBondContact O-ND2 3.21Å
499	I	98	Very high	96.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.1	-45.4	173.2	-72.8	-65.8	0	0	0	110.8	I478 Y481 Y495 I496 N502 A503 W549 Y552 A553	I478-I499 HydrophobicContact CG2-CD1 3.98Å; Y481-I499 HydrophobicContact CD1-CD1 3.95Å; Y481-I499 HydrophobicContact CD1-CG1 4.49Å; Y481-I499 HydrophobicContact CE1-CD1 4.26Å; Y481-I499 HydrophobicContact CE1-CG1 4.32Å; Y495-I499 HydrophobicContact CD1-CG1 4.28Å; Y495-I499 HydrophobicContact CD2-CG1 4.27Å; Y495-I499 HydrophobicContact CE1-CG1 3.82Å; Y495-I499 HydrophobicContact CE2-CD1 4.02Å; Y495-I499 HydrophobicContact CE2-CG1 3.81Å; Y495-I499 HydrophobicContact CG-CG1 4.49Å; Y495-I499 WeakPolarHBondContact O-CG1 3.41Å; Y495-I499 PolarHBondContact O-N 3.12Å; I496-I499 PolarHBondContact O-N 3.41Å; I496-I499 VanDerWaalsContact O-N 3.14Å; I499-N502 PolarHBondContact O-N 2.89Å; I499-A503 WeakPolarHBondContact O-CB 3.41Å; I499-A503 PolarHBondContact O-N 3.39Å; I499-W549 HydrophobicContact CG2-CB 4.35Å; I499-W549 WeakPolarHBondContact CG2-O 2.89Å; I499-Y552 HydrophobicContact CD1-CD2 4.5Å; I499-A553 HydrophobicContact CG2-CB 4.32Å
500	L	98.4	Very high	96.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.5	-41	177.9	-63.2	-179.7	0	0	0	111.8	Y426 I496 E497 Y498 N502 A503 N504 I550 A553 T594 L595 L606	Y426-L500 HydrophobicContact CD2-CB 4.18Å; Y426-L500 HydrophobicContact CD2-CD1 4.36Å; Y426-L500 HydrophobicContact CE2-CD1 4.48Å; I496-L500 HydrophobicContact CG2-CD1 3.87Å; I496-L500 HydrophobicContact CG2-CG 4.11Å; I496-L500 VanDerWaalsContact O-CG 3.29Å; I496-L500 WeakPolarHBondContact O-CG 3.24Å; I496-L500 PolarHBondContact O-N 3.48Å; E497-L500 PolarHBondContact O-N 3.5Å; Y498-L500 VanDerWaalsContact C-N 3.32Å; Y498-L500 PolarHBondContact O-N 2.94Å; L500-N502 VanDerWaalsContact C-N 3.33Å; L500-N502 PolarHBondContact O-N 2.9Å; L500-A503 PolarHBondContact O-N 3.09Å; L500-N504 WeakPolarHBondContact O-CB 3.22Å; L500-N504 PolarHBondContact O-N 2.88Å; L500-N504 PolarHBondContact O-ND2 3.26Å; L500-I550 HydrophobicContact CD2-CG2 4.16Å; L500-A553 HydrophobicContact CD2-CB 4.01Å; L500-T594 HydrophobicContact CD1-CG2 4.35Å; L500-L595 HydrophobicContact CD1-CD2 4.11Å; L500-L606 HydrophobicContact CD2-CD2 4.33Å
501	A	97.9	Very high	96.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-44.1	176.1	0	0	0	0	0	111.8	P418 T428 E497 Y498 N504 G505	P418-A501 HydrophobicContact CB-CB 4Å; P418-A501 HydrophobicContact CG-CB 3.86Å; T428-A501 HydrophobicContact CG2-CB 3.7Å; E497-A501 VanDerWaalsContact O-CB 3.3Å; E497-A501 WeakPolarHBondContact O-CB 3.44Å; E497-A501 PolarHBondContact O-N 3.32Å; Y498-A501 PolarHBondContact O-N 3.06Å; A501-N504 PolarHBondContact O-N 3.02Å; A501-G505 PolarHBondContact O-N 3.02Å
502	N	98.1	Very high	96.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.8	-41.3	177.3	-78.3	-75.8	0	0	0	111.5	W412 Y474 I478 Y498 I499 L500 N504 G505 A506 W549	W412-N502 VanDerWaalsContact CZ2-OD1 3.24Å; W412-N502 WeakPolarHBondContact CZ2-OD1 3.19Å; W412-N502 PolarHBondContact NE1-ND2 3.34Å; W412-N502 PolarHBondContact NE1-OD1 3.29Å; Y474-N502 HydrophobicContact CE2-CB 4.31Å; Y474-N502 VanDerWaalsContact CE2-OD1 3.28Å; Y474-N502 WeakPolarHBondContact CE2-OD1 3.33Å; Y474-N502 VanDerWaalsContact CZ-OD1 3.31Å; Y474-N502 VanDerWaalsContact OH-CA 3.32Å; Y474-N502 WeakPolarHBondContact OH-CA 3.36Å; Y474-N502 VanDerWaalsContact OH-CB 3.25Å; Y474-N502 WeakPolarHBondContact OH-CB 3.41Å; Y474-N502 VanDerWaalsContact OH-CG 3.25Å; Y474-N502 PolarHBondContact OH-O 3.05Å; Y474-N502 PolarHBondContact OH-OD1 3.39Å; I478-N502 HydrophobicContact CD1-CB 3.7Å; Y498-N502 WeakPolarHBondContact O-CB 3.49Å; Y498-N502 PolarHBondContact O-N 3.44Å; Y498-N502 PolarHBondContact O-ND2 3.21Å; I499-N502 PolarHBondContact O-N 2.89Å; L500-N502 VanDerWaalsContact C-N 3.33Å; L500-N502 PolarHBondContact O-N 2.9Å; N502-N504 PolarHBondContact O-N 2.85Å; N502-G505 CarbonylContact O-C 3.42Å; N502-G505 WeakPolarHBondContact O-CA 3.46Å; N502-G505 PolarHBondContact O-N 2.91Å; N502-G505 VanDerWaalsContact O-N 3.11Å; N502-A506 PolarHBondContact O-N 3.49Å; N502-W549 HydrophobicContact CB-CE3 4.25Å; N502-W549 HydrophobicContact CB-CZ3 4.24Å; N502-W549 WeakPolarHBondContact O-CZ3 3.29Å
503	A	98.5	Very high	96.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-42.1	175.2	0	0	0	0	0	112.4	I499 L500 G505 C507 A546 W549 I550 L602	I499-A503 WeakPolarHBondContact O-CB 3.41Å; I499-A503 PolarHBondContact O-N 3.39Å; L500-A503 PolarHBondContact O-N 3.09Å; A503-G505 VanDerWaalsContact C-N 3.33Å; A503-C507 PolarHBondContact O-N 3.27Å; A503-C507 PolarHBondContact O-SG 2.55Å; A503-C507 VanDerWaalsContact O-SG 3.42Å; A503-A546 HydrophobicContact CB-CB 4.27Å; A503-W549 HydrophobicContact CB-CB 4.32Å; A503-W549 HydrophobicContact CB-CE3 4.25Å; A503-I550 HydrophobicContact CB-CG2 4.03Å; A503-L602 HydrophobicContact CB-CD1 4.06Å
504	N	98.1	Very high	97.1	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.011	8%	0.083	C	C	.	.	H	α-helix	trans	-60	-46.4	170.8	-68	-20.6	0	0	0	110.5	Y426 L500 A501 N502 C507 M508 H597 T598 R599	Y426-N504 WeakPolarHBondContact O-CB 3.36Å; Y426-N504 PolarHBondContact O-ND2 2.85Å; L500-N504 WeakPolarHBondContact O-CB 3.22Å; L500-N504 PolarHBondContact O-N 2.88Å; L500-N504 PolarHBondContact O-ND2 3.26Å; A501-N504 PolarHBondContact O-N 3.02Å; N502-N504 PolarHBondContact O-N 2.85Å; N504-C507 WeakPolarHBondContact O-CB 3.28Å; N504-C507 PolarHBondContact O-N 3.49Å; N504-M508 WeakPolarHBondContact O-CG 3.32Å; N504-M508 PolarHBondContact O-N 3.44Å; N504-H597 PolarHBondContact ND2-O 3.17Å; N504-H597 VanDerWaalsContact ND2-O 3.11Å; N504-T598 WeakPolarHBondContact OD1-CA 3.4Å; N504-T598 PolarHBondContact OD1-OG1 3.11Å; N504-R599 HydrophobicContact CB-CG 4.34Å; N504-R599 PolarHBondContact OD1-N 3.41Å
505	G	97.2	Very high	97.1	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-56.5	-48.3	178.6	0	0	0	0	0	113.5	A501 N502 A503 C507 M508 I509	A501-G505 PolarHBondContact O-N 3.02Å; N502-G505 CarbonylContact O-C 3.42Å; N502-G505 WeakPolarHBondContact O-CA 3.46Å; N502-G505 PolarHBondContact O-N 2.91Å; N502-G505 VanDerWaalsContact O-N 3.11Å; A503-G505 VanDerWaalsContact C-N 3.33Å; G505-C507 VanDerWaalsContact C-N 3.32Å; G505-C507 PolarHBondContact O-N 3.33Å; G505-M508 WeakPolarHBondContact O-CA 3.24Å; G505-M508 WeakPolarHBondContact O-CB 3.25Å; G505-M508 PolarHBondContact O-N 3.23Å; G505-I509 WeakPolarHBondContact O-CG1 3.46Å; G505-I509 PolarHBondContact O-N 3.14Å
506	A	98.2	Very high	96.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-57.6	-44.7	175.5	0	0	0	0	0	111.9	Y474 N502 M508 I509 A510 Y542 A546 W549	Y474-A506 HydrophobicContact CE1-CB 4.43Å; N502-A506 PolarHBondContact O-N 3.49Å; A506-M508 VanDerWaalsContact C-N 3.32Å; A506-M508 PolarHBondContact O-N 2.85Å; A506-I509 PolarHBondContact O-N 2.88Å; A506-A510 WeakPolarHBondContact O-CB 3.27Å; A506-A510 PolarHBondContact O-N 3.39Å; A506-Y542 HydrophobicContact CB-CD1 4.07Å; A506-Y542 WeakPolarHBondContact O-CD1 3.5Å; A506-A546 HydrophobicContact CB-CB 4.3Å; A506-W549 HydrophobicContact CB-CH2 4.01Å; A506-W549 HydrophobicContact CB-CZ3 3.61Å
507	C	97.3	Very high	96.7	Very high	10 Å²	10	19.3 Å²	19.3	7%	0.068	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-36	174.8	-65.1	0	0	0	0	112.5	A503 N504 G505 H511 R599	A503-C507 PolarHBondContact O-N 3.27Å; A503-C507 PolarHBondContact O-SG 2.55Å; A503-C507 VanDerWaalsContact O-SG 3.42Å; N504-C507 WeakPolarHBondContact O-CB 3.28Å; N504-C507 PolarHBondContact O-N 3.49Å; G505-C507 VanDerWaalsContact C-N 3.32Å; G505-C507 PolarHBondContact O-N 3.33Å; C507-H511 WeakPolarHBondContact O-CB 3.41Å; C507-H511 PolarHBondContact O-N 3.41Å; C507-H511 VanDerWaalsContact O-N 3.14Å; C507-R599 VanDerWaalsContact CB-NH1 3.25Å; C507-R599 PolarHBondContact O-NH1 3.01Å
508	M	96.3	Very high	96.4	Very high	55 Å²	55	19.5 Å²	19.5	27%	0.271	11%	0.108	S	C	.	.	H	α-helix	trans	-64.3	-49.5	175.9	-54	-114.3	-26.8	0	0	110.6	P431 N504 G505 A506 A510 H511 S512 R599	P431-M508 HydrophobicContact CB-CB 3.97Å; P431-M508 HydrophobicContact CG-CB 4.1Å; P431-M508 HydrophobicContact CG-CG 4.36Å; N504-M508 WeakPolarHBondContact O-CG 3.32Å; N504-M508 PolarHBondContact O-N 3.44Å; G505-M508 WeakPolarHBondContact O-CA 3.24Å; G505-M508 WeakPolarHBondContact O-CB 3.25Å; G505-M508 PolarHBondContact O-N 3.23Å; A506-M508 VanDerWaalsContact C-N 3.32Å; A506-M508 PolarHBondContact O-N 2.85Å; M508-A510 PolarHBondContact O-N 3.32Å; M508-H511 PolarHBondContact O-N 2.96Å; M508-S512 WeakPolarHBondContact O-CB 3.45Å; M508-S512 PolarHBondContact O-N 2.91Å; M508-S512 PolarHBondContact O-OG 2.81Å; M508-S512 VanDerWaalsContact O-OG 3.09Å; M508-R599 PolarHBondContact SD-NH2 3.05Å
509	I	98.2	Very high	96.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.5	-50.8	-179.2	-69.6	165.6	0	0	0	109.6	L430 P431 V434 M467 F470 G505 A506 H511 S512 F513 Y542	L430-I509 HydrophobicContact CG-CD1 4.47Å; P431-I509 HydrophobicContact CB-CG1 3.84Å; P431-I509 HydrophobicContact CG-CD1 4.41Å; P431-I509 HydrophobicContact CG-CG1 4.16Å; V434-I509 HydrophobicContact CB-CD1 4.35Å; V434-I509 HydrophobicContact CB-CG1 4.43Å; V434-I509 HydrophobicContact CG1-CD1 4.43Å; V434-I509 HydrophobicContact CG1-CG1 4.35Å; V434-I509 HydrophobicContact CG1-CG2 3.94Å; V434-I509 HydrophobicContact CG2-CD1 4.16Å; M467-I509 HydrophobicContact CE-CG2 3.49Å; M467-I509 VanDerWaalsContact CE-CG2 3.49Å; F470-I509 HydrophobicContact CE1-CD1 4.32Å; G505-I509 WeakPolarHBondContact O-CG1 3.46Å; G505-I509 PolarHBondContact O-N 3.14Å; A506-I509 PolarHBondContact O-N 2.88Å; I509-H511 PolarHBondContact O-N 3.25Å; I509-S512 PolarHBondContact O-N 3.28Å; I509-F513 WeakPolarHBondContact O-CB 3.5Å; I509-F513 PolarHBondContact O-N 3.46Å; I509-Y542 HydrophobicContact CB-CD1 4.39Å; I509-Y542 HydrophobicContact CB-CE1 4.01Å; I509-Y542 HydrophobicContact CG2-CD1 4.31Å; I509-Y542 HydrophobicContact CG2-CE1 3.56Å
510	A	97.5	Very high	95.6	Very high	5 Å²	5	27.3 Å²	27.3	4%	0.041	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-48.3	179.3	0	0	0	0	0	112.3	A506 M508 V514 K539 Y542	A506-A510 WeakPolarHBondContact O-CB 3.27Å; A506-A510 PolarHBondContact O-N 3.39Å; M508-A510 PolarHBondContact O-N 3.32Å; A510-V514 WeakPolarHBondContact O-CB 3.27Å; A510-V514 WeakPolarHBondContact O-CG2 3.08Å; A510-V514 PolarHBondContact O-N 2.93Å; A510-K539 HydrophobicContact CB-CG 4.36Å; A510-Y542 HydrophobicContact CB-CD1 4.32Å; A510-Y542 HydrophobicContact CB-CD2 4.47Å; A510-Y542 HydrophobicContact CB-CG 3.89Å
511	H	95.9	Very high	95.2	Very high	109 Å²	109	27.3 Å²	27.3	51%	0.505	15%	0.148	S	C	.	.	H	α-helix	trans	-64.8	-49.6	-179.7	-179.4	69.9	0	0	0	112.1	C507 M508 I509 F513 V514 T515	C507-H511 WeakPolarHBondContact O-CB 3.41Å; C507-H511 PolarHBondContact O-N 3.41Å; C507-H511 VanDerWaalsContact O-N 3.14Å; M508-H511 PolarHBondContact O-N 2.96Å; I509-H511 PolarHBondContact O-N 3.25Å; H511-F513 PolarHBondContact O-N 2.94Å; H511-V514 PolarHBondContact O-N 3.17Å; H511-T515 WeakPolarHBondContact O-CB 3.45Å; H511-T515 PolarHBondContact O-N 2.67Å; H511-T515 PolarHBondContact O-OG1 3.46Å
512	S	96.1	Very high	94.8	Very high	40 Å²	40	29.9 Å²	29.9	28%	0.28	17%	0.17	S	C	.	.	H	α-helix	trans	-63	-43.1	-179	-64.1	0	0	0	0	111.8	M508 I509 T515 V516	M508-S512 WeakPolarHBondContact O-CB 3.45Å; M508-S512 PolarHBondContact O-N 2.91Å; M508-S512 PolarHBondContact O-OG 2.81Å; M508-S512 VanDerWaalsContact O-OG 3.09Å; I509-S512 PolarHBondContact O-N 3.28Å; S512-T515 PolarHBondContact O-N 3.28Å; S512-V516 WeakPolarHBondContact O-CG2 3.37Å; S512-V516 PolarHBondContact O-N 2.56Å
513	F	96.4	Very high	94.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-47.9	177.2	-177.8	-100.7	0	0	0	111.9	M435 I438 V464 M467 I509 H511 T515 V516 I517 L538	M435-F513 HydrophobicContact CE-CB 4.46Å; M435-F513 HydrophobicContact SD-CB 4.05Å; I438-F513 HydrophobicContact CD1-CD2 3.82Å; I438-F513 HydrophobicContact CD1-CE2 4.07Å; I438-F513 HydrophobicContact CG2-CD2 4.22Å; I438-F513 HydrophobicContact CG2-CE2 4.24Å; V464-F513 HydrophobicContact CG2-CE1 3.96Å; V464-F513 HydrophobicContact CG2-CZ 3.98Å; M467-F513 HydrophobicContact CB-CZ 4.38Å; M467-F513 HydrophobicContact CE-CD2 4.5Å; M467-F513 HydrophobicContact CG-CD2 3.97Å; M467-F513 HydrophobicContact CG-CE1 4.3Å; M467-F513 HydrophobicContact CG-CE2 3.59Å; M467-F513 HydrophobicContact CG-CG 4.47Å; M467-F513 HydrophobicContact CG-CZ 3.77Å; I509-F513 WeakPolarHBondContact O-CB 3.5Å; I509-F513 PolarHBondContact O-N 3.46Å; H511-F513 PolarHBondContact O-N 2.94Å; F513-T515 VanDerWaalsContact C-N 3.31Å; F513-T515 PolarHBondContact O-N 3.34Å; F513-V516 PolarHBondContact O-N 3.46Å; F513-I517 HydrophobicContact CD1-CG1 4.28Å; F513-I517 HydrophobicContact CD2-CG1 4.14Å; F513-I517 HydrophobicContact CE1-CG1 3.95Å; F513-I517 HydrophobicContact CE2-CD1 4Å; F513-I517 HydrophobicContact CE2-CG1 3.79Å; F513-I517 HydrophobicContact CG-CG1 4.38Å; F513-I517 HydrophobicContact CZ-CD1 4.06Å; F513-I517 HydrophobicContact CZ-CG1 3.7Å; F513-I517 WeakPolarHBondContact O-CB 3.46Å; F513-I517 VanDerWaalsContact O-CG1 3.25Å; F513-I517 WeakPolarHBondContact O-CG1 3.11Å; F513-I517 PolarHBondContact O-N 3.18Å; F513-L538 HydrophobicContact CD1-CD2 3.65Å; F513-L538 HydrophobicContact CE1-CD2 3.42Å; F513-L538 VanDerWaalsContact CE1-CD2 3.42Å; F513-L538 HydrophobicContact CZ-CD2 4.36Å
514	V	95.3	Very high	93.6	Very high	28 Å²	28	40.5 Å²	40.5	17%	0.17	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-45.3	177	172.3	0	0	0	0	110.6	A510 H511 M518 I535 K539	A510-V514 WeakPolarHBondContact O-CB 3.27Å; A510-V514 WeakPolarHBondContact O-CG2 3.08Å; A510-V514 PolarHBondContact O-N 2.93Å; H511-V514 PolarHBondContact O-N 3.17Å; V514-M518 HydrophobicContact CG1-CG 4.09Å; V514-M518 WeakPolarHBondContact O-CB 3.23Å; V514-M518 WeakPolarHBondContact O-CG 3.09Å; V514-M518 PolarHBondContact O-N 3.49Å; V514-I535 HydrophobicContact CB-CG2 4.15Å; V514-I535 HydrophobicContact CG1-CG2 4.02Å; V514-I535 HydrophobicContact CG2-CG2 3.63Å; V514-K539 HydrophobicContact CG2-CB 4Å; V514-K539 HydrophobicContact CG2-CD 4.29Å; V514-K539 HydrophobicContact CG2-CG 4.35Å
515	T	94.1	Very high	93.2	Very high	75 Å²	75	45.4 Å²	45.4	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-50.4	-179.8	-62.5	0	0	0	0	111.6	H511 S512 F513 I517 M518 D519	H511-T515 WeakPolarHBondContact O-CB 3.45Å; H511-T515 PolarHBondContact O-N 2.67Å; H511-T515 PolarHBondContact O-OG1 3.46Å; S512-T515 PolarHBondContact O-N 3.28Å; F513-T515 VanDerWaalsContact C-N 3.31Å; F513-T515 PolarHBondContact O-N 3.34Å; T515-I517 PolarHBondContact O-N 3.48Å; T515-M518 PolarHBondContact O-N 3.47Å; T515-D519 WeakPolarHBondContact O-CB 3.44Å; T515-D519 PolarHBondContact O-N 3.1Å
516	V	92.5	Very high	92.8	Very high	32 Å²	32	50.9 Å²	50.9	19%	0.194	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-47.8	-179.3	170.2	0	0	0	0	111.4	M435 N439 I442 S512 F513 D519 E520	M435-V516 HydrophobicContact CE-CB 4.35Å; M435-V516 HydrophobicContact CE-CG2 3.92Å; N439-V516 WeakPolarHBondContact OD1-CG2 3.43Å; I442-V516 HydrophobicContact CD1-CG1 3.68Å; S512-V516 WeakPolarHBondContact O-CG2 3.37Å; S512-V516 PolarHBondContact O-N 2.56Å; F513-V516 PolarHBondContact O-N 3.46Å; V516-D519 PolarHBondContact O-N 3.28Å; V516-E520 WeakPolarHBondContact O-CG 3.48Å; V516-E520 PolarHBondContact O-N 3.02Å
517	I	92.1	Very high	92.3	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-68.8	-39.6	-178	-60.3	-70.2	0	0	0	111.2	I442 F460 F513 T515 D519 E520 L521 I535	I442-I517 HydrophobicContact CD1-CD1 3.64Å; F460-I517 HydrophobicContact CD1-CD1 3.65Å; F460-I517 HydrophobicContact CE1-CD1 3.86Å; F513-I517 HydrophobicContact CD1-CG1 4.28Å; F513-I517 HydrophobicContact CD2-CG1 4.14Å; F513-I517 HydrophobicContact CE1-CG1 3.95Å; F513-I517 HydrophobicContact CE2-CD1 4Å; F513-I517 HydrophobicContact CE2-CG1 3.79Å; F513-I517 HydrophobicContact CG-CG1 4.38Å; F513-I517 HydrophobicContact CZ-CD1 4.06Å; F513-I517 HydrophobicContact CZ-CG1 3.7Å; F513-I517 WeakPolarHBondContact O-CB 3.46Å; F513-I517 VanDerWaalsContact O-CG1 3.25Å; F513-I517 WeakPolarHBondContact O-CG1 3.11Å; F513-I517 PolarHBondContact O-N 3.18Å; T515-I517 PolarHBondContact O-N 3.48Å; I517-D519 VanDerWaalsContact C-N 3.34Å; I517-D519 PolarHBondContact O-N 3.42Å; I517-E520 PolarHBondContact O-N 3.36Å; I517-L521 HydrophobicContact CG2-CD1 3.73Å; I517-L521 HydrophobicContact CG2-CG 4.34Å; I517-L521 WeakPolarHBondContact O-CB 3.42Å; I517-L521 WeakPolarHBondContact O-CG 3.49Å; I517-L521 PolarHBondContact O-N 2.91Å; I517-L521 VanDerWaalsContact O-N 3.14Å; I517-I535 HydrophobicContact CB-CD1 4.4Å; I517-I535 HydrophobicContact CG2-CD1 3.53Å; I517-I535 HydrophobicContact CG2-CG1 4.42Å
518	M	91.1	Very high	92	Very high	42 Å²	42	54.5 Å²	54.5	21%	0.207	30%	0.295	C	S	.	.	H	α-helix	trans	-69.6	-31.4	179.6	-71.9	-64.7	-178.5	0	0	113.1	V514 T515 L521 A522 T532 I535	V514-M518 HydrophobicContact CG1-CG 4.09Å; V514-M518 WeakPolarHBondContact O-CB 3.23Å; V514-M518 WeakPolarHBondContact O-CG 3.09Å; V514-M518 PolarHBondContact O-N 3.49Å; T515-M518 PolarHBondContact O-N 3.47Å; M518-L521 PolarHBondContact O-N 3.47Å; M518-A522 PolarHBondContact O-N 3.46Å; M518-A522 VanDerWaalsContact O-N 3.16Å; M518-T532 HydrophobicContact CE-CG2 4.34Å; M518-I535 HydrophobicContact CE-CB 3.91Å; M518-I535 HydrophobicContact CE-CD1 3.68Å; M518-I535 HydrophobicContact CE-CG1 4.42Å; M518-I535 HydrophobicContact CE-CG2 3.76Å; M518-I535 HydrophobicContact SD-CD1 4.29Å
519	D	90.7	Very high	91.7	Very high	121 Å²	121	54.4 Å²	54.4	65%	0.647	31%	0.307	S	S	*	.	H	α-helix	trans	-65.6	-48.2	173.9	-167.9	58.6	0	0	0	110.8	T515 V516 I517 L521 A522	T515-D519 WeakPolarHBondContact O-CB 3.44Å; T515-D519 PolarHBondContact O-N 3.1Å; V516-D519 PolarHBondContact O-N 3.28Å; I517-D519 VanDerWaalsContact C-N 3.34Å; I517-D519 PolarHBondContact O-N 3.42Å; D519-L521 PolarHBondContact O-N 2.99Å; D519-A522 WeakPolarHBondContact O-CB 3.32Å; D519-A522 PolarHBondContact O-N 3.11Å
520	E	89	Confident	91.2	Very high	51 Å²	51	58 Å²	58	24%	0.238	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-25.4	176.1	-72.8	-68.3	151.8	0	0	114.3	I442 H449 R456 F460 V516 I517	I442-E520 HydrophobicContact CG2-CG 3.4Å; I442-E520 WeakPolarHBondContact CG2-OE1 3.43Å; H449-E520 IonicContact CE1-OE2 2.91Å; R456-E520 PolarHBondContact NH2-O 3.41Å; F460-E520 HydrophobicContact CE1-CB 4.43Å; F460-E520 HydrophobicContact CZ-CB 3.94Å; F460-E520 HydrophobicContact CZ-CG 4.46Å; V516-E520 WeakPolarHBondContact O-CG 3.48Å; V516-E520 PolarHBondContact O-N 3.02Å; I517-E520 PolarHBondContact O-N 3.36Å
521	L	89.4	Confident	90.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	4.3	178.9	-62	178.2	0	0	0	112.8	F460 I517 M518 D519 E523 D524 L527 K528 L531 I535	F460-L521 HydrophobicContact CD2-CD2 3.85Å; F460-L521 HydrophobicContact CE2-CD2 3.87Å; I517-L521 HydrophobicContact CG2-CD1 3.73Å; I517-L521 HydrophobicContact CG2-CG 4.34Å; I517-L521 WeakPolarHBondContact O-CB 3.42Å; I517-L521 WeakPolarHBondContact O-CG 3.49Å; I517-L521 PolarHBondContact O-N 2.91Å; I517-L521 VanDerWaalsContact O-N 3.14Å; M518-L521 PolarHBondContact O-N 3.47Å; D519-L521 PolarHBondContact O-N 2.99Å; L521-E523 VanDerWaalsContact C-N 3.31Å; L521-E523 PolarHBondContact O-N 3.29Å; L521-D524 PolarHBondContact O-N 2.84Å; L521-L527 HydrophobicContact CD2-CB 3.77Å; L521-L527 HydrophobicContact CD2-CD1 4.25Å; L521-K528 HydrophobicContact CB-CB 4.23Å; L521-L531 HydrophobicContact CD1-CB 4.2Å; L521-L531 HydrophobicContact CD1-CD1 3.74Å; L521-I535 HydrophobicContact CD1-CD1 4.34Å
522	A	88.6	Confident	90.9	Very high	55 Å²	55	55.2 Å²	55.2	46%	0.455	32%	0.316	S	S	.	.	S	Bend	trans	-59.1	-41.1	-172.7	0	0	0	0	0	112.8	M518 D519	M518-A522 PolarHBondContact O-N 3.46Å; M518-A522 VanDerWaalsContact O-N 3.16Å; D519-A522 WeakPolarHBondContact O-CB 3.32Å; D519-A522 PolarHBondContact O-N 3.11Å
523	E	85.2	Confident	90.8	Very high	195 Å²	195	56.9 Å²	56.9	91%	0.911	33%	0.333	S	S	*	.	S	Bend	trans	-88.9	-15.8	-178.3	-59.8	-171.7	167.5	0	0	113.6	L521 S525	L521-E523 VanDerWaalsContact C-N 3.31Å; L521-E523 PolarHBondContact O-N 3.29Å; E523-S525 PolarHBondContact O-N 3.47Å
524	D	87.6	Confident	90.7	Very high	28 Å²	28	62.2 Å²	62.2	15%	0.15	35%	0.353	C	S	.	.			trans	-100	85	-178.9	-163.4	-39.7	0	0	0	111.4	L521 H526 L527 K528	L521-D524 PolarHBondContact O-N 2.84Å; D524-H526 PolarHBondContact O-N 3.39Å; D524-H526 PolarHBondContact OD1-N 3.45Å; D524-L527 HydrophobicContact CB-CB 4.15Å; D524-L527 HydrophobicContact CB-CD1 4.36Å; D524-L527 HydrophobicContact CB-CG 4.37Å; D524-L527 VanDerWaalsContact CG-CG 3.47Å; D524-L527 PolarHBondContact O-N 2.74Å; D524-L527 WeakPolarHBondContact OD1-CG 3.49Å; D524-L527 PolarHBondContact OD1-N 2.75Å; D524-L527 VanDerWaalsContact OD2-CD1 3.23Å; D524-L527 WeakPolarHBondContact OD2-CD1 3.44Å; D524-L527 WeakPolarHBondContact OD2-CG 3.46Å; D524-K528 WeakPolarHBondContact O-CB 3.15Å; D524-K528 PolarHBondContact O-N 3.47Å
525	S	88.9	Confident	90.7	Very high	105 Å²	105	60.9 Å²	60.9	73%	0.734	35%	0.345	S	S	*	.	H	α-helix	trans	-56.5	-32.4	-178.6	61	0	0	0	0	114.2	E523 G529	E523-S525 PolarHBondContact O-N 3.47Å; S525-G529 PolarHBondContact O-N 2.88Å
526	H	88.9	Confident	90.8	Very high	115 Å²	115	60.6 Å²	60.6	53%	0.532	35%	0.346	S	S	.	.	H	α-helix	trans	-74	-52.2	-179.4	178.5	-93.3	0	0	0	110.8	D524 K528 G529 N530	D524-H526 PolarHBondContact O-N 3.39Å; D524-H526 PolarHBondContact OD1-N 3.45Å; H526-K528 VanDerWaalsContact C-N 3.32Å; H526-K528 PolarHBondContact O-N 2.94Å; H526-G529 PolarHBondContact O-N 2.75Å; H526-N530 PolarHBondContact CE1-ND2 2.82Å; H526-N530 PolarHBondContact O-N 3.47Å
527	L	87.4	Confident	91	Very high	3 Å²	3	64.5 Å²	64.5	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-40.1	177.7	-65.3	-175.5	0	0	0	111.9	R456 E457 L521 D524 G529 N530 L531	R456-L527 HydrophobicContact CB-CD1 4.12Å; E457-L527 HydrophobicContact CB-CD2 3.5Å; E457-L527 VanDerWaalsContact CB-CD2 3.5Å; E457-L527 HydrophobicContact CG-CD2 3.53Å; L521-L527 HydrophobicContact CD2-CB 3.77Å; L521-L527 HydrophobicContact CD2-CD1 4.25Å; D524-L527 HydrophobicContact CB-CB 4.15Å; D524-L527 HydrophobicContact CB-CD1 4.36Å; D524-L527 HydrophobicContact CB-CG 4.37Å; D524-L527 VanDerWaalsContact CG-CG 3.47Å; D524-L527 PolarHBondContact O-N 2.74Å; D524-L527 WeakPolarHBondContact OD1-CG 3.49Å; D524-L527 PolarHBondContact OD1-N 2.75Å; D524-L527 VanDerWaalsContact OD2-CD1 3.23Å; D524-L527 WeakPolarHBondContact OD2-CD1 3.44Å; D524-L527 WeakPolarHBondContact OD2-CG 3.46Å; L527-G529 VanDerWaalsContact C-N 3.34Å; L527-G529 PolarHBondContact O-N 3.42Å; L527-N530 PolarHBondContact O-N 3.16Å; L527-L531 WeakPolarHBondContact O-CB 3.4Å; L527-L531 WeakPolarHBondContact O-CG 3.36Å; L527-L531 PolarHBondContact O-N 3.27Å
528	K	91.4	Very high	91.2	Very high	84 Å²	84	64.8 Å²	64.8	37%	0.365	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-46.7	173.9	-173.4	172.9	-178	169.7	0	111.3	L521 D524 H526 N530 L531 T532	L521-K528 HydrophobicContact CB-CB 4.23Å; D524-K528 WeakPolarHBondContact O-CB 3.15Å; D524-K528 PolarHBondContact O-N 3.47Å; H526-K528 VanDerWaalsContact C-N 3.32Å; H526-K528 PolarHBondContact O-N 2.94Å; K528-N530 PolarHBondContact O-N 3.44Å; K528-L531 PolarHBondContact O-N 3.24Å; K528-T532 WeakPolarHBondContact O-CB 3.3Å; K528-T532 PolarHBondContact O-N 2.97Å; K528-T532 PolarHBondContact O-OG1 3.34Å
529	G	90	Very high	91.6	Very high	52 Å²	52	66.5 Å²	66.5	54%	0.536	37%	0.37	S	S	.	.	H	α-helix	trans	-58.2	-45.3	176.1	0	0	0	0	0	112.8	S525 H526 L527 L531	S525-G529 PolarHBondContact O-N 2.88Å; H526-G529 PolarHBondContact O-N 2.75Å; L527-G529 VanDerWaalsContact C-N 3.34Å; L527-G529 PolarHBondContact O-N 3.42Å; G529-L531 PolarHBondContact O-N 3.29Å
530	N	88.1	Confident	91.9	Very high	76 Å²	76	62.7 Å²	62.7	41%	0.406	35%	0.352	S	S	.	.	H	α-helix	trans	-68.1	-33.6	-178	-70.2	-6.8	0	0	0	113.3	E457 H526 L527 K528	E457-N530 PolarHBondContact OE1-ND2 3.01Å; H526-N530 PolarHBondContact CE1-ND2 2.82Å; H526-N530 PolarHBondContact O-N 3.47Å; L527-N530 PolarHBondContact O-N 3.16Å; K528-N530 PolarHBondContact O-N 3.44Å
531	L	91.2	Very high	92.3	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-100	-19.7	-171.9	-66.3	174.3	0	0	0	114.5	F460 L521 L527 K528 G529 A533 R534 I535	F460-L531 HydrophobicContact CB-CD1 3.56Å; F460-L531 HydrophobicContact CG-CD1 4.45Å; L521-L531 HydrophobicContact CD1-CB 4.2Å; L521-L531 HydrophobicContact CD1-CD1 3.74Å; L527-L531 WeakPolarHBondContact O-CB 3.4Å; L527-L531 WeakPolarHBondContact O-CG 3.36Å; L527-L531 PolarHBondContact O-N 3.27Å; K528-L531 PolarHBondContact O-N 3.24Å; G529-L531 PolarHBondContact O-N 3.29Å; L531-A533 PolarHBondContact O-N 3.07Å; L531-R534 PolarHBondContact O-N 3.08Å; L531-I535 HydrophobicContact CB-CD1 3.89Å; L531-I535 HydrophobicContact CB-CG1 4.48Å; L531-I535 WeakPolarHBondContact O-CG1 3.39Å; L531-I535 PolarHBondContact O-N 2.98Å
532	T	94.4	Very high	92.8	Very high	53 Å²	53	63.2 Å²	63.2	33%	0.325	36%	0.355	S	S	.	.	H	α-helix	trans	-53.8	-49.1	-174.3	-68	0	0	0	0	112.8	M518 K528 R534 I535 S536	M518-T532 HydrophobicContact CE-CG2 4.34Å; K528-T532 WeakPolarHBondContact O-CB 3.3Å; K528-T532 PolarHBondContact O-N 2.97Å; K528-T532 PolarHBondContact O-OG1 3.34Å; T532-R534 VanDerWaalsContact C-N 3.32Å; T532-R534 PolarHBondContact O-N 2.95Å; T532-I535 PolarHBondContact O-N 3.31Å; T532-S536 PolarHBondContact O-N 2.93Å; T532-S536 PolarHBondContact O-OG 3.17Å; T532-S536 VanDerWaalsContact O-OG 3.11Å
533	A	94.1	Very high	93.1	Very high	75 Å²	75	63.7 Å²	63.7	62%	0.62	35%	0.348	S	S	*	.	H	α-helix	trans	-62.3	-39.2	-179.6	0	0	0	0	0	112.5	L531 H537	L531-A533 PolarHBondContact O-N 3.07Å; A533-H537 WeakPolarHBondContact O-CB 3.49Å; A533-H537 PolarHBondContact O-N 3.17Å
534	R	94.6	Very high	93.7	Very high	114 Å²	114	59.4 Å²	59.4	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-43	178.6	-63.2	-177.6	177.3	-144.9	2.1	111.5	T461 V464 E465 L531 T532 H537 L538	T461-R534 VanDerWaalsContact CG2-NH1 3.3Å; V464-R534 HydrophobicContact CG1-CB 4.08Å; E465-R534 IonicContact OE1-NH1 3.59Å; E465-R534 PolarHBondContact OE1-NH1 3.15Å; L531-R534 PolarHBondContact O-N 3.08Å; T532-R534 VanDerWaalsContact C-N 3.32Å; T532-R534 PolarHBondContact O-N 2.95Å; R534-H537 PolarHBondContact O-N 3.43Å; R534-L538 WeakPolarHBondContact O-CB 3.46Å; R534-L538 PolarHBondContact O-N 2.76Å
535	I	96	Very high	94.2	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-42.6	178	-65.9	163.5	0	0	0	110.8	V464 V514 I517 M518 L521 L531 T532 H537 L538 K539	V464-I535 HydrophobicContact CG2-CG1 3.94Å; V514-I535 HydrophobicContact CB-CG2 4.15Å; V514-I535 HydrophobicContact CG1-CG2 4.02Å; V514-I535 HydrophobicContact CG2-CG2 3.63Å; I517-I535 HydrophobicContact CB-CD1 4.4Å; I517-I535 HydrophobicContact CG2-CD1 3.53Å; I517-I535 HydrophobicContact CG2-CG1 4.42Å; M518-I535 HydrophobicContact CE-CB 3.91Å; M518-I535 HydrophobicContact CE-CD1 3.68Å; M518-I535 HydrophobicContact CE-CG1 4.42Å; M518-I535 HydrophobicContact CE-CG2 3.76Å; M518-I535 HydrophobicContact SD-CD1 4.29Å; L521-I535 HydrophobicContact CD1-CD1 4.34Å; L531-I535 HydrophobicContact CB-CD1 3.89Å; L531-I535 HydrophobicContact CB-CG1 4.48Å; L531-I535 WeakPolarHBondContact O-CG1 3.39Å; L531-I535 PolarHBondContact O-N 2.98Å; T532-I535 PolarHBondContact O-N 3.31Å; I535-H537 VanDerWaalsContact C-N 3.35Å; I535-L538 PolarHBondContact O-N 2.73Å; I535-K539 PolarHBondContact O-N 2.66Å
536	S	95.4	Very high	94.7	Very high	69 Å²	69	53.9 Å²	53.9	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-40.1	175.1	-62.5	0	0	0	0	112.3	T532 K539 S540	T532-S536 PolarHBondContact O-N 2.93Å; T532-S536 PolarHBondContact O-OG 3.17Å; T532-S536 VanDerWaalsContact O-OG 3.11Å; S536-K539 PolarHBondContact O-N 2.98Å; S536-S540 PolarHBondContact O-N 3.39Å; S536-S540 VanDerWaalsContact O-N 3.15Å
537	H	96.7	Very high	95.1	Very high	114 Å²	114	51.6 Å²	51.6	53%	0.528	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-47.2	174.8	-179.2	51.5	0	0	0	111.4	A533 R534 I535 K539 S540 E541	A533-H537 WeakPolarHBondContact O-CB 3.49Å; A533-H537 PolarHBondContact O-N 3.17Å; R534-H537 PolarHBondContact O-N 3.43Å; I535-H537 VanDerWaalsContact C-N 3.35Å; H537-K539 VanDerWaalsContact C-N 3.34Å; H537-K539 PolarHBondContact O-N 2.66Å; H537-S540 WeakPolarHBondContact O-CB 3.5Å; H537-S540 PolarHBondContact O-N 2.93Å; H537-S540 VanDerWaalsContact O-N 3.08Å; H537-E541 IonicContact CE1-OE1 2.77Å; H537-E541 PolarHBondContact O-N 3.14Å
538	L	97.6	Very high	95.5	Very high	7 Å²	7	55 Å²	55	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-54.9	-48.5	175.9	-179.1	67.8	0	0	0	111.7	V464 M467 A468 F513 R534 I535 S540 E541 Y542	V464-L538 HydrophobicContact CG1-CD2 4.18Å; M467-L538 HydrophobicContact CB-CD1 4.21Å; M467-L538 HydrophobicContact CB-CD2 3.72Å; A468-L538 HydrophobicContact CB-CD1 3.73Å; F513-L538 HydrophobicContact CD1-CD2 3.65Å; F513-L538 HydrophobicContact CE1-CD2 3.42Å; F513-L538 VanDerWaalsContact CE1-CD2 3.42Å; F513-L538 HydrophobicContact CZ-CD2 4.36Å; R534-L538 WeakPolarHBondContact O-CB 3.46Å; R534-L538 PolarHBondContact O-N 2.76Å; I535-L538 PolarHBondContact O-N 2.73Å; L538-S540 VanDerWaalsContact C-N 3.27Å; L538-S540 PolarHBondContact O-N 3.15Å; L538-E541 PolarHBondContact O-N 3.24Å; L538-E541 VanDerWaalsContact O-N 3.09Å; L538-Y542 HydrophobicContact CD1-CD2 4.11Å; L538-Y542 HydrophobicContact CD1-CE2 3.69Å; L538-Y542 HydrophobicContact CG-CD2 4.23Å; L538-Y542 HydrophobicContact CG-CE2 4.06Å; L538-Y542 WeakPolarHBondContact O-CD2 3.44Å; L538-Y542 PolarHBondContact O-N 3.39Å
539	K	97.7	Very high	95.9	Very high	78 Å²	78	51 Å²	51	34%	0.339	28%	0.277	S	S	.	.	H	α-helix	trans	-54.5	-45	176.6	-177.4	-175.9	169.3	-171.7	0	111.6	A510 V514 I535 S536 H537 E541 Y542 E543	A510-K539 HydrophobicContact CB-CG 4.36Å; V514-K539 HydrophobicContact CG2-CB 4Å; V514-K539 HydrophobicContact CG2-CD 4.29Å; V514-K539 HydrophobicContact CG2-CG 4.35Å; I535-K539 PolarHBondContact O-N 2.66Å; S536-K539 PolarHBondContact O-N 2.98Å; H537-K539 VanDerWaalsContact C-N 3.34Å; H537-K539 PolarHBondContact O-N 2.66Å; K539-E541 VanDerWaalsContact C-N 3.34Å; K539-E541 PolarHBondContact O-N 2.94Å; K539-Y542 PolarHBondContact O-N 3.31Å; K539-E543 WeakPolarHBondContact CE-OE1 3.38Å; K539-E543 IonicContact NZ-OE1 3.65Å; K539-E543 WeakPolarHBondContact O-CG 3.49Å; K539-E543 PolarHBondContact O-N 3.39Å
540	S	97.6	Very high	96.2	Very high	41 Å²	41	48.6 Å²	48.6	29%	0.287	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-36.2	178.4	-177.1	0	0	0	0	112.7	S536 H537 L538 E543 K544	S536-S540 PolarHBondContact O-N 3.39Å; S536-S540 VanDerWaalsContact O-N 3.15Å; H537-S540 WeakPolarHBondContact O-CB 3.5Å; H537-S540 PolarHBondContact O-N 2.93Å; H537-S540 VanDerWaalsContact O-N 3.08Å; L538-S540 VanDerWaalsContact C-N 3.27Å; L538-S540 PolarHBondContact O-N 3.15Å; S540-E543 PolarHBondContact O-N 3.28Å; S540-K544 WeakPolarHBondContact O-CB 3.5Å; S540-K544 VanDerWaalsContact O-CG 3.25Å; S540-K544 WeakPolarHBondContact O-CG 3.48Å; S540-K544 PolarHBondContact O-N 3.4Å
541	E	98.2	Very high	96.6	Very high	60 Å²	60	46.1 Å²	46.1	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-64.6	-41.7	176.9	-65.2	-64.9	105.2	0	0	111.8	H537 L538 K539 K544 V545	H537-E541 IonicContact CE1-OE1 2.77Å; H537-E541 PolarHBondContact O-N 3.14Å; L538-E541 PolarHBondContact O-N 3.24Å; L538-E541 VanDerWaalsContact O-N 3.09Å; K539-E541 VanDerWaalsContact C-N 3.34Å; K539-E541 PolarHBondContact O-N 2.94Å; E541-K544 PolarHBondContact O-N 2.87Å; E541-K544 IonicContact OE1-NZ 3.74Å; E541-K544 PolarHBondContact OE1-NZ 3.26Å; E541-V545 PolarHBondContact O-N 3Å; E541-V545 VanDerWaalsContact O-N 3.12Å
542	Y	98.6	Very high	96.9	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-41	174.2	-84	-101.5	0	0	0	112.8	M467 F470 V471 A506 I509 A510 L538 K539 K544 V545 A546	M467-Y542 WeakPolarHBondContact CE-OH 3.4Å; M467-Y542 PolarHBondContact O-OH 3.27Å; F470-Y542 WeakPolarHBondContact CD1-OH 3.43Å; V471-Y542 HydrophobicContact CB-CD1 4.42Å; V471-Y542 HydrophobicContact CB-CD2 4.03Å; V471-Y542 HydrophobicContact CB-CE1 4Å; V471-Y542 HydrophobicContact CB-CE2 3.55Å; V471-Y542 HydrophobicContact CB-CG 4.44Å; V471-Y542 HydrophobicContact CG1-CD2 4.38Å; V471-Y542 HydrophobicContact CG1-CE2 4.02Å; V471-Y542 HydrophobicContact CG2-CD1 3.84Å; V471-Y542 HydrophobicContact CG2-CD2 3.87Å; V471-Y542 HydrophobicContact CG2-CE1 3.87Å; V471-Y542 HydrophobicContact CG2-CE2 3.89Å; V471-Y542 HydrophobicContact CG2-CG 3.85Å; A506-Y542 HydrophobicContact CB-CD1 4.07Å; A506-Y542 WeakPolarHBondContact O-CD1 3.5Å; I509-Y542 HydrophobicContact CB-CD1 4.39Å; I509-Y542 HydrophobicContact CB-CE1 4.01Å; I509-Y542 HydrophobicContact CG2-CD1 4.31Å; I509-Y542 HydrophobicContact CG2-CE1 3.56Å; A510-Y542 HydrophobicContact CB-CD1 4.32Å; A510-Y542 HydrophobicContact CB-CD2 4.47Å; A510-Y542 HydrophobicContact CB-CG 3.89Å; L538-Y542 HydrophobicContact CD1-CD2 4.11Å; L538-Y542 HydrophobicContact CD1-CE2 3.69Å; L538-Y542 HydrophobicContact CG-CD2 4.23Å; L538-Y542 HydrophobicContact CG-CE2 4.06Å; L538-Y542 WeakPolarHBondContact O-CD2 3.44Å; L538-Y542 PolarHBondContact O-N 3.39Å; K539-Y542 PolarHBondContact O-N 3.31Å; Y542-K544 VanDerWaalsContact C-N 3.34Å; Y542-V545 VanDerWaalsContact O-CG2 3.24Å; Y542-V545 WeakPolarHBondContact O-CG2 3.44Å; Y542-V545 PolarHBondContact O-N 3.2Å; Y542-A546 WeakPolarHBondContact O-CB 3.32Å; Y542-A546 PolarHBondContact O-N 2.92Å
543	E	96.7	Very high	97.1	Very high	66 Å²	66	44.8 Å²	44.8	31%	0.308	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-40.1	176.5	-72.2	173.5	159.8	0	0	111.3	K539 S540 A546 E547	K539-E543 WeakPolarHBondContact CE-OE1 3.38Å; K539-E543 IonicContact NZ-OE1 3.65Å; K539-E543 WeakPolarHBondContact O-CG 3.49Å; K539-E543 PolarHBondContact O-N 3.39Å; S540-E543 PolarHBondContact O-N 3.28Å; E543-A546 PolarHBondContact O-N 3.44Å; E543-E547 WeakPolarHBondContact O-CG 3.38Å; E543-E547 PolarHBondContact O-N 3.09Å
544	K	97.4	Very high	97.2	Very high	105 Å²	105	42 Å²	42	46%	0.457	21%	0.205	S	C	.	.	H	α-helix	trans	-63.3	-45.2	176.6	-74.9	172	-168.2	168.9	0	112.8	S540 E541 Y542 A546 E547 Q548	S540-K544 WeakPolarHBondContact O-CB 3.5Å; S540-K544 VanDerWaalsContact O-CG 3.25Å; S540-K544 WeakPolarHBondContact O-CG 3.48Å; S540-K544 PolarHBondContact O-N 3.4Å; E541-K544 PolarHBondContact O-N 2.87Å; E541-K544 IonicContact OE1-NZ 3.74Å; E541-K544 PolarHBondContact OE1-NZ 3.26Å; Y542-K544 VanDerWaalsContact C-N 3.34Å; K544-A546 VanDerWaalsContact C-N 3.35Å; K544-E547 WeakPolarHBondContact O-CB 3.34Å; K544-E547 PolarHBondContact O-N 3.06Å; K544-Q548 PolarHBondContact O-N 3.3Å
545	V	98.1	Very high	97.3	Very high	16 Å²	16	38.8 Å²	38.8	10%	0.097	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-37.4	178.7	-61.1	0	0	0	0	111	V471 D475 E541 Y542 E547 Q548 W549	V471-V545 HydrophobicContact CG2-CG1 4.39Å; V471-V545 HydrophobicContact CG2-CG2 3.66Å; D475-V545 HydrophobicContact CB-CG1 4.14Å; E541-V545 PolarHBondContact O-N 3Å; E541-V545 VanDerWaalsContact O-N 3.12Å; Y542-V545 VanDerWaalsContact O-CG2 3.24Å; Y542-V545 WeakPolarHBondContact O-CG2 3.44Å; Y542-V545 PolarHBondContact O-N 3.2Å; V545-E547 VanDerWaalsContact C-N 3.32Å; V545-E547 PolarHBondContact O-N 2.93Å; V545-Q548 WeakPolarHBondContact O-CB 3.41Å; V545-Q548 PolarHBondContact O-N 3.49Å; V545-Q548 VanDerWaalsContact O-N 3.12Å; V545-W549 HydrophobicContact CB-CH2 4.39Å; V545-W549 HydrophobicContact CB-CZ2 3.7Å; V545-W549 HydrophobicContact CG2-CH2 3.86Å; V545-W549 HydrophobicContact CG2-CZ2 3.66Å; V545-W549 PolarHBondContact O-N 3.32Å; V545-W549 PolarHBondContact O-NE1 2.84Å
546	A	98.4	Very high	97.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-42.3	173.4	0	0	0	0	0	111.8	A503 A506 Y542 E543 K544 Q548 W549 I550 L602	A503-A546 HydrophobicContact CB-CB 4.27Å; A506-A546 HydrophobicContact CB-CB 4.3Å; Y542-A546 WeakPolarHBondContact O-CB 3.32Å; Y542-A546 PolarHBondContact O-N 2.92Å; E543-A546 PolarHBondContact O-N 3.44Å; K544-A546 VanDerWaalsContact C-N 3.35Å; A546-Q548 VanDerWaalsContact C-N 3.33Å; A546-Q548 PolarHBondContact O-N 2.75Å; A546-W549 PolarHBondContact O-N 3.05Å; A546-I550 PolarHBondContact O-N 3.43Å; A546-I550 VanDerWaalsContact O-N 3.1Å; A546-L602 HydrophobicContact CB-CD1 4.28Å; A546-L602 HydrophobicContact CB-CD2 4.33Å
547	E	96.9	Very high	97.3	Very high	68 Å²	68	35.6 Å²	35.6	32%	0.318	17%	0.172	S	C	.	.	H	α-helix	trans	-63.5	-36.1	173.4	-76	178.5	-145.2	0	0	113.2	E543 K544 V545 I550 A551 L602 K605	E543-E547 WeakPolarHBondContact O-CG 3.38Å; E543-E547 PolarHBondContact O-N 3.09Å; K544-E547 WeakPolarHBondContact O-CB 3.34Å; K544-E547 PolarHBondContact O-N 3.06Å; V545-E547 VanDerWaalsContact C-N 3.32Å; V545-E547 PolarHBondContact O-N 2.93Å; E547-I550 WeakPolarHBondContact O-CG1 3.43Å; E547-A551 PolarHBondContact O-N 3.14Å; E547-L602 HydrophobicContact CG-CD2 4.23Å; E547-K605 HydrophobicContact CG-CD 4.1Å; E547-K605 IonicContact OE1-NZ 3.44Å; E547-K605 PolarHBondContact OE1-NZ 2.81Å; E547-K605 IonicContact OE2-NZ 2.67Å
548	Q	97.2	Very high	97.3	Very high	75 Å²	75	30.2 Å²	30.2	35%	0.35	15%	0.147	S	C	.	.	H	α-helix	trans	-67.2	-39.9	174.2	179.1	175	-11.6	0	0	111.5	K544 V545 A546 A551 Y552	K544-Q548 PolarHBondContact O-N 3.3Å; V545-Q548 WeakPolarHBondContact O-CB 3.41Å; V545-Q548 PolarHBondContact O-N 3.49Å; V545-Q548 VanDerWaalsContact O-N 3.12Å; A546-Q548 VanDerWaalsContact C-N 3.33Å; A546-Q548 PolarHBondContact O-N 2.75Å; Q548-A551 VanDerWaalsContact O-CB 3.27Å; Q548-A551 WeakPolarHBondContact O-CB 3.42Å; Q548-A551 PolarHBondContact O-N 3.39Å; Q548-A551 VanDerWaalsContact O-N 3.16Å; Q548-Y552 HydrophobicContact CG-CE1 4.41Å; Q548-Y552 PolarHBondContact NE2-OH 3.06Å; Q548-Y552 PolarHBondContact O-N 3.28Å
549	W	98.3	Very high	97.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-72.3	-35.3	-177.4	-56.4	-17.4	0	0	0	112.3	Y474 D475 I478 I499 N502 A503 A506 V545 A546 A551 Y552 A553	Y474-W549 AromaticContact CD1-CH2 3.63Å; Y474-W549 HydrophobicContact CD1-CH2 3.63Å; Y474-W549 HydrophobicContact CD1-CZ3 4.36Å; Y474-W549 HydrophobicContact CD2-CH2 4.07Å; Y474-W549 AromaticContact CE1-CH2 3.6Å; Y474-W549 HydrophobicContact CE1-CH2 3.6Å; Y474-W549 AromaticContact CE1-CZ3 3.86Å; Y474-W549 HydrophobicContact CE1-CZ3 3.86Å; Y474-W549 HydrophobicContact CE2-CH2 4.05Å; Y474-W549 HydrophobicContact CE2-CZ3 4.29Å; Y474-W549 AromaticContact CG-CH2 3.87Å; Y474-W549 HydrophobicContact CG-CH2 3.87Å; Y474-W549 HydrophobicContact CG-CZ2 4.45Å; Y474-W549 AromaticContact CZ-CH2 3.82Å; Y474-W549 AromaticContact CZ-CZ3 3.83Å; D475-W549 HydrophobicContact CB-CZ2 4.08Å; D475-W549 PolarHBondContact OD1-NE1 2.86Å; I478-W549 HydrophobicContact CB-CD2 4.42Å; I478-W549 HydrophobicContact CB-CZ2 4.39Å; I478-W549 HydrophobicContact CG1-CD2 4.15Å; I478-W549 HydrophobicContact CG1-CE3 4.39Å; I478-W549 HydrophobicContact CG1-CH2 4.23Å; I478-W549 HydrophobicContact CG1-CZ2 3.96Å; I478-W549 HydrophobicContact CG1-CZ3 4.42Å; I478-W549 HydrophobicContact CG2-CD2 4.02Å; I478-W549 HydrophobicContact CG2-CG 3.79Å; I499-W549 HydrophobicContact CG2-CB 4.35Å; I499-W549 WeakPolarHBondContact CG2-O 2.89Å; N502-W549 HydrophobicContact CB-CE3 4.25Å; N502-W549 HydrophobicContact CB-CZ3 4.24Å; N502-W549 WeakPolarHBondContact O-CZ3 3.29Å; A503-W549 HydrophobicContact CB-CB 4.32Å; A503-W549 HydrophobicContact CB-CE3 4.25Å; A506-W549 HydrophobicContact CB-CH2 4.01Å; A506-W549 HydrophobicContact CB-CZ3 3.61Å; V545-W549 HydrophobicContact CB-CH2 4.39Å; V545-W549 HydrophobicContact CB-CZ2 3.7Å; V545-W549 HydrophobicContact CG2-CH2 3.86Å; V545-W549 HydrophobicContact CG2-CZ2 3.66Å; V545-W549 PolarHBondContact O-N 3.32Å; V545-W549 PolarHBondContact O-NE1 2.84Å; A546-W549 PolarHBondContact O-N 3.05Å; W549-A551 PolarHBondContact O-N 3.23Å; W549-Y552 HydrophobicContact CB-CD2 4.5Å; W549-Y552 AromaticContact CD1-CE2 3.89Å; W549-Y552 WeakPolarHBondContact O-CA 3.49Å; W549-Y552 VanDerWaalsContact O-CB 3.23Å; W549-Y552 WeakPolarHBondContact O-CB 3.39Å; W549-Y552 PolarHBondContact O-N 3.16Å; W549-A553 PolarHBondContact O-N 2.92Å
550	I	97.3	Very high	97	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-26.8	170.7	62.5	170.5	0	0	0	112.2	L500 A503 A546 E547 Y552 A553 E554 L602 K605 L606	L500-I550 HydrophobicContact CD2-CG2 4.16Å; A503-I550 HydrophobicContact CB-CG2 4.03Å; A546-I550 PolarHBondContact O-N 3.43Å; A546-I550 VanDerWaalsContact O-N 3.1Å; E547-I550 WeakPolarHBondContact O-CG1 3.43Å; I550-Y552 PolarHBondContact O-N 2.85Å; I550-A553 WeakPolarHBondContact O-CB 3.39Å; I550-A553 PolarHBondContact O-N 2.95Å; I550-A553 VanDerWaalsContact O-N 3.12Å; I550-E554 PolarHBondContact O-N 2.98Å; I550-L602 HydrophobicContact CD1-CB 4.34Å; I550-L602 HydrophobicContact CD1-CD2 4.21Å; I550-L602 HydrophobicContact CG2-CB 4.25Å; I550-L602 HydrophobicContact CG2-CD1 4.34Å; I550-K605 HydrophobicContact CD1-CB 4.12Å; I550-L606 HydrophobicContact CB-CD1 4.48Å; I550-L606 HydrophobicContact CD1-CB 4.25Å; I550-L606 WeakPolarHBondContact O-CD1 3.14Å
551	A	96.5	Very high	96.9	Very high	25 Å²	25	28.4 Å²	28.4	21%	0.207	14%	0.137	C	C	.	.	H	α-helix	trans	-67.8	-21.6	171.6	0	0	0	0	0	112.4	E547 Q548 W549 E554 E555	E547-A551 PolarHBondContact O-N 3.14Å; Q548-A551 VanDerWaalsContact O-CB 3.27Å; Q548-A551 WeakPolarHBondContact O-CB 3.42Å; Q548-A551 PolarHBondContact O-N 3.39Å; Q548-A551 VanDerWaalsContact O-N 3.16Å; W549-A551 PolarHBondContact O-N 3.23Å; A551-E554 WeakPolarHBondContact O-CB 3.24Å; A551-E555 WeakPolarHBondContact O-CB 3.39Å; A551-E555 PolarHBondContact O-N 3.35Å
552	Y	98	Very high	96.7	Very high	27 Å²	27	28.4 Å²	28.4	11%	0.106	14%	0.139	C	C	.	.	H	α-helix	trans	-75.4	-31.4	170.3	-56.1	-25.6	0	0	0	112.3	I478 R482 I499 Q548 W549 I550 T556	I478-Y552 HydrophobicContact CG2-CD2 4.15Å; I478-Y552 HydrophobicContact CG2-CE2 4.09Å; R482-Y552 HydrophobicContact CB-CD2 4.34Å; R482-Y552 HydrophobicContact CB-CE2 4.46Å; R482-Y552 HydrophobicContact CG-CG 4.48Å; I499-Y552 HydrophobicContact CD1-CD2 4.5Å; Q548-Y552 HydrophobicContact CG-CE1 4.41Å; Q548-Y552 PolarHBondContact NE2-OH 3.06Å; Q548-Y552 PolarHBondContact O-N 3.28Å; W549-Y552 HydrophobicContact CB-CD2 4.5Å; W549-Y552 AromaticContact CD1-CE2 3.89Å; W549-Y552 WeakPolarHBondContact O-CA 3.49Å; W549-Y552 VanDerWaalsContact O-CB 3.23Å; W549-Y552 WeakPolarHBondContact O-CB 3.39Å; W549-Y552 PolarHBondContact O-N 3.16Å; I550-Y552 PolarHBondContact O-N 2.85Å; Y552-T556 PolarHBondContact O-N 3.05Å; Y552-T556 PolarHBondContact O-OG1 2.81Å
553	A	97.1	Very high	96.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-45.7	169.1	0	0	0	0	0	110.7	I496 I499 L500 W549 I550 E555 T556 V557 L595	I496-A553 HydrophobicContact CG2-CB 4.14Å; I499-A553 HydrophobicContact CG2-CB 4.32Å; L500-A553 HydrophobicContact CD2-CB 4.01Å; W549-A553 PolarHBondContact O-N 2.92Å; I550-A553 WeakPolarHBondContact O-CB 3.39Å; I550-A553 PolarHBondContact O-N 2.95Å; I550-A553 VanDerWaalsContact O-N 3.12Å; A553-E555 VanDerWaalsContact C-N 3.34Å; A553-E555 PolarHBondContact O-N 3.12Å; A553-T556 PolarHBondContact O-N 3.41Å; A553-T556 VanDerWaalsContact O-N 3.17Å; A553-V557 WeakPolarHBondContact O-CG2 3.38Å; A553-V557 PolarHBondContact O-N 2.88Å; A553-L595 HydrophobicContact CB-CD2 4.28Å
554	E	97.1	Very high	96.3	Very high	17 Å²	17	34.6 Å²	34.6	8%	0.079	16%	0.162	C	C	.	.	H	α-helix	trans	-54.3	-47.6	173.3	-172.8	-140.9	129.9	0	0	111.8	I550 A551 T556 V557 F558 L606 K609 L610 R613	I550-E554 PolarHBondContact O-N 2.98Å; A551-E554 WeakPolarHBondContact O-CB 3.24Å; E554-T556 VanDerWaalsContact C-N 3.32Å; E554-T556 PolarHBondContact O-N 3.24Å; E554-V557 PolarHBondContact O-N 3.46Å; E554-F558 HydrophobicContact CG-CD2 4.2Å; E554-F558 HydrophobicContact CG-CE2 4.3Å; E554-F558 WeakPolarHBondContact O-CD2 3.23Å; E554-F558 PolarHBondContact O-N 3.34Å; E554-L606 HydrophobicContact CB-CD1 3.81Å; E554-K609 HydrophobicContact CG-CB 4.4Å; E554-L610 HydrophobicContact CB-CD2 4.39Å; E554-L610 HydrophobicContact CG-CD2 3.84Å; E554-L610 HydrophobicContact CG-CG 4.37Å; E554-R613 WeakPolarHBondContact OE1-CD 3.44Å; E554-R613 IonicContact OE1-CZ 3.63Å; E554-R613 IonicContact OE1-NE 2.8Å; E554-R613 IonicContact OE1-NH1 3.35Å; E554-R613 PolarHBondContact OE1-NH1 3.17Å
555	E	96.2	Very high	96.2	Very high	45 Å²	45	29.8 Å²	29.8	21%	0.21	14%	0.141	C	C	.	.	H	α-helix	trans	-55.1	-46.1	176.4	176.8	179.3	-150.8	0	0	112.2	R482 A551 A553 F558 M559	R482-E555 IonicContact CZ-OE1 3.58Å; R482-E555 IonicContact CZ-OE2 3.24Å; R482-E555 IonicContact NE-OE2 3.66Å; R482-E555 PolarHBondContact NE-OE2 2.71Å; R482-E555 IonicContact NH2-OE1 2.69Å; R482-E555 PolarHBondContact NH2-OE1 3.31Å; R482-E555 IonicContact NH2-OE2 2.76Å; R482-E555 PolarHBondContact NH2-OE2 3.46Å; A551-E555 WeakPolarHBondContact O-CB 3.39Å; A551-E555 PolarHBondContact O-N 3.35Å; A553-E555 VanDerWaalsContact C-N 3.34Å; A553-E555 PolarHBondContact O-N 3.12Å; E555-F558 PolarHBondContact O-N 2.83Å; E555-M559 HydrophobicContact CG-CE 3.84Å; E555-M559 WeakPolarHBondContact O-CG 3.32Å; E555-M559 PolarHBondContact O-N 3.35Å
556	T	95.2	Very high	95.9	Very high	1 Å²	1	32 Å²	32	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-43	179.2	-60.4	0	0	0	0	112.1	Y485 Y495 I496 Y552 A553 E554 F558 M559	Y485-T556 HydrophobicContact CE1-CG2 3.91Å; Y485-T556 VanDerWaalsContact OH-CG2 3.23Å; Y485-T556 WeakPolarHBondContact OH-CG2 3.29Å; Y495-T556 VanDerWaalsContact CE1-OG1 3.32Å; Y495-T556 WeakPolarHBondContact CE1-OG1 3.17Å; I496-T556 HydrophobicContact CD1-CG2 3.71Å; I496-T556 HydrophobicContact CG1-CG2 3.92Å; Y552-T556 PolarHBondContact O-N 3.05Å; Y552-T556 PolarHBondContact O-OG1 2.81Å; A553-T556 PolarHBondContact O-N 3.41Å; A553-T556 VanDerWaalsContact O-N 3.17Å; E554-T556 VanDerWaalsContact C-N 3.32Å; E554-T556 PolarHBondContact O-N 3.24Å; T556-F558 VanDerWaalsContact C-N 3.26Å; T556-F558 PolarHBondContact O-N 2.84Å; T556-M559 WeakPolarHBondContact O-CB 3.34Å; T556-M559 PolarHBondContact O-N 3.08Å; T556-M559 VanDerWaalsContact O-N 3.11Å
557	V	97.4	Very high	95.7	Very high	1 Å²	1	33 Å²	33	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-57.3	-43.8	175.9	174	0	0	0	0	110.1	I496 A553 E554 M559 D560 L561 L588 Y591 L595 L610	I496-V557 HydrophobicContact CD1-CG2 4.43Å; A553-V557 WeakPolarHBondContact O-CG2 3.38Å; A553-V557 PolarHBondContact O-N 2.88Å; E554-V557 PolarHBondContact O-N 3.46Å; V557-M559 PolarHBondContact O-N 3.39Å; V557-D560 PolarHBondContact O-N 3.11Å; V557-L561 HydrophobicContact CG1-CD1 3.57Å; V557-L561 HydrophobicContact CG1-CG 4.27Å; V557-L561 WeakPolarHBondContact O-CG 3.47Å; V557-L561 PolarHBondContact O-N 2.83Å; V557-L561 VanDerWaalsContact O-N 3.07Å; V557-L588 HydrophobicContact CG1-CD2 4.39Å; V557-Y591 HydrophobicContact CB-CD2 4.34Å; V557-Y591 HydrophobicContact CG1-CD2 3.99Å; V557-Y591 HydrophobicContact CG1-CG 4.38Å; V557-Y591 HydrophobicContact CG2-CD1 3.9Å; V557-Y591 HydrophobicContact CG2-CD2 4.06Å; V557-Y591 HydrophobicContact CG2-CE1 4.33Å; V557-Y591 HydrophobicContact CG2-CE2 4.46Å; V557-Y591 HydrophobicContact CG2-CG 3.76Å; V557-L595 HydrophobicContact CG2-CD1 4.34Å; V557-L610 HydrophobicContact CB-CD2 4.04Å; V557-L610 HydrophobicContact CG1-CD2 3.8Å; V557-L610 HydrophobicContact CG2-CD2 4.46Å
558	F	96.8	Very high	95.5	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-72.5	-22.7	177.7	-84.1	-82.2	0	0	0	114.7	E554 E555 T556 D560 L561 N562 L565 L610 R613 M614 E617	E554-F558 HydrophobicContact CG-CD2 4.2Å; E554-F558 HydrophobicContact CG-CE2 4.3Å; E554-F558 WeakPolarHBondContact O-CD2 3.23Å; E554-F558 PolarHBondContact O-N 3.34Å; E555-F558 PolarHBondContact O-N 2.83Å; T556-F558 VanDerWaalsContact C-N 3.26Å; T556-F558 PolarHBondContact O-N 2.84Å; F558-D560 PolarHBondContact O-N 2.82Å; F558-L561 HydrophobicContact CD1-CB 4.37Å; F558-L561 HydrophobicContact CD1-CD1 4.4Å; F558-L561 HydrophobicContact CE1-CD1 4.27Å; F558-L561 HydrophobicContact CZ-CD1 4.39Å; F558-N562 WeakPolarHBondContact O-CB 3.44Å; F558-N562 PolarHBondContact O-N 3.12Å; F558-N562 PolarHBondContact O-ND2 3.5Å; F558-L565 HydrophobicContact CD1-CD1 4.32Å; F558-L565 HydrophobicContact CE1-CD1 4.24Å; F558-L610 HydrophobicContact CD2-CD2 4.19Å; F558-L610 HydrophobicContact CE2-CD2 3.72Å; F558-R613 HydrophobicContact CD1-CG 4.1Å; F558-R613 HydrophobicContact CD2-CB 4.43Å; F558-R613 HydrophobicContact CD2-CG 4.04Å; F558-R613 HydrophobicContact CE1-CB 4.21Å; F558-R613 HydrophobicContact CE1-CG 3.74Å; F558-R613 HydrophobicContact CE2-CB 3.62Å; F558-R613 HydrophobicContact CE2-CG 3.65Å; F558-R613 HydrophobicContact CG-CG 4.26Å; F558-R613 HydrophobicContact CZ-CB 3.52Å; F558-R613 HydrophobicContact CZ-CG 3.52Å; F558-M614 HydrophobicContact CZ-CB 4.13Å; F558-M614 VanDerWaalsContact CZ-N 3.34Å; F558-E617 HydrophobicContact CD1-CG 4.31Å; F558-E617 HydrophobicContact CE1-CG 4.2Å
559	M	93.4	Very high	95.3	Very high	52 Å²	52	26.4 Å²	26.4	26%	0.256	13%	0.133	S	C	.	.	H	α-helix	trans	-59.4	-34.2	172.1	-71.4	178.3	179.9	0	0	112.1	Y485 I486 E555 T556 V557	Y485-M559 HydrophobicContact CE1-SD 4.5Å; I486-M559 HydrophobicContact CG1-CE 4.04Å; E555-M559 HydrophobicContact CG-CE 3.84Å; E555-M559 WeakPolarHBondContact O-CG 3.32Å; E555-M559 PolarHBondContact O-N 3.35Å; T556-M559 WeakPolarHBondContact O-CB 3.34Å; T556-M559 PolarHBondContact O-N 3.08Å; T556-M559 VanDerWaalsContact O-N 3.11Å; V557-M559 PolarHBondContact O-N 3.39Å
560	D	93.8	Very high	95.1	Very high	36 Å²	36	28 Å²	28	19%	0.193	14%	0.143	C	C	.	.	H	α-helix	trans	-91.3	-40.8	179.9	-64.1	-24.3	0	0	0	111.9	R489 V557 F558 N562 R563 Y591	R489-D560 IonicContact CZ-OD1 2.75Å; R489-D560 IonicContact CZ-OD2 3.93Å; R489-D560 IonicContact NH1-OD1 2.74Å; R489-D560 PolarHBondContact NH1-OD1 3.39Å; R489-D560 IonicContact NH2-OD1 2.82Å; R489-D560 PolarHBondContact NH2-OD1 2.94Å; R489-D560 IonicContact NH2-OD2 2.91Å; R489-D560 PolarHBondContact NH2-OD2 3.14Å; V557-D560 PolarHBondContact O-N 3.11Å; F558-D560 PolarHBondContact O-N 2.82Å; D560-N562 VanDerWaalsContact C-N 3.28Å; D560-N562 PolarHBondContact O-N 3.44Å; D560-R563 WeakPolarHBondContact O-CB 3.33Å; D560-R563 PolarHBondContact O-N 3.08Å; D560-Y591 HydrophobicContact CB-CE2 4.33Å; D560-Y591 PolarHBondContact OD2-OH 2.98Å
561	L	97	Very high	94.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-34.5	174.2	-68.3	171.3	0	0	0	112.5	V557 F558 R563 V564 L565 L584 T587 L588 M614	V557-L561 HydrophobicContact CG1-CD1 3.57Å; V557-L561 HydrophobicContact CG1-CG 4.27Å; V557-L561 WeakPolarHBondContact O-CG 3.47Å; V557-L561 PolarHBondContact O-N 2.83Å; V557-L561 VanDerWaalsContact O-N 3.07Å; F558-L561 HydrophobicContact CD1-CB 4.37Å; F558-L561 HydrophobicContact CD1-CD1 4.4Å; F558-L561 HydrophobicContact CE1-CD1 4.27Å; F558-L561 HydrophobicContact CZ-CD1 4.39Å; L561-R563 PolarHBondContact O-N 3.38Å; L561-V564 CarbonylContact O-C 3.58Å; L561-V564 WeakPolarHBondContact O-CA 3.3Å; L561-V564 WeakPolarHBondContact O-CB 3.35Å; L561-V564 PolarHBondContact O-N 3.42Å; L561-L565 HydrophobicContact CB-CD1 4.2Å; L561-L565 WeakPolarHBondContact O-CB 2.96Å; L561-L565 WeakPolarHBondContact O-CG 3.31Å; L561-L565 PolarHBondContact O-N 3.32Å; L561-L584 HydrophobicContact CD2-CD2 4.06Å; L561-T587 HydrophobicContact CD2-CG2 3.63Å; L561-T587 HydrophobicContact CG-CG2 4.12Å; L561-L588 HydrophobicContact CD1-CD2 3.92Å; L561-L588 HydrophobicContact CD1-CG 4.31Å; L561-L588 HydrophobicContact CD2-CG 4.45Å; L561-M614 HydrophobicContact CD1-CE 3.62Å; L561-M614 HydrophobicContact CD2-CE 4.02Å; L561-M614 HydrophobicContact CG-CE 4.34Å
562	N	94.1	Very high	94.5	Very high	61 Å²	61	36.4 Å²	36.4	33%	0.326	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-29.4	178.9	-80.4	-23.1	0	0	0	112.7	F558 D560 V564 S566	F558-N562 WeakPolarHBondContact O-CB 3.44Å; F558-N562 PolarHBondContact O-N 3.12Å; F558-N562 PolarHBondContact O-ND2 3.5Å; D560-N562 VanDerWaalsContact C-N 3.28Å; D560-N562 PolarHBondContact O-N 3.44Å; N562-V564 VanDerWaalsContact C-N 3.35Å; N562-S566 WeakPolarHBondContact O-CB 3.49Å; N562-S566 PolarHBondContact O-N 2.94Å
563	R	90.5	Very high	94.3	Very high	174 Å²	174	35.1 Å²	35.1	66%	0.657	18%	0.181	S	C	*	.	H	α-helix	trans	-65.7	-40.9	174	-62.3	-180	178.7	-179.1	-0.2	111	D560 L561 S566	D560-R563 WeakPolarHBondContact O-CB 3.33Å; D560-R563 PolarHBondContact O-N 3.08Å; L561-R563 PolarHBondContact O-N 3.38Å; R563-S566 WeakPolarHBondContact O-CB 3.16Å; R563-S566 PolarHBondContact O-OG 3.3Å
564	V	94.8	Very high	94	Very high	23 Å²	23	35.9 Å²	35.9	14%	0.139	19%	0.185	C	C	.	.	H	α-helix	trans	-72.5	-45.9	177	-174.4	0	0	0	0	110.7	L561 N562 S566 V567 T580 L584	L561-V564 CarbonylContact O-C 3.58Å; L561-V564 WeakPolarHBondContact O-CA 3.3Å; L561-V564 WeakPolarHBondContact O-CB 3.35Å; L561-V564 PolarHBondContact O-N 3.42Å; N562-V564 VanDerWaalsContact C-N 3.35Å; V564-S566 PolarHBondContact O-N 3.15Å; V564-V567 VanDerWaalsContact O-CB 3.31Å; V564-V567 WeakPolarHBondContact O-CB 3.3Å; V564-V567 PolarHBondContact O-N 3.22Å; V564-T580 HydrophobicContact CG1-CG2 3.96Å; V564-T580 WeakPolarHBondContact CG1-O 3.42Å; V564-L584 HydrophobicContact CB-CD2 3.79Å; V564-L584 HydrophobicContact CB-CG 4.46Å; V564-L584 HydrophobicContact CG1-CD2 3.6Å; V564-L584 HydrophobicContact CG1-CG 3.73Å
565	L	95.4	Very high	93.8	Very high	3 Å²	3	42 Å²	42	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-27.6	175.5	-67.5	163.1	0	0	0	111.9	F558 L561 V567 I568 L584 M614 E617 R625	F558-L565 HydrophobicContact CD1-CD1 4.32Å; F558-L565 HydrophobicContact CE1-CD1 4.24Å; L561-L565 HydrophobicContact CB-CD1 4.2Å; L561-L565 WeakPolarHBondContact O-CB 2.96Å; L561-L565 WeakPolarHBondContact O-CG 3.31Å; L561-L565 PolarHBondContact O-N 3.32Å; L565-V567 PolarHBondContact O-N 3.35Å; L565-V567 VanDerWaalsContact O-N 3.16Å; L565-I568 HydrophobicContact CD2-CD1 3.66Å; L565-I568 PolarHBondContact O-N 2.71Å; L565-L584 HydrophobicContact CD2-CD1 4.1Å; L565-L584 HydrophobicContact CD2-CD2 3.8Å; L565-L584 HydrophobicContact CG-CD2 3.78Å; L565-M614 HydrophobicContact CD1-SD 4.39Å; L565-M614 HydrophobicContact CD2-SD 3.96Å; L565-E617 HydrophobicContact CD1-CB 3.76Å; L565-E617 HydrophobicContact CD1-CG 4.4Å; L565-R625 VanDerWaalsContact O-CZ 3.32Å; L565-R625 PolarHBondContact O-NH1 2.99Å; L565-R625 PolarHBondContact O-NH2 3.16Å
566	S	92.6	Very high	93.3	Very high	64 Å²	64	46 Å²	46	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15	174.1	83.7	0	0	0	0	114.4	N562 R563 V564 T570 R625	N562-S566 WeakPolarHBondContact O-CB 3.49Å; N562-S566 PolarHBondContact O-N 2.94Å; R563-S566 WeakPolarHBondContact O-CB 3.16Å; R563-S566 PolarHBondContact O-OG 3.3Å; V564-S566 PolarHBondContact O-N 3.15Å; S566-T570 WeakPolarHBondContact O-CG2 3.37Å; S566-R625 PolarHBondContact O-NH1 2.61Å
567	V	93.6	Very high	93.1	Very high	20 Å²	20	51.5 Å²	51.5	12%	0.121	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-27.2	179	-178.3	0	0	0	0	112.1	V564 L565 T570 Q572 W573	V564-V567 VanDerWaalsContact O-CB 3.31Å; V564-V567 WeakPolarHBondContact O-CB 3.3Å; V564-V567 PolarHBondContact O-N 3.22Å; L565-V567 PolarHBondContact O-N 3.35Å; L565-V567 VanDerWaalsContact O-N 3.16Å; V567-T570 VanDerWaalsContact O-CB 3.24Å; V567-T570 WeakPolarHBondContact O-CB 3.39Å; V567-T570 WeakPolarHBondContact O-CG2 3.49Å; V567-T570 PolarHBondContact O-N 3.35Å; V567-T570 VanDerWaalsContact O-N 3.09Å; V567-T570 PolarHBondContact O-OG1 3.2Å; V567-Q572 HydrophobicContact CG1-CB 4.21Å; V567-Q572 HydrophobicContact CG1-CG 4Å; V567-W573 HydrophobicContact CG1-CB 4.03Å; V567-W573 WeakPolarHBondContact O-CB 3.21Å
568	I	94.1	Very high	92.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	139.3	-179.5	-64.1	167.2	0	0	0	111.4	L565 T570 T580 Y618 A621 L622 R625	L565-I568 HydrophobicContact CD2-CD1 3.66Å; L565-I568 PolarHBondContact O-N 2.71Å; I568-T570 PolarHBondContact O-N 3.2Å; I568-T580 HydrophobicContact CG1-CG2 4.02Å; I568-Y618 HydrophobicContact CD1-CD1 4.49Å; I568-Y618 HydrophobicContact CD1-CD2 3.42Å; I568-Y618 VanDerWaalsContact CD1-CD2 3.42Å; I568-Y618 HydrophobicContact CD1-CE1 4.5Å; I568-Y618 HydrophobicContact CD1-CE2 3.44Å; I568-Y618 VanDerWaalsContact CD1-CE2 3.44Å; I568-Y618 HydrophobicContact CD1-CG 3.97Å; I568-Y618 HydrophobicContact CG1-CE2 4.24Å; I568-Y618 HydrophobicContact CG2-CE1 4.33Å; I568-A621 HydrophobicContact CB-CB 4.01Å; I568-A621 HydrophobicContact CG2-CB 3.86Å; I568-L622 HydrophobicContact CG2-CD2 4.15Å; I568-R625 WeakPolarHBondContact O-CD 3.27Å; I568-R625 PolarHBondContact O-NH1 2.95Å
569	M	92.8	Very high	92.7	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.02	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	29.6	-176.6	-66.4	-66.5	-70.9	0	0	114.4	W573 L622 R625 P628 L629 F677 A710	M569-W573 HydrophobicContact SD-CH2 4.34Å; M569-W573 HydrophobicContact SD-CZ3 3.8Å; M569-L622 HydrophobicContact CG-CD2 3.68Å; M569-L622 HydrophobicContact SD-CD2 4.07Å; M569-R625 HydrophobicContact CB-CB 4.29Å; M569-P628 VanDerWaalsContact O-CD 3.29Å; M569-P628 WeakPolarHBondContact O-CD 3.31Å; M569-P628 WeakPolarHBondContact O-CG 3.18Å; M569-L629 HydrophobicContact CE-CD1 4.33Å; M569-F677 HydrophobicContact CE-CE1 4.34Å; M569-A710 HydrophobicContact CE-CB 3.99Å
570	T	92.8	Very high	92.7	Very high	35 Å²	35	53.9 Å²	53.9	22%	0.215	28%	0.279	C	S	.	.	S	Bend	trans	-109.1	163.7	167.4	72	0	0	0	0	110.9	S566 V567 I568 Q572 W573	S566-T570 WeakPolarHBondContact O-CG2 3.37Å; V567-T570 VanDerWaalsContact O-CB 3.24Å; V567-T570 WeakPolarHBondContact O-CB 3.39Å; V567-T570 WeakPolarHBondContact O-CG2 3.49Å; V567-T570 PolarHBondContact O-N 3.35Å; V567-T570 VanDerWaalsContact O-N 3.09Å; V567-T570 PolarHBondContact O-OG1 3.2Å; I568-T570 PolarHBondContact O-N 3.2Å; T570-Q572 PolarHBondContact O-N 2.8Å; T570-Q572 PolarHBondContact OG1-N 3.45Å; T570-W573 WeakPolarHBondContact O-CB 3.14Å; T570-W573 PolarHBondContact O-N 2.64Å; T570-W573 VanDerWaalsContact O-N 3.16Å; T570-W573 PolarHBondContact OG1-N 3.35Å
571	P	91.1	Very high	92.6	Very high	95 Å²	95	52.4 Å²	52.4	62%	0.617	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.6	172.9	-25	35.2	0	0	0	113.9	P628	P571-P628 HydrophobicContact CG-CB 3.95Å
572	Q	91.7	Very high	92.4	Very high	105 Å²	105	56.7 Å²	56.7	49%	0.491	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-43.2	176	177	178.1	-10.1	0	0	111.3	V567 T570 L574 R575	V567-Q572 HydrophobicContact CG1-CB 4.21Å; V567-Q572 HydrophobicContact CG1-CG 4Å; T570-Q572 PolarHBondContact O-N 2.8Å; T570-Q572 PolarHBondContact OG1-N 3.45Å; Q572-L574 PolarHBondContact O-N 3.07Å; Q572-R575 WeakPolarHBondContact O-CB 2.96Å; Q572-R575 VanDerWaalsContact O-CG 3.32Å; Q572-R575 WeakPolarHBondContact O-CG 3.03Å; Q572-R575 PolarHBondContact O-N 3.39Å; Q572-R575 VanDerWaalsContact O-N 3.1Å
573	W	93.1	Very high	92.5	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.2	179.7	177.8	72.7	0	0	0	113.6	V567 M569 T570 R575 D578 A638 K641 I642	V567-W573 HydrophobicContact CG1-CB 4.03Å; V567-W573 WeakPolarHBondContact O-CB 3.21Å; M569-W573 HydrophobicContact SD-CH2 4.34Å; M569-W573 HydrophobicContact SD-CZ3 3.8Å; T570-W573 WeakPolarHBondContact O-CB 3.14Å; T570-W573 PolarHBondContact O-N 2.64Å; T570-W573 VanDerWaalsContact O-N 3.16Å; T570-W573 PolarHBondContact OG1-N 3.35Å; W573-R575 VanDerWaalsContact C-N 3.29Å; W573-R575 PolarHBondContact O-N 3.33Å; W573-D578 WeakPolarHBondContact O-CB 3.39Å; W573-A638 HydrophobicContact CH2-CB 3.88Å; W573-A638 HydrophobicContact CZ3-CB 3.68Å; W573-K641 VanDerWaalsContact CD1-CE 3.48Å; W573-K641 HydrophobicContact CD2-CD 4.23Å; W573-K641 HydrophobicContact CH2-CB 4.05Å; W573-K641 HydrophobicContact CZ2-CB 3.49Å; W573-K641 VanDerWaalsContact CZ2-CB 3.49Å; W573-K641 HydrophobicContact CZ2-CD 4.13Å; W573-K641 HydrophobicContact CZ2-CG 4.46Å; W573-K641 WeakPolarHBondContact O-CD 3.34Å; W573-K641 WeakPolarHBondContact O-CE 3.23Å; W573-K641 PolarHBondContact O-NZ 3.21Å; W573-I642 HydrophobicContact CH2-CD1 4.3Å; W573-I642 HydrophobicContact CH2-CG1 3.83Å; W573-I642 HydrophobicContact CZ2-CG1 4.11Å
574	L	90.9	Very high	92.8	Very high	17 Å²	17	52.2 Å²	52.2	9%	0.089	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.8	177.9	-63.8	173.7	0	0	0	114.3	Q572 P628 L629 D634 A638	Q572-L574 PolarHBondContact O-N 3.07Å; L574-P628 HydrophobicContact CD1-CB 4.19Å; L574-P628 HydrophobicContact CD1-CG 3.95Å; L574-L629 HydrophobicContact CD1-CD2 3.72Å; L574-L629 HydrophobicContact CD2-CD2 3.72Å; L574-L629 HydrophobicContact CG-CD2 4.31Å; L574-D634 HydrophobicContact CD1-CB 4.24Å; L574-A638 HydrophobicContact CD2-CB 4.19Å
575	R	91.6	Very high	92.8	Very high	144 Å²	144	52.8 Å²	52.8	54%	0.543	27%	0.274	S	S	.	.	S	Bend	trans	-70	145.9	-179.7	-62	179.7	178.4	175.8	0.8	110.8	Q572 W573 D577 D578	Q572-R575 WeakPolarHBondContact O-CB 2.96Å; Q572-R575 VanDerWaalsContact O-CG 3.32Å; Q572-R575 WeakPolarHBondContact O-CG 3.03Å; Q572-R575 PolarHBondContact O-N 3.39Å; Q572-R575 VanDerWaalsContact O-N 3.1Å; W573-R575 VanDerWaalsContact C-N 3.29Å; W573-R575 PolarHBondContact O-N 3.33Å; R575-D577 WeakPolarHBondContact CB-OD1 3.36Å; R575-D577 PolarHBondContact O-N 3.1Å; R575-D578 WeakPolarHBondContact O-CB 3.33Å; R575-D578 PolarHBondContact O-N 2.77Å; R575-D578 VanDerWaalsContact O-N 3.17Å
576	P	86.8	Confident	92.8	Very high	129 Å²	129	53.9 Å²	53.9	84%	0.838	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.5	179.5	-23.6	34.3	0	0	0	114.6
577	D	90.8	Very high	93	Very high	118 Å²	118	52.4 Å²	52.4	63%	0.631	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	9.1	179.7	63.5	-35.6	0	0	0	113.4	R575 M579	R575-D577 WeakPolarHBondContact CB-OD1 3.36Å; R575-D577 PolarHBondContact O-N 3.1Å; D577-M579 PolarHBondContact O-N 3.1Å
578	D	92.3	Very high	93.1	Very high	21 Å²	21	51.6 Å²	51.6	11%	0.112	27%	0.27	C	S	.	.			trans	-67.4	128.4	178.9	174.1	71.8	0	0	0	112	W573 R575 T580 K641	W573-D578 WeakPolarHBondContact O-CB 3.39Å; R575-D578 WeakPolarHBondContact O-CB 3.33Å; R575-D578 PolarHBondContact O-N 2.77Å; R575-D578 VanDerWaalsContact O-N 3.17Å; D578-T580 VanDerWaalsContact CG-OG1 3.26Å; D578-T580 PolarHBondContact OD1-OG1 3.32Å; D578-T580 VanDerWaalsContact OD2-CB 3.28Å; D578-T580 WeakPolarHBondContact OD2-CB 3.44Å; D578-T580 PolarHBondContact OD2-N 3.21Å; D578-T580 PolarHBondContact OD2-OG1 3.1Å; D578-K641 WeakPolarHBondContact OD2-CE 3.28Å; D578-K641 IonicContact OD2-NZ 3.28Å; D578-K641 PolarHBondContact OD2-NZ 3.35Å
579	M	93.4	Very high	93.2	Very high	80 Å²	80	53.1 Å²	53.1	39%	0.394	28%	0.283	S	S	.	.			trans	-111.1	21.6	-176.2	-64.3	-64.4	-74.2	0	0	112.7	D577 T581 Q582 Y583	D577-M579 PolarHBondContact O-N 3.1Å; M579-T581 VanDerWaalsContact C-N 3.33Å; M579-T581 PolarHBondContact O-N 3.34Å; M579-Q582 HydrophobicContact CE-CB 3.86Å; M579-Q582 HydrophobicContact CE-CG 3.66Å; M579-Q582 PolarHBondContact O-N 2.8Å; M579-Q582 PolarHBondContact O-OE1 2.83Å; M579-Q582 HydrophobicContact SD-CG 4.43Å; M579-Y583 HydrophobicContact CB-CD2 4.1Å; M579-Y583 HydrophobicContact CB-CE1 4.27Å; M579-Y583 HydrophobicContact CB-CE2 3.73Å; M579-Y583 WeakPolarHBondContact O-CD2 3.34Å; M579-Y583 PolarHBondContact O-N 3.22Å
580	T	93.2	Very high	93.4	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-53.7	-48	-172.3	-67.3	0	0	0	0	111.8	V564 I568 D578 Y583 L584	V564-T580 HydrophobicContact CG1-CG2 3.96Å; V564-T580 WeakPolarHBondContact CG1-O 3.42Å; I568-T580 HydrophobicContact CG1-CG2 4.02Å; D578-T580 VanDerWaalsContact CG-OG1 3.26Å; D578-T580 PolarHBondContact OD1-OG1 3.32Å; D578-T580 VanDerWaalsContact OD2-CB 3.28Å; D578-T580 WeakPolarHBondContact OD2-CB 3.44Å; D578-T580 PolarHBondContact OD2-N 3.21Å; D578-T580 PolarHBondContact OD2-OG1 3.1Å; T580-Y583 PolarHBondContact O-N 3.04Å; T580-L584 HydrophobicContact CG2-CD1 4.37Å; T580-L584 WeakPolarHBondContact O-CG 3.34Å; T580-L584 PolarHBondContact O-N 3.25Å
581	T	91.5	Very high	93.6	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-44	-179.2	-32.2	0	0	0	0	112.2	M579 Y583 L584 V585 D645 D648	M579-T581 VanDerWaalsContact C-N 3.33Å; M579-T581 PolarHBondContact O-N 3.34Å; T581-Y583 VanDerWaalsContact C-N 3.29Å; T581-Y583 PolarHBondContact O-N 2.84Å; T581-L584 PolarHBondContact O-N 2.73Å; T581-V585 WeakPolarHBondContact O-CG2 3.34Å; T581-V585 PolarHBondContact O-N 2.99Å; T581-D645 WeakPolarHBondContact CB-OD1 3.24Å; T581-D645 HydrophobicContact CG2-CB 4.05Å; T581-D645 WeakPolarHBondContact CG2-OD1 3.5Å; T581-D645 PolarHBondContact OG1-OD1 3.5Å; T581-D648 HydrophobicContact CG2-CB 3.98Å
582	Q	94.3	Very high	93.9	Very high	91 Å²	91	55.1 Å²	55.1	43%	0.425	28%	0.284	S	S	.	.	H	α-helix	trans	-65.5	-35.5	177.9	-62.6	86.4	-14.7	0	0	110.9	M579 G586	M579-Q582 HydrophobicContact CE-CB 3.86Å; M579-Q582 HydrophobicContact CE-CG 3.66Å; M579-Q582 PolarHBondContact O-N 2.8Å; M579-Q582 PolarHBondContact O-OE1 2.83Å; M579-Q582 HydrophobicContact SD-CG 4.43Å; Q582-G586 WeakPolarHBondContact O-CA 3.29Å; Q582-G586 PolarHBondContact O-N 3.47Å
583	Y	95.4	Very high	94.1	Very high	140 Å²	140	55.3 Å²	55.3	55%	0.549	29%	0.285	S	S	.	.	H	α-helix	trans	-69.1	-40.9	172.5	-65.5	-33.7	0	0	0	112.1	M579 T580 T581 T587	M579-Y583 HydrophobicContact CB-CD2 4.1Å; M579-Y583 HydrophobicContact CB-CE1 4.27Å; M579-Y583 HydrophobicContact CB-CE2 3.73Å; M579-Y583 WeakPolarHBondContact O-CD2 3.34Å; M579-Y583 PolarHBondContact O-N 3.22Å; T580-Y583 PolarHBondContact O-N 3.04Å; T581-Y583 VanDerWaalsContact C-N 3.29Å; T581-Y583 PolarHBondContact O-N 2.84Å; Y583-T587 VanDerWaalsContact O-CB 3.26Å; Y583-T587 WeakPolarHBondContact O-CB 3.29Å; Y583-T587 PolarHBondContact O-N 2.93Å; Y583-T587 PolarHBondContact O-OG1 3.34Å
584	L	95.6	Very high	94.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-51.8	174.9	-68.2	174	0	0	0	111.6	L561 V564 L565 T580 T581 L588 M614 L649	L561-L584 HydrophobicContact CD2-CD2 4.06Å; V564-L584 HydrophobicContact CB-CD2 3.79Å; V564-L584 HydrophobicContact CB-CG 4.46Å; V564-L584 HydrophobicContact CG1-CD2 3.6Å; V564-L584 HydrophobicContact CG1-CG 3.73Å; L565-L584 HydrophobicContact CD2-CD1 4.1Å; L565-L584 HydrophobicContact CD2-CD2 3.8Å; L565-L584 HydrophobicContact CG-CD2 3.78Å; T580-L584 HydrophobicContact CG2-CD1 4.37Å; T580-L584 WeakPolarHBondContact O-CG 3.34Å; T580-L584 PolarHBondContact O-N 3.25Å; T581-L584 PolarHBondContact O-N 2.73Å; L584-L588 WeakPolarHBondContact O-CB 3.45Å; L584-L588 WeakPolarHBondContact O-CG 3.38Å; L584-L588 PolarHBondContact O-N 3.46Å; L584-M614 HydrophobicContact CB-CE 4.41Å; L584-M614 HydrophobicContact CD2-CE 4.19Å; L584-M614 HydrophobicContact CD2-SD 4.33Å; L584-L649 HydrophobicContact CB-CD2 4.25Å; L584-L649 HydrophobicContact CD1-CD1 4.48Å
585	V	95.5	Very high	94.6	Very high	35 Å²	35	55.8 Å²	55.8	21%	0.212	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-41.6	179.9	174	0	0	0	0	111.2	T581 L588 A589 L649 Y652	T581-V585 WeakPolarHBondContact O-CG2 3.34Å; T581-V585 PolarHBondContact O-N 2.99Å; V585-L588 PolarHBondContact O-N 3Å; V585-A589 WeakPolarHBondContact O-CB 3.3Å; V585-A589 PolarHBondContact O-N 3.21Å; V585-L649 HydrophobicContact CG2-CD2 4.04Å; V585-Y652 HydrophobicContact CG1-CD2 3.66Å; V585-Y652 HydrophobicContact CG1-CE2 4.18Å; V585-Y652 HydrophobicContact CG1-CG 4.1Å
586	G	95.8	Very high	94.8	Very high	27 Å²	27	53 Å²	53	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-47.5	178.2	0	0	0	0	0	112.2	Q582 L588 A589 D590	Q582-G586 WeakPolarHBondContact O-CA 3.29Å; Q582-G586 PolarHBondContact O-N 3.47Å; G586-L588 VanDerWaalsContact C-N 3.35Å; G586-L588 PolarHBondContact O-N 2.93Å; G586-A589 PolarHBondContact O-N 3.43Å; G586-A589 VanDerWaalsContact O-N 3.16Å; G586-D590 PolarHBondContact O-N 3.07Å
587	T	95.9	Very high	95.3	Very high	32 Å²	32	48.5 Å²	48.5	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-40	175.8	-61.4	0	0	0	0	112	L561 Y583 A589 D590 Y591	L561-T587 HydrophobicContact CD2-CG2 3.63Å; L561-T587 HydrophobicContact CG-CG2 4.12Å; Y583-T587 VanDerWaalsContact O-CB 3.26Å; Y583-T587 WeakPolarHBondContact O-CB 3.29Å; Y583-T587 PolarHBondContact O-N 2.93Å; Y583-T587 PolarHBondContact O-OG1 3.34Å; T587-A589 VanDerWaalsContact C-N 3.35Å; T587-D590 PolarHBondContact O-N 3.46Å; T587-Y591 HydrophobicContact CG2-CD2 3.79Å; T587-Y591 HydrophobicContact CG2-CE2 3.82Å; T587-Y591 VanDerWaalsContact O-CD2 3.29Å; T587-Y591 WeakPolarHBondContact O-CD2 3.49Å; T587-Y591 PolarHBondContact O-N 2.97Å
588	L	96.5	Very high	95.6	Very high	3 Å²	3	43 Å²	43	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-44.3	172.3	-79.5	172.7	0	0	0	111.8	V557 L561 L584 V585 G586 Y591 D592 M614 L649 Y652 F653	V557-L588 HydrophobicContact CG1-CD2 4.39Å; L561-L588 HydrophobicContact CD1-CD2 3.92Å; L561-L588 HydrophobicContact CD1-CG 4.31Å; L561-L588 HydrophobicContact CD2-CG 4.45Å; L584-L588 WeakPolarHBondContact O-CB 3.45Å; L584-L588 WeakPolarHBondContact O-CG 3.38Å; L584-L588 PolarHBondContact O-N 3.46Å; V585-L588 PolarHBondContact O-N 3Å; G586-L588 VanDerWaalsContact C-N 3.35Å; G586-L588 PolarHBondContact O-N 2.93Å; L588-Y591 PolarHBondContact O-N 3.37Å; L588-D592 VanDerWaalsContact O-CB 3.31Å; L588-D592 WeakPolarHBondContact O-CB 3.49Å; L588-D592 PolarHBondContact O-N 2.88Å; L588-M614 HydrophobicContact CD1-CE 3.58Å; L588-M614 HydrophobicContact CD2-CE 4.3Å; L588-M614 HydrophobicContact CG-CE 3.98Å; L588-L649 HydrophobicContact CD1-CD2 4.34Å; L588-Y652 HydrophobicContact CB-CD1 4.42Å; L588-Y652 HydrophobicContact CB-CE1 3.78Å; L588-Y652 HydrophobicContact CD1-CD1 4.21Å; L588-Y652 HydrophobicContact CD1-CE1 4.3Å; L588-F653 HydrophobicContact CD1-CE1 4.16Å; L588-F653 HydrophobicContact CD1-CE2 4Å; L588-F653 HydrophobicContact CD1-CZ 3.5Å; L588-F653 VanDerWaalsContact CD1-CZ 3.5Å; L588-F653 HydrophobicContact CD2-CE1 4.48Å; L588-F653 HydrophobicContact CD2-CZ 4.26Å
589	A	96.3	Very high	95.8	Very high	32 Å²	32	44.7 Å²	44.7	26%	0.264	22%	0.224	S	C	.	.	H	α-helix	trans	-63.2	-42.4	178.2	0	0	0	0	0	113	V585 G586 T587 Y591 D592 E593 Y652	V585-A589 WeakPolarHBondContact O-CB 3.3Å; V585-A589 PolarHBondContact O-N 3.21Å; G586-A589 PolarHBondContact O-N 3.43Å; G586-A589 VanDerWaalsContact O-N 3.16Å; T587-A589 VanDerWaalsContact C-N 3.35Å; A589-Y591 VanDerWaalsContact C-N 3.32Å; A589-Y591 PolarHBondContact O-N 2.8Å; A589-D592 PolarHBondContact O-N 3.07Å; A589-E593 PolarHBondContact O-N 3.31Å; A589-Y652 WeakPolarHBondContact CA-OH 3.18Å; A589-Y652 HydrophobicContact CB-CE2 4.05Å; A589-Y652 PolarHBondContact N-OH 2.94Å
590	D	96.6	Very high	95.8	Very high	121 Å²	121	46.7 Å²	46.7	65%	0.647	23%	0.232	S	C	*	.	H	α-helix	trans	-62.6	-41.8	176.5	-66.4	-23.2	0	0	0	111	G586 T587	G586-D590 PolarHBondContact O-N 3.07Å; T587-D590 PolarHBondContact O-N 3.46Å
591	Y	97	Very high	95.8	Very high	40 Å²	40	50.2 Å²	50.2	16%	0.157	25%	0.251	C	S	.	.	H	α-helix	trans	-70.6	-38.7	176	-85.6	-62	0	0	0	112.9	I496 V557 D560 T587 L588 A589 E593 T594 L595	I496-Y591 HydrophobicContact CD1-CD1 3.65Å; I496-Y591 HydrophobicContact CD1-CE1 3.3Å; V557-Y591 HydrophobicContact CB-CD2 4.34Å; V557-Y591 HydrophobicContact CG1-CD2 3.99Å; V557-Y591 HydrophobicContact CG1-CG 4.38Å; V557-Y591 HydrophobicContact CG2-CD1 3.9Å; V557-Y591 HydrophobicContact CG2-CD2 4.06Å; V557-Y591 HydrophobicContact CG2-CE1 4.33Å; V557-Y591 HydrophobicContact CG2-CE2 4.46Å; V557-Y591 HydrophobicContact CG2-CG 3.76Å; D560-Y591 HydrophobicContact CB-CE2 4.33Å; D560-Y591 PolarHBondContact OD2-OH 2.98Å; T587-Y591 HydrophobicContact CG2-CD2 3.79Å; T587-Y591 HydrophobicContact CG2-CE2 3.82Å; T587-Y591 VanDerWaalsContact O-CD2 3.29Å; T587-Y591 WeakPolarHBondContact O-CD2 3.49Å; T587-Y591 PolarHBondContact O-N 2.97Å; L588-Y591 PolarHBondContact O-N 3.37Å; A589-Y591 VanDerWaalsContact C-N 3.32Å; A589-Y591 PolarHBondContact O-N 2.8Å; Y591-E593 PolarHBondContact O-N 3.1Å; Y591-T594 WeakPolarHBondContact O-CA 3.48Å; Y591-T594 WeakPolarHBondContact O-CB 3.33Å; Y591-T594 PolarHBondContact O-N 3.04Å; Y591-L595 WeakPolarHBondContact O-CG 3.4Å; Y591-L595 PolarHBondContact O-N 3.25Å
592	D	97.2	Very high	96.1	Very high	15 Å²	15	50.2 Å²	50.2	8%	0.08	25%	0.25	C	S	.	.	H	α-helix	trans	-61.2	-29.3	-178.7	-168.6	43.5	0	0	0	112.5	L588 A589 T594 L595 K596 Y603	L588-D592 VanDerWaalsContact O-CB 3.31Å; L588-D592 WeakPolarHBondContact O-CB 3.49Å; L588-D592 PolarHBondContact O-N 2.88Å; A589-D592 PolarHBondContact O-N 3.07Å; D592-T594 PolarHBondContact O-N 3.48Å; D592-L595 PolarHBondContact O-N 3.42Å; D592-K596 WeakPolarHBondContact O-CB 3.38Å; D592-K596 WeakPolarHBondContact O-CG 3.33Å; D592-K596 PolarHBondContact O-N 3.06Å; D592-K596 VanDerWaalsContact O-N 3.07Å; D592-Y603 WeakPolarHBondContact OD1-CE2 3.31Å; D592-Y603 PolarHBondContact OD1-OH 3.34Å; D592-Y603 PolarHBondContact OD2-OH 3.35Å
593	E	95.9	Very high	96.2	Very high	110 Å²	110	46.9 Å²	46.9	51%	0.514	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-29.7	170.4	-70.7	-60	109.1	0	0	113	A589 Y591 K596 H597	A589-E593 PolarHBondContact O-N 3.31Å; Y591-E593 PolarHBondContact O-N 3.1Å; E593-K596 VanDerWaalsContact O-CE 3.27Å; E593-K596 WeakPolarHBondContact O-CE 3.44Å; E593-K596 IonicContact OE1-NZ 3.96Å; E593-K596 PolarHBondContact OE1-NZ 3.25Å; E593-K596 IonicContact OE2-NZ 2.95Å; E593-K596 PolarHBondContact OE2-NZ 3.24Å; E593-H597 PolarHBondContact O-CD2 2.92Å; E593-H597 PolarHBondContact O-NE2 3.21Å
594	T	97.1	Very high	96.2	Very high	25 Å²	25	43.2 Å²	43.2	15%	0.153	22%	0.224	C	C	.	.	H	α-helix	trans	-89.6	-44.2	173.2	-59.6	0	0	0	0	111.7	Y426 I496 E497 L500 Y591 D592 K596 H597	Y426-T594 HydrophobicContact CE2-CG2 3.83Å; Y426-T594 WeakPolarHBondContact CE2-O 3.45Å; I496-T594 HydrophobicContact CB-CG2 4.46Å; I496-T594 HydrophobicContact CG2-CG2 3.88Å; E497-T594 HydrophobicContact CG-CG2 3.73Å; L500-T594 HydrophobicContact CD1-CG2 4.35Å; Y591-T594 WeakPolarHBondContact O-CA 3.48Å; Y591-T594 WeakPolarHBondContact O-CB 3.33Å; Y591-T594 PolarHBondContact O-N 3.04Å; D592-T594 PolarHBondContact O-N 3.48Å; T594-K596 VanDerWaalsContact C-N 3.31Å; T594-K596 PolarHBondContact O-N 3.35Å; T594-H597 PolarHBondContact O-N 3.06Å
595	L	98	Very high	96.2	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-33.6	-171.9	-61.6	172.3	0	0	0	112.8	I496 L500 A553 V557 Y591 D592 H597 T598 Y603 L606 L610	I496-L595 HydrophobicContact CG2-CD2 4.03Å; L500-L595 HydrophobicContact CD1-CD2 4.11Å; A553-L595 HydrophobicContact CB-CD2 4.28Å; V557-L595 HydrophobicContact CG2-CD1 4.34Å; Y591-L595 WeakPolarHBondContact O-CG 3.4Å; Y591-L595 PolarHBondContact O-N 3.25Å; D592-L595 PolarHBondContact O-N 3.42Å; L595-H597 PolarHBondContact O-N 2.89Å; L595-T598 VanDerWaalsContact O-CG2 3.29Å; L595-T598 WeakPolarHBondContact O-CG2 3.23Å; L595-T598 PolarHBondContact O-N 3.04Å; L595-T598 VanDerWaalsContact O-N 3.1Å; L595-Y603 HydrophobicContact CB-CE2 4.25Å; L595-Y603 WeakPolarHBondContact O-CD2 3.21Å; L595-L606 HydrophobicContact CB-CD2 4.24Å; L595-L606 HydrophobicContact CD1-CD2 4.37Å; L595-L606 HydrophobicContact CD2-CD2 3.62Å; L595-L606 HydrophobicContact CG-CD2 4.26Å; L595-L610 HydrophobicContact CD1-CD1 3.56Å
596	K	96.1	Very high	96.3	Very high	85 Å²	85	45.1 Å²	45.1	37%	0.37	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.7	179.2	71	-172.1	177.6	-169	0	115	D592 E593 T594 T598 Y603	D592-K596 WeakPolarHBondContact O-CB 3.38Å; D592-K596 WeakPolarHBondContact O-CG 3.33Å; D592-K596 PolarHBondContact O-N 3.06Å; D592-K596 VanDerWaalsContact O-N 3.07Å; E593-K596 VanDerWaalsContact O-CE 3.27Å; E593-K596 WeakPolarHBondContact O-CE 3.44Å; E593-K596 IonicContact OE1-NZ 3.96Å; E593-K596 PolarHBondContact OE1-NZ 3.25Å; E593-K596 IonicContact OE2-NZ 2.95Å; E593-K596 PolarHBondContact OE2-NZ 3.24Å; T594-K596 VanDerWaalsContact C-N 3.31Å; T594-K596 PolarHBondContact O-N 3.35Å; K596-T598 VanDerWaalsContact C-N 3.25Å; K596-T598 PolarHBondContact O-N 3.48Å; K596-Y603 HydrophobicContact CB-CE2 4.11Å
597	H	97.4	Very high	96.4	Very high	34 Å²	34	43.9 Å²	43.9	16%	0.157	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	14.5	175.9	-63.3	-59.5	0	0	0	113	L420 S424 N425 Y426 N504 E593 T594 L595	L420-H597 HydrophobicContact CD2-CB 3.85Å; L420-H597 WeakPolarHBondContact CD2-ND1 3.43Å; S424-H597 PolarHBondContact O-ND1 2.81Å; N425-H597 CarbonylContact C-O 3.59Å; N425-H597 WeakPolarHBondContact CA-O 3.49Å; Y426-H597 HydrophobicContact CD1-CB 4.41Å; Y426-H597 HydrophobicContact CD2-CB 3.42Å; Y426-H597 VanDerWaalsContact CD2-CB 3.42Å; Y426-H597 HydrophobicContact CE1-CB 4.36Å; Y426-H597 HydrophobicContact CE2-CB 3.37Å; Y426-H597 AromaticContact CE2-CD2 3.96Å; Y426-H597 AromaticContact CE2-CG 3.99Å; Y426-H597 HydrophobicContact CG-CB 3.95Å; Y426-H597 AromaticContact CZ-CD2 3.72Å; Y426-H597 PolarHBondContact N-O 3.36Å; Y426-H597 PolarHBondContact OH-CD2 3.28Å; N504-H597 PolarHBondContact ND2-O 3.17Å; N504-H597 VanDerWaalsContact ND2-O 3.11Å; E593-H597 PolarHBondContact O-CD2 2.92Å; E593-H597 PolarHBondContact O-NE2 3.21Å; T594-H597 PolarHBondContact O-N 3.06Å; L595-H597 PolarHBondContact O-N 2.89Å
598	T	96.7	Very high	96.4	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	22%	0.217	C	C	.	.	S	Bend	trans	-92.2	155	163.2	-164.5	0	0	0	0	110.8	N425 N504 L595 K596 Q600 L602 Y603	N425-T598 VanDerWaalsContact OD1-C 3.3Å; N425-T598 PolarHBondContact OD1-O 3Å; N504-T598 WeakPolarHBondContact OD1-CA 3.4Å; N504-T598 PolarHBondContact OD1-OG1 3.11Å; L595-T598 VanDerWaalsContact O-CG2 3.29Å; L595-T598 WeakPolarHBondContact O-CG2 3.23Å; L595-T598 PolarHBondContact O-N 3.04Å; L595-T598 VanDerWaalsContact O-N 3.1Å; K596-T598 VanDerWaalsContact C-N 3.25Å; K596-T598 PolarHBondContact O-N 3.48Å; T598-Q600 PolarHBondContact O-N 2.78Å; T598-L602 HydrophobicContact CG2-CB 4.21Å; T598-Y603 VanDerWaalsContact CG2-CA 3.41Å; T598-Y603 VanDerWaalsContact CG2-CB 3.49Å; T598-Y603 HydrophobicContact CG2-CD2 4.15Å; T598-Y603 HydrophobicContact CG2-CG 4.33Å; T598-Y603 VanDerWaalsContact CG2-N 3.35Å
599	R	95.4	Very high	96.3	Very high	57 Å²	57	48.1 Å²	48.1	22%	0.215	23%	0.233	C	C	.	.			trans	-53.8	139.1	175.9	-74.2	177.2	163.6	-154.8	-8.5	110.3	N425 N504 C507 M508 N601 L602 Y603	N425-R599 PolarHBondContact OD1-N 2.99Å; N504-R599 HydrophobicContact CB-CG 4.34Å; N504-R599 PolarHBondContact OD1-N 3.41Å; C507-R599 VanDerWaalsContact CB-NH1 3.25Å; C507-R599 PolarHBondContact O-NH1 3.01Å; M508-R599 PolarHBondContact SD-NH2 3.05Å; R599-N601 VanDerWaalsContact C-N 3.25Å; R599-N601 WeakPolarHBondContact CB-OD1 3.45Å; R599-N601 PolarHBondContact O-N 3.28Å; R599-L602 WeakPolarHBondContact O-CA 3.08Å; R599-L602 WeakPolarHBondContact O-CB 3.12Å; R599-L602 PolarHBondContact O-N 3.34Å; R599-Y603 PolarHBondContact O-N 3.36Å
600	Q	94.9	Very high	96.4	Very high	123 Å²	123	46.6 Å²	46.6	58%	0.575	22%	0.22	S	C	*	.	H	α-helix	trans	-49.3	-43.1	-171.6	-169.5	65.6	52.7	0	0	114	T598 L602 Y603 D604	T598-Q600 PolarHBondContact O-N 2.78Å; Q600-L602 VanDerWaalsContact C-N 3.27Å; Q600-L602 PolarHBondContact O-N 3.3Å; Q600-Y603 PolarHBondContact O-N 2.94Å; Q600-D604 PolarHBondContact NE2-OD1 3.08Å; Q600-D604 PolarHBondContact O-N 2.98Å
601	N	93.4	Very high	96.4	Very high	77 Å²	77	40.8 Å²	40.8	41%	0.412	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-31.1	179.6	65.6	-37.9	0	0	0	113.7	R599 K605	R599-N601 VanDerWaalsContact C-N 3.25Å; R599-N601 WeakPolarHBondContact CB-OD1 3.45Å; R599-N601 PolarHBondContact O-N 3.28Å; N601-K605 WeakPolarHBondContact O-CG 3.43Å
602	L	96.6	Very high	96.4	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-82.3	-38.1	173.9	-66.2	179.6	0	0	0	110.9	A503 A546 E547 I550 T598 R599 Q600 D604 K605 L606	A503-L602 HydrophobicContact CB-CD1 4.06Å; A546-L602 HydrophobicContact CB-CD1 4.28Å; A546-L602 HydrophobicContact CB-CD2 4.33Å; E547-L602 HydrophobicContact CG-CD2 4.23Å; I550-L602 HydrophobicContact CD1-CB 4.34Å; I550-L602 HydrophobicContact CD1-CD2 4.21Å; I550-L602 HydrophobicContact CG2-CB 4.25Å; I550-L602 HydrophobicContact CG2-CD1 4.34Å; T598-L602 HydrophobicContact CG2-CB 4.21Å; R599-L602 WeakPolarHBondContact O-CA 3.08Å; R599-L602 WeakPolarHBondContact O-CB 3.12Å; R599-L602 PolarHBondContact O-N 3.34Å; Q600-L602 VanDerWaalsContact C-N 3.27Å; Q600-L602 PolarHBondContact O-N 3.3Å; L602-D604 PolarHBondContact O-N 3.25Å; L602-K605 PolarHBondContact O-N 3.13Å; L602-L606 WeakPolarHBondContact O-CB 3.45Å; L602-L606 PolarHBondContact O-N 2.82Å
603	Y	97.4	Very high	96.3	Very high	22 Å²	22	43.5 Å²	43.5	9%	0.086	20%	0.2	C	C	.	.	H	α-helix	trans	-59.1	-48.2	177.3	-179.6	-100.1	0	0	0	110.9	D592 L595 K596 T598 R599 Q600 K605 L606 A607	D592-Y603 WeakPolarHBondContact OD1-CE2 3.31Å; D592-Y603 PolarHBondContact OD1-OH 3.34Å; D592-Y603 PolarHBondContact OD2-OH 3.35Å; L595-Y603 HydrophobicContact CB-CE2 4.25Å; L595-Y603 WeakPolarHBondContact O-CD2 3.21Å; K596-Y603 HydrophobicContact CB-CE2 4.11Å; T598-Y603 VanDerWaalsContact CG2-CA 3.41Å; T598-Y603 VanDerWaalsContact CG2-CB 3.49Å; T598-Y603 HydrophobicContact CG2-CD2 4.15Å; T598-Y603 HydrophobicContact CG2-CG 4.33Å; T598-Y603 VanDerWaalsContact CG2-N 3.35Å; R599-Y603 PolarHBondContact O-N 3.36Å; Q600-Y603 PolarHBondContact O-N 2.94Å; Y603-K605 VanDerWaalsContact C-N 3.27Å; Y603-K605 PolarHBondContact O-N 2.89Å; Y603-L606 PolarHBondContact O-N 3.03Å; Y603-L606 VanDerWaalsContact O-N 3.09Å; Y603-A607 HydrophobicContact CE1-CB 4.43Å; Y603-A607 WeakPolarHBondContact O-CB 3.48Å; Y603-A607 PolarHBondContact O-N 3.17Å
604	D	95.9	Very high	96.4	Very high	63 Å²	63	38.3 Å²	38.3	34%	0.337	18%	0.176	S	C	.	.	H	α-helix	trans	-57.6	-43	179.4	-63.8	-18.9	0	0	0	111.2	Q600 L602 E608	Q600-D604 PolarHBondContact NE2-OD1 3.08Å; Q600-D604 PolarHBondContact O-N 2.98Å; L602-D604 PolarHBondContact O-N 3.25Å; D604-E608 WeakPolarHBondContact O-CB 3.46Å; D604-E608 WeakPolarHBondContact O-CG 3.46Å; D604-E608 PolarHBondContact O-N 2.9Å
605	K	95.5	Very high	96.4	Very high	74 Å²	74	37.1 Å²	37.1	32%	0.322	17%	0.169	S	C	.	.	H	α-helix	trans	-67.1	-40.1	176.8	-71.1	178.9	-179.5	179.8	0	112.2	E547 I550 N601 L602 Y603 K609	E547-K605 HydrophobicContact CG-CD 4.1Å; E547-K605 IonicContact OE1-NZ 3.44Å; E547-K605 PolarHBondContact OE1-NZ 2.81Å; E547-K605 IonicContact OE2-NZ 2.67Å; I550-K605 HydrophobicContact CD1-CB 4.12Å; N601-K605 WeakPolarHBondContact O-CG 3.43Å; L602-K605 PolarHBondContact O-N 3.13Å; Y603-K605 VanDerWaalsContact C-N 3.27Å; Y603-K605 PolarHBondContact O-N 2.89Å; K605-K609 WeakPolarHBondContact O-CG 3.41Å; K605-K609 PolarHBondContact O-N 2.9Å
606	L	97.2	Very high	96.3	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-45.2	178.3	179.8	56.5	0	0	0	111.2	L500 I550 E554 L595 L602 Y603 E608 K609 L610	L500-L606 HydrophobicContact CD2-CD2 4.33Å; I550-L606 HydrophobicContact CB-CD1 4.48Å; I550-L606 HydrophobicContact CD1-CB 4.25Å; I550-L606 WeakPolarHBondContact O-CD1 3.14Å; E554-L606 HydrophobicContact CB-CD1 3.81Å; L595-L606 HydrophobicContact CB-CD2 4.24Å; L595-L606 HydrophobicContact CD1-CD2 4.37Å; L595-L606 HydrophobicContact CD2-CD2 3.62Å; L595-L606 HydrophobicContact CG-CD2 4.26Å; L602-L606 WeakPolarHBondContact O-CB 3.45Å; L602-L606 PolarHBondContact O-N 2.82Å; Y603-L606 PolarHBondContact O-N 3.03Å; Y603-L606 VanDerWaalsContact O-N 3.09Å; L606-E608 VanDerWaalsContact C-N 3.34Å; L606-E608 PolarHBondContact O-N 3.12Å; L606-K609 WeakPolarHBondContact O-CB 3.47Å; L606-K609 PolarHBondContact O-N 3.09Å; L606-L610 HydrophobicContact CD1-CD1 4.22Å; L606-L610 HydrophobicContact CD1-CG 4.24Å; L606-L610 HydrophobicContact CG-CD1 4.03Å; L606-L610 WeakPolarHBondContact O-CB 3.38Å; L606-L610 VanDerWaalsContact O-CG 3.3Å; L606-L610 WeakPolarHBondContact O-CG 3.39Å; L606-L610 PolarHBondContact O-N 3.28Å
607	A	97.3	Very high	96.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-43.2	176.8	0	0	0	0	0	111.5	Y603 L610 A611 M657 V659	Y603-A607 HydrophobicContact CE1-CB 4.43Å; Y603-A607 WeakPolarHBondContact O-CB 3.48Å; Y603-A607 PolarHBondContact O-N 3.17Å; A607-L610 PolarHBondContact O-N 3Å; A607-A611 WeakPolarHBondContact O-CB 3.5Å; A607-A611 PolarHBondContact O-N 3.44Å; A607-M657 HydrophobicContact CB-CB 4.27Å; A607-M657 HydrophobicContact CB-CE 3.95Å; A607-V659 HydrophobicContact CB-CG2 3.82Å
608	E	95.4	Very high	96.3	Very high	42 Å²	42	33.2 Å²	33.2	20%	0.196	15%	0.152	C	C	.	.	H	α-helix	trans	-59.7	-45.9	173.4	-78.2	170.9	-157.9	0	0	112.3	D604 L606 A611 E612 V659 K660 V663	D604-E608 WeakPolarHBondContact O-CB 3.46Å; D604-E608 WeakPolarHBondContact O-CG 3.46Å; D604-E608 PolarHBondContact O-N 2.9Å; L606-E608 VanDerWaalsContact C-N 3.34Å; L606-E608 PolarHBondContact O-N 3.12Å; E608-A611 PolarHBondContact O-N 2.79Å; E608-E612 WeakPolarHBondContact O-CB 3.27Å; E608-E612 PolarHBondContact O-N 3.03Å; E608-V659 HydrophobicContact CG-CG1 4.03Å; E608-K660 WeakPolarHBondContact OE1-CD 3.26Å; E608-K660 WeakPolarHBondContact OE1-CE 3.44Å; E608-K660 WeakPolarHBondContact OE1-CG 3.39Å; E608-K660 IonicContact OE1-NZ 3.77Å; E608-K660 PolarHBondContact OE1-NZ 3.37Å; E608-K660 IonicContact OE2-NZ 2.56Å; E608-K660 PolarHBondContact OE2-NZ 2.85Å; E608-V663 HydrophobicContact CG-CG2 4.44Å
609	K	95.1	Very high	96.3	Very high	81 Å²	81	33.2 Å²	33.2	35%	0.352	15%	0.152	S	C	.	.	H	α-helix	trans	-62.2	-42.5	176.9	-77.6	172.5	167.1	-71.1	0	112.5	E554 K605 L606 R613	E554-K609 HydrophobicContact CG-CB 4.4Å; K605-K609 WeakPolarHBondContact O-CG 3.41Å; K605-K609 PolarHBondContact O-N 2.9Å; L606-K609 WeakPolarHBondContact O-CB 3.47Å; L606-K609 PolarHBondContact O-N 3.09Å; K609-R613 VanDerWaalsContact O-CB 3.29Å; K609-R613 WeakPolarHBondContact O-CB 3.32Å; K609-R613 PolarHBondContact O-N 3.02Å
610	L	97.9	Very high	96.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-45.3	178	-72.5	168.6	0	0	0	111.5	E554 V557 F558 L595 L606 A607 M614 F653 M657	E554-L610 HydrophobicContact CB-CD2 4.39Å; E554-L610 HydrophobicContact CG-CD2 3.84Å; E554-L610 HydrophobicContact CG-CG 4.37Å; V557-L610 HydrophobicContact CB-CD2 4.04Å; V557-L610 HydrophobicContact CG1-CD2 3.8Å; V557-L610 HydrophobicContact CG2-CD2 4.46Å; F558-L610 HydrophobicContact CD2-CD2 4.19Å; F558-L610 HydrophobicContact CE2-CD2 3.72Å; L595-L610 HydrophobicContact CD1-CD1 3.56Å; L606-L610 HydrophobicContact CD1-CD1 4.22Å; L606-L610 HydrophobicContact CD1-CG 4.24Å; L606-L610 HydrophobicContact CG-CD1 4.03Å; L606-L610 WeakPolarHBondContact O-CB 3.38Å; L606-L610 VanDerWaalsContact O-CG 3.3Å; L606-L610 WeakPolarHBondContact O-CG 3.39Å; L606-L610 PolarHBondContact O-N 3.28Å; A607-L610 PolarHBondContact O-N 3Å; L610-M614 WeakPolarHBondContact O-CB 3.35Å; L610-M614 PolarHBondContact O-N 2.73Å; L610-F653 HydrophobicContact CB-CE1 4.25Å; L610-M657 HydrophobicContact CD1-CE 3.86Å
611	A	97.2	Very high	96.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-47.5	176.7	0	0	0	0	0	111.9	A607 E608 R613 M614 L615 F653 V659 V663 Y667	A607-A611 WeakPolarHBondContact O-CB 3.5Å; A607-A611 PolarHBondContact O-N 3.44Å; E608-A611 PolarHBondContact O-N 2.79Å; A611-R613 PolarHBondContact O-N 3.33Å; A611-M614 PolarHBondContact O-N 3.02Å; A611-L615 PolarHBondContact O-N 2.85Å; A611-L615 VanDerWaalsContact O-N 3.14Å; A611-F653 HydrophobicContact CB-CB 4.31Å; A611-F653 HydrophobicContact CB-CD1 3.64Å; A611-F653 HydrophobicContact CB-CD2 4.08Å; A611-F653 HydrophobicContact CB-CE1 3.88Å; A611-F653 HydrophobicContact CB-CE2 4.33Å; A611-F653 HydrophobicContact CB-CG 3.75Å; A611-F653 HydrophobicContact CB-CZ 4.22Å; A611-V659 HydrophobicContact CB-CG1 3.98Å; A611-V659 HydrophobicContact CB-CG2 4.08Å; A611-V663 HydrophobicContact CB-CG1 3.87Å; A611-Y667 HydrophobicContact CB-CE2 4.42Å; A611-Y667 PolarHBondContact O-OH 3.5Å
612	E	95.8	Very high	96.3	Very high	47 Å²	47	23.1 Å²	23.1	22%	0.22	10%	0.104	C	C	.	.	H	α-helix	trans	-56.8	-52.5	176.6	176	172.8	175.2	0	0	111.6	E608 M614 L615 I616 F739 R744	E608-E612 WeakPolarHBondContact O-CB 3.27Å; E608-E612 PolarHBondContact O-N 3.03Å; E612-M614 VanDerWaalsContact C-N 3.35Å; E612-M614 PolarHBondContact O-N 3.37Å; E612-L615 PolarHBondContact O-N 3.4Å; E612-I616 HydrophobicContact CG-CD1 3.83Å; E612-I616 WeakPolarHBondContact O-CG1 3.47Å; E612-I616 PolarHBondContact O-N 3.05Å; E612-F739 HydrophobicContact CB-CE1 4.41Å; E612-F739 HydrophobicContact CB-CZ 3.84Å; E612-F739 HydrophobicContact CG-CE1 3.98Å; E612-F739 HydrophobicContact CG-CZ 3.63Å; E612-R744 WeakPolarHBondContact OE1-CD 3.37Å; E612-R744 IonicContact OE1-CZ 2.63Å; E612-R744 IonicContact OE1-NE 3.68Å; E612-R744 IonicContact OE1-NH1 3.74Å; E612-R744 PolarHBondContact OE1-NH1 3.19Å; E612-R744 IonicContact OE2-CZ 3.36Å; E612-R744 IonicContact OE2-NH1 2.73Å; E612-R744 PolarHBondContact OE2-NH1 2.88Å
613	R	96.2	Very high	96.1	Very high	65 Å²	65	24.2 Å²	24.2	25%	0.245	11%	0.11	C	C	.	.	H	α-helix	trans	-68.5	-34.9	-176.2	-172.9	168.7	-178.5	176.1	2.5	112.3	E554 F558 K609 A611 L615 I616 E617	E554-R613 WeakPolarHBondContact OE1-CD 3.44Å; E554-R613 IonicContact OE1-CZ 3.63Å; E554-R613 IonicContact OE1-NE 2.8Å; E554-R613 IonicContact OE1-NH1 3.35Å; E554-R613 PolarHBondContact OE1-NH1 3.17Å; F558-R613 HydrophobicContact CD1-CG 4.1Å; F558-R613 HydrophobicContact CD2-CB 4.43Å; F558-R613 HydrophobicContact CD2-CG 4.04Å; F558-R613 HydrophobicContact CE1-CB 4.21Å; F558-R613 HydrophobicContact CE1-CG 3.74Å; F558-R613 HydrophobicContact CE2-CB 3.62Å; F558-R613 HydrophobicContact CE2-CG 3.65Å; F558-R613 HydrophobicContact CG-CG 4.26Å; F558-R613 HydrophobicContact CZ-CB 3.52Å; F558-R613 HydrophobicContact CZ-CG 3.52Å; K609-R613 VanDerWaalsContact O-CB 3.29Å; K609-R613 WeakPolarHBondContact O-CB 3.32Å; K609-R613 PolarHBondContact O-N 3.02Å; A611-R613 PolarHBondContact O-N 3.33Å; R613-L615 VanDerWaalsContact C-N 3.34Å; R613-L615 PolarHBondContact O-N 3.49Å; R613-I616 PolarHBondContact O-N 3.38Å; R613-E617 HydrophobicContact CG-CG 4.2Å; R613-E617 WeakPolarHBondContact O-CG 3.22Å; R613-E617 PolarHBondContact O-N 3.01Å
614	M	97.6	Very high	95.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-46.5	176.3	177.1	63.3	85	0	0	110.4	F558 L561 L565 L584 L588 L610 A611 E612 E617 Y618 L649 F653	F558-M614 HydrophobicContact CZ-CB 4.13Å; F558-M614 VanDerWaalsContact CZ-N 3.34Å; L561-M614 HydrophobicContact CD1-CE 3.62Å; L561-M614 HydrophobicContact CD2-CE 4.02Å; L561-M614 HydrophobicContact CG-CE 4.34Å; L565-M614 HydrophobicContact CD1-SD 4.39Å; L565-M614 HydrophobicContact CD2-SD 3.96Å; L584-M614 HydrophobicContact CB-CE 4.41Å; L584-M614 HydrophobicContact CD2-CE 4.19Å; L584-M614 HydrophobicContact CD2-SD 4.33Å; L588-M614 HydrophobicContact CD1-CE 3.58Å; L588-M614 HydrophobicContact CD2-CE 4.3Å; L588-M614 HydrophobicContact CG-CE 3.98Å; L610-M614 WeakPolarHBondContact O-CB 3.35Å; L610-M614 PolarHBondContact O-N 2.73Å; A611-M614 PolarHBondContact O-N 3.02Å; E612-M614 VanDerWaalsContact C-N 3.35Å; E612-M614 PolarHBondContact O-N 3.37Å; M614-E617 PolarHBondContact O-N 2.97Å; M614-Y618 WeakPolarHBondContact O-CB 3.5Å; M614-Y618 PolarHBondContact O-N 3.27Å; M614-L649 HydrophobicContact CE-CD2 4.41Å; M614-L649 HydrophobicContact CG-CD1 4.17Å; M614-L649 HydrophobicContact CG-CD2 4.28Å; M614-F653 HydrophobicContact CB-CE2 4.05Å; M614-F653 HydrophobicContact CB-CZ 4Å; M614-F653 HydrophobicContact CG-CE2 3.97Å; M614-F653 HydrophobicContact CG-CZ 4.24Å
615	L	96.9	Very high	95.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65	-42.3	177.1	-177.9	56.4	0	0	0	112	A611 E612 R613 Y618 L619 A666 Y667 L670 I741	A611-L615 PolarHBondContact O-N 2.85Å; A611-L615 VanDerWaalsContact O-N 3.14Å; E612-L615 PolarHBondContact O-N 3.4Å; R613-L615 VanDerWaalsContact C-N 3.34Å; R613-L615 PolarHBondContact O-N 3.49Å; L615-Y618 PolarHBondContact O-N 3.27Å; L615-L619 HydrophobicContact CD1-CD1 4.03Å; L615-L619 HydrophobicContact CD1-CG 4.07Å; L615-L619 HydrophobicContact CG-CD1 4Å; L615-L619 HydrophobicContact CG-CG 4.46Å; L615-L619 WeakPolarHBondContact O-CB 3.46Å; L615-L619 VanDerWaalsContact O-CG 3.25Å; L615-L619 WeakPolarHBondContact O-CG 3.43Å; L615-L619 PolarHBondContact O-N 3.36Å; L615-A666 VanDerWaalsContact CD2-C 3.48Å; L615-A666 HydrophobicContact CD2-CB 3.57Å; L615-A666 WeakPolarHBondContact CD2-O 3.36Å; L615-Y667 HydrophobicContact CB-CE1 4.25Å; L615-Y667 HydrophobicContact CB-CE2 4.16Å; L615-Y667 HydrophobicContact CD1-CD1 4.22Å; L615-Y667 HydrophobicContact CD1-CE1 4.35Å; L615-Y667 HydrophobicContact CD1-CG 4.48Å; L615-Y667 HydrophobicContact CD2-CD2 4.11Å; L615-Y667 HydrophobicContact CD2-CE2 4.29Å; L615-Y667 HydrophobicContact CD2-CG 4.38Å; L615-L670 HydrophobicContact CD1-CD1 3.85Å; L615-L670 HydrophobicContact CD1-CD2 4.22Å; L615-L670 HydrophobicContact CD1-CG 3.75Å; L615-I741 HydrophobicContact CB-CD1 4.26Å; L615-I741 HydrophobicContact CD2-CD1 3.69Å; L615-I741 HydrophobicContact CD2-CG1 3.67Å; L615-I741 HydrophobicContact CG-CD1 3.86Å; L615-I741 HydrophobicContact CG-CG1 3.91Å
616	I	96.8	Very high	94.9	Very high	12 Å²	12	35 Å²	35	6%	0.062	15%	0.154	C	C	.	.	H	α-helix	trans	-59.5	-49.9	176.3	-72.3	173	0	0	0	111.1	E612 R613 Y618 L619 K620 I741 R744 L745 A748	E612-I616 HydrophobicContact CG-CD1 3.83Å; E612-I616 WeakPolarHBondContact O-CG1 3.47Å; E612-I616 PolarHBondContact O-N 3.05Å; R613-I616 PolarHBondContact O-N 3.38Å; I616-Y618 VanDerWaalsContact C-N 3.34Å; I616-Y618 PolarHBondContact O-N 3.07Å; I616-L619 PolarHBondContact O-N 2.92Å; I616-K620 VanDerWaalsContact O-CB 3.25Å; I616-K620 WeakPolarHBondContact O-CB 3.46Å; I616-K620 PolarHBondContact O-N 3.07Å; I616-I741 HydrophobicContact CG1-CD1 3.78Å; I616-R744 HydrophobicContact CD1-CB 4.06Å; I616-L745 HydrophobicContact CG2-CD1 3.96Å; I616-L745 WeakPolarHBondContact O-CD1 3.21Å; I616-A748 HydrophobicContact CG2-CB 3.59Å
617	E	95.8	Very high	94.2	Very high	28 Å²	28	36.4 Å²	36.4	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-67.5	-35.3	-178	-67.7	-64.6	168.7	0	0	112.1	F558 L565 R613 M614 K620 A621	F558-E617 HydrophobicContact CD1-CG 4.31Å; F558-E617 HydrophobicContact CE1-CG 4.2Å; L565-E617 HydrophobicContact CD1-CB 3.76Å; L565-E617 HydrophobicContact CD1-CG 4.4Å; R613-E617 HydrophobicContact CG-CG 4.2Å; R613-E617 WeakPolarHBondContact O-CG 3.22Å; R613-E617 PolarHBondContact O-N 3.01Å; M614-E617 PolarHBondContact O-N 2.97Å; E617-K620 PolarHBondContact O-N 3.41Å; E617-A621 PolarHBondContact O-N 3.3Å
618	Y	96.7	Very high	93.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-50.3	173.2	-160.8	-66.4	0	0	0	110.8	I568 M614 L615 I616 K620 A621 L622 I642 D645 L649 L670	I568-Y618 HydrophobicContact CD1-CD1 4.49Å; I568-Y618 HydrophobicContact CD1-CD2 3.42Å; I568-Y618 VanDerWaalsContact CD1-CD2 3.42Å; I568-Y618 HydrophobicContact CD1-CE1 4.5Å; I568-Y618 HydrophobicContact CD1-CE2 3.44Å; I568-Y618 VanDerWaalsContact CD1-CE2 3.44Å; I568-Y618 HydrophobicContact CD1-CG 3.97Å; I568-Y618 HydrophobicContact CG1-CE2 4.24Å; I568-Y618 HydrophobicContact CG2-CE1 4.33Å; M614-Y618 WeakPolarHBondContact O-CB 3.5Å; M614-Y618 PolarHBondContact O-N 3.27Å; L615-Y618 PolarHBondContact O-N 3.27Å; I616-Y618 VanDerWaalsContact C-N 3.34Å; I616-Y618 PolarHBondContact O-N 3.07Å; Y618-K620 VanDerWaalsContact C-N 3.32Å; Y618-K620 PolarHBondContact O-N 3.12Å; Y618-A621 WeakPolarHBondContact O-CB 3.43Å; Y618-A621 PolarHBondContact O-N 3.43Å; Y618-A621 VanDerWaalsContact O-N 3.16Å; Y618-L622 HydrophobicContact CD1-CD1 4.06Å; Y618-L622 HydrophobicContact CD1-CG 4.11Å; Y618-L622 HydrophobicContact CE1-CD1 4Å; Y618-L622 HydrophobicContact CE1-CD2 4.07Å; Y618-L622 HydrophobicContact CE1-CG 4.08Å; Y618-L622 PolarHBondContact O-N 2.86Å; Y618-L622 VanDerWaalsContact O-N 3.17Å; Y618-I642 HydrophobicContact CE1-CG1 4.47Å; Y618-I642 HydrophobicContact CE1-CG2 4.43Å; Y618-D645 HydrophobicContact CE2-CB 3.75Å; Y618-D645 WeakPolarHBondContact OH-CB 3.44Å; Y618-D645 PolarHBondContact OH-OD2 2.97Å; Y618-L649 HydrophobicContact CD2-CD1 4.16Å; Y618-L670 HydrophobicContact CD1-CD1 4.02Å; Y618-L670 HydrophobicContact CD1-CD2 3.47Å; Y618-L670 VanDerWaalsContact CD1-CD2 3.47Å; Y618-L670 HydrophobicContact CD1-CG 4.42Å; Y618-L670 HydrophobicContact CE1-CD1 4.36Å; Y618-L670 HydrophobicContact CE1-CD2 3.88Å; Y618-L670 HydrophobicContact CG-CD1 4.13Å; Y618-L670 HydrophobicContact CG-CD2 4.26Å
619	L	96.8	Very high	93.5	Very high	2 Å²	2	36 Å²	36	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-40.9	177.9	-70.6	172.1	0	0	0	111.6	L615 I616 A621 L622 I623 L670 I673 I741 F742 L745	L615-L619 HydrophobicContact CD1-CD1 4.03Å; L615-L619 HydrophobicContact CD1-CG 4.07Å; L615-L619 HydrophobicContact CG-CD1 4Å; L615-L619 HydrophobicContact CG-CG 4.46Å; L615-L619 WeakPolarHBondContact O-CB 3.46Å; L615-L619 VanDerWaalsContact O-CG 3.25Å; L615-L619 WeakPolarHBondContact O-CG 3.43Å; L615-L619 PolarHBondContact O-N 3.36Å; I616-L619 PolarHBondContact O-N 2.92Å; L619-A621 VanDerWaalsContact C-N 3.3Å; L619-A621 PolarHBondContact O-N 3.28Å; L619-L622 HydrophobicContact CD2-CD1 4.49Å; L619-L622 WeakPolarHBondContact O-CB 3.39Å; L619-L622 PolarHBondContact O-N 2.81Å; L619-I623 WeakPolarHBondContact O-CG1 2.99Å; L619-I623 PolarHBondContact O-N 2.95Å; L619-I623 VanDerWaalsContact O-N 3.12Å; L619-L670 HydrophobicContact CD2-CD2 3.65Å; L619-L670 HydrophobicContact CG-CD2 4.24Å; L619-I673 HydrophobicContact CD2-CD1 3.44Å; L619-I673 VanDerWaalsContact CD2-CD1 3.44Å; L619-I741 HydrophobicContact CD1-CG1 3.73Å; L619-F742 HydrophobicContact CD1-CE1 4.41Å; L619-F742 HydrophobicContact CD2-CE1 4.38Å; L619-L745 HydrophobicContact CB-CD1 4.27Å; L619-L745 HydrophobicContact CB-CD2 3.7Å; L619-L745 HydrophobicContact CD1-CD2 4.34Å
620	K	95.5	Very high	93.1	Very high	43 Å²	43	37.4 Å²	37.4	19%	0.187	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-44.1	174.5	-173.5	177.2	178.3	179.2	0	110.9	I616 E617 Y618 L622 I623 S624 L745 M749	I616-K620 VanDerWaalsContact O-CB 3.25Å; I616-K620 WeakPolarHBondContact O-CB 3.46Å; I616-K620 PolarHBondContact O-N 3.07Å; E617-K620 PolarHBondContact O-N 3.41Å; Y618-K620 VanDerWaalsContact C-N 3.32Å; Y618-K620 PolarHBondContact O-N 3.12Å; K620-L622 VanDerWaalsContact C-N 3.29Å; K620-L622 PolarHBondContact O-N 2.92Å; K620-I623 PolarHBondContact O-N 3.34Å; K620-S624 VanDerWaalsContact O-CB 3.27Å; K620-S624 WeakPolarHBondContact O-CB 3.23Å; K620-S624 PolarHBondContact O-N 3.14Å; K620-S624 PolarHBondContact O-OG 3.48Å; K620-L745 HydrophobicContact CB-CD1 3.91Å; K620-M749 HydrophobicContact CD-CG 4.43Å; K620-M749 HydrophobicContact CG-CG 4.31Å
621	A	93.7	Very high	92.8	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-36.6	175.8	0	0	0	0	0	112.6	I568 E617 Y618 L619 R625	I568-A621 HydrophobicContact CB-CB 4.01Å; I568-A621 HydrophobicContact CG2-CB 3.86Å; E617-A621 PolarHBondContact O-N 3.3Å; Y618-A621 WeakPolarHBondContact O-CB 3.43Å; Y618-A621 PolarHBondContact O-N 3.43Å; Y618-A621 VanDerWaalsContact O-N 3.16Å; L619-A621 VanDerWaalsContact C-N 3.3Å; L619-A621 PolarHBondContact O-N 3.28Å; A621-R625 WeakPolarHBondContact O-CB 3.25Å; A621-R625 WeakPolarHBondContact O-CG 3.41Å
622	L	95.1	Very high	92.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-38	178	-62.8	-178.3	0	0	0	113.4	I568 M569 Y618 L619 K620 I642 L670 I673 L707	I568-L622 HydrophobicContact CG2-CD2 4.15Å; M569-L622 HydrophobicContact CG-CD2 3.68Å; M569-L622 HydrophobicContact SD-CD2 4.07Å; Y618-L622 HydrophobicContact CD1-CD1 4.06Å; Y618-L622 HydrophobicContact CD1-CG 4.11Å; Y618-L622 HydrophobicContact CE1-CD1 4Å; Y618-L622 HydrophobicContact CE1-CD2 4.07Å; Y618-L622 HydrophobicContact CE1-CG 4.08Å; Y618-L622 PolarHBondContact O-N 2.86Å; Y618-L622 VanDerWaalsContact O-N 3.17Å; L619-L622 HydrophobicContact CD2-CD1 4.49Å; L619-L622 WeakPolarHBondContact O-CB 3.39Å; L619-L622 PolarHBondContact O-N 2.81Å; K620-L622 VanDerWaalsContact C-N 3.29Å; K620-L622 PolarHBondContact O-N 2.92Å; L622-I642 HydrophobicContact CD1-CD1 4.27Å; L622-I642 HydrophobicContact CD1-CG1 4.48Å; L622-I642 HydrophobicContact CD1-CG2 4.18Å; L622-I642 HydrophobicContact CD2-CD1 3.76Å; L622-I642 HydrophobicContact CD2-CG1 4Å; L622-L670 HydrophobicContact CD1-CD2 3.99Å; L622-I673 HydrophobicContact CD1-CD1 4.47Å; L622-I673 HydrophobicContact CD1-CG2 3.98Å; L622-L707 HydrophobicContact CB-CD2 4.12Å
623	I	93	Very high	92.4	Very high	26 Å²	26	46.7 Å²	46.7	13%	0.133	24%	0.243	C	C	.	.	H	α-helix	trans	-97	-21.1	-173	66.1	175.6	0	0	0	114.5	L619 K620 Q703 A706 L707 L745 M749	L619-I623 WeakPolarHBondContact O-CG1 2.99Å; L619-I623 PolarHBondContact O-N 2.95Å; L619-I623 VanDerWaalsContact O-N 3.12Å; K620-I623 PolarHBondContact O-N 3.34Å; I623-Q703 HydrophobicContact CD1-CG 4.25Å; I623-A706 HydrophobicContact CB-CB 3.87Å; I623-A706 HydrophobicContact CG2-CB 4.3Å; I623-L707 HydrophobicContact CG2-CD2 3.72Å; I623-L707 HydrophobicContact CG2-CG 3.86Å; I623-L745 HydrophobicContact CD1-CD2 3.63Å; I623-L745 HydrophobicContact CD1-CG 4.18Å; I623-M749 HydrophobicContact CD1-CE 4.29Å; I623-M749 HydrophobicContact CD1-SD 3.52Å; I623-M749 VanDerWaalsContact CD1-SD 3.52Å; I623-M749 HydrophobicContact CG1-SD 4.26Å
624	S	89.9	Confident	92.2	Very high	70 Å²	70	45.3 Å²	45.3	49%	0.49	24%	0.241	S	C	.	.	H	α-helix	trans	-97.4	-18.1	-174.5	63.7	0	0	0	0	114.3	K620	K620-S624 VanDerWaalsContact O-CB 3.27Å; K620-S624 WeakPolarHBondContact O-CB 3.23Å; K620-S624 PolarHBondContact O-N 3.14Å; K620-S624 PolarHBondContact O-OG 3.48Å
625	R	87.2	Confident	92.1	Very high	76 Å²	76	46 Å²	46	29%	0.287	24%	0.243	S	C	.	.	S	Bend	trans	-93.4	147.5	-171.5	-64.9	-175.6	-175	169.2	11.9	112.5	L565 S566 I568 M569 A621 S627	L565-R625 VanDerWaalsContact O-CZ 3.32Å; L565-R625 PolarHBondContact O-NH1 2.99Å; L565-R625 PolarHBondContact O-NH2 3.16Å; S566-R625 PolarHBondContact O-NH1 2.61Å; I568-R625 WeakPolarHBondContact O-CD 3.27Å; I568-R625 PolarHBondContact O-NH1 2.95Å; M569-R625 HydrophobicContact CB-CB 4.29Å; A621-R625 WeakPolarHBondContact O-CB 3.25Å; A621-R625 WeakPolarHBondContact O-CG 3.41Å; R625-S627 PolarHBondContact O-N 3.43Å
626	R	84.8	Confident	92	Very high	238 Å²	238	51.1 Å²	51.1	90%	0.898	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-66.4	127.5	171.5	-176.4	178	-179.7	-178.1	0.7	109.3	P628	R626-P628 WeakPolarHBondContact O-CD 3.36Å
627	S	84.1	Confident	91.8	Very high	31 Å²	31	54.5 Å²	54.5	22%	0.217	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-61	129.3	-178.4	-172.1	0	0	0	0	112.6	R625 L629 A710	R625-S627 PolarHBondContact O-N 3.43Å; S627-L629 VanDerWaalsContact C-N 3.31Å; S627-L629 WeakPolarHBondContact OG-CB 3.39Å; S627-L629 WeakPolarHBondContact OG-CG 3.38Å; S627-L629 PolarHBondContact OG-N 2.99Å; S627-L629 VanDerWaalsContact OG-N 3.08Å; S627-A710 WeakPolarHBondContact CB-O 3.25Å; S627-A710 PolarHBondContact OG-O 3.38Å
628	P	85.6	Confident	91.8	Very high	28 Å²	28	53.2 Å²	53.2	18%	0.182	27%	0.274	C	S	.	.			trans	-85.2	-3.7	166.3	35.9	-35.8	0	0	0	112.7	M569 P571 L574 R626 S630	M569-P628 VanDerWaalsContact O-CD 3.29Å; M569-P628 WeakPolarHBondContact O-CD 3.31Å; M569-P628 WeakPolarHBondContact O-CG 3.18Å; P571-P628 HydrophobicContact CG-CB 3.95Å; L574-P628 HydrophobicContact CD1-CB 4.19Å; L574-P628 HydrophobicContact CD1-CG 3.95Å; R626-P628 WeakPolarHBondContact O-CD 3.36Å; P628-S630 PolarHBondContact O-N 3.34Å
629	L	92.1	Very high	91.7	Very high	6 Å²	6	53.2 Å²	53.2	3%	0.031	27%	0.274	C	S	.	.			trans	-81.4	108.6	-170	-48.7	178.4	0	0	0	110.1	M569 L574 S627 D634 R635 A638 F677 A710	M569-L629 HydrophobicContact CE-CD1 4.33Å; L574-L629 HydrophobicContact CD1-CD2 3.72Å; L574-L629 HydrophobicContact CD2-CD2 3.72Å; L574-L629 HydrophobicContact CG-CD2 4.31Å; S627-L629 VanDerWaalsContact C-N 3.31Å; S627-L629 WeakPolarHBondContact OG-CB 3.39Å; S627-L629 WeakPolarHBondContact OG-CG 3.38Å; S627-L629 PolarHBondContact OG-N 2.99Å; S627-L629 VanDerWaalsContact OG-N 3.08Å; L629-D634 HydrophobicContact CD2-CB 4Å; L629-R635 HydrophobicContact CD1-CB 4.44Å; L629-R635 HydrophobicContact CD1-CG 4.29Å; L629-A638 HydrophobicContact CD1-CB 3.93Å; L629-A638 HydrophobicContact CD2-CB 3.85Å; L629-F677 HydrophobicContact CD1-CD1 3.63Å; L629-F677 HydrophobicContact CD1-CE1 3.52Å; L629-A710 WeakPolarHBondContact CD1-O 3.39Å
630	S	86.4	Confident	91.7	Very high	112 Å²	112	56.9 Å²	56.9	78%	0.783	29%	0.291	S	S	*	.			trans	-111	-18.2	179.2	-57.2	0	0	0	0	113.1	P628	P628-S630 PolarHBondContact O-N 3.34Å
631	T	91.6	Very high	91.6	Very high	68 Å²	68	55.8 Å²	55.8	42%	0.417	29%	0.286	S	S	.	.	S	Bend	trans	-123.2	157.8	-178	71.4	0	0	0	0	111.6	A633 D634 R635	T631-A633 PolarHBondContact O-N 3.46Å; T631-D634 PolarHBondContact N-OD2 3.41Å; T631-D634 PolarHBondContact O-N 3.01Å; T631-D634 PolarHBondContact OG1-N 3.5Å; T631-D634 VanDerWaalsContact OG1-N 3.1Å; T631-D634 PolarHBondContact OG1-OD2 3.49Å; T631-R635 PolarHBondContact O-N 2.9Å
632	E	92.4	Very high	91.8	Very high	117 Å²	117	55.7 Å²	55.7	55%	0.547	29%	0.285	S	S	.	.	H	α-helix	trans	-56.9	-37.2	171.1	178.6	178.9	159.6	0	0	111.8	R635 K636 T680	E632-R635 PolarHBondContact O-N 2.82Å; E632-K636 WeakPolarHBondContact O-CB 3.44Å; E632-K636 PolarHBondContact O-N 2.62Å; E632-T680 HydrophobicContact CG-CG2 4.08Å; E632-T680 WeakPolarHBondContact OE1-CG2 3.35Å
633	A	92.2	Very high	91.9	Very high	57 Å²	57	57.6 Å²	57.6	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-64.2	-42.6	177.7	0	0	0	0	0	112.2	T631 R635 K637	T631-A633 PolarHBondContact O-N 3.46Å; A633-R635 VanDerWaalsContact C-N 3.35Å; A633-K637 VanDerWaalsContact O-CG 3.3Å; A633-K637 WeakPolarHBondContact O-CG 3.42Å; A633-K637 PolarHBondContact O-N 3.32Å
634	D	93.1	Very high	91.9	Very high	36 Å²	36	62 Å²	62	19%	0.193	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-43.2	176.2	-60	-36.9	0	0	0	111	L574 L629 T631 K637 A638	L574-D634 HydrophobicContact CD1-CB 4.24Å; L629-D634 HydrophobicContact CD2-CB 4Å; T631-D634 PolarHBondContact N-OD2 3.41Å; T631-D634 PolarHBondContact O-N 3.01Å; T631-D634 PolarHBondContact OG1-N 3.5Å; T631-D634 VanDerWaalsContact OG1-N 3.1Å; T631-D634 PolarHBondContact OG1-OD2 3.49Å; D634-K637 PolarHBondContact O-N 3.46Å; D634-A638 PolarHBondContact O-N 2.88Å
635	R	94	Very high	92.2	Very high	14 Å²	14	58.7 Å²	58.7	5%	0.053	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-43	179.5	-168	-175.4	55.9	-109.9	7.1	112.2	L629 T631 E632 A633 A638 G639 F677 D713	L629-R635 HydrophobicContact CD1-CB 4.44Å; L629-R635 HydrophobicContact CD1-CG 4.29Å; T631-R635 PolarHBondContact O-N 2.9Å; E632-R635 PolarHBondContact O-N 2.82Å; A633-R635 VanDerWaalsContact C-N 3.35Å; R635-A638 WeakPolarHBondContact O-CB 3.38Å; R635-A638 PolarHBondContact O-N 3.49Å; R635-G639 PolarHBondContact O-N 3.21Å; R635-F677 HydrophobicContact CG-CB 4.3Å; R635-F677 HydrophobicContact CG-CD1 4.07Å; R635-F677 WeakPolarHBondContact CG-O 3.48Å; R635-F677 PolarHBondContact NE-O 2.8Å; R635-D713 IonicContact CZ-OD2 3.49Å; R635-D713 IonicContact NE-OD2 3.87Å; R635-D713 IonicContact NH1-OD1 2.65Å; R635-D713 IonicContact NH1-OD2 3.14Å; R635-D713 PolarHBondContact NH1-OD2 3.32Å; R635-D713 VanDerWaalsContact NH1-OD2 3.07Å; R635-D713 IonicContact NH2-OD2 3.63Å; R635-D713 PolarHBondContact NH2-OD2 3.33Å
636	K	94.7	Very high	92.6	Very high	108 Å²	108	55.1 Å²	55.1	47%	0.47	28%	0.276	S	S	.	.	H	α-helix	trans	-59.9	-46.8	174.3	-174.2	-179.8	177.4	-176.2	0	111.2	E632 A638 G639 E640 L678	E632-K636 WeakPolarHBondContact O-CB 3.44Å; E632-K636 PolarHBondContact O-N 2.62Å; K636-A638 VanDerWaalsContact C-N 3.32Å; K636-A638 PolarHBondContact O-N 3.07Å; K636-G639 PolarHBondContact O-N 2.87Å; K636-E640 WeakPolarHBondContact CE-OE1 3.45Å; K636-E640 WeakPolarHBondContact O-CG 3.43Å; K636-E640 PolarHBondContact O-N 3.23Å; K636-L678 HydrophobicContact CG-CD2 4.06Å
637	K	93.4	Very high	93.1	Very high	83 Å²	83	48.6 Å²	48.6	36%	0.361	26%	0.255	S	S	.	.	H	α-helix	trans	-58.4	-43.4	175.4	-72.9	172.2	-175.4	174.6	0	111.9	A633 D634 E640 K641	A633-K637 VanDerWaalsContact O-CG 3.3Å; A633-K637 WeakPolarHBondContact O-CG 3.42Å; A633-K637 PolarHBondContact O-N 3.32Å; D634-K637 PolarHBondContact O-N 3.46Å; K637-E640 PolarHBondContact O-N 3.32Å; K637-K641 WeakPolarHBondContact O-CB 3.27Å; K637-K641 VanDerWaalsContact O-CG 3.32Å; K637-K641 WeakPolarHBondContact O-CG 3.32Å; K637-K641 PolarHBondContact O-N 2.82Å
638	A	94.9	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-46.5	176.5	0	0	0	0	0	111.6	W573 L574 L629 D634 R635 K636 E640 K641 I642 F677	W573-A638 HydrophobicContact CH2-CB 3.88Å; W573-A638 HydrophobicContact CZ3-CB 3.68Å; L574-A638 HydrophobicContact CD2-CB 4.19Å; L629-A638 HydrophobicContact CD1-CB 3.93Å; L629-A638 HydrophobicContact CD2-CB 3.85Å; D634-A638 PolarHBondContact O-N 2.88Å; R635-A638 WeakPolarHBondContact O-CB 3.38Å; R635-A638 PolarHBondContact O-N 3.49Å; K636-A638 VanDerWaalsContact C-N 3.32Å; K636-A638 PolarHBondContact O-N 3.07Å; A638-E640 PolarHBondContact O-N 3.32Å; A638-K641 PolarHBondContact O-N 3.07Å; A638-I642 VanDerWaalsContact O-CG1 3.23Å; A638-I642 WeakPolarHBondContact O-CG1 3.47Å; A638-I642 PolarHBondContact O-N 3.47Å; A638-F677 HydrophobicContact CB-CD1 4.19Å
639	G	96.2	Very high	94.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-42.3	177.2	0	0	0	0	0	113.8	R635 K636 T643 G674	R635-G639 PolarHBondContact O-N 3.21Å; K636-G639 PolarHBondContact O-N 2.87Å; G639-T643 WeakPolarHBondContact O-CB 3.43Å; G639-T643 PolarHBondContact O-N 3.29Å; G639-T643 VanDerWaalsContact O-N 3.11Å; G639-T643 PolarHBondContact O-OG1 2.57Å; G639-G674 WeakPolarHBondContact CA-O 3.35Å
640	E	95.1	Very high	94.4	Very high	79 Å²	79	50 Å²	50	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-41.6	174.4	-69.8	175.1	176	0	0	111.7	K636 K637 A638 R644 L678	K636-E640 WeakPolarHBondContact CE-OE1 3.45Å; K636-E640 WeakPolarHBondContact O-CG 3.43Å; K636-E640 PolarHBondContact O-N 3.23Å; K637-E640 PolarHBondContact O-N 3.32Å; A638-E640 PolarHBondContact O-N 3.32Å; E640-R644 WeakPolarHBondContact O-CB 3.07Å; E640-R644 PolarHBondContact O-N 3.34Å; E640-L678 HydrophobicContact CG-CD2 3.81Å
641	K	94.8	Very high	94.9	Very high	20 Å²	20	46.7 Å²	46.7	9%	0.087	23%	0.23	C	C	.	.	H	α-helix	trans	-67.6	-49.8	177.7	-73	-177.5	78.4	100.9	0	112	W573 D578 K637 A638 T643 R644 D645	W573-K641 VanDerWaalsContact CD1-CE 3.48Å; W573-K641 HydrophobicContact CD2-CD 4.23Å; W573-K641 HydrophobicContact CH2-CB 4.05Å; W573-K641 HydrophobicContact CZ2-CB 3.49Å; W573-K641 VanDerWaalsContact CZ2-CB 3.49Å; W573-K641 HydrophobicContact CZ2-CD 4.13Å; W573-K641 HydrophobicContact CZ2-CG 4.46Å; W573-K641 WeakPolarHBondContact O-CD 3.34Å; W573-K641 WeakPolarHBondContact O-CE 3.23Å; W573-K641 PolarHBondContact O-NZ 3.21Å; D578-K641 WeakPolarHBondContact OD2-CE 3.28Å; D578-K641 IonicContact OD2-NZ 3.28Å; D578-K641 PolarHBondContact OD2-NZ 3.35Å; K637-K641 WeakPolarHBondContact O-CB 3.27Å; K637-K641 VanDerWaalsContact O-CG 3.32Å; K637-K641 WeakPolarHBondContact O-CG 3.32Å; K637-K641 PolarHBondContact O-N 2.82Å; A638-K641 PolarHBondContact O-N 3.07Å; K641-T643 PolarHBondContact O-N 2.91Å; K641-R644 PolarHBondContact O-N 3.33Å; K641-R644 VanDerWaalsContact O-N 3.12Å; K641-D645 WeakPolarHBondContact O-CB 3.35Å; K641-D645 PolarHBondContact O-N 2.91Å
642	I	97.1	Very high	95.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.2	-42.3	178.5	-64.4	162.8	0	0	0	110.7	W573 Y618 L622 A638 G646 L670 F677	W573-I642 HydrophobicContact CH2-CD1 4.3Å; W573-I642 HydrophobicContact CH2-CG1 3.83Å; W573-I642 HydrophobicContact CZ2-CG1 4.11Å; Y618-I642 HydrophobicContact CE1-CG1 4.47Å; Y618-I642 HydrophobicContact CE1-CG2 4.43Å; L622-I642 HydrophobicContact CD1-CD1 4.27Å; L622-I642 HydrophobicContact CD1-CG1 4.48Å; L622-I642 HydrophobicContact CD1-CG2 4.18Å; L622-I642 HydrophobicContact CD2-CD1 3.76Å; L622-I642 HydrophobicContact CD2-CG1 4Å; A638-I642 VanDerWaalsContact O-CG1 3.23Å; A638-I642 WeakPolarHBondContact O-CG1 3.47Å; A638-I642 PolarHBondContact O-N 3.47Å; I642-G646 PolarHBondContact O-N 2.86Å; I642-L670 HydrophobicContact CG2-CB 4.07Å; I642-L670 HydrophobicContact CG2-CD2 4.26Å; I642-L670 VanDerWaalsContact CG2-O 3.22Å; I642-L670 WeakPolarHBondContact CG2-O 3.48Å; I642-F677 HydrophobicContact CD1-CD2 4Å; I642-F677 HydrophobicContact CD1-CE2 4.11Å; I642-F677 HydrophobicContact CD1-CG 4.3Å; I642-F677 HydrophobicContact CD1-CZ 4.49Å
643	T	96.8	Very high	95.3	Very high	40 Å²	40	39 Å²	39	25%	0.245	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-46.2	178.2	-55.7	0	0	0	0	111.8	G639 K641 G646 H647 T671	G639-T643 WeakPolarHBondContact O-CB 3.43Å; G639-T643 PolarHBondContact O-N 3.29Å; G639-T643 VanDerWaalsContact O-N 3.11Å; G639-T643 PolarHBondContact O-OG1 2.57Å; K641-T643 PolarHBondContact O-N 2.91Å; T643-G646 PolarHBondContact O-N 3.39Å; T643-H647 PolarHBondContact O-N 3.41Å; T643-T671 HydrophobicContact CG2-CG2 4.06Å
644	R	94.7	Very high	95.6	Very high	120 Å²	120	40.5 Å²	40.5	45%	0.453	19%	0.186	S	C	.	.	H	α-helix	trans	-63.8	-47.2	177.8	-171.7	-174.3	-56.9	116.6	4.9	111.4	E640 K641 G646 H647 D648	E640-R644 WeakPolarHBondContact O-CB 3.07Å; E640-R644 PolarHBondContact O-N 3.34Å; K641-R644 PolarHBondContact O-N 3.33Å; K641-R644 VanDerWaalsContact O-N 3.12Å; R644-G646 VanDerWaalsContact C-N 3.31Å; R644-G646 PolarHBondContact O-N 3.24Å; R644-H647 PolarHBondContact O-N 2.9Å; R644-H647 VanDerWaalsContact O-N 3.11Å; R644-D648 PolarHBondContact O-N 2.75Å
645	D	94.9	Very high	95.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-42.5	180	-62.8	3.2	0	0	0	110.9	T581 Y618 K641 H647 D648 L649	T581-D645 WeakPolarHBondContact CB-OD1 3.24Å; T581-D645 HydrophobicContact CG2-CB 4.05Å; T581-D645 WeakPolarHBondContact CG2-OD1 3.5Å; T581-D645 PolarHBondContact OG1-OD1 3.5Å; Y618-D645 HydrophobicContact CE2-CB 3.75Å; Y618-D645 WeakPolarHBondContact OH-CB 3.44Å; Y618-D645 PolarHBondContact OH-OD2 2.97Å; K641-D645 WeakPolarHBondContact O-CB 3.35Å; K641-D645 PolarHBondContact O-N 2.91Å; D645-H647 VanDerWaalsContact C-N 3.35Å; D645-H647 PolarHBondContact O-N 3.32Å; D645-D648 PolarHBondContact O-N 3.33Å; D645-L649 VanDerWaalsContact O-CB 3.29Å; D645-L649 WeakPolarHBondContact O-CB 3.42Å; D645-L649 VanDerWaalsContact O-CG 3.27Å; D645-L649 WeakPolarHBondContact O-CG 3.48Å; D645-L649 PolarHBondContact O-N 2.94Å
646	G	95.8	Very high	95.7	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-44.7	173.2	0	0	0	0	0	112.6	I642 T643 R644 K650	I642-G646 PolarHBondContact O-N 2.86Å; T643-G646 PolarHBondContact O-N 3.39Å; R644-G646 VanDerWaalsContact C-N 3.31Å; R644-G646 PolarHBondContact O-N 3.24Å; G646-K650 WeakPolarHBondContact O-CB 3.41Å; G646-K650 PolarHBondContact O-N 2.86Å
647	H	96.2	Very high	95.8	Very high	101 Å²	101	45.5 Å²	45.5	47%	0.468	21%	0.209	S	C	.	.	H	α-helix	trans	-67.1	-48	177.7	-173.3	56.2	0	0	0	112.7	T643 R644 D645 K650 N651	T643-H647 PolarHBondContact O-N 3.41Å; R644-H647 PolarHBondContact O-N 2.9Å; R644-H647 VanDerWaalsContact O-N 3.11Å; D645-H647 VanDerWaalsContact C-N 3.35Å; D645-H647 PolarHBondContact O-N 3.32Å; H647-K650 PolarHBondContact O-N 3.15Å; H647-N651 PolarHBondContact CD2-ND2 3.21Å; H647-N651 PolarHBondContact CE1-ND2 2.7Å; H647-N651 PolarHBondContact CE1-OD1 3.31Å; H647-N651 VanDerWaalsContact CE1-OD1 3.28Å; H647-N651 PolarHBondContact ND1-OD1 2.97Å; H647-N651 PolarHBondContact NE2-ND2 3.26Å; H647-N651 WeakPolarHBondContact O-CB 3.33Å; H647-N651 PolarHBondContact O-N 3.1Å; H647-N651 PolarHBondContact O-ND2 3.13Å; H647-N651 PolarHBondContact O-OD1 3.14Å
648	D	95.6	Very high	95.8	Very high	58 Å²	58	51.4 Å²	51.4	31%	0.31	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-44.3	-176.1	-68.8	-12.5	0	0	0	111.4	T581 R644 D645 Y652	T581-D648 HydrophobicContact CG2-CB 3.98Å; R644-D648 PolarHBondContact O-N 2.75Å; D645-D648 PolarHBondContact O-N 3.33Å; D648-Y652 WeakPolarHBondContact O-CB 3.47Å; D648-Y652 PolarHBondContact O-N 2.99Å
649	L	96.7	Very high	95.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-44	175.2	-69.4	170.5	0	0	0	111.2	L584 V585 L588 M614 Y618 D645 Y652 F653 Y667	L584-L649 HydrophobicContact CB-CD2 4.25Å; L584-L649 HydrophobicContact CD1-CD1 4.48Å; V585-L649 HydrophobicContact CG2-CD2 4.04Å; L588-L649 HydrophobicContact CD1-CD2 4.34Å; M614-L649 HydrophobicContact CE-CD2 4.41Å; M614-L649 HydrophobicContact CG-CD1 4.17Å; M614-L649 HydrophobicContact CG-CD2 4.28Å; Y618-L649 HydrophobicContact CD2-CD1 4.16Å; D645-L649 VanDerWaalsContact O-CB 3.29Å; D645-L649 WeakPolarHBondContact O-CB 3.42Å; D645-L649 VanDerWaalsContact O-CG 3.27Å; D645-L649 WeakPolarHBondContact O-CG 3.48Å; D645-L649 PolarHBondContact O-N 2.94Å; L649-Y652 PolarHBondContact O-N 2.94Å; L649-F653 WeakPolarHBondContact O-CD2 3.49Å; L649-F653 PolarHBondContact O-N 3.36Å; L649-Y667 HydrophobicContact CB-CD1 4.06Å; L649-Y667 HydrophobicContact CB-CE1 3.59Å; L649-Y667 HydrophobicContact CD1-CE1 4.31Å
650	K	96	Very high	95.6	Very high	37 Å²	37	57.4 Å²	57.4	16%	0.161	26%	0.256	C	S	.	.	H	α-helix	trans	-56.8	-52.2	176.7	-176.4	-177.4	-176.2	178.5	0	111.3	G646 H647 Y652 F653 E654 I664 Y667 D668	G646-K650 WeakPolarHBondContact O-CB 3.41Å; G646-K650 PolarHBondContact O-N 2.86Å; H647-K650 PolarHBondContact O-N 3.15Å; K650-Y652 VanDerWaalsContact C-N 3.28Å; K650-Y652 PolarHBondContact O-N 2.84Å; K650-F653 PolarHBondContact O-N 2.94Å; K650-E654 VanDerWaalsContact O-CB 3.26Å; K650-E654 WeakPolarHBondContact O-CB 3.44Å; K650-E654 PolarHBondContact O-N 3.4Å; K650-I664 HydrophobicContact CD-CG2 4.34Å; K650-I664 WeakPolarHBondContact CE-O 3.43Å; K650-I664 HydrophobicContact CG-CG2 3.74Å; K650-Y667 HydrophobicContact CB-CD1 4.34Å; K650-Y667 HydrophobicContact CB-CG 4.05Å; K650-Y667 HydrophobicContact CG-CG 4.5Å; K650-D668 VanDerWaalsContact NZ-CG 3.26Å; K650-D668 IonicContact NZ-OD1 3.51Å; K650-D668 PolarHBondContact NZ-OD1 3.47Å; K650-D668 IonicContact NZ-OD2 3.07Å; K650-D668 PolarHBondContact NZ-OD2 3.45Å; K650-D668 VanDerWaalsContact NZ-OD2 3.1Å
651	N	96.1	Very high	95.3	Very high	42 Å²	42	57.6 Å²	57.6	23%	0.225	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-39.7	179.4	-67.2	-12	0	0	0	111.3	H647 E654 E655	H647-N651 PolarHBondContact CD2-ND2 3.21Å; H647-N651 PolarHBondContact CE1-ND2 2.7Å; H647-N651 PolarHBondContact CE1-OD1 3.31Å; H647-N651 VanDerWaalsContact CE1-OD1 3.28Å; H647-N651 PolarHBondContact ND1-OD1 2.97Å; H647-N651 PolarHBondContact NE2-ND2 3.26Å; H647-N651 WeakPolarHBondContact O-CB 3.33Å; H647-N651 PolarHBondContact O-N 3.1Å; H647-N651 PolarHBondContact O-ND2 3.13Å; H647-N651 PolarHBondContact O-OD1 3.14Å; N651-E654 PolarHBondContact O-N 2.86Å; N651-E655 VanDerWaalsContact O-CB 3.29Å; N651-E655 WeakPolarHBondContact O-CB 3.46Å; N651-E655 WeakPolarHBondContact O-CG 3.26Å; N651-E655 PolarHBondContact O-N 2.97Å
652	Y	96.1	Very high	95	Very high	23 Å²	23	62.3 Å²	62.3	9%	0.09	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-50.3	178.5	-176.2	-92.6	0	0	0	111.8	V585 L588 A589 D648 L649 K650 E654 K656 M657	V585-Y652 HydrophobicContact CG1-CD2 3.66Å; V585-Y652 HydrophobicContact CG1-CE2 4.18Å; V585-Y652 HydrophobicContact CG1-CG 4.1Å; L588-Y652 HydrophobicContact CB-CD1 4.42Å; L588-Y652 HydrophobicContact CB-CE1 3.78Å; L588-Y652 HydrophobicContact CD1-CD1 4.21Å; L588-Y652 HydrophobicContact CD1-CE1 4.3Å; A589-Y652 WeakPolarHBondContact CA-OH 3.18Å; A589-Y652 HydrophobicContact CB-CE2 4.05Å; A589-Y652 PolarHBondContact N-OH 2.94Å; D648-Y652 WeakPolarHBondContact O-CB 3.47Å; D648-Y652 PolarHBondContact O-N 2.99Å; L649-Y652 PolarHBondContact O-N 2.94Å; K650-Y652 VanDerWaalsContact C-N 3.28Å; K650-Y652 PolarHBondContact O-N 2.84Å; Y652-E654 VanDerWaalsContact C-N 3.29Å; Y652-E654 PolarHBondContact O-N 3.41Å; Y652-K656 HydrophobicContact CD2-CB 4.05Å; Y652-K656 HydrophobicContact CD2-CG 3.65Å; Y652-K656 HydrophobicContact CE2-CB 3.83Å; Y652-K656 HydrophobicContact CE2-CG 3.7Å; Y652-K656 HydrophobicContact CG-CB 4.48Å; Y652-K656 HydrophobicContact CG-CG 4.36Å; Y652-K656 WeakPolarHBondContact O-CA 3.17Å; Y652-K656 VanDerWaalsContact O-CB 3.24Å; Y652-K656 WeakPolarHBondContact O-CB 3.36Å; Y652-K656 PolarHBondContact O-N 3.48Å; Y652-M657 HydrophobicContact CD1-CG 4.45Å; Y652-M657 HydrophobicContact CE1-CG 3.8Å; Y652-M657 HydrophobicContact CE1-SD 3.85Å; Y652-M657 PolarHBondContact O-N 3.3Å
653	F	97.5	Very high	94.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-32.9	177.9	-74	-64.6	0	0	0	112.7	L588 L610 A611 M614 L649 K650 M657 R658 V659 I664 Y667	L588-F653 HydrophobicContact CD1-CE1 4.16Å; L588-F653 HydrophobicContact CD1-CE2 4Å; L588-F653 HydrophobicContact CD1-CZ 3.5Å; L588-F653 VanDerWaalsContact CD1-CZ 3.5Å; L588-F653 HydrophobicContact CD2-CE1 4.48Å; L588-F653 HydrophobicContact CD2-CZ 4.26Å; L610-F653 HydrophobicContact CB-CE1 4.25Å; A611-F653 HydrophobicContact CB-CB 4.31Å; A611-F653 HydrophobicContact CB-CD1 3.64Å; A611-F653 HydrophobicContact CB-CD2 4.08Å; A611-F653 HydrophobicContact CB-CE1 3.88Å; A611-F653 HydrophobicContact CB-CE2 4.33Å; A611-F653 HydrophobicContact CB-CG 3.75Å; A611-F653 HydrophobicContact CB-CZ 4.22Å; M614-F653 HydrophobicContact CB-CE2 4.05Å; M614-F653 HydrophobicContact CB-CZ 4Å; M614-F653 HydrophobicContact CG-CE2 3.97Å; M614-F653 HydrophobicContact CG-CZ 4.24Å; L649-F653 WeakPolarHBondContact O-CD2 3.49Å; L649-F653 PolarHBondContact O-N 3.36Å; K650-F653 PolarHBondContact O-N 2.94Å; F653-M657 HydrophobicContact CD1-CB 4.39Å; F653-M657 HydrophobicContact CD1-CG 4.41Å; F653-M657 HydrophobicContact CD1-SD 3.63Å; F653-M657 HydrophobicContact CE1-SD 3.58Å; F653-M657 VanDerWaalsContact CE1-SD 3.58Å; F653-M657 CarbonylContact O-C 3.53Å; F653-R658 PolarHBondContact O-N 3.45Å; F653-V659 HydrophobicContact CB-CB 4.34Å; F653-V659 HydrophobicContact CB-CG2 4.07Å; F653-V659 HydrophobicContact CD1-CG2 4.04Å; F653-V659 HydrophobicContact CG-CG2 4.48Å; F653-V659 PolarHBondContact O-N 3.31Å; F653-I664 HydrophobicContact CB-CD1 3.58Å; F653-Y667 HydrophobicContact CD2-CE1 4.36Å; F653-Y667 HydrophobicContact CD2-CE2 4.14Å; F653-Y667 AromaticContact CD2-CZ 3.67Å; F653-Y667 VanDerWaalsContact CD2-OH 3.23Å; F653-Y667 WeakPolarHBondContact CD2-OH 3.39Å; F653-Y667 HydrophobicContact CE2-CE1 4.49Å; F653-Y667 AromaticContact CE2-CZ 3.86Å; F653-Y667 WeakPolarHBondContact CE2-OH 3.48Å
654	E	97.1	Very high	94.6	Very high	89 Å²	89	60.9 Å²	60.9	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-75.3	-51.2	179	-176.5	167.4	-147.8	0	0	112.4	K650 N651 Y652 R658 I664	K650-E654 VanDerWaalsContact O-CB 3.26Å; K650-E654 WeakPolarHBondContact O-CB 3.44Å; K650-E654 PolarHBondContact O-N 3.4Å; N651-E654 PolarHBondContact O-N 2.86Å; Y652-E654 VanDerWaalsContact C-N 3.29Å; Y652-E654 PolarHBondContact O-N 3.41Å; E654-R658 WeakPolarHBondContact O-CA 3.04Å; E654-I664 HydrophobicContact CB-CD1 3.96Å; E654-I664 HydrophobicContact CB-CG1 4.16Å; E654-I664 HydrophobicContact CB-CG2 4.05Å; E654-I664 HydrophobicContact CG-CG2 4.24Å
655	E	95.8	Very high	94.5	Very high	132 Å²	132	58.9 Å²	58.9	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-87.4	-34.6	-171.9	-62.6	-170.9	165.7	0	0	113.6	N651	N651-E655 VanDerWaalsContact O-CB 3.29Å; N651-E655 WeakPolarHBondContact O-CB 3.46Å; N651-E655 WeakPolarHBondContact O-CG 3.26Å; N651-E655 PolarHBondContact O-N 2.97Å
656	K	94.5	Very high	94.5	Very high	127 Å²	127	59 Å²	59	55%	0.552	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-58.5	-174.6	-53.8	-58.7	-178.8	-175.6	0	111.5	Y652	Y652-K656 HydrophobicContact CD2-CB 4.05Å; Y652-K656 HydrophobicContact CD2-CG 3.65Å; Y652-K656 HydrophobicContact CE2-CB 3.83Å; Y652-K656 HydrophobicContact CE2-CG 3.7Å; Y652-K656 HydrophobicContact CG-CB 4.48Å; Y652-K656 HydrophobicContact CG-CG 4.36Å; Y652-K656 WeakPolarHBondContact O-CA 3.17Å; Y652-K656 VanDerWaalsContact O-CB 3.24Å; Y652-K656 WeakPolarHBondContact O-CB 3.36Å; Y652-K656 PolarHBondContact O-N 3.48Å
657	M	95.9	Very high	94.5	Very high	3 Å²	3	59 Å²	59	2%	0.015	28%	0.281	C	S	.	.	S	Bend	trans	-85.8	-8.7	-178.1	-59.1	-170.4	80.9	0	0	113.8	A607 L610 Y652 F653 V659	A607-M657 HydrophobicContact CB-CB 4.27Å; A607-M657 HydrophobicContact CB-CE 3.95Å; L610-M657 HydrophobicContact CD1-CE 3.86Å; Y652-M657 HydrophobicContact CD1-CG 4.45Å; Y652-M657 HydrophobicContact CE1-CG 3.8Å; Y652-M657 HydrophobicContact CE1-SD 3.85Å; Y652-M657 PolarHBondContact O-N 3.3Å; F653-M657 HydrophobicContact CD1-CB 4.39Å; F653-M657 HydrophobicContact CD1-CG 4.41Å; F653-M657 HydrophobicContact CD1-SD 3.63Å; F653-M657 HydrophobicContact CE1-SD 3.58Å; F653-M657 VanDerWaalsContact CE1-SD 3.58Å; F653-M657 CarbonylContact O-C 3.53Å; M657-V659 VanDerWaalsContact C-N 3.29Å; M657-V659 HydrophobicContact CB-CG2 4.15Å; M657-V659 PolarHBondContact O-N 2.96Å
658	R	94.4	Very high	94.5	Very high	207 Å²	207	56.4 Å²	56.4	78%	0.781	27%	0.271	S	S	*	.			trans	55.2	38.9	175.8	-55.6	-179.5	-179.4	-177.9	1	114.3	F653 E654	F653-R658 PolarHBondContact O-N 3.45Å; E654-R658 WeakPolarHBondContact O-CA 3.04Å
659	V	95.6	Very high	94.5	Very high	11 Å²	11	53.7 Å²	53.7	7%	0.067	26%	0.256	C	S	.	.			trans	-63.5	144.4	178.6	176.3	0	0	0	0	110.5	A607 E608 A611 F653 M657 V663 I664	A607-V659 HydrophobicContact CB-CG2 3.82Å; E608-V659 HydrophobicContact CG-CG1 4.03Å; A611-V659 HydrophobicContact CB-CG1 3.98Å; A611-V659 HydrophobicContact CB-CG2 4.08Å; F653-V659 HydrophobicContact CB-CB 4.34Å; F653-V659 HydrophobicContact CB-CG2 4.07Å; F653-V659 HydrophobicContact CD1-CG2 4.04Å; F653-V659 HydrophobicContact CG-CG2 4.48Å; F653-V659 PolarHBondContact O-N 3.31Å; M657-V659 VanDerWaalsContact C-N 3.29Å; M657-V659 HydrophobicContact CB-CG2 4.15Å; M657-V659 PolarHBondContact O-N 2.96Å; V659-V663 HydrophobicContact CG1-CB 3.77Å; V659-V663 HydrophobicContact CG1-CG1 4.29Å; V659-V663 HydrophobicContact CG1-CG2 3.99Å; V659-I664 HydrophobicContact CB-CD1 3.9Å; V659-I664 HydrophobicContact CB-CG1 4.31Å; V659-I664 HydrophobicContact CG1-CD1 4.23Å; V659-I664 HydrophobicContact CG1-CG1 4.45Å; V659-I664 WeakPolarHBondContact O-CG1 3.29Å
660	K	91	Very high	94.5	Very high	115 Å²	115	53.7 Å²	53.7	50%	0.5	26%	0.256	S	S	.	.			trans	-55.1	142.1	179.3	-70.8	-177.6	-168.8	130.5	0	112.3	E608 E662 V663 I664	E608-K660 WeakPolarHBondContact OE1-CD 3.26Å; E608-K660 WeakPolarHBondContact OE1-CE 3.44Å; E608-K660 WeakPolarHBondContact OE1-CG 3.39Å; E608-K660 IonicContact OE1-NZ 3.77Å; E608-K660 PolarHBondContact OE1-NZ 3.37Å; E608-K660 IonicContact OE2-NZ 2.56Å; E608-K660 PolarHBondContact OE2-NZ 2.85Å; K660-E662 PolarHBondContact O-N 3.11Å; K660-V663 PolarHBondContact O-N 3.25Å; K660-I664 PolarHBondContact O-N 3.37Å
661	S	89.7	Confident	94.5	Very high	84 Å²	84	54.5 Å²	54.5	59%	0.587	26%	0.264	S	S	*	.	H	α-helix	trans	-55.4	-28.5	-176.2	-51.9	0	0	0	0	114.3	V663 I664 V665	S661-V663 VanDerWaalsContact C-N 3.32Å; S661-V663 PolarHBondContact O-N 3.21Å; S661-I664 PolarHBondContact O-N 3.06Å; S661-V665 WeakPolarHBondContact O-CG2 3.16Å; S661-V665 PolarHBondContact O-N 3.35Å
662	E	87.7	Confident	94.4	Very high	119 Å²	119	53 Å²	53	56%	0.556	26%	0.256	S	S	*	.	H	α-helix	trans	-58.9	-40.5	177.6	-66.9	169.6	-172.3	0	0	112.7	K660	K660-E662 PolarHBondContact O-N 3.11Å
663	V	91.5	Very high	94.5	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.036	25%	0.252	C	S	.	.	H	α-helix	trans	-79.1	-40.2	177.3	-166.6	0	0	0	0	110.5	E608 A611 V659 K660 S661 V665 A666 F739	E608-V663 HydrophobicContact CG-CG2 4.44Å; A611-V663 HydrophobicContact CB-CG1 3.87Å; V659-V663 HydrophobicContact CG1-CB 3.77Å; V659-V663 HydrophobicContact CG1-CG1 4.29Å; V659-V663 HydrophobicContact CG1-CG2 3.99Å; K660-V663 PolarHBondContact O-N 3.25Å; S661-V663 VanDerWaalsContact C-N 3.32Å; S661-V663 PolarHBondContact O-N 3.21Å; V663-V665 VanDerWaalsContact C-N 3.34Å; V663-V665 PolarHBondContact O-N 2.92Å; V663-A666 VanDerWaalsContact O-CB 3.22Å; V663-A666 WeakPolarHBondContact O-CB 3.24Å; V663-A666 PolarHBondContact O-N 3.4Å; V663-F739 HydrophobicContact CB-CE2 4.24Å; V663-F739 HydrophobicContact CB-CZ 4.48Å; V663-F739 HydrophobicContact CG1-CE1 4.36Å; V663-F739 HydrophobicContact CG1-CE2 4.2Å; V663-F739 HydrophobicContact CG1-CZ 3.94Å; V663-F739 HydrophobicContact CG2-CD2 4.11Å; V663-F739 HydrophobicContact CG2-CE2 3.61Å; V663-F739 HydrophobicContact CG2-CZ 4.17Å
664	I	94.7	Very high	94.4	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-41.5	-178.8	-64.7	-55	0	0	0	112.2	K650 F653 E654 V659 K660 S661 A666 Y667	K650-I664 HydrophobicContact CD-CG2 4.34Å; K650-I664 WeakPolarHBondContact CE-O 3.43Å; K650-I664 HydrophobicContact CG-CG2 3.74Å; F653-I664 HydrophobicContact CB-CD1 3.58Å; E654-I664 HydrophobicContact CB-CD1 3.96Å; E654-I664 HydrophobicContact CB-CG1 4.16Å; E654-I664 HydrophobicContact CB-CG2 4.05Å; E654-I664 HydrophobicContact CG-CG2 4.24Å; V659-I664 HydrophobicContact CB-CD1 3.9Å; V659-I664 HydrophobicContact CB-CG1 4.31Å; V659-I664 HydrophobicContact CG1-CD1 4.23Å; V659-I664 HydrophobicContact CG1-CG1 4.45Å; V659-I664 WeakPolarHBondContact O-CG1 3.29Å; K660-I664 PolarHBondContact O-N 3.37Å; S661-I664 PolarHBondContact O-N 3.06Å; I664-A666 PolarHBondContact O-N 3.19Å; I664-Y667 WeakPolarHBondContact O-CB 3.45Å; I664-Y667 PolarHBondContact O-N 2.84Å
665	V	92.6	Very high	94.4	Very high	78 Å²	78	51.8 Å²	51.8	47%	0.473	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-64.1	-26.9	177.3	173.1	0	0	0	0	111.8	S661 V663 Y667 D668	S661-V665 WeakPolarHBondContact O-CG2 3.16Å; S661-V665 PolarHBondContact O-N 3.35Å; V663-V665 VanDerWaalsContact C-N 3.34Å; V663-V665 PolarHBondContact O-N 2.92Å; V665-Y667 PolarHBondContact O-N 2.82Å; V665-D668 WeakPolarHBondContact O-CB 3.4Å; V665-D668 PolarHBondContact O-N 3.45Å; V665-D668 VanDerWaalsContact O-N 3.13Å
666	A	94.5	Very high	94.4	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.025	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.9	-24.3	178.5	0	0	0	0	0	112.9	L615 V663 I664 D668 A669 F739 I741	L615-A666 VanDerWaalsContact CD2-C 3.48Å; L615-A666 HydrophobicContact CD2-CB 3.57Å; L615-A666 WeakPolarHBondContact CD2-O 3.36Å; V663-A666 VanDerWaalsContact O-CB 3.22Å; V663-A666 WeakPolarHBondContact O-CB 3.24Å; V663-A666 PolarHBondContact O-N 3.4Å; I664-A666 PolarHBondContact O-N 3.19Å; A666-D668 PolarHBondContact O-N 3.27Å; A666-A669 WeakPolarHBondContact O-CB 3.14Å; A666-A669 PolarHBondContact O-N 3.34Å; A666-A669 VanDerWaalsContact O-N 3.11Å; A666-F739 HydrophobicContact CB-CB 4.45Å; A666-F739 HydrophobicContact CB-CD1 3.89Å; A666-F739 HydrophobicContact CB-CG 4.4Å; A666-I741 HydrophobicContact CB-CB 4.2Å; A666-I741 HydrophobicContact CB-CG2 4.42Å
667	Y	96.2	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-65.8	-19.1	176.2	-82.1	-97.6	0	0	0	113.7	A611 L615 L649 K650 F653 I664 V665 A669 L670	A611-Y667 HydrophobicContact CB-CE2 4.42Å; A611-Y667 PolarHBondContact O-OH 3.5Å; L615-Y667 HydrophobicContact CB-CE1 4.25Å; L615-Y667 HydrophobicContact CB-CE2 4.16Å; L615-Y667 HydrophobicContact CD1-CD1 4.22Å; L615-Y667 HydrophobicContact CD1-CE1 4.35Å; L615-Y667 HydrophobicContact CD1-CG 4.48Å; L615-Y667 HydrophobicContact CD2-CD2 4.11Å; L615-Y667 HydrophobicContact CD2-CE2 4.29Å; L615-Y667 HydrophobicContact CD2-CG 4.38Å; L649-Y667 HydrophobicContact CB-CD1 4.06Å; L649-Y667 HydrophobicContact CB-CE1 3.59Å; L649-Y667 HydrophobicContact CD1-CE1 4.31Å; K650-Y667 HydrophobicContact CB-CD1 4.34Å; K650-Y667 HydrophobicContact CB-CG 4.05Å; K650-Y667 HydrophobicContact CG-CG 4.5Å; F653-Y667 HydrophobicContact CD2-CE1 4.36Å; F653-Y667 HydrophobicContact CD2-CE2 4.14Å; F653-Y667 AromaticContact CD2-CZ 3.67Å; F653-Y667 VanDerWaalsContact CD2-OH 3.23Å; F653-Y667 WeakPolarHBondContact CD2-OH 3.39Å; F653-Y667 HydrophobicContact CE2-CE1 4.49Å; F653-Y667 AromaticContact CE2-CZ 3.86Å; F653-Y667 WeakPolarHBondContact CE2-OH 3.48Å; I664-Y667 WeakPolarHBondContact O-CB 3.45Å; I664-Y667 PolarHBondContact O-N 2.84Å; V665-Y667 PolarHBondContact O-N 2.82Å; Y667-A669 PolarHBondContact O-N 3.03Å; Y667-L670 HydrophobicContact CD1-CD1 4.29Å; Y667-L670 WeakPolarHBondContact O-CB 3.38Å; Y667-L670 PolarHBondContact O-N 3.32Å
668	D	94.9	Very high	94.4	Very high	48 Å²	48	41.7 Å²	41.7	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-63.5	-13.5	173.5	-65.3	-31.2	0	0	0	112.3	K650 V665 A666 L670 T671 T672 F696	K650-D668 VanDerWaalsContact NZ-CG 3.26Å; K650-D668 IonicContact NZ-OD1 3.51Å; K650-D668 PolarHBondContact NZ-OD1 3.47Å; K650-D668 IonicContact NZ-OD2 3.07Å; K650-D668 PolarHBondContact NZ-OD2 3.45Å; K650-D668 VanDerWaalsContact NZ-OD2 3.1Å; V665-D668 WeakPolarHBondContact O-CB 3.4Å; V665-D668 PolarHBondContact O-N 3.45Å; V665-D668 VanDerWaalsContact O-N 3.13Å; A666-D668 PolarHBondContact O-N 3.27Å; D668-L670 VanDerWaalsContact C-N 3.29Å; D668-L670 PolarHBondContact O-N 3.39Å; D668-T671 PolarHBondContact O-N 2.93Å; D668-T672 WeakPolarHBondContact O-CB 3.4Å; D668-T672 PolarHBondContact O-N 3.49Å; D668-T672 PolarHBondContact O-OG1 3.21Å; D668-F696 HydrophobicContact CB-CZ 4.15Å
669	A	95.6	Very high	94.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-40.8	169.1	0	0	0	0	0	111.2	A666 Y667 T672 I673 F696 F742	A666-A669 WeakPolarHBondContact O-CB 3.14Å; A666-A669 PolarHBondContact O-N 3.34Å; A666-A669 VanDerWaalsContact O-N 3.11Å; Y667-A669 PolarHBondContact O-N 3.03Å; A669-T672 PolarHBondContact O-N 3.26Å; A669-I673 WeakPolarHBondContact O-CB 3.43Å; A669-I673 WeakPolarHBondContact O-CD1 3.38Å; A669-I673 WeakPolarHBondContact O-CG1 3.31Å; A669-I673 PolarHBondContact O-N 3Å; A669-F696 VanDerWaalsContact CA-CE2 3.45Å; A669-F696 VanDerWaalsContact CA-CZ 3.48Å; A669-F696 HydrophobicContact CB-CD1 4.3Å; A669-F696 HydrophobicContact CB-CD2 4.33Å; A669-F696 HydrophobicContact CB-CE1 3.87Å; A669-F696 HydrophobicContact CB-CE2 3.91Å; A669-F696 HydrophobicContact CB-CZ 3.68Å; A669-F742 HydrophobicContact CB-CE2 4.07Å; A669-F742 HydrophobicContact CB-CZ 4.04Å
670	L	97.6	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-45.5	178.2	-65.5	-179.3	0	0	0	110.9	L615 Y618 L619 L622 I642 Y667 D668 T672 I673 G674	L615-L670 HydrophobicContact CD1-CD1 3.85Å; L615-L670 HydrophobicContact CD1-CD2 4.22Å; L615-L670 HydrophobicContact CD1-CG 3.75Å; Y618-L670 HydrophobicContact CD1-CD1 4.02Å; Y618-L670 HydrophobicContact CD1-CD2 3.47Å; Y618-L670 VanDerWaalsContact CD1-CD2 3.47Å; Y618-L670 HydrophobicContact CD1-CG 4.42Å; Y618-L670 HydrophobicContact CE1-CD1 4.36Å; Y618-L670 HydrophobicContact CE1-CD2 3.88Å; Y618-L670 HydrophobicContact CG-CD1 4.13Å; Y618-L670 HydrophobicContact CG-CD2 4.26Å; L619-L670 HydrophobicContact CD2-CD2 3.65Å; L619-L670 HydrophobicContact CG-CD2 4.24Å; L622-L670 HydrophobicContact CD1-CD2 3.99Å; I642-L670 HydrophobicContact CG2-CB 4.07Å; I642-L670 HydrophobicContact CG2-CD2 4.26Å; I642-L670 VanDerWaalsContact CG2-O 3.22Å; I642-L670 WeakPolarHBondContact CG2-O 3.48Å; Y667-L670 HydrophobicContact CD1-CD1 4.29Å; Y667-L670 WeakPolarHBondContact O-CB 3.38Å; Y667-L670 PolarHBondContact O-N 3.32Å; D668-L670 VanDerWaalsContact C-N 3.29Å; D668-L670 PolarHBondContact O-N 3.39Å; L670-T672 VanDerWaalsContact C-N 3.31Å; L670-T672 PolarHBondContact O-N 3.38Å; L670-I673 CarbonylContact O-C 3.59Å; L670-I673 PolarHBondContact O-N 3.38Å; L670-G674 PolarHBondContact O-N 2.86Å
671	T	94.8	Very high	94.4	Very high	54 Å²	54	34.1 Å²	34.1	33%	0.331	19%	0.191	S	C	.	.	H	α-helix	trans	-58.7	-43.1	174.7	-58	0	0	0	0	112	T643 D668 G674 Q675	T643-T671 HydrophobicContact CG2-CG2 4.06Å; D668-T671 PolarHBondContact O-N 2.93Å; T671-G674 PolarHBondContact O-N 2.83Å; T671-Q675 PolarHBondContact O-N 2.93Å
672	T	95.1	Very high	94.4	Very high	11 Å²	11	33.5 Å²	33.5	7%	0.067	18%	0.184	C	C	.	.	H	α-helix	trans	-68.2	-38.5	179.5	-54.9	0	0	0	0	112	D668 A669 L670 Q675 L676 L692 Q695	D668-T672 WeakPolarHBondContact O-CB 3.4Å; D668-T672 PolarHBondContact O-N 3.49Å; D668-T672 PolarHBondContact O-OG1 3.21Å; A669-T672 PolarHBondContact O-N 3.26Å; L670-T672 VanDerWaalsContact C-N 3.31Å; L670-T672 PolarHBondContact O-N 3.38Å; T672-Q675 PolarHBondContact O-N 3.17Å; T672-L676 PolarHBondContact O-N 3.21Å; T672-L692 HydrophobicContact CG2-CB 3.91Å; T672-L692 HydrophobicContact CG2-CD1 3.75Å; T672-L692 HydrophobicContact CG2-CG 4.44Å; T672-Q695 PolarHBondContact OG1-OE1 3.49Å
673	I	97	Very high	94.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-40.1	172.3	-68.8	166.6	0	0	0	110.4	L619 L622 A669 L670 Q675 L676 F677 L692 L707 F742	L619-I673 HydrophobicContact CD2-CD1 3.44Å; L619-I673 VanDerWaalsContact CD2-CD1 3.44Å; L622-I673 HydrophobicContact CD1-CD1 4.47Å; L622-I673 HydrophobicContact CD1-CG2 3.98Å; A669-I673 WeakPolarHBondContact O-CB 3.43Å; A669-I673 WeakPolarHBondContact O-CD1 3.38Å; A669-I673 WeakPolarHBondContact O-CG1 3.31Å; A669-I673 PolarHBondContact O-N 3Å; L670-I673 CarbonylContact O-C 3.59Å; L670-I673 PolarHBondContact O-N 3.38Å; I673-Q675 VanDerWaalsContact C-N 3.26Å; I673-Q675 PolarHBondContact O-N 2.9Å; I673-L676 WeakPolarHBondContact O-CA 3.46Å; I673-L676 WeakPolarHBondContact O-CB 3.48Å; I673-L676 PolarHBondContact O-N 3.18Å; I673-F677 HydrophobicContact CG2-CD2 4.08Å; I673-F677 HydrophobicContact CG2-CE2 3.77Å; I673-F677 WeakPolarHBondContact O-CD2 3.5Å; I673-F677 PolarHBondContact O-N 2.63Å; I673-L692 HydrophobicContact CG1-CD1 4.18Å; I673-L692 HydrophobicContact CG1-CD2 4.48Å; I673-L707 HydrophobicContact CD1-CD1 4.02Å; I673-L707 HydrophobicContact CD1-CD2 4.33Å; I673-L707 HydrophobicContact CG1-CD1 3.91Å; I673-L707 HydrophobicContact CG2-CD1 4.44Å; I673-L707 HydrophobicContact CG2-CD2 3.8Å; I673-F742 HydrophobicContact CD1-CE1 4.34Å; I673-F742 HydrophobicContact CD1-CZ 4.12Å
674	G	97	Very high	94.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-43.5	175.9	0	0	0	0	0	111.6	G639 L670 T671 L676 F677 L678	G639-G674 WeakPolarHBondContact CA-O 3.35Å; L670-G674 PolarHBondContact O-N 2.86Å; T671-G674 PolarHBondContact O-N 2.83Å; G674-L676 VanDerWaalsContact C-N 3.31Å; G674-L676 PolarHBondContact O-N 2.89Å; G674-F677 PolarHBondContact O-N 3.27Å; G674-L678 WeakPolarHBondContact O-CG 3.26Å; G674-L678 PolarHBondContact O-N 2.99Å
675	Q	96.2	Very high	94.5	Very high	86 Å²	86	35.6 Å²	35.6	40%	0.402	20%	0.203	S	C	.	.	H	α-helix	trans	-58.7	-41.1	172.7	-174.1	57.3	41.8	0	0	112.4	T671 T672 I673 F677 L678 T679	T671-Q675 PolarHBondContact O-N 2.93Å; T672-Q675 PolarHBondContact O-N 3.17Å; I673-Q675 VanDerWaalsContact C-N 3.26Å; I673-Q675 PolarHBondContact O-N 2.9Å; Q675-F677 PolarHBondContact O-N 3.16Å; Q675-F677 VanDerWaalsContact O-N 3.17Å; Q675-L678 PolarHBondContact O-N 2.96Å; Q675-L678 VanDerWaalsContact O-N 3.08Å; Q675-T679 PolarHBondContact O-N 3.18Å; Q675-T679 VanDerWaalsContact O-N 3.09Å; Q675-T679 PolarHBondContact O-OG1 2.95Å
676	L	95.1	Very high	94.5	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-59.2	-26	174.6	-171.8	70.5	0	0	0	112.1	T672 I673 G674 L685 D688 I689 L707 L708 R711	T672-L676 PolarHBondContact O-N 3.21Å; I673-L676 WeakPolarHBondContact O-CA 3.46Å; I673-L676 WeakPolarHBondContact O-CB 3.48Å; I673-L676 PolarHBondContact O-N 3.18Å; G674-L676 VanDerWaalsContact C-N 3.31Å; G674-L676 PolarHBondContact O-N 2.89Å; L676-L685 HydrophobicContact CD1-CD2 3.74Å; L676-D688 HydrophobicContact CD1-CB 3.69Å; L676-I689 HydrophobicContact CD1-CG1 4.15Å; L676-L707 HydrophobicContact CD2-CB 3.92Å; L676-L707 HydrophobicContact CD2-CD1 4.48Å; L676-L708 HydrophobicContact CD1-CD2 4.24Å; L676-L708 HydrophobicContact CD2-CD2 4.41Å; L676-R711 PolarHBondContact O-NH1 3.29Å
677	F	95.8	Very high	94.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-88.2	-31.1	173.9	-76.5	-106.9	0	0	0	112.5	M569 L629 R635 A638 I642 I673 G674 Q675 T679 L707 A710 R711	M569-F677 HydrophobicContact CE-CE1 4.34Å; L629-F677 HydrophobicContact CD1-CD1 3.63Å; L629-F677 HydrophobicContact CD1-CE1 3.52Å; R635-F677 HydrophobicContact CG-CB 4.3Å; R635-F677 HydrophobicContact CG-CD1 4.07Å; R635-F677 WeakPolarHBondContact CG-O 3.48Å; R635-F677 PolarHBondContact NE-O 2.8Å; A638-F677 HydrophobicContact CB-CD1 4.19Å; I642-F677 HydrophobicContact CD1-CD2 4Å; I642-F677 HydrophobicContact CD1-CE2 4.11Å; I642-F677 HydrophobicContact CD1-CG 4.3Å; I642-F677 HydrophobicContact CD1-CZ 4.49Å; I673-F677 HydrophobicContact CG2-CD2 4.08Å; I673-F677 HydrophobicContact CG2-CE2 3.77Å; I673-F677 WeakPolarHBondContact O-CD2 3.5Å; I673-F677 PolarHBondContact O-N 2.63Å; G674-F677 PolarHBondContact O-N 3.27Å; Q675-F677 PolarHBondContact O-N 3.16Å; Q675-F677 VanDerWaalsContact O-N 3.17Å; F677-T679 VanDerWaalsContact C-N 3.33Å; F677-T679 PolarHBondContact O-N 3.02Å; F677-L707 HydrophobicContact CE2-CD2 4.44Å; F677-A710 HydrophobicContact CE1-CB 4.44Å; F677-A710 HydrophobicContact CZ-CB 3.99Å; F677-R711 HydrophobicContact CD1-CG 4.17Å; F677-R711 HydrophobicContact CE1-CG 4.18Å; F677-R711 HydrophobicContact CG-CG 4.41Å; F677-R711 HydrophobicContact CZ-CG 4.44Å
678	L	96.6	Very high	94.2	Very high	47 Å²	47	40.8 Å²	40.8	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-28.9	178.3	-68.7	171.8	0	0	0	113.4	K636 E640 G674 Q675 T680	K636-L678 HydrophobicContact CG-CD2 4.06Å; E640-L678 HydrophobicContact CG-CD2 3.81Å; G674-L678 WeakPolarHBondContact O-CG 3.26Å; G674-L678 PolarHBondContact O-N 2.99Å; Q675-L678 PolarHBondContact O-N 2.96Å; Q675-L678 VanDerWaalsContact O-N 3.08Å; L678-T680 PolarHBondContact O-N 2.87Å
679	T	95.1	Very high	94.1	Very high	15 Å²	15	38.6 Å²	38.6	9%	0.092	22%	0.219	C	C	.	.			trans	-63.9	116.6	179.2	-63.9	0	0	0	0	111.4	Q675 F677 D681 M684 L685 D688 R711	Q675-T679 PolarHBondContact O-N 3.18Å; Q675-T679 VanDerWaalsContact O-N 3.09Å; Q675-T679 PolarHBondContact O-OG1 2.95Å; F677-T679 VanDerWaalsContact C-N 3.33Å; F677-T679 PolarHBondContact O-N 3.02Å; T679-D681 VanDerWaalsContact CG2-O 3.31Å; T679-D681 WeakPolarHBondContact CG2-O 3.29Å; T679-M684 HydrophobicContact CG2-CB 3.9Å; T679-L685 HydrophobicContact CG2-CD2 4.08Å; T679-D688 WeakPolarHBondContact CB-OD2 3.37Å; T679-D688 WeakPolarHBondContact CG2-OD2 3.34Å; T679-D688 PolarHBondContact OG1-OD2 3.49Å; T679-R711 PolarHBondContact O-NH1 2.9Å; T679-R711 PolarHBondContact O-NH2 3.25Å
680	T	91.8	Very high	93.9	Very high	74 Å²	74	40.6 Å²	40.6	45%	0.454	24%	0.235	S	C	.	.			trans	-87.8	-42.9	-179.4	52.7	0	0	0	0	112.1	E632 L678 T682	E632-T680 HydrophobicContact CG-CG2 4.08Å; E632-T680 WeakPolarHBondContact OE1-CG2 3.35Å; L678-T680 PolarHBondContact O-N 2.87Å; T680-T682 PolarHBondContact O-N 3.48Å
681	D	92.4	Very high	93.6	Very high	86 Å²	86	42.5 Å²	42.5	46%	0.46	25%	0.245	S	C	.	.			trans	-75.7	104.3	175	-174.2	-9	0	0	0	110.5	T679 S683 M684	T679-D681 VanDerWaalsContact CG2-O 3.31Å; T679-D681 WeakPolarHBondContact CG2-O 3.29Å; D681-S683 PolarHBondContact O-N 2.86Å; D681-S683 VanDerWaalsContact O-N 3.09Å; D681-S683 VanDerWaalsContact OD1-CB 3.27Å; D681-S683 WeakPolarHBondContact OD1-CB 3.49Å; D681-S683 PolarHBondContact OD1-N 3.16Å; D681-S683 PolarHBondContact OD1-OG 2.87Å; D681-S683 PolarHBondContact OD2-OG 3.45Å; D681-M684 HydrophobicContact CB-CG 4.1Å; D681-M684 WeakPolarHBondContact O-CB 3.31Å; D681-M684 PolarHBondContact O-N 3.39Å
682	T	90.5	Very high	93.5	Very high	71 Å²	71	40 Å²	40	44%	0.436	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-59.4	-20.7	179.7	58.9	0	0	0	0	113.7	T680 M684 L685	T680-T682 PolarHBondContact O-N 3.48Å; T682-M684 PolarHBondContact O-N 2.67Å; T682-L685 HydrophobicContact CG2-CD1 4.14Å; T682-L685 WeakPolarHBondContact O-CB 3.46Å; T682-L685 WeakPolarHBondContact O-CG 3.39Å; T682-L685 PolarHBondContact O-N 2.8Å
683	S	90.5	Very high	93.3	Very high	80 Å²	80	40.6 Å²	40.6	56%	0.559	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-69.1	-18	174.5	76.1	0	0	0	0	113.2	D681 P686	D681-S683 PolarHBondContact O-N 2.86Å; D681-S683 VanDerWaalsContact O-N 3.09Å; D681-S683 VanDerWaalsContact OD1-CB 3.27Å; D681-S683 WeakPolarHBondContact OD1-CB 3.49Å; D681-S683 PolarHBondContact OD1-N 3.16Å; D681-S683 PolarHBondContact OD1-OG 2.87Å; D681-S683 PolarHBondContact OD2-OG 3.45Å; S683-P686 WeakPolarHBondContact O-CD 3.48Å
684	M	92.6	Very high	93	Very high	91 Å²	91	48.4 Å²	48.4	45%	0.448	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-90.6	-12.5	177.8	-62.6	-65.9	-77.7	0	0	113.5	T679 D681 T682 P686 L687	T679-M684 HydrophobicContact CG2-CB 3.9Å; D681-M684 HydrophobicContact CB-CG 4.1Å; D681-M684 WeakPolarHBondContact O-CB 3.31Å; D681-M684 PolarHBondContact O-N 3.39Å; T682-M684 PolarHBondContact O-N 2.67Å; M684-P686 VanDerWaalsContact C-N 3.32Å; M684-L687 HydrophobicContact CE-CD1 3.48Å; M684-L687 VanDerWaalsContact CE-CD1 3.48Å; M684-L687 WeakPolarHBondContact O-CB 3.19Å; M684-L687 PolarHBondContact O-N 2.89Å; M684-L687 HydrophobicContact SD-CD1 3.94Å
685	L	93.1	Very high	92.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-54.4	-35.5	178.7	-66.7	172.7	0	0	0	114.8	L676 T679 T682 L687 D688 I689 L708 V714 L722	L676-L685 HydrophobicContact CD1-CD2 3.74Å; T679-L685 HydrophobicContact CG2-CD2 4.08Å; T682-L685 HydrophobicContact CG2-CD1 4.14Å; T682-L685 WeakPolarHBondContact O-CB 3.46Å; T682-L685 WeakPolarHBondContact O-CG 3.39Å; T682-L685 PolarHBondContact O-N 2.8Å; L685-L687 PolarHBondContact O-N 3.24Å; L685-D688 PolarHBondContact O-N 2.63Å; L685-I689 WeakPolarHBondContact O-CD1 3.46Å; L685-I689 VanDerWaalsContact O-CG1 3.24Å; L685-I689 WeakPolarHBondContact O-CG1 3.22Å; L685-I689 PolarHBondContact O-N 2.79Å; L685-L708 HydrophobicContact CD1-CD2 4.2Å; L685-V714 HydrophobicContact CD1-CG2 3.69Å; L685-L722 HydrophobicContact CB-CD1 4.33Å; L685-L722 HydrophobicContact CD1-CD1 4.21Å
686	P	91.9	Very high	92.4	Very high	59 Å²	59	48.3 Å²	48.3	38%	0.383	26%	0.261	S	S	.	.	H	α-helix	trans	-54.2	-35.2	172.8	-27.2	34.7	0	0	0	114	S683 M684 A690 L722	S683-P686 WeakPolarHBondContact O-CD 3.48Å; M684-P686 VanDerWaalsContact C-N 3.32Å; P686-A690 VanDerWaalsContact O-CB 3.28Å; P686-A690 WeakPolarHBondContact O-CB 3.4Å; P686-A690 PolarHBondContact O-N 3.13Å; P686-L722 HydrophobicContact CG-CD2 3.72Å
687	L	91.5	Very high	92.2	Very high	107 Å²	107	50.7 Å²	50.7	56%	0.56	28%	0.276	S	S	*	.	H	α-helix	trans	-71.2	-41.5	178.7	-63.5	172.9	0	0	0	111.5	M684 L685 A690 N691	M684-L687 HydrophobicContact CE-CD1 3.48Å; M684-L687 VanDerWaalsContact CE-CD1 3.48Å; M684-L687 WeakPolarHBondContact O-CB 3.19Å; M684-L687 PolarHBondContact O-N 2.89Å; M684-L687 HydrophobicContact SD-CD1 3.94Å; L685-L687 PolarHBondContact O-N 3.24Å; L687-A690 PolarHBondContact O-N 3.26Å; L687-N691 PolarHBondContact O-N 2.93Å
688	D	93.2	Very high	92	Very high	25 Å²	25	51.9 Å²	51.9	13%	0.134	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-42.9	176.5	-64.4	-37.8	0	0	0	111.2	L676 T679 L685 A690 N691 L692	L676-D688 HydrophobicContact CD1-CB 3.69Å; T679-D688 WeakPolarHBondContact CB-OD2 3.37Å; T679-D688 WeakPolarHBondContact CG2-OD2 3.34Å; T679-D688 PolarHBondContact OG1-OD2 3.49Å; L685-D688 PolarHBondContact O-N 2.63Å; D688-A690 VanDerWaalsContact C-N 3.34Å; D688-A690 PolarHBondContact O-N 2.95Å; D688-N691 PolarHBondContact O-N 3.31Å; D688-L692 WeakPolarHBondContact O-CB 3.23Å; D688-L692 PolarHBondContact O-N 3.31Å
689	I	93.5	Very high	91.8	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-42.7	175.4	-63.9	163	0	0	0	110.5	L676 L685 N691 L692 K693 V704 L708 L722	L676-I689 HydrophobicContact CD1-CG1 4.15Å; L685-I689 WeakPolarHBondContact O-CD1 3.46Å; L685-I689 VanDerWaalsContact O-CG1 3.24Å; L685-I689 WeakPolarHBondContact O-CG1 3.22Å; L685-I689 PolarHBondContact O-N 2.79Å; I689-N691 VanDerWaalsContact C-N 3.33Å; I689-N691 PolarHBondContact O-N 3.39Å; I689-L692 PolarHBondContact O-N 2.96Å; I689-K693 HydrophobicContact CG2-CD 4.42Å; I689-K693 WeakPolarHBondContact O-CG 3.23Å; I689-K693 PolarHBondContact O-N 3.23Å; I689-V704 HydrophobicContact CD1-CG1 4.26Å; I689-V704 HydrophobicContact CG1-CG1 4.07Å; I689-V704 HydrophobicContact CG2-CG1 3.88Å; I689-L708 HydrophobicContact CD1-CD1 3.93Å; I689-L708 HydrophobicContact CD1-CD2 4.22Å; I689-L722 HydrophobicContact CD1-CB 3.87Å
690	A	90.8	Very high	91.6	Very high	42 Å²	42	54.9 Å²	54.9	35%	0.347	29%	0.29	S	S	.	.	H	α-helix	trans	-62.6	-40.5	175.8	0	0	0	0	0	111.5	P686 L687 D688 R694	P686-A690 VanDerWaalsContact O-CB 3.28Å; P686-A690 WeakPolarHBondContact O-CB 3.4Å; P686-A690 PolarHBondContact O-N 3.13Å; L687-A690 PolarHBondContact O-N 3.26Å; D688-A690 VanDerWaalsContact C-N 3.34Å; D688-A690 PolarHBondContact O-N 2.95Å; A690-R694 VanDerWaalsContact O-CB 3.23Å; A690-R694 WeakPolarHBondContact O-CB 3.29Å; A690-R694 PolarHBondContact O-N 3.19Å
691	N	92	Very high	91.6	Very high	40 Å²	40	53.5 Å²	53.5	21%	0.214	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-43.7	175.4	-177.1	55.1	0	0	0	112.1	L687 D688 I689 R694 Q695	L687-N691 PolarHBondContact O-N 2.93Å; D688-N691 PolarHBondContact O-N 3.31Å; I689-N691 VanDerWaalsContact C-N 3.33Å; I689-N691 PolarHBondContact O-N 3.39Å; N691-R694 PolarHBondContact O-N 3.26Å; N691-R694 PolarHBondContact OD1-NH2 3.37Å; N691-Q695 PolarHBondContact ND2-NE2 3.27Å; N691-Q695 WeakPolarHBondContact O-CG 3.37Å; N691-Q695 PolarHBondContact O-N 3.05Å; N691-Q695 PolarHBondContact OD1-NE2 2.73Å; N691-Q695 VanDerWaalsContact OD1-NE2 3.13Å
692	L	92.8	Very high	91.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-58.2	-49.9	175.3	-179	63.7	0	0	0	111.3	T672 I673 D688 I689 R694 Q695 F696 V699 L707 F742	T672-L692 HydrophobicContact CG2-CB 3.91Å; T672-L692 HydrophobicContact CG2-CD1 3.75Å; T672-L692 HydrophobicContact CG2-CG 4.44Å; I673-L692 HydrophobicContact CG1-CD1 4.18Å; I673-L692 HydrophobicContact CG1-CD2 4.48Å; D688-L692 WeakPolarHBondContact O-CB 3.23Å; D688-L692 PolarHBondContact O-N 3.31Å; I689-L692 PolarHBondContact O-N 2.96Å; L692-R694 VanDerWaalsContact C-N 3.31Å; L692-R694 PolarHBondContact O-N 3.49Å; L692-Q695 PolarHBondContact O-N 3.28Å; L692-F696 HydrophobicContact CD1-CD2 4Å; L692-F696 WeakPolarHBondContact O-CA 3.41Å; L692-F696 WeakPolarHBondContact O-CB 3.37Å; L692-F696 PolarHBondContact O-N 3.37Å; L692-V699 HydrophobicContact CD2-CG2 4.32Å; L692-V699 HydrophobicContact CG-CG1 4.36Å; L692-L707 HydrophobicContact CD2-CD1 4.12Å; L692-F742 HydrophobicContact CD1-CE2 4.48Å; L692-F742 HydrophobicContact CD1-CZ 4.23Å
693	K	90.3	Very high	91.8	Very high	24 Å²	24	49.9 Å²	49.9	10%	0.104	26%	0.262	C	S	.	.	H	α-helix	trans	-65.6	-31.7	177.1	-72.7	-173.2	-179.8	-173.1	0	113.3	I689 F696 P697 V699 S726	I689-K693 HydrophobicContact CG2-CD 4.42Å; I689-K693 WeakPolarHBondContact O-CG 3.23Å; I689-K693 PolarHBondContact O-N 3.23Å; K693-F696 CarbonylContact O-C 3.55Å; K693-P697 WeakPolarHBondContact O-CA 3.19Å; K693-V699 HydrophobicContact CB-CG1 4.34Å; K693-V699 HydrophobicContact CG-CG1 3.62Å; K693-S726 WeakPolarHBondContact CD-O 3.38Å; K693-S726 WeakPolarHBondContact CE-OG 3.27Å; K693-S726 PolarHBondContact NZ-O 3.5Å; K693-S726 PolarHBondContact NZ-OG 3.23Å
694	R	89.7	Confident	92	Very high	164 Å²	164	46.1 Å²	46.1	62%	0.619	24%	0.235	S	C	*	.	H	α-helix	trans	-68.6	-45.3	176.8	-179.2	-177.2	64.5	156.8	-0.9	111.3	A690 N691 L692	A690-R694 VanDerWaalsContact O-CB 3.23Å; A690-R694 WeakPolarHBondContact O-CB 3.29Å; A690-R694 PolarHBondContact O-N 3.19Å; N691-R694 PolarHBondContact O-N 3.26Å; N691-R694 PolarHBondContact OD1-NH2 3.37Å; L692-R694 VanDerWaalsContact C-N 3.31Å; L692-R694 PolarHBondContact O-N 3.49Å
695	Q	90.1	Very high	92.1	Very high	79 Å²	79	44.9 Å²	44.9	37%	0.369	23%	0.226	S	C	.	.	H	α-helix	trans	-76.3	-34.7	179.8	-66.4	-171.5	24.5	0	0	112.3	T672 N691 L692	T672-Q695 PolarHBondContact OG1-OE1 3.49Å; N691-Q695 PolarHBondContact ND2-NE2 3.27Å; N691-Q695 WeakPolarHBondContact O-CG 3.37Å; N691-Q695 PolarHBondContact O-N 3.05Å; N691-Q695 PolarHBondContact OD1-NE2 2.73Å; N691-Q695 VanDerWaalsContact OD1-NE2 3.13Å; L692-Q695 PolarHBondContact O-N 3.28Å
696	F	91.9	Very high	92.2	Very high	5 Å²	5	45.9 Å²	45.9	2%	0.022	23%	0.234	C	C	.	.			trans	-127.7	78.9	-178.5	-58.7	-83.6	0	0	0	110.3	D668 A669 L692 K693 D698 V699 I741 F742	D668-F696 HydrophobicContact CB-CZ 4.15Å; A669-F696 VanDerWaalsContact CA-CE2 3.45Å; A669-F696 VanDerWaalsContact CA-CZ 3.48Å; A669-F696 HydrophobicContact CB-CD1 4.3Å; A669-F696 HydrophobicContact CB-CD2 4.33Å; A669-F696 HydrophobicContact CB-CE1 3.87Å; A669-F696 HydrophobicContact CB-CE2 3.91Å; A669-F696 HydrophobicContact CB-CZ 3.68Å; L692-F696 HydrophobicContact CD1-CD2 4Å; L692-F696 WeakPolarHBondContact O-CA 3.41Å; L692-F696 WeakPolarHBondContact O-CB 3.37Å; L692-F696 PolarHBondContact O-N 3.37Å; K693-F696 CarbonylContact O-C 3.55Å; F696-D698 PolarHBondContact O-N 2.96Å; F696-D698 VanDerWaalsContact O-N 3.1Å; F696-V699 WeakPolarHBondContact O-CB 3.39Å; F696-V699 WeakPolarHBondContact O-CG1 3.46Å; F696-V699 PolarHBondContact O-N 3.16Å; F696-V699 VanDerWaalsContact O-N 3.09Å; F696-I741 HydrophobicContact CD1-CG2 4.13Å; F696-I741 HydrophobicContact CE1-CG2 4.44Å; F696-F742 HydrophobicContact CB-CD2 3.72Å; F696-F742 HydrophobicContact CB-CE2 3.48Å; F696-F742 VanDerWaalsContact CB-CE2 3.48Å; F696-F742 HydrophobicContact CD1-CD2 4.33Å; F696-F742 AromaticContact CD1-CE2 3.94Å; F696-F742 HydrophobicContact CD1-CE2 3.94Å; F696-F742 HydrophobicContact CD2-CE2 4.29Å; F696-F742 HydrophobicContact CG-CD2 4.21Å; F696-F742 AromaticContact CG-CE2 3.63Å; F696-F742 HydrophobicContact CG-CE2 3.63Å
697	P	90	Very high	92.3	Very high	52 Å²	52	43.1 Å²	43.1	34%	0.338	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.5	-175.5	-22.4	34.5	0	0	0	114.5	K693 V699 S733	K693-P697 WeakPolarHBondContact O-CA 3.19Å; P697-V699 VanDerWaalsContact C-N 3.34Å; P697-S733 WeakPolarHBondContact CG-OG 3.32Å
698	D	92.1	Very high	92.5	Very high	25 Å²	25	38 Å²	38	13%	0.134	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-5.6	178.3	66.7	-55	0	0	0	113.7	F696 R700 A740 I741 F742 T743	F696-D698 PolarHBondContact O-N 2.96Å; F696-D698 VanDerWaalsContact O-N 3.1Å; D698-R700 PolarHBondContact O-N 3.14Å; D698-A740 HydrophobicContact CB-CB 4.38Å; D698-A740 WeakPolarHBondContact OD2-CA 3.36Å; D698-I741 PolarHBondContact OD2-N 3.35Å; D698-F742 WeakPolarHBondContact OD2-CA 3.39Å; D698-F742 WeakPolarHBondContact OD2-CB 3.42Å; D698-F742 PolarHBondContact OD2-N 3.4Å; D698-T743 PolarHBondContact OD2-N 2.87Å; D698-T743 VanDerWaalsContact OD2-N 3.1Å
699	V	91.9	Very high	92.5	Very high	11 Å²	11	39.5 Å²	39.5	7%	0.067	20%	0.199	C	C	.	.			trans	-64.1	127.4	173.4	74	0	0	0	0	110.9	L692 K693 F696 P697 Q703 V704 F742	L692-V699 HydrophobicContact CD2-CG2 4.32Å; L692-V699 HydrophobicContact CG-CG1 4.36Å; K693-V699 HydrophobicContact CB-CG1 4.34Å; K693-V699 HydrophobicContact CG-CG1 3.62Å; F696-V699 WeakPolarHBondContact O-CB 3.39Å; F696-V699 WeakPolarHBondContact O-CG1 3.46Å; F696-V699 PolarHBondContact O-N 3.16Å; F696-V699 VanDerWaalsContact O-N 3.09Å; P697-V699 VanDerWaalsContact C-N 3.34Å; V699-Q703 HydrophobicContact CG2-CB 4.27Å; V699-V704 HydrophobicContact CG1-CG2 4.37Å; V699-V704 HydrophobicContact CG2-CG2 3.99Å; V699-F742 HydrophobicContact CB-CB 4.34Å; V699-F742 HydrophobicContact CB-CD1 4.23Å; V699-F742 HydrophobicContact CB-CD2 3.81Å; V699-F742 HydrophobicContact CB-CE2 4.13Å; V699-F742 HydrophobicContact CB-CG 3.86Å; V699-F742 HydrophobicContact CB-CZ 4.46Å; V699-F742 HydrophobicContact CG2-CD1 3.77Å; V699-F742 HydrophobicContact CG2-CD2 4.2Å; V699-F742 HydrophobicContact CG2-CE1 3.86Å; V699-F742 HydrophobicContact CG2-CE2 4.29Å; V699-F742 HydrophobicContact CG2-CG 3.94Å; V699-F742 HydrophobicContact CG2-CZ 4.11Å
700	R	91.6	Very high	92.5	Very high	114 Å²	114	39.7 Å²	39.7	43%	0.43	20%	0.201	S	C	.	.			trans	-89.1	153.5	-177.7	-62.5	173.8	49.7	174	-6.6	112.3	D698 D702 Q703 V704	D698-R700 PolarHBondContact O-N 3.14Å; R700-D702 VanDerWaalsContact C-N 3.25Å; R700-D702 WeakPolarHBondContact CB-OD1 3.49Å; R700-D702 IonicContact CZ-OD1 2.76Å; R700-D702 VanDerWaalsContact CZ-OD1 3.28Å; R700-D702 IonicContact CZ-OD2 3.53Å; R700-D702 IonicContact NE-OD1 2.7Å; R700-D702 PolarHBondContact NE-OD1 2.92Å; R700-D702 IonicContact NE-OD2 3.19Å; R700-D702 IonicContact NH2-OD1 2.81Å; R700-D702 PolarHBondContact NH2-OD1 3.42Å; R700-D702 IonicContact NH2-OD2 3.81Å; R700-D702 PolarHBondContact NH2-OD2 3.27Å; R700-D702 PolarHBondContact O-N 3.25Å; R700-Q703 HydrophobicContact CB-CG 4.35Å; R700-Q703 WeakPolarHBondContact O-CB 3.29Å; R700-Q703 PolarHBondContact O-N 3.49Å; R700-Q703 VanDerWaalsContact O-N 3.07Å; R700-V704 PolarHBondContact O-N 3.41Å
701	S	91.6	Very high	92.6	Very high	45 Å²	45	37.7 Å²	37.7	32%	0.315	18%	0.184	S	C	.	.	H	α-helix	trans	-58.7	-35	177.1	-72.5	0	0	0	0	112.9	V704 Y705 S723	S701-V704 PolarHBondContact O-N 3.19Å; S701-Y705 WeakPolarHBondContact O-CB 3.5Å; S701-Y705 PolarHBondContact O-N 2.78Å; S701-S723 WeakPolarHBondContact CB-O 3.45Å; S701-S723 WeakPolarHBondContact O-CB 3.19Å; S701-S723 PolarHBondContact OG-O 2.98Å
702	D	92.1	Very high	92.5	Very high	78 Å²	78	38 Å²	38	42%	0.417	20%	0.197	S	C	.	.	H	α-helix	trans	-66.9	-34.9	175.4	52.7	-71	0	0	0	113.1	R700 Y705 A706	R700-D702 VanDerWaalsContact C-N 3.25Å; R700-D702 WeakPolarHBondContact CB-OD1 3.49Å; R700-D702 IonicContact CZ-OD1 2.76Å; R700-D702 VanDerWaalsContact CZ-OD1 3.28Å; R700-D702 IonicContact CZ-OD2 3.53Å; R700-D702 IonicContact NE-OD1 2.7Å; R700-D702 PolarHBondContact NE-OD1 2.92Å; R700-D702 IonicContact NE-OD2 3.19Å; R700-D702 IonicContact NH2-OD1 2.81Å; R700-D702 PolarHBondContact NH2-OD1 3.42Å; R700-D702 IonicContact NH2-OD2 3.81Å; R700-D702 PolarHBondContact NH2-OD2 3.27Å; R700-D702 PolarHBondContact O-N 3.25Å; D702-Y705 WeakPolarHBondContact O-CB 3.19Å; D702-Y705 PolarHBondContact O-N 2.99Å; D702-A706 WeakPolarHBondContact O-CB 3.43Å; D702-A706 PolarHBondContact O-N 2.6Å
703	Q	94.4	Very high	92.5	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.019	21%	0.211	C	C	.	.	H	α-helix	trans	-69.9	-41.4	173.5	-65.7	167.2	-35.2	0	0	111.1	I623 V699 R700 A706 L707 F742	I623-Q703 HydrophobicContact CD1-CG 4.25Å; V699-Q703 HydrophobicContact CG2-CB 4.27Å; R700-Q703 HydrophobicContact CB-CG 4.35Å; R700-Q703 WeakPolarHBondContact O-CB 3.29Å; R700-Q703 PolarHBondContact O-N 3.49Å; R700-Q703 VanDerWaalsContact O-N 3.07Å; Q703-A706 PolarHBondContact O-N 3.11Å; Q703-L707 WeakPolarHBondContact O-CG 3.37Å; Q703-L707 PolarHBondContact O-N 3.06Å; Q703-F742 PolarHBondContact NE2-O 3.23Å
704	V	95.2	Very high	92.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-45.1	173.4	176.4	0	0	0	0	110.8	I689 V699 R700 S701 A706 L707 L708	I689-V704 HydrophobicContact CD1-CG1 4.26Å; I689-V704 HydrophobicContact CG1-CG1 4.07Å; I689-V704 HydrophobicContact CG2-CG1 3.88Å; V699-V704 HydrophobicContact CG1-CG2 4.37Å; V699-V704 HydrophobicContact CG2-CG2 3.99Å; R700-V704 PolarHBondContact O-N 3.41Å; S701-V704 PolarHBondContact O-N 3.19Å; V704-A706 VanDerWaalsContact C-N 3.33Å; V704-A706 PolarHBondContact O-N 3.5Å; V704-L707 PolarHBondContact O-N 2.98Å; V704-L708 HydrophobicContact CG1-CD1 4.07Å; V704-L708 HydrophobicContact CG1-CG 4.44Å; V704-L708 WeakPolarHBondContact O-CG 3.24Å; V704-L708 PolarHBondContact O-N 3.5Å
705	Y	94.9	Very high	92.6	Very high	66 Å²	66	35.3 Å²	35.3	26%	0.259	20%	0.201	S	C	.	.	H	α-helix	trans	-56.1	-48.1	174.3	167.7	-100	0	0	0	111.3	S701 D702 L707 L708 V709 S716 A719 K720	S701-Y705 WeakPolarHBondContact O-CB 3.5Å; S701-Y705 PolarHBondContact O-N 2.78Å; D702-Y705 WeakPolarHBondContact O-CB 3.19Å; D702-Y705 PolarHBondContact O-N 2.99Å; Y705-L707 PolarHBondContact O-N 2.85Å; Y705-L708 PolarHBondContact O-N 2.58Å; Y705-V709 HydrophobicContact CD1-CG2 4.48Å; Y705-V709 HydrophobicContact CD2-CG2 4.15Å; Y705-V709 HydrophobicContact CE1-CG2 4Å; Y705-V709 HydrophobicContact CE2-CG2 3.62Å; Y705-V709 WeakPolarHBondContact O-CG2 3.28Å; Y705-V709 PolarHBondContact O-N 2.92Å; Y705-S716 PolarHBondContact OH-OG 3.08Å; Y705-A719 HydrophobicContact CD2-CB 3.77Å; Y705-A719 HydrophobicContact CE2-CB 3.9Å; Y705-K720 HydrophobicContact CD2-CG 3.79Å; Y705-K720 HydrophobicContact CE2-CD 4.5Å; Y705-K720 HydrophobicContact CE2-CG 3.56Å
706	A	94.4	Very high	92.5	Very high	21 Å²	21	33.9 Å²	33.9	17%	0.174	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-43.3	179.2	0	0	0	0	0	112.2	I623 D702 Q703 V704 L708 V709 A710	I623-A706 HydrophobicContact CB-CB 3.87Å; I623-A706 HydrophobicContact CG2-CB 4.3Å; D702-A706 WeakPolarHBondContact O-CB 3.43Å; D702-A706 PolarHBondContact O-N 2.6Å; Q703-A706 PolarHBondContact O-N 3.11Å; V704-A706 VanDerWaalsContact C-N 3.33Å; V704-A706 PolarHBondContact O-N 3.5Å; A706-L708 PolarHBondContact O-N 2.51Å; A706-V709 PolarHBondContact O-N 3.22Å; A706-A710 VanDerWaalsContact O-CB 3.26Å; A706-A710 WeakPolarHBondContact O-CB 3.2Å; A706-A710 PolarHBondContact O-N 3.45Å
707	L	95.4	Very high	92.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-40.7	175.1	-69.6	171	0	0	0	112.5	L622 I623 I673 L676 F677 L692 Q703 V704 Y705 A710 R711	L622-L707 HydrophobicContact CB-CD2 4.12Å; I623-L707 HydrophobicContact CG2-CD2 3.72Å; I623-L707 HydrophobicContact CG2-CG 3.86Å; I673-L707 HydrophobicContact CD1-CD1 4.02Å; I673-L707 HydrophobicContact CD1-CD2 4.33Å; I673-L707 HydrophobicContact CG1-CD1 3.91Å; I673-L707 HydrophobicContact CG2-CD1 4.44Å; I673-L707 HydrophobicContact CG2-CD2 3.8Å; L676-L707 HydrophobicContact CD2-CB 3.92Å; L676-L707 HydrophobicContact CD2-CD1 4.48Å; F677-L707 HydrophobicContact CE2-CD2 4.44Å; L692-L707 HydrophobicContact CD2-CD1 4.12Å; Q703-L707 WeakPolarHBondContact O-CG 3.37Å; Q703-L707 PolarHBondContact O-N 3.06Å; V704-L707 PolarHBondContact O-N 2.98Å; Y705-L707 PolarHBondContact O-N 2.85Å; L707-A710 WeakPolarHBondContact O-CB 3.33Å; L707-A710 PolarHBondContact O-N 3.16Å; L707-R711 PolarHBondContact O-N 3.09Å
708	L	94.6	Very high	92.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-41.8	177.3	-70.9	171.9	0	0	0	112	L676 L685 I689 V704 Y705 A706 A710 R711 A719 L722	L676-L708 HydrophobicContact CD1-CD2 4.24Å; L676-L708 HydrophobicContact CD2-CD2 4.41Å; L685-L708 HydrophobicContact CD1-CD2 4.2Å; I689-L708 HydrophobicContact CD1-CD1 3.93Å; I689-L708 HydrophobicContact CD1-CD2 4.22Å; V704-L708 HydrophobicContact CG1-CD1 4.07Å; V704-L708 HydrophobicContact CG1-CG 4.44Å; V704-L708 WeakPolarHBondContact O-CG 3.24Å; V704-L708 PolarHBondContact O-N 3.5Å; Y705-L708 PolarHBondContact O-N 2.58Å; A706-L708 PolarHBondContact O-N 2.51Å; L708-A710 VanDerWaalsContact C-N 3.29Å; L708-A710 PolarHBondContact O-N 3.21Å; L708-R711 WeakPolarHBondContact O-CB 3.34Å; L708-R711 PolarHBondContact O-N 2.6Å; L708-A719 HydrophobicContact CB-CB 3.71Å; L708-A719 HydrophobicContact CD1-CB 4.3Å; L708-L722 HydrophobicContact CD1-CB 3.7Å; L708-L722 HydrophobicContact CD1-CD1 4.27Å
709	V	93.1	Very high	92.5	Very high	57 Å²	57	40.6 Å²	40.6	35%	0.345	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-38.4	173.1	172.4	0	0	0	0	110.7	Y705 A706 R711 G712 A719	Y705-V709 HydrophobicContact CD1-CG2 4.48Å; Y705-V709 HydrophobicContact CD2-CG2 4.15Å; Y705-V709 HydrophobicContact CE1-CG2 4Å; Y705-V709 HydrophobicContact CE2-CG2 3.62Å; Y705-V709 WeakPolarHBondContact O-CG2 3.28Å; Y705-V709 PolarHBondContact O-N 2.92Å; A706-V709 PolarHBondContact O-N 3.22Å; V709-R711 PolarHBondContact O-N 3.04Å; V709-G712 PolarHBondContact O-N 3.2Å; V709-G712 VanDerWaalsContact O-N 3.16Å; V709-A719 HydrophobicContact CG2-CB 4.01Å
710	A	93.3	Very high	92.5	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.033	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-21.8	178.1	0	0	0	0	0	113.1	M569 S627 L629 F677 A706 L707 L708 G712	M569-A710 HydrophobicContact CE-CB 3.99Å; S627-A710 WeakPolarHBondContact CB-O 3.25Å; S627-A710 PolarHBondContact OG-O 3.38Å; L629-A710 WeakPolarHBondContact CD1-O 3.39Å; F677-A710 HydrophobicContact CE1-CB 4.44Å; F677-A710 HydrophobicContact CZ-CB 3.99Å; A706-A710 VanDerWaalsContact O-CB 3.26Å; A706-A710 WeakPolarHBondContact O-CB 3.2Å; A706-A710 PolarHBondContact O-N 3.45Å; L707-A710 WeakPolarHBondContact O-CB 3.33Å; L707-A710 PolarHBondContact O-N 3.16Å; L708-A710 VanDerWaalsContact C-N 3.29Å; L708-A710 PolarHBondContact O-N 3.21Å; A710-G712 VanDerWaalsContact C-N 3.3Å; A710-G712 PolarHBondContact O-N 2.8Å
711	R	93.4	Very high	92.4	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.5	175	-70.4	174.3	46	96.3	-7	114.4	L676 F677 T679 L707 L708 V709 D713	L676-R711 PolarHBondContact O-NH1 3.29Å; F677-R711 HydrophobicContact CD1-CG 4.17Å; F677-R711 HydrophobicContact CE1-CG 4.18Å; F677-R711 HydrophobicContact CG-CG 4.41Å; F677-R711 HydrophobicContact CZ-CG 4.44Å; T679-R711 PolarHBondContact O-NH1 2.9Å; T679-R711 PolarHBondContact O-NH2 3.25Å; L707-R711 PolarHBondContact O-N 3.09Å; L708-R711 WeakPolarHBondContact O-CB 3.34Å; L708-R711 PolarHBondContact O-N 2.6Å; V709-R711 PolarHBondContact O-N 3.04Å; R711-D713 VanDerWaalsContact C-N 3.26Å; R711-D713 VanDerWaalsContact CB-OD1 3.23Å; R711-D713 WeakPolarHBondContact CB-OD1 3.37Å; R711-D713 IonicContact CZ-OD1 2.66Å; R711-D713 IonicContact CZ-OD2 3.1Å; R711-D713 IonicContact NE-OD1 3.58Å; R711-D713 PolarHBondContact NE-OD1 2.71Å; R711-D713 IonicContact NE-OD2 3.39Å; R711-D713 VanDerWaalsContact NH2-CG 3.34Å; R711-D713 IonicContact NH2-OD1 2.98Å; R711-D713 PolarHBondContact NH2-OD1 3.24Å; R711-D713 IonicContact NH2-OD2 2.93Å; R711-D713 PolarHBondContact NH2-OD2 2.9Å; R711-D713 PolarHBondContact O-N 3.4Å
712	G	90.4	Very high	92.3	Very high	47 Å²	47	41.1 Å²	41.1	49%	0.485	24%	0.242	S	C	.	.	S	Bend	trans	78.9	-12.9	179.2	0	0	0	0	0	116.5	V709 A710	V709-G712 PolarHBondContact O-N 3.2Å; V709-G712 VanDerWaalsContact O-N 3.16Å; A710-G712 VanDerWaalsContact C-N 3.3Å; A710-G712 PolarHBondContact O-N 2.8Å
713	D	93	Very high	92.1	Very high	57 Å²	57	37.8 Å²	37.8	31%	0.305	23%	0.225	S	C	.	.	S	Bend	trans	-105.9	-7.2	179.9	69.8	-32.3	0	0	0	114.5	R635 R711	R635-D713 IonicContact CZ-OD2 3.49Å; R635-D713 IonicContact NE-OD2 3.87Å; R635-D713 IonicContact NH1-OD1 2.65Å; R635-D713 IonicContact NH1-OD2 3.14Å; R635-D713 PolarHBondContact NH1-OD2 3.32Å; R635-D713 VanDerWaalsContact NH1-OD2 3.07Å; R635-D713 IonicContact NH2-OD2 3.63Å; R635-D713 PolarHBondContact NH2-OD2 3.33Å; R711-D713 VanDerWaalsContact C-N 3.26Å; R711-D713 VanDerWaalsContact CB-OD1 3.23Å; R711-D713 WeakPolarHBondContact CB-OD1 3.37Å; R711-D713 IonicContact CZ-OD1 2.66Å; R711-D713 IonicContact CZ-OD2 3.1Å; R711-D713 IonicContact NE-OD1 3.58Å; R711-D713 PolarHBondContact NE-OD1 2.71Å; R711-D713 IonicContact NE-OD2 3.39Å; R711-D713 VanDerWaalsContact NH2-CG 3.34Å; R711-D713 IonicContact NH2-OD1 2.98Å; R711-D713 PolarHBondContact NH2-OD1 3.24Å; R711-D713 IonicContact NH2-OD2 2.93Å; R711-D713 PolarHBondContact NH2-OD2 2.9Å; R711-D713 PolarHBondContact O-N 3.4Å
714	V	91.2	Very high	91.4	Very high	17 Å²	17	39.9 Å²	39.9	10%	0.103	24%	0.242	C	C	.	.	S	Bend	trans	-102.4	123.4	176.4	-173.1	0	0	0	0	108.8	L685 N718 A719 L722	L685-V714 HydrophobicContact CD1-CG2 3.69Å; V714-N718 HydrophobicContact CG1-CB 3.77Å; V714-A719 HydrophobicContact CG1-CB 3.95Å; V714-L722 HydrophobicContact CG1-CD1 4.36Å
715	S	89.2	Confident	90	Very high	58 Å²	58	45.9 Å²	45.9	41%	0.406	28%	0.275	S	S	.	.			trans	-61.9	151.5	174.1	69.3	0	0	0	0	110.7	D717 N718 A719	S715-D717 PolarHBondContact O-N 2.94Å; S715-N718 PolarHBondContact O-N 2.56Å; S715-N718 VanDerWaalsContact O-N 3.14Å; S715-N718 WeakPolarHBondContact OG-CB 3.27Å; S715-N718 VanDerWaalsContact OG-CG 3.25Å; S715-N718 PolarHBondContact OG-N 3.24Å; S715-A719 WeakPolarHBondContact O-CB 3.47Å; S715-A719 PolarHBondContact O-N 2.7Å
716	S	89.3	Confident	88.2	Confident	50 Å²	50	43.6 Å²	43.6	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-54.6	-38.1	178.4	179.5	0	0	0	0	112.3	Y705 A719 K720	Y705-S716 PolarHBondContact OH-OG 3.08Å; S716-A719 PolarHBondContact O-N 3.19Å; S716-K720 WeakPolarHBondContact O-CG 3.41Å; S716-K720 PolarHBondContact O-N 2.93Å
717	D	90.9	Very high	86.3	Confident	119 Å²	119	48.7 Å²	48.7	64%	0.636	29%	0.288	S	S	*	.	H	α-helix	trans	-68.8	-43	178.8	-65.1	-28.2	0	0	0	112.2	S715 A719 K720 G721	S715-D717 PolarHBondContact O-N 2.94Å; D717-A719 VanDerWaalsContact C-N 3.33Å; D717-A719 PolarHBondContact O-N 3.09Å; D717-K720 PolarHBondContact O-N 2.92Å; D717-G721 PolarHBondContact O-N 3.21Å
718	N	91	Very high	84.1	Confident	103 Å²	103	58.6 Å²	58.6	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-65.9	-38.3	175	-71.5	1.7	0	0	0	111.2	V714 S715 G721 L722	V714-N718 HydrophobicContact CG1-CB 3.77Å; S715-N718 PolarHBondContact O-N 2.56Å; S715-N718 VanDerWaalsContact O-N 3.14Å; S715-N718 WeakPolarHBondContact OG-CB 3.27Å; S715-N718 VanDerWaalsContact OG-CG 3.25Å; S715-N718 PolarHBondContact OG-N 3.24Å; N718-G721 PolarHBondContact O-N 2.57Å; N718-L722 WeakPolarHBondContact O-CB 3.31Å; N718-L722 VanDerWaalsContact O-CG 3.31Å; N718-L722 WeakPolarHBondContact O-CG 3.45Å; N718-L722 PolarHBondContact O-N 3.09Å
719	A	91.9	Very high	81.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.6	-40.1	175.9	0	0	0	0	0	111.7	Y705 L708 V709 V714 S715 S716 D717 S723	Y705-A719 HydrophobicContact CD2-CB 3.77Å; Y705-A719 HydrophobicContact CE2-CB 3.9Å; L708-A719 HydrophobicContact CB-CB 3.71Å; L708-A719 HydrophobicContact CD1-CB 4.3Å; V709-A719 HydrophobicContact CG2-CB 4.01Å; V714-A719 HydrophobicContact CG1-CB 3.95Å; S715-A719 WeakPolarHBondContact O-CB 3.47Å; S715-A719 PolarHBondContact O-N 2.7Å; S716-A719 PolarHBondContact O-N 3.19Å; D717-A719 VanDerWaalsContact C-N 3.33Å; D717-A719 PolarHBondContact O-N 3.09Å; A719-S723 VanDerWaalsContact O-CB 3.27Å; A719-S723 WeakPolarHBondContact O-CB 3.37Å; A719-S723 PolarHBondContact O-N 3.17Å; A719-S723 PolarHBondContact O-OG 3Å
720	K	91.2	Very high	79.7	Confident	113 Å²	113	67 Å²	67	49%	0.491	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-45.4	172.8	-76	175.3	-171.7	168.2	0	111.5	Y705 S716 D717 S723 A724	Y705-K720 HydrophobicContact CD2-CG 3.79Å; Y705-K720 HydrophobicContact CE2-CD 4.5Å; Y705-K720 HydrophobicContact CE2-CG 3.56Å; S716-K720 WeakPolarHBondContact O-CG 3.41Å; S716-K720 PolarHBondContact O-N 2.93Å; D717-K720 PolarHBondContact O-N 2.92Å; K720-S723 WeakPolarHBondContact CA-OG 3.43Å; K720-S723 PolarHBondContact O-N 2.91Å; K720-S723 PolarHBondContact O-OG 2.87Å; K720-A724 VanDerWaalsContact O-CB 3.31Å; K720-A724 WeakPolarHBondContact O-CB 3.34Å; K720-A724 PolarHBondContact O-N 2.8Å
721	G	89.9	Confident	77.6	Confident	28 Å²	28	75.6 Å²	75.6	29%	0.289	40%	0.398	S	S	.	.	H	α-helix	trans	-57.7	-54.7	176.1	0	0	0	0	0	111.9	D717 N718 S723 A724 D725	D717-G721 PolarHBondContact O-N 3.21Å; N718-G721 PolarHBondContact O-N 2.57Å; G721-S723 VanDerWaalsContact C-N 3.33Å; G721-S723 PolarHBondContact O-N 3.46Å; G721-A724 PolarHBondContact O-N 3.07Å; G721-D725 WeakPolarHBondContact O-CB 3.48Å; G721-D725 PolarHBondContact O-N 3.26Å
722	L	89.6	Confident	75.4	Confident	40 Å²	40	82.9 Å²	82.9	21%	0.209	44%	0.436	C	S	.	.	H	α-helix	trans	-61.2	-36.8	-179.8	-70.9	172.3	0	0	0	113.6	L685 P686 I689 L708 V714 N718 S726	L685-L722 HydrophobicContact CB-CD1 4.33Å; L685-L722 HydrophobicContact CD1-CD1 4.21Å; P686-L722 HydrophobicContact CG-CD2 3.72Å; I689-L722 HydrophobicContact CD1-CB 3.87Å; L708-L722 HydrophobicContact CD1-CB 3.7Å; L708-L722 HydrophobicContact CD1-CD1 4.27Å; V714-L722 HydrophobicContact CG1-CD1 4.36Å; N718-L722 WeakPolarHBondContact O-CB 3.31Å; N718-L722 VanDerWaalsContact O-CG 3.31Å; N718-L722 WeakPolarHBondContact O-CG 3.45Å; N718-L722 PolarHBondContact O-N 3.09Å; L722-S726 WeakPolarHBondContact O-CB 3.34Å; L722-S726 PolarHBondContact O-OG 2.99Å
723	S	87.8	Confident	73.4	Confident	9 Å²	9	82.3 Å²	82.3	6%	0.063	42%	0.424	C	S	.	.	H	α-helix	trans	-75.2	-26.1	178.3	57.3	0	0	0	0	113.7	S701 A719 K720 G721 S726	S701-S723 WeakPolarHBondContact CB-O 3.45Å; S701-S723 WeakPolarHBondContact O-CB 3.19Å; S701-S723 PolarHBondContact OG-O 2.98Å; A719-S723 VanDerWaalsContact O-CB 3.27Å; A719-S723 WeakPolarHBondContact O-CB 3.37Å; A719-S723 PolarHBondContact O-N 3.17Å; A719-S723 PolarHBondContact O-OG 3Å; K720-S723 WeakPolarHBondContact CA-OG 3.43Å; K720-S723 PolarHBondContact O-N 2.91Å; K720-S723 PolarHBondContact O-OG 2.87Å; G721-S723 VanDerWaalsContact C-N 3.33Å; G721-S723 PolarHBondContact O-N 3.46Å; S723-S726 PolarHBondContact O-OG 3.08Å; S723-S726 VanDerWaalsContact O-OG 3.12Å
724	A	79.8	Confident	71.4	Confident	47 Å²	47	88.4 Å²	88.4	39%	0.388	45%	0.451	S	S	.	.	H	α-helix	trans	-86	-48	175.5	0	0	0	0	0	112.9	K720 G721 S726 H727	K720-A724 VanDerWaalsContact O-CB 3.31Å; K720-A724 WeakPolarHBondContact O-CB 3.34Å; K720-A724 PolarHBondContact O-N 2.8Å; G721-A724 PolarHBondContact O-N 3.07Å; A724-S726 PolarHBondContact O-N 3.49Å; A724-S726 VanDerWaalsContact O-N 3.13Å; A724-H727 PolarHBondContact O-CD2 3.5Å
725	D	65.2	Low	69.7	Low	127 Å²	127	96 Å²	96	68%	0.679	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-16	-175.6	-75.3	-24.1	0	0	0	113.4	G721 H727	G721-D725 WeakPolarHBondContact O-CB 3.48Å; G721-D725 PolarHBondContact O-N 3.26Å; D725-H727 PolarHBondContact O-N 3.22Å
726	S	57.5	Low	68.1	Low	17 Å²	17	98.5 Å²	98.5	12%	0.119	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-75.5	32.6	178.8	46.4	0	0	0	0	113.9	K693 L722 S723 A724 Y728	K693-S726 WeakPolarHBondContact CD-O 3.38Å; K693-S726 WeakPolarHBondContact CE-OG 3.27Å; K693-S726 PolarHBondContact NZ-O 3.5Å; K693-S726 PolarHBondContact NZ-OG 3.23Å; L722-S726 WeakPolarHBondContact O-CB 3.34Å; L722-S726 PolarHBondContact O-OG 2.99Å; S723-S726 PolarHBondContact O-OG 3.08Å; S723-S726 VanDerWaalsContact O-OG 3.12Å; A724-S726 PolarHBondContact O-N 3.49Å; A724-S726 VanDerWaalsContact O-N 3.13Å; S726-Y728 PolarHBondContact O-N 3.25Å
727	H	54	Low	66.8	Low	128 Å²	128	97.1 Å²	97.1	59%	0.593	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-66.4	-9	168.5	-78.9	-60.7	0	0	0	113.4	A724 D725 G729 R730	A724-H727 PolarHBondContact O-CD2 3.5Å; D725-H727 PolarHBondContact O-N 3.22Å; H727-G729 PolarHBondContact O-N 2.88Å; H727-R730 PolarHBondContact O-N 3.26Å
728	Y	50.4	Low	65.6	Low	208 Å²	208	96.6 Å²	96.6	82%	0.816	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-59.1	-5.3	179.2	-97.4	-85.8	0	0	0	116.6	S726	S726-Y728 PolarHBondContact O-N 3.25Å
729	G	48.1	Very low	65.2	Low	19 Å²	19	92.3 Å²	92.3	20%	0.196	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-101.8	-18.4	-179.6	0	0	0	0	0	116.2	H727 E731 L732	H727-G729 PolarHBondContact O-N 2.88Å; G729-E731 VanDerWaalsContact C-N 3.32Å; G729-E731 PolarHBondContact O-N 3.24Å; G729-L732 PolarHBondContact O-N 3.11Å
730	R	46.4	Very low	65.1	Low	215 Å²	215	93.7 Å²	93.7	81%	0.811	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-30.7	-171.4	-101.7	-171.6	-176.8	178.3	1.3	113.5	H727	H727-R730 PolarHBondContact O-N 3.26Å
731	E	48.5	Very low	65.3	Low	184 Å²	184	88.3 Å²	88.3	86%	0.86	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.8	-178.9	-68	-172.6	169	0	0	113.4	G729	G729-E731 VanDerWaalsContact C-N 3.32Å; G729-E731 PolarHBondContact O-N 3.24Å
732	L	48.2	Very low	65.4	Low	155 Å²	155	87.1 Å²	87.1	81%	0.812	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-13.6	-172.1	-73.6	168.5	0	0	0	114.9	G729	G729-L732 PolarHBondContact O-N 3.11Å
733	S	49.2	Very low	65.6	Low	34 Å²	34	88.7 Å²	88.7	24%	0.238	45%	0.454	C	S	.	.			trans	-117.9	87.4	177.6	-170.1	0	0	0	0	111.8	P697 K735	P697-S733 WeakPolarHBondContact CG-OG 3.32Å; S733-K735 VanDerWaalsContact C-N 3.28Å; S733-K735 PolarHBondContact OG-O 3.12Å
734	Q	50.4	Low	65.9	Low	185 Å²	185	92.5 Å²	92.5	86%	0.864	47%	0.467	S	S	*	.			trans	-82.2	-3.9	171.5	-71.4	-174.9	-4.5	0	0	113.2
735	K	54.7	Low	66.5	Low	177 Å²	177	90.2 Å²	90.2	77%	0.77	45%	0.448	S	S	*	.	S	Bend	trans	-100.4	115.6	177.3	-75.3	-173.7	177.7	-178.5	0	109.4	S733 S737	S733-K735 VanDerWaalsContact C-N 3.28Å; S733-K735 PolarHBondContact OG-O 3.12Å; K735-S737 PolarHBondContact O-N 2.93Å
736	P	56.4	Low	67.7	Low	110 Å²	110	85.2 Å²	85.2	71%	0.714	42%	0.422	S	S	*	.			trans	-56.9	140.1	168.2	23.8	-30.6	0	0	0	108.9
737	S	62.7	Low	69.1	Low	22 Å²	22	88.5 Å²	88.5	15%	0.154	44%	0.442	C	S	.	.			trans	-55.8	129.4	164.5	170.9	0	0	0	0	107.4	K735 F739 A740	K735-S737 PolarHBondContact O-N 2.93Å; S737-F739 PolarHBondContact O-N 3.02Å; S737-F739 VanDerWaalsContact O-N 3.07Å; S737-A740 PolarHBondContact O-N 2.96Å
738	P	64.1	Low	70.6	Confident	108 Å²	108	83.5 Å²	83.5	70%	0.701	42%	0.422	S	S	*	.	S	Bend	trans	-58.7	-26.7	-173.7	18.9	-29.6	0	0	0	112.9
739	F	83.4	Confident	72.1	Confident	13 Å²	13	76.8 Å²	76.8	6%	0.057	40%	0.399	C	S	.	.	S	Bend	trans	-97.8	-29.2	-178.3	-161.6	-106.2	0	0	0	114.7	E612 V663 A666 S737 I741 R744	E612-F739 HydrophobicContact CB-CE1 4.41Å; E612-F739 HydrophobicContact CB-CZ 3.84Å; E612-F739 HydrophobicContact CG-CE1 3.98Å; E612-F739 HydrophobicContact CG-CZ 3.63Å; V663-F739 HydrophobicContact CB-CE2 4.24Å; V663-F739 HydrophobicContact CB-CZ 4.48Å; V663-F739 HydrophobicContact CG1-CE1 4.36Å; V663-F739 HydrophobicContact CG1-CE2 4.2Å; V663-F739 HydrophobicContact CG1-CZ 3.94Å; V663-F739 HydrophobicContact CG2-CD2 4.11Å; V663-F739 HydrophobicContact CG2-CE2 3.61Å; V663-F739 HydrophobicContact CG2-CZ 4.17Å; A666-F739 HydrophobicContact CB-CB 4.45Å; A666-F739 HydrophobicContact CB-CD1 3.89Å; A666-F739 HydrophobicContact CB-CG 4.4Å; S737-F739 PolarHBondContact O-N 3.02Å; S737-F739 VanDerWaalsContact O-N 3.07Å; F739-I741 HydrophobicContact CD1-CB 4.04Å; F739-I741 HydrophobicContact CD1-CD1 4.13Å; F739-I741 HydrophobicContact CE1-CD1 3.77Å; F739-R744 VanDerWaalsContact CE2-CZ 3.46Å; F739-R744 WeakPolarHBondContact O-CD 3.46Å; F739-R744 PolarHBondContact O-NE 3.41Å
740	A	90.5	Very high	73.5	Confident	29 Å²	29	82.1 Å²	82.1	24%	0.24	42%	0.423	C	S	.	.			trans	50.7	52.4	-177	0	0	0	0	0	114.5	D698 S737 F742 T743 R744	D698-A740 HydrophobicContact CB-CB 4.38Å; D698-A740 WeakPolarHBondContact OD2-CA 3.36Å; S737-A740 PolarHBondContact O-N 2.96Å; A740-F742 VanDerWaalsContact C-N 3.34Å; A740-F742 PolarHBondContact O-N 2.92Å; A740-T743 PolarHBondContact O-N 2.65Å; A740-R744 WeakPolarHBondContact O-CG 3.34Å; A740-R744 PolarHBondContact O-N 3.42Å; A740-R744 VanDerWaalsContact O-N 3.1Å
741	I	93.4	Very high	74	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-58	-38.4	-175.5	-173.7	65.7	0	0	0	114	L615 I616 L619 A666 F696 D698 F739 T743 R744 L745	L615-I741 HydrophobicContact CB-CD1 4.26Å; L615-I741 HydrophobicContact CD2-CD1 3.69Å; L615-I741 HydrophobicContact CD2-CG1 3.67Å; L615-I741 HydrophobicContact CG-CD1 3.86Å; L615-I741 HydrophobicContact CG-CG1 3.91Å; I616-I741 HydrophobicContact CG1-CD1 3.78Å; L619-I741 HydrophobicContact CD1-CG1 3.73Å; A666-I741 HydrophobicContact CB-CB 4.2Å; A666-I741 HydrophobicContact CB-CG2 4.42Å; F696-I741 HydrophobicContact CD1-CG2 4.13Å; F696-I741 HydrophobicContact CE1-CG2 4.44Å; D698-I741 PolarHBondContact OD2-N 3.35Å; F739-I741 HydrophobicContact CD1-CB 4.04Å; F739-I741 HydrophobicContact CD1-CD1 4.13Å; F739-I741 HydrophobicContact CE1-CD1 3.77Å; I741-T743 VanDerWaalsContact C-N 3.34Å; I741-R744 PolarHBondContact O-N 3.03Å; I741-L745 WeakPolarHBondContact O-CB 3.01Å; I741-L745 PolarHBondContact O-N 3.32Å
742	F	94	Very high	73.9	Confident	2 Å²	2	76.6 Å²	76.6	1%	0.009	41%	0.413	C	S	.	.	H	α-helix	trans	-74.4	-28.6	-178.1	-71.9	-79.4	0	0	0	111.9	L619 A669 I673 L692 F696 D698 V699 Q703 A740 L745 V746	L619-F742 HydrophobicContact CD1-CE1 4.41Å; L619-F742 HydrophobicContact CD2-CE1 4.38Å; A669-F742 HydrophobicContact CB-CE2 4.07Å; A669-F742 HydrophobicContact CB-CZ 4.04Å; I673-F742 HydrophobicContact CD1-CE1 4.34Å; I673-F742 HydrophobicContact CD1-CZ 4.12Å; L692-F742 HydrophobicContact CD1-CE2 4.48Å; L692-F742 HydrophobicContact CD1-CZ 4.23Å; F696-F742 HydrophobicContact CB-CD2 3.72Å; F696-F742 HydrophobicContact CB-CE2 3.48Å; F696-F742 VanDerWaalsContact CB-CE2 3.48Å; F696-F742 HydrophobicContact CD1-CD2 4.33Å; F696-F742 AromaticContact CD1-CE2 3.94Å; F696-F742 HydrophobicContact CD1-CE2 3.94Å; F696-F742 HydrophobicContact CD2-CE2 4.29Å; F696-F742 HydrophobicContact CG-CD2 4.21Å; F696-F742 AromaticContact CG-CE2 3.63Å; F696-F742 HydrophobicContact CG-CE2 3.63Å; D698-F742 WeakPolarHBondContact OD2-CA 3.39Å; D698-F742 WeakPolarHBondContact OD2-CB 3.42Å; D698-F742 PolarHBondContact OD2-N 3.4Å; V699-F742 HydrophobicContact CB-CB 4.34Å; V699-F742 HydrophobicContact CB-CD1 4.23Å; V699-F742 HydrophobicContact CB-CD2 3.81Å; V699-F742 HydrophobicContact CB-CE2 4.13Å; V699-F742 HydrophobicContact CB-CG 3.86Å; V699-F742 HydrophobicContact CB-CZ 4.46Å; V699-F742 HydrophobicContact CG2-CD1 3.77Å; V699-F742 HydrophobicContact CG2-CD2 4.2Å; V699-F742 HydrophobicContact CG2-CE1 3.86Å; V699-F742 HydrophobicContact CG2-CE2 4.29Å; V699-F742 HydrophobicContact CG2-CG 3.94Å; V699-F742 HydrophobicContact CG2-CZ 4.11Å; Q703-F742 PolarHBondContact NE2-O 3.23Å; A740-F742 VanDerWaalsContact C-N 3.34Å; A740-F742 PolarHBondContact O-N 2.92Å; F742-L745 HydrophobicContact CD1-CD2 4.25Å; F742-V746 WeakPolarHBondContact O-CG2 3.18Å; F742-V746 PolarHBondContact O-N 3.44Å
743	T	93.2	Very high	75.2	Confident	74 Å²	74	72.7 Å²	72.7	45%	0.454	39%	0.393	S	S	.	.	H	α-helix	trans	-68.2	-44.8	168.9	-60.6	0	0	0	0	110.9	D698 A740 I741 L745 V746 V747	D698-T743 PolarHBondContact OD2-N 2.87Å; D698-T743 VanDerWaalsContact OD2-N 3.1Å; A740-T743 PolarHBondContact O-N 2.65Å; I741-T743 VanDerWaalsContact C-N 3.34Å; T743-L745 VanDerWaalsContact C-N 3.31Å; T743-L745 PolarHBondContact O-N 2.99Å; T743-V746 WeakPolarHBondContact O-CB 3.37Å; T743-V746 PolarHBondContact O-N 3.28Å; T743-V747 PolarHBondContact O-N 3.45Å; T743-V747 VanDerWaalsContact O-N 3.17Å
744	R	93	Very high	76.6	Confident	88 Å²	88	74.7 Å²	74.7	33%	0.332	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-38.1	175.6	-66.5	171	-178.7	-127.2	13	112.2	E612 I616 F739 A740 I741 V746 V747 A748	E612-R744 WeakPolarHBondContact OE1-CD 3.37Å; E612-R744 IonicContact OE1-CZ 2.63Å; E612-R744 IonicContact OE1-NE 3.68Å; E612-R744 IonicContact OE1-NH1 3.74Å; E612-R744 PolarHBondContact OE1-NH1 3.19Å; E612-R744 IonicContact OE2-CZ 3.36Å; E612-R744 IonicContact OE2-NH1 2.73Å; E612-R744 PolarHBondContact OE2-NH1 2.88Å; I616-R744 HydrophobicContact CD1-CB 4.06Å; F739-R744 VanDerWaalsContact CE2-CZ 3.46Å; F739-R744 WeakPolarHBondContact O-CD 3.46Å; F739-R744 PolarHBondContact O-NE 3.41Å; A740-R744 WeakPolarHBondContact O-CG 3.34Å; A740-R744 PolarHBondContact O-N 3.42Å; A740-R744 VanDerWaalsContact O-N 3.1Å; I741-R744 PolarHBondContact O-N 3.03Å; R744-V746 VanDerWaalsContact C-N 3.33Å; R744-V746 PolarHBondContact O-N 2.67Å; R744-V747 PolarHBondContact O-N 3.41Å; R744-A748 WeakPolarHBondContact O-CB 3.49Å; R744-A748 PolarHBondContact O-N 3.33Å
745	L	93.6	Very high	78	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-58.4	-42.3	173.3	175.7	60.9	0	0	0	112.1	I616 L619 K620 I623 I741 F742 T743 A748 M749	I616-L745 HydrophobicContact CG2-CD1 3.96Å; I616-L745 WeakPolarHBondContact O-CD1 3.21Å; L619-L745 HydrophobicContact CB-CD1 4.27Å; L619-L745 HydrophobicContact CB-CD2 3.7Å; L619-L745 HydrophobicContact CD1-CD2 4.34Å; K620-L745 HydrophobicContact CB-CD1 3.91Å; I623-L745 HydrophobicContact CD1-CD2 3.63Å; I623-L745 HydrophobicContact CD1-CG 4.18Å; I741-L745 WeakPolarHBondContact O-CB 3.01Å; I741-L745 PolarHBondContact O-N 3.32Å; F742-L745 HydrophobicContact CD1-CD2 4.25Å; T743-L745 VanDerWaalsContact C-N 3.31Å; T743-L745 PolarHBondContact O-N 2.99Å; L745-A748 PolarHBondContact O-N 2.7Å; L745-M749 HydrophobicContact CD1-CG 4.32Å; L745-M749 HydrophobicContact CD1-SD 4.28Å; L745-M749 HydrophobicContact CG-SD 4.31Å; L745-M749 VanDerWaalsContact O-CG 3.29Å; L745-M749 WeakPolarHBondContact O-CG 3.32Å; L745-M749 PolarHBondContact O-N 3.35Å
746	V	89.9	Confident	79.4	Confident	21 Å²	21	62.2 Å²	62.2	13%	0.127	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-49.2	175.4	174.5	0	0	0	0	110.5	F742 T743 R744 A748 M749 D750	F742-V746 WeakPolarHBondContact O-CG2 3.18Å; F742-V746 PolarHBondContact O-N 3.44Å; T743-V746 WeakPolarHBondContact O-CB 3.37Å; T743-V746 PolarHBondContact O-N 3.28Å; R744-V746 VanDerWaalsContact C-N 3.33Å; R744-V746 PolarHBondContact O-N 2.67Å; V746-A748 VanDerWaalsContact C-N 3.26Å; V746-A748 PolarHBondContact O-N 3.1Å; V746-M749 WeakPolarHBondContact O-CA 3.41Å; V746-M749 WeakPolarHBondContact O-CB 3.41Å; V746-M749 PolarHBondContact O-N 3.06Å; V746-D750 PolarHBondContact O-N 3.33Å
747	V	86.6	Confident	80.8	Confident	87 Å²	87	59.3 Å²	59.3	53%	0.527	33%	0.33	S	S	.	.	H	α-helix	trans	-56.8	-44	179.1	176.7	0	0	0	0	110.6	T743 R744 M749 D750 T751	T743-V747 PolarHBondContact O-N 3.45Å; T743-V747 VanDerWaalsContact O-N 3.17Å; R744-V747 PolarHBondContact O-N 3.41Å; V747-M749 VanDerWaalsContact C-N 3.3Å; V747-M749 PolarHBondContact O-N 3.35Å; V747-D750 PolarHBondContact O-N 3.07Å; V747-T751 WeakPolarHBondContact O-CG2 3.3Å; V747-T751 PolarHBondContact O-N 3.1Å; V747-T751 VanDerWaalsContact O-N 3.15Å; V747-T751 PolarHBondContact O-OG1 3.23Å; V747-T751 VanDerWaalsContact O-OG1 3.14Å
748	A	85.3	Confident	82.1	Confident	22 Å²	22	61.7 Å²	61.7	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-26.8	177.6	0	0	0	0	0	113.9	I616 R744 L745 V746 T751	I616-A748 HydrophobicContact CG2-CB 3.59Å; R744-A748 WeakPolarHBondContact O-CB 3.49Å; R744-A748 PolarHBondContact O-N 3.33Å; L745-A748 PolarHBondContact O-N 2.7Å; V746-A748 VanDerWaalsContact C-N 3.26Å; V746-A748 PolarHBondContact O-N 3.1Å; A748-T751 WeakPolarHBondContact CA-OG1 3.16Å; A748-T751 PolarHBondContact O-OG1 3.17Å
749	M	82.6	Confident	83.3	Confident	68 Å²	68	58.4 Å²	58.4	34%	0.335	32%	0.316	S	S	.	.	H	α-helix	trans	-79.6	-30.3	174.3	-74	-177.9	69.6	0	0	112.8	K620 I623 L745 V746 V747	K620-M749 HydrophobicContact CD-CG 4.43Å; K620-M749 HydrophobicContact CG-CG 4.31Å; I623-M749 HydrophobicContact CD1-CE 4.29Å; I623-M749 HydrophobicContact CD1-SD 3.52Å; I623-M749 VanDerWaalsContact CD1-SD 3.52Å; I623-M749 HydrophobicContact CG1-SD 4.26Å; L745-M749 HydrophobicContact CD1-CG 4.32Å; L745-M749 HydrophobicContact CD1-SD 4.28Å; L745-M749 HydrophobicContact CG-SD 4.31Å; L745-M749 VanDerWaalsContact O-CG 3.29Å; L745-M749 WeakPolarHBondContact O-CG 3.32Å; L745-M749 PolarHBondContact O-N 3.35Å; V746-M749 WeakPolarHBondContact O-CA 3.41Å; V746-M749 WeakPolarHBondContact O-CB 3.41Å; V746-M749 PolarHBondContact O-N 3.06Å; V747-M749 VanDerWaalsContact C-N 3.3Å; V747-M749 PolarHBondContact O-N 3.35Å
750	D	77.1	Confident	83.3	Confident	130 Å²	130	61.9 Å²	61.9	70%	0.695	34%	0.336	S	S	*	.	H	α-helix	trans	-80.8	-20.6	177.8	-69	-23.7	0	0	0	112.6	V746 V747 H752	V746-D750 PolarHBondContact O-N 3.33Å; V747-D750 PolarHBondContact O-N 3.07Å; D750-H752 VanDerWaalsContact C-N 3.32Å; D750-H752 PolarHBondContact O-N 3.25Å
751	T	57.3	Low	82.7	Confident	101 Å²	101	64.7 Å²	64.7	62%	0.62	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.3	179	47.5	0	0	0	0	115.2	V747 A748	V747-T751 WeakPolarHBondContact O-CG2 3.3Å; V747-T751 PolarHBondContact O-N 3.1Å; V747-T751 VanDerWaalsContact O-N 3.15Å; V747-T751 PolarHBondContact O-OG1 3.23Å; V747-T751 VanDerWaalsContact O-OG1 3.14Å; A748-T751 WeakPolarHBondContact CA-OG1 3.16Å; A748-T751 PolarHBondContact O-OG1 3.17Å
752	H	46.8	Very low	81.8	Confident	183 Å²	183	70.5 Å²	70.5	85%	0.847	38%	0.375	S	S	*	.			trans	-126	0	177	-76.2	-63.9	0	0	0	110.4	D750	D750-H752 VanDerWaalsContact C-N 3.32Å; D750-H752 PolarHBondContact O-N 3.25Å

Retrieved 752 of 752 residues in 209.2 ms (Link to these results)

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